USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1167 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 118 MET CE :methyl -159:sc= -1.03 (180deg=-0.0578) USER MOD Set 1.2: A 119 LYS NZ :NH3+ 173:sc= 0.0203 (180deg=0.162) USER MOD Set 2.1: A 107 ASN : amide:sc= -5.88! C(o=-5.9!,f=-2.4!) USER MOD Set 2.2: A 112 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 73 THR OG1 : rot -34:sc= -0.473 USER MOD Set 3.2: A 74 GLN : amide:sc= -8.07! K(o=-8.5!,f=-1) USER MOD Set 4.1: A 31 SER OG : rot 180:sc= -2.03 USER MOD Set 4.2: A 62 THR OG1 : rot -158:sc= -1.46 USER MOD Set 5.1: A 13 SER OG : rot 55:sc= 0.751 USER MOD Set 5.2: A 17 GLN : amide:sc= -6.82! K(o=-9.6!,f=-4.1) USER MOD Set 5.3: A 93 THR OG1 : rot -105:sc= -3.57! USER MOD Single : A 1 THR N :NH3+ 179:sc= 0.205 (180deg=0.205) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot -13:sc= -3.63! USER MOD Single : A 10 ASN : amide:sc= -1.04 X(o=-1,f=-1.1) USER MOD Single : A 19 ASN : amide:sc= -0.717 K(o=-0.72,f=-2.8!) USER MOD Single : A 23 LYS NZ :NH3+ 167:sc= -0.0383 (180deg=-0.247) USER MOD Single : A 32 HIS : no HD1:sc= -1.44 K(o=-1.4,f=-0.18) USER MOD Single : A 35 THR OG1 : rot -154:sc= -6.51! USER MOD Single : A 37 SER OG : rot 180:sc= 0.162 USER MOD Single : A 38 SER OG : rot -90:sc= -0.612 USER MOD Single : A 40 TYR OH : rot 90:sc= -12.4! USER MOD Single : A 42 THR OG1 : rot 79:sc= -1.45 USER MOD Single : A 48 GLN : amide:sc= -13.3! C(o=-13!,f=-8.2!) USER MOD Single : A 50 GLN : amide:sc= -6! K(o=-6!,f=-2.7) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -9.88! C(o=-9.9!,f=-11!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -4.85! K(o=-4.9!,f=-1.1) USER MOD Single : A 72 HIS : no HD1:sc= -0.222 K(o=-0.22,f=-0.88) USER MOD Single : A 79 GLN : amide:sc= -1.35! K(o=-1.3!,f=0) USER MOD Single : A 80 GLN : amide:sc= -1.08 K(o=-1.1,f=-3.1!) USER MOD Single : A 99 MET CE :methyl 145:sc= -4.08! (180deg=-5.86!) USER MOD Single : A 103 ASN : amide:sc= -4.68! K(o=-4.7!,f=-3.3) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HE2:sc= -2.65 X(o=-2.7,f=-2.8!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.924 K(o=-0.92,f=0) USER MOD Single : A 124 MET CE :methyl 141:sc= -0.516 (180deg=-4.66!) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 GLN : amide:sc= -26.5! C(o=-27!,f=-16!) USER MOD Single : A 148 HIS : no HD1:sc= -1.23 K(o=-1.2,f=-0.09) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -136:sc= -0.0368 (180deg=-0.31) USER MOD Single : A 156 ASN : amide:sc= -6.6! K(o=-6.6!,f=-0.82) USER MOD Single : A 157 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.45) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 4.325 -9.533 -14.601 1.00 0.82 N ATOM 2 CA THR A 1 3.252 -9.930 -13.651 1.00 0.59 C ATOM 3 C THR A 1 2.687 -8.716 -12.925 1.00 0.52 C ATOM 4 O THR A 1 3.369 -8.100 -12.105 1.00 0.52 O ATOM 5 CB THR A 1 3.835 -10.923 -12.644 1.00 0.64 C ATOM 6 OG1 THR A 1 4.409 -12.033 -13.311 1.00 0.92 O ATOM 7 CG2 THR A 1 2.812 -11.461 -11.664 1.00 0.62 C ATOM 0 H1 THR A 1 4.704 -10.380 -15.070 1.00 0.82 H new ATOM 0 H2 THR A 1 3.934 -8.887 -15.316 1.00 0.82 H new ATOM 0 H3 THR A 1 5.088 -9.054 -14.082 1.00 0.82 H new ATOM 0 HA THR A 1 2.435 -10.393 -14.205 1.00 0.59 H new ATOM 0 HB THR A 1 4.585 -10.359 -12.088 1.00 0.64 H new ATOM 0 HG1 THR A 1 4.778 -12.656 -12.651 1.00 0.92 H new ATOM 0 HG21 THR A 1 3.295 -12.159 -10.980 1.00 0.62 H new ATOM 0 HG22 THR A 1 2.383 -10.635 -11.096 1.00 0.62 H new ATOM 0 HG23 THR A 1 2.021 -11.976 -12.210 1.00 0.62 H new ATOM 17 N VAL A 2 1.437 -8.377 -13.226 1.00 0.54 N ATOM 18 CA VAL A 2 0.788 -7.236 -12.594 1.00 0.54 C ATOM 19 C VAL A 2 0.584 -7.493 -11.106 1.00 0.44 C ATOM 20 O VAL A 2 -0.313 -8.237 -10.711 1.00 0.45 O ATOM 21 CB VAL A 2 -0.575 -6.932 -13.245 1.00 0.65 C ATOM 22 CG1 VAL A 2 -1.221 -5.716 -12.601 1.00 1.49 C ATOM 23 CG2 VAL A 2 -0.419 -6.730 -14.745 1.00 1.42 C ATOM 0 H VAL A 2 0.856 -8.875 -13.901 1.00 0.54 H new ATOM 0 HA VAL A 2 1.442 -6.375 -12.731 1.00 0.54 H new ATOM 0 HB VAL A 2 -1.230 -7.788 -13.082 1.00 0.65 H new ATOM 0 HG11 VAL A 2 -2.182 -5.520 -13.076 1.00 1.49 H new ATOM 0 HG12 VAL A 2 -1.374 -5.905 -11.538 1.00 1.49 H new ATOM 0 HG13 VAL A 2 -0.571 -4.850 -12.726 1.00 1.49 H new ATOM 0 HG21 VAL A 2 -1.392 -6.516 -15.187 1.00 1.42 H new ATOM 0 HG22 VAL A 2 0.255 -5.894 -14.931 1.00 1.42 H new ATOM 0 HG23 VAL A 2 -0.008 -7.635 -15.193 1.00 1.42 H new ATOM 33 N ALA A 3 1.428 -6.876 -10.287 1.00 0.43 N ATOM 34 CA ALA A 3 1.348 -7.041 -8.842 1.00 0.40 C ATOM 35 C ALA A 3 0.616 -5.877 -8.192 1.00 0.33 C ATOM 36 O ALA A 3 0.849 -4.715 -8.526 1.00 0.37 O ATOM 37 CB ALA A 3 2.740 -7.182 -8.248 1.00 0.48 C ATOM 0 H ALA A 3 2.176 -6.257 -10.600 1.00 0.43 H new ATOM 0 HA ALA A 3 0.782 -7.950 -8.641 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.664 -7.305 -7.168 1.00 0.48 H new ATOM 0 HB2 ALA A 3 3.233 -8.054 -8.678 1.00 0.48 H new ATOM 0 HB3 ALA A 3 3.323 -6.289 -8.472 1.00 0.48 H new ATOM 43 N TYR A 4 -0.266 -6.198 -7.254 1.00 0.38 N ATOM 44 CA TYR A 4 -1.030 -5.179 -6.547 1.00 0.48 C ATOM 45 C TYR A 4 -0.326 -4.801 -5.247 1.00 0.46 C ATOM 46 O TYR A 4 -0.091 -5.653 -4.384 1.00 0.72 O ATOM 47 CB TYR A 4 -2.452 -5.673 -6.281 1.00 0.79 C ATOM 48 CG TYR A 4 -3.227 -5.971 -7.551 1.00 2.03 C ATOM 49 CD1 TYR A 4 -2.829 -6.990 -8.408 1.00 3.01 C ATOM 50 CD2 TYR A 4 -4.355 -5.233 -7.891 1.00 2.70 C ATOM 51 CE1 TYR A 4 -3.535 -7.265 -9.564 1.00 4.21 C ATOM 52 CE2 TYR A 4 -5.064 -5.504 -9.046 1.00 3.83 C ATOM 53 CZ TYR A 4 -4.649 -6.516 -9.880 1.00 4.50 C ATOM 54 OH TYR A 4 -5.352 -6.791 -11.030 1.00 5.73 O ATOM 0 H TYR A 4 -0.470 -7.155 -6.966 1.00 0.38 H new ATOM 0 HA TYR A 4 -1.094 -4.287 -7.170 1.00 0.48 H new ATOM 0 HB2 TYR A 4 -2.408 -6.574 -5.669 1.00 0.79 H new ATOM 0 HB3 TYR A 4 -2.989 -4.921 -5.703 1.00 0.79 H new ATOM 0 HD1 TYR A 4 -1.954 -7.576 -8.167 1.00 3.01 H new ATOM 0 HD2 TYR A 4 -4.683 -4.435 -7.242 1.00 2.70 H new ATOM 0 HE1 TYR A 4 -3.215 -8.063 -10.217 1.00 4.21 H new ATOM 0 HE2 TYR A 4 -5.941 -4.923 -9.293 1.00 3.83 H new ATOM 0 HH TYR A 4 -6.110 -6.174 -11.106 1.00 5.73 H new ATOM 64 N ILE A 5 0.036 -3.521 -5.143 1.00 0.40 N ATOM 65 CA ILE A 5 0.758 -2.999 -3.981 1.00 0.45 C ATOM 66 C ILE A 5 -0.002 -1.868 -3.289 1.00 0.44 C ATOM 67 O ILE A 5 -0.287 -0.835 -3.894 1.00 0.57 O ATOM 68 CB ILE A 5 2.148 -2.476 -4.408 1.00 0.55 C ATOM 69 CG1 ILE A 5 2.294 -2.592 -5.927 1.00 0.52 C ATOM 70 CG2 ILE A 5 3.249 -3.243 -3.691 1.00 0.93 C ATOM 71 CD1 ILE A 5 3.614 -2.086 -6.462 1.00 0.79 C ATOM 0 H ILE A 5 -0.162 -2.820 -5.857 1.00 0.40 H new ATOM 0 HA ILE A 5 0.862 -3.824 -3.276 1.00 0.45 H new ATOM 0 HB ILE A 5 2.240 -1.427 -4.128 1.00 0.55 H new ATOM 0 HG12 ILE A 5 2.175 -3.637 -6.214 1.00 0.52 H new ATOM 0 HG13 ILE A 5 1.485 -2.037 -6.402 1.00 0.52 H new ATOM 0 HG21 ILE A 5 4.221 -2.862 -4.004 1.00 0.93 H new ATOM 0 HG22 ILE A 5 3.139 -3.116 -2.614 1.00 0.93 H new ATOM 0 HG23 ILE A 5 3.177 -4.302 -3.941 1.00 0.93 H new ATOM 0 HD11 ILE A 5 3.637 -2.204 -7.545 1.00 0.79 H new ATOM 0 HD12 ILE A 5 3.729 -1.032 -6.209 1.00 0.79 H new ATOM 0 HD13 ILE A 5 4.429 -2.657 -6.018 1.00 0.79 H new ATOM 83 N ALA A 6 -0.306 -2.065 -2.012 1.00 0.48 N ATOM 84 CA ALA A 6 -1.012 -1.056 -1.230 1.00 0.51 C ATOM 85 C ALA A 6 -0.038 -0.011 -0.701 1.00 0.46 C ATOM 86 O ALA A 6 1.084 -0.340 -0.315 1.00 0.58 O ATOM 87 CB ALA A 6 -1.761 -1.712 -0.081 1.00 0.71 C ATOM 0 H ALA A 6 -0.075 -2.914 -1.495 1.00 0.48 H new ATOM 0 HA ALA A 6 -1.733 -0.557 -1.878 1.00 0.51 H new ATOM 0 HB1 ALA A 6 -2.284 -0.949 0.495 1.00 0.71 H new ATOM 0 HB2 ALA A 6 -2.483 -2.426 -0.478 1.00 0.71 H new ATOM 0 HB3 ALA A 6 -1.054 -2.233 0.564 1.00 0.71 H new ATOM 93 N ILE A 7 -0.462 1.252 -0.688 1.00 0.44 N ATOM 94 CA ILE A 7 0.398 2.329 -0.210 1.00 0.43 C ATOM 95 C ILE A 7 -0.362 3.280 0.710 1.00 0.49 C ATOM 96 O ILE A 7 -1.487 3.678 0.416 1.00 0.58 O ATOM 97 CB ILE A 7 1.004 3.117 -1.388 1.00 0.47 C ATOM 98 CG1 ILE A 7 1.947 4.208 -0.878 1.00 1.19 C ATOM 99 CG2 ILE A 7 -0.100 3.719 -2.248 1.00 1.41 C ATOM 100 CD1 ILE A 7 2.698 4.923 -1.982 1.00 1.42 C ATOM 0 H ILE A 7 -1.386 1.551 -1.000 1.00 0.44 H new ATOM 0 HA ILE A 7 1.206 1.868 0.359 1.00 0.43 H new ATOM 0 HB ILE A 7 1.583 2.428 -2.003 1.00 0.47 H new ATOM 0 HG12 ILE A 7 1.371 4.938 -0.309 1.00 1.19 H new ATOM 0 HG13 ILE A 7 2.666 3.763 -0.190 1.00 1.19 H new ATOM 0 HG21 ILE A 7 0.344 4.272 -3.075 1.00 1.41 H new ATOM 0 HG22 ILE A 7 -0.730 2.922 -2.642 1.00 1.41 H new ATOM 0 HG23 ILE A 7 -0.705 4.395 -1.643 1.00 1.41 H new ATOM 0 HD11 ILE A 7 3.347 5.683 -1.547 1.00 1.42 H new ATOM 0 HD12 ILE A 7 3.301 4.204 -2.536 1.00 1.42 H new ATOM 0 HD13 ILE A 7 1.987 5.397 -2.658 1.00 1.42 H new ATOM 112 N GLY A 8 0.260 3.638 1.830 1.00 0.57 N ATOM 113 CA GLY A 8 -0.383 4.535 2.775 1.00 0.69 C ATOM 114 C GLY A 8 0.569 5.561 3.360 