USER MOD reduce.3.24.130724 H: found=0, std=0, add=983, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 859 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 132 SER OG : rot 180:sc= -0.652 USER MOD Set 2.1: A 98 THR OG1 : rot 180:sc=-0.00583 USER MOD Set 2.2: A 129 HIS : no HD1:sc= -3.15! C(o=-3.2!,f=-3.4!) USER MOD Set 3.1: A 80 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 81 GLN : amide:sc= -0.118 X(o=-0.12,f=0.36) USER MOD Set 4.1: A 55 TYR OH : rot -80:sc= 0.00467 USER MOD Set 4.2: A 68 THR OG1 : rot 122:sc= 1.72 USER MOD Single : A 8 ASN : amide:sc= -5.1! C(o=-5.1!,f=-9.2!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -161:sc= -0.21 (180deg=-0.836) USER MOD Single : A 17 THR OG1 : rot 74:sc= 0.646 USER MOD Single : A 19 ASN : amide:sc= -10.3! C(o=-10!,f=-11!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0.613 K(o=0.61,f=-1.5) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0.00463 USER MOD Single : A 33 GLN : amide:sc= -3.4! C(o=-3.4!,f=-4!) USER MOD Single : A 34 TYR OH : rot 180:sc=-0.00794 USER MOD Single : A 35 LYS NZ :NH3+ 140:sc= -0.174 (180deg=-1.07) USER MOD Single : A 38 ASN : amide:sc= -3.68! K(o=-3.7!,f=-0.5) USER MOD Single : A 39 SER OG : rot 3:sc= 0.454! USER MOD Single : A 41 ASN : amide:sc= -4.63! K(o=-4.6!,f=-0.9) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= -3.84! (180deg=-3.84!) USER MOD Single : A 47 LYS NZ :NH3+ -158:sc= -0.895 (180deg=-1.52) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.768 USER MOD Single : A 56 THR OG1 : rot 167:sc= -1.21 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -149:sc= -0.414 (180deg=-1.87!) USER MOD Single : A 71 THR OG1 : rot 80:sc= 0.725 USER MOD Single : A 73 LYS NZ :NH3+ 164:sc= -0.338 (180deg=-0.981) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -1.79! K(o=-1.8!,f=-0.011) USER MOD Single : A 87 THR OG1 : rot 23:sc= -0.637 USER MOD Single : A 91 GLN : amide:sc= -2.88! K(o=-2.9!,f=-0.86) USER MOD Single : A 93 MET CE :methyl -173:sc= -1.32 (180deg=-1.62) USER MOD Single : A 97 SER OG : rot -78:sc= 0.0703! USER MOD Single : A 102 TYR OH : rot -45:sc= 0.172 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 150:sc= -4.74! USER MOD Single : A 121 ASN : amide:sc= -0.0941 X(o=-0.094,f=0) USER MOD Single : A 123 THR OG1 : rot 150:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -129:sc= 0 (180deg=-1.93) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 103 N GLU A 7 98.264 20.628 10.439 1.00 1.00 N ATOM 104 CA GLU A 7 97.831 19.351 11.003 1.00 1.00 C ATOM 105 C GLU A 7 98.573 18.210 10.347 1.00 1.00 C ATOM 106 O GLU A 7 99.178 17.368 11.002 1.00 1.00 O ATOM 107 CB GLU A 7 96.346 19.140 10.783 1.00 1.00 C ATOM 108 CG GLU A 7 95.580 20.376 11.209 1.00 1.00 C ATOM 109 CD GLU A 7 94.083 20.080 11.231 1.00 1.00 C ATOM 110 OE1 GLU A 7 93.449 20.397 12.224 1.00 1.00 O ATOM 111 OE2 GLU A 7 93.595 19.533 10.255 1.00 1.00 O ATOM 0 HA GLU A 7 98.044 19.374 12.072 1.00 1.00 H new ATOM 0 HB2 GLU A 7 96.152 18.926 9.732 1.00 1.00 H new ATOM 0 HB3 GLU A 7 96.004 18.276 11.353 1.00 1.00 H new ATOM 0 HG2 GLU A 7 95.910 20.696 12.197 1.00 1.00 H new ATOM 0 HG3 GLU A 7 95.787 21.197 10.522 1.00 1.00 H new ATOM 118 N ASN A 8 98.524 18.210 9.040 1.00 1.00 N ATOM 119 CA ASN A 8 99.190 17.185 8.269 1.00 1.00 C ATOM 120 C ASN A 8 100.656 17.191 8.631 1.00 1.00 C ATOM 121 O ASN A 8 101.320 16.156 8.695 1.00 1.00 O ATOM 122 CB ASN A 8 99.039 17.500 6.794 1.00 1.00 C ATOM 123 CG ASN A 8 97.582 17.694 6.453 1.00 1.00 C ATOM 124 OD1 ASN A 8 96.720 17.559 7.319 1.00 1.00 O ATOM 125 ND2 ASN A 8 97.263 18.006 5.232 1.00 1.00 N ATOM 0 H ASN A 8 98.030 18.908 8.484 1.00 1.00 H new ATOM 0 HA ASN A 8 98.755 16.208 8.481 1.00 1.00 H new ATOM 0 HB2 ASN A 8 99.602 18.400 6.547 1.00 1.00 H new ATOM 0 HB3 ASN A 8 99.456 16.689 6.196 1.00 1.00 H new ATOM 0 HD21 ASN A 8 96.284 18.143 4.980 1.00 1.00 H new ATOM 0 HD22 ASN A 8 97.991 18.114 4.526 1.00 1.00 H new ATOM 132 N LYS A 9 101.134 18.390 8.873 1.00 1.00 N ATOM 133 CA LYS A 9 102.522 18.610 9.244 1.00 1.00 C ATOM 134 C LYS A 9 102.844 17.998 10.608 1.00 1.00 C ATOM 135 O LYS A 9 103.806 17.257 10.746 1.00 1.00 O ATOM 136 CB LYS A 9 102.742 20.135 9.254 1.00 1.00 C ATOM 137 CG LYS A 9 103.813 20.577 10.250 1.00 1.00 C ATOM 138 CD LYS A 9 104.101 22.069 10.062 1.00 1.00 C ATOM 139 CE LYS A 9 105.240 22.498 10.992 1.00 1.00 C ATOM 140 NZ LYS A 9 104.705 22.699 12.369 1.00 1.00 N ATOM 0 H LYS A 9 100.576 19.242 8.820 1.00 1.00 H new ATOM 0 HA LYS A 9 103.189 18.124 8.531 1.00 1.00 H new ATOM 0 HB2 LYS A 9 103.027 20.462 8.254 1.00 1.00 H new ATOM 0 HB3 LYS A 9 101.802 20.631 9.496 1.00 1.00 H new ATOM 0 HG2 LYS A 9 103.478 20.386 11.269 1.00 1.00 H new ATOM 0 HG3 LYS A 9 104.725 19.998 10.101 1.00 1.00 H new ATOM 0 HD2 LYS A 9 104.371 22.269 9.025 1.00 1.00 H new ATOM 0 HD3 LYS A 9 103.205 22.652 10.276 1.00 1.00 H new ATOM 0 HE2 LYS A 9 106.022 21.739 11.001 1.00 1.00 H new ATOM 0 HE3 LYS A 9 105.694 23.420 10.628 1.00 1.00 H new ATOM 0 HZ1 LYS A 9 105.477 22.990 13.002 1.00 1.00 H new ATOM 0 HZ2 LYS A 9 103.973 23.438 12.353 1.00 1.00 H new ATOM 0 HZ3 LYS A 9 104.291 21.809 12.714 1.00 1.00 H new ATOM 154 N VAL A 10 102.053 18.315 11.618 1.00 1.00 N ATOM 155 CA VAL A 10 102.327 17.787 12.948 1.00 1.00 C ATOM 156 C VAL A 10 102.064 16.296 13.037 1.00 1.00 C ATOM 157 O VAL A 10 102.900 15.541 13.531 1.00 1.00 O ATOM 158 CB VAL A 10 101.503 18.537 13.989 1.00 1.00 C ATOM 159 CG1 VAL A 10 101.660 17.869 15.343 1.00 1.00 C ATOM 160 CG2 VAL A 10 101.992 19.982 14.053 1.00 1.00 C ATOM 0 H VAL A 10 101.235 18.920 11.550 1.00 1.00 H new ATOM 0 HA VAL A 10 103.387 17.939 13.150 1.00 1.00 H new ATOM 0 HB VAL A 10 100.448 18.521 13.714 1.00 1.00 H new ATOM 0 HG11 VAL A 10 101.070 18.407 16.085 1.00 1.00 H new ATOM 0 HG12 VAL A 10 101.313 16.837 15.282 1.00 1.00 H new ATOM 0 HG13 VAL A 10 102.710 17.882 15.636 1.00 1.00 H new ATOM 0 HG21 VAL A 10 101.411 20.530 14.794 1.00 1.00 H new ATOM 0 HG22 VAL A 10 103.045 19.998 14.334 1.00 1.00 H new ATOM 0 HG23 VAL A 10 101.870 20.451 13.077 1.00 1.00 H new ATOM 164 N LYS A 11 100.915 15.875 12.555 1.00 1.00 N ATOM 165 CA LYS A 11 100.585 14.473 12.589 1.00 1.00 C ATOM 166 C LYS A 11 101.602 13.730 11.751 1.00 1.00 C ATOM 167 O LYS A 11 102.057 12.653 12.116 1.00 1.00 O ATOM 168 CB LYS A 11 99.177 14.239 12.055 1.00 1.00 C ATOM 169 CG LYS A 11 98.114 14.638 13.098 1.00 1.00 C ATOM 170 CD LYS A 11 97.873 16.146 13.072 1.00 1.00 C ATOM 171 CE LYS A 11 96.980 16.528 14.250 1.00 1.00 C ATOM 172 NZ LYS A 11 95.925 15.490 14.430 1.00 1.00 N ATOM 0 H LYS A 11 100.204 16.477 12.140 1.00 1.00 H new ATOM 0 HA LYS A 11 100.610 14.109 13.616 1.00 1.00 H new ATOM 0 HB2 LYS A 11 99.030 14.817 11.142 1.00 1.00 H new ATOM 0 HB3 LYS A 11 99.055 13.189 11.790 1.00 1.00 H new ATOM 0 HG2 LYS A 11 97.181 14.112 12.894 1.00 1.00 H new ATOM 0 HG3 LYS A 11 98.441 14.334 14.092 1.00 1.00 H new ATOM 0 HD2 LYS A 11 98.822 16.680 13.130 1.00 1.00 H new ATOM 0 HD3 LYS A 11 97.401 16.436 12.133 1.00 1.00 H new ATOM 0 HE2 LYS A 11 97.576 16.617 15.158 1.00 1.00 H new ATOM 0 HE3 LYS A 11 96.522 17.501 14.072 1.00 1.00 H new ATOM 0 HZ1 LYS A 11 95.144 15.883 14.993 1.00 1.00 H new ATOM 0 HZ2 LYS A 11 95.567 15.194 13.500 1.00 1.00 H new ATOM 0 HZ3 LYS A 11 96.328 14.668 14.923 1.00 1.00 H new ATOM 186 N GLY A 12 101.961 14.339 10.630 1.00 1.00 N ATOM 187 CA GLY A 12 102.939 13.746 9.723 1.00 1.00 C ATOM 188 C GLY A 12 104.339 13.713 10.336 1.00 1.00 C ATOM 189 O GLY A 12 105.028 12.697 10.269 1.00 1.00 O ATOM 0 H GLY A 12 101.593 15.240 10.326 1.00 1.00 H new ATOM 0 HA2 GLY A 12 102.630 12.732 9.469 1.00 1.00 H new ATOM 0 HA3 GLY A 12 102.963 14.314 8.793 1.00 1.00 H new ATOM 193 N GLU A 13 104.757 14.816 10.949 1.00 1.00 N ATOM 194 CA GLU A 13 106.072 14.854 11.577 1.00 1.00 C ATOM 195 C GLU A 13 106.125 13.808 12.674 1.00 1.00 C ATOM 196 O GLU A 13 107.168 13.229 12.952 1.00 1.00 O ATOM 197 CB GLU A 13 106.350 16.239 12.182 1.00 1.00 C ATOM 198 CG GLU A 13 106.715 17.229 11.080 1.00 1.00 C ATOM 199 CD GLU A 13 106.786 18.645 11.644 1.00 1.00 C ATOM 200 OE1 GLU A 13 106.993 19.561 10.864 1.00 1.00 O ATOM 201 OE2 GLU A 13 106.633 18.792 12.846 1.00 1.00 O ATOM 0 H GLU A 13 104.217 15.678 11.024 1.00 1.00 H new ATOM 0 HA GLU A 13 106.829 14.649 10.820 1.00 1.00 H new ATOM 0 HB2 GLU A 13 105.471 16.592 12.722 1.00 1.00 H new ATOM 0 HB3 GLU A 13 107.163 16.172 12.905 1.00 1.00 H new ATOM 0 HG2 GLU A 13 107.674 16.957 10.640 1.00 1.00 H new ATOM 0 HG3 GLU A 13 105.974 17.185 10.282 1.00 1.00 H new ATOM 208 N ALA A 14 104.975 13.572 13.284 1.00 1.00 N ATOM 209 CA ALA A 14 104.861 12.600 14.347 1.00 1.00 C ATOM 210 C ALA A 14 104.812 11.199 13.770 1.00 1.00 C ATOM 211 O ALA A 14 105.298 10.238 14.364 1.00 1.00 O ATOM 212 CB ALA A 14 103.596 12.869 15.155 1.00 1.00 C ATOM 0 H ALA A 14 104.102 14.048 13.055 1.00 1.00 H new ATOM 0 HA ALA A 14 105.731 12.683 14.999 1.00 1.00 H new ATOM 0 HB1 ALA A 14 103.513 12.134 15.956 1.00 1.00 H new ATOM 0 HB2 ALA A 14 103.644 13.870 15.584 1.00 1.00 H new ATOM 0 HB3 ALA A 14 102.725 12.795 14.503 1.00 1.00 H new ATOM 218 N PHE A 15 104.195 11.110 12.607 1.00 1.00 N ATOM 219 CA PHE A 15 104.033 9.854 11.906 1.00 1.00 C ATOM 220 C PHE A 15 105.382 9.275 11.520 1.00 1.00 C ATOM 221 O PHE A 15 105.672 8.114 11.810 1.00 1.00 O ATOM 222 CB PHE A 15 103.194 10.162 10.677 1.00 1.00 C ATOM 223 CG PHE A 15 102.735 8.929 9.969 1.00 1.00 C ATOM 224 CD1 PHE A 15 103.453 8.462 8.876 1.00 1.00 C ATOM 225 CD2 PHE A 15 101.545 8.306 10.356 1.00 1.00 C ATOM 226 CE1 PHE A 15 102.981 7.368 8.159 1.00 1.00 C ATOM 227 CE2 PHE A 15 101.081 7.197 9.650 1.00 1.00 C ATOM 228 CZ PHE A 15 101.798 6.732 8.547 1.00 1.00 C ATOM 0 H PHE A 15 103.791 11.911 12.121 1.00 1.00 H new ATOM 0 HA PHE A 15 103.547 9.107 12.533 1.00 1.00 H new ATOM 0 HB2 PHE A 15 102.326 10.751 10.973 1.00 1.00 H new ATOM 0 HB3 PHE A 15 103.776 10.776 9.989 1.00 1.00 H new ATOM 0 HD1 PHE A 15 104.373 8.946 8.584 1.00 1.00 H new ATOM 0 HD2 PHE A 15 100.986 8.683 11.200 1.00 1.00 H new ATOM 0 HE1 PHE A 15 103.529 7.009 7.301 1.00 1.00 H new ATOM 0 HE2 PHE A 15 100.172 6.701 9.955 1.00 1.00 H new ATOM 0 HZ PHE A 15 101.438 5.879 7.992 1.00 1.00 H new ATOM 238 N LEU A 16 106.221 10.091 10.890 1.00 1.00 N ATOM 239 CA LEU A 16 107.549 9.619 10.512 1.00 1.00 C ATOM 240 C LEU A 16 108.430 9.508 11.732 1.00 1.00 C ATOM 241 O LEU A 16 109.220 8.575 11.860 1.00 1.00 O ATOM 242 CB LEU A 16 108.237 10.556 9.512 1.00 1.00 C ATOM 243 CG LEU A 16 107.581 10.470 8.119 1.00 1.00 C ATOM 244 CD1 LEU A 16 106.401 11.447 8.001 1.00 1.00 C ATOM 245 CD2 LEU A 16 108.633 10.797 7.063 1.00 1.00 C ATOM 0 H LEU A 16 106.014 11.057 10.636 1.00 1.00 H new ATOM 0 HA LEU A 16 107.411 8.645 10.042 1.00 1.00 H new ATOM 0 HB2 LEU A 16 108.186 11.582 9.877 1.00 1.00 H new ATOM 0 HB3 LEU A 16 109.293 10.297 9.435 1.00 1.00 H new ATOM 0 HG LEU A 16 107.195 9.462 7.969 1.00 1.00 H new ATOM 0 HD11 LEU A 16 105.958 11.364 7.008 1.00 1.00 H new ATOM 0 HD12 LEU A 16 105.651 11.205 8.754 1.00 1.00 H new ATOM 0 HD13 LEU A 16 106.755 12.466 8.156 1.00 1.00 H new ATOM 0 HD21 LEU A 16 108.183 10.740 6.072 1.00 1.00 H new ATOM 0 HD22 LEU A 16 109.016 11.804 7.231 1.00 1.00 H new ATOM 0 HD23 LEU A 16 109.452 10.081 7.131 1.00 1.00 H new ATOM 257 N THR A 17 108.301 10.476 12.622 1.00 1.00 N ATOM 258 CA THR A 17 109.112 10.473 13.821 1.00 1.00 C ATOM 259 C THR A 17 108.800 9.236 14.634 1.00 1.00 C ATOM 260 O THR A 17 109.695 8.591 15.177 1.00 1.00 O ATOM 261 CB THR A 17 108.860 11.721 14.667 1.00 1.00 C ATOM 262 OG1 THR A 17 109.223 12.878 13.933 1.00 1.00 O ATOM 263 CG2 THR A 17 109.703 11.654 15.930 1.00 1.00 C ATOM 0 H THR A 17 107.654 11.260 12.538 1.00 1.00 H new ATOM 0 HA THR A 17 110.161 10.472 13.525 1.00 1.00 H new ATOM 0 HB THR A 17 107.803 11.769 14.927 1.00 1.00 H new ATOM 0 HG1 THR A 17 108.552 13.049 13.239 1.00 1.00 H new ATOM 0 HG21 THR A 17 109.524 12.543 16.534 1.00 1.00 H new ATOM 0 HG22 THR A 17 109.432 10.766 16.502 1.00 1.00 H new ATOM 0 HG23 THR A 17 110.758 11.604 15.661 1.00 1.00 H new ATOM 271 N GLU A 18 107.518 8.920 14.736 1.00 1.00 N ATOM 272 CA GLU A 18 107.091 7.774 15.500 1.00 1.00 C ATOM 273 C GLU A 18 107.353 6.462 14.768 1.00 1.00 C ATOM 274 O GLU A 18 107.845 5.506 15.367 1.00 1.00 O ATOM 275 CB GLU A 18 105.609 7.907 15.841 1.00 1.00 C ATOM 276 CG GLU A 18 105.174 6.745 16.732 1.00 1.00 C ATOM 277 CD GLU A 18 103.736 6.946 17.193 1.00 1.00 C ATOM 278 OE1 GLU A 18 103.070 7.802 16.636 1.00 1.00 O ATOM 279 OE2 GLU A 18 103.323 6.243 18.103 1.00 1.00 O ATOM 0 H GLU A 18 106.761 9.445 14.297 1.00 1.00 H new ATOM 0 HA GLU A 18 107.678 7.749 16.418 1.00 1.00 H new ATOM 0 HB2 GLU A 18 105.427 8.854 16.349 1.00 1.00 H new ATOM 0 HB3 GLU A 18 105.016 7.917 14.926 1.00 1.00 H new ATOM 0 HG2 GLU A 18 105.261 5.806 16.186 1.00 1.00 H new ATOM 0 HG3 GLU A 18 105.834 6.673 17.596 1.00 1.00 H new ATOM 286 N ASN A 19 106.991 6.403 13.488 1.00 1.00 N ATOM 287 CA ASN A 19 107.163 5.164 12.727 1.00 1.00 C ATOM 288 C ASN A 19 108.610 4.707 12.628 1.00 1.00 C ATOM 289 O ASN A 19 108.898 3.524 12.814 1.00 1.00 O ATOM 290 CB ASN A 19 106.588 5.326 11.326 1.00 1.00 C ATOM 291 CG ASN A 19 106.557 3.972 10.643 1.00 1.00 C ATOM 292 OD1 ASN A 19 106.083 2.992 11.220 1.00 1.00 O ATOM 293 ND2 ASN A 19 107.049 3.853 9.451 1.00 1.00 N ATOM 0 H ASN A 19 106.586 7.179 12.964 1.00 1.00 H new ATOM 0 HA ASN A 19 106.623 4.393 13.277 1.00 1.00 H new ATOM 0 HB2 ASN A 19 105.583 5.744 11.378 1.00 1.00 H new ATOM 0 HB3 ASN A 19 107.194 6.024 10.749 1.00 1.00 H new ATOM 0 HD21 ASN A 19 107.045 2.945 8.986 1.00 1.00 H new ATOM 0 HD22 ASN A 19 107.440 4.667 8.977 1.00 1.00 H new ATOM 300 N LYS A 20 109.520 5.616 12.347 1.00 1.00 N ATOM 301 CA LYS A 20 110.925 5.226 12.241 1.00 1.00 C ATOM 302 C LYS A 20 111.388 4.614 13.555 1.00 1.00 C ATOM 303 O LYS A 20 112.201 3.689 13.578 1.00 1.00 O ATOM 304 CB LYS A 20 111.807 6.429 11.915 1.00 1.00 C ATOM 305 CG LYS A 20 111.740 7.434 13.066 1.00 1.00 C ATOM 306 CD LYS A 20 112.371 8.764 