USER MOD reduce.3.24.130724 H: found=0, std=0, add=1034, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1036 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 147 GLN :FLIP amide:sc= -0.363 F(o=-1.9,f=-0.44) USER MOD Set 1.2: A 148 LYS NZ :NH3+ -125:sc= -0.0727 (180deg=-0.588) USER MOD Set 2.1: A 124 MET CE :methyl -167:sc= -1.44 (180deg=-2.15) USER MOD Set 2.2: A 144 MET CE :methyl -164:sc= -1.02 (180deg=-1.96!) USER MOD Set 3.1: A 58 ASN : amide:sc= -2 K(o=-2.5,f=-4.4) USER MOD Set 3.2: A 59 ASN : amide:sc= -0.526 K(o=-2.5,f=-3.6) USER MOD Set 4.1: A 36 MET CE :methyl 170:sc= -3.23! (180deg=-2.23!) USER MOD Set 4.2: A 75 GLN : amide:sc= -1.47 K(o=-4.7,f=-6.7!) USER MOD Set 5.1: A 5 THR OG1 : rot -157:sc= -0.257 USER MOD Set 5.2: A 8 GLN : amide:sc= -5.94! C(o=-6.2!,f=-10!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.203 X(o=-0.2,f=-0.081) USER MOD Single : A 21 LYS NZ :NH3+ 172:sc=-0.00292 (180deg=-0.115) USER MOD Single : A 24 THR OG1 : rot 53:sc= 1.18 USER MOD Single : A 26 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0533) USER MOD Single : A 29 THR OG1 : rot -84:sc= -1.03 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 78:sc= 1.24 USER MOD Single : A 41 GLN :FLIP amide:sc= -1.23 F(o=-2.7!,f=-1.2) USER MOD Single : A 42 ASN :FLIP amide:sc=-0.00711 F(o=-2.7,f=-0.0071) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.698 USER MOD Single : A 49 GLN :FLIP amide:sc= -2.8! C(o=-5.7!,f=-2.8!) USER MOD Single : A 57 ASN : amide:sc= -0.514 X(o=-0.51,f=-0.077) USER MOD Single : A 60 ASN :FLIP amide:sc= -0.0418 F(o=-0.99,f=-0.042) USER MOD Single : A 62 GLN :FLIP amide:sc= -2.52 F(o=-6.5!,f=-2.5) USER MOD Single : A 64 ASN : amide:sc= -0.994 K(o=-0.99,f=-4.8!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -51:sc= 0.739 USER MOD Single : A 72 MET CE :methyl 165:sc= -2.94! (180deg=-4.08!) USER MOD Single : A 74 LYS NZ :NH3+ 164:sc= -0.0485 (180deg=-0.295) USER MOD Single : A 85 MET CE :methyl -147:sc= -4.9! (180deg=-8.74!) USER MOD Single : A 90 LYS NZ :NH3+ -177:sc= -0.305 (180deg=-0.311) USER MOD Single : A 101 SER OG : rot 180:sc= -0.437 USER MOD Single : A 109 MET CE :methyl -133:sc= -0.481 (180deg=-2.98!) USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -170:sc= -0.205 USER MOD Single : A 135 MET CE :methyl 152:sc= -0.264 (180deg=-1.1) USER MOD Single : A 137 ASN : amide:sc= -3.04! C(o=-3!,f=-12!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.0613 USER MOD Single : A 146 SER OG : rot -30:sc= 0.793 USER MOD ----------------------------------------------------------------- ATOM 46 N LEU A 4 6.758 -6.617 10.004 1.00 0.37 N ATOM 47 CA LEU A 4 6.174 -7.351 8.886 1.00 0.29 C ATOM 48 C LEU A 4 5.781 -8.766 9.295 1.00 0.32 C ATOM 49 O LEU A 4 5.855 -9.123 10.471 1.00 0.36 O ATOM 50 CB LEU A 4 7.157 -7.393 7.717 1.00 0.22 C ATOM 51 CG LEU A 4 7.598 -6.023 7.200 1.00 0.25 C ATOM 52 CD1 LEU A 4 8.948 -5.636 7.779 1.00 0.37 C ATOM 53 CD2 LEU A 4 7.651 -6.019 5.685 1.00 0.27 C ATOM 0 HA LEU A 4 5.269 -6.829 8.576 1.00 0.29 H new ATOM 0 HB2 LEU A 4 8.041 -7.952 8.024 1.00 0.22 H new ATOM 0 HB3 LEU A 4 6.700 -7.946 6.896 1.00 0.22 H new ATOM 0 HG LEU A 4 6.864 -5.285 7.524 1.00 0.25 H new ATOM 0 HD11 LEU A 4 9.241 -4.658 7.397 1.00 0.37 H new ATOM 0 HD12 LEU A 4 8.879 -5.595 8.866 1.00 0.37 H new ATOM 0 HD13 LEU A 4 9.694 -6.377 7.490 1.00 0.37 H new ATOM 0 HD21 LEU A 4 7.967 -5.036 5.335 1.00 0.27 H new ATOM 0 HD22 LEU A 4 8.362 -6.771 5.344 1.00 0.27 H new ATOM 0 HD23 LEU A 4 6.663 -6.246 5.286 1.00 0.27 H new ATOM 65 N THR A 5 5.361 -9.573 8.321 1.00 0.32 N ATOM 66 CA THR A 5 4.950 -10.944 8.599 1.00 0.37 C ATOM 67 C THR A 5 6.112 -11.914 8.427 1.00 0.37 C ATOM 68 O THR A 5 6.700 -12.378 9.405 1.00 0.39 O ATOM 69 CB THR A 5 3.794 -11.384 7.678 1.00 0.42 C ATOM 70 OG1 THR A 5 4.133 -11.139 6.308 1.00 0.91 O ATOM 71 CG2 THR A 5 2.514 -10.645 8.024 1.00 0.91 C ATOM 0 H THR A 5 5.297 -9.301 7.340 1.00 0.32 H new ATOM 0 HA THR A 5 4.611 -10.965 9.635 1.00 0.37 H new ATOM 0 HB THR A 5 3.632 -12.452 7.827 1.00 0.42 H new ATOM 0 HG1 THR A 5 3.313 -11.066 5.776 1.00 0.91 H new ATOM 0 HG21 THR A 5 1.714 -10.973 7.360 1.00 0.91 H new ATOM 0 HG22 THR A 5 2.239 -10.858 9.057 1.00 0.91 H new ATOM 0 HG23 THR A 5 2.669 -9.573 7.903 1.00 0.91 H new ATOM 79 N GLU A 6 6.437 -12.195 7.169 1.00 0.35 N ATOM 80 CA GLU A 6 7.518 -13.107 6.816 1.00 0.35 C ATOM 81 C GLU A 6 7.535 -13.307 5.311 1.00 0.34 C ATOM 82 O GLU A 6 8.597 -13.424 4.703 1.00 0.32 O ATOM 83 CB GLU A 6 7.359 -14.456 7.524 1.00 0.40 C ATOM 84 CG GLU A 6 8.442 -15.463 7.170 1.00 0.94 C ATOM 85 CD GLU A 6 8.268 -16.787 7.889 1.00 1.48 C ATOM 86 OE1 GLU A 6 7.540 -17.656 7.364 1.00 1.55 O ATOM 87 OE2 GLU A 6 8.859 -16.954 8.976 1.00 2.21 O ATOM 0 H GLU A 6 5.956 -11.795 6.363 1.00 0.35 H new ATOM 0 HA GLU A 6 8.462 -12.669 7.141 1.00 0.35 H new ATOM 0 HB2 GLU A 6 7.364 -14.294 8.602 1.00 0.40 H new ATOM 0 HB3 GLU A 6 6.386 -14.877 7.270 1.00 0.40 H new ATOM 0 HG2 GLU A 6 8.435 -15.635 6.094 1.00 0.94 H new ATOM 0 HG3 GLU A 6 9.417 -15.044 7.419 1.00 0.94 H new ATOM 94 N GLU A 7 6.346 -13.358 4.716 1.00 0.38 N ATOM 95 CA GLU A 7 6.234 -13.508 3.273 1.00 0.40 C ATOM 96 C GLU A 7 6.822 -12.276 2.600 1.00 0.35 C ATOM 97 O GLU A 7 7.678 -12.379 1.717 1.00 0.33 O ATOM 98 CB GLU A 7 4.772 -13.703 2.860 1.00 0.46 C ATOM 99 CG GLU A 7 3.824 -12.663 3.436 1.00 0.49 C ATOM 100 CD GLU A 7 2.376 -12.932 3.078 1.00 0.56 C ATOM 101 OE1 GLU A 7 1.940 -12.487 1.995 1.00 0.60 O ATOM 102 OE2 GLU A 7 1.678 -13.589 3.879 1.00 0.62 O ATOM 0 H GLU A 7 5.455 -13.298 5.208 1.00 0.38 H new ATOM 0 HA GLU A 7 6.787 -14.393 2.958 1.00 0.40 H new ATOM 0 HB2 GLU A 7 4.706 -13.678 1.772 1.00 0.46 H new ATOM 0 HB3 GLU A 7 4.445 -14.693 3.176 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.928 -12.643 4.521 1.00 0.49 H new ATOM 0 HG3 GLU A 7 4.108 -11.676 3.070 1.00 0.49 H new ATOM 109 N GLN A 8 6.357 -11.108 3.031 1.00 0.33 N ATOM 110 CA GLN A 8 6.849 -9.848 2.508 1.00 0.30 C ATOM 111 C GLN A 8 8.327 -9.713 2.828 1.00 0.24 C ATOM 112 O GLN A 8 9.104 -9.154 2.048 1.00 0.22 O ATOM 113 CB GLN A 8 6.075 -8.688 3.127 1.00 0.32 C ATOM 114 CG GLN A 8 5.909 -8.820 4.629 1.00 0.32 C ATOM 115 CD GLN A 8 4.931 -7.811 5.207 1.00 0.36 C ATOM 116 OE1 GLN A 8 4.288 -8.070 6.224 1.00 0.85 O ATOM 117 NE2 GLN A 8 4.805 -6.657 4.559 1.00 0.57 N ATOM 0 H GLN A 8 5.636 -11.013 3.746 1.00 0.33 H new ATOM 0 HA GLN A 8 6.709 -9.826 1.427 1.00 0.30 H new ATOM 0 HB2 GLN A 8 6.592 -7.754 2.905 1.00 0.32 H new ATOM 0 HB3 GLN A 8 5.091 -8.626 2.662 1.00 0.32 H new ATOM 0 HG2 GLN A 8 5.565 -9.827 4.864 1.00 0.32 H new ATOM 0 HG3 GLN A 8 6.879 -8.694 5.109 1.00 0.32 H new ATOM 0 HE21 GLN A 8 5.356 -6.481 3.719 1.00 0.57 H new ATOM 0 HE22 GLN A 8 4.157 -5.948 4.902 1.00 0.57 H new ATOM 126 N ILE A 9 8.702 -10.249 3.986 1.00 0.22 N ATOM 127 CA ILE A 9 10.080 -10.214 4.434 1.00 0.18 C ATOM 128 C ILE A 9 10.945 -10.986 3.462 1.00 0.17 C ATOM 129 O ILE A 9 12.028 -10.547 3.085 1.00 0.15 O ATOM 130 CB ILE A 9 10.236 -10.800 5.851 1.00 0.20 C ATOM 131 CG1 ILE A 9 9.419 -9.973 6.850 1.00 0.21 C ATOM 132 CG2 ILE A 9 11.706 -10.839 6.252 1.00 0.21 C ATOM 133 CD1 ILE A 9 9.511 -10.467 8.278 1.00 0.24 C ATOM 0 H ILE A 9 8.063 -10.714 4.630 1.00 0.22 H new ATOM 0 HA ILE A 9 10.397 -9.172 4.471 1.00 0.18 H new ATOM 0 HB ILE A 9 9.858 -11.822 5.856 1.00 0.20 H new ATOM 0 HG12 ILE A 9 9.758 -8.938 6.812 1.00 0.21 H new ATOM 0 HG13 ILE A 9 8.374 -9.978 6.541 1.00 0.21 H new ATOM 0 HG21 ILE A 9 11.799 -11.255 7.255 1.00 0.21 H new ATOM 0 HG22 ILE A 9 12.259 -11.461 5.548 1.00 0.21 H new ATOM 0 HG23 ILE A 9 12.113 -9.828 6.240 1.00 0.21 H new ATOM 0 HD11 ILE A 9 8.906 -9.830 8.923 1.00 0.24 H new ATOM 0 HD12 ILE A 9 9.144 -11.492 8.333 1.00 0.24 H new ATOM 0 HD13 ILE A 9 10.549 -10.435 8.608 1.00 0.24 H new ATOM 145 N ALA A 10 10.437 -12.138 3.057 1.00 0.20 N ATOM 146 CA ALA A 10 11.133 -12.996 2.112 1.00 0.21 C ATOM 147 C ALA A 10 11.200 -12.330 0.747 1.00 0.20 C ATOM 148 O ALA A 10 12.055 -12.653 -0.077 1.00 0.19 O ATOM 149 CB ALA A 10 10.424 -14.338 2.006 1.00 0.26 C ATOM 0 H ALA A 10 9.538 -12.503 3.371 1.00 0.20 H new ATOM 0 HA ALA A 10 12.149 -13.161 2.470 1.00 0.21 H new ATOM 0 HB1 ALA A 10 10.953 -14.974 1.296 1.00 0.26 H new ATOM 0 HB2 ALA A 10 10.409 -14.820 2.984 1.00 0.26 H new ATOM 0 HB3 ALA A 10 9.401 -14.183 1.663 1.00 0.26 H new ATOM 155 N GLU A 11 10.282 -11.396 0.522 1.00 0.20 N ATOM 156 CA GLU A 11 10.213 -10.675 -0.746 1.00 0.21 C ATOM 157 C GLU A 11 11.400 -9.745 -0.926 1.00 0.18 C ATOM 158 O GLU A 11 12.307 -10.044 -1.698 1.00 0.18 O ATOM 159 CB GLU A 11 8.928 -9.862 -0.841 1.00 0.25 C ATOM 160 CG GLU A 11 8.416 -9.693 -2.263 1.00 0.29 C ATOM 161 CD GLU A 11 8.081 -11.016 -2.925 1.00 0.94 C ATOM 162 OE1 GLU A 11 6.972 -11.537 -2.684 1.00 0.84 O ATOM 163 OE2 GLU A 11 8.930 -11.531 -3.683 1.00 1.78 O ATOM 0 H GLU A 11 9.574 -11.119 1.202 1.00 0.20 H new ATOM 0 HA GLU A 11 10.230 -11.425 -1.537 1.00 0.21 H new ATOM 0 HB2 GLU A 11 8.157 -10.346 -0.242 1.00 0.25 H new ATOM 0 HB3 GLU A 11 9.098 -8.877 -0.406 1.00 0.25 H new ATOM 0 HG2 GLU A 11 7.528 -9.061 -2.252 1.00 0.29 H new ATOM 0 HG3 GLU A 11 9.169 -9.174 -2.857 1.00 0.29 H new ATOM 170 N PHE A 12 11.406 -8.606 -0.222 1.00 0.17 N ATOM 171 CA PHE A 12 12.513 -7.675 -0.370 1.00 0.17 C ATOM 172 C PHE A 12 13.820 -8.369 -0.050 1.00 0.14 C ATOM 173 O PHE A 12 14.885 -7.939 -0.483 1.00 0.15 O ATOM 174 CB PHE A 12 12.339 -6.408 0.468 1.00 0.20 C ATOM 175 CG PHE A 12 11.802 -6.612 1.852 1.00 0.18 C ATOM 176 CD1 PHE A 12 12.645 -6.925 2.905 1.00 0.21 C ATOM 177 CD2 PHE A 12 10.452 -6.452 2.102 1.00 0.24 C ATOM 178 CE1 PHE A 12 12.147 -7.076 4.185 1.00 0.23 C ATOM 179 CE2 PHE A 12 9.948 -6.606 3.375 1.00 0.26 C ATOM 180 CZ PHE A 12 10.795 -6.915 4.420 1.00 0.21 C ATOM 0 H PHE A 12 10.679 -8.320 0.433 1.00 0.17 H new ATOM 0 HA PHE A 12 12.527 -7.349 -1.410 1.00 0.17 H new ATOM 0 HB2 PHE A 12 13.305 -5.909 0.543 1.00 0.20 H new ATOM 0 HB3 PHE A 12 11.671 -5.731 -0.065 1.00 0.20 H new ATOM 0 HD1 PHE A 12 13.702 -7.052 2.724 1.00 0.21 H new ATOM 0 HD2 PHE A 12 9.785 -6.203 1.290 1.00 0.24 H new ATOM 0 HE1 PHE A 12 12.813 -7.319 5.000 1.00 0.23 H new ATOM 0 HE2 PHE A 12 8.890 -6.485 3.555 1.00 0.26 H new ATOM 0 HZ PHE A 12 10.402 -7.031 5.419 1.00 0.21 H new ATOM 190 N LYS A 13 13.732 -9.441 0.727 1.00 0.12 N ATOM 191 CA LYS A 13 14.907 -10.225 1.050 1.00 0.12 C ATOM 192 C LYS A 13 15.438 -10.860 -0.225 1.00 0.13 C ATOM 193 O LYS A 13 16.624 -10.771 -0.528 1.00 0.16 O ATOM 194 CB LYS A 13 14.568 -11.311 2.071 1.00 0.14 C ATOM 195 CG LYS A 13 15.625 -12.398 2.182 1.00 0.24 C ATOM 196 CD LYS A 13 16.919 -11.859 2.768 1.00 1.07 C ATOM 197 CE LYS A 13 18.059 -12.853 2.609 1.00 1.30 C ATOM 198 NZ LYS A 13 19.343 -12.315 3.137 1.00 2.27 N ATOM 0 H LYS A 13 12.864 -9.782 1.140 1.00 0.12 H new ATOM 0 HA LYS A 13 15.665 -9.574 1.487 1.00 0.12 H new ATOM 0 HB2 LYS A 13 14.432 -10.848 3.048 1.00 0.14 H new ATOM 0 HB3 LYS A 13 13.617 -11.768 1.799 1.00 0.14 H new ATOM 0 HG2 LYS A 13 15.251 -13.208 2.808 1.00 0.24 H new ATOM 0 HG3 LYS A 13 15.819 -12.820 1.196 1.00 0.24 H new ATOM 0 HD2 LYS A 13 17.180 -10.922 2.276 1.00 1.07 H new ATOM 0 HD3 LYS A 13 16.775 -11.634 3.825 1.00 1.07 H new ATOM 0 HE2 LYS A 13 17.810 -13.777 3.131 1.00 1.30 H new ATOM 0 HE3 LYS A 13 18.177 -13.105 1.555 1.00 1.30 H new ATOM 0 HZ1 LYS A 13 20.094 -13.023 3.010 1.00 2.27 H new ATOM 0 HZ2 LYS A 13 19.594 -11.447 2.622 1.00 2.27 H new ATOM 0 HZ3 LYS A 13 19.239 -12.099 4.149 1.00 2.27 H new ATOM 212 N ASP A 14 14.533 -11.484 -0.978 1.00 0.14 N ATOM 213 CA ASP A 14 14.892 -12.137 -2.229 1.00 0.16 C ATOM 214 C ASP A 14 15.322 -11.106 -3.264 1.00 0.16 C ATOM 215 O ASP A 14 16.230 -11.355 -4.059 1.00 0.17 O ATOM 216 CB ASP A 14 13.715 -12.972 -2.760 1.00 0.19 C ATOM 217 CG ASP A 14 12.739 -12.173 -3.605 1.00 0.20 C ATOM 218 OD1 ASP A 14 13.112 -11.768 -4.726 1.00 0.22 O ATOM 219 OD2 ASP A 14 11.593 -11.972 -3.153 1.00 0.22 O ATOM 0 H ASP A 14 13.543 -11.549 -0.739 1.00 0.14 H new ATOM 0 HA ASP A 14 15.731 -12.807 -2.038 1.00 0.16 H new ATOM 0 HB2 ASP A 14 14.105 -13.799 -3.353 1.00 0.19 H new ATOM 0 HB3 ASP A 14 13.180 -13.409 -1.917 1.00 0.19 H new ATOM 224 N ALA A 15 14.671 -9.944 -3.249 1.00 0.16 N ATOM 225 CA ALA A 15 14.998 -8.883 -4.192 1.00 0.17 C ATOM 226 C ALA A 15 16.380 -8.317 -3.895 1.00 0.16 C ATOM 227 O ALA A 15 17.150 -7.998 -4.798 1.00 0.20 O ATOM 228 CB ALA A 15 13.951 -7.781 -4.128 1.00 0.20 C ATOM 0 H ALA A 15 13.919 -9.717 -2.598 1.00 0.16 H new ATOM 0 HA ALA A 15 15.004 -9.301 -5.198 1.00 0.17 H new ATOM 0 HB1 ALA A 15 14.207 -6.994 -4.838 1.00 0.20 H new ATOM 0 HB2 ALA A 15 12.974 -8.193 -4.380 1.00 0.20 H new ATOM 0 HB3 ALA A 15 13.921 -7.366 -3.121 1.00 0.20 H new ATOM 234 N PHE A 16 16.669 -8.182 -2.613 1.00 0.14 N ATOM 235 CA PHE A 16 17.942 -7.658 -2.151 1.00 0.14 C ATOM 236 C PHE A 16 19.133 -8.471 -2.666 1.00 0.14 C ATOM 237 O PHE A 16 20.044 -7.929 -3.291 1.00 0.15 O ATOM 238 CB PHE A 16 17.946 -7.664 -0.625 1.00 0.15 C ATOM 239 CG PHE A 16 19.054 -6.861 -0.023 1.00 0.25 C ATOM 240 CD1 PHE A 16 18.922 -5.494 0.134 1.00 0.35 C ATOM 241 CD2 PHE A 16 20.221 -7.473 0.393 1.00 0.45 C ATOM 242 CE1 PHE A 16 19.938 -4.747 0.695 1.00 0.50 C ATOM 243 CE2 PHE A 16 21.243 -6.734 0.954 1.00 0.59 C ATOM 244 CZ PHE A 16 21.102 -5.367 1.106 1.00 0.59 C ATOM 0 H PHE A 16 16.027 -8.433 -1.862 1.00 0.14 H new ATOM 0 HA PHE A 16 18.051 -6.646 -2.541 1.00 0.14 H new ATOM 0 HB2 PHE A 16 16.992 -7.276 -0.267 1.00 0.15 H new ATOM 0 HB3 PHE A 16 18.024 -8.693 -0.275 1.00 0.15 H new ATOM 0 HD1 PHE A 16 18.014 -5.005 -0.186 1.00 0.35 H new ATOM 0 HD2 PHE A 16 20.335 -8.541 0.278 1.00 0.45 H new ATOM 0 HE1 PHE A 16 19.823 -3.680 0.812 1.00 0.50 H new ATOM 0 HE2 PHE A 16 22.151 -7.223 1.274 1.00 0.59 H new ATOM 0 HZ PHE A 16 21.899 -4.786 1.545 1.00 0.59 H new ATOM 254 N VAL A 17 19.113 -9.775 -2.398 1.00 0.16 N ATOM 255 CA VAL A 17 20.208 -10.667 -2.789 1.00 0.18 C ATOM 256 C VAL A 17 20.403 -10.708 -4.293 1.00 0.16 C ATOM 257 O VAL A 17 21.524 -10.622 -4.791 1.00 0.15 O ATOM 258 CB VAL A 17 19.973 -12.116 -2.287 1.00 0.22 C ATOM 259 CG1 VAL A 17 19.111 -12.118 -1.047 1.00 0.31 C ATOM 260 CG2 VAL A 17 19.335 -12.994 -3.358 1.00 0.28 C ATOM 0 H VAL A 17 18.348 -10.241 -1.910 1.00 0.16 H new ATOM 0 HA VAL A 17 21.104 -10.257 -2.323 1.00 0.18 H new ATOM 0 HB VAL A 17 20.951 -12.533 -2.048 1.00 0.22 H new ATOM 0 HG11 VAL A 17 18.958 -13.144 -0.712 1.00 0.31 H new ATOM 0 HG12 VAL A 17 19.605 -11.548 -0.260 1.00 0.31 H new ATOM 0 HG13 VAL A 17 18.147 -11.663 -1.274 1.00 0.31 H new ATOM 0 HG21 VAL A 17 19.188 -14.000 -2.964 1.00 0.28 H new ATOM 0 HG22 VAL A 17 18.372 -12.573 -3.647 1.00 0.28 H new ATOM 0 HG23 VAL A 17 19.988 -13.037 -4.230 1.00 0.28 H new ATOM 270 N GLN A 18 19.297 -10.821 -5.003 1.00 0.17 N ATOM 271 CA GLN A 18 19.320 -10.925 -6.441 1.00 0.18 C ATOM 272 C GLN A 18 19.930 -9.677 -7.068 1.00 0.15 C ATOM 273 O GLN A 18 20.280 -9.668 -8.248 1.00 0.18 O ATOM 274 CB GLN A 18 17.914 -11.193 -6.950 1.00 0.23 C ATOM 275 CG GLN A 18 16.971 -10.027 -6.784 1.00 0.19 C ATOM 276 CD GLN A 18 15.800 -10.097 -7.734 1.00 0.39 C ATOM 277 OE1 GLN A 18 15.837 -9.540 -8.831 1.00 1.02 O ATOM 278 NE2 GLN A 18 14.752 -10.794 -7.320 1.00 0.42 N ATOM 0 H GLN A 18 18.362 -10.843 -4.596 1.00 0.17 H new ATOM 0 HA GLN A 18 19.954 -11.762 -6.735 