1.00 0.68 C ATOM 115 O GLY A 8 1.758 5.289 3.531 1.00 0.77 O ATOM 0 H GLY A 8 1.193 3.325 2.099 1.00 0.57 H new ATOM 0 HA2 GLY A 8 -1.204 5.051 2.277 1.00 0.69 H new ATOM 0 HA3 GLY A 8 -0.819 3.949 3.584 1.00 0.69 H new ATOM 119 N SER A 9 0.043 6.746 3.673 1.00 0.70 N ATOM 120 CA SER A 9 0.857 7.814 4.245 1.00 0.75 C ATOM 121 C SER A 9 0.043 8.749 5.140 1.00 0.87 C ATOM 122 O SER A 9 -1.199 8.772 5.109 1.00 0.92 O ATOM 123 CB SER A 9 1.541 8.625 3.144 1.00 0.76 C ATOM 124 OG SER A 9 0.608 9.057 2.171 1.00 1.67 O ATOM 0 H SER A 9 -0.939 6.988 3.540 1.00 0.70 H new ATOM 0 HA SER A 9 1.613 7.331 4.864 1.00 0.75 H new ATOM 0 HB2 SER A 9 2.040 9.489 3.582 1.00 0.76 H new ATOM 0 HB3 SER A 9 2.312 8.019 2.668 1.00 0.76 H new ATOM 0 HG SER A 9 -0.236 8.573 2.290 1.00 1.67 H new ATOM 130 N ASN A 10 0.776 9.527 5.933 1.00 1.03 N ATOM 131 CA ASN A 10 0.187 10.488 6.853 1.00 1.23 C ATOM 132 C ASN A 10 1.130 11.679 7.044 1.00 1.30 C ATOM 133 O ASN A 10 1.401 12.414 6.094 1.00 2.00 O ATOM 134 CB ASN A 10 -0.107 9.812 8.195 1.00 1.55 C ATOM 135 CG ASN A 10 -1.147 8.715 8.073 1.00 2.18 C ATOM 136 OD1 ASN A 10 -2.286 8.966 7.678 1.00 2.66 O ATOM 137 ND2 ASN A 10 -0.759 7.491 8.410 1.00 3.02 N ATOM 0 H ASN A 10 1.796 9.506 5.953 1.00 1.03 H new ATOM 0 HA ASN A 10 -0.751 10.855 6.436 1.00 1.23 H new ATOM 0 HB2 ASN A 10 0.815 9.392 8.597 1.00 1.55 H new ATOM 0 HB3 ASN A 10 -0.454 10.560 8.908 1.00 1.55 H new ATOM 0 HD21 ASN A 10 -1.415 6.712 8.347 1.00 3.02 H new ATOM 0 HD22 ASN A 10 0.195 7.329 8.732 1.00 3.02 H new ATOM 144 N LEU A 11 1.638 11.859 8.263 1.00 1.21 N ATOM 145 CA LEU A 11 2.561 12.954 8.563 1.00 1.31 C ATOM 146 C LEU A 11 1.980 14.311 8.172 1.00 1.49 C ATOM 147 O LEU A 11 0.852 14.407 7.687 1.00 1.96 O ATOM 148 CB LEU A 11 3.892 12.741 7.838 1.00 1.36 C ATOM 149 CG LEU A 11 4.745 11.576 8.349 1.00 1.66 C ATOM 150 CD1 LEU A 11 6.086 11.552 7.632 1.00 2.11 C ATOM 151 CD2 LEU A 11 4.949 11.676 9.854 1.00 2.45 C ATOM 0 H LEU A 11 1.426 11.259 9.060 1.00 1.21 H new ATOM 0 HA LEU A 11 2.724 12.953 9.641 1.00 1.31 H new ATOM 0 HB2 LEU A 11 3.687 12.581 6.779 1.00 1.36 H new ATOM 0 HB3 LEU A 11 4.477 13.657 7.914 1.00 1.36 H new ATOM 0 HG LEU A 11 4.218 10.645 8.138 1.00 1.66 H new ATOM 0 HD11 LEU A 11 6.683 10.719 8.004 1.00 2.11 H new ATOM 0 HD12 LEU A 11 5.924 11.432 6.561 1.00 2.11 H new ATOM 0 HD13 LEU A 11 6.614 12.488 7.816 1.00 2.11 H new ATOM 0 HD21 LEU A 11 5.558 10.838 10.195 1.00 2.45 H new ATOM 0 HD22 LEU A 11 5.454 12.612 10.091 1.00 2.45 H new ATOM 0 HD23 LEU A 11 3.981 11.649 10.355 1.00 2.45 H new ATOM 163 N ALA A 12 2.772 15.363 8.379 1.00 1.57 N ATOM 164 CA ALA A 12 2.355 16.719 8.037 1.00 1.79 C ATOM 165 C ALA A 12 2.426 16.922 6.529 1.00 1.71 C ATOM 166 O ALA A 12 1.524 17.500 5.923 1.00 2.29 O ATOM 167 CB ALA A 12 3.226 17.739 8.756 1.00 2.08 C ATOM 0 H ALA A 12 3.707 15.300 8.782 1.00 1.57 H new ATOM 0 HA ALA A 12 1.324 16.862 8.360 1.00 1.79 H new ATOM 0 HB1 ALA A 12 2.902 18.745 8.490 1.00 2.08 H new ATOM 0 HB2 ALA A 12 3.134 17.601 9.833 1.00 2.08 H new ATOM 0 HB3 ALA A 12 4.266 17.602 8.460 1.00 2.08 H new ATOM 173 N SER A 13 3.501 16.418 5.932 1.00 1.54 N ATOM 174 CA SER A 13 3.703 16.507 4.491 1.00 1.42 C ATOM 175 C SER A 13 3.640 15.108 3.884 1.00 1.10 C ATOM 176 O SER A 13 4.669 14.471 3.658 1.00 1.17 O ATOM 177 CB SER A 13 5.047 17.166 4.174 1.00 1.72 C ATOM 178 OG SER A 13 6.120 16.437 4.744 1.00 2.45 O ATOM 0 H SER A 13 4.252 15.940 6.430 1.00 1.54 H new ATOM 0 HA SER A 13 2.915 17.124 4.058 1.00 1.42 H new ATOM 0 HB2 SER A 13 5.179 17.228 3.094 1.00 1.72 H new ATOM 0 HB3 SER A 13 5.054 18.187 4.556 1.00 1.72 H new ATOM 0 HG SER A 13 6.074 15.503 4.449 1.00 2.45 H new ATOM 184 N PRO A 14 2.420 14.599 3.643 1.00 0.96 N ATOM 185 CA PRO A 14 2.214 13.254 3.094 1.00 0.92 C ATOM 186 C PRO A 14 2.706 13.095 1.660 1.00 0.86 C ATOM 187 O PRO A 14 3.178 12.026 1.287 1.00 0.90 O ATOM 188 CB PRO A 14 0.697 13.070 3.158 1.00 1.18 C ATOM 189 CG PRO A 14 0.142 14.450 3.169 1.00 1.23 C ATOM 190 CD PRO A 14 1.143 15.284 3.914 1.00 1.14 C ATOM 0 HA PRO A 14 2.781 12.512 3.657 1.00 0.92 H new ATOM 0 HB2 PRO A 14 0.332 12.504 2.301 1.00 1.18 H new ATOM 0 HB3 PRO A 14 0.404 12.519 4.052 1.00 1.18 H new ATOM 0 HG2 PRO A 14 -0.001 14.823 2.155 1.00 1.23 H new ATOM 0 HG3 PRO A 14 -0.832 14.477 3.658 1.00 1.23 H new ATOM 0 HD2 PRO A 14 1.155 16.314 3.557 1.00 1.14 H new ATOM 0 HD3 PRO A 14 0.923 15.319 4.981 1.00 1.14 H new ATOM 198 N LEU A 15 2.582 14.145 0.856 1.00 0.89 N ATOM 199 CA LEU A 15 3.010 14.081 -0.541 1.00 0.90 C ATOM 200 C LEU A 15 4.423 13.526 -0.668 1.00 0.84 C ATOM 201 O LEU A 15 4.641 12.514 -1.326 1.00 0.84 O ATOM 202 CB LEU A 15 2.950 15.459 -1.197 1.00 1.07 C ATOM 203 CG LEU A 15 3.358 15.483 -2.675 1.00 1.33 C ATOM 204 CD1 LEU A 15 2.349 14.719 -3.518 1.00 1.67 C ATOM 205 CD2 LEU A 15 3.493 16.915 -3.169 1.00 1.72 C ATOM 0 H LEU A 15 2.193 15.044 1.141 1.00 0.89 H new ATOM 0 HA LEU A 15 2.321 13.408 -1.052 1.00 0.90 H new ATOM 0 HB2 LEU A 15 1.934 15.845 -1.108 1.00 1.07 H new ATOM 0 HB3 LEU A 15 3.599 16.138 -0.644 1.00 1.07 H new ATOM 0 HG LEU A 15 4.328 14.995 -2.773 1.00 1.33 H new ATOM 0 HD11 LEU A 15 2.654 14.746 -4.564 1.00 1.67 H new ATOM 0 HD12 LEU A 15 2.303 13.684 -3.180 1.00 1.67 H new ATOM 0 HD13 LEU A 15 1.366 15.179 -3.415 1.00 1.67 H new ATOM 0 HD21 LEU A 15 3.783 16.912 -4.220 1.00 1.72 H new ATOM 0 HD22 LEU A 15 2.539 17.430 -3.058 1.00 1.72 H new ATOM 0 HD23 LEU A 15 4.254 17.431 -2.584 1.00 1.72 H new ATOM 217 N GLU A 16 5.382 14.208 -0.053 1.00 0.86 N ATOM 218 CA GLU A 16 6.783 13.801 -0.114 1.00 0.88 C ATOM 219 C GLU A 16 6.976 12.330 0.263 1.00 0.76 C ATOM 220 O GLU A 16 7.891 11.674 -0.238 1.00 0.75 O ATOM 221 CB GLU A 16 7.626 14.685 0.806 1.00 1.05 C ATOM 222 CG GLU A 16 7.545 16.165 0.468 1.00 1.40 C ATOM 223 CD GLU A 16 8.009 16.469 -0.943 1.00 1.82 C ATOM 224 OE1 GLU A 16 9.183 16.178 -1.258 1.00 2.49 O ATOM 225 OE2 GLU A 16 7.200 16.996 -1.735 1.00 2.16 O ATOM 0 H GLU A 16 5.215 15.051 0.497 1.00 0.86 H new ATOM 0 HA GLU A 16 7.110 13.922 -1.147 1.00 0.88 H new ATOM 0 HB2 GLU A 16 7.301 14.538 1.836 1.00 1.05 H new ATOM 0 HB3 GLU A 16 8.666 14.365 0.751 1.00 1.05 H new ATOM 0 HG2 GLU A 16 6.517 16.505 0.589 1.00 1.40 H new ATOM 0 HG3 GLU A 16 8.153 16.729 1.175 1.00 1.40 H new ATOM 232 N GLN A 17 6.128 11.820 1.149 1.00 0.73 N ATOM 233 CA GLN A 17 6.238 10.430 1.589 1.00 0.71 C ATOM 234 C GLN A 17 5.546 9.487 0.604 1.00 0.57 C ATOM 235 O GLN A 17 6.184 8.611 0.013 1.00 0.51 O ATOM 236 CB GLN A 17 5.648 10.275 2.993 1.00 0.86 C ATOM 237 CG GLN A 17 5.764 11.533 3.847 1.00 1.20 C ATOM 238 CD GLN A 17 7.200 11.957 4.113 1.00 1.35 C ATOM 239 OE1 GLN A 17 7.445 13.035 4.654 1.00 2.20 O ATOM 240 NE2 GLN A 17 8.158 11.108 3.757 1.00 1.36 N ATOM 0 H GLN A 17 5.362 12.341 1.575 1.00 0.73 H new ATOM 0 HA GLN A 17 7.294 10.161 1.621 1.00 0.71 H new ATOM 0 HB2 GLN A 17 4.597 10.000 2.908 1.00 0.86 H new ATOM 0 HB3 GLN A 17 6.153 9.453 3.501 1.00 0.86 H new ATOM 0 HG2 GLN A 17 5.239 12.349 3.350 1.00 1.20 H new ATOM 0 HG3 GLN A 17 5.262 11.363 4.799 1.00 1.20 H new ATOM 0 HE21 GLN A 17 7.916 10.223 3.311 1.00 1.36 H new ATOM 0 HE22 GLN A 17 9.136 11.341 3.930 1.00 1.36 H new ATOM 249 N VAL A 18 4.241 9.674 0.418 1.00 0.57 N ATOM 250 CA VAL A 18 3.477 8.847 -0.510 1.00 0.53 C ATOM 251 C VAL A 18 4.136 8.850 -1.885 1.00 0.49 C ATOM 252 O VAL A 18 4.031 7.886 -2.644 1.00 0.51 O ATOM 253 CB VAL A 18 2.021 9.335 -0.644 1.00 0.62 C ATOM 254 CG1 VAL A 18 1.977 10.745 -1.216 1.00 1.10 C ATOM 255 CG2 VAL A 18 1.210 8.377 -1.505 1.00 1.25 C ATOM 0 H VAL A 18 3.693 10.389 0.897 1.00 0.57 H new ATOM 0 HA VAL A 18 3.464 7.834 -0.107 1.00 0.53 H new ATOM 0 HB VAL A 18 1.575 9.358 0.351 1.00 0.62 H new ATOM 0 HG11 VAL A 18 0.940 11.070 -1.302 1.00 1.10 H new ATOM 0 HG12 VAL A 18 2.516 11.423 -0.554 1.00 1.10 H new ATOM 0 HG13 VAL A 18 2.443 10.753 -2.201 1.00 1.10 H new ATOM 0 HG21 VAL A 18 0.185 8.740 -1.587 1.00 1.25 H new ATOM 0 HG22 VAL A 18 1.654 8.316 -2.499 1.00 1.25 H new ATOM 0 HG23 VAL A 18 1.209 7.388 -1.047 1.00 1.25 H new ATOM 265 N ASN A 19 4.832 9.943 -2.186 1.00 0.52 N ATOM 266 CA ASN A 19 5.532 10.087 -3.455 1.00 0.57 C ATOM 267 C ASN A 19 6.859 9.349 -3.411 1.00 0.50 C ATOM 268 O ASN A 19 7.346 8.872 -4.430 1.00 0.52 O ATOM 269 CB ASN A 19 5.764 11.564 -3.775 1.00 0.72 C ATOM 270 CG ASN A 19 6.641 11.760 -4.994 1.00 1.26 C ATOM 271 OD1 ASN A 19 7.827 11.431 -4.985 1.00 1.96 O ATOM 272 ND2 ASN A 19 6.060 12.298 -6.055 1.00 1.71 N ATOM 0 H ASN A 19 4.925 10.745 -1.563 1.00 0.52 H new ATOM 0 HA ASN A 19 4.913 9.654 -4.240 1.00 0.57 H new ATOM 0 HB2 ASN A 19 4.804 12.052 -3.939 1.00 0.72 H new ATOM 0 HB3 ASN A 19 6.226 12.051 -2.916 1.00 0.72 H new ATOM 0 HD21 ASN A 19 6.598 12.454 -6.907 1.00 1.71 H new ATOM 0 HD22 ASN A 19 5.074 12.556 -6.020 1.00 1.71 H new ATOM 279 N ALA A 20 7.431 9.254 -2.216 1.00 0.49 N ATOM 280 CA ALA A 20 8.699 8.560 -2.027 1.00 0.49 C ATOM 281 C ALA A 20 8.629 7.164 -2.622 1.00 0.42 C ATOM 282 O ALA A 20 9.570 6.696 -3.267 1.00 0.48 O ATOM 283 CB ALA A 20 9.040 8.487 -0.548 1.00 0.57 C ATOM 0 H ALA A 20 7.036 9.649 -1.363 1.00 0.49 H new ATOM 0 HA ALA A 20 9.483 9.117 -2.540 1.00 0.49 H new ATOM 0 HB1 ALA A 20 9.989 7.967 -0.419 1.00 0.57 H new ATOM 0 HB2 ALA A 20 9.121 9.496 -0.143 1.00 0.57 H new ATOM 0 HB3 ALA A 20 8.255 7.946 -0.020 1.00 0.57 H new ATOM 289 N ALA A 21 7.490 6.512 -2.423 1.00 0.41 N ATOM 290 CA ALA A 21 7.287 5.176 -2.960 1.00 0.45 C ATOM 291 C ALA A 21 6.955 5.288 -4.431 1.00 0.36 C ATOM 292 O ALA A 21 7.553 4.628 -5.271 1.00 0.40 O ATOM 293 CB ALA A 21 6.171 4.454 -2.224 1.00 0.64 C ATOM 0 H ALA A 21 6.699 6.885 -1.897 1.00 0.41 H new ATOM 0 HA ALA A 21 8.200 4.596 -2.827 1.00 0.45 H new ATOM 0 HB1 ALA A 21 6.041 3.458 -2.647 1.00 0.64 H new ATOM 0 HB2 ALA A 21 6.427 4.370 -1.168 1.00 0.64 H new ATOM 0 HB3 ALA A 21 5.243 5.016 -2.329 1.00 0.64 H new ATOM 299 N LEU A 22 6.006 6.163 -4.726 1.00 0.40 N ATOM 300 CA LEU A 22 5.586 6.419 -6.091 1.00 0.47 C ATOM 301 C LEU A 22 6.784 6.844 -6.942 1.00 0.44 C ATOM 302 O LEU A 22 6.740 6.802 -8.172 1.00 0.53 O ATOM 303 CB LEU A 22 4.503 7.503 -6.082 1.00 0.64 C ATOM 304 CG LEU A 22 4.331 8.271 -7.386 1.00 1.16 C ATOM 305 CD1 LEU A 22 3.863 7.347 -8.501 1.00 1.74 C ATOM 306 CD2 LEU A 22 3.356 9.425 -7.201 1.00 1.73 C ATOM 0 H LEU A 22 5.508 6.713 -4.026 1.00 0.40 H new ATOM 0 HA LEU A 22 5.175 5.510 -6.530 1.00 0.47 H new ATOM 0 HB2 LEU A 22 3.551 7.038 -5.826 1.00 0.64 H new ATOM 0 HB3 LEU A 22 4.733 8.215 -5.289 1.00 0.64 H new ATOM 0 HG LEU A 22 5.300 8.681 -7.670 1.00 1.16 H new ATOM 0 HD11 LEU A 22 3.747 7.918 -9.422 1.00 1.74 H new ATOM 0 HD12 LEU A 22 4.600 6.558 -8.653 1.00 1.74 H new ATOM 0 HD13 LEU A 22 2.906 6.902 -8.227 1.00 1.74 H new ATOM 0 HD21 LEU A 22 3.245 9.962 -8.143 1.00 1.73 H new ATOM 0 HD22 LEU A 22 2.387 9.036 -6.889 1.00 1.73 H new ATOM 0 HD23 LEU A 22 3.737 10.104 -6.438 1.00 1.73 H new ATOM 318 N LYS A 23 7.859 7.243 -6.269 1.00 0.43 N ATOM 319 CA LYS A 23 9.078 7.670 -6.942 1.00 0.52 C ATOM 320 C LYS A 23 9.861 6.461 -7.446 1.00 0.47 C ATOM 321 O LYS A 23 10.104 6.327 -8.646 1.00 0.56 O ATOM 322 CB LYS A 23 9.933 8.520 -5.997 1.00 0.61 C ATOM 323 CG LYS A 23 11.240 8.993 -6.613 1.00 1.13 C ATOM 324 CD LYS A 23 12.038 9.845 -5.639 1.00 1.51 C ATOM 325 CE LYS A 23 13.358 10.293 -6.246 1.00 2.12 C ATOM 326 NZ LYS A 23 13.158 11.095 -7.485 1.00 2.74 N ATOM 0 H LYS A 23 7.909 7.279 -5.251 1.00 0.43 H new ATOM 0 HA LYS A 23 8.808 8.281 -7.804 1.00 0.52 H new ATOM 0 HB2 LYS A 23 9.355 9.389 -5.681 1.00 0.61 H new ATOM 0 HB3 LYS A 23 10.153 7.940 -5.100 1.00 0.61 H new ATOM 0 HG2 LYS A 23 11.834 8.131 -6.915 1.00 1.13 H new ATOM 0 HG3 LYS A 23 11.031 9.568 -7.515 1.00 1.13 H new ATOM 0 HD2 LYS A 23 11.452 10.719 -5.353 1.00 1.51 H new ATOM 0 HD3 LYS A 23 12.229 9.277 -4.728 1.00 1.51 H new ATOM 0 HE2 LYS A 23 13.910 10.885 -5.516 1.00 2.12 H new ATOM 0 HE3 LYS A 23 13.967 9.419 -6.474 1.00 2.12 H new ATOM 0 HZ1 LYS A 23 14.050 11.562 -7.744 1.00 2.74 H new ATOM 0 HZ2 LYS A 23 12.858 10.469 -8.259 1.00 2.74 H new ATOM 0 HZ3 LYS A 23 12.426 11.815 -7.318 1.00 2.74 H new ATOM 340 N ALA A 24 10.238 5.568 -6.531 1.00 0.40 N ATOM 341 CA ALA A 24 10.971 4.362 -6.906 1.00 0.43 C ATOM 342 C ALA A 24 10.042 3.385 -7.613 1.00 0.38 C ATOM 343 O ALA A 24 10.375 2.848 -8.668 1.00 0.46 O ATOM 344 CB ALA A 24 11.597 3.714 -5.681 1.00 0.51 C ATOM 0 H ALA A 24 10.049 5.657 -5.533 1.00 0.40 H new ATOM 0 HA ALA A 24 11.773 4.639 -7.590 1.00 0.43 H new ATOM 0 HB1 ALA A 24 12.139 2.817 -5.981 1.00 0.51 H new ATOM 0 HB2 ALA A 24 12.287 4.415 -5.211 1.00 0.51 H new ATOM 0 HB3 ALA A 24 10.814 3.445 -4.972 1.00 0.51 H new ATOM 350 N LEU A 25 8.864 3.179 -7.027 1.00 0.43 N ATOM 351 CA LEU A 25 7.867 2.288 -7.604 1.00 0.40 C ATOM 352 C LEU A 25 7.615 2.687 -9.053 1.00 0.37 C ATOM 353 O LEU A 25 7.412 1.837 -9.916 1.00 0.45 O ATOM 354 CB LEU A 25 6.557 2.349 -6.804 1.00 0.47 C ATOM 355 CG LEU A 25 5.570 1.215 -7.068 1.00 0.56 C ATOM 356 CD1 LEU A 25 6.218 -0.125 -6.784 1.00 0.96 C ATOM 357 CD2 LEU A 25 4.328 1.393 -6.214 1.00 1.04 C ATOM 0 H LEU A 25 8.579 3.619 -6.152 1.00 0.43 H new ATOM 0 HA LEU A 25 8.241 1.265 -7.566 1.00 0.40 H new ATOM 0 HB2 LEU A 25 6.801 2.355 -5.742 1.00 0.47 H new ATOM 0 HB3 LEU A 25 6.062 3.295 -7.022 1.00 0.47 H new ATOM 0 HG LEU A 25 5.279 1.242 -8.118 1.00 0.56 H new ATOM 0 HD11 LEU A 25 5.502 -0.924 -6.977 1.00 0.96 H new ATOM 0 HD12 LEU A 25 7.087 -0.253 -7.430 1.00 0.96 H new ATOM 0 HD13 LEU A 25 6.532 -0.163 -5.741 1.00 0.96 H new ATOM 0 HD21 LEU A 25 3.631 0.578 -6.411 1.00 1.04 H new ATOM 0 HD22 LEU A 25 4.607 1.385 -5.160 1.00 1.04 H new ATOM 0 HD23 LEU A 25 3.853 2.343 -6.457 1.00 1.04 H new ATOM 369 N GLY A 26 7.657 3.994 -9.310 1.00 0.43 N ATOM 370 CA GLY A 26 7.454 4.490 -10.658 1.00 0.53 C ATOM 371 C GLY A 26 8.403 3.838 -11.638 1.00 0.56 C ATOM 372 O GLY A 26 7.985 3.351 -12.689 1.00 0.82 O ATOM 0 H GLY A 26 7.828 4.715 -8.609 1.00 0.43 H new ATOM 0 HA2 GLY A 26 6.425 4.301 -10.965 1.00 0.53 H new ATOM 0 HA3 GLY A 26 7.598 5.570 -10.675 1.00 0.53 H new ATOM 376 N ASP A 27 9.685 3.807 -11.281 1.00 0.59 N ATOM 377 CA ASP A 27 10.694 3.182 -12.128 1.00 0.76 C ATOM 378 C ASP A 27 11.549 2.219 -11.312 1.00 0.56 C ATOM 379 O ASP A 27 12.466 2.627 -10.599 1.00 0.81 O ATOM 380 CB ASP A 27 11.577 4.248 -12.782 1.00 1.35 C ATOM 381 CG ASP A 27 12.609 3.656 -13.723 1.00 2.02 C ATOM 382 OD1 ASP A 27 13.467 2.882 -13.252 1.00 2.61 O ATOM 383 OD2 ASP A 27 12.560 3.964 -14.932 1.00 2.42 O ATOM 0 H ASP A 27 10.047 4.206 -10.415 1.00 0.59 H new ATOM 0 HA ASP A 27 10.187 2.620 -12.912 1.00 0.76 H new ATOM 0 HB2 ASP A 27 10.948 4.947 -13.333 1.00 1.35 H new ATOM 0 HB3 ASP A 27 12.085 4.820 -12.005 1.00 1.35 H new ATOM 388 N ILE A 28 11.238 0.936 -11.438 1.00 0.51 N ATOM 389 CA ILE A 28 11.961 -0.118 -10.738 1.00 0.51 C ATOM 390 C ILE A 28 12.728 -0.973 -11.748 1.00 0.49 C ATOM 391 O ILE A 28 12.273 -1.128 -12.881 1.00 0.48 O ATOM 392 CB ILE A 28 10.984 -1.011 -9.942 1.00 0.71 C ATOM 393 CG1 ILE A 28 9.825 -0.174 -9.402 1.00 0.82 C ATOM 394 CG2 ILE A 28 11.693 -1.710 -8.795 1.00 0.83 C ATOM 395 CD1 ILE A 28 8.816 -0.976 -8.611 1.00 1.26 C ATOM 0 H ILE A 28 10.478 0.596 -12.028 1.00 0.51 H new ATOM 0 HA ILE A 28 12.660 0.343 -10.041 1.00 0.51 H new ATOM 0 HB ILE A 28 10.595 -1.771 -10.619 1.00 0.71 H new ATOM 0 HG12 ILE A 28 10.224 0.618 -8.768 1.00 0.82 H new ATOM 0 HG13 ILE A 28 9.318 0.310 -10.236 1.00 0.82 H new ATOM 0 HG21 ILE A 28 10.981 -2.332 -8.252 1.00 0.83 H new ATOM 0 HG22 ILE A 28 12.494 -2.335 -9.189 1.00 0.83 H new ATOM 0 HG23 ILE A 28 12.113 -0.965 -8.119 1.00 0.83 H new ATOM 0 HD11 ILE A 28 8.022 -0.317 -8.259 1.00 1.26 H new ATOM 0 HD12 ILE A 28 8.389 -1.751 -9.247 1.00 1.26 H new ATOM 0 HD13 ILE A 28 9.309 -1.439 -7.756 1.00 1.26 H new ATOM 407 N PRO A 29 13.897 -1.534 -11.367 1.00 0.68 N ATOM 408 CA PRO A 29 14.713 -2.366 -12.247 1.00 0.83 C ATOM 409 C PRO A 29 13.928 -3.072 -13.357 1.00 0.70 C ATOM 410 O PRO A 29 14.204 -2.868 -14.538 1.00 0.88 O ATOM 411 CB PRO A 29 15.287 -3.374 -11.260 1.00 1.07 C ATOM 412 CG PRO A 29 15.490 -2.592 -9.997 1.00 1.14 C ATOM 413 CD PRO A 29 14.543 -1.410 -10.044 1.00 0.87 C ATOM 0 HA PRO A 29 15.447 -1.782 -12.803 1.00 0.83 H new ATOM 0 HB2 PRO A 29 14.604 -4.209 -11.104 1.00 1.07 H new ATOM 0 HB3 PRO A 29 16.226 -3.793 -11.622 1.00 1.07 H new ATOM 0 HG2 PRO A 29 15.288 -3.212 -9.124 1.00 1.14 H new ATOM 0 HG3 PRO A 29 16.523 -2.254 -9.916 1.00 1.14 H new ATOM 0 HD2 PRO A 29 13.812 -1.449 -9.236 1.00 0.87 H new ATOM 0 HD3 PRO A 29 15.077 -0.465 -9.946 1.00 0.87 H new ATOM 421 N GLU A 30 12.958 -3.908 -12.978 1.00 0.54 N ATOM 422 CA GLU A 30 12.162 -4.642 -13.965 1.00 0.58 C ATOM 423 C GLU A 30 10.659 -4.441 -13.753 1.00 0.60 C ATOM 424 O GLU A 30 9.851 -5.250 -14.208 1.00 1.01 O ATOM 425 CB GLU A 30 12.487 -6.138 -13.894 1.00 0.62 C ATOM 426 CG GLU A 30 13.965 -6.458 -14.055 1.00 0.63 C ATOM 427 CD GLU A 30 14.483 -6.181 -15.454 1.00 1.39 C ATOM 428 OE1 GLU A 30 14.407 -5.019 -15.901 1.00 2.35 O ATOM 429 OE2 GLU A 30 14.971 -7.131 -16.102 1.00 1.66 O ATOM 0 H GLU A 30 12.707 -4.092 -12.007 1.00 0.54 H new ATOM 0 HA GLU A 30 12.421 -4.248 -14.948 1.00 0.58 H new ATOM 0 HB2 GLU A 30 12.143 -6.529 -12.936 1.00 0.62 H new ATOM 0 HB3 GLU A 30 11.926 -6.658 -14.670 1.00 0.62 H new ATOM 0 HG2 GLU A 30 14.538 -5.870 -13.338 1.00 0.63 H new ATOM 0 HG3 GLU A 30 14.132 -7.508 -13.813 1.00 0.63 H new ATOM 436 N SER A 31 10.288 -3.368 -13.063 1.00 0.36 N ATOM 437 CA SER A 31 8.880 -3.083 -12.797 1.00 0.34 C ATOM 438 C SER A 31 8.447 -1.769 -13.441 1.00 0.36 C