12.636 1.00 1.00 C ATOM 307 CE LYS A 20 113.879 8.598 12.444 1.00 1.00 C ATOM 308 NZ LYS A 20 114.522 9.943 12.434 1.00 1.00 N ATOM 0 H LYS A 20 109.329 6.606 12.190 1.00 1.00 H new ATOM 0 HA LYS A 20 111.013 4.498 11.435 1.00 1.00 H new ATOM 0 HB2 LYS A 20 112.837 6.107 11.758 1.00 1.00 H new ATOM 0 HB3 LYS A 20 111.475 6.897 10.989 1.00 1.00 H new ATOM 0 HG2 LYS A 20 110.703 7.592 13.362 1.00 1.00 H new ATOM 0 HG3 LYS A 20 112.263 7.038 13.937 1.00 1.00 H new ATOM 0 HD2 LYS A 20 111.915 9.107 11.707 1.00 1.00 H new ATOM 0 HD3 LYS A 20 112.175 9.528 13.389 1.00 1.00 H new ATOM 0 HE2 LYS A 20 114.295 7.989 13.246 1.00 1.00 H new ATOM 0 HE3 LYS A 20 114.084 8.077 11.509 1.00 1.00 H new ATOM 0 HZ1 LYS A 20 115.548 9.836 12.304 1.00 1.00 H new ATOM 0 HZ2 LYS A 20 114.131 10.509 11.654 1.00 1.00 H new ATOM 0 HZ3 LYS A 20 114.336 10.423 13.337 1.00 1.00 H new ATOM 322 N ASN A 21 110.856 5.146 14.646 1.00 1.00 N ATOM 323 CA ASN A 21 111.203 4.664 15.978 1.00 1.00 C ATOM 324 C ASN A 21 110.558 3.315 16.261 1.00 1.00 C ATOM 325 O ASN A 21 111.117 2.486 16.979 1.00 1.00 O ATOM 326 CB ASN A 21 110.761 5.693 17.028 1.00 1.00 C ATOM 327 CG ASN A 21 111.790 6.818 17.140 1.00 1.00 C ATOM 328 OD1 ASN A 21 112.796 6.677 17.836 1.00 1.00 O ATOM 329 ND2 ASN A 21 111.597 7.932 16.487 1.00 1.00 N ATOM 0 H ASN A 21 110.182 5.912 14.637 1.00 1.00 H new ATOM 0 HA ASN A 21 112.284 4.534 16.027 1.00 1.00 H new ATOM 0 HB2 ASN A 21 109.790 6.106 16.755 1.00 1.00 H new ATOM 0 HB3 ASN A 21 110.640 5.205 17.995 1.00 1.00 H new ATOM 0 HD21 ASN A 21 112.280 8.687 16.553 1.00 1.00 H new ATOM 0 HD22 ASN A 21 110.763 8.048 15.911 1.00 1.00 H new ATOM 336 N LYS A 22 109.367 3.120 15.725 1.00 1.00 N ATOM 337 CA LYS A 22 108.634 1.891 15.956 1.00 1.00 C ATOM 338 C LYS A 22 109.405 0.651 15.449 1.00 1.00 C ATOM 339 O LYS A 22 109.771 0.597 14.275 1.00 1.00 O ATOM 340 CB LYS A 22 107.276 1.986 15.256 1.00 1.00 C ATOM 341 CG LYS A 22 106.323 2.958 16.020 1.00 1.00 C ATOM 342 CD LYS A 22 104.940 2.324 16.213 1.00 1.00 C ATOM 343 CE LYS A 22 104.202 2.305 14.877 1.00 1.00 C ATOM 344 NZ LYS A 22 103.068 1.342 14.958 1.00 1.00 N ATOM 0 H LYS A 22 108.889 3.795 15.129 1.00 1.00 H new ATOM 0 HA LYS A 22 108.500 1.768 17.031 1.00 1.00 H new ATOM 0 HB2 LYS A 22 107.413 2.335 14.232 1.00 1.00 H new ATOM 0 HB3 LYS A 22 106.822 0.997 15.197 1.00 1.00 H new ATOM 0 HG2 LYS A 22 106.752 3.208 16.990 1.00 1.00 H new ATOM 0 HG3 LYS A 22 106.226 3.891 15.465 1.00 1.00 H new ATOM 0 HD2 LYS A 22 105.043 1.310 16.599 1.00 1.00 H new ATOM 0 HD3 LYS A 22 104.368 2.889 16.949 1.00 1.00 H new ATOM 0 HE2 LYS A 22 103.832 3.302 14.638 1.00 1.00 H new ATOM 0 HE3 LYS A 22 104.883 2.017 14.076 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 102.561 1.325 14.050 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 103.434 0.391 15.168 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 102.416 1.636 15.713 1.00 1.00 H new ATOM 358 N PRO A 23 109.641 -0.359 16.284 1.00 1.00 N ATOM 359 CA PRO A 23 110.357 -1.603 15.850 1.00 1.00 C ATOM 360 C PRO A 23 109.760 -2.221 14.585 1.00 1.00 C ATOM 361 O PRO A 23 108.566 -2.096 14.313 1.00 1.00 O ATOM 362 CB PRO A 23 110.208 -2.567 17.035 1.00 1.00 C ATOM 363 CG PRO A 23 109.989 -1.693 18.224 1.00 1.00 C ATOM 364 CD PRO A 23 109.279 -0.431 17.718 1.00 1.00 C ATOM 0 HA PRO A 23 111.395 -1.385 15.598 1.00 1.00 H new ATOM 0 HB2 PRO A 23 109.369 -3.247 16.886 1.00 1.00 H new ATOM 0 HB3 PRO A 23 111.100 -3.182 17.157 1.00 1.00 H new ATOM 0 HG2 PRO A 23 109.384 -2.203 18.973 1.00 1.00 H new ATOM 0 HG3 PRO A 23 110.937 -1.440 18.698 1.00 1.00 H new ATOM 0 HD2 PRO A 23 108.200 -0.500 17.853 1.00 1.00 H new ATOM 0 HD3 PRO A 23 109.611 0.456 18.257 1.00 1.00 H new ATOM 372 N GLY A 24 110.621 -2.875 13.818 1.00 1.00 N ATOM 373 CA GLY A 24 110.225 -3.511 12.570 1.00 1.00 C ATOM 374 C GLY A 24 110.342 -2.526 11.429 1.00 1.00 C ATOM 375 O GLY A 24 110.444 -2.914 10.273 1.00 1.00 O ATOM 0 H GLY A 24 111.610 -2.979 14.043 1.00 1.00 H new ATOM 0 HA2 GLY A 24 110.856 -4.379 12.378 1.00 1.00 H new ATOM 0 HA3 GLY A 24 109.200 -3.873 12.646 1.00 1.00 H new ATOM 379 N VAL A 25 110.354 -1.247 11.771 1.00 1.00 N ATOM 380 CA VAL A 25 110.474 -0.196 10.771 1.00 1.00 C ATOM 381 C VAL A 25 111.939 0.185 10.603 1.00 1.00 C ATOM 382 O VAL A 25 112.645 0.430 11.582 1.00 1.00 O ATOM 383 CB VAL A 25 109.693 1.049 11.223 1.00 1.00 C ATOM 384 CG1 VAL A 25 109.752 2.146 10.158 1.00 1.00 C ATOM 385 CG2 VAL A 25 108.230 0.698 11.511 1.00 1.00 C ATOM 0 H VAL A 25 110.282 -0.911 12.732 1.00 1.00 H new ATOM 0 HA VAL A 25 110.071 -0.562 9.827 1.00 1.00 H new ATOM 0 HB VAL A 25 110.159 1.416 12.138 1.00 1.00 H new ATOM 0 HG11 VAL A 25 109.192 3.016 10.501 1.00 1.00 H new ATOM 0 HG12 VAL A 25 110.790 2.428 9.983 1.00 1.00 H new ATOM 0 HG13 VAL A 25 109.315 1.776 9.230 1.00 1.00 H new ATOM 0 HG21 VAL A 25 107.697 1.594 11.829 1.00 1.00 H new ATOM 0 HG22 VAL A 25 107.766 0.301 10.608 1.00 1.00 H new ATOM 0 HG23 VAL A 25 108.184 -0.051 12.301 1.00 1.00 H new ATOM 389 N VAL A 26 112.375 0.278 9.356 1.00 1.00 N ATOM 390 CA VAL A 26 113.749 0.682 9.049 1.00 1.00 C ATOM 391 C VAL A 26 113.706 1.978 8.264 1.00 1.00 C ATOM 392 O VAL A 26 113.098 2.040 7.200 1.00 1.00 O ATOM 393 CB VAL A 26 114.451 -0.403 8.227 1.00 1.00 C ATOM 394 CG1 VAL A 26 115.867 0.032 7.886 1.00 1.00 C ATOM 395 CG2 VAL A 26 114.497 -1.695 9.022 1.00 1.00 C ATOM 0 H VAL A 26 111.801 0.080 8.536 1.00 1.00 H new ATOM 0 HA VAL A 26 114.306 0.824 9.975 1.00 1.00 H new ATOM 0 HB VAL A 26 113.895 -0.561 7.303 1.00 1.00 H new ATOM 0 HG11 VAL A 26 116.356 -0.747 7.302 1.00 1.00 H new ATOM 0 HG12 VAL A 26 115.835 0.954 7.306 1.00 1.00 H new ATOM 0 HG13 VAL A 26 116.427 0.201 8.806 1.00 1.00 H new ATOM 0 HG21 VAL A 26 114.997 -2.466 8.435 1.00 1.00 H new ATOM 0 HG22 VAL A 26 115.046 -1.532 9.950 1.00 1.00 H new ATOM 0 HG23 VAL A 26 113.481 -2.016 9.253 1.00 1.00 H new ATOM 399 N VAL A 27 114.338 3.024 8.798 1.00 1.00 N ATOM 400 CA VAL A 27 114.338 4.331 8.137 1.00 1.00 C ATOM 401 C VAL A 27 115.586 4.531 7.313 1.00 1.00 C ATOM 402 O VAL A 27 116.672 4.058 7.657 1.00 1.00 O ATOM 403 CB VAL A 27 114.176 5.463 9.168 1.00 1.00 C ATOM 404 CG1 VAL A 27 115.262 5.356 10.209 1.00 1.00 C ATOM 405 CG2 VAL A 27 114.234 6.850 8.507 1.00 1.00 C ATOM 0 H VAL A 27 114.852 2.994 9.678 1.00 1.00 H new ATOM 0 HA VAL A 27 113.486 4.360 7.458 1.00 1.00 H new ATOM 0 HB VAL A 27 113.196 5.354 9.633 1.00 1.00 H new ATOM 0 HG11 VAL A 27 115.147 6.158 10.939 1.00 1.00 H new ATOM 0 HG12 VAL A 27 115.189 4.393 10.714 1.00 1.00 H new ATOM 0 HG13 VAL A 27 116.237 5.440 9.728 1.00 1.00 H new ATOM 0 HG21 VAL A 27 114.116 7.621 9.268 1.00 1.00 H new ATOM 0 HG22 VAL A 27 115.195 6.976 8.009 1.00 1.00 H new ATOM 0 HG23 VAL A 27 113.432 6.938 7.774 1.00 1.00 H new ATOM 409 N LEU A 28 115.405 5.245 6.203 1.00 1.00 N ATOM 410 CA LEU A 28 116.504 5.527 5.285 1.00 1.00 C ATOM 411 C LEU A 28 116.829 7.015 5.265 1.00 1.00 C ATOM 412 O LEU A 28 116.025 7.832 5.717 1.00 1.00 O ATOM 413 CB LEU A 28 116.117 5.088 3.869 1.00 1.00 C ATOM 414 CG LEU A 28 115.739 3.610 3.837 1.00 1.00 C ATOM 415 CD1 LEU A 28 115.171 3.286 2.454 1.00 1.00 C ATOM 416 CD2 LEU A 28 116.987 2.754 4.076 1.00 1.00 C ATOM 0 H LEU A 28 114.508 5.638 5.919 1.00 1.00 H new ATOM 0 HA LEU A 28 117.381 4.977 5.626 1.00 1.00 H new ATOM 0 HB2 LEU A 28 115.279 5.689 3.515 1.00 1.00 H new ATOM 0 HB3 LEU A 28 116.949 5.269 3.189 1.00 1.00 H new ATOM 0 HG LEU A 28 115.002 3.399 4.612 1.00 1.00 H new ATOM 0 HD11 LEU A 28 114.895 2.232 2.412 1.00 1.00 H new ATOM 0 HD12 LEU A 28 114.289 3.900 2.270 1.00 1.00 H new ATOM 0 HD13 LEU A 28 115.924 3.494 1.694 1.00 1.00 H new ATOM 0 HD21 LEU A 28 116.714 1.699 4.053 1.00 1.00 H new ATOM 0 HD22 LEU A 28 117.722 2.956 3.297 1.00 1.00 H new ATOM 0 HD23 LEU A 28 117.414 2.997 5.049 1.00 1.00 H new ATOM 428 N PRO A 29 117.980 7.395 4.744 1.00 1.00 N ATOM 429 CA PRO A 29 118.374 8.824 4.671 1.00 1.00 C ATOM 430 C PRO A 29 117.361 9.627 3.864 1.00 1.00 C ATOM 431 O PRO A 29 117.149 10.816 4.110 1.00 1.00 O ATOM 432 CB PRO A 29 119.750 8.808 3.995 1.00 1.00 C ATOM 433 CG PRO A 29 120.260 7.426 4.212 1.00 1.00 C ATOM 434 CD PRO A 29 119.031 6.535 4.174 1.00 1.00 C ATOM 0 HA PRO A 29 118.409 9.299 5.651 1.00 1.00 H new ATOM 0 HB2 PRO A 29 119.672 9.039 2.933 1.00 1.00 H new ATOM 0 HB3 PRO A 29 120.416 9.550 4.435 1.00 1.00 H new ATOM 0 HG2 PRO A 29 120.974 7.144 3.438 1.00 1.00 H new ATOM 0 HG3 PRO A 29 120.777 7.343 5.168 1.00 1.00 H new ATOM 0 HD2 PRO A 29 118.790 6.223 3.158 1.00 1.00 H new ATOM 0 HD3 PRO A 29 119.172 5.627 4.761 1.00 1.00 H new ATOM 442 N SER A 30 116.737 8.957 2.899 1.00 1.00 N ATOM 443 CA SER A 30 115.745 9.597 2.052 1.00 1.00 C ATOM 444 C SER A 30 114.512 9.941 2.873 1.00 1.00 C ATOM 445 O SER A 30 113.662 10.722 2.447 1.00 1.00 O ATOM 446 CB SER A 30 115.358 8.661 0.904 1.00 1.00 C ATOM 447 OG SER A 30 116.526 8.021 0.406 1.00 1.00 O ATOM 0 H SER A 30 116.903 7.973 2.687 1.00 1.00 H new ATOM 0 HA SER A 30 116.167 10.513 1.638 1.00 1.00 H new ATOM 0 HB2 SER A 30 114.642 7.917 1.252 1.00 1.00 H new ATOM 0 HB3 SER A 30 114.871 9.225 0.108 1.00 1.00 H new ATOM 0 HG SER A 30 116.282 7.420 -0.328 1.00 1.00 H new ATOM 453 N GLY A 31 114.426 9.344 4.054 1.00 1.00 N ATOM 454 CA GLY A 31 113.297 9.572 4.945 1.00 1.00 C ATOM 455 C GLY A 31 112.251 8.494 4.746 1.00 1.00 C ATOM 456 O GLY A 31 111.254 8.441 5.464 1.00 1.00 O ATOM 0 H GLY A 31 115.126 8.697 4.418 1.00 1.00 H new ATOM 0 HA2 GLY A 31 113.636 9.574 5.981 1.00 1.00 H new ATOM 0 HA3 GLY A 31 112.862 10.552 4.750 1.00 1.00 H new ATOM 460 N LEU A 32 112.487 7.624 3.768 1.00 1.00 N ATOM 461 CA LEU A 32 111.551 6.547 3.491 1.00 1.00 C ATOM 462 C LEU A 32 111.738 5.448 4.526 1.00 1.00 C ATOM 463 O LEU A 32 112.863 5.053 4.826 1.00 1.00 O ATOM 464 CB LEU A 32 111.792 5.998 2.063 1.00 1.00 C ATOM 465 CG LEU A 32 110.780 4.898 1.631 1.00 1.00 C ATOM 466 CD1 LEU A 32 111.177 3.529 2.164 1.00 1.00 C ATOM 467 CD2 LEU A 32 109.366 5.242 2.085 1.00 1.00 C ATOM 0 H LEU A 32 113.308 7.645 3.163 1.00 1.00 H new ATOM 0 HA LEU A 32 110.528 6.920 3.548 1.00 1.00 H new ATOM 0 HB2 LEU A 32 111.741 6.824 1.353 1.00 1.00 H new ATOM 0 HB3 LEU A 32 112.802 5.591 2.006 1.00 1.00 H new ATOM 0 HG LEU A 32 110.799 4.859 0.542 1.00 1.00 H new ATOM 0 HD11 LEU A 32 110.446 2.787 1.842 1.00 1.00 H new ATOM 0 HD12 LEU A 32 112.161 3.260 1.780 1.00 1.00 H new ATOM 0 HD13 LEU A 32 111.208 3.558 3.253 1.00 1.00 H new ATOM 0 HD21 LEU A 32 108.681 4.455 1.769 1.00 1.00 H new ATOM 0 HD22 LEU A 32 109.343 5.328 3.171 1.00 1.00 H new ATOM 0 HD23 LEU A 32 109.061 6.189 1.640 1.00 1.00 H new ATOM 479 N GLN A 33 110.628 4.958 5.069 1.00 1.00 N ATOM 480 CA GLN A 33 110.670 3.902 6.074 1.00 1.00 C ATOM 481 C GLN A 33 109.856 2.700 5.637 1.00 1.00 C ATOM 482 O GLN A 33 108.748 2.848 5.128 1.00 1.00 O ATOM 483 CB GLN A 33 110.082 4.429 7.385 1.00 1.00 C ATOM 484 CG GLN A 33 110.929 5.587 7.923 1.00 1.00 C ATOM 485 CD GLN A 33 110.335 6.936 7.568 1.00 1.00 C ATOM 486 OE1 GLN A 33 109.415 7.028 6.753 1.00 1.00 O ATOM 487 NE2 GLN A 33 110.822 7.998 8.136 1.00 1.00 N ATOM 0 H GLN A 33 109.689 5.275 4.830 1.00 1.00 H new ATOM 0 HA GLN A 33 111.709 3.601 6.206 1.00 1.00 H new ATOM 0 HB2 GLN A 33 109.058 4.764 7.223 1.00 1.00 H new ATOM 0 HB3 GLN A 33 110.042 3.627 8.122 1.00 1.00 H new ATOM 0 HG2 GLN A 33 111.014 5.502 9.006 1.00 1.00 H new ATOM 0 HG3 GLN A 33 111.938 5.517 7.518 1.00 1.00 H new ATOM 0 HE21 GLN A 33 111.583 7.913 8.809 1.00 1.00 H new ATOM 0 HE22 GLN A 33 110.443 8.917 7.909 1.00 1.00 H new ATOM 496 N TYR A 34 110.399 1.504 5.864 1.00 1.00 N ATOM 497 CA TYR A 34 109.686 0.279 5.512 1.00 1.00 C ATOM 498 C TYR A 34 109.743 -0.718 6.637 1.00 1.00 C ATOM 499 O TYR A 34 110.748 -0.849 7.336 1.00 1.00 O ATOM 500 CB TYR A 34 110.255 -0.344 4.238 1.00 1.00 C ATOM 501 CG TYR A 34 111.700 -0.702 4.451 1.00 1.00 C ATOM 502 CD1 TYR A 34 112.016 -1.879 5.125 1.00 1.00 C ATOM 503 CD2 TYR A 34 112.720 0.131 3.975 1.00 1.00 C ATOM 504 CE1 TYR A 34 113.355 -2.234 5.330 1.00 1.00 C ATOM 505 CE2 TYR A 34 114.060 -0.222 4.180 1.00 1.00 C ATOM 506 CZ TYR A 34 114.377 -1.404 4.858 1.00 1.00 C ATOM 507 OH TYR A 34 115.696 -1.754 5.061 1.00 1.00 O ATOM 0 H TYR A 34 111.317 1.359 6.284 1.00 1.00 H new ATOM 0 HA TYR A 34 108.645 0.547 5.332 1.00 1.00 H new ATOM 0 HB2 TYR A 34 109.685 -1.234 3.971 1.00 1.00 H new ATOM 0 HB3 TYR A 34 110.162 0.355 3.407 1.00 1.00 H new ATOM 0 HD1 TYR A 34 111.227 -2.519 5.490 1.00 1.00 H new ATOM 0 HD2 TYR A 34 112.474 1.043 3.451 1.00 1.00 H new ATOM 0 HE1 TYR A 34 113.598 -3.148 5.852 1.00 1.00 H new ATOM 0 HE2 TYR A 34 114.849 0.419 3.814 1.00 1.00 H new ATOM 0 HH TYR A 34 116.280 -1.070 4.670 1.00 1.00 H new ATOM 517 N LYS A 35 108.634 -1.429 6.797 1.00 1.00 N ATOM 518 CA LYS A 35 108.509 -2.433 7.823 1.00 1.00 C ATOM 519 C LYS A 35 108.069 -3.731 7.206 1.00 1.00 C ATOM 520 O LYS A 35 107.144 -3.769 6.397 1.00 1.00 O ATOM 521 CB LYS A 35 107.508 -1.977 8.882 1.00 1.00 C ATOM 522 CG LYS A 35 107.403 -3.004 10.009 1.00 1.00 C ATOM 523 CD LYS A 35 106.153 -3.859 9.857 1.00 1.00 C ATOM 524 CE LYS A 35 106.050 -4.776 11.067 1.00 1.00 C ATOM 525 NZ LYS A 35 105.937 -3.955 12.306 1.00 1.00 N ATOM 0 H LYS A 35 107.803 -1.320 6.216 1.00 1.00 H new ATOM 0 HA LYS A 35 109.476 -2.581 8.304 1.00 1.00 H new ATOM 0 HB2 LYS A 35 107.816 -1.014 9.289 1.00 1.00 H new ATOM 0 HB3 LYS A 35 106.529 -1.831 8.425 1.00 1.00 H new ATOM 0 HG2 LYS A 35 108.286 -3.642 10.007 1.00 1.00 H new ATOM 0 HG3 LYS A 35 107.382 -2.492 10.971 1.00 1.00 H new ATOM 0 HD2 LYS A 35 105.268 -3.227 9.783 1.00 1.00 H new ATOM 0 HD3 LYS A 35 106.204 -4.445 8.940 1.00 1.00 H new ATOM 0 HE2 LYS A 35 105.182 -5.428 10.970 1.00 1.00 H new ATOM 0 HE3 LYS A 35 106.927 -5.420 11.124 1.00 1.00 H new ATOM 0 HZ1 LYS A 35 105.249 -4.393 12.951 1.00 1.00 H new ATOM 0 HZ2 LYS A 35 106.865 -3.902 12.773 1.00 1.00 H new ATOM 0 HZ3 LYS A 35 105.618 -2.996 12.059 1.00 1.00 H new ATOM 539 N VAL A 36 108.765 -4.791 7.572 1.00 1.00 N ATOM 540 CA VAL A 36 108.469 -6.106 