1.00 0.18 H new ATOM 0 HB2 GLN A 18 17.965 -11.459 -8.006 1.00 0.23 H new ATOM 0 HB3 GLN A 18 17.506 -12.056 -6.423 1.00 0.23 H new ATOM 0 HG2 GLN A 18 16.603 -10.004 -5.758 1.00 0.19 H new ATOM 0 HG3 GLN A 18 17.515 -9.097 -6.949 1.00 0.19 H new ATOM 0 HE21 GLN A 18 14.766 -11.239 -6.402 1.00 0.42 H new ATOM 0 HE22 GLN A 18 13.932 -10.886 -7.919 1.00 0.42 H new ATOM 287 N PHE A 19 20.054 -8.626 -6.264 1.00 0.12 N ATOM 288 CA PHE A 19 20.650 -7.378 -6.718 1.00 0.15 C ATOM 289 C PHE A 19 22.124 -7.310 -6.322 1.00 0.18 C ATOM 290 O PHE A 19 22.925 -6.655 -6.987 1.00 0.26 O ATOM 291 CB PHE A 19 19.893 -6.181 -6.138 1.00 0.16 C ATOM 292 CG PHE A 19 18.769 -5.700 -7.014 1.00 0.18 C ATOM 293 CD1 PHE A 19 17.720 -6.539 -7.342 1.00 0.26 C ATOM 294 CD2 PHE A 19 18.772 -4.410 -7.519 1.00 0.23 C ATOM 295 CE1 PHE A 19 16.691 -6.105 -8.154 1.00 0.28 C ATOM 296 CE2 PHE A 19 17.747 -3.969 -8.335 1.00 0.25 C ATOM 297 CZ PHE A 19 16.705 -4.818 -8.652 1.00 0.24 C ATOM 0 H PHE A 19 19.748 -8.616 -5.291 1.00 0.12 H new ATOM 0 HA PHE A 19 20.581 -7.343 -7.805 1.00 0.15 H new ATOM 0 HB2 PHE A 19 19.491 -6.454 -5.162 1.00 0.16 H new ATOM 0 HB3 PHE A 19 20.594 -5.362 -5.977 1.00 0.16 H new ATOM 0 HD1 PHE A 19 17.705 -7.548 -6.958 1.00 0.26 H new ATOM 0 HD2 PHE A 19 19.584 -3.742 -7.273 1.00 0.23 H new ATOM 0 HE1 PHE A 19 15.877 -6.771 -8.399 1.00 0.28 H new ATOM 0 HE2 PHE A 19 17.761 -2.962 -8.724 1.00 0.25 H new ATOM 0 HZ PHE A 19 15.903 -4.475 -9.288 1.00 0.24 H new ATOM 307 N ASP A 20 22.473 -7.993 -5.232 1.00 0.15 N ATOM 308 CA ASP A 20 23.851 -8.010 -4.746 1.00 0.19 C ATOM 309 C ASP A 20 24.639 -9.191 -5.313 1.00 0.27 C ATOM 310 O ASP A 20 25.392 -9.039 -6.274 1.00 0.37 O ATOM 311 CB ASP A 20 23.877 -8.069 -3.218 1.00 0.20 C ATOM 312 CG ASP A 20 25.239 -8.459 -2.683 1.00 0.29 C ATOM 313 OD1 ASP A 20 26.242 -7.854 -3.116 1.00 0.34 O ATOM 314 OD2 ASP A 20 25.304 -9.371 -1.830 1.00 0.40 O ATOM 0 H ASP A 20 21.821 -8.541 -4.670 1.00 0.15 H new ATOM 0 HA ASP A 20 24.324 -7.089 -5.087 1.00 0.19 H new ATOM 0 HB2 ASP A 20 23.595 -7.097 -2.814 1.00 0.20 H new ATOM 0 HB3 ASP A 20 23.133 -8.787 -2.871 1.00 0.20 H new ATOM 319 N LYS A 21 24.440 -10.366 -4.715 1.00 0.35 N ATOM 320 CA LYS A 21 25.140 -11.582 -5.127 1.00 0.45 C ATOM 321 C LYS A 21 26.617 -11.310 -5.406 1.00 0.46 C ATOM 322 O LYS A 21 27.091 -11.474 -6.531 1.00 0.84 O ATOM 323 CB LYS A 21 24.471 -12.207 -6.352 1.00 0.53 C ATOM 324 CG LYS A 21 23.174 -12.933 -6.033 1.00 0.61 C ATOM 325 CD LYS A 21 23.425 -14.201 -5.232 1.00 0.69 C ATOM 326 CE LYS A 21 22.124 -14.833 -4.764 1.00 0.83 C ATOM 327 NZ LYS A 21 21.231 -15.176 -5.905 1.00 1.65 N ATOM 0 H LYS A 21 23.794 -10.501 -3.937 1.00 0.35 H new ATOM 0 HA LYS A 21 25.080 -12.290 -4.300 1.00 0.45 H new ATOM 0 HB2 LYS A 21 24.269 -11.425 -7.084 1.00 0.53 H new ATOM 0 HB3 LYS A 21 25.165 -12.907 -6.817 1.00 0.53 H new ATOM 0 HG2 LYS A 21 22.515 -12.271 -5.471 1.00 0.61 H new ATOM 0 HG3 LYS A 21 22.659 -13.184 -6.960 1.00 0.61 H new ATOM 0 HD2 LYS A 21 23.978 -14.915 -5.843 1.00 0.69 H new ATOM 0 HD3 LYS A 21 24.049 -13.969 -4.369 1.00 0.69 H new ATOM 0 HE2 LYS A 21 22.344 -15.734 -4.191 1.00 0.83 H new ATOM 0 HE3 LYS A 21 21.608 -14.147 -4.093 1.00 0.83 H new ATOM 0 HZ1 LYS A 21 20.419 -15.725 -5.557 1.00 1.65 H new ATOM 0 HZ2 LYS A 21 20.891 -14.302 -6.355 1.00 1.65 H new ATOM 0 HZ3 LYS A 21 21.758 -15.741 -6.601 1.00 1.65 H new ATOM 341 N GLU A 22 27.338 -10.896 -4.366 1.00 0.42 N ATOM 342 CA GLU A 22 28.768 -10.607 -4.475 1.00 0.47 C ATOM 343 C GLU A 22 29.478 -10.859 -3.148 1.00 0.45 C ATOM 344 O GLU A 22 30.687 -10.653 -3.034 1.00 0.53 O ATOM 345 CB GLU A 22 29.000 -9.159 -4.912 1.00 0.46 C ATOM 346 CG GLU A 22 28.582 -8.874 -6.346 1.00 0.66 C ATOM 347 CD GLU A 22 28.794 -7.426 -6.740 1.00 1.52 C ATOM 348 OE1 GLU A 22 29.921 -7.083 -7.155 1.00 1.49 O ATOM 349 OE2 GLU A 22 27.834 -6.635 -6.635 1.00 2.47 O ATOM 0 H GLU A 22 26.953 -10.752 -3.432 1.00 0.42 H new ATOM 0 HA GLU A 22 29.181 -11.276 -5.230 1.00 0.47 H new ATOM 0 HB2 GLU A 22 28.450 -8.496 -4.245 1.00 0.46 H new ATOM 0 HB3 GLU A 22 30.057 -8.920 -4.798 1.00 0.46 H new ATOM 0 HG2 GLU A 22 29.149 -9.516 -7.020 1.00 0.66 H new ATOM 0 HG3 GLU A 22 27.530 -9.130 -6.471 1.00 0.66 H new ATOM 356 N GLY A 23 28.724 -11.303 -2.146 1.00 0.48 N ATOM 357 CA GLY A 23 29.305 -11.565 -0.840 1.00 0.51 C ATOM 358 C GLY A 23 29.229 -10.356 0.069 1.00 0.45 C ATOM 359 O GLY A 23 29.854 -10.323 1.128 1.00 0.72 O ATOM 0 H GLY A 23 27.723 -11.486 -2.215 1.00 0.48 H new ATOM 0 HA2 GLY A 23 28.785 -12.402 -0.374 1.00 0.51 H new ATOM 0 HA3 GLY A 23 30.347 -11.863 -0.960 1.00 0.51 H new ATOM 363 N THR A 24 28.456 -9.361 -0.354 1.00 0.33 N ATOM 364 CA THR A 24 28.286 -8.133 0.415 1.00 0.33 C ATOM 365 C THR A 24 26.841 -7.657 0.335 1.00 0.27 C ATOM 366 O THR A 24 26.438 -7.044 -0.649 1.00 0.25 O ATOM 367 CB THR A 24 29.218 -7.015 -0.094 1.00 0.43 C ATOM 368 OG1 THR A 24 28.800 -6.576 -1.393 1.00 0.52 O ATOM 369 CG2 THR A 24 30.657 -7.500 -0.169 1.00 0.44 C ATOM 0 H THR A 24 27.935 -9.382 -1.230 1.00 0.33 H new ATOM 0 HA THR A 24 28.545 -8.356 1.450 1.00 0.33 H new ATOM 0 HB THR A 24 29.161 -6.185 0.610 1.00 0.43 H new ATOM 0 HG1 THR A 24 27.848 -6.344 -1.369 1.00 0.52 H new ATOM 0 HG21 THR A 24 31.294 -6.693 -0.531 1.00 0.44 H new ATOM 0 HG22 THR A 24 30.989 -7.808 0.822 1.00 0.44 H new ATOM 0 HG23 THR A 24 30.720 -8.347 -0.852 1.00 0.44 H new ATOM 377 N GLY A 25 26.065 -7.947 1.375 1.00 0.27 N ATOM 378 CA GLY A 25 24.663 -7.560 1.396 1.00 0.24 C ATOM 379 C GLY A 25 24.444 -6.065 1.494 1.00 0.20 C ATOM 380 O GLY A 25 23.965 -5.569 2.514 1.00 0.21 O ATOM 0 H GLY A 25 26.382 -8.445 2.207 1.00 0.27 H new ATOM 0 HA2 GLY A 25 24.180 -7.930 0.492 1.00 0.24 H new ATOM 0 HA3 GLY A 25 24.174 -8.046 2.240 1.00 0.24 H new ATOM 384 N LYS A 26 24.789 -5.345 0.434 1.00 0.16 N ATOM 385 CA LYS A 26 24.604 -3.902 0.396 1.00 0.14 C ATOM 386 C LYS A 26 24.393 -3.443 -1.038 1.00 0.14 C ATOM 387 O LYS A 26 25.292 -3.549 -1.873 1.00 0.17 O ATOM 388 CB LYS A 26 25.797 -3.150 0.998 1.00 0.17 C ATOM 389 CG LYS A 26 26.540 -3.902 2.088 1.00 0.37 C ATOM 390 CD LYS A 26 27.885 -3.258 2.388 1.00 0.50 C ATOM 391 CE LYS A 26 28.462 -3.754 3.704 1.00 0.56 C ATOM 392 NZ LYS A 26 28.614 -5.234 3.722 1.00 1.37 N ATOM 0 H LYS A 26 25.199 -5.739 -0.412 1.00 0.16 H new ATOM 0 HA LYS A 26 23.724 -3.673 0.998 1.00 0.14 H new ATOM 0 HB2 LYS A 26 26.498 -2.911 0.199 1.00 0.17 H new ATOM 0 HB3 LYS A 26 25.443 -2.203 1.406 1.00 0.17 H new ATOM 0 HG2 LYS A 26 25.935 -3.924 2.994 1.00 0.37 H new ATOM 0 HG3 LYS A 26 26.691 -4.937 1.780 1.00 0.37 H new ATOM 0 HD2 LYS A 26 28.582 -3.477 1.579 1.00 0.50 H new ATOM 0 HD3 LYS A 26 27.770 -2.175 2.426 1.00 0.50 H new ATOM 0 HE2 LYS A 26 29.433 -3.288 3.873 1.00 0.56 H new ATOM 0 HE3 LYS A 26 27.813 -3.446 4.524 1.00 0.56 H new ATOM 0 HZ1 LYS A 26 29.103 -5.522 4.593 1.00 1.37 H new ATOM 0 HZ2 LYS A 26 27.675 -5.680 3.688 1.00 1.37 H new ATOM 0 HZ3 LYS A 26 29.170 -5.536 2.897 1.00 1.37 H new ATOM 406 N ILE A 27 23.204 -2.937 -1.318 1.00 0.16 N ATOM 407 CA ILE A 27 22.878 -2.460 -2.659 1.00 0.19 C ATOM 408 C ILE A 27 23.007 -0.946 -2.746 1.00 0.19 C ATOM 409 O ILE A 27 22.750 -0.236 -1.777 1.00 0.22 O ATOM 410 CB ILE A 27 21.454 -2.865 -3.084 1.00 0.23 C ATOM 411 CG1 ILE A 27 20.445 -2.473 -2.008 1.00 0.28 C ATOM 412 CG2 ILE A 27 21.386 -4.359 -3.362 1.00 0.32 C ATOM 413 CD1 ILE A 27 19.057 -2.211 -2.547 1.00 0.34 C ATOM 0 H ILE A 27 22.448 -2.844 -0.640 1.00 0.16 H new ATOM 0 HA ILE A 27 23.592 -2.929 -3.336 1.00 0.19 H new ATOM 0 HB ILE A 27 21.203 -2.333 -4.002 1.00 0.23 H new ATOM 0 HG12 ILE A 27 20.393 -3.268 -1.264 1.00 0.28 H new ATOM 0 HG13 ILE A 27 20.801 -1.579 -1.496 1.00 0.28 H new ATOM 0 HG21 ILE A 27 20.373 -4.628 -3.661 1.00 0.32 H new ATOM 0 HG22 ILE A 27 22.080 -4.612 -4.164 1.00 0.32 H new ATOM 0 HG23 ILE A 27 21.656 -4.909 -2.461 1.00 0.32 H new ATOM 0 HD11 ILE A 27 18.394 -1.938 -1.726 1.00 0.34 H new ATOM 0 HD12 ILE A 27 19.095 -1.396 -3.270 1.00 0.34 H new ATOM 0 HD13 ILE A 27 18.680 -3.110 -3.034 1.00 0.34 H new ATOM 425 N ALA A 28 23.395 -0.456 -3.916 1.00 0.19 N ATOM 426 CA ALA A 28 23.560 0.976 -4.131 1.00 0.21 C ATOM 427 C ALA A 28 22.216 1.693 -4.078 1.00 0.20 C ATOM 428 O ALA A 28 21.239 1.251 -4.682 1.00 0.20 O ATOM 429 CB ALA A 28 24.251 1.235 -5.461 1.00 0.23 C ATOM 0 H ALA A 28 23.602 -1.031 -4.733 1.00 0.19 H new ATOM 0 HA ALA A 28 24.185 1.371 -3.331 1.00 0.21 H new ATOM 0 HB1 ALA A 28 24.367 2.309 -5.608 1.00 0.23 H new ATOM 0 HB2 ALA A 28 25.232 0.761 -5.460 1.00 0.23 H new ATOM 0 HB3 ALA A 28 23.649 0.821 -6.270 1.00 0.23 H new ATOM 435 N THR A 29 22.179 2.798 -3.337 1.00 0.21 N ATOM 436 CA THR A 29 20.964 3.591 -3.183 1.00 0.22 C ATOM 437 C THR A 29 20.415 4.056 -4.529 1.00 0.22 C ATOM 438 O THR A 29 19.212 4.280 -4.671 1.00 0.22 O ATOM 439 CB THR A 29 21.214 4.826 -2.301 1.00 0.26 C ATOM 440 OG1 THR A 29 22.149 5.704 -2.938 1.00 0.28 O ATOM 441 CG2 THR A 29 21.746 4.419 -0.936 1.00 0.28 C ATOM 0 H THR A 29 22.984 3.166 -2.830 1.00 0.21 H new ATOM 0 HA THR A 29 20.231 2.941 -2.706 1.00 0.22 H new ATOM 0 HB THR A 29 20.264 5.343 -2.165 1.00 0.26 H new ATOM 0 HG1 THR A 29 23.062 5.410 -2.738 1.00 0.28 H new ATOM 0 HG21 THR A 29 21.915 5.310 -0.331 1.00 0.28 H new ATOM 0 HG22 THR A 29 21.020 3.775 -0.440 1.00 0.28 H new ATOM 0 HG23 THR A 29 22.685 3.880 -1.058 1.00 0.28 H new ATOM 449 N ARG A 30 21.300 4.210 -5.510 1.00 0.23 N ATOM 450 CA ARG A 30 20.894 4.647 -6.842 1.00 0.25 C ATOM 451 C ARG A 30 19.975 3.615 -7.486 1.00 0.26 C ATOM 452 O ARG A 30 19.265 3.908 -8.449 1.00 0.43 O ATOM 453 CB ARG A 30 22.125 4.879 -7.723 1.00 0.29 C ATOM 454 CG ARG A 30 21.791 5.372 -9.123 1.00 1.36 C ATOM 455 CD ARG A 30 23.048 5.710 -9.909 1.00 1.46 C ATOM 456 NE ARG A 30 23.803 6.797 -9.292 1.00 1.85 N ATOM 457 CZ ARG A 30 24.904 7.322 -9.821 1.00 2.23 C ATOM 458 NH1 ARG A 30 25.382 6.856 -10.967 1.00 2.10 N ATOM 459 NH2 ARG A 30 25.529 8.315 -9.203 1.00 3.19 N ATOM 0 H ARG A 30 22.300 4.039 -5.408 1.00 0.23 H new ATOM 0 HA ARG A 30 20.349 5.586 -6.745 1.00 0.25 H new ATOM 0 HB2 ARG A 30 22.777 5.605 -7.237 1.00 0.29 H new ATOM 0 HB3 ARG A 30 22.687 3.948 -7.800 1.00 0.29 H new ATOM 0 HG2 ARG A 30 21.223 4.607 -9.653 1.00 1.36 H new ATOM 0 HG3 ARG A 30 21.154 6.254 -9.057 1.00 1.36 H new ATOM 0 HD2 ARG A 30 23.680 4.825 -9.981 1.00 1.46 H new ATOM 0 HD3 ARG A 30 22.775 5.990 -10.926 1.00 1.46 H new ATOM 0 HE ARG A 30 23.467 7.174 -8.406 1.00 1.85 H new ATOM 0 HH11 ARG A 30 24.905 6.092 -11.446 1.00 2.10 H new ATOM 0 HH12 ARG A 30 26.227 7.261 -11.370 1.00 2.10 H new ATOM 0 HH21 ARG A 30 25.165 8.676 -8.321 1.00 3.19 H new ATOM 0 HH22 ARG A 30 26.374 8.717 -9.609 1.00 3.19 H new ATOM 473 N GLU A 31 19.994 2.407 -6.936 1.00 0.17 N ATOM 474 CA GLU A 31 19.169 1.318 -7.440 1.00 0.18 C ATOM 475 C GLU A 31 18.212 0.831 -6.353 1.00 0.16 C ATOM 476 O GLU A 31 17.755 -0.312 -6.369 1.00 0.18 O ATOM 477 CB GLU A 31 20.061 0.172 -7.923 1.00 0.20 C ATOM 478 CG GLU A 31 19.337 -0.847 -8.787 1.00 0.26 C ATOM 479 CD GLU A 31 20.290 -1.781 -9.507 1.00 0.29 C ATOM 480 OE1 GLU A 31 20.876 -2.661 -8.843 1.00 0.28 O ATOM 481 OE2 GLU A 31 20.451 -1.632 -10.737 1.00 0.44 O ATOM 0 H GLU A 31 20.576 2.157 -6.136 1.00 0.17 H new ATOM 0 HA GLU A 31 18.577 1.680 -8.280 1.00 0.18 H new ATOM 0 HB2 GLU A 31 20.895 0.587 -8.489 1.00 0.20 H new ATOM 0 HB3 GLU A 31 20.485 -0.336 -7.057 1.00 0.20 H new ATOM 0 HG2 GLU A 31 18.662 -1.433 -8.163 1.00 0.26 H new ATOM 0 HG3 GLU A 31 18.722 -0.325 -9.520 1.00 0.26 H new ATOM 488 N LEU A 32 17.916 1.718 -5.407 1.00 0.17 N ATOM 489 CA LEU A 32 17.017 1.400 -4.303 1.00 0.19 C ATOM 490 C LEU A 32 15.558 1.486 -4.743 1.00 0.18 C ATOM 491 O LEU A 32 14.742 0.617 -4.415 1.00 0.17 O ATOM 492 CB LEU A 32 17.264 2.359 -3.135 1.00 0.24 C ATOM 493 CG LEU A 32 16.221 2.306 -2.019 1.00 0.29 C ATOM 494 CD1 LEU A 32 16.171 0.920 -1.402 1.00 0.39 C ATOM 495 CD2 LEU A 32 16.520 3.352 -0.958 1.00 0.38 C ATOM 0 H LEU A 32 18.288 2.667 -5.384 1.00 0.17 H new ATOM 0 HA LEU A 32 17.219 0.378 -3.983 1.00 0.19 H new ATOM 0 HB2 LEU A 32 18.242 2.141 -2.707 1.00 0.24 H new ATOM 0 HB3 LEU A 32 17.306 3.377 -3.524 1.00 0.24 H new ATOM 0 HG LEU A 32 15.245 2.525 -2.451 1.00 0.29 H new ATOM 0 HD11 LEU A 32 15.423 0.901 -0.609 1.00 0.39 H new ATOM 0 HD12 LEU A 32 15.907 0.190 -2.167 1.00 0.39 H new ATOM 0 HD13 LEU A 32 17.147 0.672 -0.985 1.00 0.39 H new ATOM 0 HD21 LEU A 32 15.767 3.299 -0.172 1.00 0.38 H new ATOM 0 HD22 LEU A 32 17.505 3.165 -0.530 1.00 0.38 H new ATOM 0 HD23 LEU A 32 16.503 4.344 -1.410 1.00 0.38 H new ATOM 507 N GLY A 33 15.238 2.552 -5.473 1.00 0.22 N ATOM 508 CA GLY A 33 13.885 2.745 -5.955 1.00 0.23 C ATOM 509 C GLY A 33 13.330 1.501 -6.617 1.00 0.20 C ATOM 510 O GLY A 33 12.133 1.227 -6.535 1.00 0.19 O ATOM 0 H GLY A 33 15.895 3.286 -5.739 1.00 0.22 H new ATOM 0 HA2 GLY A 33 13.242 3.029 -5.122 1.00 0.23 H new ATOM 0 HA3 GLY A 33 13.869 3.571 -6.666 1.00 0.23 H new ATOM 514 N THR A 34 14.206 0.745 -7.268 1.00 0.19 N ATOM 515 CA THR A 34 13.806 -0.477 -7.951 1.00 0.18 C ATOM 516 C THR A 34 13.129 -1.458 -6.998 1.00 0.16 C ATOM 517 O THR A 34 12.045 -1.962 -7.288 1.00 0.17 O ATOM 518 CB THR A 34 15.014 -1.171 -8.608 1.00 0.21 C ATOM 519 OG1 THR A 34 15.787 -0.217 -9.347 1.00 0.26 O ATOM 520 CG2 THR A 34 14.554 -2.284 -9.537 1.00 0.23 C ATOM 0 H THR A 34 15.201 0.959 -7.337 1.00 0.19 H new ATOM 0 HA THR A 34 13.094 -0.183 -8.722 1.00 0.18 H new ATOM 0 HB THR A 34 15.630 -1.604 -7.820 1.00 0.21 H new ATOM 0 HG1 THR A 34 16.554 -0.667 -9.760 1.00 0.26 H new ATOM 0 HG21 THR A 34 15.422 -2.761 -9.991 1.00 0.23 H new ATOM 0 HG22 THR A 34 13.990 -3.023 -8.968 1.00 0.23 H new ATOM 0 HG23 THR A 34 13.920 -1.866 -10.319 1.00 0.23 H new ATOM 528 N LEU A 35 13.772 -1.730 -5.861 1.00 0.13 N ATOM 529 CA LEU A 35 13.218 -2.664 -4.882 1.00 0.12 C ATOM 530 C LEU A 35 11.906 -2.170 -4.294 1.00 0.14 C ATOM 531 O LEU A 35 10.892 -2.859 -4.392 1.00 0.15 O ATOM 532 CB LEU A 35 14.218 -2.940 -3.757 1.00 0.13 C ATOM 533 CG LEU A 35 15.125 -4.155 -3.982 1.00 0.14 C ATOM 534 CD1 LEU A 35 15.687 -4.158 -5.390 1.00 0.18 C ATOM 535 CD2 LEU A 35 16.248 -4.176 -2.958 1.00 0.20 C ATOM 0 H LEU A 35 14.668 -1.321 -5.598 1.00 0.13 H new ATOM 0 HA LEU A 35 13.017 -3.592 -5.418 1.00 0.12 H new ATOM 0 HB2 LEU A 35 14.844 -2.058 -3.623 1.00 0.13 H new ATOM 0 HB3 LEU A 35 13.667 -3.084 -2.828 1.00 0.13 H new ATOM 0 HG LEU A 35 14.524 -5.056 -3.856 1.00 0.14 H new ATOM 0 HD11 LEU A 35 16.327 -5.030 -5.524 1.00 0.18 H new ATOM 0 HD12 LEU A 35 14.868 -4.195 -6.109 1.00 0.18 H new ATOM 0 HD13 LEU A 35 16.270 -3.251 -5.551 1.00 0.18 H new ATOM 0 HD21 LEU A 35 16.883 -5.045 -3.132 1.00 0.20 H new ATOM 0 HD22 LEU A 35 16.843 -3.267 -3.052 1.00 0.20 H new ATOM 0 HD23 LEU A 35 15.825 -4.231 -1.955 1.00 0.20 H new ATOM 547 N MET A 36 11.906 -0.975 -3.703 1.00 0.17 N ATOM 548 CA MET A 36 10.681 -0.449 -3.107 1.00 0.21 C ATOM 549 C MET A 36 9.524 -0.536 -4.093 1.00 0.23 C ATOM 550 O MET A 36 8.384 -0.779 -3.699 1.00 0.26 O ATOM 551 CB MET A 36 10.864 0.979 -2.586 1.00 0.25 C ATOM 552 CG MET A 36 11.943 1.774 -3.297 1.00 0.21 C ATOM 553 SD MET A 36 12.173 3.419 -2.589 1.00 0.30 S ATOM 554 CE MET A 36 12.242 3.054 -0.837 1.00 0.73 C ATOM 0 H MET A 36 12.721 -0.366 -3.625 1.00 0.17 H new ATOM 0 HA MET A 36 10.442 -1.071 -2.244 1.00 0.21 H new ATOM 0 HB2 MET A 36 9.917 