ATOM 439 O SER A 31 9.270 -1.028 -13.979 1.00 0.46 O ATOM 440 CB SER A 31 8.633 -3.019 -11.292 1.00 0.37 C ATOM 441 OG SER A 31 9.074 -4.198 -10.650 1.00 0.83 O ATOM 0 H SER A 31 10.939 -2.683 -12.679 1.00 0.36 H new ATOM 0 HA SER A 31 8.290 -3.889 -13.232 1.00 0.34 H new ATOM 0 HB2 SER A 31 9.152 -2.157 -10.872 1.00 0.37 H new ATOM 0 HB3 SER A 31 7.570 -2.874 -11.101 1.00 0.37 H new ATOM 0 HG SER A 31 8.905 -4.129 -9.687 1.00 0.83 H new ATOM 447 N HIS A 32 7.144 -1.484 -13.380 1.00 0.33 N ATOM 448 CA HIS A 32 6.602 -0.255 -13.957 1.00 0.39 C ATOM 449 C HIS A 32 5.160 -0.015 -13.501 1.00 0.34 C ATOM 450 O HIS A 32 4.325 -0.917 -13.540 1.00 0.36 O ATOM 451 CB HIS A 32 6.658 -0.325 -15.484 1.00 0.51 C ATOM 452 CG HIS A 32 6.234 0.939 -16.176 1.00 0.94 C ATOM 453 ND1 HIS A 32 6.056 1.022 -17.542 1.00 1.83 N ATOM 454 CD2 HIS A 32 5.962 2.176 -15.690 1.00 1.60 C ATOM 455 CE1 HIS A 32 5.694 2.252 -17.864 1.00 2.29 C ATOM 456 NE2 HIS A 32 5.629 2.971 -16.759 1.00 2.07 N ATOM 0 H HIS A 32 6.449 -2.086 -12.939 1.00 0.33 H new ATOM 0 HA HIS A 32 7.212 0.578 -13.608 1.00 0.39 H new ATOM 0 HB2 HIS A 32 7.676 -0.568 -15.788 1.00 0.51 H new ATOM 0 HB3 HIS A 32 6.021 -1.142 -15.822 1.00 0.51 H new ATOM 0 HD2 HIS A 32 6.000 2.479 -14.654 1.00 1.60 H new ATOM 0 HE1 HIS A 32 5.487 2.608 -18.862 1.00 2.29 H new ATOM 0 HE2 HIS A 32 5.373 3.957 -16.707 1.00 2.07 H new ATOM 465 N ILE A 33 4.884 1.217 -13.079 1.00 0.36 N ATOM 466 CA ILE A 33 3.552 1.607 -12.619 1.00 0.36 C ATOM 467 C ILE A 33 2.548 1.648 -13.772 1.00 0.38 C ATOM 468 O ILE A 33 2.915 1.921 -14.915 1.00 0.50 O ATOM 469 CB ILE A 33 3.602 2.997 -11.947 1.00 0.53 C ATOM 470 CG1 ILE A 33 4.282 2.902 -10.583 1.00 0.58 C ATOM 471 CG2 ILE A 33 2.209 3.600 -11.808 1.00 0.93 C ATOM 472 CD1 ILE A 33 3.600 1.950 -9.634 1.00 1.05 C ATOM 0 H ILE A 33 5.572 1.969 -13.046 1.00 0.36 H new ATOM 0 HA ILE A 33 3.226 0.857 -11.899 1.00 0.36 H new ATOM 0 HB ILE A 33 4.186 3.658 -12.588 1.00 0.53 H new ATOM 0 HG12 ILE A 33 5.315 2.585 -10.723 1.00 0.58 H new ATOM 0 HG13 ILE A 33 4.311 3.893 -10.131 1.00 0.58 H new ATOM 0 HG21 ILE A 33 2.282 4.578 -11.331 1.00 0.93 H new ATOM 0 HG22 ILE A 33 1.760 3.710 -12.795 1.00 0.93 H new ATOM 0 HG23 ILE A 33 1.588 2.944 -11.198 1.00 0.93 H new ATOM 0 HD11 ILE A 33 4.138 1.934 -8.686 1.00 1.05 H new ATOM 0 HD12 ILE A 33 2.575 2.278 -9.464 1.00 1.05 H new ATOM 0 HD13 ILE A 33 3.594 0.949 -10.065 1.00 1.05 H new ATOM 484 N LEU A 34 1.274 1.399 -13.461 1.00 0.38 N ATOM 485 CA LEU A 34 0.224 1.435 -14.474 1.00 0.50 C ATOM 486 C LEU A 34 -1.083 2.000 -13.907 1.00 0.46 C ATOM 487 O LEU A 34 -1.882 2.578 -14.645 1.00 0.60 O ATOM 488 CB LEU A 34 0.018 0.046 -15.100 1.00 0.65 C ATOM 489 CG LEU A 34 -0.241 -1.101 -14.123 1.00 1.01 C ATOM 490 CD1 LEU A 34 -1.690 -1.106 -13.665 1.00 1.69 C ATOM 491 CD2 LEU A 34 0.120 -2.434 -14.763 1.00 1.34 C ATOM 0 H LEU A 34 0.949 1.172 -12.521 1.00 0.38 H new ATOM 0 HA LEU A 34 0.547 2.110 -15.267 1.00 0.50 H new ATOM 0 HB2 LEU A 34 -0.822 0.103 -15.792 1.00 0.65 H new ATOM 0 HB3 LEU A 34 0.901 -0.199 -15.690 1.00 0.65 H new ATOM 0 HG LEU A 34 0.391 -0.952 -13.247 1.00 1.01 H new ATOM 0 HD11 LEU A 34 -1.849 -1.931 -12.971 1.00 1.69 H new ATOM 0 HD12 LEU A 34 -1.917 -0.164 -13.167 1.00 1.69 H new ATOM 0 HD13 LEU A 34 -2.344 -1.227 -14.528 1.00 1.69 H new ATOM 0 HD21 LEU A 34 -0.070 -3.241 -14.055 1.00 1.34 H new ATOM 0 HD22 LEU A 34 -0.486 -2.585 -15.656 1.00 1.34 H new ATOM 0 HD23 LEU A 34 1.175 -2.432 -15.037 1.00 1.34 H new ATOM 503 N THR A 35 -1.294 1.855 -12.595 1.00 0.46 N ATOM 504 CA THR A 35 -2.505 2.385 -11.954 1.00 0.43 C ATOM 505 C THR A 35 -2.215 2.920 -10.552 1.00 0.43 C ATOM 506 O THR A 35 -1.625 2.228 -9.724 1.00 0.52 O ATOM 507 CB THR A 35 -3.599 1.319 -11.883 1.00 0.49 C ATOM 508 OG1 THR A 35 -3.081 0.102 -11.390 1.00 0.68 O ATOM 509 CG2 THR A 35 -4.260 1.040 -13.215 1.00 0.72 C ATOM 0 H THR A 35 -0.651 1.381 -11.961 1.00 0.46 H new ATOM 0 HA THR A 35 -2.854 3.213 -12.571 1.00 0.43 H new ATOM 0 HB THR A 35 -4.352 1.727 -11.209 1.00 0.49 H new ATOM 0 HG1 THR A 35 -3.625 -0.643 -11.721 1.00 0.68 H new ATOM 0 HG21 THR A 35 -5.025 0.274 -13.088 1.00 0.72 H new ATOM 0 HG22 THR A 35 -4.720 1.954 -13.591 1.00 0.72 H new ATOM 0 HG23 THR A 35 -3.512 0.691 -13.927 1.00 0.72 H new ATOM 517 N VAL A 36 -2.647 4.156 -10.295 1.00 0.40 N ATOM 518 CA VAL A 36 -2.450 4.804 -8.994 1.00 0.46 C ATOM 519 C VAL A 36 -3.513 5.878 -8.758 1.00 0.48 C ATOM 520 O VAL A 36 -3.554 6.878 -9.475 1.00 0.56 O ATOM 521 CB VAL A 36 -1.060 5.474 -8.888 1.00 0.58 C ATOM 522 CG1 VAL A 36 -0.913 6.199 -7.557 1.00 1.32 C ATOM 523 CG2 VAL A 36 0.057 4.459 -9.063 1.00 1.45 C ATOM 0 H VAL A 36 -3.140 4.734 -10.976 1.00 0.40 H new ATOM 0 HA VAL A 36 -2.529 4.019 -8.242 1.00 0.46 H new ATOM 0 HB VAL A 36 -0.982 6.204 -9.694 1.00 0.58 H new ATOM 0 HG11 VAL A 36 0.072 6.663 -7.502 1.00 1.32 H new ATOM 0 HG12 VAL A 36 -1.682 6.967 -7.474 1.00 1.32 H new ATOM 0 HG13 VAL A 36 -1.024 5.486 -6.740 1.00 1.32 H new ATOM 0 HG21 VAL A 36 1.021 4.961 -8.983 1.00 1.45 H new ATOM 0 HG22 VAL A 36 -0.020 3.696 -8.288 1.00 1.45 H new ATOM 0 HG23 VAL A 36 -0.028 3.990 -10.043 1.00 1.45 H new ATOM 533 N SER A 37 -4.369 5.678 -7.751 1.00 0.45 N ATOM 534 CA SER A 37 -5.413 6.652 -7.449 1.00 0.54 C ATOM 535 C SER A 37 -6.139 6.297 -6.151 1.00 0.57 C ATOM 536 O SER A 37 -5.742 5.369 -5.446 1.00 1.08 O ATOM 537 CB SER A 37 -6.414 6.725 -8.606 1.00 0.65 C ATOM 538 OG SER A 37 -7.375 7.745 -8.397 1.00 1.28 O ATOM 0 H SER A 37 -4.358 4.861 -7.141 1.00 0.45 H new ATOM 0 HA SER A 37 -4.941 7.626 -7.319 1.00 0.54 H new ATOM 0 HB2 SER A 37 -5.881 6.911 -9.538 1.00 0.65 H new ATOM 0 HB3 SER A 37 -6.918 5.765 -8.713 1.00 0.65 H new ATOM 0 HG SER A 37 -7.998 7.767 -9.153 1.00 1.28 H new ATOM 544 N SER A 38 -7.204 7.044 -5.857 1.00 0.59 N ATOM 545 CA SER A 38 -8.016 6.830 -4.659 1.00 0.59 C ATOM 546 C SER A 38 -7.330 7.346 -3.395 1.00 0.52 C ATOM 547 O SER A 38 -7.093 6.587 -2.453 1.00 0.63 O ATOM 548 CB SER A 38 -8.370 5.346 -4.501 1.00 0.78 C ATOM 549 OG SER A 38 -9.117 4.880 -5.611 1.00 1.68 O ATOM 0 H SER A 38 -7.528 7.814 -6.442 1.00 0.59 H new ATOM 0 HA SER A 38 -8.933 7.404 -4.791 1.00 0.59 H new ATOM 0 HB2 SER A 38 -7.457 4.760 -4.401 1.00 0.78 H new ATOM 0 HB3 SER A 38 -8.944 5.201 -3.586 1.00 0.78 H new ATOM 0 HG SER A 38 -10.073 5.004 -5.437 1.00 1.68 H new ATOM 555 N PHE A 39 -7.037 8.645 -3.368 1.00 0.44 N ATOM 556 CA PHE A 39 -6.409 9.262 -2.202 1.00 0.50 C ATOM 557 C PHE A 39 -7.484 9.776 -1.250 1.00 0.57 C ATOM 558 O PHE A 39 -8.044 10.858 -1.442 1.00 0.75 O ATOM 559 CB PHE A 39 -5.487 10.412 -2.609 1.00 0.59 C ATOM 560 CG PHE A 39 -4.316 9.997 -3.460 1.00 0.59 C ATOM 561 CD1 PHE A 39 -4.522 9.323 -4.653 1.00 0.65 C ATOM 562 CD2 PHE A 39 -3.014 10.273 -3.068 1.00 0.83 C ATOM 563 CE1 PHE A 39 -3.454 8.932 -5.438 1.00 0.98 C ATOM 564 CE2 PHE A 39 -1.943 9.884 -3.850 1.00 1.19 C ATOM 565 CZ PHE A 39 -2.144 9.247 -5.026 1.00 1.26 C ATOM 0 H PHE A 39 -7.224 9.288 -4.137 1.00 0.44 H new ATOM 0 HA PHE A 39 -5.805 8.505 -1.702 1.00 0.50 H new ATOM 0 HB2 PHE A 39 -6.071 11.155 -3.152 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -5.112 10.898 -1.708 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -5.529 9.101 -4.973 1.00 0.65 H new ATOM 0 HD2 PHE A 39 -2.835 10.798 -2.141 1.00 0.83 H new ATOM 0 HE1 PHE A 39 -3.622 8.391 -6.357 1.00 0.98 H new ATOM 0 HE2 PHE A 39 -0.936 10.091 -3.519 1.00 1.19 H new ATOM 0 HZ PHE A 39 -1.302 8.980 -5.648 1.00 1.26 H new ATOM 575 N TYR A 40 -7.787 8.985 -0.236 1.00 0.65 N ATOM 576 CA TYR A 40 -8.816 9.351 0.722 1.00 0.81 C ATOM 577 C TYR A 40 -8.236 9.689 2.091 1.00 0.71 C ATOM 578 O TYR A 40 -7.019 9.704 2.292 1.00 0.71 O ATOM 579 CB TYR A 40 -9.830 8.221 0.838 1.00 1.01 C ATOM 580 CG TYR A 40 -9.165 6.884 0.923 1.00 1.49 C ATOM 581 CD1 TYR A 40 -8.411 6.534 2.029 1.00 2.39 C ATOM 582 CD2 TYR A 40 -9.335 5.951 -0.084 1.00 1.73 C ATOM 583 CE1 TYR A 40 -7.836 5.291 2.121 1.00 3.35 C ATOM 584 CE2 TYR A 40 -8.770 4.705 0.007 1.00 2.61 C ATOM 585 CZ TYR A 40 -7.859 4.459 1.050 1.00 3.41 C ATOM 586 OH TYR A 40 -7.476 3.139 1.198 1.00 4.43 O ATOM 0 H TYR A 40 -7.337 8.088 -0.055 1.00 0.65 H new ATOM 0 HA TYR A 40 -9.309 10.251 0.355 1.00 0.81 H new ATOM 0 HB2 TYR A 40 -10.448 8.376 1.722 1.00 1.01 H new ATOM 0 HB3 TYR A 40 -10.497 8.241 -0.024 1.00 1.01 H new ATOM 0 HD1 TYR A 40 -8.273 7.247 2.829 1.00 2.39 H new ATOM 0 HD2 TYR A 40 -9.921 6.208 -0.954 1.00 1.73 H new ATOM 0 HE1 TYR A 40 -7.367 4.977 3.042 1.00 3.35 H new ATOM 0 HE2 TYR A 40 -9.018 3.932 -0.705 1.00 2.61 H new ATOM 0 HH TYR A 40 -8.257 2.596 1.432 1.00 4.43 H new ATOM 596 N ARG A 41 -9.143 9.966 3.019 1.00 0.70 N ATOM 597 CA ARG A 41 -8.791 10.325 4.388 1.00 0.67 C ATOM 598 C ARG A 41 -8.525 9.086 5.237 1.00 0.64 C ATOM 599 O ARG A 41 -9.432 