7.021 1.00 1.00 C ATOM 541 C VAL A 36 107.411 -6.840 7.837 1.00 1.00 C ATOM 542 O VAL A 36 107.669 -7.364 8.919 1.00 1.00 O ATOM 543 CB VAL A 36 109.766 -6.927 6.898 1.00 1.00 C ATOM 544 CG1 VAL A 36 110.550 -6.900 8.211 1.00 1.00 C ATOM 545 CG2 VAL A 36 109.438 -8.381 6.515 1.00 1.00 C ATOM 0 H VAL A 36 109.533 -4.772 8.242 1.00 1.00 H new ATOM 0 HA VAL A 36 108.049 -5.973 6.024 1.00 1.00 H new ATOM 0 HB VAL A 36 110.381 -6.481 6.117 1.00 1.00 H new ATOM 0 HG11 VAL A 36 111.463 -7.486 8.102 1.00 1.00 H new ATOM 0 HG12 VAL A 36 110.808 -5.871 8.460 1.00 1.00 H new ATOM 0 HG13 VAL A 36 109.939 -7.324 9.008 1.00 1.00 H new ATOM 0 HG21 VAL A 36 110.362 -8.952 6.431 1.00 1.00 H new ATOM 0 HG22 VAL A 36 108.805 -8.826 7.283 1.00 1.00 H new ATOM 0 HG23 VAL A 36 108.914 -8.396 5.559 1.00 1.00 H new ATOM 549 N ILE A 37 106.213 -6.890 7.283 1.00 1.00 N ATOM 550 CA ILE A 37 105.120 -7.581 7.934 1.00 1.00 C ATOM 551 C ILE A 37 105.405 -9.073 7.898 1.00 1.00 C ATOM 552 O ILE A 37 105.192 -9.795 8.871 1.00 1.00 O ATOM 553 CB ILE A 37 103.808 -7.299 7.197 1.00 1.00 C ATOM 554 CG1 ILE A 37 103.678 -5.805 6.852 1.00 1.00 C ATOM 555 CG2 ILE A 37 102.653 -7.715 8.083 1.00 1.00 C ATOM 556 CD1 ILE A 37 103.600 -4.919 8.094 1.00 1.00 C ATOM 0 H ILE A 37 105.975 -6.462 6.388 1.00 1.00 H new ATOM 0 HA ILE A 37 105.028 -7.235 8.964 1.00 1.00 H new ATOM 0 HB ILE A 37 103.797 -7.865 6.266 1.00 1.00 H new ATOM 0 HG12 ILE A 37 104.531 -5.500 6.246 1.00 1.00 H new ATOM 0 HG13 ILE A 37 102.786 -5.653 6.245 1.00 1.00 H new ATOM 0 HG21 ILE A 37 101.712 -7.519 7.569 1.00 1.00 H new ATOM 0 HG22 ILE A 37 102.730 -8.779 8.306 1.00 1.00 H new ATOM 0 HG23 ILE A 37 102.684 -7.146 9.012 1.00 1.00 H new ATOM 0 HD11 ILE A 37 103.509 -3.876 7.792 1.00 1.00 H new ATOM 0 HD12 ILE A 37 102.731 -5.201 8.688 1.00 1.00 H new ATOM 0 HD13 ILE A 37 104.504 -5.047 8.689 1.00 1.00 H new ATOM 563 N ASN A 38 105.886 -9.514 6.743 1.00 1.00 N ATOM 564 CA ASN A 38 106.210 -10.913 6.517 1.00 1.00 C ATOM 565 C ASN A 38 107.472 -11.018 5.672 1.00 1.00 C ATOM 566 O ASN A 38 107.554 -10.418 4.605 1.00 1.00 O ATOM 567 CB ASN A 38 105.057 -11.587 5.782 1.00 1.00 C ATOM 568 CG ASN A 38 103.798 -11.559 6.647 1.00 1.00 C ATOM 569 OD1 ASN A 38 103.507 -12.526 7.353 1.00 1.00 O ATOM 570 ND2 ASN A 38 103.038 -10.498 6.653 1.00 1.00 N ATOM 0 H ASN A 38 106.062 -8.912 5.939 1.00 1.00 H new ATOM 0 HA ASN A 38 106.373 -11.404 7.476 1.00 1.00 H new ATOM 0 HB2 ASN A 38 104.870 -11.077 4.837 1.00 1.00 H new ATOM 0 HB3 ASN A 38 105.320 -12.617 5.542 1.00 1.00 H new ATOM 0 HD21 ASN A 38 102.205 -10.471 7.241 1.00 1.00 H new ATOM 0 HD22 ASN A 38 103.277 -9.696 6.069 1.00 1.00 H new ATOM 577 N SER A 39 108.449 -11.777 6.146 1.00 1.00 N ATOM 578 CA SER A 39 109.695 -11.947 5.405 1.00 1.00 C ATOM 579 C SER A 39 109.567 -13.092 4.405 1.00 1.00 C ATOM 580 O SER A 39 109.129 -14.187 4.754 1.00 1.00 O ATOM 581 CB SER A 39 110.839 -12.240 6.367 1.00 1.00 C ATOM 582 OG SER A 39 110.740 -13.584 6.819 1.00 1.00 O ATOM 0 H SER A 39 108.407 -12.282 7.031 1.00 1.00 H new ATOM 0 HA SER A 39 109.903 -11.024 4.865 1.00 1.00 H new ATOM 0 HB2 SER A 39 111.796 -12.081 5.871 1.00 1.00 H new ATOM 0 HB3 SER A 39 110.801 -11.555 7.214 1.00 1.00 H new ATOM 0 HG SER A 39 109.991 -14.027 6.368 1.00 1.00 H new ATOM 588 N GLY A 40 109.963 -12.829 3.161 1.00 1.00 N ATOM 589 CA GLY A 40 109.909 -13.826 2.097 1.00 1.00 C ATOM 590 C GLY A 40 111.302 -14.048 1.523 1.00 1.00 C ATOM 591 O GLY A 40 111.672 -15.167 1.169 1.00 1.00 O ATOM 0 H GLY A 40 110.328 -11.924 2.865 1.00 1.00 H new ATOM 0 HA2 GLY A 40 109.513 -14.764 2.486 1.00 1.00 H new ATOM 0 HA3 GLY A 40 109.231 -13.495 1.311 1.00 1.00 H new ATOM 595 N ASN A 41 112.073 -12.967 1.454 1.00 1.00 N ATOM 596 CA ASN A 41 113.436 -13.032 0.946 1.00 1.00 C ATOM 597 C ASN A 41 113.478 -13.567 -0.481 1.00 1.00 C ATOM 598 O ASN A 41 114.434 -14.235 -0.876 1.00 1.00 O ATOM 599 CB ASN A 41 114.267 -13.920 1.864 1.00 1.00 C ATOM 600 CG ASN A 41 114.091 -13.453 3.304 1.00 1.00 C ATOM 601 OD1 ASN A 41 114.624 -14.068 4.228 1.00 1.00 O ATOM 602 ND2 ASN A 41 113.363 -12.394 3.549 1.00 1.00 N ATOM 0 H ASN A 41 111.775 -12.036 1.744 1.00 1.00 H new ATOM 0 HA ASN A 41 113.848 -12.023 0.929 1.00 1.00 H new ATOM 0 HB2 ASN A 41 113.955 -14.960 1.765 1.00 1.00 H new ATOM 0 HB3 ASN A 41 115.318 -13.875 1.580 1.00 1.00 H new ATOM 0 HD21 ASN A 41 113.235 -12.074 4.509 1.00 1.00 H new ATOM 0 HD22 ASN A 41 112.924 -11.888 2.780 1.00 1.00 H new ATOM 609 N GLY A 42 112.440 -13.263 -1.256 1.00 1.00 N ATOM 610 CA GLY A 42 112.370 -13.705 -2.642 1.00 1.00 C ATOM 611 C GLY A 42 112.974 -12.686 -3.587 1.00 1.00 C ATOM 612 O GLY A 42 113.720 -11.792 -3.188 1.00 1.00 O ATOM 0 H GLY A 42 111.638 -12.713 -0.947 1.00 1.00 H new ATOM 0 HA2 GLY A 42 112.894 -14.655 -2.748 1.00 1.00 H new ATOM 0 HA3 GLY A 42 111.330 -13.883 -2.915 1.00 1.00 H new ATOM 616 N VAL A 43 112.610 -12.837 -4.844 1.00 1.00 N ATOM 617 CA VAL A 43 113.053 -11.951 -5.901 1.00 1.00 C ATOM 618 C VAL A 43 112.405 -10.588 -5.725 1.00 1.00 C ATOM 619 O VAL A 43 111.655 -10.377 -4.785 1.00 1.00 O ATOM 620 CB VAL A 43 112.726 -12.543 -7.279 1.00 1.00 C ATOM 621 CG1 VAL A 43 113.398 -13.905 -7.405 1.00 1.00 C ATOM 622 CG2 VAL A 43 111.219 -12.704 -7.470 1.00 1.00 C ATOM 0 H VAL A 43 111.993 -13.584 -5.163 1.00 1.00 H new ATOM 0 HA VAL A 43 114.135 -11.836 -5.841 1.00 1.00 H new ATOM 0 HB VAL A 43 113.095 -11.862 -8.045 1.00 1.00 H new ATOM 0 HG11 VAL A 43 113.171 -14.334 -8.381 1.00 1.00 H new ATOM 0 HG12 VAL A 43 114.477 -13.789 -7.301 1.00 1.00 H new ATOM 0 HG13 VAL A 43 113.027 -14.567 -6.623 1.00 1.00 H new ATOM 0 HG21 VAL A 43 111.020 -13.125 -8.455 1.00 1.00 H new ATOM 0 HG22 VAL A 43 110.824 -13.371 -6.704 1.00 1.00 H new ATOM 0 HG23 VAL A 43 110.736 -11.730 -7.387 1.00 1.00 H new ATOM 626 N LYS A 44 112.696 -9.683 -6.644 1.00 1.00 N ATOM 627 CA LYS A 44 112.150 -8.320 -6.609 1.00 1.00 C ATOM 628 C LYS A 44 112.729 -7.501 -7.778 1.00 1.00 C ATOM 629 O LYS A 44 113.768 -7.852 -8.338 1.00 1.00 O ATOM 630 CB LYS A 44 112.435 -7.612 -5.248 1.00 1.00 C ATOM 631 CG LYS A 44 113.926 -7.234 -5.060 1.00 1.00 C ATOM 632 CD LYS A 44 114.690 -8.359 -4.316 1.00 1.00 C ATOM 633 CE LYS A 44 114.652 -8.140 -2.801 1.00 1.00 C ATOM 634 NZ LYS A 44 114.927 -9.436 -2.133 1.00 1.00 N ATOM 0 H LYS A 44 113.314 -9.863 -7.436 1.00 1.00 H new ATOM 0 HA LYS A 44 111.067 -8.387 -6.713 1.00 1.00 H new ATOM 0 HB2 LYS A 44 111.826 -6.710 -5.180 1.00 1.00 H new ATOM 0 HB3 LYS A 44 112.127 -8.267 -4.433 1.00 1.00 H new ATOM 0 HG2 LYS A 44 114.386 -7.057 -6.032 1.00 1.00 H new ATOM 0 HG3 LYS A 44 114.002 -6.303 -4.497 1.00 1.00 H new ATOM 0 HD2 LYS A 44 114.248 -9.325 -4.558 1.00 1.00 H new ATOM 0 HD3 LYS A 44 115.725 -8.387 -4.657 1.00 1.00 H new ATOM 0 HE2 LYS A 44 115.393 -7.397 -2.507 1.00 1.00 H new ATOM 0 HE3 LYS A 44 113.678 -7.756 -2.498 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 114.905 -9.306 -1.101 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 114.203 -10.130 -2.410 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 115.865 -9.782 -2.419 1.00 1.00 H new ATOM 648 N PRO A 45 112.009 -6.481 -8.219 1.00 1.00 N ATOM 649 CA PRO A 45 112.377 -5.658 -9.422 1.00 1.00 C ATOM 650 C PRO A 45 113.294 -4.458 -9.200 1.00 1.00 C ATOM 651 O PRO A 45 113.335 -3.869 -8.132 1.00 1.00 O ATOM 652 CB PRO A 45 111.005 -5.183 -9.926 1.00 1.00 C ATOM 653 CG PRO A 45 110.105 -5.153 -8.723 1.00 1.00 C ATOM 654 CD PRO A 45 110.764 -5.971 -7.608 1.00 1.00 C ATOM 0 HA PRO A 45 112.971 -6.264 -10.106 1.00 1.00 H new ATOM 0 HB2 PRO A 45 111.078 -4.196 -10.382 1.00 1.00 H new ATOM 0 HB3 PRO A 45 110.615 -5.858 -10.688 1.00 1.00 H new ATOM 0 HG2 PRO A 45 109.943 -4.126 -8.395 1.00 1.00 H new ATOM 0 HG3 PRO A 45 109.127 -5.567 -8.970 1.00 1.00 H new ATOM 0 HD2 PRO A 45 110.973 -5.356 -6.733 1.00 1.00 H new ATOM 0 HD3 PRO A 45 110.120 -6.786 -7.278 1.00 1.00 H new ATOM 662 N GLY A 46 113.957 -4.062 -10.292 1.00 1.00 N ATOM 663 CA GLY A 46 114.809 -2.882 -10.301 1.00 1.00 C ATOM 664 C GLY A 46 113.975 -1.650 -10.605 1.00 1.00 C ATOM 665 O GLY A 46 112.775 -1.732 -10.848 1.00 1.00 O ATOM 0 H GLY A 46 113.915 -4.551 -11.186 1.00 1.00 H new ATOM 0 HA2 GLY A 46 115.302 -2.770 -9.335 1.00 1.00 H new ATOM 0 HA3 GLY A 46 115.594 -2.995 -11.048 1.00 1.00 H new ATOM 669 N LYS A 47 114.630 -0.515 -10.591 1.00 1.00 N ATOM 670 CA LYS A 47 113.971 0.752 -10.854 1.00 1.00 C ATOM 671 C LYS A 47 113.238 0.744 -12.184 1.00 1.00 C ATOM 672 O LYS A 47 112.304 1.516 -12.388 1.00 1.00 O ATOM 673 CB LYS A 47 115.008 1.892 -10.822 1.00 1.00 C ATOM 674 CG LYS A 47 115.823 1.991 -12.138 1.00 1.00 C ATOM 675 CD LYS A 47 116.690 0.742 -12.365 1.00 1.00 C ATOM 676 CE LYS A 47 117.710 0.567 -11.233 1.00 1.00 C ATOM 677 NZ LYS A 47 118.188 1.901 -10.768 1.00 1.00 N ATOM 0 H LYS A 47 115.629 -0.437 -10.399 1.00 1.00 H new ATOM 0 HA LYS A 47 113.226 0.912 -10.074 1.00 1.00 H new ATOM 0 HB2 LYS A 47 114.497 2.838 -10.643 1.00 1.00 H new ATOM 0 HB3 LYS A 47 115.690 1.735 -9.987 1.00 1.00 H new ATOM 0 HG2 LYS A 47 115.142 2.119 -12.979 1.00 1.00 H new ATOM 0 HG3 LYS A 47 116.460 2.875 -12.106 1.00 1.00 H new ATOM 0 HD2 LYS A 47 116.053 -0.141 -12.425 1.00 1.00 H new ATOM 0 HD3 LYS A 47 117.211 0.825 -13.319 1.00 1.00 H new ATOM 0 HE2 LYS A 47 117.256 0.025 -10.404 1.00 1.00 H new ATOM 0 HE3 LYS A 47 118.553 -0.030 -11.581 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 119.108 1.795 -10.296 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 118.289 2.537 -11.584 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 117.500 2.302 -10.099 1.00 1.00 H new ATOM 691 N SER A 48 113.693 -0.097 -13.098 1.00 1.00 N ATOM 692 CA SER A 48 113.095 -0.156 -14.443 1.00 1.00 C ATOM 693 C SER A 48 112.293 -1.433 -14.671 1.00 1.00 C ATOM 694 O SER A 48 111.648 -1.594 -15.708 1.00 1.00 O ATOM 695 CB SER A 48 114.223 -0.046 -15.465 1.00 1.00 C ATOM 696 OG SER A 48 114.537 1.327 -15.659 1.00 1.00 O ATOM 0 H SER A 48 114.465 -0.746 -12.947 1.00 1.00 H new ATOM 0 HA SER A 48 112.391 0.669 -14.550 1.00 1.00 H new ATOM 0 HB2 SER A 48 115.102 -0.588 -15.116 1.00 1.00 H new ATOM 0 HB3 SER A 48 113.922 -0.501 -16.409 1.00 1.00 H new ATOM 0 HG SER A 48 115.262 1.407 -16.313 1.00 1.00 H new ATOM 702 N ASP A 49 112.328 -2.324 -13.704 1.00 1.00 N ATOM 703 CA ASP A 49 111.590 -3.576 -13.800 1.00 1.00 C ATOM 704 C ASP A 49 110.146 -3.332 -13.399 1.00 1.00 C ATOM 705 O ASP A 49 109.823 -2.267 -12.874 1.00 1.00 O ATOM 706 CB ASP A 49 112.219 -4.570 -12.861 1.00 1.00 C ATOM 707 CG ASP A 49 113.583 -4.992 -13.382 1.00 1.00 C ATOM 708 OD1 ASP A 49 114.286 -5.674 -12.656 1.00 1.00 O ATOM 709 OD2 ASP A 49 113.911 -4.619 -14.496 1.00 1.00 O ATOM 0 H ASP A 49 112.858 -2.210 -12.840 1.00 1.00 H new ATOM 0 HA ASP A 49 111.618 -3.961 -14.819 1.00 1.00 H new ATOM 0 HB2 ASP A 49 112.320 -4.130 -11.869 1.00 1.00 H new ATOM 0 HB3 ASP A 49 111.574 -5.443 -12.758 1.00 1.00 H new ATOM 714 N THR A 50 109.281 -4.314 -13.631 1.00 1.00 N ATOM 715 CA THR A 50 107.868 -4.182 -13.263 1.00 1.00 C ATOM 716 C THR A 50 107.546 -5.129 -12.123 1.00 1.00 C ATOM 717 O THR A 50 108.215 -6.142 -11.931 1.00 1.00 O ATOM 718 CB THR A 50 106.960 -4.411 -14.478 1.00 1.00 C ATOM 719 OG1 THR A 50 107.449 -3.659 -15.576 1.00 1.00 O ATOM 720 CG2 THR A 50 105.533 -3.977 -14.154 1.00 1.00 C ATOM 0 H THR A 50 109.526 -5.203 -14.067 1.00 1.00 H new ATOM 0 HA THR A 50 107.680 -3.165 -12.920 1.00 1.00 H new ATOM 0 HB THR A 50 106.958 -5.471 -14.731 1.00 1.00 H new ATOM 0 HG1 THR A 50 106.872 -3.804 -16.355 1.00 1.00 H new ATOM 0 HG21 THR A 50 104.896 -4.143 -15.023 1.00 1.00 H new ATOM 0 HG22 THR A 50 105.158 -4.559 -13.312 1.00 1.00 H new ATOM 0 HG23 THR A 50 105.525 -2.918 -13.895 1.00 1.00 H new ATOM 728 N VAL A 51 106.565 -4.747 -11.316 1.00 1.00 N ATOM 729 CA VAL A 51 106.201 -5.529 -10.138 1.00 1.00 C ATOM 730 C VAL A 51 104.711 -5.791 -10.078 1.00 1.00 C ATOM 731 O VAL A 51 103.941 -5.096 -10.720 1.00 1.00 O ATOM 732 CB VAL A 51 106.649 -4.760 -8.887 1.00 1.00 C ATOM 733 CG1 VAL A 51 105.723 -3.585 -8.579 1.00 1.00 C ATOM 734 CG2 VAL A 51 106.710 -5.719 -7.702 1.00 1.00 C ATOM 0 H VAL A 51 106.008 -3.904 -11.453 1.00 1.00 H new ATOM 0 HA VAL A 51 106.698 -6.498 -10.191 1.00 1.00 H new ATOM 0 HB VAL A 51 107.639 -4.344 -9.076 1.00 1.00 H new ATOM 0 HG11 VAL A 51 106.076 -3.068 -7.687 1.00 1.00 H new ATOM 0 HG12 VAL A 51 105.720 -2.894 -9.422 1.00 1.00 H new ATOM 0 HG13 VAL A 51 104.712 -3.954 -8.409 1.00 1.00 H new ATOM 0 HG21 VAL A 51 107.028 -5.177 -6.811 1.00 1.00 H new ATOM 0 HG22 VAL A 51 105.723 -6.150 -7.532 1.00 1.00 H new ATOM 0 HG23 VAL A 51 107.422 -6.516 -7.915 1.00 1.00 H new ATOM 738 N THR A 52 104.312 -6.776 -9.268 1.00 1.00 N ATOM 739 CA THR A 52 102.893 -7.092 -9.091 1.00 1.00 C ATOM 740 C THR A 52 102.598 -7.152 -7.591 1.00 1.00 C ATOM 741 O THR A 52 103.236 -7.915 -6.867 1.00 1.00 O ATOM 742 CB THR A 52 102.594 -8.430 -9.761 1.00 1.00 C ATOM 743 OG1 THR A 52 102.828 -8.318 -11.156 1.00 1.00 O ATOM 744 CG2 THR A 52 101.149 -8.822 -9.518 1.00 1.00 C ATOM 0 H THR A 52 104.947 -7.364 -8.728 1.00 1.00 H new ATOM 0 HA THR A 52 102.262 -6.330 -9.548 1.00 1.00 H new ATOM 0 HB THR A 52 103.244 -9.196 -9.339 1.00 1.00 H new ATOM 0 HG1 THR A 52 102.639 -9.176 -11.589 1.00 1.00 H new ATOM 0 HG21 THR A 52 100.945 -9.778 -10.000 1.00 1.00 H new ATOM 0 HG22 THR A 52 100.971 -8.911 -8.446 1.00 1.00 H new ATOM 0 HG23 THR A 52 100.490 -8.059 -9.933 1.00 1.00 H new ATOM 752 N VAL A 53 101.681 -6.298 -7.108 1.00 1.00 N ATOM 753 CA VAL A 53 101.407 -6.238 -5.664 1.00 1.00 C ATOM 754 C VAL A 53 99.957 -5.858 -5.307 1.00 1.00 C ATOM 755 O VAL A 53 99.247 -5.261 -6.115 1.00 1.00 O ATOM 756 CB VAL A 53 102.305 -5.136 -5.090 1.00 1.00 C ATOM 757 CG1 VAL A 53 103.761 -5.376 -5.493 1.00 1.00 C ATOM 758 CG2 VAL A 53 101.865 -3.743 -5.641 1.00 1.00 C ATOM 0 H VAL A 53 101.130 -5.656 -7.678 1.00 1.00 H new ATOM 0 HA VAL A 53 101.589 -7.234 -5.260 1.00 1.00 H new ATOM 0 HB VAL A 53 102.213 -5.154 -4.004 1.00 1.00 H new ATOM 0 HG11 VAL A 53 104.388 -4.586 -5.079 1.00 1.00 H new ATOM 0 HG12 VAL A 53 104.091 -6.341 -5.108 1.00 1.00 H new ATOM 0 HG13 VAL A 53 103.843 -5.372 -6.580 1.00 1.00 H new ATOM 0 HG21 VAL A 53 102.510 -2.968 -5.227 1.00 1.00 H new ATOM 0 HG22 VAL A 53 101.946 -3.740 -6.728 1.00 1.00 H new ATOM 0 HG23 VAL A 53 100.832 -3.548 -5.353 1.00 1.00 H new ATOM 762 N GLU A 54 99.579 -6.097 -4.033 1.00 1.00 N ATOM 763 CA GLU A 54 98.254 -5.664 -3.518 1.00 1.00 C ATOM 764 C GLU A 54 98.543 -4.685 -2.374 1.00 1.00 C ATOM 765 O GLU A 54 99.566 -4.829 -1.703 1.00 1.00 O ATOM 766 CB GLU A 54 97.364 -6.812 -2.964 1.00 1.00 C ATOM 767 CG GLU A 54 97.472 -8.111 -3.792 1.00 1.00 C ATOM 768 CD GLU A 54 97.309 -9.355 -2.908 1.00 1.00 C ATOM 769 OE1 GLU A 54 97.476 -10.446 -3.426 1.00 1.00 O ATOM 770 OE2 GLU A 54 97.004 -9.202 -1.736 1.00 1.00 O ATOM 0 H GLU A 54 100.160 -6.580 -3.348 1.00 1.00 H new ATOM 0 HA GLU A 54 97.696 -5.234 -4.349 1.00 1.00 H new ATOM 0 HB2 GLU A 54 97.649 -7.020 -1.933 1.00 1.00 H new ATOM 0 HB3 GLU A 54 96.325 -6.483 -2.947 1.00 1.00 H new ATOM 0 HG2 GLU A 54 96.708 -8.113 -4.570 1.00 1.00 H new ATOM 0 HG3 GLU A 54 98.439 -8.144 -4.295 1.00 1.00 H new ATOM 777 N TYR A 55 97.712 -3.653 -2.159 1.00 1.00 N ATOM 778 CA TYR A 55 98.046 -2.694 -1.108 1.00 1.00 C ATOM 779 C TYR A 55 96.887 -1.806 -0.652 1.00 1.00 C ATOM 780 O TYR A 55 95.889 -1.642 -1.354 1.00 1.00 O ATOM 781 CB TYR A 55 99.096 -1.778 -1.699 1.00 1.00 C ATOM 782 CG TYR A 55 98.505 -1.242 -2.987 1.00 1.00 C ATOM 783 CD1 TYR A 55 97.720 -0.078 -2.984 1.00 1.00 C ATOM 784 CD2 TYR A 55 98.689 -1.951 -4.176 1.00 1.00 C ATOM 785 CE1 TYR A 55 97.127 0.377 -4.168 1.00 1.00 C ATOM 786 CE2 TYR A 55 98.102 -1.494 -5.359 1.00 1.00 C ATOM 787 CZ TYR A 55 97.320 -0.332 -5.357 1.00 1.00 C ATOM 788 OH TYR A 55 96.741 0.111 -6.529 1.00 1.00 O ATOM 0 H TYR A 55 96.849 -3.470 -2.671 1.00 1.00 H new ATOM 0 HA TYR A 55 98.361 -3.264 -0.234 1.00 1.00 H new ATOM 0 HB2 TYR A 55 99.337 -0.966 -1.013 1.00 1.00 H new ATOM 0 HB3 TYR A 55 100.023 -2.319 -1.890 1.00 1.00 H new ATOM 0 HD1 TYR A 55 97.573 0.469 -2.064 1.00 1.00 H new ATOM 0 HD2 TYR A 55 99.285 -2.852 -4.181 1.00 1.00 H new ATOM 0 HE1 TYR A 55 96.523 1.272 -4.163 1.00 1.00 H new ATOM 0 HE2 TYR A 55 98.252 -2.039 -6.279 1.00 1.00 H new ATOM 0 HH TYR A 55 95.799 -0.160 -6.551 1.00 1.00 H new ATOM 798 N THR A 56 97.091 -1.161 0.515 1.00 1.00 N ATOM 799 CA THR A 56 96.129 -0.193 1.058 1.00 1.00 C ATOM 800 C THR A 56 96.857 1.115 1.337 1.00 1.00 C ATOM 801 O THR A 56 97.902 1.116 1.959 1.00 1.00 O ATOM 802 CB THR A 56 95.388 -0.721 2.306 1.00 1.00 C ATOM 803 OG1 THR A 56 94.267 -1.481 1.884 1.00 1.00 O ATOM 804 CG2 THR A 56 94.877 0.432 3.187 1.00 1.00 C ATOM 0 H THR A 56 97.917 -1.297 1.097 1.00 1.00 H new ATOM 0 HA THR A 56 95.349 -0.024 0.316 1.00 1.00 H new ATOM 0 HB THR A 56 96.087 -1.325 2.885 1.00 1.00 H new ATOM 0 HG1 THR A 56 93.909 -1.985 2.644 1.00 1.00 H new ATOM 0 HG21 THR A 56 94.361 0.025 4.056 1.00 1.00 H new ATOM 0 HG22 THR A 56 95.720 1.039 3.517 1.00 1.00 H new ATOM 0 HG23 THR A 56 94.188 1.051 2.613 1.00 1.00 H new ATOM 812 N GLY A 57 96.307 2.229 0.867 1.00 1.00 N ATOM 813 CA GLY A 57 96.950 3.537 1.078 1.00 1.00 C ATOM 814 C GLY A 57 96.108 4.428 1.962 1.00 1.00 C ATOM 815 O GLY A 57 94.901 4.555 1.749 1.00 1.00 O ATOM 0 H GLY A 57 95.432 2.262 0.345 1.00 1.00 H new ATOM 0 HA2 GLY A 57 97.931 3.393 1.532 1.00 1.00 H new ATOM 0 HA3 GLY A 57 97.112 4.024 0.116 1.00 1.00 H new ATOM 819 N ARG A 58 96.731 5.061 2.965 1.00 1.00 N ATOM 820 CA ARG A 58 95.983 5.931 3.852 1.00 1.00 C ATOM 821 C ARG A 58 96.809 7.110 4.352 1.00 1.00 C ATOM 822 O ARG A 58 98.035 7.139 4.236 1.00 1.00 O ATOM 823 CB ARG A 58 95.436 5.121 5.036 1.00 1.00 C ATOM 824 CG ARG A 58 96.506 4.932 6.141 1.00 1.00 C ATOM 825 CD ARG A 58 95.866 4.321 7.387 1.00 1.00 C ATOM 826 NE ARG A 58 95.725 2.878 7.229 1.00 1.00 N ATOM 827 CZ ARG A 58 95.054 2.152 8.120 1.00 1.00 C ATOM 828 NH1 ARG A 58 94.460 2.741 9.121 1.00 1.00 N ATOM 829 NH2 ARG A 58 94.984 0.856 7.984 1.00 1.00 N ATOM 0 H ARG A 58 97.727 4.984 3.172 1.00 1.00 H new ATOM 0 HA ARG A 58 95.156 6.348 3.277 1.00 1.00 H new ATOM 0 HB2 ARG A 58 94.566 5.628 5.454 1.00 1.00 H new ATOM 0 HB3 ARG A 58 95.098 4.146 4.685 1.00 1.00 H new ATOM 0 HG2 ARG A 58 97.305 4.286 5.778 1.00 1.00 H new ATOM 0 HG3 ARG A 58 96.959 5.892 6.388 1.00 1.00 H new ATOM 0 HD2 ARG A 58 96.478 4.540 8.262 1.00 1.00 H new ATOM 0 HD3 ARG A 58 94.889 4.772 7.560 1.00 1.00 H new ATOM 0 HE ARG A 58 96.147 2.418 6.423 1.00 1.00 H new ATOM 0 HH11 ARG A 58 94.511 3.755 9.219 1.00 1.00 H new ATOM 0 HH12 ARG A 58 93.945 2.188 9.806 1.00 1.00 H new ATOM 0 HH21 ARG A 58 95.443 0.400 7.195 1.00 1.00 H new ATOM 0 HH22 ARG A 58 94.470 0.299 8.666 1.00 1.00 H new ATOM 843 N LEU A 59 96.100 8.058 4.946 1.00 1.00 N ATOM 844 CA LEU A 59 96.712 9.243 5.527 1.00 1.00 C ATOM 845 C LEU A 59 97.250 8.931 6.921 1.00 1.00 C ATOM 846 O LEU A 59 96.888 7.933 7.542 1.00 1.00 O ATOM 847 CB LEU A 59 95.658 10.364 5.639 1.00 1.00 C ATOM 848 CG LEU A 59 95.755 11.379 4.485 1.00 1.00 C ATOM 849 CD1 LEU A 59 95.125 10.804 3.224 1.00 1.00 C ATOM 850 CD2 LEU A 59 95.010 12.674 4.847 1.00 1.00 C ATOM 0 H LEU A 59 95.085 8.027 5.039 1.00 1.00 H new ATOM 0 HA LEU A 59 97.534 9.563 4.886 1.00 1.00 H new ATOM 0 HB2 LEU A 59 94.662 9.922 5.648 1.00 1.00 H new ATOM 0 HB3 LEU A 59 95.785 10.884 6.588 1.00 1.00 H new ATOM 0 HG LEU A 59 96.810 11.592 4.313 1.00 1.00 H new ATOM 0 HD11 LEU A 59 95.200 11.531 2.416 1.00 1.00 H new ATOM 0 HD12 LEU A 59 95.648 9.891 2.940 1.00 1.00 H new ATOM 0 HD13 LEU A 59 94.075 10.578 3.412 1.00 1.00 H new ATOM 0 HD21 LEU A 59 95.088 13.381 4.021 1.00 1.00 H new ATOM 0 HD22 LEU A 59 93.960 12.449 5.035 1.00 1.00 H new ATOM 0 HD23 LEU A 59 95.453 13.111 5.742 1.00 1.00 H new ATOM 862 N ILE A 60 98.089 9.828 7.404 1.00 1.00 N ATOM 863 CA ILE A 60 98.665 9.706 8.734 1.00 1.00 C ATOM 864 C ILE A 60 97.569 9.709 9.783 1.00 1.00 C ATOM 865 O ILE A 60 97.736 9.215 10.899 1.00 1.00 O ATOM 866 CB ILE A 60 99.623 10.884 9.015 1.00 1.00 C ATOM 867 CG1 ILE A 60 98.876 12.209 9.307 1.00 1.00 C ATOM 868 CG2 ILE A 60 100.562 11.107 7.832 1.00 1.00 C ATOM 869 CD1 ILE A 60 98.159 12.737 8.072 1.00 1.00 C ATOM 0 H ILE A 60 98.390 10.657 6.891 1.00 1.00 H new ATOM 0 HA ILE A 60 99.216 8.767 8.779 1.00 1.00 H new ATOM 0 HB ILE A 60 100.188 10.607 9.905 1.00 1.00 H new ATOM 0 HG12 ILE A 60 98.153 12.050 10.107 1.00 1.00 H new ATOM 0 HG13 ILE A 60 99.586 12.956 9.663 1.00 1.00 H new ATOM 0 HG21 ILE A 60 101.229 11.941 8.049 1.00 1.00 H new ATOM 0 HG22 ILE A 60 101.151 10.206 7.660 1.00 1.00 H new ATOM 0 HG23 ILE A 60 99.977 11.333 6.941 1.00 1.00 H new ATOM 0 HD11 ILE A 60 97.647 13.667 8.318 1.00 1.00 H new ATOM 0 HD12 ILE A 60 98.885 12.921 7.280 1.00 1.00 H new ATOM 0 HD13 ILE A 60 97.430 12.001 7.732 1.00 1.00 H new ATOM 876 N ASP A 61 96.472 10.338 9.411 1.00 1.00 N ATOM 877 CA ASP A 61 95.322 10.518 10.298 1.00 1.00 C ATOM 878 C ASP A 61 94.283 9.418 10.113 1.00 1.00 C ATOM 879 O ASP A 61 93.214 9.455 10.724 1.00 1.00 O ATOM 880 CB ASP A 61 94.694 11.885 10.012 1.00 1.00 C ATOM 881 CG ASP A 61 93.846 12.342 11.195 1.00 1.00 C ATOM 882 OD1 ASP A 61 94.201 13.344 11.795 1.00 1.00 O ATOM 883 OD2 ASP A 61 92.858 11.688 11.482 1.00 1.00 O ATOM 0 H ASP A 61 96.345 10.743 8.483 1.00 1.00 H new ATOM 0 HA ASP A 61 95.667 10.464 11.330 1.00 1.00 H new ATOM 0 HB2 ASP A 61 95.477 12.617 9.814 1.00 1.00 H new ATOM 0 HB3 ASP A 61 94.077 11.828 9.115 1.00 1.00 H new ATOM 888 N GLY A 62 94.603 8.431 9.289 1.00 1.00 N ATOM 889 CA GLY A 62 93.688 7.314 9.061 1.00 1.00 C ATOM 890 C GLY A 62 92.748 7.537 7.877 1.00 1.00 C ATOM 891 O GLY A 62 91.983 6.639 7.520 1.00 1.00 O ATOM 0 H GLY A 62 95.480 8.377 8.770 1.00 1.00 H new ATOM 0 HA2 GLY A 62 94.268 6.407 8.890 1.00 1.00 H new ATOM 0 HA3 GLY A 62 93.095 7.149 9.961 1.00 1.00 H new ATOM 895 N THR A 63 92.789 8.712 7.259 1.00 1.00 N ATOM 896 CA THR A 63 91.909 8.964 6.119 1.00 1.00 C ATOM 897 C THR A 63 92.357 8.139 4.923 1.00 1.00 C ATOM 898 O THR A 63 93.340 8.471 4.262 1.00 1.00 O ATOM 899 CB THR A 63 91.905 10.446 5.732 1.00 1.00 C ATOM 900 OG1 THR A 63 91.795 11.250 6.898 1.00 1.00 O ATOM 901 CG2 THR A 63 90.728 10.720 4.801 1.00 1.00 C ATOM 0 H THR A 63 93.402 9.486 7.516 1.00 1.00 H new ATOM 0 HA THR A 63 90.899 8.679 6.412 1.00 1.00 H new ATOM 0 HB THR A 63 92.837 10.690 5.222 1.00 1.00 H new ATOM 0 HG1 THR A 63 91.795 12.196 6.644 1.00 1.00 H new ATOM 0 HG21 THR A 63 90.722 11.774 4.523 1.00 1.00 H new ATOM 0 HG22 THR A 63 90.824 10.109 3.904 1.00 1.00 H new ATOM 0 HG23 THR A 63 89.796 10.473 5.310 1.00 1.00 H new ATOM 909 N VAL A 64 91.631 7.066 4.645 1.00 1.00 N ATOM 910 CA VAL A 64 91.971 6.213 3.518 1.00 1.00 C ATOM 911 C VAL A 64 91.562 6.874 2.228 1.00 1.00 C ATOM 912 O VAL A 64 90.417 7.297 2.068 1.00 1.00 O ATOM 913 CB VAL A 64 91.306 4.845 3.666 1.00 1.00 C ATOM 914 CG1 VAL A 64 91.666 3.938 2.484 1.00 1.00 C ATOM 915 CG2 VAL A 64 91.788 4.205 4.952 1.00 1.00 C ATOM 0 H VAL A 64 90.813 6.769 5.177 1.00 1.00 H new ATOM 0 HA VAL A 64 93.051 6.063 3.500 1.00 1.00 H new ATOM 0 HB VAL A 64 90.224 4.975 3.687 1.00 1.00 H new ATOM 0 HG11 VAL A 64 91.183 2.969 2.609 1.00 1.00 H new ATOM 0 HG12 VAL A 64 91.325 4.397 1.556 1.00 1.00 H new ATOM 0 HG13 VAL A 64 92.747 3.802 2.446 1.00 1.00 H new ATOM 0 HG21 VAL A 64 91.320 3.227 5.069 1.00 1.00 H new ATOM 0 HG22 VAL A 64 92.871 4.087 4.916 1.00 1.00 H new ATOM 0 HG23 VAL A 64 91.520 4.839 5.797 1.00 1.00 H new ATOM 919 N PHE A 65 92.515 6.953 1.297 1.00 1.00 N ATOM 920 CA PHE A 65 92.248 7.566 -0.002 1.00 1.00 C ATOM 921 C PHE A 65 92.379 6.549 -1.125 1.00 1.00 C ATOM 922 O PHE A 65 91.977 6.808 -2.258 1.00 1.00 O ATOM 923 CB PHE A 65 93.141 8.789 -0.228 1.00 1.00 C ATOM 924 CG PHE A 65 94.605 8.439 -0.354 1.00 1.00 C ATOM 925 CD1 PHE A 65 95.292 7.971 0.763 1.00 1.00 C ATOM 926 CD2 PHE A 65 95.284 8.633 -1.566 1.00 1.00 C ATOM 927 CE1 PHE A 65 96.659 7.691 0.681 1.00 1.00 C ATOM 928 CE2 PHE A 65 96.655 8.349 -1.651 1.00 1.00 C ATOM 929 CZ PHE A 65 97.339 7.881 -0.526 1.00 1.00 C ATOM 0 H PHE A 65 93.466 6.605 1.417 1.00 1.00 H new ATOM 0 HA PHE A 65 91.216 7.917 -0.006 1.00 1.00 H new ATOM 0 HB2 PHE A 65 92.818 9.305 -1.132 1.00 1.00 H new ATOM 0 HB3 PHE A 65 93.010 9.485 0.601 1.00 1.00 H new ATOM 0 HD1 PHE A 65 94.767 7.824 1.695 1.00 1.00 H new ATOM 0 HD2 PHE A 65 94.753 9.000 -2.432 1.00 1.00 H new ATOM 0 HE1 PHE A 65 97.189 7.328 1.549 1.00 1.00 H new ATOM 0 HE2 PHE A 65 97.181 8.492 -2.584 1.00 1.00 H new ATOM 0 HZ PHE A 65 98.395 7.666 -0.589 1.00 1.00 H new ATOM 939 N ASP A 66 92.905 5.374 -0.799 1.00 1.00 N ATOM 940 CA ASP A 66 93.026 4.314 -1.798 1.00 1.00 C ATOM 941 C ASP A 66 93.282 2.965 -1.155 1.00 1.00 C ATOM 942 O ASP A 66 93.846 2.878 -0.066 1.00 1.00 O ATOM 943 CB ASP A 66 94.146 4.626 -2.791 1.00 1.00 C ATOM 944 CG ASP A 66 93.978 3.772 -4.045 1.00 1.00 C ATOM 945 OD1 ASP A 66 94.422 2.636 -4.029 1.00 1.00 O ATOM 946 OD2 ASP A 66 93.402 4.264 -5.001 1.00 1.00 O ATOM 0 H ASP A 66 93.249 5.132 0.130 1.00 1.00 H new ATOM 0 HA ASP A 66 92.076 4.268 -2.330 1.00 1.00 H new ATOM 0 HB2 ASP A 66 94.126 5.683 -3.055 1.00 1.00 H new ATOM 0 HB3 ASP A 66 95.116 4.429 -2.333 1.00 1.00 H new ATOM 951 N SER A 67 92.872 1.904 -1.851 1.00 1.00 N ATOM 952 CA SER A 67 93.076 0.555 -1.348 1.00 1.00 C ATOM 953 C SER A 67 93.010 -0.482 -2.462 1.00 1.00 C ATOM 954 O SER A 67 92.437 -0.240 -3.526 1.00 1.00 O ATOM 955 CB SER A 67 92.058 0.233 -0.253 1.00 1.00 C ATOM 956 OG SER A 67 90.760 0.133 -0.824 1.00 1.00 O ATOM 0 H SER A 67 92.402 1.956 -2.755 1.00 1.00 H new ATOM 0 HA SER A 67 94.078 0.512 -0.922 1.00 1.00 H new ATOM 0 HB2 SER A 67 92.323 -0.702 0.240 1.00 1.00 H new ATOM 0 HB3 SER A 67 92.072 1.011 0.511 1.00 1.00 H new ATOM 0 HG SER A 67 90.109 -0.075 -0.122 1.00 1.00 H new ATOM 962 N THR A 68 93.618 -1.643 -2.200 1.00 1.00 N ATOM 963 CA THR A 68 93.651 -2.735 -3.174 1.00 1.00 C ATOM 964 C THR A 68 93.768 -4.073 -2.461 1.00 1.00 C ATOM 965 O THR A 68 93.128 -5.056 -2.841 1.00 1.00 O ATOM 966 CB THR A 68 94.857 -2.572 -4.099 1.00 1.00 C ATOM 967 OG1 THR A 68 94.727 -1.374 -4.849 1.00 1.00 O ATOM 968 CG2 THR A 68 94.947 -3.767 -5.049 1.00 1.00 C ATOM 0 H THR A 68 94.093 -1.850 -1.322 1.00 1.00 H new ATOM 0 HA THR A 68 92.728 -2.705 -3.753 1.00 1.00 H new ATOM 0 HB THR A 68 95.765 -2.523 -3.498 1.00 1.00 H new ATOM 0 HG1 THR A 68 95.500 -0.796 -4.678 1.00 1.00 H new ATOM 0 HG21 THR A 68 95.808 -3.646 -5.706 1.00 1.00 H new ATOM 0 HG22 THR A 68 95.058 -4.684 -4.471 1.00 1.00 H new ATOM 0 HG23 THR A 68 94.039 -3.824 -5.649 1.00 1.00 H new ATOM 976 N GLU A 69 94.591 -4.101 -1.423 1.00 1.00 N ATOM 977 CA GLU A 69 94.789 -5.319 -0.654 1.00 1.00 C ATOM 978 C GLU A 69 93.467 -5.764 -0.070 1.00 1.00 C ATOM 979 O GLU A 69 93.238 -6.954 0.146 1.00 1.00 O ATOM 980 CB GLU A 69 95.844 -5.118 0.424 1.00 1.00 C ATOM 981 CG GLU A 69 95.513 -3.928 1.309 1.00 1.00 C ATOM 982 CD GLU A 69 94.493 -4.305 2.384 1.00 1.00 C ATOM 983 OE1 GLU A 69 94.151 -3.442 3.176 1.00 1.00 O ATOM 984 OE2 GLU A 69 94.078 -5.449 2.409 1.00 1.00 O ATOM 0 H GLU A 69 95.129 -3.299 -1.096 1.00 1.00 H new ATOM 0 HA GLU A 69 95.158 -6.105 -1.313 1.00 1.00 H new ATOM 0 HB2 GLU A 69 95.918 -6.018 1.035 1.00 1.00 H new ATOM 0 HB3 GLU A 69 96.818 -4.967 -0.042 1.00 1.00 H new ATOM 0 HG2 GLU A 69 96.423 -3.558 1.781 1.00 1.00 H new ATOM 0 HG3 GLU A 69 95.118 -3.116 0.698 1.00 1.00 H new ATOM 991 N LYS A 70 92.583 -4.801 0.156 1.00 1.00 N ATOM 992 CA LYS A 70 91.272 -5.113 0.682 1.00 1.00 C ATOM 993 C LYS A 70 90.635 -6.129 -0.245 1.00 1.00 C ATOM 994 O LYS A 70 90.003 -7.093 0.185 1.00 1.00 O ATOM 995 CB LYS A 70 90.409 -3.854 0.719 1.00 1.00 C ATOM 996 CG LYS A 70 91.054 -2.818 1.638 1.00 1.00 C ATOM 997 CD LYS A 70 90.883 -3.206 3.139 1.00 1.00 C ATOM 998 CE LYS A 70 89.967 -2.213 3.866 1.00 1.00 C ATOM 999 NZ LYS A 70 90.358 -0.815 3.535 1.00 1.00 N ATOM 0 H LYS A 70 92.752 -3.810 -0.016 1.00 1.00 H new ATOM 0 HA LYS A 70 91.356 -5.507 1.695 1.00 1.00 H new ATOM 0 HB2 LYS A 70 90.300 -3.446 -0.286 