1.511 -2.680 1.00 0.25 H new ATOM 0 HB3 MET A 36 11.102 0.937 -1.523 1.00 0.25 H new ATOM 0 HG2 MET A 36 12.884 1.227 -3.248 1.00 0.21 H new ATOM 0 HG3 MET A 36 11.684 1.869 -4.351 1.00 0.21 H new ATOM 0 HE1 MET A 36 12.557 3.944 -0.292 1.00 0.73 H new ATOM 0 HE2 MET A 36 11.256 2.746 -0.490 1.00 0.73 H new ATOM 0 HE3 MET A 36 12.956 2.249 -0.661 1.00 0.73 H new ATOM 564 N ARG A 37 9.816 -0.341 -5.375 1.00 0.23 N ATOM 565 CA ARG A 37 8.787 -0.451 -6.400 1.00 0.27 C ATOM 566 C ARG A 37 8.351 -1.907 -6.528 1.00 0.25 C ATOM 567 O ARG A 37 7.161 -2.220 -6.493 1.00 0.28 O ATOM 568 CB ARG A 37 9.304 0.059 -7.748 1.00 0.31 C ATOM 569 CG ARG A 37 9.471 1.568 -7.809 1.00 0.37 C ATOM 570 CD ARG A 37 10.151 2.001 -9.097 1.00 0.43 C ATOM 571 NE ARG A 37 10.354 3.446 -9.149 1.00 0.53 N ATOM 572 CZ ARG A 37 11.235 4.040 -9.949 1.00 0.71 C ATOM 573 NH1 ARG A 37 11.996 3.314 -10.759 1.00 0.94 N ATOM 574 NH2 ARG A 37 11.356 5.360 -9.940 1.00 0.79 N ATOM 0 H ARG A 37 10.745 -0.109 -5.725 1.00 0.23 H new ATOM 0 HA ARG A 37 7.935 0.163 -6.107 1.00 0.27 H new ATOM 0 HB2 ARG A 37 10.264 -0.412 -7.961 1.00 0.31 H new ATOM 0 HB3 ARG A 37 8.615 -0.253 -8.533 1.00 0.31 H new ATOM 0 HG2 ARG A 37 8.495 2.047 -7.733 1.00 0.37 H new ATOM 0 HG3 ARG A 37 10.059 1.905 -6.955 1.00 0.37 H new ATOM 0 HD2 ARG A 37 11.113 1.496 -9.187 1.00 0.43 H new ATOM 0 HD3 ARG A 37 9.547 1.689 -9.949 1.00 0.43 H new ATOM 0 HE ARG A 37 9.788 4.033 -8.537 1.00 0.53 H new ATOM 0 HH11 ARG A 37 11.906 2.298 -10.769 1.00 0.94 H new ATOM 0 HH12 ARG A 37 12.671 3.772 -11.371 1.00 0.94 H new ATOM 0 HH21 ARG A 37 10.773 5.921 -9.319 1.00 0.79 H new ATOM 0 HH22 ARG A 37 12.032 5.814 -10.554 1.00 0.79 H new ATOM 588 N THR A 38 9.338 -2.790 -6.681 1.00 0.24 N ATOM 589 CA THR A 38 9.088 -4.223 -6.794 1.00 0.29 C ATOM 590 C THR A 38 8.341 -4.731 -5.565 1.00 0.26 C ATOM 591 O THR A 38 7.729 -5.800 -5.588 1.00 0.32 O ATOM 592 CB THR A 38 10.410 -5.005 -6.943 1.00 0.38 C ATOM 593 OG1 THR A 38 11.193 -4.443 -8.002 1.00 1.07 O ATOM 594 CG2 THR A 38 10.148 -6.477 -7.232 1.00 0.67 C ATOM 0 H THR A 38 10.324 -2.533 -6.730 1.00 0.24 H new ATOM 0 HA THR A 38 8.479 -4.384 -7.684 1.00 0.29 H new ATOM 0 HB THR A 38 10.955 -4.929 -6.002 1.00 0.38 H new ATOM 0 HG1 THR A 38 11.629 -3.623 -7.687 1.00 1.07 H new ATOM 0 HG21 THR A 38 11.098 -7.003 -7.332 1.00 0.67 H new ATOM 0 HG22 THR A 38 9.577 -6.913 -6.412 1.00 0.67 H new ATOM 0 HG23 THR A 38 9.582 -6.571 -8.159 1.00 0.67 H new ATOM 602 N LEU A 39 8.398 -3.946 -4.492 1.00 0.21 N ATOM 603 CA LEU A 39 7.729 -4.290 -3.244 1.00 0.26 C ATOM 604 C LEU A 39 6.264 -3.866 -3.283 1.00 0.33 C ATOM 605 O LEU A 39 5.365 -4.699 -3.162 1.00 0.83 O ATOM 606 CB LEU A 39 8.439 -3.631 -2.054 1.00 0.24 C ATOM 607 CG LEU A 39 9.536 -4.470 -1.388 1.00 0.25 C ATOM 608 CD1 LEU A 39 10.609 -4.874 -2.386 1.00 0.29 C ATOM 609 CD2 LEU A 39 10.146 -3.695 -0.230 1.00 0.41 C ATOM 0 H LEU A 39 8.905 -3.061 -4.464 1.00 0.21 H new ATOM 0 HA LEU A 39 7.773 -5.372 -3.122 1.00 0.26 H new ATOM 0 HB2 LEU A 39 8.879 -2.692 -2.391 1.00 0.24 H new ATOM 0 HB3 LEU A 39 7.691 -3.380 -1.302 1.00 0.24 H new ATOM 0 HG LEU A 39 9.083 -5.385 -1.007 1.00 0.25 H new ATOM 0 HD11 LEU A 39 11.371 -5.467 -1.881 1.00 0.29 H new ATOM 0 HD12 LEU A 39 10.160 -5.464 -3.184 1.00 0.29 H new ATOM 0 HD13 LEU A 39 11.067 -3.980 -2.810 1.00 0.29 H new ATOM 0 HD21 LEU A 39 10.925 -4.296 0.240 1.00 0.41 H new ATOM 0 HD22 LEU A 39 10.579 -2.766 -0.602 1.00 0.41 H new ATOM 0 HD23 LEU A 39 9.372 -3.467 0.503 1.00 0.41 H new ATOM 621 N GLY A 40 6.029 -2.569 -3.451 1.00 0.48 N ATOM 622 CA GLY A 40 4.670 -2.062 -3.507 1.00 0.54 C ATOM 623 C GLY A 40 4.604 -0.549 -3.468 1.00 0.44 C ATOM 624 O GLY A 40 3.647 0.052 -3.956 1.00 0.56 O ATOM 0 H GLY A 40 6.755 -1.860 -3.549 1.00 0.48 H new ATOM 0 HA2 GLY A 40 4.192 -2.418 -4.419 1.00 0.54 H new ATOM 0 HA3 GLY A 40 4.101 -2.467 -2.670 1.00 0.54 H new ATOM 628 N GLN A 41 5.627 0.068 -2.885 1.00 0.41 N ATOM 629 CA GLN A 41 5.683 1.522 -2.775 1.00 0.37 C ATOM 630 C GLN A 41 6.578 2.115 -3.855 1.00 0.29 C ATOM 631 O GLN A 41 7.756 1.773 -3.952 1.00 0.35 O ATOM 632 CB GLN A 41 6.199 1.932 -1.395 1.00 0.47 C ATOM 633 CG GLN A 41 5.186 1.739 -0.272 1.00 0.66 C ATOM 634 CD GLN A 41 4.724 0.298 -0.108 1.00 0.90 C ATOM 635 OE1 GLN A 41 5.629 -0.655 -0.307 1.00 1.79 O flip ATOM 636 NE2 GLN A 41 3.564 0.047 0.216 1.00 0.85 N flip ATOM 0 H GLN A 41 6.429 -0.416 -2.481 1.00 0.41 H new ATOM 0 HA GLN A 41 4.673 1.908 -2.909 1.00 0.37 H new ATOM 0 HB2 GLN A 41 7.094 1.353 -1.166 1.00 0.47 H new ATOM 0 HB3 GLN A 41 6.496 2.980 -1.426 1.00 0.47 H new ATOM 0 HG2 GLN A 41 5.626 2.079 0.665 1.00 0.66 H new ATOM 0 HG3 GLN A 41 4.318 2.370 -0.464 1.00 0.66 H new ATOM 0 HE21 GLN A 41 2.899 0.807 0.360 1.00 0.85 H new ATOM 0 HE22 GLN A 41 3.267 -0.921 0.341 1.00 0.85 H new ATOM 645 N ASN A 42 6.019 3.009 -4.663 1.00 0.34 N ATOM 646 CA ASN A 42 6.778 3.647 -5.727 1.00 0.29 C ATOM 647 C ASN A 42 7.315 5.001 -5.263 1.00 0.31 C ATOM 648 O ASN A 42 6.543 5.931 -5.025 1.00 0.36 O ATOM 649 CB ASN A 42 5.903 3.826 -6.967 1.00 0.34 C ATOM 650 CG ASN A 42 5.316 2.516 -7.458 1.00 0.43 C ATOM 651 OD1 ASN A 42 6.042 1.424 -7.248 1.00 1.03 O flip ATOM 652 ND2 ASN A 42 4.222 2.487 -8.021 1.00 0.96 N flip ATOM 0 H ASN A 42 5.045 3.306 -4.600 1.00 0.34 H new ATOM 0 HA ASN A 42 7.622 3.006 -5.981 1.00 0.29 H new ATOM 0 HB2 ASN A 42 5.094 4.520 -6.740 1.00 0.34 H new ATOM 0 HB3 ASN A 42 6.495 4.276 -7.764 1.00 0.34 H new ATOM 0 HD21 ASN A 42 3.698 3.351 -8.162 1.00 0.96 H new ATOM 0 HD22 ASN A 42 3.840 1.599 -8.347 1.00 0.96 H new ATOM 659 N PRO A 43 8.648 5.129 -5.129 1.00 0.30 N ATOM 660 CA PRO A 43 9.289 6.377 -4.692 1.00 0.35 C ATOM 661 C PRO A 43 9.366 7.427 -5.795 1.00 0.34 C ATOM 662 O PRO A 43 9.467 7.095 -6.976 1.00 0.52 O ATOM 663 CB PRO A 43 10.695 5.915 -4.322 1.00 0.40 C ATOM 664 CG PRO A 43 10.949 4.792 -5.262 1.00 0.35 C ATOM 665 CD PRO A 43 9.644 4.060 -5.356 1.00 0.27 C ATOM 0 HA PRO A 43 8.734 6.857 -3.886 1.00 0.35 H new ATOM 0 HB2 PRO A 43 11.426 6.714 -4.445 1.00 0.40 H new ATOM 0 HB3 PRO A 43 10.750 5.589 -3.283 1.00 0.40 H new ATOM 0 HG2 PRO A 43 11.267 5.159 -6.238 1.00 0.35 H new ATOM 0 HG3 PRO A 43 11.741 4.140 -4.893 1.00 0.35 H new ATOM 0 HD2 PRO A 43 9.515 3.588 -6.330 1.00 0.27 H new ATOM 0 HD3 PRO A 43 9.568 3.272 -4.607 1.00 0.27 H new ATOM 673 N THR A 44 9.317 8.695 -5.397 1.00 0.38 N ATOM 674 CA THR A 44 9.404 9.798 -6.345 1.00 0.38 C ATOM 675 C THR A 44 10.861 10.140 -6.636 1.00 0.34 C ATOM 676 O THR A 44 11.731 9.936 -5.791 1.00 0.33 O ATOM 677 CB THR A 44 8.688 11.056 -5.816 1.00 0.43 C ATOM 678 OG1 THR A 44 9.285 11.479 -4.584 1.00 0.43 O ATOM 679 CG2 THR A 44 7.206 10.786 -5.600 1.00 0.53 C ATOM 0 H THR A 44 9.217 8.983 -4.424 1.00 0.38 H new ATOM 0 HA THR A 44 8.912 9.474 -7.262 1.00 0.38 H new ATOM 0 HB THR A 44 8.793 11.845 -6.560 1.00 0.43 H new ATOM 0 HG1 THR A 44 8.825 12.280 -4.256 1.00 0.43 H new ATOM 0 HG21 THR A 44 6.722 11.689 -5.226 1.00 0.53 H new ATOM 0 HG22 THR A 44 6.748 10.493 -6.545 1.00 0.53 H new ATOM 0 HG23 THR A 44 7.085 9.982 -4.874 1.00 0.53 H new ATOM 687 N GLU A 45 11.128 10.650 -7.832 1.00 0.36 N ATOM 688 CA GLU A 45 12.488 11.009 -8.220 1.00 0.37 C ATOM 689 C GLU A 45 13.173 11.856 -7.146 1.00 0.33 C ATOM 690 O GLU A 45 14.323 11.606 -6.784 1.00 0.30 O ATOM 691 CB GLU A 45 12.474 11.768 -9.550 1.00 0.43 C ATOM 692 CG GLU A 45 13.861 12.130 -10.058 1.00 0.48 C ATOM 693 CD GLU A 45 13.823 12.855 -11.388 1.00 0.58 C ATOM 694 OE1 GLU A 45 13.750 14.102 -11.383 1.00 0.63 O ATOM 695 OE2 GLU A 45 13.869 12.176 -12.436 1.00 0.66 O ATOM 0 H GLU A 45 10.424 10.824 -8.549 1.00 0.36 H new ATOM 0 HA GLU A 45 13.055 10.085 -8.334 1.00 0.37 H new ATOM 0 HB2 GLU A 45 11.968 11.160 -10.300 1.00 0.43 H new ATOM 0 HB3 GLU A 45 11.890 12.680 -9.432 1.00 0.43 H new ATOM 0 HG2 GLU A 45 14.362 12.757 -9.321 1.00 0.48 H new ATOM 0 HG3 GLU A 45 14.455 11.222 -10.160 1.00 0.48 H new ATOM 702 N ALA A 46 12.447 12.843 -6.630 1.00 0.35 N ATOM 703 CA ALA A 46 12.977 13.752 -5.615 1.00 0.35 C ATOM 704 C ALA A 46 13.410 13.030 -4.337 1.00 0.32 C ATOM 705 O ALA A 46 14.543 13.188 -3.882 1.00 0.33 O ATOM 706 CB ALA A 46 11.945 14.819 -5.285 1.00 0.40 C ATOM 0 H ALA A 46 11.482 13.036 -6.900 1.00 0.35 H new ATOM 0 HA ALA A 46 13.870 14.214 -6.036 1.00 0.35 H new ATOM 0 HB1 ALA A 46 12.347 15.492 -4.528 1.00 0.40 H new ATOM 0 HB2 ALA A 46 11.707 15.386 -6.185 1.00 0.40 H new ATOM 0 HB3 ALA A 46 11.040 14.345 -4.905 1.00 0.40 H new ATOM 712 N GLU A 47 12.511 12.245 -3.754 1.00 0.30 N ATOM 713 CA GLU A 47 12.818 11.535 -2.517 1.00 0.30 C ATOM 714 C GLU A 47 13.992 10.578 -2.702 1.00 0.26 C ATOM 715 O GLU A 47 14.739 10.311 -1.762 1.00 0.26 O ATOM 716 CB GLU A 47 11.592 10.776 -2.002 1.00 0.33 C ATOM 717 CG GLU A 47 11.170 9.610 -2.878 1.00 0.37 C ATOM 718 CD GLU A 47 10.037 8.806 -2.269 1.00 0.88 C ATOM 719 OE1 GLU A 47 8.864 9.188 -2.468 1.00 1.43 O ATOM 720 OE2 GLU A 47 10.323 7.796 -1.593 1.00 1.15 O ATOM 0 H GLU A 47 11.570 12.084 -4.114 1.00 0.30 H new ATOM 0 HA GLU A 47 13.102 12.281 -1.775 1.00 0.30 H new ATOM 0 HB2 GLU A 47 11.803 10.405 -0.999 1.00 0.33 H new ATOM 0 HB3 GLU A 47 10.757 11.472 -1.915 1.00 0.33 H new ATOM 0 HG2 GLU A 47 10.861 9.986 -3.853 1.00 0.37 H new ATOM 0 HG3 GLU A 47 12.026 8.956 -3.045 1.00 0.37 H new ATOM 727 N LEU A 48 14.149 10.060 -3.912 1.00 0.24 N ATOM 728 CA LEU A 48 15.236 9.138 -4.206 1.00 0.22 C ATOM 729 C LEU A 48 16.598 9.809 -4.069 1.00 0.20 C ATOM 730 O LEU A 48 17.446 9.358 -3.304 1.00 0.19 O ATOM 731 CB LEU A 48 15.088 8.591 -5.624 1.00 0.25 C ATOM 732 CG LEU A 48 13.879 7.685 -5.849 1.00 0.27 C ATOM 733 CD1 LEU A 48 13.589 7.551 -7.335 1.00 0.31 C ATOM 734 CD2 LEU A 48 14.119 6.318 -5.227 1.00 0.29 C ATOM 0 H LEU A 48 13.539 10.262 -4.704 1.00 0.24 H new ATOM 0 HA LEU A 48 15.180 8.325 -3.482 1.00 0.22 H new ATOM 0 HB2 LEU A 48 15.026 9.431 -6.316 1.00 0.25 H new ATOM 0 HB3 LEU A 48 15.991 8.035 -5.878 1.00 0.25 H new ATOM 0 HG LEU A 48 13.011 8.135 -5.367 1.00 0.27 H new ATOM 0 HD11 LEU A 48 12.725 6.903 -7.480 1.00 0.31 H new ATOM 0 HD12 LEU A 48 13.379 8.535 -7.755 1.00 0.31 H new ATOM 0 HD13 LEU A 48 14.455 7.119 -7.837 1.00 0.31 H new ATOM 0 HD21 LEU A 48 13.249 5.684 -5.396 1.00 0.29 H new ATOM 0 HD22 LEU A 48 14.996 5.859 -5.684 1.00 0.29 H new ATOM 0 HD23 LEU A 48 14.284 6.430 -4.155 1.00 0.29 H new ATOM 746 N GLN A 49 16.794 10.899 -4.806 1.00 0.23 N ATOM 747 CA GLN A 49 18.066 11.614 -4.790 1.00 0.25 C ATOM 748 C GLN A 49 18.459 12.075 -3.388 1.00 0.25 C ATOM 749 O GLN A 49 19.642 12.068 -3.045 1.00 0.26 O ATOM 750 CB GLN A 49 18.018 12.808 -5.746 1.00 0.31 C ATOM 751 CG GLN A 49 17.107 13.934 -5.289 1.00 0.36 C ATOM 752 CD GLN A 49 16.238 14.473 -6.410 1.00 0.36 C ATOM 753 OE1 GLN A 49 15.888 13.608 -7.357 1.00 0.40 O flip ATOM 754 NE2 GLN A 49 15.881 15.651 -6.424 1.00 0.33 N flip ATOM 0 H GLN A 49 16.089 11.306 -5.421 1.00 0.23 H new ATOM 0 HA GLN A 49 18.831 10.913 -5.124 1.00 0.25 H new ATOM 0 HB2 GLN A 49 19.027 13.200 -5.871 1.00 0.31 H new ATOM 0 HB3 GLN A 49 17.687 12.462 -6.725 1.00 0.31 H new ATOM 0 HG2 GLN A 49 16.470 13.575 -4.481 1.00 0.36 H new ATOM 0 HG3 GLN A 49 17.713 14.744 -4.882 1.00 0.36 H new ATOM 0 HE21 GLN A 49 16.173 16.281 -5.677 1.00 0.33 H new ATOM 0 HE22 GLN A 49 15.294 15.997 -7.183 1.00 0.33 H new ATOM 763 N ASP A 50 17.484 12.480 -2.575 1.00 0.25 N ATOM 764 CA ASP A 50 17.791 12.940 -1.224 1.00 0.29 C ATOM 765 C ASP A 50 18.358 11.799 -0.377 1.00 0.27 C ATOM 766 O ASP A 50 19.421 11.941 0.226 1.00 0.30 O ATOM 767 CB ASP A 50 16.558 13.565 -0.550 1.00 0.33 C ATOM 768 CG ASP A 50 15.719 12.572 0.236 1.00 0.33 C ATOM 769 OD1 ASP A 50 16.168 12.138 1.318 1.00 0.35 O ATOM 770 OD2 ASP A 50 14.606 12.246 -0.220 1.00 0.33 O ATOM 0 H ASP A 50 16.495 12.499 -2.822 1.00 0.25 H new ATOM 0 HA ASP A 50 18.552 13.716 -1.303 1.00 0.29 H new ATOM 0 HB2 ASP A 50 16.886 14.360 0.120 1.00 0.33 H new ATOM 0 HB3 ASP A 50 15.934 14.029 -1.314 1.00 0.33 H new ATOM 775 N LEU A 51 17.649 10.671 -0.337 1.00 0.25 N ATOM 776 CA LEU A 51 18.094 9.518 0.439 1.00 0.27 C ATOM 777 C LEU A 51 19.353 8.903 -0.161 1.00 0.24 C ATOM 778 O LEU A 51 20.125 8.239 0.534 1.00 0.27 O ATOM 779 CB LEU A 51 16.976 8.471 0.542 1.00 0.30 C ATOM 780 CG LEU A 51 16.418 7.959 -0.787 1.00 0.29 C ATOM 781 CD1 LEU A 51 17.319 6.883 -1.366 1.00 0.30 C ATOM 782 CD2 LEU A 51 15.005 7.427 -0.596 1.00 0.35 C ATOM 0 H LEU A 51 16.768 10.533 -0.832 1.00 0.25 H new ATOM 0 HA LEU A 51 18.337 9.864 1.444 1.00 0.27 H new ATOM 0 HB2 LEU A 51 17.353 7.619 1.108 1.00 0.30 H new ATOM 0 HB3 LEU A 51 16.156 8.899 1.118 1.00 0.30 H new ATOM 0 HG LEU A 51 16.384 8.790 -1.491 1.00 0.29 H new ATOM 0 HD11 LEU A 51 16.905 6.532 -2.311 1.00 0.30 H new ATOM 0 HD12 LEU A 51 18.314 7.294 -1.536 1.00 0.30 H new ATOM 0 HD13 LEU A 51 17.386 6.049 -0.667 1.00 0.30 H new ATOM 0 HD21 LEU A 51 14.620 7.066 -1.550 1.00 0.35 H new ATOM 0 HD22 LEU A 51 15.019 6.608 0.123 1.00 0.35 H new ATOM 0 HD23 LEU A 51 14.363 8.225 -0.224 1.00 0.35 H new ATOM 794 N ILE A 52 19.560 9.130 -1.455 1.00 0.20 N ATOM 795 CA ILE A 52 20.732 8.600 -2.142 1.00 0.21 C ATOM 796 C ILE A 52 21.988 9.337 -1.697 1.00 0.25 C ATOM 797 O ILE A 52 22.941 8.722 -1.217 1.00 0.29 O ATOM 798 CB ILE A 52 20.583 8.690 -3.677 1.00 0.23 C ATOM 799 CG1 ILE A 52 19.620 7.608 -4.173 1.00 0.25 C ATOM 800 CG2 ILE A 52 21.938 8.560 -4.364 1.00 0.28 C ATOM 801 CD1 ILE A 52 19.281 7.722 -5.643 1.00 0.31 C ATOM 0 H ILE A 52 18.933 9.676 -2.047 1.00 0.20 H new ATOM 0 HA ILE A 52 20.820 7.547 -1.874 1.00 0.21 H new ATOM 0 HB ILE A 52 20.173 9.668 -3.929 1.00 0.23 H new ATOM 0 HG12 ILE A 52 20.061 6.629 -3.986 1.00 0.25 H new ATOM 0 HG13 ILE A 52 18.699 7.660 -3.592 1.00 0.25 H new ATOM 0 HG21 ILE A 52 21.806 8.627 -5.444 1.00 0.28 H new ATOM 0 HG22 ILE A 52 22.595 9.363 -4.028 1.00 0.28 H new ATOM 0 HG23 ILE A 52 22.383 7.598 -4.111 1.00 0.28 H new ATOM 0 HD11 ILE A 52 18.595 6.922 -5.921 1.00 0.31 H new ATOM 0 HD12 ILE A 52 18.811 8.687 -5.834 1.00 0.31 H new ATOM 0 HD13 ILE A 52 20.193 7.640 -6.234 1.00 0.31 H new ATOM 813 N ALA A 53 21.984 10.656 -1.857 1.00 0.29 N ATOM 814 CA ALA A 53 23.122 11.466 -1.459 1.00 0.36 C ATOM 815 C ALA A 53 23.320 11.341 0.039 1.00 0.38 C ATOM 816 O ALA A 53 24.408 11.568 0.569 1.00 0.45 O ATOM 817 CB ALA A 53 22.893 12.920 -1.844 1.00 0.40 C ATOM 0 H ALA A 53 21.208 11.182 -2.258 1.00 0.29 H new ATOM 0 HA ALA A 53 24.017 11.115 -1.972 1.00 0.36 H new ATOM 0 HB1 ALA A 53 23.753 13.517 -1.540 1.00 0.40 H new ATOM 0 HB2 ALA A 53 22.763 12.994 -2.924 1.00 0.40 H new ATOM 0 HB3 ALA A 53 21.999 13.292 -1.344 1.00 0.40 H new ATOM 823 N GLU A 54 22.234 10.972 0.705 1.00 0.40 N ATOM 824 CA GLU A 54 22.221 10.804 2.145 1.00 0.47 C ATOM 825 C GLU A 54 23.202 9.715 2.566 1.00 0.40 C ATOM 826 O GLU A 54 24.093 9.947 3.382 1.00 0.45 O ATOM 827 CB GLU A 54 20.810 10.424 2.588 1.00 0.59 C ATOM 828 CG GLU A 54 20.436 10.966 3.948 1.00 0.69 C ATOM 829 CD GLU A 54 21.488 10.689 5.006 1.00 1.02 C ATOM 830 OE1 GLU A 54 21.514 9.558 5.536 1.00 1.47 O ATOM 831 OE2 GLU A 54 22.285 11.604 5.303 1.00 1.27 O ATOM 0 H GLU A 54 21.337 10.781 0.258 1.00 0.40 H new ATOM 0 HA GLU A 54 22.521 11.740 2.617 1.00 0.47 H new ATOM 0 HB2 GLU A 54 20.096 10.791 1.851 1.00 0.59 H new ATOM 0 HB3 GLU A 54 20.723 9.338 2.603 1.00 0.59 H new ATOM 0 HG2 GLU A 54 20.278 12.042 3.873 