8.287 5.481 1.00 0.70 O ATOM 600 CB ARG A 41 -9.933 11.135 5.005 1.00 0.79 C ATOM 601 CG ARG A 41 -9.718 11.520 6.462 1.00 0.95 C ATOM 602 CD ARG A 41 -11.029 11.919 7.125 1.00 1.52 C ATOM 603 NE ARG A 41 -10.830 12.458 8.467 1.00 2.11 N ATOM 604 CZ ARG A 41 -10.348 13.673 8.707 1.00 2.49 C ATOM 605 NH1 ARG A 41 -10.071 14.491 7.700 1.00 2.37 N ATOM 606 NH2 ARG A 41 -10.159 14.080 9.956 1.00 3.51 N ATOM 0 H ARG A 41 -10.148 9.948 2.843 1.00 0.70 H new ATOM 0 HA ARG A 41 -7.877 10.919 4.364 1.00 0.67 H new ATOM 0 HB2 ARG A 41 -10.075 12.043 4.419 1.00 0.79 H new ATOM 0 HB3 ARG A 41 -10.854 10.558 4.927 1.00 0.79 H new ATOM 0 HG2 ARG A 41 -9.275 10.682 7.001 1.00 0.95 H new ATOM 0 HG3 ARG A 41 -9.011 12.347 6.522 1.00 0.95 H new ATOM 0 HD2 ARG A 41 -11.534 12.663 6.508 1.00 1.52 H new ATOM 0 HD3 ARG A 41 -11.686 11.051 7.178 1.00 1.52 H new ATOM 0 HE ARG A 41 -11.074 11.870 9.264 1.00 2.11 H new ATOM 0 HH11 ARG A 41 -10.228 14.188 6.739 1.00 2.37 H new ATOM 0 HH12 ARG A 41 -9.701 15.423 7.887 1.00 2.37 H new ATOM 0 HH21 ARG A 41 -10.384 13.460 10.734 1.00 3.51 H new ATOM 0 HH22 ARG A 41 -9.789 15.013 10.138 1.00 3.51 H new ATOM 620 N THR A 42 -7.287 8.935 5.698 1.00 0.80 N ATOM 621 CA THR A 42 -6.931 7.792 6.536 1.00 0.97 C ATOM 622 C THR A 42 -6.100 8.224 7.737 1.00 1.03 C ATOM 623 O THR A 42 -4.925 8.571 7.599 1.00 1.12 O ATOM 624 CB THR A 42 -6.157 6.749 5.736 1.00 1.17 C ATOM 625 OG1 THR A 42 -6.935 6.266 4.661 1.00 1.44 O ATOM 626 CG2 THR A 42 -5.740 5.560 6.573 1.00 1.32 C ATOM 0 H THR A 42 -6.520 9.581 5.509 1.00 0.80 H new ATOM 0 HA THR A 42 -7.863 7.352 6.892 1.00 0.97 H new ATOM 0 HB THR A 42 -5.263 7.257 5.374 1.00 1.17 H new ATOM 0 HG1 THR A 42 -6.913 6.913 3.925 1.00 1.44 H new ATOM 0 HG21 THR A 42 -5.193 4.851 5.951 1.00 1.32 H new ATOM 0 HG22 THR A 42 -5.100 5.896 7.389 1.00 1.32 H new ATOM 0 HG23 THR A 42 -6.626 5.075 6.983 1.00 1.32 H new ATOM 634 N PRO A 43 -6.680 8.184 8.944 1.00 1.12 N ATOM 635 CA PRO A 43 -5.958 8.560 10.154 1.00 1.31 C ATOM 636 C PRO A 43 -4.859 7.551 10.471 1.00 1.50 C ATOM 637 O PRO A 43 -4.975 6.375 10.126 1.00 1.71 O ATOM 638 CB PRO A 43 -7.042 8.573 11.228 1.00 1.48 C ATOM 639 CG PRO A 43 -8.059 7.600 10.736 1.00 1.38 C ATOM 640 CD PRO A 43 -8.062 7.745 9.235 1.00 1.15 C ATOM 0 HA PRO A 43 -5.447 9.519 10.068 1.00 1.31 H new ATOM 0 HB2 PRO A 43 -6.644 8.276 12.198 1.00 1.48 H new ATOM 0 HB3 PRO A 43 -7.470 9.568 11.350 1.00 1.48 H new ATOM 0 HG2 PRO A 43 -7.804 6.582 11.031 1.00 1.38 H new ATOM 0 HG3 PRO A 43 -9.043 7.816 11.153 1.00 1.38 H new ATOM 0 HD2 PRO A 43 -8.300 6.804 8.739 1.00 1.15 H new ATOM 0 HD3 PRO A 43 -8.797 8.477 8.901 1.00 1.15 H new ATOM 648 N PRO A 44 -3.767 8.006 11.106 1.00 1.55 N ATOM 649 CA PRO A 44 -2.629 7.158 11.447 1.00 1.80 C ATOM 650 C PRO A 44 -3.049 5.750 11.878 1.00 2.15 C ATOM 651 O PRO A 44 -2.543 4.753 11.362 1.00 2.77 O ATOM 652 CB PRO A 44 -1.998 7.921 12.605 1.00 1.80 C ATOM 653 CG PRO A 44 -2.217 9.348 12.248 1.00 1.81 C ATOM 654 CD PRO A 44 -3.541 9.398 11.528 1.00 1.54 C ATOM 0 HA PRO A 44 -1.961 6.988 10.603 1.00 1.80 H new ATOM 0 HB2 PRO A 44 -2.470 7.669 13.555 1.00 1.80 H new ATOM 0 HB3 PRO A 44 -0.937 7.692 12.705 1.00 1.80 H new ATOM 0 HG2 PRO A 44 -2.234 9.975 13.139 1.00 1.81 H new ATOM 0 HG3 PRO A 44 -1.413 9.719 11.612 1.00 1.81 H new ATOM 0 HD2 PRO A 44 -4.338 9.752 12.182 1.00 1.54 H new ATOM 0 HD3 PRO A 44 -3.506 10.074 10.674 1.00 1.54 H new ATOM 662 N LEU A 45 -3.993 5.691 12.817 1.00 2.16 N ATOM 663 CA LEU A 45 -4.526 4.424 13.326 1.00 2.52 C ATOM 664 C LEU A 45 -3.466 3.578 14.032 1.00 2.69 C ATOM 665 O LEU A 45 -2.964 2.606 13.467 1.00 3.09 O ATOM 666 CB LEU A 45 -5.166 3.618 12.191 1.00 2.75 C ATOM 667 CG LEU A 45 -5.820 2.300 12.619 1.00 3.05 C ATOM 668 CD1 LEU A 45 -6.935 2.554 13.622 1.00 3.66 C ATOM 669 CD2 LEU A 45 -6.353 1.552 11.407 1.00 3.32 C ATOM 0 H LEU A 45 -4.410 6.517 13.246 1.00 2.16 H new ATOM 0 HA LEU A 45 -5.283 4.679 14.068 1.00 2.52 H new ATOM 0 HB2 LEU A 45 -5.919 4.239 11.705 1.00 2.75 H new ATOM 0 HB3 LEU A 45 -4.402 3.401 11.444 1.00 2.75 H new ATOM 0 HG LEU A 45 -5.062 1.682 13.100 1.00 3.05 H new ATOM 0 HD11 LEU A 45 -7.386 1.605 13.913 1.00 3.66 H new ATOM 0 HD12 LEU A 45 -6.526 3.047 14.504 1.00 3.66 H new ATOM 0 HD13 LEU A 45 -7.693 3.192 13.169 1.00 3.66 H new ATOM 0 HD21 LEU A 45 -6.814 0.618 11.729 1.00 3.32 H new ATOM 0 HD22 LEU A 45 -7.095 2.166 10.898 1.00 3.32 H new ATOM 0 HD23 LEU A 45 -5.532 1.334 10.724 1.00 3.32 H new ATOM 681 N GLY A 46 -3.136 3.938 15.275 1.00 2.52 N ATOM 682 CA GLY A 46 -2.154 3.172 16.015 1.00 2.73 C ATOM 683 C GLY A 46 -1.217 4.053 16.805 1.00 2.68 C ATOM 684 O GLY A 46 -1.129 3.930 18.027 1.00 2.81 O ATOM 0 H GLY A 46 -3.528 4.737 15.773 1.00 2.52 H new ATOM 0 HA2 GLY A 46 -2.665 2.489 16.693 1.00 2.73 H new ATOM 0 HA3 GLY A 46 -1.576 2.560 15.322 1.00 2.73 H new ATOM 688 N PRO A 47 -0.500 4.961 16.130 1.00 2.59 N ATOM 689 CA PRO A 47 0.435 5.868 16.789 1.00 2.65 C ATOM 690 C PRO A 47 -0.214 6.649 17.924 1.00 2.60 C ATOM 691 O PRO A 47 0.423 6.898 18.948 1.00 2.86 O ATOM 692 CB PRO A 47 0.873 6.811 15.667 1.00 2.59 C ATOM 693 CG PRO A 47 0.661 6.033 14.417 1.00 2.63 C ATOM 694 CD PRO A 47 -0.541 5.176 14.670 1.00 2.54 C ATOM 0 HA PRO A 47 1.261 5.330 17.254 1.00 2.65 H new ATOM 0 HB2 PRO A 47 0.284 7.728 15.668 1.00 2.59 H new ATOM 0 HB3 PRO A 47 1.917 7.103 15.780 1.00 2.59 H new ATOM 0 HG2 PRO A 47 0.497 6.695 13.567 1.00 2.63 H new ATOM 0 HG3 PRO A 47 1.534 5.423 14.183 1.00 2.63 H new ATOM 0 HD2 PRO A 47 -1.461 5.672 14.362 1.00 2.54 H new ATOM 0 HD3 PRO A 47 -0.487 4.235 14.123 1.00 2.54 H new ATOM 702 N GLN A 48 -1.482 7.043 17.745 1.00 2.39 N ATOM 703 CA GLN A 48 -2.179 7.806 18.777 1.00 2.50 C ATOM 704 C GLN A 48 -3.631 8.108 18.391 1.00 2.40 C ATOM 705 O GLN A 48 -4.329 7.245 17.859 1.00 2.57 O ATOM 706 CB GLN A 48 -1.409 9.099 19.036 1.00 2.56 C ATOM 707 CG GLN A 48 -1.467 10.101 17.893 1.00 2.73 C ATOM 708 CD GLN A 48 -0.781 9.609 16.635 1.00 2.73 C ATOM 709 OE1 GLN A 48 0.445 9.572 16.557 1.00 3.26 O ATOM 710 NE2 GLN A 48 -1.578 9.205 15.652 1.00 2.45 N ATOM 0 H GLN A 48 -2.034 6.848 16.910 1.00 2.39 H new ATOM 0 HA GLN A 48 -2.218 7.205 19.686 1.00 2.50 H new ATOM 0 HB2 GLN A 48 -1.804 9.569 19.937 1.00 2.56 H new ATOM 0 HB3 GLN A 48 -0.366 8.853 19.236 1.00 2.56 H new ATOM 0 HG2 GLN A 48 -2.509 10.325 17.667 1.00 2.73 H new ATOM 0 HG3 GLN A 48 -1.002 11.034 18.212 1.00 2.73 H new ATOM 0 HE21 GLN A 48 -2.591 9.255 15.763 1.00 2.45 H new ATOM 0 HE22 GLN A 48 -1.177 8.845 14.786 1.00 2.45 H new ATOM 719 N ASP A 49 -4.079 9.339 18.667 1.00 2.45 N ATOM 720 CA ASP A 49 -5.443 9.766 18.354 1.00 2.47 C ATOM 721 C ASP A 49 -5.731 9.673 16.856 1.00 2.38 C ATOM 722 O ASP A 49 -6.818 10.030 16.403 1.00 2.57 O ATOM 723 CB ASP A 49 -5.672 11.199 18.840 1.00 2.79 C ATOM 724 CG ASP A 49 -5.489 11.339 20.338 1.00 2.83 C ATOM 725 OD1 ASP A 49 -4.377 11.054 20.831 1.00 3.02 O ATOM 726 OD2 ASP A 49 -6.457 11.735 21.021 1.00 3.28 O ATOM 0 H ASP A 49 -3.509 10.060 19.110 1.00 2.45 H new ATOM 0 HA ASP A 49 -6.128 9.094 18.871 1.00 2.47 H new ATOM 0 HB2 ASP A 49 -4.980 11.868 18.328 1.00 2.79 H new ATOM 0 HB3 ASP A 49 -6.679 11.515 18.569 1.00 2.79 H new ATOM 731 N GLN A 50 -4.756 9.181 16.098 1.00 2.26 N ATOM 732 CA GLN A 50 -4.897 9.016 14.658 1.00 2.39 C ATOM 733 C GLN A 50 -5.233 10.334 13.955 1.00 2.01 C ATOM 734 O GLN A 50 -6.264 10.446 13.294 1.00 2.19 O ATOM 735 CB GLN A 50 -5.971 7.971 14.349 1.00 3.08 C ATOM 736 CG GLN A 50 -5.826 6.687 15.153 1.00 3.45 C ATOM 737 CD GLN A 50 -6.694 6.639 16.402 1.00 3.73 C ATOM 738 OE1 GLN A 50 -6.549 5.742 17.231 1.00 4.34 O ATOM 739 NE2 GLN A 50 -7.615 7.586 16.537 1.00 3.74 N ATOM 0 H GLN A 50 -3.850 8.887 16.464 1.00 2.26 H new ATOM 0 HA GLN A 50 -3.935 8.676 14.275 1.00 2.39 H new ATOM 0 HB2 GLN A 50 -6.952 8.403 14.545 1.00 3.08 H new ATOM 0 HB3 GLN A 50 -5.935 7.730 13.287 1.00 3.08 H new ATOM 0 HG2 GLN A 50 -6.078 5.840 14.515 1.00 3.45 H new ATOM 0 HG3 GLN A 50 -4.782 6.568 15.443 1.00 3.45 H new ATOM 0 HE21 GLN A 50 -7.706 8.314 15.828 1.00 3.74 H new ATOM 0 HE22 GLN A 50 -8.232 7.585 17.349 1.00 3.74 H new ATOM 748 N PRO A 51 -4.378 11.358 14.102 1.00 1.98 N ATOM 749 CA PRO A 51 -4.577 12.666 13.509 1.00 2.00 C ATOM 750 C PRO A 51 -3.801 12.862 12.201 1.00 1.82 C ATOM 751 O PRO A 51 -2.773 13.533 12.180 1.00 2.47 O ATOM 752 CB PRO A 51 -4.031 13.599 14.600 1.00 2.71 C ATOM 753 CG PRO A 51 -3.282 12.710 15.556 1.00 2.89 C ATOM 754 CD PRO A 51 -3.162 11.372 14.889 1.00 2.51 C ATOM 0 HA PRO A 51 -5.617 12.840 13.232 1.00 2.00 H new ATOM 0 HB2 PRO A 51 -3.374 14.358 14.174 1.00 2.71 H new ATOM 0 HB3 PRO A 51 -4.840 14.125 15.106 1.00 2.71 H new ATOM 0 HG2 PRO A 51 -2.298 13.122 15.779 1.00 2.89 H new ATOM 0 HG3 PRO A 51 -3.814 12.625 16.504 1.00 2.89 H new ATOM 0 HD2 