1.00 1.00 H new ATOM 0 HB3 LYS A 70 89.408 -4.097 1.075 1.00 1.00 H new ATOM 0 HG2 LYS A 70 92.114 -2.730 1.402 1.00 1.00 H new ATOM 0 HG3 LYS A 70 90.605 -1.841 1.459 1.00 1.00 H new ATOM 0 HD2 LYS A 70 90.467 -4.211 3.213 1.00 1.00 H new ATOM 0 HD3 LYS A 70 91.858 -3.229 3.625 1.00 1.00 H new ATOM 0 HE2 LYS A 70 88.930 -2.386 3.578 1.00 1.00 H new ATOM 0 HE3 LYS A 70 90.030 -2.371 4.943 1.00 1.00 H new ATOM 0 HZ1 LYS A 70 90.150 -0.196 4.344 1.00 1.00 H new ATOM 0 HZ2 LYS A 70 91.376 -0.780 3.325 1.00 1.00 H new ATOM 0 HZ3 LYS A 70 89.821 -0.492 2.705 1.00 1.00 H new ATOM 1013 N THR A 71 90.855 -5.899 -1.529 1.00 1.00 N ATOM 1014 CA THR A 71 90.358 -6.785 -2.561 1.00 1.00 C ATOM 1015 C THR A 71 91.248 -8.029 -2.608 1.00 1.00 C ATOM 1016 O THR A 71 90.778 -9.137 -2.865 1.00 1.00 O ATOM 1017 CB THR A 71 90.376 -6.043 -3.917 1.00 1.00 C ATOM 1018 OG1 THR A 71 90.542 -4.655 -3.674 1.00 1.00 O ATOM 1019 CG2 THR A 71 89.061 -6.260 -4.675 1.00 1.00 C ATOM 0 H THR A 71 91.380 -5.098 -1.881 1.00 1.00 H new ATOM 0 HA THR A 71 89.334 -7.090 -2.347 1.00 1.00 H new ATOM 0 HB THR A 71 91.196 -6.432 -4.521 1.00 1.00 H new ATOM 0 HG1 THR A 71 91.486 -4.465 -3.494 1.00 1.00 H new ATOM 0 HG21 THR A 71 89.097 -5.728 -5.626 1.00 1.00 H new ATOM 0 HG22 THR A 71 88.919 -7.325 -4.860 1.00 1.00 H new ATOM 0 HG23 THR A 71 88.231 -5.881 -4.079 1.00 1.00 H new ATOM 1027 N GLY A 72 92.545 -7.821 -2.355 1.00 1.00 N ATOM 1028 CA GLY A 72 93.504 -8.913 -2.369 1.00 1.00 C ATOM 1029 C GLY A 72 93.936 -9.229 -3.789 1.00 1.00 C ATOM 1030 O GLY A 72 94.461 -10.308 -4.062 1.00 1.00 O ATOM 0 H GLY A 72 92.946 -6.908 -2.140 1.00 1.00 H new ATOM 0 HA2 GLY A 72 94.375 -8.647 -1.769 1.00 1.00 H new ATOM 0 HA3 GLY A 72 93.061 -9.798 -1.913 1.00 1.00 H new ATOM 1034 N LYS A 73 93.697 -8.284 -4.699 1.00 1.00 N ATOM 1035 CA LYS A 73 94.054 -8.481 -6.113 1.00 1.00 C ATOM 1036 C LYS A 73 95.294 -7.674 -6.474 1.00 1.00 C ATOM 1037 O LYS A 73 95.266 -6.446 -6.408 1.00 1.00 O ATOM 1038 CB LYS A 73 92.877 -8.047 -7.012 1.00 1.00 C ATOM 1039 CG LYS A 73 91.868 -9.190 -7.195 1.00 1.00 C ATOM 1040 CD LYS A 73 90.925 -9.256 -5.987 1.00 1.00 C ATOM 1041 CE LYS A 73 90.009 -10.481 -6.091 1.00 1.00 C ATOM 1042 NZ LYS A 73 90.770 -11.653 -6.608 1.00 1.00 N ATOM 0 H LYS A 73 93.264 -7.384 -4.491 1.00 1.00 H new ATOM 0 HA LYS A 73 94.268 -9.538 -6.271 1.00 1.00 H new ATOM 0 HB2 LYS A 73 92.378 -7.185 -6.571 1.00 1.00 H new ATOM 0 HB3 LYS A 73 93.255 -7.733 -7.985 1.00 1.00 H new ATOM 0 HG2 LYS A 73 91.293 -9.036 -8.108 1.00 1.00 H new ATOM 0 HG3 LYS A 73 92.395 -10.137 -7.307 1.00 1.00 H new ATOM 0 HD2 LYS A 73 91.506 -9.306 -5.066 1.00 1.00 H new ATOM 0 HD3 LYS A 73 90.324 -8.348 -5.936 1.00 1.00 H new ATOM 0 HE2 LYS A 73 89.590 -10.714 -5.112 1.00 1.00 H new ATOM 0 HE3 LYS A 73 89.171 -10.262 -6.753 1.00 1.00 H new ATOM 0 HZ1 LYS A 73 90.233 -12.524 -6.423 1.00 1.00 H new ATOM 0 HZ2 LYS A 73 90.916 -11.548 -7.632 1.00 1.00 H new ATOM 0 HZ3 LYS A 73 91.692 -11.706 -6.130 1.00 1.00 H new ATOM 1056 N PRO A 74 96.393 -8.317 -6.843 1.00 1.00 N ATOM 1057 CA PRO A 74 97.632 -7.585 -7.186 1.00 1.00 C ATOM 1058 C PRO A 74 97.463 -6.628 -8.359 1.00 1.00 C ATOM 1059 O PRO A 74 96.678 -6.864 -9.275 1.00 1.00 O ATOM 1060 CB PRO A 74 98.649 -8.684 -7.514 1.00 1.00 C ATOM 1061 CG PRO A 74 98.111 -9.903 -6.871 1.00 1.00 C ATOM 1062 CD PRO A 74 96.617 -9.777 -6.972 1.00 1.00 C ATOM 0 HA PRO A 74 97.945 -6.945 -6.361 1.00 1.00 H new ATOM 0 HB2 PRO A 74 98.753 -8.818 -8.591 1.00 1.00 H new ATOM 0 HB3 PRO A 74 99.637 -8.436 -7.127 1.00 1.00 H new ATOM 0 HG2 PRO A 74 98.465 -10.802 -7.375 1.00 1.00 H new ATOM 0 HG3 PRO A 74 98.431 -9.973 -5.831 1.00 1.00 H new ATOM 0 HD2 PRO A 74 96.244 -10.160 -7.922 1.00 1.00 H new ATOM 0 HD3 PRO A 74 96.111 -10.334 -6.183 1.00 1.00 H new ATOM 1070 N ALA A 75 98.248 -5.564 -8.316 1.00 1.00 N ATOM 1071 CA ALA A 75 98.255 -4.548 -9.370 1.00 1.00 C ATOM 1072 C ALA A 75 99.673 -4.433 -9.910 1.00 1.00 C ATOM 1073 O ALA A 75 100.626 -4.708 -9.181 1.00 1.00 O ATOM 1074 CB ALA A 75 97.794 -3.193 -8.818 1.00 1.00 C ATOM 0 H ALA A 75 98.899 -5.375 -7.554 1.00 1.00 H new ATOM 0 HA ALA A 75 97.568 -4.838 -10.165 1.00 1.00 H new ATOM 0 HB1 ALA A 75 97.806 -2.451 -9.617 1.00 1.00 H new ATOM 0 HB2 ALA A 75 96.782 -3.286 -8.424 1.00 1.00 H new ATOM 0 HB3 ALA A 75 98.466 -2.878 -8.020 1.00 1.00 H new ATOM 1080 N THR A 76 99.822 -4.055 -11.181 1.00 1.00 N ATOM 1081 CA THR A 76 101.156 -3.950 -11.776 1.00 1.00 C ATOM 1082 C THR A 76 101.611 -2.514 -11.971 1.00 1.00 C ATOM 1083 O THR A 76 100.934 -1.708 -12.611 1.00 1.00 O ATOM 1084 CB THR A 76 101.187 -4.673 -13.124 1.00 1.00 C ATOM 1085 OG1 THR A 76 102.356 -4.283 -13.837 1.00 1.00 O ATOM 1086 CG2 THR A 76 99.938 -4.325 -13.942 1.00 1.00 C ATOM 0 H THR A 76 99.052 -3.821 -11.808 1.00 1.00 H new ATOM 0 HA THR A 76 101.845 -4.418 -11.073 1.00 1.00 H new ATOM 0 HB THR A 76 101.202 -5.750 -12.954 1.00 1.00 H new ATOM 0 HG1 THR A 76 102.381 -4.745 -14.701 1.00 1.00 H new ATOM 0 HG21 THR A 76 99.973 -4.846 -14.899 1.00 1.00 H new ATOM 0 HG22 THR A 76 99.047 -4.632 -13.394 1.00 1.00 H new ATOM 0 HG23 THR A 76 99.905 -3.249 -14.116 1.00 1.00 H new ATOM 1094 N PHE A 77 102.806 -2.222 -11.452 1.00 1.00 N ATOM 1095 CA PHE A 77 103.411 -0.907 -11.608 1.00 1.00 C ATOM 1096 C PHE A 77 104.846 -1.075 -12.006 1.00 1.00 C ATOM 1097 O PHE A 77 105.522 -2.006 -11.575 1.00 1.00 O ATOM 1098 CB PHE A 77 103.459 -0.091 -10.311 1.00 1.00 C ATOM 1099 CG PHE A 77 102.105 -0.002 -9.676 1.00 1.00 C ATOM 1100 CD1 PHE A 77 101.870 -0.695 -8.492 1.00 1.00 C ATOM 1101 CD2 PHE A 77 101.088 0.753 -10.276 1.00 1.00 C ATOM 1102 CE1 PHE A 77 100.616 -0.647 -7.890 1.00 1.00 C ATOM 1103 CE2 PHE A 77 99.826 0.810 -9.670 1.00 1.00 C ATOM 1104 CZ PHE A 77 99.588 0.105 -8.476 1.00 1.00 C ATOM 0 H PHE A 77 103.371 -2.884 -10.920 1.00 1.00 H new ATOM 0 HA PHE A 77 102.797 -0.389 -12.345 1.00 1.00 H new ATOM 0 HB2 PHE A 77 104.160 -0.551 -9.615 1.00 1.00 H new ATOM 0 HB3 PHE A 77 103.831 0.912 -10.523 1.00 1.00 H new ATOM 0 HD1 PHE A 77 102.663 -1.272 -8.039 1.00 1.00 H new ATOM 0 HD2 PHE A 77 101.275 1.286 -11.197 1.00 1.00 H new ATOM 0 HE1 PHE A 77 100.435 -1.188 -6.973 1.00 1.00 H new ATOM 0 HE2 PHE A 77 99.037 1.395 -10.119 1.00 1.00 H new ATOM 0 HZ PHE A 77 98.614 0.143 -8.011 1.00 1.00 H new ATOM 1114 N GLN A 78 105.334 -0.121 -12.742 1.00 1.00 N ATOM 1115 CA GLN A 78 106.731 -0.111 -13.099 1.00 1.00 C ATOM 1116 C GLN A 78 107.440 0.666 -12.018 1.00 1.00 C ATOM 1117 O GLN A 78 107.050 1.788 -11.699 1.00 1.00 O ATOM 1118 CB GLN A 78 106.941 0.525 -14.467 1.00 1.00 C ATOM 1119 CG GLN A 78 106.565 -0.474 -15.553 1.00 1.00 C ATOM 1120 CD GLN A 78 106.967 0.073 -16.913 1.00 1.00 C ATOM 1121 OE1 GLN A 78 106.732 -0.560 -17.941 1.00 1.00 O ATOM 1122 NE2 GLN A 78 107.582 1.215 -16.964 1.00 1.00 N ATOM 0 H GLN A 78 104.791 0.661 -13.109 1.00 1.00 H new ATOM 0 HA GLN A 78 107.126 -1.124 -13.171 1.00 1.00 H new ATOM 0 HB2 GLN A 78 106.333 1.425 -14.559 1.00 1.00 H new ATOM 0 HB3 GLN A 78 107.981 0.830 -14.583 1.00 1.00 H new ATOM 0 HG2 GLN A 78 107.062 -1.427 -15.372 1.00 1.00 H new ATOM 0 HG3 GLN A 78 105.492 -0.665 -15.530 1.00 1.00 H new ATOM 0 HE21 GLN A 78 107.771 1.731 -16.105 1.00 1.00 H new ATOM 0 HE22 GLN A 78 107.876 1.596 -17.863 1.00 1.00 H new ATOM 1131 N VAL A 79 108.442 0.056 -11.413 1.00 1.00 N ATOM 1132 CA VAL A 79 109.135 0.707 -10.327 1.00 1.00 C ATOM 1133 C VAL A 79 109.506 2.134 -10.719 1.00 1.00 C ATOM 1134 O VAL A 79 109.575 3.010 -9.864 1.00 1.00 O ATOM 1135 CB VAL A 79 110.408 -0.067 -9.948 1.00 1.00 C ATOM 1136 CG1 VAL A 79 111.027 0.539 -8.705 1.00 1.00 C ATOM 1137 CG2 VAL A 79 110.084 -1.520 -9.637 1.00 1.00 C ATOM 0 H VAL A 79 108.787 -0.874 -11.652 1.00 1.00 H new ATOM 0 HA VAL A 79 108.467 0.729 -9.466 1.00 1.00 H new ATOM 0 HB VAL A 79 111.095 -0.011 -10.793 1.00 1.00 H new ATOM 0 HG11 VAL A 79 111.929 -0.014 -8.441 1.00 1.00 H new ATOM 0 HG12 VAL A 79 111.283 1.581 -8.897 1.00 1.00 H new ATOM 0 HG13 VAL A 79 110.315 0.486 -7.881 1.00 1.00 H new ATOM 0 HG21 VAL A 79 111.000 -2.048 -9.371 1.00 1.00 H new ATOM 0 HG22 VAL A 79 109.384 -1.566 -8.803 1.00 1.00 H new ATOM 0 HG23 VAL A 79 109.636 -1.989 -10.513 1.00 1.00 H new ATOM 1141 N SER A 80 109.748 2.371 -12.011 1.00 1.00 N ATOM 1142 CA SER A 80 110.126 3.705 -12.454 1.00 1.00 C ATOM 1143 C SER A 80 108.936 4.648 -12.473 1.00 1.00 C ATOM 1144 O SER A 80 109.094 5.865 -12.403 1.00 1.00 O ATOM 1145 CB SER A 80 110.729 3.645 -13.854 1.00 1.00 C ATOM 1146 OG SER A 80 110.710 4.947 -14.429 1.00 1.00 O ATOM 0 H SER A 80 109.690 1.671 -12.750 1.00 1.00 H new ATOM 0 HA SER A 80 110.861 4.085 -11.744 1.00 1.00 H new ATOM 0 HB2 SER A 80 111.752 3.270 -13.807 1.00 1.00 H new ATOM 0 HB3 SER A 80 110.164 2.951 -14.477 1.00 1.00 H new ATOM 0 HG SER A 80 111.098 4.913 -15.328 1.00 1.00 H new ATOM 1152 N GLN A 81 107.748 4.079 -12.611 1.00 1.00 N ATOM 1153 CA GLN A 81 106.528 4.880 -12.689 1.00 1.00 C ATOM 1154 C GLN A 81 105.767 4.971 -11.355 1.00 1.00 C ATOM 1155 O GLN A 81 104.795 5.723 -11.266 1.00 1.00 O ATOM 1156 CB GLN A 81 105.590 4.265 -13.725 1.00 1.00 C ATOM 1157 CG GLN A 81 106.244 4.167 -15.100 1.00 1.00 C ATOM 1158 CD GLN A 81 106.788 5.523 -15.536 1.00 1.00 C ATOM 1159 OE1 GLN A 81 106.054 6.510 -15.565 1.00 1.00 O ATOM 1160 NE2 GLN A 81 108.047 5.631 -15.858 1.00 1.00 N ATOM 0 H GLN A 81 107.599 3.072 -12.671 1.00 1.00 H new ATOM 0 HA GLN A 81 106.838 5.888 -12.963 1.00 1.00 H new ATOM 0 HB2 GLN A 81 105.287 3.271 -13.396 1.00 1.00 H new ATOM 0 HB3 GLN A 81 104.684 4.867 -13.796 1.00 1.00 H new ATOM 0 HG2 GLN A 81 107.053 3.437 -15.072 1.00 1.00 H new ATOM 0 HG3 GLN A 81 105.517 3.810 -15.829 1.00 1.00 H new ATOM 0 HE21 GLN A 81 108.652 4.810 -15.833 1.00 1.00 H new ATOM 0 HE22 GLN A 81 108.427 6.536 -16.135 1.00 1.00 H new ATOM 1169 N VAL A 82 106.166 4.209 -10.329 1.00 1.00 N ATOM 1170 CA VAL A 82 105.432 4.247 -9.045 1.00 1.00 C ATOM 1171 C VAL A 82 105.964 5.342 -8.112 1.00 1.00 C ATOM 1172 O VAL A 82 106.968 5.982 -8.417 1.00 1.00 O ATOM 1173 CB VAL A 82 105.448 2.846 -8.421 1.00 1.00 C ATOM 1174 CG1 VAL A 82 106.764 2.591 -7.771 1.00 1.00 C ATOM 1175 CG2 VAL A 82 104.376 2.688 -7.396 1.00 1.00 C ATOM 0 H VAL A 82 106.966 3.576 -10.352 1.00 1.00 H new ATOM 0 HA VAL A 82 104.392 4.521 -9.224 1.00 1.00 H new ATOM 0 HB VAL A 82 105.275 2.131 -9.226 1.00 1.00 H new ATOM 0 HG11 VAL A 82 106.765 1.594 -7.331 1.00 1.00 H new ATOM 0 HG12 VAL A 82 107.557 2.660 -8.516 1.00 1.00 H new ATOM 0 HG13 VAL A 82 106.934 3.332 -6.990 1.00 1.00 H new ATOM 0 HG21 VAL A 82 104.419 1.683 -6.976 1.00 1.00 H new ATOM 0 HG22 VAL A 82 104.522 3.420 -6.601 1.00 1.00 H new ATOM 0 HG23 VAL A 82 103.403 2.846 -7.860 1.00 1.00 H new ATOM 1179 N ILE A 83 105.254 5.605 -6.999 1.00 1.00 N ATOM 1180 CA ILE A 83 105.665 6.690 -6.098 1.00 1.00 C ATOM 1181 C ILE A 83 107.150 6.506 -5.707 1.00 1.00 C ATOM 1182 O ILE A 83 107.628 5.374 -5.624 1.00 1.00 O ATOM 1183 CB ILE A 83 104.756 6.746 -4.820 1.00 1.00 C ATOM 1184 CG1 ILE A 83 103.710 5.640 -4.879 1.00 1.00 C ATOM 1185 CG2 ILE A 83 104.026 8.101 -4.724 1.00 1.00 C ATOM 1186 CD1 ILE A 83 102.884 5.635 -3.600 1.00 1.00 C ATOM 0 H ILE A 83 104.418 5.097 -6.710 1.00 1.00 H new ATOM 0 HA ILE A 83 105.548 7.639 -6.622 1.00 1.00 H new ATOM 0 HB ILE A 83 105.397 6.617 -3.948 1.00 1.00 H new ATOM 0 HG12 ILE A 83 103.060 5.789 -5.741 1.00 1.00 H new ATOM 0 HG13 ILE A 83 104.197 4.674 -5.011 1.00 1.00 H new ATOM 0 HG21 ILE A 83 103.402 8.116 -3.830 1.00 1.00 H new ATOM 0 HG22 ILE A 83 104.759 8.906 -4.668 1.00 1.00 H new ATOM 0 HG23 ILE A 83 103.400 8.240 -5.605 1.00 1.00 H new ATOM 0 HD11 ILE A 83 102.139 4.841 -3.651 1.00 1.00 H new ATOM 0 HD12 ILE A 83 103.538 5.464 -2.745 1.00 1.00 H new ATOM 0 HD13 ILE A 83 102.383 6.596 -3.487 1.00 1.00 H new ATOM 1193 N PRO A 84 107.890 7.582 -5.467 1.00 1.00 N ATOM 1194 CA PRO A 84 109.337 7.489 -5.085 1.00 1.00 C ATOM 1195 C PRO A 84 109.591 6.527 -3.933 1.00 1.00 C ATOM 1196 O PRO A 84 110.538 5.745 -3.956 1.00 1.00 O ATOM 1197 CB PRO A 84 109.684 8.914 -4.640 1.00 1.00 C ATOM 1198 CG PRO A 84 108.744 9.794 -5.380 1.00 1.00 C ATOM 1199 CD PRO A 84 107.453 8.993 -5.536 1.00 1.00 C ATOM 0 HA PRO A 84 109.936 7.112 -5.914 1.00 1.00 H new ATOM 0 HB2 PRO A 84 109.566 9.030 -3.563 1.00 1.00 H new ATOM 0 HB3 PRO A 84 110.720 9.159 -4.875 1.00 1.00 H new ATOM 0 HG2 PRO A 84 108.565 10.720 -4.834 1.00 1.00 H new ATOM 0 HG3 PRO A 84 109.152 10.071 -6.352 1.00 1.00 H new ATOM 0 HD2 PRO A 84 106.741 9.228 -4.745 1.00 1.00 H new ATOM 0 HD3 PRO A 84 106.961 9.211 -6.484 1.00 1.00 H new ATOM 1207 N GLY A 85 108.756 6.607 -2.913 1.00 1.00 N ATOM 1208 CA GLY A 85 108.939 5.739 -1.761 1.00 1.00 C ATOM 1209 C GLY A 85 108.884 4.294 -2.195 1.00 1.00 C ATOM 1210 O GLY A 85 109.736 3.475 -1.847 1.00 1.00 O ATOM 0 H GLY A 85 107.963 7.246 -2.856 1.00 1.00 H new ATOM 0 HA2 GLY A 85 109.897 5.949 -1.285 1.00 1.00 H new ATOM 0 HA3 GLY A 85 108.164 5.935 -1.020 1.00 1.00 H new ATOM 1214 N TRP A 86 107.872 4.017 -2.981 1.00 1.00 N ATOM 1215 CA TRP A 86 107.651 2.692 -3.529 1.00 1.00 C ATOM 1216 C TRP A 86 108.805 2.307 -4.458 1.00 1.00 C ATOM 1217 O TRP A 86 109.199 1.146 -4.525 1.00 1.00 O ATOM 1218 CB TRP A 86 106.351 2.714 -4.338 1.00 1.00 C ATOM 1219 CG TRP A 86 105.142 2.443 -3.500 1.00 1.00 C ATOM 1220 CD1 TRP A 86 104.637 3.214 -2.511 1.00 1.00 C ATOM 1221 CD2 TRP A 86 104.258 1.318 -3.615 1.00 1.00 C ATOM 1222 NE1 TRP A 86 103.489 2.620 -2.023 1.00 1.00 N ATOM 1223 CE2 TRP A 86 103.220 1.446 -2.675 1.00 1.00 C ATOM 1224 CE3 TRP A 86 104.267 0.206 -4.445 1.00 1.00 C ATOM 1225 CZ2 TRP A 86 102.222 0.496 -2.569 1.00 1.00 C ATOM 1226 CZ3 TRP A 86 103.266 -0.755 -4.340 1.00 1.00 C ATOM 1227 CH2 TRP A 86 102.242 -0.612 -3.404 1.00 1.00 C ATOM 0 H TRP A 86 107.173 4.704 -3.262 1.00 1.00 H new ATOM 0 HA TRP A 86 107.590 1.967 -2.717 1.00 1.00 H new ATOM 0 HB2 TRP A 86 106.244 3.687 -4.818 1.00 1.00 H new ATOM 0 HB3 TRP A 86 106.411 1.971 -5.133 1.00 1.00 H new ATOM 0 HD1 TRP A 86 105.062 4.143 -2.160 1.00 1.00 H new ATOM 0 HE1 