1.00 0.69 H new ATOM 0 HG3 GLU A 54 19.489 10.526 4.261 1.00 0.69 H new ATOM 838 N ALA A 55 23.023 8.526 1.998 1.00 0.33 N ATOM 839 CA ALA A 55 23.886 7.391 2.303 1.00 0.31 C ATOM 840 C ALA A 55 25.323 7.658 1.867 1.00 0.33 C ATOM 841 O ALA A 55 26.268 7.196 2.503 1.00 0.41 O ATOM 842 CB ALA A 55 23.353 6.132 1.635 1.00 0.37 C ATOM 0 H ALA A 55 22.286 8.324 1.322 1.00 0.33 H new ATOM 0 HA ALA A 55 23.886 7.245 3.383 1.00 0.31 H new ATOM 0 HB1 ALA A 55 24.006 5.291 1.870 1.00 0.37 H new ATOM 0 HB2 ALA A 55 22.347 5.924 2.001 1.00 0.37 H new ATOM 0 HB3 ALA A 55 23.324 6.278 0.555 1.00 0.37 H new ATOM 848 N GLU A 56 25.480 8.399 0.776 1.00 0.34 N ATOM 849 CA GLU A 56 26.807 8.725 0.263 1.00 0.44 C ATOM 850 C GLU A 56 27.546 9.663 1.216 1.00 0.52 C ATOM 851 O GLU A 56 28.763 9.824 1.125 1.00 0.65 O ATOM 852 CB GLU A 56 26.698 9.373 -1.119 1.00 0.50 C ATOM 853 CG GLU A 56 26.048 8.480 -2.163 1.00 0.61 C ATOM 854 CD GLU A 56 25.916 9.160 -3.512 1.00 1.09 C ATOM 855 OE1 GLU A 56 26.853 9.045 -4.330 1.00 1.31 O ATOM 856 OE2 GLU A 56 24.874 9.807 -3.751 1.00 1.88 O ATOM 0 H GLU A 56 24.709 8.784 0.231 1.00 0.34 H new ATOM 0 HA GLU A 56 27.373 7.797 0.181 1.00 0.44 H new ATOM 0 HB2 GLU A 56 26.123 10.295 -1.034 1.00 0.50 H new ATOM 0 HB3 GLU A 56 27.695 9.650 -1.461 1.00 0.50 H new ATOM 0 HG2 GLU A 56 26.638 7.570 -2.275 1.00 0.61 H new ATOM 0 HG3 GLU A 56 25.060 8.179 -1.814 1.00 0.61 H new ATOM 863 N ASN A 57 26.800 10.279 2.129 1.00 0.54 N ATOM 864 CA ASN A 57 27.378 11.211 3.093 1.00 0.68 C ATOM 865 C ASN A 57 27.892 10.490 4.340 1.00 0.70 C ATOM 866 O ASN A 57 28.318 11.131 5.300 1.00 0.98 O ATOM 867 CB ASN A 57 26.336 12.258 3.497 1.00 0.79 C ATOM 868 CG ASN A 57 26.950 13.613 3.807 1.00 0.96 C ATOM 869 OD1 ASN A 57 26.292 14.646 3.679 1.00 1.37 O ATOM 870 ND2 ASN A 57 28.215 13.620 4.212 1.00 1.66 N ATOM 0 H ASN A 57 25.793 10.149 2.222 1.00 0.54 H new ATOM 0 HA ASN A 57 28.226 11.699 2.613 1.00 0.68 H new ATOM 0 HB2 ASN A 57 25.609 12.369 2.692 1.00 0.79 H new ATOM 0 HB3 ASN A 57 25.791 11.903 4.372 1.00 0.79 H new ATOM 0 HD21 ASN A 57 28.676 14.503 4.430 1.00 1.66 H new ATOM 0 HD22 ASN A 57 28.726 12.742 4.305 1.00 1.66 H new ATOM 877 N ASN A 58 27.850 9.159 4.329 1.00 0.64 N ATOM 878 CA ASN A 58 28.316 8.380 5.476 1.00 0.70 C ATOM 879 C ASN A 58 28.470 6.899 5.130 1.00 0.63 C ATOM 880 O ASN A 58 29.537 6.317 5.327 1.00 0.89 O ATOM 881 CB ASN A 58 27.354 8.545 6.656 1.00 0.79 C ATOM 882 CG ASN A 58 25.916 8.239 6.281 1.00 1.13 C ATOM 883 OD1 ASN A 58 25.457 7.105 6.411 1.00 2.14 O ATOM 884 ND2 ASN A 58 25.197 9.254 5.816 1.00 1.12 N ATOM 0 H ASN A 58 27.502 8.602 3.548 1.00 0.64 H new ATOM 0 HA ASN A 58 29.298 8.761 5.755 1.00 0.70 H new ATOM 0 HB2 ASN A 58 27.663 7.886 7.467 1.00 0.79 H new ATOM 0 HB3 ASN A 58 27.418 9.566 7.033 1.00 0.79 H new ATOM 0 HD21 ASN A 58 24.223 9.109 5.550 1.00 1.12 H new ATOM 0 HD22 ASN A 58 25.619 10.178 5.725 1.00 1.12 H new ATOM 891 N ASN A 59 27.403 6.295 4.616 1.00 0.54 N ATOM 892 CA ASN A 59 27.421 4.882 4.249 1.00 0.72 C ATOM 893 C ASN A 59 28.213 4.648 2.963 1.00 0.82 C ATOM 894 O ASN A 59 28.138 3.570 2.375 1.00 1.69 O ATOM 895 CB ASN A 59 25.993 4.357 4.080 1.00 0.81 C ATOM 896 CG ASN A 59 25.192 4.432 5.365 1.00 0.88 C ATOM 897 OD1 ASN A 59 25.743 4.323 6.461 1.00 1.09 O ATOM 898 ND2 ASN A 59 23.883 4.619 5.237 1.00 0.93 N ATOM 0 H ASN A 59 26.513 6.763 4.444 1.00 0.54 H new ATOM 0 HA ASN A 59 27.913 4.339 5.056 1.00 0.72 H new ATOM 0 HB2 ASN A 59 25.487 4.933 3.306 1.00 0.81 H new ATOM 0 HB3 ASN A 59 26.028 3.323 3.737 1.00 0.81 H new ATOM 0 HD21 ASN A 59 23.293 4.678 6.067 1.00 0.93 H new ATOM 0 HD22 ASN A 59 23.468 4.704 4.309 1.00 0.93 H new ATOM 905 N ASN A 60 28.951 5.676 2.530 1.00 0.78 N ATOM 906 CA ASN A 60 29.776 5.611 1.320 1.00 0.73 C ATOM 907 C ASN A 60 28.934 5.784 0.058 1.00 0.61 C ATOM 908 O ASN A 60 29.312 6.521 -0.852 1.00 0.68 O ATOM 909 CB ASN A 60 30.562 4.295 1.251 1.00 0.76 C ATOM 910 CG ASN A 60 31.485 4.110 2.441 1.00 1.00 C ATOM 911 OD1 ASN A 60 30.979 3.477 3.492 1.00 1.32 O flip ATOM 912 ND2 ASN A 60 32.642 4.531 2.414 1.00 1.74 N flip ATOM 0 H ASN A 60 28.993 6.576 3.009 1.00 0.78 H new ATOM 0 HA ASN A 60 30.486 6.436 1.374 1.00 0.73 H new ATOM 0 HB2 ASN A 60 29.863 3.460 1.203 1.00 0.76 H new ATOM 0 HB3 ASN A 60 31.149 4.273 0.333 1.00 0.76 H new ATOM 0 HD21 ASN A 60 32.990 5.012 1.585 1.00 1.74 H new ATOM 0 HD22 ASN A 60 33.252 4.398 3.221 1.00 1.74 H new ATOM 919 N GLY A 61 27.793 5.102 0.007 1.00 0.53 N ATOM 920 CA GLY A 61 26.923 5.202 -1.152 1.00 0.47 C ATOM 921 C GLY A 61 25.945 4.048 -1.251 1.00 0.41 C ATOM 922 O GLY A 61 24.892 4.172 -1.878 1.00 0.56 O ATOM 0 H GLY A 61 27.456 4.484 0.745 1.00 0.53 H new ATOM 0 HA2 GLY A 61 26.369 6.139 -1.105 1.00 0.47 H new ATOM 0 HA3 GLY A 61 27.531 5.236 -2.056 1.00 0.47 H new ATOM 926 N GLN A 62 26.291 2.925 -0.632 1.00 0.28 N ATOM 927 CA GLN A 62 25.439 1.744 -0.653 1.00 0.22 C ATOM 928 C GLN A 62 24.729 1.560 0.683 1.00 0.19 C ATOM 929 O GLN A 62 25.186 2.053 1.714 1.00 0.22 O ATOM 930 CB GLN A 62 26.250 0.491 -1.011 1.00 0.22 C ATOM 931 CG GLN A 62 27.658 0.463 -0.428 1.00 0.31 C ATOM 932 CD GLN A 62 27.693 0.472 1.091 1.00 1.15 C ATOM 933 OE1 GLN A 62 26.665 -0.086 1.718 1.00 1.44 O flip ATOM 934 NE2 GLN A 62 28.638 0.977 1.695 1.00 1.87 N flip ATOM 0 H GLN A 62 27.158 2.808 -0.108 1.00 0.28 H new ATOM 0 HA GLN A 62 24.681 1.892 -1.423 1.00 0.22 H new ATOM 0 HB2 GLN A 62 25.709 -0.389 -0.663 1.00 0.22 H new ATOM 0 HB3 GLN A 62 26.318 0.415 -2.096 1.00 0.22 H new ATOM 0 HG2 GLN A 62 28.173 -0.427 -0.789 1.00 0.31 H new ATOM 0 HG3 GLN A 62 28.212 1.325 -0.800 1.00 0.31 H new ATOM 0 HE21 GLN A 62 29.410 1.396 1.176 1.00 1.87 H new ATOM 0 HE22 GLN A 62 28.650 0.977 2.715 1.00 1.87 H new ATOM 943 N LEU A 63 23.602 0.858 0.652 1.00 0.19 N ATOM 944 CA LEU A 63 22.819 0.611 1.856 1.00 0.19 C ATOM 945 C LEU A 63 22.774 -0.877 2.195 1.00 0.18 C ATOM 946 O LEU A 63 22.883 -1.732 1.314 1.00 0.19 O ATOM 947 CB LEU A 63 21.396 1.160 1.682 1.00 0.23 C ATOM 948 CG LEU A 63 20.601 0.591 0.501 1.00 0.25 C ATOM 949 CD1 LEU A 63 20.028 -0.775 0.844 1.00 0.28 C ATOM 950 CD2 LEU A 63 19.486 1.545 0.100 1.00 0.39 C ATOM 0 H LEU A 63 23.210 0.449 -0.196 1.00 0.19 H new ATOM 0 HA LEU A 63 23.303 1.128 2.685 1.00 0.19 H new ATOM 0 HB2 LEU A 63 20.838 0.967 2.598 1.00 0.23 H new ATOM 0 HB3 LEU A 63 21.456 2.242 1.567 1.00 0.23 H new ATOM 0 HG LEU A 63 21.282 0.476 -0.342 1.00 0.25 H new ATOM 0 HD11 LEU A 63 19.468 -1.159 -0.009 1.00 0.28 H new ATOM 0 HD12 LEU A 63 20.841 -1.461 1.083 1.00 0.28 H new ATOM 0 HD13 LEU A 63 19.364 -0.686 1.704 1.00 0.28 H new ATOM 0 HD21 LEU A 63 18.932 1.125 -0.740 1.00 0.39 H new ATOM 0 HD22 LEU A 63 18.811 1.691 0.943 1.00 0.39 H new ATOM 0 HD23 LEU A 63 19.915 2.504 -0.191 1.00 0.39 H new ATOM 962 N ASN A 64 22.602 -1.171 3.482 1.00 0.18 N ATOM 963 CA ASN A 64 22.530 -2.546 3.969 1.00 0.18 C ATOM 964 C ASN A 64 21.076 -2.985 4.112 1.00 0.17 C ATOM 965 O ASN A 64 20.181 -2.151 4.244 1.00 0.17 O ATOM 966 CB ASN A 64 23.252 -2.681 5.311 1.00 0.20 C ATOM 967 CG ASN A 64 24.667 -2.142 5.264 1.00 0.26 C ATOM 968 OD1 ASN A 64 25.612 -2.868 4.954 1.00 0.74 O ATOM 969 ND2 ASN A 64 24.821 -0.860 5.576 1.00 0.61 N ATOM 0 H ASN A 64 22.509 -0.466 4.213 1.00 0.18 H new ATOM 0 HA ASN A 64 23.023 -3.191 3.242 1.00 0.18 H new ATOM 0 HB2 ASN A 64 22.689 -2.149 6.078 1.00 0.20 H new ATOM 0 HB3 ASN A 64 23.276 -3.731 5.603 1.00 0.20 H new ATOM 0 HD21 ASN A 64 25.751 -0.440 5.565 1.00 0.61 H new ATOM 0 HD22 ASN A 64 24.010 -0.295 5.827 1.00 0.61 H new ATOM 976 N PHE A 65 20.842 -4.292 4.077 1.00 0.17 N ATOM 977 CA PHE A 65 19.489 -4.831 4.184 1.00 0.17 C ATOM 978 C PHE A 65 18.732 -4.272 5.391 1.00 0.19 C ATOM 979 O PHE A 65 17.511 -4.133 5.340 1.00 0.18 O ATOM 980 CB PHE A 65 19.513 -6.360 4.259 1.00 0.19 C ATOM 981 CG PHE A 65 18.137 -6.964 4.322 1.00 0.18 C ATOM 982 CD1 PHE A 65 17.415 -7.194 3.161 1.00 0.20 C ATOM 983 CD2 PHE A 65 17.559 -7.284 5.540 1.00 0.19 C ATOM 984 CE1 PHE A 65 16.145 -7.734 3.216 1.00 0.21 C ATOM 985 CE2 PHE A 65 16.287 -7.822 5.599 1.00 0.19 C ATOM 986 CZ PHE A 65 15.578 -8.047 4.435 1.00 0.19 C ATOM 0 H PHE A 65 21.571 -4.999 3.975 1.00 0.17 H new ATOM 0 HA PHE A 65 18.961 -4.519 3.283 1.00 0.17 H new ATOM 0 HB2 PHE A 65 20.038 -6.753 3.388 1.00 0.19 H new ATOM 0 HB3 PHE A 65 20.080 -6.667 5.138 1.00 0.19 H new ATOM 0 HD1 PHE A 65 17.850 -6.948 2.204 1.00 0.20 H new ATOM 0 HD2 PHE A 65 18.108 -7.111 6.454 1.00 0.19 H new ATOM 0 HE1 PHE A 65 15.595 -7.912 2.304 1.00 0.21 H new ATOM 0 HE2 PHE A 65 15.848 -8.066 6.555 1.00 0.19 H new ATOM 0 HZ PHE A 65 14.584 -8.466 4.479 1.00 0.19 H new ATOM 996 N THR A 66 19.438 -3.957 6.475 1.00 0.23 N ATOM 997 CA THR A 66 18.770 -3.434 7.667 1.00 0.25 C ATOM 998 C THR A 66 18.148 -2.069 7.414 1.00 0.24 C ATOM 999 O THR A 66 16.953 -1.878 7.635 1.00 0.24 O ATOM 1000 CB THR A 66 19.711 -3.315 8.877 1.00 0.30 C ATOM 1001 OG1 THR A 66 20.313 -4.584 9.163 1.00 0.33 O ATOM 1002 CG2 THR A 66 18.934 -2.824 10.096 1.00 0.32 C ATOM 0 H THR A 66 20.451 -4.051 6.554 1.00 0.23 H new ATOM 0 HA THR A 66 17.992 -4.162 7.896 1.00 0.25 H new ATOM 0 HB THR A 66 20.496 -2.597 8.641 1.00 0.30 H new ATOM 0 HG1 THR A 66 20.911 -4.496 9.934 1.00 0.33 H new ATOM 0 HG21 THR A 66 19.608 -2.743 10.949 1.00 0.32 H new ATOM 0 HG22 THR A 66 18.500 -1.847 9.882 1.00 0.32 H new ATOM 0 HG23 THR A 66 18.138 -3.531 10.329 1.00 0.32 H new ATOM 1010 N GLU A 67 18.953 -1.113 6.961 1.00 0.25 N ATOM 1011 CA GLU A 67 18.437 0.220 6.700 1.00 0.26 C ATOM 1012 C GLU A 67 17.341 0.159 5.645 1.00 0.23 C ATOM 1013 O GLU A 67 16.322 0.839 5.764 1.00 0.23 O ATOM 1014 CB GLU A 67 19.555 1.182 6.280 1.00 0.29 C ATOM 1015 CG GLU A 67 20.444 0.660 5.166 1.00 0.27 C ATOM 1016 CD GLU A 67 21.634 1.565 4.913 1.00 0.45 C ATOM 1017 OE1 GLU A 67 21.440 2.655 4.334 1.00 0.66 O ATOM 1018 OE2 GLU A 67 22.760 1.187 5.299 1.00 0.61 O ATOM 0 H GLU A 67 19.948 -1.235 6.771 1.00 0.25 H new ATOM 0 HA GLU A 67 18.009 0.608 7.625 1.00 0.26 H new ATOM 0 HB2 GLU A 67 19.107 2.123 5.961 1.00 0.29 H new ATOM 0 HB3 GLU A 67 20.174 1.402 7.150 1.00 0.29 H new ATOM 0 HG2 GLU A 67 20.797 -0.339 5.423 1.00 0.27 H new ATOM 0 HG3 GLU A 67 19.860 0.566 4.251 1.00 0.27 H new ATOM 1025 N PHE A 68 17.546 -0.658 4.615 1.00 0.22 N ATOM 1026 CA PHE A 68 16.545 -0.808 3.568 1.00 0.20 C ATOM 1027 C PHE A 68 15.238 -1.337 4.144 1.00 0.18 C ATOM 1028 O PHE A 68 14.183 -0.736 3.960 1.00 0.19 O ATOM 1029 CB PHE A 68 17.022 -1.757 2.471 1.00 0.19 C ATOM 1030 CG PHE A 68 15.934 -2.093 1.492 1.00 0.18 C ATOM 1031 CD1 PHE A 68 15.132 -1.091 0.969 1.00 0.25 C ATOM 1032 CD2 PHE A 68 15.698 -3.402 1.108 1.00 0.17 C ATOM 1033 CE1 PHE A 68 14.119 -1.385 0.084 1.00 0.27 C ATOM 1034 CE2 PHE A 68 14.685 -3.702 0.218 1.00 0.18 C ATOM 1035 CZ PHE A 68 13.894 -2.689 -0.293 1.00 0.23 C ATOM 0 H PHE A 68 18.387 -1.220 4.485 1.00 0.22 H new ATOM 0 HA PHE A 68 16.383 0.180 3.136 1.00 0.20 H new ATOM 0 HB2 PHE A 68 17.858 -1.302 1.939 1.00 0.19 H new ATOM 0 HB3 PHE A 68 17.395 -2.675 2.925 1.00 0.19 H new ATOM 0 HD1 PHE A 68 15.304 -0.065 1.260 1.00 0.25 H new ATOM 0 HD2 PHE A 68 16.311 -4.196 1.508 1.00 0.17 H new ATOM 0 HE1 PHE A 68 13.502 -0.593 -0.314 1.00 0.27 H new ATOM 0 HE2 PHE A 68 14.511 -4.726 -0.078 1.00 0.18 H new ATOM 0 HZ PHE A 68 13.100 -2.921 -0.987 1.00 0.23 H new ATOM 1045 N CYS A 69 15.312 -2.486 4.811 1.00 0.18 N ATOM 1046 CA CYS A 69 14.132 -3.085 5.425 1.00 0.19 C ATOM 1047 C CYS A 69 13.431 -2.044 6.282 1.00 0.20 C ATOM 1048 O CYS A 69 12.204 -2.022 6.386 1.00 0.20 O ATOM 1049 CB CYS A 69 14.511 -4.306 6.268 1.00 0.21 C ATOM 1050 SG CYS A 69 14.995 -3.923 7.967 1.00 0.26 S ATOM 0 H CYS A 69 16.173 -3.018 4.939 1.00 0.18 H new ATOM 0 HA CYS A 69 13.457 -3.423 4.639 1.00 0.19 H new ATOM 0 HB2 CYS A 69 13.665 -4.993 6.291 1.00 0.21 H new ATOM 0 HB3 CYS A 69 15.333 -4.829 5.779 1.00 0.21 H new ATOM 0 HG CYS A 69 15.900 -2.990 7.960 1.00 0.26 H new ATOM 1056 N GLY A 70 14.236 -1.181 6.895 1.00 0.22 N ATOM 1057 CA GLY A 70 13.697 -0.121 7.714 1.00 0.25 C ATOM 1058 C GLY A 70 12.977 0.903 6.858 1.00 0.25 C ATOM 1059 O GLY A 70 11.993 1.511 7.279 1.00 0.27 O ATOM 0 H GLY A 70 15.254 -1.201 6.836 1.00 0.22 H new ATOM 0 HA2 GLY A 70 13.008 -0.537 8.449 1.00 0.25 H new ATOM 0 HA3 GLY A 70 14.502 0.362 8.269 1.00 0.25 H new ATOM 1063 N ILE A 71 13.492 1.083 5.641 1.00 0.25 N ATOM 1064 CA ILE A 71 12.932 2.024 4.678 1.00 0.27 C ATOM 1065 C ILE A 71 11.614 1.533 4.098 1.00 0.26 C ATOM 1066 O ILE A 71 10.617 2.248 4.126 1.00 0.29 O ATOM 1067 CB ILE A 71 13.921 2.290 3.529 1.00 0.28 C ATOM 1068 CG1 ILE A 71 15.064 3.164 4.044 1.00 0.30 C ATOM 1069 CG2 ILE A 71 13.213 2.950 2.350 1.00 0.30 C ATOM 1070 CD1 ILE A 71 16.099 3.507 2.992 1.00 0.33 C ATOM 0 H ILE A 71 14.310 0.579 5.298 1.00 0.25 H new ATOM 0 HA ILE A 71 12.745 2.950 5.222 1.00 0.27 H new ATOM 0 HB ILE A 71 14.329 1.343 3.175 1.00 0.28 H new ATOM 0 HG12 ILE A 71 14.649 4.088 4.445 1.00 0.30 H new ATOM 0 HG13 ILE A 71 15.557 2.651 4.870 1.00 0.30 H new ATOM 0 HG21 ILE A 71 13.930 3.129 1.549 1.00 0.30 H new ATOM 0 HG22 ILE A 71 12.421 2.295 1.988 1.00 0.30 H new ATOM 0 HG23 ILE A 71 12.781 3.899 2.669 1.00 0.30 H new ATOM 0 HD11 ILE A 71 16.876 4.129 3.436 1.00 0.33 H new ATOM 0 HD12 ILE A 71 16.544 2.590 2.607 1.00 0.33 H new ATOM 0 HD13 ILE A 71 15.622 4.049 2.176 1.00 0.33 H new ATOM 1082 N MET A 72 11.607 0.325 3.549 1.00 0.24 N ATOM 1083 CA MET A 72 10.385 -0.217 2.984 1.00 0.25 C ATOM 1084 C MET A 72 9.290 -0.160 4.036 1.00 0.27 C ATOM 1085 O MET A 72 8.121 0.074 3.729 1.00 0.31 O ATOM 1086 CB MET A 72 10.602 -1.647 2.474 1.00 0.23 C ATOM 1087 CG MET A 72 10.981 -2.653 3.553 1.00 0.26 C ATOM 1088 SD MET A 72 9.579 -3.176 4.565 1.00 0.49 S ATOM 1089 CE MET A 72 8.368 -3.578 3.309 1.00 0.33 C ATOM 0 H MET A 72 12.421 -0.287 3.485 1.00 0.24 H new ATOM 0 HA MET A 72 10.083 0.381 2.124 1.00 0.25 H new ATOM 0 HB2 MET A 72 9.690 -1.986 1.983 1.00 0.23 H new ATOM 0 HB3 MET A 72 11.385 -1.634 1.716 1.00 0.23 H new ATOM 0 HG2 MET A 72 11.428 -3.529 3.083 1.00 0.26 H new ATOM 0 HG3 MET A 72 11.742 -2.214 4.198 1.00 0.26 H new ATOM 0 HE1 MET A 72 7.560 -4.158 3.755 1.00 0.33 H new ATOM 0 HE2 MET A 72 7.963 -2.658 2.886 1.00 0.33 H new ATOM 0 HE3 MET A 72 8.842 -4.162 2.520 1.00 0.33 H new ATOM 1099 N ALA A 73 9.689 -0.379 5.287 1.00 0.26 N ATOM 1100 CA ALA A 73 8.769 -0.322 6.409 1.00 0.29 C ATOM 1101 C ALA A 73 8.174 1.076 6.558 1.00 0.31 C ATOM 1102 O ALA A 73 6.958 1.230 6.658 1.00 0.36 O ATOM 1103 CB ALA A 73 9.483 -0.735 7.687 1.00 0.29 C ATOM 0 H ALA A 73 10.651 -0.599 5.545 1.00 0.26 H new ATOM 0 HA ALA A 73 7.950 -1.016 6.219 1.00 0.29 H new ATOM 0 HB1 ALA A 73 8.786 -0.690 8.524 1.00 0.29 H new ATOM 0 HB2 ALA A 73 9.858 -1.753 7.582 1.00 0.29 H new ATOM 0 HB3 ALA A 73 10.317 -0.059 7.872 1.00 0.29 H new ATOM 1109 N LYS A 74 9.037 2.101 6.577 1.00 0.31 N ATOM 1110 CA LYS A 74 8.565 3.477 6.715 1.00 0.35 C ATOM 1111 C LYS A 74 7.775 3.903 5.488 1.00 0.38 C ATOM 1112 O LYS A 74 6.951 4.813 5.555 1.00 0.44 O ATOM 1113 CB LYS A 74 9.731 4.447 6.941 1.00 0.38 C ATOM 1114 CG LYS A 74 10.665 4.591 5.751 1.00 0.43 C ATOM 1115 CD LYS A 74 11.762 5.599 6.019 1.00 0.48 C ATOM 1116 CE LYS A 74 12.614 5.839 4.784 1.00 1.38 C ATOM 1117 NZ LYS A 74 11.831 6.461 3.681 1.00 2.11 N ATOM 0 H LYS A 74 10.049 2.002 6.500 1.00 0.31 H new ATOM 