PRO A 51 -2.267 11.296 14.271 1.00 2.51 H new ATOM 0 HD3 PRO A 51 -3.124 10.553 15.607 1.00 2.51 H new ATOM 762 N ASP A 52 -4.324 12.287 11.115 1.00 1.32 N ATOM 763 CA ASP A 52 -3.718 12.396 9.783 1.00 1.52 C ATOM 764 C ASP A 52 -4.638 11.745 8.759 1.00 1.28 C ATOM 765 O ASP A 52 -5.726 11.290 9.115 1.00 2.07 O ATOM 766 CB ASP A 52 -2.321 11.769 9.733 1.00 2.12 C ATOM 767 CG ASP A 52 -1.217 12.764 10.042 1.00 2.77 C ATOM 768 OD1 ASP A 52 -1.512 13.975 10.099 1.00 3.26 O ATOM 769 OD2 ASP A 52 -0.063 12.331 10.243 1.00 3.33 O ATOM 0 H ASP A 52 -5.180 11.732 11.133 1.00 1.32 H new ATOM 0 HA ASP A 52 -3.596 13.453 9.548 1.00 1.52 H new ATOM 0 HB2 ASP A 52 -2.272 10.946 10.446 1.00 2.12 H new ATOM 0 HB3 ASP A 52 -2.154 11.344 8.743 1.00 2.12 H new ATOM 774 N TYR A 53 -4.222 11.706 7.489 1.00 0.84 N ATOM 775 CA TYR A 53 -5.061 11.112 6.443 1.00 1.19 C ATOM 776 C TYR A 53 -4.479 11.212 5.029 1.00 0.96 C ATOM 777 O TYR A 53 -4.627 12.237 4.377 1.00 1.43 O ATOM 778 CB TYR A 53 -6.444 11.783 6.459 1.00 2.08 C ATOM 779 CG TYR A 53 -6.422 13.266 6.804 1.00 3.12 C ATOM 780 CD1 TYR A 53 -5.700 14.159 6.022 1.00 3.74 C ATOM 781 CD2 TYR A 53 -7.126 13.773 7.891 1.00 3.88 C ATOM 782 CE1 TYR A 53 -5.676 15.510 6.316 1.00 4.86 C ATOM 783 CE2 TYR A 53 -7.109 15.122 8.190 1.00 5.03 C ATOM 784 CZ TYR A 53 -6.383 15.969 7.468 1.00 5.45 C ATOM 785 OH TYR A 53 -6.362 17.329 7.693 1.00 6.66 O ATOM 0 H TYR A 53 -3.327 12.071 7.164 1.00 0.84 H new ATOM 0 HA TYR A 53 -5.122 10.049 6.676 1.00 1.19 H new ATOM 0 HB2 TYR A 53 -6.906 11.657 5.480 1.00 2.08 H new ATOM 0 HB3 TYR A 53 -7.077 11.265 7.179 1.00 2.08 H new ATOM 0 HD1 TYR A 53 -5.148 13.792 5.170 1.00 3.74 H new ATOM 0 HD2 TYR A 53 -7.697 13.100 8.513 1.00 3.88 H new ATOM 0 HE1 TYR A 53 -5.135 16.202 5.688 1.00 4.86 H new ATOM 0 HE2 TYR A 53 -7.692 15.492 9.020 1.00 5.03 H new ATOM 0 HH TYR A 53 -6.875 17.535 8.502 1.00 6.66 H new ATOM 795 N LEU A 54 -3.882 10.137 4.511 1.00 0.84 N ATOM 796 CA LEU A 54 -3.376 10.172 3.140 1.00 0.76 C ATOM 797 C LEU A 54 -3.027 8.775 2.650 1.00 0.76 C ATOM 798 O LEU A 54 -1.864 8.376 2.671 1.00 0.98 O ATOM 799 CB LEU A 54 -2.157 11.095 3.031 1.00 0.97 C ATOM 800 CG LEU A 54 -1.884 11.662 1.628 1.00 1.15 C ATOM 801 CD1 LEU A 54 -1.547 10.558 0.636 1.00 1.60 C ATOM 802 CD2 LEU A 54 -3.079 12.467 1.138 1.00 1.60 C ATOM 0 H LEU A 54 -3.740 9.255 5.004 1.00 0.84 H new ATOM 0 HA LEU A 54 -4.168 10.569 2.505 1.00 0.76 H new ATOM 0 HB2 LEU A 54 -2.290 11.928 3.722 1.00 0.97 H new ATOM 0 HB3 LEU A 54 -1.275 10.545 3.360 1.00 0.97 H new ATOM 0 HG LEU A 54 -1.019 12.321 1.700 1.00 1.15 H new ATOM 0 HD11 LEU A 54 -1.360 10.995 -0.345 1.00 1.60 H new ATOM 0 HD12 LEU A 54 -0.657 10.026 0.972 1.00 1.60 H new ATOM 0 HD13 LEU A 54 -2.382 9.861 0.569 1.00 1.60 H new ATOM 0 HD21 LEU A 54 -2.869 12.861 0.144 1.00 1.60 H new ATOM 0 HD22 LEU A 54 -3.958 11.824 1.095 1.00 1.60 H new ATOM 0 HD23 LEU A 54 -3.267 13.293 1.824 1.00 1.60 H new ATOM 814 N ASN A 55 -4.034 8.035 2.187 1.00 0.60 N ATOM 815 CA ASN A 55 -3.798 6.684 1.679 1.00 0.66 C ATOM 816 C ASN A 55 -4.273 6.545 0.240 1.00 0.50 C ATOM 817 O ASN A 55 -5.126 7.303 -0.220 1.00 0.56 O ATOM 818 CB ASN A 55 -4.481 5.627 2.552 1.00 0.87 C ATOM 819 CG ASN A 55 -3.731 5.327 3.840 1.00 1.51 C ATOM 820 OD1 ASN A 55 -4.069 4.384 4.555 1.00 2.21 O ATOM 821 ND2 ASN A 55 -2.713 6.122 4.148 1.00 2.21 N ATOM 0 H ASN A 55 -5.006 8.342 2.153 1.00 0.60 H new ATOM 0 HA ASN A 55 -2.721 6.517 1.712 1.00 0.66 H new ATOM 0 HB2 ASN A 55 -5.488 5.965 2.798 1.00 0.87 H new ATOM 0 HB3 ASN A 55 -4.585 4.706 1.979 1.00 0.87 H new ATOM 0 HD21 ASN A 55 -2.181 5.961 5.003 1.00 2.21 H new ATOM 0 HD22 ASN A 55 -2.463 6.894 3.529 1.00 2.21 H new ATOM 828 N ALA A 56 -3.711 5.567 -0.463 1.00 0.50 N ATOM 829 CA ALA A 56 -4.070 5.319 -1.851 1.00 0.45 C ATOM 830 C ALA A 56 -3.653 3.918 -2.279 1.00 0.45 C ATOM 831 O ALA A 56 -3.061 3.165 -1.503 1.00 0.61 O ATOM 832 CB ALA A 56 -3.435 6.364 -2.756 1.00 0.58 C ATOM 0 H ALA A 56 -3.004 4.933 -0.091 1.00 0.50 H new ATOM 0 HA ALA A 56 -5.154 5.391 -1.941 1.00 0.45 H new ATOM 0 HB1 ALA A 56 -3.712 6.166 -3.791 1.00 0.58 H new ATOM 0 HB2 ALA A 56 -3.787 7.355 -2.470 1.00 0.58 H new ATOM 0 HB3 ALA A 56 -2.350 6.321 -2.656 1.00 0.58 H new ATOM 838 N ALA A 57 -3.969 3.573 -3.520 1.00 0.43 N ATOM 839 CA ALA A 57 -3.631 2.264 -4.050 1.00 0.47 C ATOM 840 C ALA A 57 -2.739 2.376 -5.271 1.00 0.40 C ATOM 841 O ALA A 57 -2.832 3.333 -6.040 1.00 0.44 O ATOM 842 CB ALA A 57 -4.886 1.492 -4.399 1.00 0.59 C ATOM 0 H ALA A 57 -4.458 4.182 -4.176 1.00 0.43 H new ATOM 0 HA ALA A 57 -3.084 1.726 -3.275 1.00 0.47 H new ATOM 0 HB1 ALA A 57 -4.613 0.514 -4.795 1.00 0.59 H new ATOM 0 HB2 ALA A 57 -5.495 1.365 -3.504 1.00 0.59 H new ATOM 0 HB3 ALA A 57 -5.454 2.041 -5.150 1.00 0.59 H new ATOM 848 N VAL A 58 -1.881 1.383 -5.440 1.00 0.39 N ATOM 849 CA VAL A 58 -0.974 1.347 -6.563 1.00 0.39 C ATOM 850 C VAL A 58 -0.846 -0.070 -7.095 1.00 0.40 C ATOM 851 O VAL A 58 -0.555 -1.003 -6.351 1.00 0.60 O ATOM 852 CB VAL A 58 0.421 1.871 -6.183 1.00 0.49 C ATOM 853 CG1 VAL A 58 1.343 1.814 -7.384 1.00 1.11 C ATOM 854 CG2 VAL A 58 0.336 3.287 -5.635 1.00 1.22 C ATOM 0 H VAL A 58 -1.798 0.588 -4.806 1.00 0.39 H new ATOM 0 HA VAL A 58 -1.389 1.996 -7.334 1.00 0.39 H new ATOM 0 HB VAL A 58 0.830 1.233 -5.399 1.00 0.49 H new ATOM 0 HG11 VAL A 58 2.328 2.187 -7.104 1.00 1.11 H new ATOM 0 HG12 VAL A 58 1.430 0.783 -7.728 1.00 1.11 H new ATOM 0 HG13 VAL A 58 0.935 2.431 -8.185 1.00 1.11 H new ATOM 0 HG21 VAL A 58 1.335 3.636 -5.373 1.00 1.22 H new ATOM 0 HG22 VAL A 58 -0.092 3.945 -6.392 1.00 1.22 H new ATOM 0 HG23 VAL A 58 -0.296 3.296 -4.747 1.00 1.22 H new ATOM 864 N ALA A 59 -1.055 -0.218 -8.388 1.00 0.34 N ATOM 865 CA ALA A 59 -0.952 -1.513 -9.030 1.00 0.36 C ATOM 866 C ALA A 59 0.111 -1.461 -10.106 1.00 0.37 C ATOM 867 O ALA A 59 -0.103 -0.907 -11.187 1.00 0.43 O ATOM 868 CB ALA A 59 -2.293 -1.944 -9.604 1.00 0.44 C ATOM 0 H ALA A 59 -1.298 0.547 -9.017 1.00 0.34 H new ATOM 0 HA ALA A 59 -0.664 -2.256 -8.286 1.00 0.36 H new ATOM 0 HB1 ALA A 59 -2.189 -2.919 -10.080 1.00 0.44 H new ATOM 0 HB2 ALA A 59 -3.028 -2.009 -8.802 1.00 0.44 H new ATOM 0 HB3 ALA A 59 -2.625 -1.213 -10.342 1.00 0.44 H new ATOM 874 N LEU A 60 1.268 -2.008 -9.782 1.00 0.37 N ATOM 875 CA LEU A 60 2.396 -2.010 -10.695 1.00 0.45 C ATOM 876 C LEU A 60 2.733 -3.414 -11.174 1.00 0.39 C ATOM 877 O LEU A 60 2.657 -4.380 -10.417 1.00 0.38 O ATOM 878 CB LEU A 60 3.607 -1.380 -10.005 1.00 0.56 C ATOM 879 CG LEU A 60 4.966 -1.684 -10.637 1.00 0.48 C ATOM 880 CD1 LEU A 60 5.946 -0.565 -10.336 1.00 0.44 C ATOM 881 CD2 LEU A 60 5.509 -3.007 -10.115 1.00 0.98 C ATOM 0 H LEU A 60 1.452 -2.460 -8.886 1.00 0.37 H new ATOM 0 HA LEU A 60 2.125 -1.425 -11.574 1.00 0.45 H new ATOM 0 HB2 LEU A 60 3.469 -0.299 -9.987 1.00 0.56 H new ATOM 0 HB3 LEU A 60 3.626 -1.716 -8.968 1.00 0.56 H new ATOM 0 HG LEU A 60 4.837 -1.760 -11.717 1.00 0.48 H new ATOM 0 HD11 LEU A 60 6.910 -0.793 -10.791 1.00 0.44 H new ATOM 0 HD12 LEU A 60 5.565 0.372 -10.743 1.00 0.44 H new ATOM 0 HD13 LEU A 60 6.068 -0.469 -9.257 1.00 0.44 H new ATOM 0 HD21 LEU A 60 6.477 -3.210 -10.574 1.00 0.98 H new ATOM 0 HD22 LEU A 60 5.625 -2.951 -9.033 1.00 0.98 H new ATOM 0 HD23 LEU A 60 4.814 -3.809 -10.364 1.00 0.98 H new ATOM 893 N GLU A 61 3.139 -3.507 -12.435 1.00 0.39 N ATOM 894 CA GLU A 61 3.529 -4.778 -13.020 1.00 0.38 C ATOM 895 C GLU A 61 5.024 -4.995 -12.813 1.00 0.36 C ATOM 896 O GLU A 61 5.854 -4.409 -13.512 1.00 0.38 O ATOM 897 CB GLU A 61 3.174 -4.817 -14.510 1.00 0.44 C ATOM 898 CG GLU A 61 3.719 -3.641 -15.305 1.00 1.08 C ATOM 899 CD GLU A 61 3.345 -3.702 -16.775 1.00 1.06 C ATOM 900 OE1 GLU A 61 2.656 -4.665 -17.173 1.00 1.39 O ATOM 901 OE2 GLU A 61 3.741 -2.787 -17.526 1.00 1.24 O ATOM 0 H GLU A 61 3.206 -2.713 -13.071 1.00 0.39 H new ATOM 0 HA GLU A 61 2.983 -5.582 -12.527 1.00 0.38 H new ATOM 0 HB2 GLU A 61 3.557 -5.742 -14.940 1.00 0.44 H new ATOM 0 HB3 GLU A 61 2.089 -4.842 -14.614 1.00 0.44 H new ATOM 0 HG2 GLU A 61 3.341 -2.712 -14.877 1.00 1.08 H new ATOM 0 HG3 GLU A 61 4.805 -3.617 -15.212 1.00 1.08 H new ATOM 908 N THR A 62 5.365 -5.819 -11.828 1.00 0.39 N ATOM 909 CA THR A 62 6.758 -6.090 -11.513 1.00 0.43 C ATOM 910 C THR A 62 7.225 -7.412 -12.102 1.00 0.39 C ATOM 911 O THR A 62 6.446 -8.189 -12.652 1.00 0.43 O ATOM 912 CB THR A 62 6.971 -6.105 -9.991 1.00 0.54 C ATOM 913 OG1 THR A 62 8.253 -6.609 -9.662 1.00 1.47 O ATOM 914 CG2 THR A 62 5.947 -6.933 -9.247 1.00 1.02 C ATOM 0 H THR A 62 4.695 -6.309 -11.236 1.00 0.39 H new ATOM 0 HA THR A 62 7.350 -5.291 -11.959 1.00 0.43 H new ATOM 0 HB THR A 62 6.867 -5.065 -9.681 1.00 0.54 H new ATOM 0 HG1 THR A 62 8.247 -6.940 -8.740 1.00 1.47 H new ATOM 0 HG21 THR A 62 6.158 -6.899 -8.178 1.00 1.02 H new ATOM 0 HG22 THR A 62 4.951 -6.532 -9.433 1.00 1.02 H new ATOM 0 HG23 THR A 62 5.993 -7.966 -9.593 1.00 1.02 H new ATOM 922 N SER A 63 8.508 -7.651 -11.929 1.00 0.40 N ATOM 923 CA SER A 63 9.160 -8.872 -12.373 1.00 0.44 C ATOM 924 C SER A 63 9.997 -9.361 -11.215 1.00 0.44 C ATOM 925 O SER A 63 10.290 -10.548 -11.068 1.00 0.64 O ATOM 926 CB SER A 63 10.035 -8.618 -13.602 1.00 0.56 C ATOM 927 OG SER A 63 10.685 -9.808 -14.017 1.00 1.23 O ATOM 0 H SER A 63 9.139 -6.995 -11.470 1.00 0.40 H new ATOM 0 HA SER A 63 8.420 -9.617 -12.667 1.00 0.44 H new ATOM 0 HB2 SER A 63 9.422 -8.231 -14.416 1.00 0.56 H new ATOM 0 HB3 SER A 63 10.778 -7.854 -13.372 1.00 0.56 H new ATOM 0 HG SER A 63 11.237 -9.621 -14.805 1.00 1.23 H new ATOM 933 N LEU A 64 10.334 -8.397 -10.370 1.00 0.39 N ATOM 934 CA LEU A 64 11.089 -8.623 -9.167 1.00 0.38 C ATOM 935 C LEU A 64 10.121 -8.830 -8.016 1.00 0.35 C ATOM 936 O LEU A 64 9.621 -7.860 -7.445 1.00 0.39 O ATOM 937 CB LEU A 64 11.981 -7.413 -8.881 1.00 0.42 C ATOM 938 CG LEU A 64 11.365 -6.054 -9.210 1.00 0.50 C ATOM 939 CD1 LEU A 64 11.956 -4.979 -8.314 1.00 0.78 C ATOM 940 CD2 LEU A 64 11.605 -5.708 -10.671 1.00 0.84 C ATOM 0 H LEU A 64 10.080 -7.420 -10.513 1.00 0.39 H new ATOM 0 HA LEU A 64 11.719 -9.505 -9.285 1.00 0.38 H new ATOM 0 HB2 LEU A 64 12.252 -7.424 -7.825 1.00 0.42 H new ATOM 0 HB3 LEU A 64 12.905 -7.521 -9.449 1.00 0.42 H new ATOM 0 HG LEU A 64 10.291 -6.106 -9.034 1.00 0.50 H new ATOM 0 HD11 LEU A 64 11.509 -4.015 -8.558 1.00 0.78 H new ATOM 0 HD12 LEU A 64 11.750 -5.221 -7.271 1.00 0.78 H new ATOM 0 HD13 LEU A 64 13.034 -4.929 -8.469 1.00 0.78 H new ATOM 0 HD21 LEU A 64 11.161 -4.737 -10.893 1.00 0.84 H new ATOM 0 HD22 LEU A 64 12.677 -5.670 -10.864 1.00 0.84 H new ATOM 0 HD23 LEU A 64 11.149 -6.469 -11.305 1.00 0.84 H new ATOM 952 N ALA A 65 9.846 -10.092 -7.697 1.00 0.38 N ATOM 953 CA ALA A 65 8.922 -10.425 -6.620 1.00 0.42 C ATOM 954 C ALA A 65 9.039 -9.419 -5.484 1.00 0.39 C ATOM 955 O ALA A 65 10.141 -8.976 -5.171 1.00 0.38 O ATOM 956 CB ALA A 65 9.196 -11.833 -6.111 1.00 0.52 C ATOM 0 H ALA A 65 10.251 -10.900 -8.170 1.00 0.38 H new ATOM 0 HA ALA A 65 7.905 -10.384 -7.010 1.00 0.42 H new ATOM 0 HB1 ALA A 65 8.500 -12.071 -5.307 1.00 0.52 H new ATOM 0 HB2 ALA A 65 9.067 -12.546 -6.925 1.00 0.52 H new ATOM 0 HB3 ALA A 65 10.218 -11.892 -5.736 1.00 0.52 H new ATOM 962 N PRO A 66 7.905 -9.032 -4.861 1.00 0.44 N ATOM 963 CA PRO A 66 7.877 -8.070 -3.761 1.00 0.47 C ATOM 964 C PRO A 66 9.133 -8.091 -2.915 1.00 0.45 C ATOM 965 O PRO A 66 9.558 -7.063 -2.411 1.00 0.49 O ATOM 966 CB PRO A 66 6.675 -8.545 -2.973 1.00 0.55 C ATOM 967 CG PRO A 66 5.714 -8.931 -4.038 1.00 0.57 C ATOM 968 CD PRO A 66 6.541 -9.491 -5.179 1.00 0.50 C ATOM 0 HA PRO A 66 7.820 -7.037 -4.103 1.00 0.47 H new ATOM 0 HB2 PRO A 66 6.922 -9.387 -2.327 1.00 0.55 H new ATOM 0 HB3 PRO A 66 6.275 -7.759 -2.333 1.00 0.55 H new ATOM 0 HG2 PRO A 66 5.005 -9.674 -3.671 1.00 0.57 H new ATOM 0 HG3 PRO A 66 5.132 -8.070 -4.366 1.00 0.57 H new ATOM 0 HD2 PRO A 66 6.482 -10.578 -5.224 1.00 0.50 H new ATOM 0 HD3 PRO A 66 6.204 -9.114 -6.144 1.00 0.50 H new ATOM 976 N GLU A 67 9.744 -9.254 -2.781 1.00 0.45 N ATOM 977 CA GLU A 67 10.973 -9.351 -2.023 1.00 0.49 C ATOM 978 C GLU A 67 11.896 -8.202 -2.441 1.00 0.44 C ATOM 979 O GLU A 67 12.288 -7.366 -1.624 1.00 0.47 O ATOM 980 CB GLU A 67 11.634 -10.701 -2.286 1.00 0.52 C ATOM 981 CG GLU A 67 10.683 -11.872 -2.100 1.00 0.71 C ATOM 982 CD GLU A 67 11.292 -13.191 -2.528 1.00 0.77 C ATOM 983 OE1 GLU A 67 12.334 -13.577 -1.957 1.00 1.06 O ATOM 984 OE2 GLU A 67 10.729 -13.842 -3.433 1.00 1.20 O ATOM 0 H GLU A 67 9.414 -10.132 -3.182 1.00 0.45 H new ATOM 0 HA GLU A 67 10.768 -9.276 -0.955 1.00 0.49 H new ATOM 0 HB2 GLU A 67 12.026 -10.716 -3.303 1.00 0.52 H new ATOM 0 HB3 GLU A 67 12.485 -10.820 -1.615 1.00 0.52 H new ATOM 0 HG2 GLU A 67 10.390 -11.934 -1.052 1.00 0.71 H new ATOM 0 HG3 GLU A 67 9.774 -11.692 -2.675 1.00 0.71 H new ATOM 991 N GLU A 68 12.193 -8.151 -3.741 1.00 0.40 N ATOM 992 CA GLU A 68 13.028 -7.102 -4.319 1.00 0.39 C ATOM 993 C GLU A 68 12.266 -5.782 -4.399 1.00 0.35 C ATOM 994 O GLU A 68 12.734 -4.752 -3.916 1.00 0.40 O ATOM 995 CB GLU A 68 13.473 -7.512 -5.725 1.00 0.41 C ATOM 996 CG GLU A 68 14.213 -8.838 -5.770 1.00 0.97 C ATOM 997 CD GLU A 68 15.529 -8.813 -5.012 1.00 1.52 C ATOM 998 OE1 GLU A 68 15.894 -7.741 -4.482 1.00 1.90 O ATOM 999 OE2 GLU A 68 16.198 -9.865 -4.954 1.00 2.06 O ATOM 0 H GLU A 68 11.861 -8.836 -4.420 1.00 0.40 H new ATOM 0 HA GLU A 68 13.899 -6.966 -3.677 1.00 0.39 H new ATOM 0 HB2 GLU A 68 12.597 -7.573 -6.370 1.00 0.41 H new ATOM 0 HB3 GLU A 68 14.116 -6.733 -6.134 1.00 0.41 H new ATOM 0 HG2 GLU A 68 13.575 -9.617 -5.353 1.00 0.97 H new ATOM 0 HG3 GLU A 68 14.404 -9.105 -6.809 1.00 0.97 H new ATOM 1006 N LEU A 69 11.088 -5.829 -5.020 1.00 0.32 N ATOM 1007 CA LEU A 69 10.240 -4.647 -5.179 1.00 0.33 C ATOM 1008 C LEU A 69 10.127 -3.865 -3.870 1.00 0.34 C ATOM 1009 O LEU A 69 10.450 -2.679 -3.818 1.00 0.44 O ATOM 1010 CB LEU A 69 8.854 -5.076 -5.678 1.00 0.38 C ATOM 1011 CG LEU A 69 7.685 -4.192 -5.226 1.00 0.44 C ATOM 1012 CD1 LEU A 69 7.717 -2.865 -5.958 1.00 0.66 C ATOM 1013 CD2 LEU A 69 6.349 -4.900 -5.446 1.00 0.67 C ATOM 0 H LEU A 69 10.696 -6.680 -5.424 1.00 0.32 H new ATOM 0 HA LEU A 69 10.697 -3.985 -5.914 1.00 0.33 H new ATOM 0 HB2 LEU A 69 8.870 -5.097 -6.768 1.00 0.38 H new ATOM 0 HB3 LEU A 69 8.666 -6.096 -5.342 1.00 0.38 H new ATOM 0 HG LEU A 69 7.791 -4.002 -4.158 1.00 0.44 H new ATOM 0 HD11 LEU A 69 6.882 -2.247 -5.628 1.00 0.66 H new ATOM 0 HD12 LEU A 69 8.655 -2.353 -5.742 1.00 0.66 H new ATOM 0 HD13 LEU A 69 7.637 -3.039 -7.031 1.00 0.66 H new ATOM 0 HD21 LEU A 69 5.536 -4.253 -5.118 1.00 0.67 H new ATOM 0 HD22 LEU A 69 6.227 -5.127 -6.505 1.00 0.67 H new ATOM 0 HD23 LEU A 69 6.329 -5.827 -4.872 1.00 0.67 H new ATOM 1025 N LEU A 70 9.673 -4.540 -2.820 1.00 0.39 N ATOM 1026 CA LEU A 70 9.524 -3.914 -1.511 1.00 0.47 C ATOM 1027 C LEU A 70 10.819 -3.234 -1.093 1.00 0.44 C ATOM 1028 O LEU A 70 10.798 -2.127 -0.562 1.00 0.47 O ATOM 1029 CB LEU A 70 9.115 -4.945 -0.454 1.00 0.62 C ATOM 1030 CG LEU A 70 7.757 -5.615 -0.679 1.00 0.99 C ATOM 1031 CD1 LEU A 70 7.477 -6.633 0.415 1.00 1.48 C ATOM 1032 CD2 LEU A 70 6.648 -4.577 -0.732 1.00 1.65 C ATOM 0 H LEU A 70 9.401 -5.523 -2.850 1.00 0.39 H new ATOM 0 HA LEU A 70 8.737 -3.163 -1.588 1.00 0.47 H new ATOM 0 HB2 LEU A 70 9.880 -5.720 -0.412 1.00 0.62 H new ATOM 0 HB3 LEU A 70 9.103 -4.456 0.520 1.00 0.62 H new ATOM 0 HG LEU A 70 7.788 -6.134 -1.637 1.00 0.99 H new ATOM 0 HD11 LEU A 70 6.508 -7.099 0.239 1.00 1.48 H new ATOM 0 HD12 LEU A 70 8.254 -7.397 0.408 1.00 1.48 H new ATOM 0 HD13 LEU A 70 7.468 -6.133 1.384 1.00 1.48 H new ATOM 0 HD21 LEU A 70 5.691 -5.074 -0.893 1.00 1.65 H new ATOM 0 HD22 LEU A 70 6.618 -4.028 0.209 1.00 1.65 H new ATOM 0 HD23 LEU A 70 6.838 -3.883 -1.551 1.00 1.65 H new ATOM 1044 N ASN A 71 11.952 -3.896 -1.335 1.00 0.46 N ATOM 1045 CA ASN A 71 13.243 -3.319 -0.978 1.00 0.50 C ATOM 1046 C ASN A 71 13.383 -1.904 -1.536 1.00 0.41 C ATOM 1047 O ASN A 71 13.774 -0.990 -0.816 1.00 0.44 O ATOM 1048 CB ASN A 71 14.399 -4.192 -1.475 1.00 0.59 C ATOM 1049 CG ASN A 71 14.583 -5.447 -0.643 1.00 0.79 C ATOM 1050 OD1 ASN A 71 14.693 -5.381 0.582 1.00 1.59 O ATOM 1051 ND2 ASN A 71 14.636 -6.597 -1.304 1.00 0.72 N ATOM 0 H ASN A 71 12.000 -4.817 -1.770 1.00 0.46 H new ATOM 0 HA ASN A 71 13.288 -3.273 0.110 1.00 0.50 H new ATOM 0 HB2 ASN A 71 14.218 -4.472 -2.513 1.00 0.59 H new ATOM 0 HB3 ASN A 71 15.321 -3.611 -1.458 1.00 0.59 H new ATOM 0 HD21 ASN A 71 14.772 -7.471 -0.796 1.00 0.72 H new ATOM 0 HD22 ASN A 71 14.540 -6.606 -2.319 1.00 0.72 H new ATOM 1058 N HIS A 72 13.061 -1.730 -2.820 1.00 0.37 N ATOM 1059 CA HIS A 72 13.157 -0.423 -3.470 1.00 0.35 C ATOM 1060 C HIS A 72 12.142 0.567 -2.908 1.00 0.32 C ATOM 1061 O HIS A 72 12.489 1.707 -2.601 1.00 0.35 O ATOM 1062 CB HIS A 72 12.965 -0.571 -4.977 1.00 0.39 C ATOM 1063 CG HIS A 72 14.104 -1.274 -5.645 1.00 0.57 C ATOM 1064 ND1 HIS A 72 15.335 -0.689 -5.851 1.00 1.07 N ATOM 1065 CD2 HIS A 72 14.204 -2.534 -6.129 1.00 0.61 C ATOM 1066 CE1 HIS A 72 16.141 -1.556 -6.437 1.00 1.40 C ATOM 1067 NE2 HIS A 72 15.479 -2.684 -6.617 1.00 1.11 N ATOM 0 H HIS A 72 12.732 -2.479 -3.429 1.00 0.37 H new ATOM 0 HA HIS A 72 14.152 -0.027 -3.267 1.00 0.35 H new ATOM 0 HB2 HIS A 72 12.044 -1.121 -5.168 1.00 0.39 H new ATOM 0 HB3 HIS A 72 12.844 0.417 -5.421 1.00 0.39 H new ATOM 0 HD2 HIS A 72 13.426 -3.283 -6.131 1.00 0.61 H new ATOM 0 HE1 HIS A 72 17.167 -1.373 -6.721 1.00 1.40 H new ATOM 0 HE2 HIS A 72 15.853 -3.529 -7.048 1.00 1.11 H new ATOM 1076 N THR A 73 10.891 0.140 -2.771 1.00 0.34 N ATOM 1077 CA THR A 73 9.855 1.019 -2.236 1.00 0.38 C ATOM 1078 C THR A 73 10.244 1.499 -0.838 1.00 0.36 C ATOM 1079 O THR A 73 10.336 2.701 -0.578 