TRP A 86 102.915 3.006 -1.273 1.00 1.00 H new ATOM 0 HE3 TRP A 86 105.054 0.086 -5.175 1.00 1.00 H new ATOM 0 HZ2 TRP A 86 101.432 0.615 -1.842 1.00 1.00 H new ATOM 0 HZ3 TRP A 86 103.282 -1.618 -4.989 1.00 1.00 H new ATOM 0 HH2 TRP A 86 101.467 -1.361 -3.329 1.00 1.00 H new ATOM 1238 N THR A 87 109.315 3.285 -5.198 1.00 1.00 N ATOM 1239 CA THR A 87 110.380 3.024 -6.148 1.00 1.00 C ATOM 1240 C THR A 87 111.523 2.262 -5.492 1.00 1.00 C ATOM 1241 O THR A 87 111.937 1.214 -5.978 1.00 1.00 O ATOM 1242 CB THR A 87 110.908 4.359 -6.683 1.00 1.00 C ATOM 1243 OG1 THR A 87 109.814 5.159 -7.112 1.00 1.00 O ATOM 1244 CG2 THR A 87 111.862 4.121 -7.850 1.00 1.00 C ATOM 0 H THR A 87 109.009 4.257 -5.157 1.00 1.00 H new ATOM 0 HA THR A 87 109.981 2.416 -6.960 1.00 1.00 H new ATOM 0 HB THR A 87 111.449 4.873 -5.889 1.00 1.00 H new ATOM 0 HG1 THR A 87 108.996 4.863 -6.661 1.00 1.00 H new ATOM 0 HG21 THR A 87 112.230 5.078 -8.220 1.00 1.00 H new ATOM 0 HG22 THR A 87 112.703 3.514 -7.514 1.00 1.00 H new ATOM 0 HG23 THR A 87 111.336 3.600 -8.650 1.00 1.00 H new ATOM 1252 N GLU A 88 112.034 2.800 -4.401 1.00 1.00 N ATOM 1253 CA GLU A 88 113.139 2.164 -3.699 1.00 1.00 C ATOM 1254 C GLU A 88 112.707 0.905 -2.943 1.00 1.00 C ATOM 1255 O GLU A 88 113.420 -0.092 -2.934 1.00 1.00 O ATOM 1256 CB GLU A 88 113.769 3.158 -2.727 1.00 1.00 C ATOM 1257 CG GLU A 88 115.157 2.660 -2.310 1.00 1.00 C ATOM 1258 CD GLU A 88 116.129 2.815 -3.473 1.00 1.00 C ATOM 1259 OE1 GLU A 88 115.736 3.391 -4.474 1.00 1.00 O ATOM 1260 OE2 GLU A 88 117.254 2.362 -3.347 1.00 1.00 O ATOM 0 H GLU A 88 111.706 3.670 -3.982 1.00 1.00 H new ATOM 0 HA GLU A 88 113.867 1.856 -4.450 1.00 1.00 H new ATOM 0 HB2 GLU A 88 113.849 4.139 -3.195 1.00 1.00 H new ATOM 0 HB3 GLU A 88 113.134 3.275 -1.849 1.00 1.00 H new ATOM 0 HG2 GLU A 88 115.513 3.225 -1.448 1.00 1.00 H new ATOM 0 HG3 GLU A 88 115.103 1.615 -2.006 1.00 1.00 H new ATOM 1267 N ALA A 89 111.562 0.977 -2.277 1.00 1.00 N ATOM 1268 CA ALA A 89 111.071 -0.144 -1.472 1.00 1.00 C ATOM 1269 C ALA A 89 110.922 -1.446 -2.263 1.00 1.00 C ATOM 1270 O ALA A 89 111.338 -2.504 -1.794 1.00 1.00 O ATOM 1271 CB ALA A 89 109.716 0.212 -0.874 1.00 1.00 C ATOM 0 H ALA A 89 110.954 1.796 -2.275 1.00 1.00 H new ATOM 0 HA ALA A 89 111.819 -0.314 -0.698 1.00 1.00 H new ATOM 0 HB1 ALA A 89 109.352 -0.623 -0.275 1.00 1.00 H new ATOM 0 HB2 ALA A 89 109.818 1.094 -0.242 1.00 1.00 H new ATOM 0 HB3 ALA A 89 109.008 0.420 -1.676 1.00 1.00 H new ATOM 1277 N LEU A 90 110.308 -1.383 -3.437 1.00 1.00 N ATOM 1278 CA LEU A 90 110.099 -2.591 -4.230 1.00 1.00 C ATOM 1279 C LEU A 90 111.430 -3.257 -4.521 1.00 1.00 C ATOM 1280 O LEU A 90 111.559 -4.480 -4.474 1.00 1.00 O ATOM 1281 CB LEU A 90 109.435 -2.241 -5.555 1.00 1.00 C ATOM 1282 CG LEU A 90 108.042 -1.662 -5.311 1.00 1.00 C ATOM 1283 CD1 LEU A 90 107.532 -1.074 -6.621 1.00 1.00 C ATOM 1284 CD2 LEU A 90 107.083 -2.744 -4.801 1.00 1.00 C ATOM 0 H LEU A 90 109.951 -0.525 -3.857 1.00 1.00 H new ATOM 0 HA LEU A 90 109.459 -3.267 -3.663 1.00 1.00 H new ATOM 0 HB2 LEU A 90 110.047 -1.520 -6.097 1.00 1.00 H new ATOM 0 HB3 LEU A 90 109.362 -3.131 -6.180 1.00 1.00 H new ATOM 0 HG LEU A 90 108.096 -0.886 -4.548 1.00 1.00 H new ATOM 0 HD11 LEU A 90 106.537 -0.655 -6.469 1.00 1.00 H new ATOM 0 HD12 LEU A 90 108.210 -0.289 -6.955 1.00 1.00 H new ATOM 0 HD13 LEU A 90 107.484 -1.858 -7.377 1.00 1.00 H new ATOM 0 HD21 LEU A 90 106.098 -2.308 -4.635 1.00 1.00 H new ATOM 0 HD22 LEU A 90 107.007 -3.541 -5.541 1.00 1.00 H new ATOM 0 HD23 LEU A 90 107.461 -3.154 -3.864 1.00 1.00 H new ATOM 1296 N GLN A 91 112.416 -2.434 -4.835 1.00 1.00 N ATOM 1297 CA GLN A 91 113.741 -2.918 -5.152 1.00 1.00 C ATOM 1298 C GLN A 91 114.383 -3.595 -3.944 1.00 1.00 C ATOM 1299 O GLN A 91 115.288 -4.416 -4.094 1.00 1.00 O ATOM 1300 CB GLN A 91 114.612 -1.749 -5.592 1.00 1.00 C ATOM 1301 CG GLN A 91 113.960 -1.036 -6.778 1.00 1.00 C ATOM 1302 CD GLN A 91 114.706 0.261 -7.066 1.00 1.00 C ATOM 1303 OE1 GLN A 91 115.882 0.388 -6.739 1.00 1.00 O ATOM 1304 NE2 GLN A 91 114.074 1.255 -7.620 1.00 1.00 N ATOM 0 H GLN A 91 112.318 -1.420 -4.876 1.00 1.00 H new ATOM 0 HA GLN A 91 113.656 -3.651 -5.955 1.00 1.00 H new ATOM 0 HB2 GLN A 91 114.746 -1.052 -4.765 1.00 1.00 H new ATOM 0 HB3 GLN A 91 115.603 -2.107 -5.871 1.00 1.00 H new ATOM 0 HG2 GLN A 91 113.977 -1.680 -7.657 1.00 1.00 H new ATOM 0 HG3 GLN A 91 112.914 -0.825 -6.558 1.00 1.00 H new ATOM 0 HE21 GLN A 91 113.097 1.150 -7.892 1.00 1.00 H new ATOM 0 HE22 GLN A 91 114.556 2.139 -7.782 1.00 1.00 H new ATOM 1313 N LEU A 92 113.924 -3.233 -2.745 1.00 1.00 N ATOM 1314 CA LEU A 92 114.479 -3.807 -1.512 1.00 1.00 C ATOM 1315 C LEU A 92 113.527 -4.814 -0.904 1.00 1.00 C ATOM 1316 O LEU A 92 113.894 -5.541 0.012 1.00 1.00 O ATOM 1317 CB LEU A 92 114.718 -2.700 -0.484 1.00 1.00 C ATOM 1318 CG LEU A 92 115.596 -1.595 -1.071 1.00 1.00 C ATOM 1319 CD1 LEU A 92 115.663 -0.445 -0.083 1.00 1.00 C ATOM 1320 CD2 LEU A 92 116.998 -2.118 -1.341 1.00 1.00 C ATOM 0 H LEU A 92 113.178 -2.553 -2.599 1.00 1.00 H new ATOM 0 HA LEU A 92 115.415 -4.301 -1.770 1.00 1.00 H new ATOM 0 HB2 LEU A 92 113.763 -2.281 -0.165 1.00 1.00 H new ATOM 0 HB3 LEU A 92 115.195 -3.118 0.403 1.00 1.00 H new ATOM 0 HG LEU A 92 115.166 -1.255 -2.013 1.00 1.00 H new ATOM 0 HD11 LEU A 92 116.287 0.350 -0.491 1.00 1.00 H new ATOM 0 HD12 LEU A 92 114.659 -0.061 0.097 1.00 1.00 H new ATOM 0 HD13 LEU A 92 116.091 -0.796 0.856 1.00 1.00 H new ATOM 0 HD21 LEU A 92 117.610 -1.319 -1.759 1.00 1.00 H new ATOM 0 HD22 LEU A 92 117.442 -2.466 -0.409 1.00 1.00 H new ATOM 0 HD23 LEU A 92 116.948 -2.945 -2.050 1.00 1.00 H new ATOM 1332 N MET A 93 112.304 -4.828 -1.401 1.00 1.00 N ATOM 1333 CA MET A 93 111.272 -5.722 -0.889 1.00 1.00 C ATOM 1334 C MET A 93 111.280 -7.085 -1.612 1.00 1.00 C ATOM 1335 O MET A 93 110.878 -7.160 -2.772 1.00 1.00 O ATOM 1336 CB MET A 93 109.941 -5.013 -1.097 1.00 1.00 C ATOM 1337 CG MET A 93 108.789 -5.799 -0.474 1.00 1.00 C ATOM 1338 SD MET A 93 107.194 -5.121 -1.029 1.00 1.00 S ATOM 1339 CE MET A 93 107.572 -3.345 -0.997 1.00 1.00 C ATOM 0 H MET A 93 111.996 -4.227 -2.165 1.00 1.00 H new ATOM 0 HA MET A 93 111.450 -5.937 0.165 1.00 1.00 H new ATOM 0 HB2 MET A 93 109.985 -4.017 -0.656 1.00 1.00 H new ATOM 0 HB3 MET A 93 109.759 -4.882 -2.164 1.00 1.00 H new ATOM 0 HG2 MET A 93 108.863 -6.850 -0.754 1.00 1.00 H new ATOM 0 HG3 MET A 93 108.854 -5.753 0.613 1.00 1.00 H new ATOM 0 HE1 MET A 93 106.663 -2.776 -1.191 1.00 1.00 H new ATOM 0 HE2 MET A 93 107.967 -3.075 -0.018 1.00 1.00 H new ATOM 0 HE3 MET A 93 108.313 -3.117 -1.763 1.00 1.00 H new ATOM 1349 N PRO A 94 111.712 -8.165 -0.965 1.00 1.00 N ATOM 1350 CA PRO A 94 111.743 -9.528 -1.588 1.00 1.00 C ATOM 1351 C PRO A 94 110.355 -10.078 -1.908 1.00 1.00 C ATOM 1352 O PRO A 94 109.375 -9.776 -1.229 1.00 1.00 O ATOM 1353 CB PRO A 94 112.456 -10.403 -0.541 1.00 1.00 C ATOM 1354 CG PRO A 94 113.108 -9.457 0.405 1.00 1.00 C ATOM 1355 CD PRO A 94 112.220 -8.236 0.418 1.00 1.00 C ATOM 0 HA PRO A 94 112.251 -9.507 -2.552 1.00 1.00 H new ATOM 0 HB2 PRO A 94 111.746 -11.047 -0.022 1.00 1.00 H new ATOM 0 HB3 PRO A 94 113.192 -11.054 -1.012 1.00 1.00 H new ATOM 0 HG2 PRO A 94 113.194 -9.892 1.401 1.00 1.00 H new ATOM 0 HG3 PRO A 94 114.117 -9.207 0.079 1.00 1.00 H new ATOM 0 HD2 PRO A 94 111.409 -8.337 1.139 1.00 1.00 H new ATOM 0 HD3 PRO A 94 112.776 -7.338 0.688 1.00 1.00 H new ATOM 1363 N ALA A 95 110.287 -10.886 -2.957 1.00 1.00 N ATOM 1364 CA ALA A 95 109.024 -11.475 -3.367 1.00 1.00 C ATOM 1365 C ALA A 95 108.490 -12.420 -2.315 1.00 1.00 C ATOM 1366 O ALA A 95 109.214 -13.254 -1.770 1.00 1.00 O ATOM 1367 CB ALA A 95 109.163 -12.192 -4.702 1.00 1.00 C ATOM 0 H ALA A 95 111.086 -11.146 -3.535 1.00 1.00 H new ATOM 0 HA ALA A 95 108.309 -10.661 -3.486 1.00 1.00 H new ATOM 0 HB1 ALA A 95 108.203 -12.624 -4.985 1.00 1.00 H new ATOM 0 HB2 ALA A 95 109.481 -11.482 -5.465 1.00 1.00 H new ATOM 0 HB3 ALA A 95 109.905 -12.985 -4.613 1.00 1.00 H new ATOM 1373 N GLY A 96 107.204 -12.262 -2.030 1.00 1.00 N ATOM 1374 CA GLY A 96 106.538 -13.073 -1.037 1.00 1.00 C ATOM 1375 C GLY A 96 106.570 -12.367 0.303 1.00 1.00 C ATOM 1376 O GLY A 96 105.773 -12.669 1.193 1.00 1.00 O ATOM 0 H GLY A 96 106.603 -11.572 -2.480 1.00 1.00 H new ATOM 0 HA2 GLY A 96 105.507 -13.258 -1.337 1.00 1.00 H new ATOM 0 HA3 GLY A 96 107.027 -14.044 -0.959 1.00 1.00 H new ATOM 1380 N SER A 97 107.486 -11.403 0.440 1.00 1.00 N ATOM 1381 CA SER A 97 107.592 -10.649 1.676 1.00 1.00 C ATOM 1382 C SER A 97 106.592 -9.506 1.673 1.00 1.00 C ATOM 1383 O SER A 97 106.562 -8.693 0.749 1.00 1.00 O ATOM 1384 CB SER A 97 109.013 -10.103 1.833 1.00 1.00 C ATOM 1385 OG SER A 97 109.150 -9.490 3.110 1.00 1.00 O ATOM 0 H SER A 97 108.153 -11.135 -0.284 1.00 1.00 H new ATOM 0 HA SER A 97 107.372 -11.309 2.515 1.00 1.00 H new ATOM 0 HB2 SER A 97 109.738 -10.910 1.726 1.00 1.00 H new ATOM 0 HB3 SER A 97 109.224 -9.379 1.046 1.00 1.00 H new ATOM 0 HG SER A 97 108.728 -8.605 3.095 1.00 1.00 H new ATOM 1391 N THR A 98 105.767 -9.445 2.717 1.00 1.00 N ATOM 1392 CA THR A 98 104.761 -8.391 2.823 1.00 1.00 C ATOM 1393 C THR A 98 105.275 -7.272 3.691 1.00 1.00 C ATOM 1394 O THR A 98 105.488 -7.449 4.887 1.00 1.00 O ATOM 1395 CB THR A 98 103.467 -8.932 3.417 1.00 1.00 C ATOM 1396 OG1 THR A 98 103.020 -10.047 2.658 1.00 1.00 O ATOM 1397 CG2 THR A 98 102.416 -7.827 3.377 1.00 1.00 C ATOM 0 H THR A 98 105.775 -10.106 3.494 1.00 1.00 H new ATOM 0 HA THR A 98 104.559 -8.016 1.820 1.00 1.00 H new ATOM 0 HB THR A 98 103.634 -9.251 4.446 1.00 1.00 H new ATOM 0 HG1 THR A 98 102.188 -10.393 3.044 1.00 1.00 H new ATOM 0 HG21 THR A 98 101.482 -8.198 3.799 1.00 1.00 H new ATOM 0 HG22 THR A 98 102.763 -6.973 3.959 1.00 1.00 H new ATOM 0 HG23 THR A 98 102.251 -7.519 2.344 1.00 1.00 H new ATOM 1405 N TRP A 99 105.520 -6.120 3.076 1.00 1.00 N ATOM 1406 CA TRP A 99 106.055 -4.971 3.798 1.00 1.00 C ATOM 1407 C TRP A 99 105.061 -3.821 3.829 1.00 1.00 C ATOM 1408 O TRP A 99 104.131 -3.744 3.026 1.00 1.00 O ATOM 1409 CB TRP A 99 107.322 -4.431 3.109 1.00 1.00 C ATOM 1410 CG TRP A 99 108.494 -5.361 3.210 1.00 1.00 C ATOM 1411 CD1 TRP A 99 108.479 -6.652 3.620 1.00 1.00 C ATOM 1412 CD2 TRP A 99 109.882 -5.056 2.896 1.00 1.00 C ATOM 1413 NE1 TRP A 99 109.753 -7.160 3.565 1.00 1.00 N ATOM 1414 CE2 TRP A 99 110.660 -6.214 3.126 1.00 1.00 C ATOM 1415 CE3 TRP A 99 110.529 -3.895 2.431 1.00 1.00 C ATOM 1416 CZ2 TRP A 99 112.035 -6.221 2.904 1.00 1.00 C ATOM 1417 CZ3 TRP A 99 111.917 -3.900 2.209 1.00 1.00 C ATOM 1418 CH2 TRP A 99 112.667 -5.062 2.446 1.00 1.00 C ATOM 0 H TRP A 99 105.357 -5.957 2.082 1.00 1.00 H new ATOM 0 HA TRP A 99 106.272 -5.321 4.807 1.00 1.00 H new ATOM 0 HB2 TRP A 99 107.104 -4.245 2.057 1.00 1.00 H new ATOM 0 HB3 TRP A 99 107.588 -3.472 3.554 1.00 1.00 H new ATOM 0 HD1 TRP A 99 107.603 -7.196 3.940 1.00 1.00 H new ATOM 0 HE1 TRP A 99 110.000 -8.117 3.817 1.00 1.00 H new ATOM 0 HE3 TRP A 99 109.957 -2.998 2.244 1.00 1.00 H new ATOM 0 HZ2 TRP A 99 112.610 -7.117 3.085 1.00 1.00 H new ATOM 0 HZ3 TRP A 99 112.408 -3.006 1.855 1.00 1.00 H new ATOM 0 HH2 TRP A 99 113.733 -5.061 2.274 1.00 1.00 H new ATOM 1429 N GLU A 100 105.344 -2.889 4.727 1.00 1.00 N ATOM 1430 CA GLU A 100 104.581 -1.659 4.866 1.00 1.00 C ATOM 1431 C GLU A 100 105.571 -0.525 4.769 1.00 1.00 C ATOM 1432 O GLU A 100 106.556 -0.517 5.506 1.00 1.00 O ATOM 1433 CB GLU A 100 103.862 -1.567 6.216 1.00 1.00 C ATOM 1434 CG GLU A 100 102.616 -2.440 6.200 1.00 1.00 C ATOM 1435 CD GLU A 100 101.960 -2.435 7.575 1.00 1.00 C ATOM 1436 OE1 GLU A 100 100.955 -3.105 7.732 1.00 1.00 O ATOM 1437 OE2 GLU A 100 102.472 -1.758 8.450 1.00 1.00 O ATOM 0 H GLU A 100 106.118 -2.967 5.386 1.00 1.00 H new ATOM 0 HA GLU A 100 103.816 -1.622 4.091 1.00 1.00 H new ATOM 0 HB2 GLU A 100 104.530 -1.886 7.016 1.00 1.00 H new ATOM 0 HB3 GLU A 100 103.589 -0.532 6.423 1.00 1.00 H new ATOM 0 HG2 GLU A 100 101.914 -2.073 5.451 1.00 1.00 H new ATOM 0 HG3 GLU A 100 102.879 -3.459 5.917 1.00 1.00 H new ATOM 1444 N ILE A 101 105.334 0.431 3.876 1.00 1.00 N ATOM 1445 CA ILE A 101 106.253 1.547 3.734 1.00 1.00 C ATOM 1446 C ILE A 101 105.529 2.843 4.006 1.00 1.00 C ATOM 1447 O ILE A 101 104.389 3.048 3.590 1.00 1.00 O ATOM 1448 CB ILE A 101 106.955 1.519 2.365 1.00 1.00 C ATOM 1449 CG1 ILE A 101 106.131 2.191 1.264 1.00 1.00 C ATOM 1450 CG2 ILE A 101 107.202 0.055 1.995 1.00 1.00 C ATOM 1451 CD1 ILE A 101 106.972 2.216 -0.004 1.00 1.00 C ATOM 0 H ILE A 101 104.528 0.454 3.252 1.00 1.00 H new ATOM 0 HA ILE A 101 107.048 1.459 4.475 1.00 1.00 H new ATOM 0 HB ILE A 101 107.887 2.078 2.445 1.00 1.00 H new ATOM 0 HG12 ILE A 101 105.203 1.644 1.095 1.00 1.00 H new ATOM 0 HG13 ILE A 101 105.855 3.204 1.559 1.00 1.00 H new ATOM 0 HG21 ILE A 101 107.700 0.003 1.027 1.00 1.00 H new ATOM 0 HG22 ILE A 101 107.833 -0.410 2.752 1.00 1.00 H new ATOM 0 HG23 ILE A 101 106.250 -0.473 1.942 1.00 1.00 H new ATOM 0 HD11 ILE A 101 106.407 2.691 -0.806 1.00 1.00 H new ATOM 0 HD12 ILE A 101 107.887 2.779 0.178 1.00 1.00 H new ATOM 0 HD13 ILE A 101 107.225 1.196 -0.293 1.00 1.00 H new ATOM 1458 N TYR A 102 106.214 3.692 4.748 1.00 1.00 N ATOM 1459 CA TYR A 102 105.690 4.971 5.157 1.00 1.00 C ATOM 1460 C TYR A 102 106.450 6.001 4.356 1.00 1.00 C ATOM 1461 O TYR A 102 107.635 6.241 4.585 1.00 1.00 O ATOM 1462 CB TYR A 102 105.942 5.151 6.662 1.00 1.00 C ATOM 1463 CG TYR A 102 105.350 3.989 7.463 1.00 1.00 C ATOM 1464 CD1 TYR A 102 105.672 2.655 7.154 1.00 1.00 C ATOM 1465 CD2 TYR A 102 104.469 4.244 8.521 1.00 1.00 C ATOM 1466 CE1 TYR A 102 105.119 1.605 7.879 1.00 1.00 C ATOM 1467 CE2 TYR A 102 103.916 3.186 9.255 1.00 1.00 C ATOM 1468 CZ TYR A 102 104.239 1.866 8.932 1.00 1.00 C ATOM 1469 OH TYR A 102 103.690 0.824 9.652 1.00 1.00 O ATOM 0 H TYR A 102 107.159 3.507 5.085 1.00 1.00 H new ATOM 0 HA TYR A 102 104.618 5.063 4.985 1.00 1.00 H new ATOM 0 HB2 TYR A 102 107.014 5.217 6.849 1.00 1.00 H new ATOM 0 HB3 TYR A 102 105.502 6.090 6.998 1.00 1.00 H new ATOM 0 HD1 TYR A 102 106.356 2.444 6.345 1.00 1.00 H new ATOM 0 HD2 TYR A 102 104.214 