0 HA LYS A 74 7.913 3.510 7.588 1.00 0.35 H new ATOM 0 HB2 LYS A 74 9.328 5.428 7.193 1.00 0.38 H new ATOM 0 HB3 LYS A 74 10.308 4.109 7.802 1.00 0.38 H new ATOM 0 HG2 LYS A 74 11.109 3.623 5.518 1.00 0.43 H new ATOM 0 HG3 LYS A 74 10.094 4.899 4.875 1.00 0.43 H new ATOM 0 HD2 LYS A 74 11.320 6.540 6.346 1.00 0.48 H new ATOM 0 HD3 LYS A 74 12.393 5.243 6.834 1.00 0.48 H new ATOM 0 HE2 LYS A 74 13.453 6.485 5.042 1.00 1.38 H new ATOM 0 HE3 LYS A 74 13.033 4.892 4.443 1.00 1.38 H new ATOM 0 HZ1 LYS A 74 12.482 6.854 2.972 1.00 2.11 H new ATOM 0 HZ2 LYS A 74 11.227 5.741 3.236 1.00 2.11 H new ATOM 0 HZ3 LYS A 74 11.236 7.223 4.064 1.00 2.11 H new ATOM 1131 N GLN A 75 8.036 3.247 4.364 1.00 0.36 N ATOM 1132 CA GLN A 75 7.341 3.560 3.125 1.00 0.42 C ATOM 1133 C GLN A 75 5.884 3.120 3.198 1.00 0.51 C ATOM 1134 O GLN A 75 5.066 3.510 2.366 1.00 0.63 O ATOM 1135 CB GLN A 75 8.032 2.890 1.933 1.00 0.43 C ATOM 1136 CG GLN A 75 9.284 3.615 1.461 1.00 0.69 C ATOM 1137 CD GLN A 75 8.972 4.903 0.720 1.00 0.90 C ATOM 1138 OE1 GLN A 75 7.964 5.556 0.983 1.00 1.48 O ATOM 1139 NE2 GLN A 75 9.839 5.274 -0.216 1.00 0.80 N ATOM 0 H GLN A 75 8.723 2.497 4.286 1.00 0.36 H new ATOM 0 HA GLN A 75 7.372 4.641 2.985 1.00 0.42 H new ATOM 0 HB2 GLN A 75 8.296 1.868 2.206 1.00 0.43 H new ATOM 0 HB3 GLN A 75 7.326 2.827 1.105 1.00 0.43 H new ATOM 0 HG2 GLN A 75 9.915 3.839 2.321 1.00 0.69 H new ATOM 0 HG3 GLN A 75 9.857 2.955 0.809 1.00 0.69 H new ATOM 0 HE21 GLN A 75 10.663 4.703 -0.403 1.00 0.80 H new ATOM 0 HE22 GLN A 75 9.680 6.130 -0.748 1.00 0.80 H new ATOM 1289 N MET A 85 -6.184 4.434 -1.588 1.00 12.20 N ATOM 1290 CA MET A 85 -7.520 3.903 -1.363 1.00 13.28 C ATOM 1291 C MET A 85 -8.502 4.463 -2.388 1.00 14.20 C ATOM 1292 O MET A 85 -9.221 3.712 -3.047 1.00 15.28 O ATOM 1293 CB MET A 85 -7.996 4.225 0.057 1.00 13.04 C ATOM 1294 CG MET A 85 -9.433 3.825 0.313 1.00 14.20 C ATOM 1295 SD MET A 85 -9.734 2.088 -0.047 1.00 15.12 S ATOM 1296 CE MET A 85 -11.483 2.126 -0.418 1.00 16.29 C ATOM 0 HA MET A 85 -7.478 2.820 -1.479 1.00 13.28 H new ATOM 0 HB2 MET A 85 -7.351 3.715 0.773 1.00 13.04 H new ATOM 0 HB3 MET A 85 -7.887 5.295 0.235 1.00 13.04 H new ATOM 0 HG2 MET A 85 -9.684 4.026 1.354 1.00 14.20 H new ATOM 0 HG3 MET A 85 -10.093 4.440 -0.298 1.00 14.20 H new ATOM 0 HE1 MET A 85 -11.944 1.192 -0.096 1.00 16.29 H new ATOM 0 HE2 MET A 85 -11.948 2.960 0.107 1.00 16.29 H new ATOM 0 HE3 MET A 85 -11.625 2.249 -1.492 1.00 16.29 H new ATOM 1306 N ARG A 86 -8.528 5.786 -2.515 1.00 13.88 N ATOM 1307 CA ARG A 86 -9.412 6.447 -3.462 1.00 14.84 C ATOM 1308 C ARG A 86 -9.105 6.002 -4.885 1.00 15.43 C ATOM 1309 O ARG A 86 -9.983 5.988 -5.745 1.00 16.55 O ATOM 1310 CB ARG A 86 -9.259 7.963 -3.352 1.00 14.45 C ATOM 1311 CG ARG A 86 -9.677 8.525 -2.004 1.00 14.20 C ATOM 1312 CD ARG A 86 -9.544 10.038 -1.966 1.00 14.13 C ATOM 1313 NE ARG A 86 -10.484 10.694 -2.872 1.00 14.82 N ATOM 1314 CZ ARG A 86 -10.569 12.013 -3.019 1.00 15.11 C ATOM 1315 NH1 ARG A 86 -9.771 12.815 -2.327 1.00 14.78 N ATOM 1316 NH2 ARG A 86 -11.454 12.531 -3.860 1.00 15.88 N ATOM 0 H ARG A 86 -7.944 6.421 -1.971 1.00 13.88 H new ATOM 0 HA ARG A 86 -10.439 6.170 -3.223 1.00 14.84 H new ATOM 0 HB2 ARG A 86 -8.218 8.228 -3.539 1.00 14.45 H new ATOM 0 HB3 ARG A 86 -9.854 8.437 -4.133 1.00 14.45 H new ATOM 0 HG2 ARG A 86 -10.709 8.244 -1.796 1.00 14.20 H new ATOM 0 HG3 ARG A 86 -9.062 8.085 -1.219 1.00 14.20 H new ATOM 0 HD2 ARG A 86 -9.714 10.391 -0.949 1.00 14.13 H new ATOM 0 HD3 ARG A 86 -8.526 10.319 -2.235 1.00 14.13 H new ATOM 0 HE ARG A 86 -11.110 10.107 -3.423 1.00 14.82 H new ATOM 0 HH11 ARG A 86 -9.089 12.421 -1.679 1.00 14.78 H new ATOM 0 HH12 ARG A 86 -9.839 13.826 -2.443 1.00 14.78 H new ATOM 0 HH21 ARG A 86 -12.070 11.918 -4.394 1.00 15.88 H new ATOM 0 HH22 ARG A 86 -11.519 13.543 -3.973 1.00 15.88 H new ATOM 1330 N GLU A 87 -7.851 5.631 -5.121 1.00 14.77 N ATOM 1331 CA GLU A 87 -7.423 5.186 -6.438 1.00 15.43 C ATOM 1332 C GLU A 87 -8.121 3.885 -6.807 1.00 16.43 C ATOM 1333 O GLU A 87 -8.608 3.727 -7.926 1.00 17.50 O ATOM 1334 CB GLU A 87 -5.906 4.994 -6.472 1.00 14.60 C ATOM 1335 CG GLU A 87 -5.337 4.914 -7.877 1.00 15.22 C ATOM 1336 CD GLU A 87 -3.831 4.735 -7.886 1.00 14.94 C ATOM 1337 OE1 GLU A 87 -3.371 3.574 -7.842 1.00 14.72 O ATOM 1338 OE2 GLU A 87 -3.112 5.754 -7.936 1.00 15.08 O ATOM 0 H GLU A 87 -7.114 5.630 -4.415 1.00 14.77 H new ATOM 0 HA GLU A 87 -7.694 5.951 -7.165 1.00 15.43 H new ATOM 0 HB2 GLU A 87 -5.431 5.820 -5.943 1.00 14.60 H new ATOM 0 HB3 GLU A 87 -5.651 4.082 -5.933 1.00 14.60 H new ATOM 0 HG2 GLU A 87 -5.801 4.082 -8.406 1.00 15.22 H new ATOM 0 HG3 GLU A 87 -5.595 5.822 -8.422 1.00 15.22 H new ATOM 1345 N ALA A 88 -8.206 2.973 -5.845 1.00 16.17 N ATOM 1346 CA ALA A 88 -8.842 1.684 -6.073 1.00 17.18 C ATOM 1347 C ALA A 88 -10.349 1.854 -6.206 1.00 18.20 C ATOM 1348 O ALA A 88 -10.969 1.289 -7.111 1.00 19.32 O ATOM 1349 CB ALA A 88 -8.499 0.708 -4.958 1.00 16.77 C ATOM 0 H ALA A 88 -7.842 3.104 -4.901 1.00 16.17 H new ATOM 0 HA ALA A 88 -8.461 1.270 -7.007 1.00 17.18 H new ATOM 0 HB1 ALA A 88 -8.985 -0.249 -5.149 1.00 16.77 H new ATOM 0 HB2 ALA A 88 -7.419 0.565 -4.919 1.00 16.77 H new ATOM 0 HB3 ALA A 88 -8.846 1.107 -4.005 1.00 16.77 H new ATOM 1355 N PHE A 89 -10.938 2.633 -5.302 1.00 17.88 N ATOM 1356 CA PHE A 89 -12.371 2.885 -5.347 1.00 18.88 C ATOM 1357 C PHE A 89 -12.766 3.385 -6.734 1.00 19.75 C ATOM 1358 O PHE A 89 -13.804 3.001 -7.275 1.00 20.90 O ATOM 1359 CB PHE A 89 -12.777 3.909 -4.281 1.00 18.44 C ATOM 1360 CG PHE A 89 -14.196 4.381 -4.427 1.00 19.53 C ATOM 1361 CD1 PHE A 89 -15.231 3.676 -3.843 1.00 20.04 C ATOM 1362 CD2 PHE A 89 -14.493 5.520 -5.160 1.00 20.12 C ATOM 1363 CE1 PHE A 89 -16.539 4.094 -3.983 1.00 21.09 C ATOM 1364 CE2 PHE A 89 -15.800 5.942 -5.305 1.00 21.19 C ATOM 1365 CZ PHE A 89 -16.824 5.226 -4.715 1.00 21.66 C ATOM 0 H PHE A 89 -10.448 3.096 -4.537 1.00 17.88 H new ATOM 0 HA PHE A 89 -12.894 1.951 -5.140 1.00 18.88 H new ATOM 0 HB2 PHE A 89 -12.647 3.467 -3.293 1.00 18.44 H new ATOM 0 HB3 PHE A 89 -12.107 4.767 -4.337 1.00 18.44 H new ATOM 0 HD1 PHE A 89 -15.014 2.787 -3.270 1.00 20.04 H new ATOM 0 HD2 PHE A 89 -13.695 6.082 -5.622 1.00 20.12 H new ATOM 0 HE1 PHE A 89 -17.338 3.534 -3.519 1.00 21.09 H new ATOM 0 HE2 PHE A 89 -16.021 6.830 -5.878 1.00 21.19 H new ATOM 0 HZ PHE A 89 -17.847 5.553 -4.828 1.00 21.66 H new ATOM 1375 N LYS A 90 -11.925 4.247 -7.299 1.00 19.26 N ATOM 1376 CA LYS A 90 -12.166 4.802 -8.627 1.00 20.11 C ATOM 1377 C LYS A 90 -12.150 3.710 -9.691 1.00 20.94 C ATOM 1378 O LYS A 90 -12.923 3.752 -10.649 1.00 22.05 O ATOM 1379 CB LYS A 90 -11.112 5.855 -8.968 1.00 19.45 C ATOM 1380 CG LYS A 90 -11.356 7.206 -8.318 1.00 18.94 C ATOM 1381 CD LYS A 90 -10.471 8.281 -8.929 1.00 18.35 C ATOM 1382 CE LYS A 90 -9.021 8.134 -8.493 1.00 17.84 C ATOM 1383 NZ LYS A 90 -8.847 8.413 -7.040 1.00 18.07 N ATOM 0 H LYS A 90 -11.068 4.577 -6.856 1.00 19.26 H new ATOM 0 HA LYS A 90 -13.152 5.266 -8.615 1.00 20.11 H new ATOM 0 HB2 LYS A 90 -10.133 5.487 -8.661 1.00 19.45 H new ATOM 0 HB3 LYS A 90 -11.079 5.984 -10.050 1.00 19.45 H new ATOM 0 HG2 LYS A 90 -12.403 7.484 -8.435 1.00 18.94 H new ATOM 0 HG3 LYS A 90 -11.162 7.137 -7.248 1.00 18.94 H new ATOM 0 HD2 LYS A 90 -10.531 8.227 -10.016 1.00 18.35 H new ATOM 0 HD3 LYS A 90 -10.840 9.264 -8.638 1.00 18.35 H new ATOM 0 HE2 LYS A 90 -8.677 7.123 -8.712 1.00 17.84 H new ATOM 0 HE3 LYS A 90 -8.397 8.816 -9.071 1.00 17.84 H new ATOM 0 HZ1 LYS A 90 -7.839 8.352 -6.793 1.00 18.07 H new ATOM 0 HZ2 LYS A 90 -9.199 9.368 -6.825 1.00 18.07 H new ATOM 0 HZ3 LYS A 90 -9.382 7.714 -6.486 1.00 18.07 H new ATOM 1397 N ILE A 91 -11.264 2.733 -9.519 1.00 20.46 N ATOM 1398 CA ILE A 91 -11.143 1.636 -10.474 1.00 21.30 C ATOM 1399 C ILE A 91 -12.441 0.842 -10.586 1.00 22.45 C ATOM 1400 O ILE A 91 -12.830 0.433 -11.679 1.00 23.52 O ATOM 1401 CB ILE A 91 -9.990 0.684 -10.097 1.00 20.67 C ATOM 1402 CG1 ILE A 91 -8.705 1.485 -9.893 1.00 19.54 C ATOM 1403 CG2 ILE A 91 -9.801 -0.376 -11.174 1.00 21.70 C ATOM 1404 CD1 ILE A 91 -7.548 0.673 -9.348 1.00 18.86 C ATOM 0 H ILE A 91 -10.621 2.679 -8.729 1.00 20.46 H new ATOM 0 HA ILE A 91 -10.925 2.089 -11.441 1.00 21.30 H new ATOM 0 HB ILE A 91 -10.238 0.176 -9.165 1.00 20.67 H new ATOM 0 HG12 ILE A 91 -8.409 1.925 -10.845 1.00 19.54 H new ATOM 0 HG13 ILE A 91 -8.909 2.310 -9.211 1.00 19.54 H new ATOM 0 HG21 ILE A 91 -8.983 -1.039 -10.892 1.00 21.70 H new ATOM 0 HG22 ILE A 91 -10.718 -0.955 -11.279 1.00 21.70 H new ATOM 0 HG23 ILE A 91 -9.566 0.107 -12.122 1.00 21.70 H new ATOM 0 HD11 ILE A 91 -6.675 1.315 -9.233 1.00 18.86 H new ATOM 0 HD12 ILE A 91 -7.821 0.255 -8.379 1.00 18.86 H new ATOM 0 HD13 ILE A 91 -7.314 -0.136 -10.040 1.00 18.86 H new ATOM 1416 N PHE A 92 -13.111 0.627 -9.458 1.00 22.30 N ATOM 1417 CA PHE A 92 -14.366 -0.123 -9.454 1.00 23.42 C ATOM 1418 C PHE A 92 -15.517 0.715 -9.992 1.00 24.20 C ATOM 1419 O PHE A 92 -16.405 0.197 -10.665 1.00 25.36 O ATOM 1420 CB PHE A 92 -14.720 -0.588 -8.045 1.00 23.12 C ATOM 1421 CG PHE A 92 -13.710 -1.514 -7.434 1.00 22.46 C ATOM 1422 CD1 PHE A 92 -13.654 -2.840 -7.824 1.00 22.24 C ATOM 1423 CD2 PHE A 92 -12.822 -1.062 -6.468 1.00 22.15 C ATOM 1424 CE1 PHE A 92 -12.734 -3.703 -7.266 1.00 21.74 C ATOM 1425 CE2 PHE A 92 -11.897 -1.922 -5.907 1.00 21.64 C ATOM 1426 CZ PHE A 92 -11.852 -3.245 -6.307 1.00 21.45 C ATOM 0 H PHE A 92 -12.811 0.958 -8.541 1.00 22.30 H new ATOM 0 HA PHE A 92 -14.218 -0.988 -10.101 1.00 23.42 H new ATOM 0 HB2 PHE A 92 -14.831 0.286 -7.403 1.00 23.12 H new ATOM 0 HB3 PHE A 92 -15.687 -1.089 -8.072 1.00 23.12 H new ATOM 0 HD1 PHE A 92 -14.339 -3.204 -8.575 1.00 22.24 H new ATOM 0 HD2 PHE A 92 -12.854 -0.030 -6.152 1.00 22.15 H new ATOM 0 HE1 PHE A 92 -12.703 -4.736 -7.579 1.00 21.74 H new ATOM 0 HE2 PHE A 92 -11.209 -1.561 -5.156 1.00 21.64 H new ATOM 0 HZ PHE A 92 -11.129 -3.918 -5.871 1.00 21.45 H new ATOM 1436 N ASP A 93 -15.487 2.011 -9.705 1.00 23.63 N ATOM 1437 CA ASP A 93 -16.548 2.917 -10.131 1.00 24.39 C ATOM 1438 C ASP A 93 -16.600 3.034 -11.650 1.00 25.20 C ATOM 1439 O ASP A 93 -17.673 2.949 -12.244 1.00 26.19 O ATOM 1440 CB ASP A 93 -16.347 4.297 -9.503 1.00 23.63 C ATOM 1441 CG ASP A 93 -17.576 5.180 -9.621 1.00 24.48 C ATOM 1442 OD1 ASP A 93 -18.102 5.324 -10.744 1.00 24.88 O ATOM 1443 OD2 ASP A 93 -18.007 5.733 -8.589 1.00 24.81 O ATOM 0 H ASP A 93 -14.738 2.459 -9.178 1.00 23.63 H new ATOM 0 HA ASP A 93 -17.498 2.504 -9.792 1.00 24.39 H new ATOM 0 HB2 ASP A 93 -16.090 4.178 -8.450 1.00 23.63 H new ATOM 0 HB3 ASP A 93 -15.503 4.791 -9.984 1.00 23.63 H new ATOM 1448 N ARG A 94 -15.434 3.262 -12.253 1.00 24.82 N ATOM 1449 CA ARG A 94 -15.299 3.401 -13.707 1.00 25.61 C ATOM 1450 C ARG A 94 -15.646 4.813 -14.162 1.00 25.96 C ATOM 1451 O ARG A 94 -14.993 5.369 -15.045 1.00 26.03 O ATOM 1452 CB ARG A 94 -16.180 2.391 -14.452 1.00 26.84 C ATOM 1453 CG ARG A 94 -15.813 0.940 -14.180 1.00 26.72 C ATOM 1454 CD ARG A 94 -16.701 -0.015 -14.962 1.00 27.97 C ATOM 1455 NE ARG A 94 -18.116 0.173 -14.655 1.00 28.57 N ATOM 1456 CZ ARG A 94 -19.101 -0.445 -15.302 1.00 29.55 C ATOM 1457 NH1 ARG A 94 -18.825 -1.285 -16.289 1.00 30.03 N ATOM 1458 NH2 ARG A 94 -20.363 -0.221 -14.961 1.00 30.10 N ATOM 0 H ARG A 94 -14.553 3.356 -11.748 1.00 24.82 H new ATOM 0 HA ARG A 94 -14.255 3.199 -13.948 1.00 25.61 H new ATOM 0 HB2 ARG A 94 -17.220 2.552 -14.169 1.00 26.84 H new ATOM 0 HB3 ARG A 94 -16.108 2.580 -15.523 1.00 26.84 H new ATOM 0 HG2 ARG A 94 -14.770 0.771 -14.448 1.00 26.72 H new ATOM 0 HG3 ARG A 94 -15.905 0.734 -13.114 1.00 26.72 H new ATOM 0 HD2 ARG A 94 -16.540 0.133 -16.030 1.00 27.97 H new ATOM 0 HD3 ARG A 94 -16.415 -1.042 -14.736 1.00 27.97 H new ATOM 0 HE ARG A 94 -18.364 0.815 -13.902 1.00 28.57 H new ATOM 0 HH11 ARG A 94 -17.856 -1.459 -16.554 1.00 30.03 H new ATOM 0 HH12 ARG A 94 -19.582 -1.757 -16.783 1.00 30.03 H new ATOM 0 HH21 ARG A 94 -20.579 0.425 -14.202 1.00 30.10 H new ATOM 0 HH22 ARG A 94 -21.117 -0.695 -15.458 1.00 30.10 H new ATOM 1472 N ASP A 95 -16.679 5.387 -13.550 1.00 26.27 N ATOM 1473 CA ASP A 95 -17.124 6.733 -13.901 1.00 26.74 C ATOM 1474 C ASP A 95 -16.413 7.783 -13.057 1.00 25.70 C ATOM 1475 O ASP A 95 -15.769 8.690 -13.584 1.00 25.63 O ATOM 1476 CB ASP A 95 -18.633 6.867 -13.692 1.00 27.69 C ATOM 1477 CG ASP A 95 -19.370 5.554 -13.855 1.00 28.38 C ATOM 1478 OD1 ASP A 95 -19.428 5.040 -14.992 1.00 28.88 O ATOM 1479 OD2 ASP A 95 -19.890 5.041 -12.839 1.00 28.47 O ATOM 0 H ASP A 95 -17.222 4.942 -12.810 1.00 26.27 H new ATOM 0 HA ASP A 95 -16.881 6.896 -14.951 1.00 26.74 H new ATOM 0 HB2 ASP A 95 -18.823 7.263 -12.694 1.00 27.69 H new ATOM 0 HB3 ASP A 95 -19.030 7.591 -14.403 1.00 27.69 H new ATOM 1484 N GLY A 96 -16.537 7.648 -11.741 1.00 24.96 N ATOM 1485 CA GLY A 96 -15.921 8.595 -10.832 1.00 24.00 C ATOM 1486 C GLY A 96 -16.936 9.550 -10.233 1.00 24.47 C ATOM 1487 O GLY A 96 -16.619 10.705 -9.948 1.00 24.19 O ATOM 0 H GLY A 96 -17.055 6.896 -11.287 1.00 24.96 H new ATOM 0 HA2 GLY A 96 -15.416 8.054 -10.032 1.00 24.00 H new ATOM 0 HA3 GLY A 96 -15.158 9.164 -11.363 1.00 24.00 H new ATOM 1491 N ASP A 97 -18.160 9.064 -10.044 1.00 25.28 N ATOM 1492 CA ASP A 97 -19.233 9.877 -9.482 1.00 25.89 C ATOM 1493 C ASP A 97 -19.158 9.893 -7.961 1.00 25.11 C ATOM 1494 O ASP A 97 -19.929 10.588 -7.298 1.00 25.54 O ATOM 1495 CB ASP A 97 -20.597 9.340 -9.920 1.00 27.15 C ATOM 1496 CG ASP A 97 -20.578 8.781 -11.328 1.00 27.81 C ATOM 1497 OD1 ASP A 97 -20.510 9.582 -12.285 1.00 28.07 O ATOM 1498 OD2 ASP A 97 -20.631 7.542 -11.474 1.00 28.13 O ATOM 0 H ASP A 97 -18.433 8.108 -10.273 1.00 25.28 H new ATOM 0 HA ASP A 97 -19.112 10.895 -9.853 1.00 25.89 H new ATOM 0 HB2 ASP A 97 -20.916 8.561 -9.228 1.00 27.15 H new ATOM 0 HB3 ASP A 97 -21.335 10.140 -9.861 1.00 27.15 H new ATOM 1503 N GLY A 98 -18.224 9.125 -7.416 1.00 24.03 N ATOM 1504 CA GLY A 98 -18.065 9.056 -5.979 1.00 23.27 C ATOM 1505 C GLY A 98 -18.734 7.831 -5.387 1.00 23.53 C ATOM 1506 O GLY A 98 -18.574 7.542 -4.201 1.00 22.95 O ATOM 0 H GLY A 98 -17.572 8.547 -7.947 1.00 24.03 H new ATOM 0 HA2 GLY A 98 -17.003 9.043 -5.733 1.00 23.27 H new ATOM 0 HA3 GLY A 98 -18.486 9.953 -5.525 1.00 23.27 H new ATOM 1510 N PHE A 99 -19.501 7.120 -6.211 1.00 24.50 N ATOM 1511 CA PHE A 99 -20.186 5.912 -5.769 1.00 24.94 C ATOM 1512 C PHE A 99 -20.177 4.830 -6.849 1.00 25.47 C ATOM 1513 O PHE A 99 -20.507 5.081 -8.014 1.00 26.19 O ATOM 1514 CB PHE A 99 -21.620 6.228 -5.331 1.00 25.98 C ATOM 1515 CG PHE A 99 -22.214 7.429 -6.006 1.00 26.68 C ATOM 1516 CD1 PHE A 99 -22.882 7.309 -7.210 1.00 27.04 C ATOM 1517 CD2 PHE A 99 -22.101 8.681 -5.425 1.00 27.05 C ATOM 1518 CE1 PHE A 99 -23.428 8.418 -7.828 1.00 27.76 C ATOM 1519 CE2 PHE A 99 -22.643 9.794 -6.035 1.00 27.77 C ATOM 1520 CZ PHE A 99 -23.308 9.664 -7.239 1.00 28.11 C ATOM 0 H PHE A 99 -19.662 7.362 -7.189 1.00 24.50 H new ATOM 0 HA PHE A 99 -19.640 5.523 -4.909 1.00 24.94 H new ATOM 0 HB2 PHE A 99 -22.250 5.362 -5.533 1.00 25.98 H new ATOM 0 HB3 PHE A 99 -21.633 6.387 -4.253 1.00 25.98 H new ATOM 0 HD1 PHE A 99 -22.978 6.338 -7.673 1.00 27.04 H new ATOM 0 HD2 PHE A 99 -21.583 8.788 -4.484 1.00 27.05 H new ATOM 0 HE1 PHE A 99 -23.947 8.312 -8.769 1.00 27.76 H new ATOM 0 HE2 PHE A 99 -22.547 10.765 -5.572 1.00 27.77 H new ATOM 0 HZ PHE A 99 -23.733 10.533 -7.719 1.00 28.11 H new ATOM 1530 N ILE A 100 -19.786 