5.263 8.773 1.00 1.00 H new ATOM 0 HE1 TYR A 102 105.371 0.585 7.627 1.00 1.00 H new ATOM 0 HE2 TYR A 102 103.239 3.391 10.071 1.00 1.00 H new ATOM 0 HH TYR A 102 103.376 0.130 9.035 1.00 1.00 H new ATOM 1479 N VAL A 103 105.777 6.520 3.339 1.00 1.00 N ATOM 1480 CA VAL A 103 106.400 7.434 2.401 1.00 1.00 C ATOM 1481 C VAL A 103 106.283 8.906 2.765 1.00 1.00 C ATOM 1482 O VAL A 103 105.195 9.471 2.711 1.00 1.00 O ATOM 1483 CB VAL A 103 105.783 7.266 1.021 1.00 1.00 C ATOM 1484 CG1 VAL A 103 106.654 7.986 -0.002 1.00 1.00 C ATOM 1485 CG2 VAL A 103 105.681 5.786 0.666 1.00 1.00 C ATOM 0 H VAL A 103 104.796 6.321 3.145 1.00 1.00 H new ATOM 0 HA VAL A 103 107.457 7.171 2.426 1.00 1.00 H new ATOM 0 HB VAL A 103 104.780 7.693 1.017 1.00 1.00 H new ATOM 0 HG11 VAL A 103 106.219 7.871 -0.995 1.00 1.00 H new ATOM 0 HG12 VAL A 103 106.710 9.045 0.249 1.00 1.00 H new ATOM 0 HG13 VAL A 103 107.656 7.557 0.007 1.00 1.00 H new ATOM 0 HG21 VAL A 103 105.238 5.679 -0.324 1.00 1.00 H new ATOM 0 HG22 VAL A 103 106.676 5.342 0.668 1.00 1.00 H new ATOM 0 HG23 VAL A 103 105.056 5.278 1.400 1.00 1.00 H new ATOM 1489 N PRO A 104 107.383 9.560 3.044 1.00 1.00 N ATOM 1490 CA PRO A 104 107.360 11.014 3.316 1.00 1.00 C ATOM 1491 C PRO A 104 106.619 11.735 2.199 1.00 1.00 C ATOM 1492 O PRO A 104 106.684 11.328 1.038 1.00 1.00 O ATOM 1493 CB PRO A 104 108.847 11.404 3.329 1.00 1.00 C ATOM 1494 CG PRO A 104 109.597 10.143 3.648 1.00 1.00 C ATOM 1495 CD PRO A 104 108.738 8.988 3.155 1.00 1.00 C ATOM 0 HA PRO A 104 106.853 11.275 4.245 1.00 1.00 H new ATOM 0 HB2 PRO A 104 109.154 11.808 2.364 1.00 1.00 H new ATOM 0 HB3 PRO A 104 109.043 12.175 4.074 1.00 1.00 H new ATOM 0 HG2 PRO A 104 110.571 10.138 3.159 1.00 1.00 H new ATOM 0 HG3 PRO A 104 109.778 10.061 4.720 1.00 1.00 H new ATOM 0 HD2 PRO A 104 109.091 8.612 2.194 1.00 1.00 H new ATOM 0 HD3 PRO A 104 108.760 8.151 3.852 1.00 1.00 H new ATOM 1503 N SER A 105 105.896 12.782 2.554 1.00 1.00 N ATOM 1504 CA SER A 105 105.130 13.517 1.571 1.00 1.00 C ATOM 1505 C SER A 105 105.986 13.857 0.355 1.00 1.00 C ATOM 1506 O SER A 105 105.504 13.838 -0.779 1.00 1.00 O ATOM 1507 CB SER A 105 104.577 14.797 2.192 1.00 1.00 C ATOM 1508 OG SER A 105 105.658 15.627 2.599 1.00 1.00 O ATOM 0 H SER A 105 105.825 13.138 3.507 1.00 1.00 H new ATOM 0 HA SER A 105 104.303 12.888 1.242 1.00 1.00 H new ATOM 0 HB2 SER A 105 103.951 15.323 1.472 1.00 1.00 H new ATOM 0 HB3 SER A 105 103.946 14.557 3.048 1.00 1.00 H new ATOM 0 HG SER A 105 105.306 16.451 2.997 1.00 1.00 H new ATOM 1514 N GLY A 106 107.255 14.162 0.592 1.00 1.00 N ATOM 1515 CA GLY A 106 108.166 14.500 -0.494 1.00 1.00 C ATOM 1516 C GLY A 106 108.412 13.305 -1.404 1.00 1.00 C ATOM 1517 O GLY A 106 108.630 13.460 -2.606 1.00 1.00 O ATOM 0 H GLY A 106 107.675 14.182 1.521 1.00 1.00 H new ATOM 0 HA2 GLY A 106 107.751 15.323 -1.076 1.00 1.00 H new ATOM 0 HA3 GLY A 106 109.114 14.847 -0.082 1.00 1.00 H new ATOM 1521 N LEU A 107 108.389 12.110 -0.822 1.00 1.00 N ATOM 1522 CA LEU A 107 108.624 10.884 -1.590 1.00 1.00 C ATOM 1523 C LEU A 107 107.305 10.219 -1.956 1.00 1.00 C ATOM 1524 O LEU A 107 107.296 9.147 -2.548 1.00 1.00 O ATOM 1525 CB LEU A 107 109.466 9.885 -0.775 1.00 1.00 C ATOM 1526 CG LEU A 107 110.834 10.486 -0.406 1.00 1.00 C ATOM 1527 CD1 LEU A 107 111.686 9.417 0.278 1.00 1.00 C ATOM 1528 CD2 LEU A 107 111.561 10.990 -1.664 1.00 1.00 C ATOM 0 H LEU A 107 108.212 11.961 0.171 1.00 1.00 H new ATOM 0 HA LEU A 107 109.160 11.162 -2.497 1.00 1.00 H new ATOM 0 HB2 LEU A 107 108.930 9.608 0.133 1.00 1.00 H new ATOM 0 HB3 LEU A 107 109.610 8.971 -1.351 1.00 1.00 H new ATOM 0 HG LEU A 107 110.678 11.328 0.268 1.00 1.00 H new ATOM 0 HD11 LEU A 107 112.656 9.838 0.541 1.00 1.00 H new ATOM 0 HD12 LEU A 107 111.182 9.074 1.182 1.00 1.00 H new ATOM 0 HD13 LEU A 107 111.828 8.576 -0.400 1.00 1.00 H new ATOM 0 HD21 LEU A 107 112.526 11.411 -1.382 1.00 1.00 H new ATOM 0 HD22 LEU A 107 111.715 10.159 -2.353 1.00 1.00 H new ATOM 0 HD23 LEU A 107 110.958 11.757 -2.150 1.00 1.00 H new ATOM 1540 N ALA A 108 106.189 10.846 -1.579 1.00 1.00 N ATOM 1541 CA ALA A 108 104.871 10.297 -1.860 1.00 1.00 C ATOM 1542 C ALA A 108 104.181 11.122 -2.942 1.00 1.00 C ATOM 1543 O ALA A 108 104.585 11.102 -4.100 1.00 1.00 O ATOM 1544 CB ALA A 108 104.006 10.307 -0.600 1.00 1.00 C ATOM 0 H ALA A 108 106.177 11.735 -1.078 1.00 1.00 H new ATOM 0 HA ALA A 108 104.996 9.270 -2.202 1.00 1.00 H new ATOM 0 HB1 ALA A 108 103.024 9.893 -0.829 1.00 1.00 H new ATOM 0 HB2 ALA A 108 104.482 9.704 0.173 1.00 1.00 H new ATOM 0 HB3 ALA A 108 103.894 11.331 -0.244 1.00 1.00 H new ATOM 1550 N TYR A 109 103.124 11.844 -2.563 1.00 1.00 N ATOM 1551 CA TYR A 109 102.369 12.646 -3.514 1.00 1.00 C ATOM 1552 C TYR A 109 102.769 14.115 -3.478 1.00 1.00 C ATOM 1553 O TYR A 109 102.191 14.934 -4.193 1.00 1.00 O ATOM 1554 CB TYR A 109 100.869 12.463 -3.237 1.00 1.00 C ATOM 1555 CG TYR A 109 100.492 11.133 -3.819 1.00 1.00 C ATOM 1556 CD1 TYR A 109 100.444 10.007 -3.006 1.00 1.00 C ATOM 1557 CD2 TYR A 109 100.293 11.018 -5.194 1.00 1.00 C ATOM 1558 CE1 TYR A 109 100.204 8.769 -3.559 1.00 1.00 C ATOM 1559 CE2 TYR A 109 100.036 9.784 -5.748 1.00 1.00 C ATOM 1560 CZ TYR A 109 100.001 8.651 -4.927 1.00 1.00 C ATOM 1561 OH TYR A 109 99.791 7.420 -5.460 1.00 1.00 O ATOM 0 H TYR A 109 102.776 11.886 -1.605 1.00 1.00 H new ATOM 0 HA TYR A 109 102.598 12.300 -4.522 1.00 1.00 H new ATOM 0 HB2 TYR A 109 100.665 12.491 -2.167 1.00 1.00 H new ATOM 0 HB3 TYR A 109 100.289 13.265 -3.693 1.00 1.00 H new ATOM 0 HD1 TYR A 109 100.595 10.103 -1.941 1.00 1.00 H new ATOM 0 HD2 TYR A 109 100.340 11.895 -5.823 1.00 1.00 H new ATOM 0 HE1 TYR A 109 100.174 7.892 -2.930 1.00 1.00 H new ATOM 0 HE2 TYR A 109 99.862 9.691 -6.810 1.00 1.00 H new ATOM 0 HH TYR A 109 99.664 7.500 -6.428 1.00 1.00 H new ATOM 1571 N GLY A 110 103.781 14.443 -2.675 1.00 1.00 N ATOM 1572 CA GLY A 110 104.276 15.821 -2.594 1.00 1.00 C ATOM 1573 C GLY A 110 103.964 16.479 -1.250 1.00 1.00 C ATOM 1574 O GLY A 110 103.040 16.071 -0.548 1.00 1.00 O ATOM 0 H GLY A 110 104.272 13.781 -2.075 1.00 1.00 H new ATOM 0 HA2 GLY A 110 105.354 15.826 -2.755 1.00 1.00 H new ATOM 0 HA3 GLY A 110 103.831 16.411 -3.395 1.00 1.00 H new ATOM 1578 N PRO A 111 104.716 17.502 -0.895 1.00 1.00 N ATOM 1579 CA PRO A 111 104.528 18.261 0.377 1.00 1.00 C ATOM 1580 C PRO A 111 103.298 19.157 0.289 1.00 1.00 C ATOM 1581 O PRO A 111 102.827 19.708 1.278 1.00 1.00 O ATOM 1582 CB PRO A 111 105.813 19.079 0.491 1.00 1.00 C ATOM 1583 CG PRO A 111 106.224 19.324 -0.919 1.00 1.00 C ATOM 1584 CD PRO A 111 105.835 18.060 -1.682 1.00 1.00 C ATOM 0 HA PRO A 111 104.362 17.622 1.244 1.00 1.00 H new ATOM 0 HB2 PRO A 111 105.642 20.015 1.023 1.00 1.00 H new ATOM 0 HB3 PRO A 111 106.582 18.536 1.040 1.00 1.00 H new ATOM 0 HG2 PRO A 111 105.721 20.200 -1.328 1.00 1.00 H new ATOM 0 HG3 PRO A 111 107.296 19.511 -0.989 1.00 1.00 H new ATOM 0 HD2 PRO A 111 105.531 18.287 -2.704 1.00 1.00 H new ATOM 0 HD3 PRO A 111 106.668 17.359 -1.746 1.00 1.00 H new ATOM 1592 N ARG A 112 102.791 19.285 -0.925 1.00 1.00 N ATOM 1593 CA ARG A 112 101.611 20.096 -1.193 1.00 1.00 C ATOM 1594 C ARG A 112 100.401 19.181 -1.321 1.00 1.00 C ATOM 1595 O ARG A 112 100.553 17.974 -1.475 1.00 1.00 O ATOM 1596 CB ARG A 112 101.827 20.856 -2.505 1.00 1.00 C ATOM 1597 CG ARG A 112 100.758 21.938 -2.677 1.00 1.00 C ATOM 1598 CD ARG A 112 101.046 22.744 -3.944 1.00 1.00 C ATOM 1599 NE ARG A 112 100.142 23.889 -4.027 1.00 1.00 N ATOM 1600 CZ ARG A 112 100.262 24.798 -4.989 1.00 1.00 C ATOM 1601 NH1 ARG A 112 101.218 24.696 -5.872 1.00 1.00 N ATOM 1602 NH2 ARG A 112 99.420 25.794 -5.051 1.00 1.00 N ATOM 0 H ARG A 112 103.182 18.833 -1.751 1.00 1.00 H new ATOM 0 HA ARG A 112 101.444 20.805 -0.382 1.00 1.00 H new ATOM 0 HB2 ARG A 112 102.818 21.310 -2.511 1.00 1.00 H new ATOM 0 HB3 ARG A 112 101.790 20.162 -3.345 1.00 1.00 H new ATOM 0 HG2 ARG A 112 99.770 21.481 -2.741 1.00 1.00 H new ATOM 0 HG3 ARG A 112 100.749 22.597 -1.809 1.00 1.00 H new ATOM 0 HD2 ARG A 112 102.081 23.087 -3.939 1.00 1.00 H new ATOM 0 HD3 ARG A 112 100.925 22.111 -4.823 1.00 1.00 H new ATOM 0 HE ARG A 112 99.403 23.993 -3.332 1.00 1.00 H new ATOM 0 HH11 ARG A 112 101.875 23.917 -5.825 1.00 1.00 H new ATOM 0 HH12 ARG A 112 101.308 25.395 -6.609 1.00 1.00 H new ATOM 0 HH21 ARG A 112 98.672 25.873 -4.362 1.00 1.00 H new ATOM 0 HH22 ARG A 112 99.510 26.493 -5.788 1.00 1.00 H new ATOM 1616 N SER A 113 99.204 19.741 -1.264 1.00 1.00 N ATOM 1617 CA SER A 113 98.017 18.926 -1.404 1.00 1.00 C ATOM 1618 C SER A 113 97.883 18.482 -2.856 1.00 1.00 C ATOM 1619 O SER A 113 97.385 19.237 -3.694 1.00 1.00 O ATOM 1620 CB SER A 113 96.791 19.732 -1.001 1.00 1.00 C ATOM 1621 OG SER A 113 97.105 20.508 0.145 1.00 1.00 O ATOM 0 H SER A 113 99.033 20.737 -1.125 1.00 1.00 H new ATOM 0 HA SER A 113 98.097 18.051 -0.759 1.00 1.00 H new ATOM 0 HB2 SER A 113 96.480 20.380 -1.821 1.00 1.00 H new ATOM 0 HB3 SER A 113 95.956 19.065 -0.787 1.00 1.00 H new ATOM 0 HG SER A 113 96.574 21.332 0.138 1.00 1.00 H new ATOM 1627 N VAL A 114 98.341 17.266 -3.161 1.00 1.00 N ATOM 1628 CA VAL A 114 98.273 16.753 -4.538 1.00 1.00 C ATOM 1629 C VAL A 114 97.288 15.594 -4.650 1.00 1.00 C ATOM 1630 O VAL A 114 97.674 14.483 -5.015 1.00 1.00 O ATOM 1631 CB VAL A 114 99.659 16.284 -5.001 1.00 1.00 C ATOM 1632 CG1 VAL A 114 99.662 16.117 -6.522 1.00 1.00 C ATOM 1633 CG2 VAL A 114 100.722 17.313 -4.596 1.00 1.00 C ATOM 0 H VAL A 114 98.758 16.624 -2.487 1.00 1.00 H new ATOM 0 HA VAL A 114 97.928 17.567 -5.175 1.00 1.00 H new ATOM 0 HB VAL A 114 99.888 15.329 -4.529 1.00 1.00 H new ATOM 0 HG11 VAL A 114 100.647 15.784 -6.850 1.00 1.00 H new ATOM 0 HG12 VAL A 114 98.915 15.377 -6.808 1.00 1.00 H new ATOM 0 HG13 VAL A 114 99.426 17.071 -6.993 1.00 1.00 H new ATOM 0 HG21 VAL A 114 101.703 16.973 -4.928 1.00 1.00 H new ATOM 0 HG22 VAL A 114 100.495 18.273 -5.060 1.00 1.00 H new ATOM 0 HG23 VAL A 114 100.725 17.426 -3.512 1.00 1.00 H new ATOM 1637 N GLY A 115 96.017 15.847 -4.343 1.00 1.00 N ATOM 1638 CA GLY A 115 95.014 14.792 -4.431 1.00 1.00 C ATOM 1639 C GLY A 115 93.742 15.149 -3.666 1.00 1.00 C ATOM 1640 O GLY A 115 93.706 16.111 -2.897 1.00 1.00 O ATOM 0 H GLY A 115 95.664 16.754 -4.038 1.00 1.00 H new ATOM 0 HA2 GLY A 115 94.769 14.611 -5.478 1.00 1.00 H new ATOM 0 HA3 GLY A 115 95.427 13.864 -4.035 1.00 1.00 H new ATOM 1644 N GLY A 116 92.706 14.342 -3.880 1.00 1.00 N ATOM 1645 CA GLY A 116 91.420 14.533 -3.212 1.00 1.00 C ATOM 1646 C GLY A 116 91.604 14.740 -1.705 1.00 1.00 C ATOM 1647 O GLY A 116 91.966 15.835 -1.273 1.00 1.00 O ATOM 0 H GLY A 116 92.732 13.544 -4.515 1.00 1.00 H new ATOM 0 HA2 GLY A 116 90.909 15.395 -3.641 1.00 1.00 H new ATOM 0 HA3 GLY A 116 90.784 13.666 -3.388 1.00 1.00 H new ATOM 1651 N PRO A 117 91.335 13.745 -0.887 1.00 1.00 N ATOM 1652 CA PRO A 117 91.448 13.874 0.596 1.00 1.00 C ATOM 1653 C PRO A 117 92.871 14.213 1.023 1.00 1.00 C ATOM 1654 O PRO A 117 93.096 14.720 2.122 1.00 1.00 O ATOM 1655 CB PRO A 117 91.016 12.503 1.116 1.00 1.00 C ATOM 1656 CG PRO A 117 91.304 11.599 -0.020 1.00 1.00 C ATOM 1657 CD PRO A 117 90.925 12.382 -1.256 1.00 1.00 C ATOM 0 HA PRO A 117 90.836 14.684 0.993 1.00 1.00 H new ATOM 0 HB2 PRO A 117 91.574 12.218 2.008 1.00 1.00 H new ATOM 0 HB3 PRO A 117 89.959 12.489 1.383 1.00 1.00 H new ATOM 0 HG2 PRO A 117 92.356 11.316 -0.041 1.00 1.00 H new ATOM 0 HG3 PRO A 117 90.727 10.677 0.054 1.00 1.00 H new ATOM 0 HD2 PRO A 117 91.448 12.024 -2.143 1.00 1.00 H new ATOM 0 HD3 PRO A 117 89.858 12.320 -1.468 1.00 1.00 H new ATOM 1665 N ILE A 118 93.832 13.952 0.136 1.00 1.00 N ATOM 1666 CA ILE A 118 95.212 14.266 0.449 1.00 1.00 C ATOM 1667 C ILE A 118 95.337 15.779 0.500 1.00 1.00 C ATOM 1668 O ILE A 118 95.042 16.477 -0.470 1.00 1.00 O ATOM 1669 CB ILE A 118 96.175 13.700 -0.601 1.00 1.00 C ATOM 1670 CG1 ILE A 118 95.999 12.170 -0.729 1.00 1.00 C ATOM 1671 CG2 ILE A 118 97.597 14.003 -0.131 1.00 1.00 C ATOM 1672 CD1 ILE A 118 94.935 11.807 -1.784 1.00 1.00 C ATOM 0 H ILE A 118 93.679 13.534 -0.782 1.00 1.00 H new ATOM 0 HA ILE A 118 95.478 13.814 1.405 1.00 1.00 H new ATOM 0 HB ILE A 118 95.974 14.151 -1.573 1.00 1.00 H new ATOM 0 HG12 ILE A 118 96.952 11.715 -1.001 1.00 1.00 H new ATOM 0 HG13 ILE A 118 95.711 11.754 0.237 1.00 1.00 H new ATOM 0 HG21 ILE A 118 98.311 13.613 -0.857 1.00 1.00 H new ATOM 0 HG22 ILE A 118 97.727 15.081 -0.037 1.00 1.00 H new ATOM 0 HG23 ILE A 118 97.769 13.531 0.836 1.00 1.00 H new ATOM 0 HD11 ILE A 118 94.839 10.723 -1.846 1.00 1.00 H new ATOM 0 HD12 ILE A 118 93.977 12.240 -1.498 1.00 1.00 H new ATOM 0 HD13 ILE A 118 95.236 12.201 -2.755 1.00 1.00 H new ATOM 1679 N GLY A 119 95.713 16.274 1.666 1.00 1.00 N ATOM 1680 CA GLY A 119 95.812 17.703 1.910 1.00 1.00 C ATOM 1681 C GLY A 119 97.237 18.238 1.858 1.00 1.00 C ATOM 1682 O GLY A 119 98.158 17.550 1.436 1.00 1.00 O ATOM 0 H GLY A 119 95.958 15.697 2.471 1.00 1.00 H new ATOM 0 HA2 GLY A 119 95.208 18.231 1.172 1.00 1.00 H new ATOM 0 HA3 GLY A 119 95.386 17.926 2.888 1.00 1.00 H new ATOM 1686 N PRO A 120 97.419 19.456 2.305 1.00 1.00 N ATOM 1687 CA PRO A 120 98.762 20.109 2.355 1.00 1.00 C ATOM 1688 C PRO A 120 99.728 19.384 3.307 1.00 1.00 C ATOM 1689 O PRO A 120 99.316 18.882 4.346 1.00 1.00 O ATOM 1690 CB PRO A 120 98.465 21.540 2.849 1.00 1.00 C ATOM 1691 CG PRO A 120 97.109 21.475 3.486 1.00 1.00 C ATOM 1692 CD PRO A 120 96.351 20.351 2.800 1.00 1.00 C ATOM 0 HA PRO A 120 99.258 20.089 1.385 1.00 1.00 H new ATOM 0 HB2 PRO A 120 99.218 21.872 3.564 1.00 1.00 H new ATOM 0 HB3 PRO A 120 98.476 22.250 2.022 1.00 1.00 H new ATOM 0 HG2 PRO A 120 97.194 21.286 4.556 1.00 1.00 H new ATOM 0 HG3 PRO A 120 96.582 22.422 3.370 1.00 1.00 H new ATOM 0 HD2 PRO A 120 95.686 19.835 3.493 1.00 1.00 H new ATOM 0 HD3 PRO A 120 95.733 20.725 1.984 1.00 1.00 H new ATOM 1700 N ASN A 121 101.013 19.349 2.949 1.00 1.00 N ATOM 1701 CA ASN A 121 102.025 18.700 3.793 1.00 1.00 C ATOM 1702 C ASN A 121 101.515 17.367 4.331 1.00 1.00 C ATOM 1703 O ASN A 121 101.550 17.121 5.535 1.00 1.00 O ATOM 1704 CB ASN A 121 102.391 19.631 4.965 1.00 1.00 C ATOM 1705 CG ASN A 121 103.818 19.365 5.438 1.00 1.00 C ATOM 1706 OD1 ASN A 121 104.620 20.292 5.535 1.00 1.00 O ATOM 1707 ND2 ASN A 121 104.182 18.149 5.743 1.00 1.00 N ATOM 0 H ASN A 121 101.378 19.758 2.089 1.00 1.00 H new ATOM 0 HA ASN A 121 102.910 18.506 3.186 1.00 1.00 H new ATOM 0 HB2 ASN A 121 102.293 20.671 4.654 1.00 1.00 H new ATOM 0 HB3 ASN A 121 101.694 19.478 5.789 1.00 1.00 H new ATOM 0 HD21 ASN A 121 105.133 17.966 6.063 1.00 1.00 H new ATOM 0 HD22 ASN A 121 103.515 17.382 5.662 1.00 1.00 H new ATOM 1714 N GLU A 122 101.014 16.533 3.433 1.00 1.00 N ATOM 1715 CA GLU A 122 100.438 15.236 3.803 1.00 1.00 C ATOM 1716 C GLU A 122 101.343 14.066 3.435 1.00 1.00 C ATOM 1717 O GLU A 122 101.766 13.913 2.290 1.00 1.00 O ATOM 1718 CB GLU A 122 99.110 15.123 3.072 1.00 1.00 C ATOM 1719 CG GLU A 122 98.089 14.256 3.799 1.00 1.00 C ATOM 1720 CD GLU A 122 97.573 14.970 5.041 1.00 1.00 C ATOM 1721 OE1 GLU A 122 96.612 15.713 4.913 1.00 1.00 O ATOM 1722 OE2 GLU A 122 98.138 14.766 6.097 1.00 1.00 O ATOM 0 H GLU A 122 100.992 16.728 2.432 1.00 1.00 H new ATOM 0 HA GLU A 122 100.313 15.189 4.885 1.00 1.00 H new ATOM 0 HB2 GLU A 122 98.694 16.121 2.933 1.00 1.00 H new ATOM 0 HB3 GLU A 122 99.285 14.709 2.079 1.00 1.00 H new ATOM 0 HG2 GLU A 122 97.258 14.026 3.132 1.00 1.00 H new ATOM 0 HG3 GLU A 122 98.544 13.306 4.081 1.00 1.00 H new ATOM 1729 N THR A 123 101.599 13.231 4.431 1.00 1.00 N ATOM 1730 CA THR A 123 102.413 12.037 4.254 1.00 1.00 C ATOM 1731 C THR A 123 101.488 10.854 4.002 1.00 1.00 C ATOM 1732 O THR A 123 100.480 10.694 4.685 1.00 1.00 O ATOM 1733 CB THR A 123 103.253 11.808 5.517 1.00 1.00 C ATOM 1734 OG1 THR A 123 104.222 12.842 5.616 1.00 1.00 O ATOM 1735 CG2 THR A 123 103.977 10.458 5.456 1.00 1.00 C ATOM 0 H THR A 123 101.250 13.361 5.381 1.00 1.00 H new ATOM 0 HA THR A 123 103.087 12.152 3.405 1.00 1.00 H new ATOM 0 HB THR A 123 102.591 11.812 6.383 1.00 1.00 H new ATOM 0 HG1 THR A 123 104.423 13.012 6.560 1.00 1.00 H new ATOM 0 HG21 THR A 123 104.566 10.320 6.363 1.00 1.00 H new ATOM 0 HG22 THR A 123 103.244 9.655 5.373 1.00 1.00 H new ATOM 0 HG23 THR A 123 104.637 10.438 4.589 1.00 1.00 H new ATOM 1743 N LEU A 124 101.829 10.025 3.019 1.00 1.00 N ATOM 1744 CA LEU A 124 101.007 8.854 2.692 1.00 1.00 C ATOM 1745 C LEU A 124 101.773 7.559 2.961 1.00 1.00 C ATOM 1746 O LEU A 124 102.972 7.461 2.701 1.00 1.00 O ATOM 1747 CB LEU A 124 100.596 8.865 1.211 1.00 1.00 C ATOM 1748 CG LEU A 124 99.724 10.089 0.822 1.00 1.00 C ATOM 1749 CD1 LEU A 124 98.711 10.433 1.899 1.00 1.00 C ATOM 1750 CD2 LEU A 124 100.590 11.315 0.557 1.00 1.00 C ATOM 0 H LEU A 124 102.660 10.137 2.438 1.00 1.00 H new ATOM 0 HA LEU A 124 100.120 8.901 3.323 1.00 1.00 H new ATOM 0 HB2 LEU A 124 101.494 8.856 0.593 1.00 1.00 H new ATOM 0 HB3 LEU A 124 100.046 7.951 0.987 1.00 1.00 H new ATOM 0 HG LEU A 124 99.190 9.809 -0.086 1.00 1.00 H new ATOM 0 HD11 LEU A 124 98.123 11.295 1.584 1.00 1.00 H new ATOM 0 HD12 LEU A 124 98.049 9.582 2.061 1.00 1.00 H new ATOM 0 HD13 LEU A 124 99.232 10.669 2.827 1.00 1.00 H new ATOM 0 HD21 LEU A 124 99.954 12.158 0.287 1.00 1.00 H new ATOM 0 HD22 LEU A 124 101.157 11.561 1.455 1.00 1.00 H new ATOM 0 HD23 LEU A 124 101.279 11.104 -0.260 1.00 1.00 H new ATOM 1762 N ILE A 125 101.048 6.557 3.463 1.00 1.00 N ATOM 1763 CA ILE A 125 101.605 5.243 3.756 1.00 1.00 C ATOM 1764 C ILE A 125 100.860 4.203 2.950 1.00 1.00 C ATOM 1765 O ILE A 125 99.665 4.345 2.709 1.00 1.00 O ATOM 1766 CB ILE A 125 101.433 4.910 5.252 1.00 1.00 C ATOM 1767 CG1 ILE A 125 101.533 3.380 5.473 1.00 1.00 C ATOM 1768 CG2 ILE A 125 100.058 5.395 5.726 1.00 1.00 C ATOM 1769 CD1 ILE A 125 101.611 3.049 6.949 1.00 1.00 C ATOM 0 H ILE A 125 100.054 6.639 3.677 1.00 1.00 H new ATOM 0 HA ILE A 125 102.665 5.245 3.503 1.00 1.00 H new ATOM 0 HB ILE A 125 102.220 5.408 5.818 1.00 1.00 H new ATOM 0 HG12 ILE A 125 100.666 2.888 5.032 1.00 1.00 H new ATOM 0 HG13 ILE A 125 102.414 2.992 4.963 1.00 1.00 H new ATOM 0 HG21 ILE A 125 99.934 5.161 6.783 1.00 1.00 H new ATOM 0 HG22 ILE A 125 99.983 6.473 5.582 1.00 1.00 H new ATOM 0 HG23 ILE A 125 99.278 4.897 5.150 1.00 1.00 H new ATOM 0 HD11 ILE A 125 101.680 1.969 7.076 1.00 1.00 H new ATOM 0 HD12 ILE A 125 102.492 3.523 7.382 1.00 1.00 H new ATOM 0 HD13 ILE A 125 100.717 3.417 7.452 1.00 1.00 H new ATOM 1776 N PHE A 126 101.555 3.130 2.588 1.00 1.00 N ATOM 1777 CA PHE A 126 100.913 2.044 1.867 1.00 1.00 C ATOM 1778 C PHE A 126 101.400 0.691 2.369 1.00 1.00 C ATOM 1779 O PHE A 126 102.549 0.548 2.787 1.00 1.00 O ATOM 1780 CB PHE A 126 101.173 2.151 0.366 1.00 1.00 C ATOM 1781 CG PHE A 126 101.205 3.599 -0.040 1.00 1.00 C ATOM 1782 CD1 PHE A 126 100.151 4.156 -0.778 1.00 1.00 C ATOM 1783 CD2 PHE A 126 102.297 4.387 0.317 1.00 1.00 C ATOM 1784 CE1 PHE A 126 100.202 5.506 -1.154 1.00 1.00 C ATOM 1785 CE2 PHE A 126 102.343 5.728 -0.057 1.00 1.00 C ATOM 1786 CZ PHE A 126 101.300 6.288 -0.789 1.00 1.00 C ATOM 0 H PHE A 126 102.547 2.992 2.779 1.00 1.00 H new ATOM 0 HA PHE A 126 99.841 2.126 2.048 1.00 1.00 H new ATOM 0 HB2 PHE A 126 102.120 1.672 0.116 1.00 1.00 H new ATOM 0 HB3 PHE A 126 100.394 1.625 -0.186 1.00 1.00 H new ATOM 0 HD1 PHE A 126 99.303 3.548 -1.056 1.00 1.00 H new ATOM 0 HD2 PHE A 126 103.109 3.957 0.885 1.00 1.00 H new ATOM 0 HE1 PHE A 126 99.394 5.940 -1.724 1.00 1.00 H new ATOM 0 HE2 PHE A 126 103.191 6.336 0.222 1.00 1.00 H new ATOM 0 HZ PHE A 126 101.340 7.329 -1.075 1.00 1.00 H new ATOM 1796 N LYS A 127 100.523 -0.313 2.286 1.00 1.00 N ATOM 1797 CA LYS A 127 100.870 -1.659 2.690 1.00 1.00 C ATOM 1798 C LYS A 127 101.171 -2.396 1.419 1.00 1.00 C ATOM 1799 O LYS A 127 100.353 -2.394 0.512 1.00 1.00 O ATOM 1800 CB LYS A 127 99.707 -2.352 3.453 1.00 1.00 C ATOM 1801 CG LYS A 127 98.627 -1.347 3.860 1.00 1.00 C ATOM 1802 CD LYS A 127 99.177 -0.370 4.912 1.00 1.00 C ATOM 1803 CE LYS A 127 98.096 0.645 5.284 1.00 1.00 C ATOM 1804 NZ LYS A 127 98.594 1.517 6.386 1.00 1.00 N ATOM 0 H LYS A 127 99.569 -0.209 1.941 1.00 1.00 H new ATOM 0 HA LYS A 127 101.718 -1.651 3.375 1.00 1.00 H new ATOM 0 HB2 LYS A 127 99.267 -3.126 2.824 1.00 1.00 H new ATOM 0 HB3 LYS A 127 100.098 -2.848 4.342 1.00 1.00 H new ATOM 0 HG2 LYS A 127 98.286 -0.795 2.984 1.00 1.00 H new ATOM 0 HG3 LYS A 127 97.762 -1.875 4.261 1.00 1.00 H new ATOM 0 HD2 LYS A 127 99.497 -0.917 5.799 1.00 1.00 H new ATOM 0 HD3 LYS A 127 100.055 0.145 4.521 1.00 1.00 H new ATOM 0 HE2 LYS A 127 97.836 1.250 4.416 1.00 1.00 H new ATOM 0 HE3 LYS A 127 97.188 0.128 5.596 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 97.894 1.539 7.154 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 99.493 1.140 6.748 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 98.743 2.481 6.025 1.00 1.00 H new ATOM 1818 N ILE A 128 102.366 -2.950 1.301 1.00 1.00 N ATOM 1819 CA ILE A 128 102.733 -3.598 0.044 1.00 1.00 C ATOM 1820 C ILE A 128 103.046 -5.077 0.192 1.00 1.00 C ATOM 1821 O ILE A 128 103.985 -5.475 0.882 1.00 1.00 O ATOM 1822 CB ILE A 128 103.939 -2.863 -0.549 1.00 1.00 C ATOM 1823 CG1 ILE A 128 103.783 -1.351 -0.257 1.00 1.00 C ATOM 1824 CG2 ILE A 128 103.985 -3.121 -2.061 1.00 1.00 C ATOM 1825 CD1 ILE A 128 104.901 -0.524 -0.910 1.00 1.00 C ATOM 0 H ILE A 128 103.080 -2.968 2.030 1.00 1.00 H new ATOM 0 HA ILE A 128 101.870 -3.539 -0.619 1.00 1.00 H new ATOM 0 HB ILE A 128 104.869 -3.219 -0.105 1.00 1.00 H new ATOM 0 HG12 ILE A 128 102.816 -1.008 -0.624 1.00 1.00 H new ATOM 0 HG13 ILE A 128 103.791 -1.186 0.820 1.00 1.00 H new ATOM 0 HG21 ILE A 128 104.841 -2.602 -2.493 1.00 1.00 H new ATOM 0 HG22 ILE A 128 104.080 -4.191 -2.245 1.00 1.00 H new ATOM 0 HG23 ILE A 128 103.068 -2.754 -2.521 1.00 1.00 H new ATOM 0 HD11 ILE A 128 104.754 0.531 -0.681 1.00 1.00 H new ATOM 0 HD12 ILE A 128 105.867 -0.849 -0.523 1.00 1.00 H new ATOM 0 HD13 ILE A 128 104.876 -0.667 -1.990 1.00 1.00 H new ATOM 1832 N HIS A 129 102.247 -5.872 -0.519 1.00 1.00 N ATOM 1833 CA HIS A 129 102.395 -7.316 -0.564 1.00 1.00 C ATOM 1834 C HIS A 129 102.922 -7.703 -1.936 1.00 1.00 C ATOM 1835 O HIS A 129 102.319 -7.361 -2.951 1.00 1.00 O ATOM 1836 CB HIS A 129 101.039 -7.979 -0.329 1.00 1.00 C ATOM 1837 CG HIS A 129 101.162 -9.463 -0.528 1.00 1.00 C ATOM 1838 ND1 HIS A 129 100.140 -10.206 -1.090 1.00 1.00 N ATOM 1839 CD2 HIS A 129 102.187 -10.350 -0.288 1.00 1.00 C ATOM 1840 CE1 HIS A 129 100.563 -11.475 -1.178 1.00 1.00 C ATOM 1841 NE2 HIS A 129 101.801 -11.623 -0.710 1.00 1.00 N ATOM 0 H HIS A 129 101.473 -5.523 -1.084 1.00 1.00 H new ATOM 0 HA HIS A 129 103.088 -7.646 0.210 1.00 1.00 H new ATOM 0 HB2 HIS A 129 100.689 -7.765 0.681 1.00 1.00 H new ATOM 0 HB3 HIS A 129 100.299 -7.570 -1.017 1.00 1.00 H new ATOM 0 HD2 HIS A 129 103.139 -10.100 0.156 1.00 1.00 H new ATOM 0 HE1 HIS A 129 99.970 -12.282 -1.581 1.00 1.00 H new ATOM 0 HE2 HIS A 129 102.349 -12.482 -0.669 1.00 1.00 H new ATOM 1849 N LEU A 130 104.066 -8.388 -1.979 1.00 1.00 N ATOM 1850 CA LEU A 130 104.656 -8.769 -3.262 1.00 1.00 C ATOM 1851 C LEU A 130 104.264 -10.195 -3.663 1.00 1.00 C ATOM 1852 O LEU A 130 104.693 -11.170 -3.048 1.00 1.00 O ATOM 1853 CB LEU A 130 106.187 -8.624 -3.185 1.00 1.00 C ATOM 1854 CG LEU A 130 106.731 -7.884 -4.422 1.00 1.00 C ATOM 1855 CD1 LEU A 130 108.244 -7.673 -4.295 1.00 1.00 C ATOM 1856 CD2 LEU A 130 106.441 -8.683 -5.698 1.00 1.00 C ATOM 0 H LEU A 130 104.593 -8.685 -1.158 1.00 1.00 H new ATOM 0 HA LEU A 130 104.268 -8.102 -4.032 1.00 1.00 H new ATOM 0 HB2 LEU A 130 106.460 -8.079 -2.281 1.00 1.00 H new ATOM 0 HB3 LEU A 130 106.647 -9.610 -3.114 1.00 1.00 H new ATOM 0 HG LEU A 130 106.233 -6.916 -4.482 1.00 1.00 H new ATOM 0 HD11 LEU A 130 108.614 -7.149 -5.176 1.00 1.00 H new ATOM 0 HD12 LEU A 130 108.455 -7.080 -3.405 1.00 1.00 H new ATOM 0 HD13 LEU A 130 108.741 -8.640 -4.213 1.00 1.00 H new ATOM 0 HD21 LEU A 130 106.832 -8.145 -6.561 1.00 1.00 H new ATOM 0 HD22 LEU A 130 106.919 -9.660 -5.632 1.00 1.00 H new ATOM 0 HD23 LEU A 130 105.364 -8.813 -5.809 1.00 1.00 H new ATOM 1868 N ILE A 131 103.437 -10.293 -4.704 1.00 1.00 N ATOM 1869 CA ILE A 131 102.975 -11.581 -5.204 1.00 1.00 C ATOM 1870 C ILE A 131 103.865 -12.085 -6.338 1.00 1.00 C ATOM 1871 O ILE A 131 104.262 -13.252 -6.344 1.00 1.00 O ATOM 1872 CB ILE A 131 101.526 -11.441 -5.691 1.00 1.00 C ATOM 1873 CG1 ILE A 131 100.595 -11.182 -4.495 1.00 1.00 C ATOM 1874 CG2 ILE A 131 101.084 -12.734 -6.367 1.00 1.00 C ATOM 1875 CD1 ILE A 131 100.552 -9.707 -4.129 1.00 1.00 C ATOM 0 H ILE A 131 103.074 -9.490 -5.217 1.00 1.00 H new ATOM 0 HA ILE A 131 103.025 -12.310 -4.395 1.00 1.00 H new ATOM 0 HB ILE A 131 101.474 -10.610 -6.394 1.00 1.00 H new ATOM 0 HG12 ILE A 131 99.589 -11.528 -4.734 1.00 1.00 H new ATOM 0 HG13 ILE A 131 100.935 -11.761 -3.636 1.00 1.00 H new ATOM 0 HG21 ILE A 131 100.055 -12.631 -6.711 1.00 1.00 H new ATOM 0 HG22 ILE A 131 101.733 -12.940 -7.218 1.00 1.00 H new ATOM 0 HG23 ILE A 131 101.148 -13.557 -5.655 1.00 1.00 H new ATOM 0 HD11 ILE A 131 99.884 -9.562 -3.280 1.00 1.00 H new ATOM 0 HD12 ILE A 131 101.554 -9.368 -3.865 1.00 1.00 H new ATOM 0 HD13 ILE A 131 100.187 -9.132 -4.980 1.00 1.00 H new ATOM 1882 N SER A 132 104.176 -11.219 -7.301 1.00 1.00 N ATOM 1883 CA SER A 132 105.018 -11.630 -8.426 1.00 1.00 C ATOM 1884 C SER A 132 105.815 -10.449 -8.980 1.00 1.00 C ATOM 1885 O SER A 132 105.478 -9.287 -8.750 1.00 1.00 O ATOM 1886 CB SER A 132 104.152 -12.247 -9.530 1.00 1.00 C ATOM 1887 OG SER A 132 103.632 -11.220 -10.362 1.00 1.00 O ATOM 0 H SER A 132 103.866 -10.248 -7.328 1.00 1.00 H new ATOM 0 HA SER A 132 105.727 -12.376 -8.066 1.00 1.00 H new ATOM 0 HB2 SER A 132 104.744 -12.944 -10.123 1.00 1.00 H new ATOM 0 HB3 SER A 132 103.336 -12.818 -9.088 1.00 1.00 H new ATOM 0 HG SER A 132 103.080 -11.618 -11.067 1.00 1.00 H new ATOM 1893 N VAL A 133 106.908 -10.769 -9.673 1.00 1.00 N ATOM 1894 CA VAL A 133 107.804 -9.759 -10.234 1.00 1.00 C ATOM 1895 C VAL A 133 108.055 -10.047 -11.715 1.00 1.00 C ATOM 1896 O VAL A 133 108.154 -11.204 -12.123 1.00 1.00 O ATOM 1897 CB VAL A 133 109.121 -9.780 -9.461 1.00 1.00 C ATOM 1898 CG1 VAL A 133 110.052 -8.686 -9.990 1.00 1.00 C ATOM 1899 CG2 VAL A 133 108.815 -9.518 -7.993 1.00 1.00 C ATOM 0 H VAL A 133 107.196 -11.730 -9.860 1.00 1.00 H new ATOM 0 HA VAL A 133 107.347 -8.773 -10.147 1.00 1.00 H new ATOM 0 HB VAL A 133 109.610 -10.747 -9.582 1.00 1.00 H new ATOM 0 HG11 VAL A 133 110.990 -8.706 -9.435 1.00 1.00 H new ATOM 0 HG12 VAL A 133 110.253 -8.859 -11.047 1.00 1.00 H new ATOM 0 HG13 VAL A 133 109.577 -7.713 -9.865 1.00 1.00 H new ATOM 0 HG21 VAL A 133 109.742 -9.528 -7.421 1.00 1.00 H new ATOM 0 HG22 VAL A 133 108.336 -8.545 -7.889 1.00 1.00 H new ATOM 0 HG23 VAL A 133 108.148 -10.293 -7.616 1.00 1.00 H new ATOM 1903 N LYS A 134 108.128 -8.986 -12.511 1.00 1.00 N ATOM 1904 CA LYS A 134 108.337 -9.103 -13.940 1.00 1.00 C ATOM 1905 C LYS A 134 109.816 -9.228 -14.291 1.00 1.00 C ATOM 1906 O LYS A 134 110.335 -10.324 -14.506 1.00 1.00 O ATOM 1907 CB LYS A 134 107.763 -7.847 -14.572 1.00 1.00 C ATOM 1908 CG LYS A 134 108.127 -7.714 -16.057 1.00 1.00 C ATOM 1909 CD LYS A 134 107.883 -9.023 -16.809 1.00 1.00 C ATOM 1910 CE LYS A 134 108.227 -8.824 -18.287 1.00 1.00 C ATOM 1911 NZ LYS A 134 107.062 -8.228 -19.000 1.00 1.00 N ATOM 0 H LYS A 134 108.044 -8.025 -12.180 1.00 1.00 H new ATOM 0 HA LYS A 134 107.849 -10.004 -14.311 1.00 1.00 H new ATOM 0 HB2 LYS A 134 106.678 -7.855 -14.467 1.00 1.00 H new ATOM 0 HB3 LYS A 134 108.129 -6.973 -14.032 1.00 1.00 H new ATOM 0 HG2 LYS A 134 107.536 -6.917 -16.508 1.00 1.00 H new ATOM 0 HG3 LYS A 134 109.174 -7.427 -16.153 1.00 1.00 H new ATOM 0 HD2 LYS A 134 108.494 -9.820 -16.385 1.00 1.00 H new ATOM 0 HD3 LYS A 134 106.842 -9.329 -16.703 1.00 1.00 H new ATOM 0 HE2 LYS A 134 109.096 -8.173 -18.383 1.00 1.00 H new ATOM 0 HE3 LYS A 134 108.493 -9.779 -18.740 1.00 1.00 H new ATOM 0 HZ1 LYS A 134 107.300 -8.095 -20.004 1.00 1.00 H new ATOM 0 HZ2 LYS A 134 106.243 -8.865 -18.920 1.00 1.00 H new ATOM 0 HZ3 LYS A 134 106.828 -7.308 -18.575 1.00 1.00 H new