3.624 -6.441 1.00 25.18 N ATOM 1531 CA ILE A 100 -19.720 2.476 -7.330 1.00 25.71 C ATOM 1532 C ILE A 100 -21.048 1.732 -7.357 1.00 26.98 C ATOM 1533 O ILE A 100 -21.457 1.146 -6.355 1.00 27.09 O ATOM 1534 CB ILE A 100 -18.641 1.478 -6.864 1.00 24.88 C ATOM 1535 CG1 ILE A 100 -17.282 2.153 -6.737 1.00 23.56 C ATOM 1536 CG2 ILE A 100 -18.552 0.300 -7.819 1.00 25.54 C ATOM 1537 CD1 ILE A 100 -16.351 1.410 -5.807 1.00 22.62 C ATOM 0 H ILE A 100 -19.506 3.420 -5.482 1.00 25.18 H new ATOM 0 HA ILE A 100 -19.479 2.859 -8.322 1.00 25.71 H new ATOM 0 HB ILE A 100 -18.933 1.112 -5.880 1.00 24.88 H new ATOM 0 HG12 ILE A 100 -16.823 2.226 -7.723 1.00 23.56 H new ATOM 0 HG13 ILE A 100 -17.418 3.171 -6.372 1.00 23.56 H new ATOM 0 HG21 ILE A 100 -17.785 -0.392 -7.472 1.00 25.54 H new ATOM 0 HG22 ILE A 100 -19.513 -0.212 -7.856 1.00 25.54 H new ATOM 0 HG23 ILE A 100 -18.294 0.658 -8.816 1.00 25.54 H new ATOM 0 HD11 ILE A 100 -15.397 1.934 -5.753 1.00 22.62 H new ATOM 0 HD12 ILE A 100 -16.794 1.359 -4.812 1.00 22.62 H new ATOM 0 HD13 ILE A 100 -16.190 0.400 -6.184 1.00 22.62 H new ATOM 1549 N SER A 101 -21.717 1.751 -8.498 1.00 27.98 N ATOM 1550 CA SER A 101 -22.977 1.042 -8.637 1.00 29.24 C ATOM 1551 C SER A 101 -22.699 -0.437 -8.897 1.00 29.53 C ATOM 1552 O SER A 101 -21.626 -0.782 -9.386 1.00 29.01 O ATOM 1553 CB SER A 101 -23.803 1.636 -9.778 1.00 30.23 C ATOM 1554 OG SER A 101 -23.289 1.246 -11.039 1.00 31.40 O ATOM 0 H SER A 101 -21.411 2.246 -9.336 1.00 27.98 H new ATOM 0 HA SER A 101 -23.549 1.145 -7.715 1.00 29.24 H new ATOM 0 HB2 SER A 101 -24.839 1.310 -9.688 1.00 30.23 H new ATOM 0 HB3 SER A 101 -23.803 2.723 -9.703 1.00 30.23 H new ATOM 0 HG SER A 101 -23.836 1.638 -11.751 1.00 31.40 H new ATOM 1560 N PRO A 102 -23.645 -1.330 -8.554 1.00 30.40 N ATOM 1561 CA PRO A 102 -23.492 -2.770 -8.758 1.00 30.84 C ATOM 1562 C PRO A 102 -22.724 -3.125 -10.033 1.00 31.00 C ATOM 1563 O PRO A 102 -21.740 -3.858 -9.986 1.00 30.80 O ATOM 1564 CB PRO A 102 -24.940 -3.238 -8.848 1.00 32.14 C ATOM 1565 CG PRO A 102 -25.678 -2.331 -7.920 1.00 32.10 C ATOM 1566 CD PRO A 102 -24.938 -1.013 -7.921 1.00 31.10 C ATOM 0 HA PRO A 102 -22.910 -3.239 -7.965 1.00 30.84 H new ATOM 0 HB2 PRO A 102 -25.321 -3.161 -9.866 1.00 32.14 H new ATOM 0 HB3 PRO A 102 -25.040 -4.281 -8.548 1.00 32.14 H new ATOM 0 HG2 PRO A 102 -26.709 -2.196 -8.249 1.00 32.10 H new ATOM 0 HG3 PRO A 102 -25.716 -2.753 -6.916 1.00 32.10 H new ATOM 0 HD2 PRO A 102 -25.480 -0.251 -8.481 1.00 31.10 H new ATOM 0 HD3 PRO A 102 -24.804 -0.630 -6.909 1.00 31.10 H new ATOM 1574 N ALA A 103 -23.161 -2.586 -11.166 1.00 31.44 N ATOM 1575 CA ALA A 103 -22.510 -2.866 -12.446 1.00 31.71 C ATOM 1576 C ALA A 103 -21.019 -2.531 -12.403 1.00 30.52 C ATOM 1577 O ALA A 103 -20.194 -3.262 -12.943 1.00 30.50 O ATOM 1578 CB ALA A 103 -23.196 -2.097 -13.565 1.00 32.55 C ATOM 0 H ALA A 103 -23.960 -1.955 -11.227 1.00 31.44 H new ATOM 0 HA ALA A 103 -22.603 -3.934 -12.641 1.00 31.71 H new ATOM 0 HB1 ALA A 103 -22.702 -2.314 -14.512 1.00 32.55 H new ATOM 0 HB2 ALA A 103 -24.242 -2.397 -13.624 1.00 32.55 H new ATOM 0 HB3 ALA A 103 -23.136 -1.028 -13.362 1.00 32.55 H new ATOM 1584 N GLU A 104 -20.688 -1.425 -11.751 1.00 29.57 N ATOM 1585 CA GLU A 104 -19.304 -0.968 -11.624 1.00 28.37 C ATOM 1586 C GLU A 104 -18.499 -1.867 -10.682 1.00 27.59 C ATOM 1587 O GLU A 104 -17.385 -2.288 -11.007 1.00 27.15 O ATOM 1588 CB GLU A 104 -19.302 0.472 -11.115 1.00 27.67 C ATOM 1589 CG GLU A 104 -20.226 1.391 -11.898 1.00 28.56 C ATOM 1590 CD GLU A 104 -20.431 2.728 -11.213 1.00 28.05 C ATOM 1591 OE1 GLU A 104 -19.553 3.128 -10.424 1.00 27.67 O ATOM 1592 OE2 GLU A 104 -21.470 3.374 -11.464 1.00 28.09 O ATOM 0 H GLU A 104 -21.368 -0.817 -11.294 1.00 29.57 H new ATOM 0 HA GLU A 104 -18.828 -1.017 -12.603 1.00 28.37 H new ATOM 0 HB2 GLU A 104 -19.598 0.479 -10.066 1.00 27.67 H new ATOM 0 HB3 GLU A 104 -18.286 0.865 -11.162 1.00 27.67 H new ATOM 0 HG2 GLU A 104 -19.812 1.556 -12.893 1.00 28.56 H new ATOM 0 HG3 GLU A 104 -21.191 0.903 -12.031 1.00 28.56 H new ATOM 1599 N LEU A 105 -19.083 -2.184 -9.531 1.00 27.51 N ATOM 1600 CA LEU A 105 -18.410 -3.008 -8.531 1.00 26.86 C ATOM 1601 C LEU A 105 -18.135 -4.422 -9.040 1.00 27.51 C ATOM 1602 O LEU A 105 -16.986 -4.863 -9.059 1.00 26.94 O ATOM 1603 CB LEU A 105 -19.254 -3.065 -7.255 1.00 26.95 C ATOM 1604 CG LEU A 105 -18.783 -4.063 -6.195 1.00 26.49 C ATOM 1605 CD1 LEU A 105 -17.383 -3.714 -5.714 1.00 25.10 C ATOM 1606 CD2 LEU A 105 -19.757 -4.093 -5.027 1.00 26.84 C ATOM 0 H LEU A 105 -20.021 -1.883 -9.267 1.00 27.51 H new ATOM 0 HA LEU A 105 -17.446 -2.546 -8.317 1.00 26.86 H new ATOM 0 HB2 LEU A 105 -19.273 -2.071 -6.809 1.00 26.95 H new ATOM 0 HB3 LEU A 105 -20.280 -3.311 -7.530 1.00 26.95 H new ATOM 0 HG LEU A 105 -18.751 -5.055 -6.645 1.00 26.49 H new ATOM 0 HD11 LEU A 105 -17.067 -4.436 -4.961 1.00 25.10 H new ATOM 0 HD12 LEU A 105 -16.691 -3.742 -6.556 1.00 25.10 H new ATOM 0 HD13 LEU A 105 -17.386 -2.714 -5.280 1.00 25.10 H new ATOM 0 HD21 LEU A 105 -19.409 -4.807 -4.281 1.00 26.84 H new ATOM 0 HD22 LEU A 105 -19.818 -3.101 -4.579 1.00 26.84 H new ATOM 0 HD23 LEU A 105 -20.743 -4.392 -5.383 1.00 26.84 H new ATOM 1618 N ARG A 106 -19.182 -5.120 -9.462 1.00 28.76 N ATOM 1619 CA ARG A 106 -19.045 -6.492 -9.951 1.00 29.56 C ATOM 1620 C ARG A 106 -18.127 -6.578 -11.166 1.00 29.58 C ATOM 1621 O ARG A 106 -17.192 -7.370 -11.196 1.00 29.39 O ATOM 1622 CB ARG A 106 -20.412 -7.063 -10.336 1.00 30.94 C ATOM 1623 CG ARG A 106 -21.512 -6.788 -9.327 1.00 31.13 C ATOM 1624 CD ARG A 106 -22.782 -7.544 -9.684 1.00 32.40 C ATOM 1625 NE ARG A 106 -23.985 -6.846 -9.236 1.00 32.96 N ATOM 1626 CZ ARG A 106 -25.099 -6.757 -9.960 1.00 33.97 C ATOM 1627 NH1 ARG A 106 -25.159 -7.312 -11.164 1.00 34.53 N ATOM 1628 NH2 ARG A 106 -26.153 -6.110 -9.483 1.00 34.47 N ATOM 0 H ARG A 106 -20.137 -4.761 -9.477 1.00 28.76 H new ATOM 0 HA ARG A 106 -18.607 -7.071 -9.138 1.00 29.56 H new ATOM 0 HB2 ARG A 106 -20.707 -6.648 -11.300 1.00 30.94 H new ATOM 0 HB3 ARG A 106 -20.318 -8.141 -10.468 1.00 30.94 H new ATOM 0 HG2 ARG A 106 -21.178 -7.081 -8.331 1.00 31.13 H new ATOM 0 HG3 ARG A 106 -21.719 -5.718 -9.292 1.00 31.13 H new ATOM 0 HD2 ARG A 106 -22.827 -7.685 -10.764 1.00 32.40 H new ATOM 0 HD3 ARG A 106 -22.751 -8.536 -9.234 1.00 32.40 H new ATOM 0 HE ARG A 106 -23.971 -6.402 -8.318 1.00 32.96 H new ATOM 0 HH11 ARG A 106 -24.350 -7.809 -11.537 1.00 34.53 H new ATOM 0 HH12 ARG A 106 -26.014 -7.242 -11.716 1.00 34.53 H new ATOM 0 HH21 ARG A 106 -26.112 -5.679 -8.559 1.00 34.47 H new ATOM 0 HH22 ARG A 106 -27.005 -6.043 -10.039 1.00 34.47 H new ATOM 1642 N PHE A 107 -18.411 -5.754 -12.159 1.00 29.92 N ATOM 1643 CA PHE A 107 -17.657 -5.749 -13.415 1.00 30.13 C ATOM 1644 C PHE A 107 -16.152 -5.637 -13.207 1.00 29.04 C ATOM 1645 O PHE A 107 -15.381 -6.265 -13.929 1.00 29.31 O ATOM 1646 CB PHE A 107 -18.131 -4.609 -14.316 1.00 30.44 C ATOM 1647 CG PHE A 107 -17.465 -4.587 -15.663 1.00 30.81 C ATOM 1648 CD1 PHE A 107 -17.932 -5.386 -16.694 1.00 31.17 C ATOM 1649 CD2 PHE A 107 -16.372 -3.768 -15.897 1.00 30.89 C ATOM 1650 CE1 PHE A 107 -17.322 -5.368 -17.935 1.00 31.59 C ATOM 1651 CE2 PHE A 107 -15.758 -3.745 -17.135 1.00 31.32 C ATOM 1652 CZ PHE A 107 -16.233 -4.546 -18.155 1.00 31.68 C ATOM 0 H PHE A 107 -19.166 -5.069 -12.125 1.00 29.92 H new ATOM 0 HA PHE A 107 -17.849 -6.710 -13.891 1.00 30.13 H new ATOM 0 HB2 PHE A 107 -19.209 -4.692 -14.455 1.00 30.44 H new ATOM 0 HB3 PHE A 107 -17.946 -3.660 -13.813 1.00 30.44 H new ATOM 0 HD1 PHE A 107 -18.782 -6.030 -16.527 1.00 31.17 H new ATOM 0 HD2 PHE A 107 -15.996 -3.140 -15.103 1.00 30.89 H new ATOM 0 HE1 PHE A 107 -17.696 -5.995 -18.731 1.00 31.59 H new ATOM 0 HE2 PHE A 107 -14.908 -3.101 -17.305 1.00 31.32 H new ATOM 0 HZ PHE A 107 -15.754 -4.530 -19.123 1.00 31.68 H new ATOM 1662 N VAL A 108 -15.726 -4.851 -12.227 1.00 27.85 N ATOM 1663 CA VAL A 108 -14.300 -4.672 -11.993 1.00 26.77 C ATOM 1664 C VAL A 108 -13.714 -5.772 -11.110 1.00 26.50 C ATOM 1665 O VAL A 108 -12.672 -6.342 -11.436 1.00 26.41 O ATOM 1666 CB VAL A 108 -14.000 -3.298 -11.372 1.00 25.58 C ATOM 1667 CG1 VAL A 108 -12.530 -3.187 -11.018 1.00 24.43 C ATOM 1668 CG2 VAL A 108 -14.410 -2.186 -12.326 1.00 25.89 C ATOM 0 H VAL A 108 -16.335 -4.336 -11.592 1.00 27.85 H new ATOM 0 HA VAL A 108 -13.823 -4.732 -12.971 1.00 26.77 H new ATOM 0 HB VAL A 108 -14.581 -3.195 -10.455 1.00 25.58 H new ATOM 0 HG11 VAL A 108 -12.334 -2.208 -10.580 1.00 24.43 H new ATOM 0 HG12 VAL A 108 -12.269 -3.965 -10.301 1.00 24.43 H new ATOM 0 HG13 VAL A 108 -11.929 -3.308 -11.919 1.00 24.43 H new ATOM 0 HG21 VAL A 108 -14.192 -1.219 -11.873 1.00 25.89 H new ATOM 0 HG22 VAL A 108 -13.854 -2.283 -13.259 1.00 25.89 H new ATOM 0 HG23 VAL A 108 -15.478 -2.258 -12.531 1.00 25.89 H new ATOM 1678 N MET A 109 -14.375 -6.069 -10.000 1.00 26.48 N ATOM 1679 CA MET A 109 -13.889 -7.096 -9.086 1.00 26.33 C ATOM 1680 C MET A 109 -13.921 -8.480 -9.729 1.00 27.50 C ATOM 1681 O MET A 109 -13.164 -9.371 -9.345 1.00 27.46 O ATOM 1682 CB MET A 109 -14.709 -7.093 -7.799 1.00 26.26 C ATOM 1683 CG MET A 109 -16.165 -7.474 -7.996 1.00 27.48 C ATOM 1684 SD MET A 109 -17.173 -7.068 -6.560 1.00 27.39 S ATOM 1685 CE MET A 109 -16.353 -8.022 -5.284 1.00 26.90 C ATOM 0 H MET A 109 -15.243 -5.618 -9.711 1.00 26.48 H new ATOM 0 HA MET A 109 -12.851 -6.863 -8.848 1.00 26.33 H new ATOM 0 HB2 MET A 109 -14.255 -7.785 -7.089 1.00 26.26 H new ATOM 0 HB3 MET A 109 -14.661 -6.100 -7.351 1.00 26.26 H new ATOM 0 HG2 MET A 109 -16.559 -6.958 -8.872 1.00 27.48 H new ATOM 0 HG3 MET A 109 -16.235 -8.543 -8.197 1.00 27.48 H new ATOM 0 HE1 MET A 109 -17.097 -8.567 -4.702 1.00 26.90 H new ATOM 0 HE2 MET A 109 -15.664 -8.729 -5.745 1.00 26.90 H new ATOM 0 HE3 MET A 109 -15.799 -7.351 -4.627 1.00 26.90 H new ATOM 1695 N ILE A 110 -14.803 -8.657 -10.708 1.00 28.57 N ATOM 1696 CA ILE A 110 -14.930 -9.933 -11.399 1.00 29.77 C ATOM 1697 C ILE A 110 -13.968 -10.026 -12.576 1.00 29.90 C ATOM 1698 O ILE A 110 -13.382 -11.079 -12.827 1.00 30.43 O ATOM 1699 CB ILE A 110 -16.370 -10.161 -11.905 1.00 30.96 C ATOM 1700 CG1 ILE A 110 -17.330 -10.297 -10.719 1.00 31.00 C ATOM 1701 CG2 ILE A 110 -16.435 -11.398 -12.794 1.00 32.20 C ATOM 1702 CD1 ILE A 110 -18.790 -10.352 -11.117 1.00 32.05 C ATOM 0 H ILE A 110 -15.440 -7.932 -11.040 1.00 28.57 H new ATOM 0 HA ILE A 110 -14.682 -10.707 -10.673 1.00 29.77 H new ATOM 0 HB ILE A 110 -16.672 -9.299 -12.500 1.00 30.96 H new ATOM 0 HG12 ILE A 110 -17.080 -11.201 -10.163 1.00 31.00 H new ATOM 0 HG13 ILE A 110 -17.179 -9.455 -10.043 1.00 31.00 H new ATOM 0 HG21 ILE A 110 -17.458 -11.543 -13.141 1.00 32.20 H new ATOM 0 HG22 ILE A 110 -15.776 -11.265 -13.652 1.00 32.20 H new ATOM 0 HG23 ILE A 110 -16.118 -12.272 -12.225 1.00 32.20 H new ATOM 0 HD11 ILE A 110 -19.407 -10.448 -10.224 1.00 32.05 H new ATOM 0 HD12 ILE A 110 -19.058 -9.437 -11.646 1.00 32.05 H new ATOM 0 HD13 ILE A 110 -18.958 -11.210 -11.768 1.00 32.05 H new ATOM 1714 N ASN A 111 -13.806 -8.921 -13.292 1.00 29.51 N ATOM 1715 CA ASN A 111 -12.921 -8.895 -14.448 1.00 29.69 C ATOM 1716 C ASN A 111 -11.468 -9.087 -14.034 1.00 28.92 C ATOM 1717 O ASN A 111 -10.683 -9.679 -14.773 1.00 29.42 O ATOM 1718 CB ASN A 111 -13.078 -7.583 -15.217 1.00 29.42 C ATOM 1719 CG ASN A 111 -12.490 -7.663 -16.611 1.00 30.42 C ATOM 1720 OD1 ASN A 111 -11.359 -7.239 -16.847 1.00 30.38 O ATOM 1721 ND2 ASN A 111 -13.256 -8.222 -17.541 1.00 31.39 N ATOM 0 H ASN A 111 -14.273 -8.036 -13.094 1.00 29.51 H new ATOM 0 HA ASN A 111 -13.203 -9.722 -15.100 1.00 29.69 H new ATOM 0 HB2 ASN A 111 -14.136 -7.328 -15.285 1.00 29.42 H new ATOM 0 HB3 ASN A 111 -12.591 -6.779 -14.665 1.00 29.42 H new ATOM 0 HD21 ASN A 111 -12.913 -8.314 -18.497 1.00 31.39 H new ATOM 0 HD22 ASN A 111 -14.188 -8.559 -17.299 1.00 31.39 H new ATOM 1728 N LEU A 112 -11.109 -8.588 -12.854 1.00 27.75 N ATOM 1729 CA LEU A 112 -9.739 -8.722 -12.377 1.00 26.97 C ATOM 1730 C LEU A 112 -9.387 -10.186 -12.121 1.00 27.67 C ATOM 1731 O LEU A 112 -8.306 -10.638 -12.498 1.00 27.59 O ATOM 1732 CB LEU A 112 -9.492 -7.861 -11.126 1.00 25.59 C ATOM 1733 CG LEU A 112 -10.220 -8.281 -9.845 1.00 25.50 C ATOM 1734 CD1 LEU A 112 -9.426 -9.337 -9.086 1.00 25.51 C ATOM 1735 CD2 LEU A 112 -10.455 -7.068 -8.961 1.00 24.36 C ATOM 0 H LEU A 112 -11.738 -8.095 -12.220 1.00 27.75 H new ATOM 0 HA LEU A 112 -9.079 -8.353 -13.162 1.00 26.97 H new ATOM 0 HB2 LEU A 112 -8.421 -7.856 -10.923 1.00 25.59 H new ATOM 0 HB3 LEU A 112 -9.777 -6.835 -11.358 1.00 25.59 H new ATOM 0 HG LEU A 112 -11.181 -8.714 -10.123 1.00 25.50 H new ATOM 0 HD11 LEU A 112 -9.965 -9.617 -8.181 1.00 25.51 H new ATOM 0 HD12 LEU A 112 -9.294 -10.216 -9.717 1.00 25.51 H new ATOM 0 HD13 LEU A 112 -8.450 -8.934 -8.816 1.00 25.51 H new ATOM 0 HD21 LEU A 112 -10.973 -7.375 -8.052 1.00 24.36 H new ATOM 0 HD22 LEU A 112 -9.498 -6.618 -8.699 1.00 24.36 H new ATOM 0 HD23 LEU A 112 -11.063 -6.340 -9.497 1.00 24.36 H new ATOM 1747 N GLY A 113 -10.294 -10.930 -11.481 1.00 28.44 N ATOM 1748 CA GLY A 113 -10.014 -12.332 -11.214 1.00 29.23 C ATOM 1749 C GLY A 113 -10.967 -13.005 -10.237 1.00 29.21 C ATOM 1750 O GLY A 113 -11.014 -14.233 -10.175 1.00 29.01 O ATOM 0 H GLY A 113 -11.198 -10.594 -11.150 1.00 28.44 H new ATOM 0 HA2 GLY A 113 -10.040 -12.878 -12.157 1.00 29.23 H new ATOM 0 HA3 GLY A 113 -8.999 -12.416 -10.825 1.00 29.23 H new ATOM 1754 N GLU A 114 -11.727 -12.222 -9.473 1.00 29.51 N ATOM 1755 CA GLU A 114 -12.642 -12.795 -8.492 1.00 29.65 C ATOM 1756 C GLU A 114 -14.005 -13.102 -9.095 1.00 30.86 C ATOM 1757 O GLU A 114 -14.791 -12.199 -9.371 1.00 31.02 O ATOM 1758 CB GLU A 114 -12.815 -11.850 -7.306 1.00 28.56 C ATOM 1759 CG GLU A 114 -11.505 -11.416 -6.671 1.00 27.33 C ATOM 1760 CD GLU A 114 -11.710 -10.494 -5.485 1.00 26.52 C ATOM 1761 OE1 GLU A 114 -11.852 -9.271 -5.701 1.00 26.19 O ATOM 1762 OE2 GLU A 114 -11.731 -10.993 -4.340 1.00 26.29 O ATOM 0 H GLU A 114 -11.727 -11.203 -9.514 1.00 29.51 H new ATOM 0 HA GLU A 114 -12.200 -13.733 -8.154 1.00 29.65 H new ATOM 0 HB2 GLU A 114 -13.359 -10.965 -7.635 1.00 28.56 H new ATOM 0 HB3 GLU A 114 -13.430 -12.339 -6.550 1.00 28.56 H new ATOM 0 HG2 GLU A 114 -10.951 -12.298 -6.349 1.00 27.33 H new ATOM 0 HG3 GLU A 114 -10.893 -10.911 -7.418 1.00 27.33 H new ATOM 1769 N LYS A 115 -14.289 -14.383 -9.275 1.00 31.76 N ATOM 1770 CA LYS A 115 -15.569 -14.805 -9.826 1.00 32.97 C ATOM 1771 C LYS A 115 -16.616 -14.804 -8.726 1.00 32.97 C ATOM 1772 O LYS A 115 -16.952 -15.846 -8.163 1.00 33.55 O ATOM 1773 CB LYS A 115 -15.457 -16.190 -10.466 1.00 34.07 C ATOM 1774 CG LYS A 115 -14.489 -16.245 -11.638 1.00 34.37 C ATOM 1775 CD LYS A 115 -14.938 -15.347 -12.780 1.00 34.03 C ATOM 1776 CE LYS A 115 -13.950 -15.375 -13.934 1.00 34.21 C ATOM 1777 NZ LYS A 115 -14.339 -14.436 -15.023 1.00 34.46 N ATOM 0 H LYS A 115 -13.653 -15.147 -9.048 1.00 31.76 H new ATOM 0 HA LYS A 115 -15.868 -14.105 -10.606 1.00 32.97 H new ATOM 0 HB2 LYS A 115 -15.138 -16.906 -9.709 1.00 34.07 H new ATOM 0 HB3 LYS A 115 -16.444 -16.504 -10.806 1.00 34.07 H new ATOM 0 HG2 LYS A 115 -13.496 -15.942 -11.305 1.00 34.37 H new ATOM 0 HG3 LYS A 115 -14.406 -17.272 -11.994 1.00 34.37 H new ATOM 0 HD2 LYS A 115 -15.919 -15.667 -13.132 1.00 34.03 H new ATOM 0 HD3 LYS A 115 -15.047 -14.325 -12.418 1.00 34.03 H new ATOM 0 HE2 LYS A 115 -12.957 -15.114 -13.568 1.00 34.21 H new ATOM 0 HE3 LYS A 115 -13.887 -16.387 -14.333 1.00 34.21 H new ATOM 0 HZ1 LYS A 115 -13.639 -14.486 -15.791 1.00 34.46 H new ATOM 0 HZ2 LYS A 115 -15.275 -14.700 -15.391 1.00 34.46 H new ATOM 0 HZ3 LYS A 115 -14.374 -13.466 -14.649 1.00 34.46 H new ATOM 1791 N VAL A 116 -17.124 -13.615 -8.428 1.00 32.39 N ATOM 1792 CA VAL A 116 -18.116 -13.447 -7.379 1.00 32.39 C ATOM 1793 C VAL A 116 -19.534 -13.567 -7.925 1.00 33.53 C ATOM 1794 O VAL A 116 -19.810 -13.197 -9.067 1.00 33.96 O ATOM 1795 CB VAL A 116 -17.956 -12.078 -6.684 1.00 31.13 C ATOM 1796 CG1 VAL A 116 -16.486 -11.740 -6.482 1.00 29.96 C ATOM 1797 CG2 VAL A 116 -18.653 -10.981 -7.475 1.00 31.21 C ATOM 0 H VAL A 116 -16.863 -12.750 -8.902 1.00 32.39 H new ATOM 0 HA VAL A 116 -17.950 -14.244 -6.654 1.00 32.39 H new ATOM 0 HB VAL A 116 -18.429 -12.144 -5.704 1.00 31.13 H new ATOM 0 HG11 VAL A 116 -16.400 -10.771 -5.991 1.00 29.96 H new ATOM 0 HG12 VAL A 116 -16.019 -12.505 -5.861 1.00 29.96 H new ATOM 0 HG13 VAL A 116 -15.985 -11.702 -7.449 1.00 29.96 H new ATOM 0 HG21 VAL A 116 -18.525 -10.027 -6.964 1.00 31.21 H new ATOM 0 HG22 VAL A 116 -18.218 -10.919 -8.473 1.00 31.21 H new ATOM 0 HG23 VAL A 116 -19.716 -11.210 -7.556 1.00 31.21 H new ATOM 1807 N THR A 117 -20.424 -14.097 -7.098 1.00 34.07 N ATOM 1808 CA THR A 117 -21.821 -14.256 -7.474 1.00 35.18 C ATOM 1809 C THR A 117 -22.619 -13.008 -7.110 1.00 34.78 C ATOM 1810 O THR A 117 -22.277 -12.302 -6.163 1.00 33.80 O ATOM 1811 CB THR A 117 -22.451 -15.482 -6.789 1.00 36.10 C ATOM 1812 OG1 THR A 117 -22.187 -15.446 -5.381 1.00 35.42 O ATOM 1813 CG2 THR A 117 -21.905 -16.773 -7.379 1.00 36.81 C ATOM 0 H THR A 117 -20.202 -14.425 -6.158 1.00 34.07 H new ATOM 0 HA THR A 117 -21.852 -14.406 -8.553 1.00 35.18 H new ATOM 0 HB THR A 117 -23.527 -15.451 -6.958 1.00 36.10 H new ATOM 0 HG1 THR A 117 -22.450 -16.299 -4.977 1.00 35.42 H new ATOM 0 HG21 THR A 117 -22.365 -17.625 -6.879 1.00 36.81 H new ATOM 0 HG22 THR A 117 -22.133 -16.811 -8.444 1.00 36.81 H new ATOM 0 HG23 THR A 117 -20.825 -16.809 -7.238 1.00 36.81 H new ATOM 1821 N ASP A 118 -23.680 -12.741 -7.862 1.00 35.59 N ATOM 1822 CA ASP A 118 -24.516 -11.571 -7.617 1.00 35.40 C ATOM 1823 C ASP A 118 -24.961 -11.505 -6.160 1.00 35.21 C ATOM 1824 O ASP A 118 -25.004 -10.431 -5.563 1.00 34.50 O ATOM 1825 CB ASP A 118 -25.740 -11.596 -8.532 1.00 36.59 C ATOM 1826 CG ASP A 118 -25.364 -11.621 -10.000 1.00 36.85 C ATOM 1827 OD1 ASP A 118 -25.186 -12.729 -10.549 1.00 37.02 O ATOM 1828 OD2 ASP A 118 -25.246 -10.533 -10.602 1.00 36.95 O ATOM 0 H ASP A 118 -23.982 -13.318 -8.647 1.00 35.59 H new ATOM 0 HA ASP A 118 -23.921 -10.684 -7.833 1.00 35.40 H new ATOM 0 HB2 ASP A 118 -26.346 -12.472 -8.300 1.00 36.59 H new ATOM 0 HB3 ASP A 118 -26.357 -10.720 -8.333 1.00 36.59 H new ATOM 1833 N GLU A 119 -25.292 -12.661 -5.597 1.00 35.91 N ATOM 1834 CA GLU A 119 -25.746 -12.739 -4.213 1.00 35.91 C ATOM 1835 C GLU A 119 -24.727 -12.146 -3.242 1.00 34.60 C ATOM 1836 O GLU A 119 -25.087 -11.382 -2.346 1.00 34.24 O ATOM 1837 CB GLU A 119 -26.046 -14.190 -3.837 1.00 36.90 C ATOM 1838 CG GLU A 119 -24.880 -15.134 -4.076 1.00 36.71 C ATOM 1839 CD GLU A 119 -25.201 -16.565 -3.691 1.00 37.77 C ATOM 1840 OE1 GLU A 119 -25.733 -17.305 -4.544 1.00 38.22 O ATOM 1841 OE2 GLU A 119 -24.920 -16.945 -2.533 1.00 38.19 O ATOM 0 H GLU A 119 -25.254 -13.559 -6.079 1.00 35.91 H new ATOM 0 HA GLU A 119 -26.658 -12.147 -4.135 1.00 35.91 H new ATOM 0 HB2 GLU A 119 -26.328 -14.233 -2.785 1.00 36.90 H new ATOM 0 HB3 GLU A 119 -26.906 -14.535 -4.411 1.00 36.90 H new ATOM 0 HG2 GLU A 119 -24.599 -15.099 -5.128 1.00 36.71 H new ATOM 0 HG3 GLU A 119 -24.017 -14.792 -3.504 1.00 36.71 H new ATOM 1848 N GLU A 120 -23.454 -12.489 -3.416 1.00 33.92 N ATOM 1849 CA GLU A 120 -22.420 -11.970 -2.530 1.00 32.68 C ATOM 1850 C GLU A 120 -22.298 -10.465 -2.722 1.00 31.73 C ATOM 1851 O GLU A 120 -22.022 -9.724 -1.778 1.00 30.88 O ATOM 1852 CB GLU A 120 -21.079 -12.671 -2.779 1.00 32.23 C ATOM 1853 CG GLU A 120 -20.276 -12.095 -3.934 1.00 31.98 C ATOM 1854 CD GLU A 120 -19.225 -11.103 -3.475 1.00 31.39 C ATOM 1855 OE1 GLU A 120 -19.552 -9.903 -3.355 1.00 31.34 O ATOM 1856 OE2 GLU A 120 -18.076 -11.525 -3.234 1.00 31.03 O ATOM 0 H GLU A 120 -23.118 -13.113 -4.150 1.00 33.92 H new ATOM 0 HA GLU A 120 -22.702 -12.172 -1.497 1.00 32.68 H new ATOM 0 HB2 GLU A 120 -20.479 -12.614 -1.871 1.00 32.23 H new ATOM 0 HB3 GLU A 120 -21.265 -13.727 -2.973 1.00 32.23 H new ATOM 0 HG2 GLU A 120 -19.792 -12.907 -4.476 1.00 31.98 H new ATOM 0 HG3 GLU A 120 -20.953 -11.604 -4.633 1.00 31.98 H new ATOM 1863 N ILE A 121 -22.507 -10.024 -3.958 1.00 31.93 N ATOM 1864 CA ILE A 121 -22.453 -8.608 -4.285 1.00 31.19 C ATOM 1865 C ILE A 121 -23.529 -7.826 -3.534 1.00 31.38 C ATOM 1866 O ILE A 121 -23.238 -6.810 -2.907 1.00 30.48 O ATOM 1867 CB ILE A 121 -22.615 -8.377 -5.805 1.00 31.66 C ATOM 1868 CG1 ILE A 121 -21.376 -8.873 -6.559 1.00 31.30 C ATOM 1869 CG2 ILE A 121 -22.870 -6.905 -6.102 1.00 31.21 C ATOM 1870 CD1 ILE A 121 -20.083 -8.251 -6.080 1.00 29.89 C ATOM 0 H ILE A 121 -22.716 -10.631 -4.751 1.00 31.93 H new ATOM 0 HA ILE A 121 -21.472 -8.246 -3.976 1.00 31.19 H new ATOM 0 HB ILE A 121 -23.478 -8.948 -6.148 1.00 31.66 H new ATOM 0 HG12 ILE A 121 -21.308 -9.956 -6.456 1.00 31.30 H new ATOM 0 HG13 ILE A 121 -21.499 -8.661 -7.621 1.00 31.30 H new ATOM 0 HG21 ILE A 121 -22.981 -6.765 -7.177 1.00 31.21 H new ATOM 0 HG22 ILE A 121 -23.782 -6.585 -5.598 1.00 31.21 H new ATOM 0 HG23 ILE A 121 -22.030 -6.311 -5.743 1.00 31.21 H new ATOM 0 HD11 ILE A 121 -19.251 -8.650 -6.660 1.00 29.89 H new ATOM 0 HD12 ILE A 121 -20.130 -7.170 -6.209 1.00 29.89 H new ATOM 0 HD13 ILE A 121 -19.936 -8.484 -5.026 1.00 29.89 H new ATOM 1882 N ASP A 122 -24.776 -8.290 -3.605 1.00 32.59 N ATOM 1883 CA ASP A 122 -25.869 -7.607 -2.922 1.00 32.95 C ATOM 1884 C ASP A 122 -25.594 -7.507 -1.427 1.00 32.41 C ATOM 1885 O ASP A 122 -25.988 -6.539 -0.778 1.00 32.19 O ATOM 1886 CB ASP A 122 -27.205 -8.319 -3.164 1.00 34.41 C ATOM 1887 CG ASP A 122 -27.404 -9.545 -2.289 1.00 35.02 C ATOM 1888 OD1 ASP A 122 -27.520 -9.386 -1.055 1.00 35.24 O ATOM 1889 OD2 ASP A 122 -27.468 -10.662 -2.840 1.00 35.33 O ATOM 0 H ASP A 122 -25.051 -9.125 -4.122 1.00 32.59 H new ATOM 0 HA ASP A 122 -25.937 -6.600 -3.335 1.00 32.95 H new ATOM 0 HB2 ASP A 122 -28.020 -7.618 -2.984 1.00 34.41 H new ATOM 0 HB3 ASP A 122 -27.265 -8.616 -4.211 1.00 34.41 H new ATOM 1894 N GLU A 123 -24.914 -8.516 -0.887 1.00 32.28 N ATOM 1895 CA GLU A 123 -24.594 -8.552 0.536 1.00 31.88 C ATOM 1896 C GLU A 123 -23.664 -7.409 0.938 1.00 30.51 C ATOM 1897 O GLU A 123 -23.968 -6.645 1.852 1.00 30.32 O ATOM 1898 CB GLU A 123 -23.953 -9.892 0.900 1.00 32.05 C ATOM 1899 CG GLU A 123 -23.414 -9.936 2.319 1.00 31.72 C ATOM 1900 CD GLU A 123 -23.171 -11.351 2.808 1.00 32.49 C ATOM 1901 OE1 GLU A 123 -22.061 -11.875 2.580 1.00 32.69 O ATOM 1902 OE2 GLU A 123 -24.090 -11.935 3.419 1.00 32.95 O ATOM 0 H GLU A 123 -24.574 -9.320 -1.415 1.00 32.28 H new ATOM 0 HA GLU A 123 -25.529 -8.433 1.084 1.00 31.88 H new ATOM 0 HB2 GLU A 123 -24.690 -10.685 0.774 1.00 32.05 H new ATOM 0 HB3 GLU A 123 -23.140 -10.099 0.204 1.00 32.05 H new ATOM 0 HG2 GLU A 123 -22.481 -9.374 2.367 1.00 31.72 H new ATOM 0 HG3 GLU A 123 -24.119 -9.441 2.987 1.00 31.72 H new ATOM 1909 N MET A 124 -22.524 -7.307 0.268 1.00 29.62 N ATOM 1910 CA MET A 124 -21.561 -6.257 0.579 1.00 28.28 C ATOM 1911 C MET A 124 -22.177 -4.869 0.413 1.00 28.13 C ATOM 1912 O MET A 124 -21.998 -3.999 1.267 1.00 27.52 O ATOM 1913 CB MET A 124 -20.308 -6.396 -0.291 1.00 27.46 C ATOM 1914 CG MET A 124 -20.597 -6.506 -1.778 1.00 28.01 C ATOM 1915 SD MET A 124 -19.124 -6.888 -2.745 1.00 27.29 S ATOM 1916 CE MET A 124 -18.053 -5.525 -2.293 1.00 26.32 C ATOM 0 H MET A 124 -22.244 -7.932 -0.488 1.00 29.62 H new ATOM 0 HA MET A 124 -21.273 -6.372 1.624 1.00 28.28 H new ATOM 0 HB2 MET A 124 -19.662 -5.535 -0.120 1.00 27.46 H new ATOM 0 HB3 MET A 124 -19.753 -7.279 0.027 1.00 27.46 H new ATOM 0 HG2 MET A 124 -21.346 -7.281 -1.942 1.00 28.01 H new ATOM 0 HG3 MET A 124 -21.026 -5.568 -2.131 1.00 28.01 H new ATOM 0 HE1 MET A 124 -17.203 -5.489 -2.974 1.00 26.32 H new ATOM 0 HE2 MET A 124 -18.608 -4.589 -2.356 1.00 26.32 H new ATOM 0 HE3 MET A 124 -17.695 -5.666 -1.273 1.00 26.32 H new ATOM 1926 N ILE A 125 -22.902 -4.659 -0.686 1.00 28.78 N ATOM 1927 CA ILE A 125 -23.531 -3.363 -0.940 1.00 28.80 C ATOM 1928 C ILE A 125 -24.513 -2.980 0.162 1.00 29.32 C ATOM 1929 O ILE A 125 -24.373 -1.933 0.782 1.00 28.74 O ATOM 1930 CB ILE A 125 -24.298 -3.346 -2.281 1.00 29.69 C ATOM 1931 CG1 ILE A 125 -23.364 -3.695 -3.444 1.00 29.31 C ATOM 1932 CG2 ILE A 125 -24.942 -1.977 -2.496 1.00 29.77 C ATOM 1933 CD1 ILE A 125 -24.071 -3.839 -4.774 1.00 30.29 C ATOM 0 H ILE A 125 -23.067 -5.361 -1.407 1.00 28.78 H new ATOM 0 HA ILE A 125 -22.712 -2.644 -0.973 1.00 28.80 H new ATOM 0 HB ILE A 125 -25.084 -4.100 -2.244 1.00 29.69 H new ATOM 0 HG12 ILE A 125 -22.602 -2.921 -3.530 1.00 29.31 H new ATOM 0 HG13 ILE A 125 -22.847 -4.627 -3.215 1.00 29.31 H new ATOM 0 HG21 ILE A 125 -25.481 -1.973 -3.444 1.00 29.77 H new ATOM 0 HG22 ILE A 125 -25.637 -1.770 -1.682 1.00 29.77 H new ATOM 0 HG23 ILE A 125 -24.168 -1.210 -2.516 1.00 29.77 H new ATOM 0 HD11 ILE A 125 -23.344 -4.086 -5.548 1.00 30.29 H new ATOM 0 HD12 ILE A 125 -24.814 -4.634 -4.707 1.00 30.29 H new ATOM 0 HD13 ILE A 125 -24.565 -2.901 -5.027 1.00 30.29 H new ATOM 1945 N ARG A 126 -25.503 -3.838 0.398 1.00 30.48 N ATOM 1946 CA ARG A 126 -26.530 -3.579 1.408 1.00 31.17 C ATOM 1947 C ARG A 126 -25.938 -3.235 2.776 1.00 30.45 C ATOM 1948 O ARG A 126 -26.413 -2.322 3.452 1.00 30.52 O ATOM 1949 CB ARG A 126 -27.470 -4.787 1.529 1.00 32.45 C ATOM 1950 CG ARG A 126 -26.808 -6.040 2.082 1.00 32.40 C ATOM 1951 CD ARG A 126 -27.809 -7.170 2.253 1.00 33.74 C ATOM 1952 NE ARG A 126 -28.875 -6.823 3.189 1.00 34.27 N ATOM 1953 CZ ARG A 126 -29.732 -7.707 3.693 1.00 35.37 C ATOM 1954 NH1 ARG A 126 -29.646 -8.987 3.354 1.00 36.06 N ATOM 1955 NH2 ARG A 126 -30.674 -7.314 4.539 1.00 35.85 N ATOM 0 H ARG A 126 -25.617 -4.722 -0.098 1.00 30.48 H new ATOM 0 HA ARG A 126 -27.092 -2.707 1.074 1.00 31.17 H new ATOM 0 HB2 ARG A 126 -28.308 -4.518 2.173 1.00 32.45 H new ATOM 0 HB3 ARG A 126 -27.883 -5.012 0.546 1.00 32.45 H new ATOM 0 HG2 ARG A 126 -26.010 -6.358 1.411 1.00 32.40 H new ATOM 0 HG3 ARG A 126 -26.345 -5.814 3.043 1.00 32.40 H new ATOM 0 HD2 ARG A 126 -28.244 -7.418 1.285 1.00 33.74 H new ATOM 0 HD3 ARG A 126 -27.292 -8.061 2.608 1.00 33.74 H new ATOM 0 HE ARG A 126 -28.968 -5.848 3.472 1.00 34.27 H new ATOM 0 HH11 ARG A 126 -28.922 -9.295 2.706 1.00 36.06 H new ATOM 0 HH12 ARG A 126 -30.304 -9.663 3.742 1.00 36.06 H new ATOM 0 HH21 ARG A 126 -30.743 -6.332 4.805 1.00 35.85 H new ATOM 0 HH22 ARG A 126 -31.330 -7.994 4.924 1.00 35.85 H new ATOM 1969 N GLU A 127 -24.905 -3.966 3.182 1.00 29.84 N ATOM 1970 CA GLU A 127 -24.273 -3.748 4.482 1.00 29.22 C ATOM 1971 C GLU A 127 -23.657 -2.356 4.606 1.00 28.15 C ATOM 1972 O GLU A 127 -23.821 -1.690 5.630 1.00 28.09 O ATOM 1973 CB GLU A 127 -23.192 -4.798 4.728 1.00 28.76 C ATOM 1974 CG GLU A 127 -22.960 -5.094 6.203 1.00 28.80 C ATOM 1975 CD GLU A 127 -22.067 -6.300 6.422 1.00 28.73 C ATOM 1976 OE1 GLU A 127 -22.597 -7.429 6.471 1.00 28.78 O ATOM 1977 OE2 GLU A 127 -20.837 -6.116 6.545 1.00 28.70 O ATOM 0 H GLU A 127 -24.486 -4.715 2.631 1.00 29.84 H new ATOM 0 HA GLU A 127 -25.060 -3.835 5.232 1.00 29.22 H new ATOM 0 HB2 GLU A 127 -23.470 -5.721 4.219 1.00 28.76 H new ATOM 0 HB3 GLU A 127 -22.257 -4.458 4.282 1.00 28.76 H new ATOM 0 HG2 GLU A 127 -22.510 -4.222 6.678 1.00 28.80 H new ATOM 0 HG3 GLU A 127 -23.920 -5.264 6.691 1.00 28.80 H new ATOM 1984 N ALA A 128 -22.953 -1.916 3.568 1.00 27.36 N ATOM 1985 CA ALA A 128 -22.298 -0.613 3.599 1.00 26.33 C ATOM 1986 C ALA A 128 -23.204 0.497 3.081 1.00 26.81 C ATOM 1987 O ALA A 128 -22.962 1.669 3.348 1.00 26.28 O ATOM 1988 CB ALA A 128 -21.001 -0.652 2.802 1.00 25.22 C ATOM 0 H ALA A 128 -22.822 -2.438 2.701 1.00 27.36 H new ATOM 0 HA ALA A 128 -22.072 -0.389 4.641 1.00 26.33 H new ATOM 0 HB1 ALA A 128 -20.524 0.328 2.835 1.00 25.22 H new ATOM 0 HB2 ALA A 128 -20.331 -1.396 3.233 1.00 25.22 H new ATOM 0 HB3 ALA A 128 -21.218 -0.916 1.767 1.00 25.22 H new ATOM 1994 N ASP A 129 -24.251 0.126 2.353 1.00 27.88 N ATOM 1995 CA ASP A 129 -25.176 1.107 1.796 1.00 28.48 C ATOM 1996 C ASP A 129 -25.993 1.783 2.891 1.00 29.02 C ATOM 1997 O ASP A 129 -27.176 1.494 3.074 1.00 30.17 O ATOM 1998 CB ASP A 129 -26.107 0.449 0.781 1.00 29.57 C ATOM 1999 CG ASP A 129 -26.915 1.469 0.010 1.00 30.10 C ATOM 2000 OD1 ASP A 129 -26.315 2.456 -0.477 1.00 30.12 O ATOM 2001 OD2 ASP A 129 -28.143 1.282 -0.111 1.00 30.56 O ATOM 0 H ASP A 129 -24.480 -0.844 2.135 1.00 27.88 H new ATOM 0 HA ASP A 129 -24.584 1.871 1.292 1.00 28.48 H new ATOM 0 HB2 ASP A 129 -25.520 -0.150 0.085 1.00 29.57 H new ATOM 0 HB3 ASP A 129 -26.782 -0.233 1.297 1.00 29.57 H new ATOM 2006 N PHE A 130 -25.347 2.685 3.616 1.00 28.23 N ATOM 2007 CA PHE A 130 -25.994 3.415 4.700 1.00 28.72 C ATOM 2008 C PHE A 130 -26.976 4.451 4.163 1.00 29.48 C ATOM 2009 O PHE A 130 -28.053 4.650 4.724 1.00 30.47 O ATOM 2010 CB PHE A 130 -24.944 4.109 5.571 1.00 27.68 C ATOM 2011 CG PHE A 130 -23.930 3.170 6.161 1.00 26.94 C ATOM 2012 CD1 PHE A 130 -24.316 2.183 7.055 1.00 26.82 C ATOM 2013 CD2 PHE A 130 -22.591 3.276 5.823 1.00 26.44 C ATOM 2014 CE1 PHE A 130 -23.385 1.318 7.598 1.00 26.23 C ATOM 2015 CE2 PHE A 130 -21.655 2.413 6.364 1.00 25.82 C ATOM 2016 CZ PHE A 130 -22.054 1.433 7.253 1.00 25.72 C ATOM 0 H PHE A 130 -24.368 2.931 3.472 1.00 28.23 H new ATOM 0 HA PHE A 130 -26.548 2.694 5.301 1.00 28.72 H new ATOM 0 HB2 PHE A 130 -24.426 4.859 4.972 1.00 27.68 H new ATOM 0 HB3 PHE A 130 -25.448 4.639 6.379 1.00 27.68 H new ATOM 0 HD1 PHE A 130 -25.356 2.089 7.330 1.00 26.82 H new ATOM 0 HD2 PHE A 130 -22.274 4.041 5.129 1.00 26.44 H new ATOM 0 HE1 PHE A 130 -23.699 0.552 8.292 1.00 26.23 H new ATOM 0 HE2 PHE A 130 -20.614 2.505 6.092 1.00 25.82 H new ATOM 0 HZ PHE A 130 -21.325 0.758 7.677 1.00 25.72 H new ATOM 2026 N ASP A 131 -26.596 5.110 3.070 1.00 29.07 N ATOM 2027 CA ASP A 131 -27.440 6.136 2.464 1.00 29.81 C ATOM 2028 C ASP A 131 -28.652 5.500 1.795 1.00 31.01 C ATOM 2029 O ASP A 131 -29.540 6.195 1.299 1.00 31.82 O ATOM 2030 CB ASP A 131 -26.664 6.917 1.408 1.00 29.11 C ATOM 2031 CG ASP A 131 -25.167 6.912 1.638 1.00 27.70 C ATOM 2032 OD1 ASP A 131 -24.714 7.511 2.636 1.00 27.01 O ATOM 2033 OD2 ASP A 131 -24.448 6.303 0.814 1.00 27.31 O ATOM 0 H ASP A 131 -25.711 4.952 2.587 1.00 29.07 H new ATOM 0 HA ASP A 131 -27.763 6.810 3.258 1.00 29.81 H new ATOM 0 HB2 ASP A 131 -26.875 6.494 0.426 1.00 29.11 H new ATOM 0 HB3 ASP A 131 -27.019 7.947 1.395 1.00 29.11 H new ATOM 2038 N GLY A 132 -28.674 4.173 1.789 1.00 31.16 N ATOM 2039 CA GLY A 132 -29.759 3.446 1.162 1.00 32.30 C ATOM 2040 C GLY A 132 -29.909 3.768 -0.305 1.00 32.54 C ATOM 2041 O GLY A 132 -31.014 4.010 -0.788 1.00 33.59 O ATOM 0 H GLY A 132 -27.955 3.585 2.210 1.00 31.16 H new ATOM 0 HA2 GLY A 132 -29.588 2.376 1.279 1.00 32.30 H new ATOM 0 HA3 GLY A 132 -30.691 3.678 1.677 1.00 32.30 H new ATOM 2045 N ASP A 133 -28.786 3.762 -1.017 1.00 31.60 N ATOM 2046 CA ASP A 133 -28.789 4.017 -2.438 1.00 31.81 C ATOM 2047 C ASP A 133 -28.450 2.733 -3.158 1.00 31.80 C ATOM 2048 O ASP A 133 -27.832 1.832 -2.594 1.00 31.29 O ATOM 2049 CB ASP A 133 -27.753 5.071 -2.837 1.00 30.84 C ATOM 2050 CG ASP A 133 -27.421 6.041 -1.732 1.00 30.25 C ATOM 2051 OD1 ASP A 133 -28.347 6.694 -1.208 1.00 30.65 O ATOM 2052 OD2 ASP A 133 -26.221 6.148 -1.392 1.00 29.45 O ATOM 0 H ASP A 133 -27.863 3.582 -0.623 1.00 31.60 H new ATOM 0 HA ASP A 133 -29.778 4.387 -2.708 1.00 31.81 H new ATOM 0 HB2 ASP A 133 -26.839 4.568 -3.154 1.00 30.84 H new ATOM 0 HB3 ASP A 133 -28.126 5.627 -3.697 1.00 30.84 H new ATOM 2057 N GLY A 134 -28.852 2.657 -4.397 1.00 32.44 N ATOM 2058 CA GLY A 134 -28.549 1.488 -5.192 1.00 32.56 C ATOM 2059 C GLY A 134 -27.085 1.444 -5.572 1.00 31.38 C ATOM 2060 O GLY A 134 -26.706 0.766 -6.524 1.00 31.48 O ATOM 0 H GLY A 134 -29.385 3.381 -4.879 1.00 32.44 H new ATOM 0 HA2 GLY A 134 -28.809 0.589 -4.633 1.00 32.56 H new ATOM 0 HA3 GLY A 134 -29.161 1.491 -6.094 1.00 32.56 H new ATOM 2064 N MET A 135 -26.258 2.182 -4.825 1.00 30.31 N ATOM 2065 CA MET A 135 -24.827 2.240 -5.092 1.00 29.12 C ATOM 2066 C MET A 135 -24.021 2.455 -3.809 1.00 28.02 C ATOM 2067 O MET A 135 -24.526 2.997 -2.815 1.00 28.13 O ATOM 2068 CB MET A 135 -24.533 3.355 -6.098 1.00 28.97 C ATOM 2069 CG MET A 135 -25.363 4.610 -5.874 1.00 29.26 C ATOM 2070 SD MET A 135 -25.636 5.546 -7.390 1.00 30.55 S ATOM 2071 CE MET A 135 -26.587 4.372 -8.353 1.00 31.50 C ATOM 0 H MET A 135 -26.560 2.746 -4.031 1.00 30.31 H new ATOM 0 HA MET A 135 -24.523 1.282 -5.513 1.00 29.12 H new ATOM 0 HB2 MET A 135 -23.476 3.614 -6.043 1.00 28.97 H new ATOM 0 HB3 MET A 135 -24.717 2.982 -7.106 1.00 28.97 H new ATOM 0 HG2 MET A 135 -26.326 4.332 -5.446 1.00 29.26 H new ATOM 0 HG3 MET A 135 -24.862 5.246 -5.145 1.00 29.26 H new ATOM 0 HE1 MET A 135 -27.234 4.909 -9.046 1.00 31.50 H new ATOM 0 HE2 MET A 135 -25.910 3.728 -8.914 1.00 31.50 H new ATOM 0 HE3 MET A 135 -27.197 3.763 -7.686 1.00 31.50 H new ATOM 2081 N ILE A 136 -22.758 2.034 -3.849 1.00 27.01 N ATOM 2082 CA ILE A 136 -21.867 2.163 -2.699 1.00 25.91 C ATOM 2083 C ILE A 136 -21.013 3.421 -2.807 1.00 24.90 C ATOM 2084 O ILE A 136 -20.431 3.691 -3.846 1.00 24.54 O ATOM 2085 CB ILE A 136 -20.921 0.952 -2.562 1.00 25.40 C ATOM 2086 CG1 ILE A 136 -21.708 -0.358 -2.528 1.00 26.49 C ATOM 2087 CG2 ILE A 136 -20.071 1.092 -1.309 1.00 24.33 C ATOM 2088 CD1 ILE A 136 -20.826 -1.587 -2.463 1.00 26.17 C ATOM 0 H ILE A 136 -22.329 1.600 -4.667 1.00 27.01 H new ATOM 0 HA ILE A 136 -22.510 2.218 -1.821 1.00 25.91 H new ATOM 0 HB ILE A 136 -20.266 0.929 -3.433 1.00 25.40 H new ATOM 0 HG12 ILE A 136 -22.374 -0.351 -1.665 1.00 26.49 H new ATOM 0 HG13 ILE A 136 -22.338 -0.418 -3.416 1.00 26.49 H new ATOM 0 HG21 ILE A 136 -19.407 0.232 -1.222 1.00 24.33 H new ATOM 0 HG22 ILE A 136 -19.477 2.004 -1.372 1.00 24.33 H new ATOM 0 HG23 ILE A 136 -20.719 1.140 -0.434 1.00 24.33 H new ATOM 0 HD11 ILE A 136 -21.449 -2.481 -2.442 1.00 26.17 H new ATOM 0 HD12 ILE A 136 -20.178 -1.617 -3.339 1.00 26.17 H new ATOM 0 HD13 ILE A 136 -20.215 -1.549 -1.561 1.00 26.17 H new ATOM 2100 N ASN A 137 -20.932 4.179 -1.723 1.00 24.49 N ATOM 2101 CA ASN A 137 -20.139 5.400 -1.707 1.00 23.59 C ATOM 2102 C ASN A 137 -18.751 5.107 -1.155 1.00 22.27 C ATOM 2103 O ASN A 137 -18.588 4.196 -0.348 1.00 22.13 O ATOM 2104 CB ASN A 137 -20.840 6.470 -0.863 1.00 23.94 C ATOM 2105 CG ASN A 137 -20.147 7.820 -0.909 1.00 23.25 C ATOM 2106 OD1 ASN A 137 -18.930 7.912 -1.054 1.00 22.19 O ATOM 2107 ND2 ASN A 137 -20.924 8.886 -0.782 1.00 23.92 N ATOM 0 H ASN A 137 -21.405 3.970 -0.844 1.00 24.49 H new ATOM 0 HA ASN A 137 -20.037 5.776 -2.725 1.00 23.59 H new ATOM 0 HB2 ASN A 137 -21.866 6.584 -1.213 1.00 23.94 H new ATOM 0 HB3 ASN A 137 -20.891 6.131 0.172 1.00 23.94 H new ATOM 0 HD21 ASN A 137 -20.515 9.820 -0.803 1.00 23.92 H new ATOM 0 HD22 ASN A 137 -21.931 8.772 -0.663 1.00 23.92 H new ATOM 2114 N TYR A 138 -17.756 5.862 -1.607 1.00 21.38 N ATOM 2115 CA TYR A 138 -16.381 5.678 -1.151 1.00 20.08 C ATOM 2116 C TYR A 138 -16.319 5.356 0.337 1.00 19.79 C ATOM 2117 O TYR A 138 -15.584 4.464 0.749 1.00 19.22 O ATOM 2118 CB TYR A 138 -15.557 6.930 -1.446 1.00 19.28 C ATOM 2119 CG TYR A 138 -14.158 6.876 -0.876 1.00 17.91 C ATOM 2120 CD1 TYR A 138 -13.189 6.051 -1.434 1.00 17.42 C ATOM 2121 CD2 TYR A 138 -13.807 7.649 0.224 1.00 17.16 C ATOM 2122 CE1 TYR A 138 -11.914 5.998 -0.913 1.00 16.17 C ATOM 2123 CE2 TYR A 138 -12.532 7.601 0.752 1.00 15.93 C ATOM 2124 CZ TYR A 138 -11.588 6.774 0.181 1.00 15.40 C ATOM 2125 OH TYR A 138 -10.316 6.725 0.703 1.00 14.17 O ATOM 0 H TYR A 138 -17.875 6.610 -2.291 1.00 21.38 H new ATOM 0 HA TYR A 138 -15.964 4.831 -1.695 1.00 20.08 H new ATOM 0 HB2 TYR A 138 -15.496 7.070 -2.525 1.00 19.28 H new ATOM 0 HB3 TYR A 138 -16.073 7.800 -1.040 1.00 19.28 H new ATOM 0 HD1 TYR A 138 -13.439 5.441 -2.290 1.00 17.42 H new ATOM 0 HD2 TYR A 138 -14.544 8.298 0.674 1.00 17.16 H new ATOM 0 HE1 TYR A 138 -11.173 5.352 -1.359 1.00 16.17 H new ATOM 0 HE2 TYR A 138 -12.276 8.208 1.608 1.00 15.93 H new ATOM 0 HH TYR A 138 -10.253 7.332 1.469 1.00 14.17 H new ATOM 2135 N GLU A 139 -17.106 6.073 1.128 1.00 20.30 N ATOM 2136 CA GLU A 139 -17.133 5.873 2.576 1.00 20.23 C ATOM 2137 C GLU A 139 -17.635 4.479 2.950 1.00 20.87 C ATOM 2138 O GLU A 139 -17.070 3.813 3.821 1.00 20.48 O ATOM 2139 CB GLU A 139 -18.026 6.927 3.228 1.00 20.94 C ATOM 2140 CG GLU A 139 -19.423 6.999 2.630 1.00 22.25 C ATOM 2141 CD GLU A 139 -20.278 8.072 3.273 1.00 22.99 C ATOM 2142 OE1 GLU A 139 -20.898 7.789 4.321 1.00 23.27 O ATOM 2143 OE2 GLU A 139 -20.328 9.196 2.731 1.00 23.36 O ATOM 0 H GLU A 139 -17.737 6.801 0.793 1.00 20.30 H new ATOM 0 HA GLU A 139 -16.110 5.971 2.940 1.00 20.23 H new ATOM 0 HB2 GLU A 139 -18.107 6.713 4.294 1.00 20.94 H new ATOM 0 HB3 GLU A 139 -17.549 7.903 3.134 1.00 20.94 H new ATOM 0 HG2 GLU A 139 -19.347 7.193 1.560 1.00 22.25 H new ATOM 0 HG3 GLU A 139 -19.913 6.032 2.744 1.00 22.25 H new ATOM 2150 N GLU A 140 -18.682 4.038 2.270 1.00 21.93 N ATOM 2151 CA GLU A 140 -19.284 2.740 2.539 1.00 22.74 C ATOM 2152 C GLU A 140 -18.363 1.616 2.091 1.00 22.24 C ATOM 2153 O GLU A 140 -18.128 0.654 2.821 1.00 22.29 O ATOM 2154 CB GLU A 140 -20.613 2.616 1.801 1.00 24.01 C ATOM 2155 CG GLU A 140 -21.524 3.826 1.937 1.00 24.56 C ATOM 2156 CD GLU A 140 -22.837 3.645 1.194 1.00 25.83 C ATOM 2157 OE1 GLU A 140 -22.815 3.088 0.080 1.00 26.40 O ATOM 2158 OE2 GLU A 140 -23.888 4.057 1.726 1.00 26.30 O ATOM 0 H GLU A 140 -19.135 4.564 1.523 1.00 21.93 H new ATOM 0 HA GLU A 140 -19.449 2.661 3.614 1.00 22.74 H new ATOM 0 HB2 GLU A 140 -20.412 2.445 0.743 1.00 24.01 H new ATOM 0 HB3 GLU A 140 -21.140 1.737 2.172 1.00 24.01 H new ATOM 0 HG2 GLU A 140 -21.728 4.008 2.992 1.00 24.56 H new ATOM 0 HG3 GLU A 140 -21.011 4.709 1.555 1.00 24.56 H new ATOM 2165 N PHE A 141 -17.852 1.755 0.880 1.00 21.88 N ATOM 2166 CA PHE A 141 -16.967 0.764 0.294 1.00 21.51 C ATOM 2167 C PHE A 141 -15.693 0.597 1.122 1.00 20.36 C ATOM 2168 O PHE A 141 -15.346 -0.514 1.522 1.00 20.46 O ATOM 2169 CB PHE A 141 -16.632 1.179 -1.140 1.00 21.36 C ATOM 2170 CG PHE A 141 -15.560 0.357 -1.784 1.00 20.89 C ATOM 2171 CD1 PHE A 141 -15.860 -0.847 -2.396 1.00 20.72 C ATOM 2172 CD2 PHE A 141 -14.252 0.798 -1.780 1.00 20.72 C ATOM 2173 CE1 PHE A 141 -14.868 -1.600 -2.993 1.00 20.40 C ATOM 2174 CE2 PHE A 141 -13.254 0.051 -2.373 1.00 20.40 C ATOM 2175 CZ PHE A 141 -13.562 -1.149 -2.981 1.00 20.24 C ATOM 0 H PHE A 141 -18.038 2.556 0.277 1.00 21.88 H new ATOM 0 HA PHE A 141 -17.473 -0.201 0.285 1.00 21.51 H new ATOM 0 HB2 PHE A 141 -17.536 1.114 -1.745 1.00 21.36 H new ATOM 0 HB3 PHE A 141 -16.322 2.224 -1.141 1.00 21.36 H new ATOM 0 HD1 PHE A 141 -16.880 -1.202 -2.407 1.00 20.72 H new ATOM 0 HD2 PHE A 141 -14.007 1.738 -1.308 1.00 20.72 H new ATOM 0 HE1 PHE A 141 -15.112 -2.539 -3.468 1.00 20.40 H new ATOM 0 HE2 PHE A 141 -12.234 0.405 -2.361 1.00 20.40 H new ATOM 0 HZ PHE A 141 -12.783 -1.735 -3.447 1.00 20.24 H new ATOM 2185 N VAL A 142 -14.999 1.706 1.372 1.00 19.36 N ATOM 2186 CA VAL A 142 -13.757 1.670 2.148 1.00 18.22 C ATOM 2187 C VAL A 142 -13.985 1.035 3.510 1.00 18.56 C ATOM 2188 O VAL A 142 -13.098 0.384 4.062 1.00 18.08 O ATOM 2189 CB VAL A 142 -13.136 3.070 2.344 1.00 17.23 C ATOM 2190 CG1 VAL A 142 -14.066 3.988 3.111 1.00 17.77 C ATOM 2191 CG2 VAL A 142 -11.799 2.954 3.055 1.00 16.07 C ATOM 0 H VAL A 142 -15.272 2.635 1.052 1.00 19.36 H new ATOM 0 HA VAL A 142 -13.058 1.067 1.569 1.00 18.22 H new ATOM 0 HB VAL A 142 -12.978 3.509 1.359 1.00 17.23 H new ATOM 0 HG11 VAL A 142 -13.597 4.964 3.230 1.00 17.77 H new ATOM 0 HG12 VAL A 142 -15.001 4.100 2.562 1.00 17.77 H new ATOM 0 HG13 VAL A 142 -14.270 3.561 4.093 1.00 17.77 H new ATOM 0 HG21 VAL A 142 -11.370 3.947 3.188 1.00 16.07 H new ATOM 0 HG22 VAL A 142 -11.944 2.488 4.030 1.00 16.07 H new ATOM 0 HG23 VAL A 142 -11.121 2.343 2.458 1.00 16.07 H new ATOM 2201 N TRP A 143 -15.181 1.230 4.045 1.00 19.50 N ATOM 2202 CA TRP A 143 -15.538 0.662 5.332 1.00 20.05 C ATOM 2203 C TRP A 143 -15.516 -0.856 5.246 1.00 20.61 C ATOM 2204 O TRP A 143 -14.891 -1.542 6.054 1.00 20.44 O ATOM 2205 CB TRP A 143 -16.939 1.126 5.738 1.00 21.15 C ATOM 2206 CG TRP A 143 -17.596 0.204 6.716 1.00 22.13 C ATOM 2207 CD1 TRP A 143 -17.437 0.223 8.056 1.00 22.20 C ATOM 2208 CD2 TRP A 143 -18.483 -0.883 6.431 1.00 23.25 C ATOM 2209 NE1 TRP A 143 -18.180 -0.775 8.640 1.00 23.30 N ATOM 2210 CE2 TRP A 143 -18.827 -1.469 7.662 1.00 23.94 C ATOM 2211 CE3 TRP A 143 -19.022 -1.416 5.262 1.00 23.82 C ATOM 2212 CZ2 TRP A 143 -19.678 -2.560 7.755 1.00 25.11 C ATOM 2213 CZ3 TRP A 143 -19.867 -2.502 5.356 1.00 24.98 C ATOM 2214 CH2 TRP A 143 -20.187 -3.062 6.596 1.00 25.59 C ATOM 0 H TRP A 143 -15.920 1.778 3.605 1.00 19.50 H new ATOM 0 HA TRP A 143 -14.817 0.996 6.078 1.00 20.05 H new ATOM 0 HB2 TRP A 143 -16.874 2.123 6.173 1.00 21.15 H new ATOM 0 HB3 TRP A 143 -17.562 1.207 4.847 1.00 21.15 H new ATOM 0 HD1 TRP A 143 -16.814 0.923 8.593 1.00 22.20 H new ATOM 0 HE1 TRP A 143 -18.238 -0.965 9.641 1.00 23.30 H new ATOM 0 HE3 TRP A 143 -18.783 -0.987 4.300 1.00 23.82 H new ATOM 0 HZ2 TRP A 143 -19.928 -2.995 8.711 1.00 25.11 H new ATOM 0 HZ3 TRP A 143 -20.288 -2.927 4.457 1.00 24.98 H new ATOM 0 HH2 TRP A 143 -20.853 -3.912 6.636 1.00 25.59 H new ATOM 2225 N MET A 144 -16.222 -1.349 4.249 1.00 21.37 N ATOM 2226 CA MET A 144 -16.360 -2.773 4.001 1.00 22.12 C ATOM 2227 C MET A 144 -15.018 -3.497 3.918 1.00 21.40 C ATOM 2228 O MET A 144 -14.838 -4.546 4.534 1.00 21.75 O ATOM 2229 CB MET A 144 -17.157 -2.939 2.716 1.00 22.89 C ATOM 2230 CG MET A 144 -17.198 -4.361 2.178 1.00 23.65 C ATOM 2231 SD MET A 144 -15.895 -4.687 0.977 1.00 23.25 S ATOM 2232 CE MET A 144 -16.267 -3.447 -0.260 1.00 22.97 C ATOM 0 H MET A 144 -16.723 -0.766 3.579 1.00 21.37 H new ATOM 0 HA MET A 144 -16.880 -3.232 4.842 1.00 22.12 H new ATOM 0 HB2 MET A 144 -18.178 -2.601 2.891 1.00 22.89 H new ATOM 0 HB3 MET A 144 -16.731 -2.287 1.953 1.00 22.89 H new ATOM 0 HG2 MET A 144 -17.106 -5.062 3.008 1.00 23.65 H new ATOM 0 HG3 MET A 144 -18.168 -4.542 1.714 1.00 23.65 H new ATOM 0 HE1 MET A 144 -15.746 -3.690 -1.186 1.00 22.97 H new ATOM 0 HE2 MET A 144 -17.341 -3.426 -0.442 1.00 22.97 H new ATOM 0 HE3 MET A 144 -15.940 -2.470 0.095 1.00 22.97 H new ATOM 2242 N ILE A 145 -14.083 -2.943 3.157 1.00 20.47 N ATOM 2243 CA ILE A 145 -12.770 -3.561 3.004 1.00 19.79 C ATOM 2244 C ILE A 145 -11.910 -3.356 4.249 1.00 18.96 C ATOM 2245 O ILE A 145 -10.890 -4.022 4.424 1.00 18.60 O ATOM 2246 CB ILE A 145 -12.024 -2.993 1.783 1.00 19.06 C ATOM 2247 CG1 ILE A 145 -11.607 -1.546 2.046 1.00 18.09 C ATOM 2248 CG2 ILE A 145 -12.897 -3.084 0.540 1.00 20.01 C ATOM 2249 CD1 ILE A 145 -10.771 -0.945 0.939 1.00 17.41 C ATOM 0 H ILE A 145 -14.207 -2.073 2.639 1.00 20.47 H new ATOM 0 HA ILE A 145 -12.940 -4.628 2.858 1.00 19.79 H new ATOM 0 HB ILE A 145 -11.125 -3.586 1.613 1.00 19.06 H new ATOM 0 HG12 ILE A 145 -12.501 -0.939 2.185 1.00 18.09 H new ATOM 0 HG13 ILE A 145 -11.045 -1.503 2.979 1.00 18.09 H new ATOM 0 HG21 ILE A 145 -12.356 -2.679 -0.315 1.00 20.01 H new ATOM 0 HG22 ILE A 145 -13.150 -4.127 0.348 1.00 20.01 H new ATOM 0 HG23 ILE A 145 -13.812 -2.512 0.695 1.00 20.01 H new ATOM 0 HD11 ILE A 145 -10.513 0.083 1.195 1.00 17.41 H new ATOM 0 HD12 ILE A 145 -9.859 -1.528 0.814 1.00 17.41 H new ATOM 0 HD13 ILE A 145 -11.338 -0.955 0.008 1.00 17.41 H new ATOM 2261 N SER A 146 -12.328 -2.432 5.109 1.00 18.76 N ATOM 2262 CA SER A 146 -11.590 -2.135 6.333 1.00 18.09 C ATOM 2263 C SER A 146 -11.850 -3.195 7.399 1.00 18.99 C ATOM 2264 O SER A 146 -11.323 -3.116 8.509 1.00 18.73 O ATOM 2265 CB SER A 146 -11.974 -0.753 6.864 1.00 17.78 C ATOM 2266 OG SER A 146 -11.248 -0.438 8.041 1.00 17.22 O ATOM 0 H SER A 146 -13.174 -1.876 4.981 1.00 18.76 H new ATOM 0 HA SER A 146 -10.526 -2.141 6.095 1.00 18.09 H new ATOM 0 HB2 SER A 146 -11.779 0.000 6.101 1.00 17.78 H new ATOM 0 HB3 SER A 146 -13.043 -0.725 7.074 1.00 17.78 H new ATOM 0 HG SER A 146 -11.037 -1.263 8.526 1.00 17.22 H new ATOM 2272 N GLN A 147 -12.664 -4.188 7.054 1.00 20.13 N ATOM 2273 CA GLN A 147 -12.993 -5.268 7.978 1.00 21.14 C ATOM 2274 C GLN A 147 -13.027 -6.602 7.244 1.00 21.86 C ATOM 2275 O GLN A 147 -12.433 -7.584 7.687 1.00 22.11 O ATOM 2276 CB GLN A 147 -14.344 -5.013 8.644 1.00 22.13 C ATOM 2277 CG GLN A 147 -14.685 -3.543 8.788 1.00 21.65 C ATOM 2278 CD GLN A 147 -15.846 -3.312 9.723 1.00 22.67 C ATOM 2279 OE1 GLN A 147 -17.049 -3.355 9.175 1.00 22.79 O flip ATOM 2280 NE2 GLN A 147 -15.666 -3.103 10.923 1.00 23.48 N flip ATOM 0 H GLN A 147 -13.109 -4.267 6.139 1.00 20.13 H new ATOM 0 HA GLN A 147 -12.222 -5.303 8.747 1.00 21.14 H new ATOM 0 HB2 GLN A 147 -15.124 -5.502 8.061 1.00 22.13 H new ATOM 0 HB3 GLN A 147 -14.346 -5.476 9.631 1.00 22.13 H new ATOM 0 HG2 GLN A 147 -13.812 -3.005 9.157 1.00 21.65 H new ATOM 0 HG3 GLN A 147 -14.923 -3.130 7.808 1.00 21.65 H new ATOM 0 HE21 GLN A 147 -14.719 -3.079 11.300 1.00 23.48 H new ATOM 0 HE22 GLN A 147 -16.464 -2.954 11.540 1.00 23.48 H new ATOM 2289 N LYS A 148 -13.733 -6.622 6.119 1.00 22.30 N ATOM 2290 CA LYS A 148 -13.859 -7.828 5.310 1.00 23.11 C ATOM 2291 C LYS A 148 -12.691 -7.960 4.338 1.00 22.36 C ATOM 2292 O LYS A 148 -12.792 -7.420 3.215 1.00 22.12 O ATOM 2293 CB LYS A 148 -15.183 -7.808 4.545 1.00 24.04 C ATOM 2294 CG LYS A 148 -16.382 -8.183 5.401 1.00 24.96 C ATOM 2295 CD LYS A 148 -17.668 -7.581 4.858 1.00 25.58 C ATOM 2296 CE LYS A 148 -17.809 -6.121 5.258 1.00 25.71 C ATOM 2297 NZ LYS A 148 -17.884 -5.956 6.736 1.00 26.17 N ATOM 2298 OXT LYS A 148 -11.684 -8.599 4.707 1.00 22.11 O ATOM 0 H LYS A 148 -14.229 -5.813 5.746 1.00 22.30 H new ATOM 0 HA LYS A 148 -13.843 -8.690 5.976 1.00 23.11 H new ATOM 0 HB2 LYS A 148 -15.339 -6.812 4.131 1.00 24.04 H new ATOM 0 HB3 LYS A 148 -15.118 -8.497 3.703 1.00 24.04 H new ATOM 0 HG2 LYS A 148 -16.476 -9.268 5.441 1.00 24.96 H new ATOM 0 HG3 LYS A 148 -16.222 -7.839 6.423 1.00 24.96 H new ATOM 0 HD2 LYS A 148 -17.680 -7.665 3.771 1.00 25.58 H new ATOM 0 HD3 LYS A 148 -18.522 -8.146 5.231 1.00 25.58 H new ATOM 0 HE2 LYS A 148 -16.961 -5.555 4.872 1.00 25.71 H new ATOM 0 HE3 LYS A 148 -18.706 -5.704 4.800 1.00 25.71 H new ATOM 0 HZ1 LYS A 148 -18.746 -5.429 6.983 1.00 26.17 H new ATOM 0 HZ2 LYS A 148 -17.909 -6.892 7.189 1.00 26.17 H new ATOM 0 HZ3 LYS A 148 -17.050 -5.432 7.070 1.00 26.17 H new