1.00 0.36 O ATOM 1080 CB THR A 73 8.512 0.295 -2.200 1.00 0.47 C ATOM 1081 OG1 THR A 73 8.588 -0.867 -1.396 1.00 0.77 O ATOM 1082 CG2 THR A 73 8.024 -0.124 -3.570 1.00 0.61 C ATOM 0 H THR A 73 10.572 -0.796 -3.019 1.00 0.34 H new ATOM 0 HA THR A 73 9.759 1.888 -2.888 1.00 0.38 H new ATOM 0 HB THR A 73 7.807 1.014 -1.784 1.00 0.47 H new ATOM 0 HG1 THR A 73 9.478 -1.267 -1.483 1.00 0.77 H new ATOM 0 HG21 THR A 73 7.065 -0.633 -3.475 1.00 0.61 H new ATOM 0 HG22 THR A 73 7.906 0.758 -4.199 1.00 0.61 H new ATOM 0 HG23 THR A 73 8.750 -0.799 -4.024 1.00 0.61 H new ATOM 1090 N GLN A 74 10.494 0.540 0.046 1.00 0.39 N ATOM 1091 CA GLN A 74 10.897 0.827 1.413 1.00 0.42 C ATOM 1092 C GLN A 74 12.290 1.445 1.435 1.00 0.41 C ATOM 1093 O GLN A 74 12.753 1.918 2.472 1.00 0.50 O ATOM 1094 CB GLN A 74 10.895 -0.457 2.244 1.00 0.49 C ATOM 1095 CG GLN A 74 9.554 -1.170 2.264 1.00 1.45 C ATOM 1096 CD GLN A 74 8.468 -0.343 2.922 1.00 1.87 C ATOM 1097 OE1 GLN A 74 8.559 -0.005 4.103 1.00 2.25 O ATOM 1098 NE2 GLN A 74 7.437 -0.011 2.160 1.00 2.54 N ATOM 0 H GLN A 74 10.423 -0.455 -0.166 1.00 0.39 H new ATOM 0 HA GLN A 74 10.186 1.534 1.841 1.00 0.42 H new ATOM 0 HB2 GLN A 74 11.651 -1.136 1.850 1.00 0.49 H new ATOM 0 HB3 GLN A 74 11.184 -0.217 3.267 1.00 0.49 H new ATOM 0 HG2 GLN A 74 9.257 -1.408 1.243 1.00 1.45 H new ATOM 0 HG3 GLN A 74 9.657 -2.117 2.794 1.00 1.45 H new ATOM 0 HE21 GLN A 74 7.404 -0.313 1.186 1.00 2.54 H new ATOM 0 HE22 GLN A 74 6.676 0.547 2.547 1.00 2.54 H new ATOM 1107 N ARG A 75 12.953 1.442 0.285 1.00 0.37 N ATOM 1108 CA ARG A 75 14.290 2.011 0.180 1.00 0.41 C ATOM 1109 C ARG A 75 14.203 3.525 0.247 1.00 0.39 C ATOM 1110 O ARG A 75 15.038 4.188 0.866 1.00 0.43 O ATOM 1111 CB ARG A 75 14.955 1.582 -1.132 1.00 0.48 C ATOM 1112 CG ARG A 75 16.424 1.951 -1.231 1.00 0.89 C ATOM 1113 CD ARG A 75 17.005 1.546 -2.579 1.00 0.88 C ATOM 1114 NE ARG A 75 18.453 1.739 -2.631 1.00 1.59 N ATOM 1115 CZ ARG A 75 19.050 2.924 -2.509 1.00 2.26 C ATOM 1116 NH1 ARG A 75 18.326 4.023 -2.340 1.00 2.72 N ATOM 1117 NH2 ARG A 75 20.372 3.008 -2.558 1.00 3.06 N ATOM 0 H ARG A 75 12.588 1.053 -0.585 1.00 0.37 H new ATOM 0 HA ARG A 75 14.896 1.645 1.009 1.00 0.41 H new ATOM 0 HB2 ARG A 75 14.854 0.502 -1.242 1.00 0.48 H new ATOM 0 HB3 ARG A 75 14.420 2.038 -1.965 1.00 0.48 H new ATOM 0 HG2 ARG A 75 16.542 3.025 -1.089 1.00 0.89 H new ATOM 0 HG3 ARG A 75 16.979 1.461 -0.431 1.00 0.89 H new ATOM 0 HD2 ARG A 75 16.771 0.499 -2.775 1.00 0.88 H new ATOM 0 HD3 ARG A 75 16.533 2.131 -3.368 1.00 0.88 H new ATOM 0 HE ARG A 75 19.042 0.917 -2.769 1.00 1.59 H new ATOM 0 HH11 ARG A 75 17.308 3.963 -2.303 1.00 2.72 H new ATOM 0 HH12 ARG A 75 18.787 4.928 -2.247 1.00 2.72 H new ATOM 0 HH21 ARG A 75 20.932 2.166 -2.689 1.00 3.06 H new ATOM 0 HH22 ARG A 75 20.829 3.915 -2.465 1.00 3.06 H new ATOM 1131 N ILE A 76 13.174 4.063 -0.392 1.00 0.38 N ATOM 1132 CA ILE A 76 12.961 5.496 -0.408 1.00 0.41 C ATOM 1133 C ILE A 76 12.441 5.979 0.937 1.00 0.42 C ATOM 1134 O ILE A 76 13.055 6.836 1.558 1.00 0.44 O ATOM 1135 CB ILE A 76 11.974 5.915 -1.511 1.00 0.45 C ATOM 1136 CG1 ILE A 76 12.303 5.195 -2.822 1.00 0.55 C ATOM 1137 CG2 ILE A 76 12.015 7.423 -1.705 1.00 0.50 C ATOM 1138 CD1 ILE A 76 13.695 5.482 -3.347 1.00 0.83 C ATOM 0 H ILE A 76 12.475 3.525 -0.905 1.00 0.38 H new ATOM 0 HA ILE A 76 13.927 5.957 -0.614 1.00 0.41 H new ATOM 0 HB ILE A 76 10.966 5.631 -1.207 1.00 0.45 H new ATOM 0 HG12 ILE A 76 12.196 4.121 -2.672 1.00 0.55 H new ATOM 0 HG13 ILE A 76 11.573 5.485 -3.578 1.00 0.55 H new ATOM 0 HG21 ILE A 76 11.313 7.708 -2.488 1.00 0.50 H new ATOM 0 HG22 ILE A 76 11.740 7.917 -0.773 1.00 0.50 H new ATOM 0 HG23 ILE A 76 13.022 7.726 -1.993 1.00 0.50 H new ATOM 0 HD11 ILE A 76 13.853 4.936 -4.277 1.00 0.83 H new ATOM 0 HD12 ILE A 76 13.801 6.551 -3.531 1.00 0.83 H new ATOM 0 HD13 ILE A 76 14.434 5.165 -2.611 1.00 0.83 H new ATOM 1150 N GLU A 77 11.314 5.427 1.390 1.00 0.44 N ATOM 1151 CA GLU A 77 10.744 5.833 2.678 1.00 0.47 C ATOM 1152 C GLU A 77 11.792 5.752 3.781 1.00 0.48 C ATOM 1153 O GLU A 77 11.718 6.475 4.776 1.00 0.54 O ATOM 1154 CB GLU A 77 9.521 4.982 3.043 1.00 0.50 C ATOM 1155 CG GLU A 77 9.808 3.500 3.225 1.00 0.66 C ATOM 1156 CD GLU A 77 10.473 3.188 4.554 1.00 0.97 C ATOM 1157 OE1 GLU A 77 9.876 3.506 5.602 1.00 1.43 O ATOM 1158 OE2 GLU A 77 11.585 2.622 4.545 1.00 1.32 O ATOM 0 H GLU A 77 10.785 4.710 0.895 1.00 0.44 H new ATOM 0 HA GLU A 77 10.417 6.868 2.581 1.00 0.47 H new ATOM 0 HB2 GLU A 77 9.088 5.370 3.965 1.00 0.50 H new ATOM 0 HB3 GLU A 77 8.768 5.099 2.263 1.00 0.50 H new ATOM 0 HG2 GLU A 77 8.874 2.942 3.151 1.00 0.66 H new ATOM 0 HG3 GLU A 77 10.450 3.157 2.413 1.00 0.66 H new ATOM 1165 N LEU A 78 12.775 4.880 3.591 1.00 0.45 N ATOM 1166 CA LEU A 78 13.849 4.716 4.562 1.00 0.49 C ATOM 1167 C LEU A 78 14.761 5.935 4.541 1.00 0.49 C ATOM 1168 O LEU A 78 15.251 6.378 5.578 1.00 0.59 O ATOM 1169 CB LEU A 78 14.656 3.451 4.256 1.00 0.53 C ATOM 1170 CG LEU A 78 15.829 3.178 5.201 1.00 0.88 C ATOM 1171 CD1 LEU A 78 15.334 2.959 6.622 1.00 1.66 C ATOM 1172 CD2 LEU A 78 16.627 1.976 4.720 1.00 1.52 C ATOM 0 H LEU A 78 12.850 4.276 2.773 1.00 0.45 H new ATOM 0 HA LEU A 78 13.410 4.618 5.555 1.00 0.49 H new ATOM 0 HB2 LEU A 78 13.982 2.595 4.283 1.00 0.53 H new ATOM 0 HB3 LEU A 78 15.040 3.522 3.238 1.00 0.53 H new ATOM 0 HG LEU A 78 16.483 4.050 5.200 1.00 0.88 H new ATOM 0 HD11 LEU A 78 16.183 2.767 7.278 1.00 1.66 H new ATOM 0 HD12 LEU A 78 14.806 3.849 6.964 1.00 1.66 H new ATOM 0 HD13 LEU A 78 14.658 2.104 6.644 1.00 1.66 H new ATOM 0 HD21 LEU A 78 17.458 1.794 5.402 1.00 1.52 H new ATOM 0 HD22 LEU A 78 15.981 1.098 4.692 1.00 1.52 H new ATOM 0 HD23 LEU A 78 17.015 2.173 3.720 1.00 1.52 H new ATOM 1184 N GLN A 79 14.985 6.469 3.344 1.00 0.47 N ATOM 1185 CA GLN A 79 15.840 7.637 3.172 1.00 0.52 C ATOM 1186 C GLN A 79 15.037 8.848 2.697 1.00 0.53 C ATOM 1187 O GLN A 79 15.608 9.825 2.212 1.00 0.72 O ATOM 1188 CB GLN A 79 16.942 7.322 2.160 1.00 0.63 C ATOM 1189 CG GLN A 79 17.791 6.119 2.539 1.00 1.12 C ATOM 1190 CD GLN A 79 18.793 5.732 1.465 1.00 1.67 C ATOM 1191 OE1 GLN A 79 19.606 4.830 1.660 1.00 2.24 O ATOM 1192 NE2 GLN A 79 18.737 6.403 0.317 1.00 2.32 N ATOM 0 H GLN A 79 14.585 6.110 2.477 1.00 0.47 H new ATOM 0 HA GLN A 79 16.282 7.880 4.138 1.00 0.52 H new ATOM 0 HB2 GLN A 79 16.488 7.143 1.185 1.00 0.63 H new ATOM 0 HB3 GLN A 79 17.588 8.194 2.056 1.00 0.63 H new ATOM 0 HG2 GLN A 79 18.325 6.336 3.464 1.00 1.12 H new ATOM 0 HG3 GLN A 79 17.138 5.270 2.740 1.00 1.12 H new ATOM 0 HE21 GLN A 79 18.048 7.145 0.193 1.00 2.32 H new ATOM 0 HE22 GLN A 79 19.383 6.175 -0.439 1.00 2.32 H new ATOM 1201 N GLN A 80 13.712 8.779 2.825 1.00 0.61 N ATOM 1202 CA GLN A 80 12.851 9.875 2.389 1.00 0.72 C ATOM 1203 C GLN A 80 11.923 10.352 3.503 1.00 0.88 C ATOM 1204 O GLN A 80 11.522 11.516 3.524 1.00 1.15 O ATOM 1205 CB GLN A 80 12.017 9.465 1.170 1.00 0.74 C ATOM 1206 CG GLN A 80 11.237 10.620 0.560 1.00 1.27 C ATOM 1207 CD GLN A 80 12.134 11.709 0.006 1.00 1.51 C ATOM 1208 OE1 GLN A 80 12.911 12.326 0.736 1.00 2.00 O ATOM 1209 NE2 GLN A 80 12.032 11.954 -1.296 1.00 2.07 N ATOM 0 H GLN A 80 13.216 7.982 3.224 1.00 0.61 H new ATOM 0 HA GLN A 80 13.509 10.700 2.116 1.00 0.72 H new ATOM 0 HB2 GLN A 80 12.677 9.041 0.413 1.00 0.74 H new ATOM 0 HB3 GLN A 80 11.320 8.679 1.462 1.00 0.74 H new ATOM 0 HG2 GLN A 80 10.600 10.240 -0.238 1.00 1.27 H new ATOM 0 HG3 GLN A 80 10.579 11.048 1.317 1.00 1.27 H new ATOM 0 HE21 GLN A 80 11.376 11.420 -1.866 1.00 2.07 H new ATOM 0 HE22 GLN A 80 12.610 12.676 -1.726 1.00 2.07 H new ATOM 1218 N GLY A 81 11.564 9.453 4.417 1.00 0.99 N ATOM 1219 CA GLY A 81 10.665 9.827 5.495 1.00 1.25 C ATOM 1220 C GLY A 81 11.235 10.907 6.395 1.00 1.79 C ATOM 1221 O GLY A 81 10.515 11.443 7.238 1.00 2.18 O ATOM 0 H GLY A 81 11.876 8.482 4.431 1.00 0.99 H new ATOM 0 HA2 GLY A 81 9.723 10.175 5.071 1.00 1.25 H new ATOM 0 HA3 GLY A 81 10.438 8.945 6.094 1.00 1.25 H new ATOM 1429 N THR A 93 5.277 7.108 7.558 1.00 1.14 N ATOM 1430 CA THR A 93 5.476 8.053 6.482 1.00 1.33 C ATOM 1431 C THR A 93 5.124 7.422 5.146 1.00 1.11 C ATOM 1432 O THR A 93 4.509 8.054 4.291 1.00 1.61 O ATOM 1433 CB THR A 93 6.933 8.520 6.474 1.00 1.94 C ATOM 1434 OG1 THR A 93 7.172 9.397 5.396 1.00 2.57 O ATOM 1435 CG2 THR A 93 7.928 7.384 6.371 1.00 2.58 C ATOM 0 HA THR A 93 4.822 8.910 6.640 1.00 1.33 H new ATOM 0 HB THR A 93 7.078 9.022 7.431 1.00 1.94 H new ATOM 0 HG1 THR A 93 7.676 8.928 4.699 1.00 2.57 H new ATOM 0 HG21 THR A 93 8.941 7.786 6.371 1.00 2.58 H new ATOM 0 HG22 THR A 93 7.804 6.714 7.222 1.00 2.58 H new ATOM 0 HG23 THR A 93 7.756 6.833 5.447 1.00 2.58 H new ATOM 1443 N LEU A 94 5.529 6.172 4.968 1.00 0.80 N ATOM 1444 CA LEU A 94 5.273 5.468 3.725 1.00 0.54 C ATOM 1445 C LEU A 94 5.315 3.953 3.930 1.00 0.52 C ATOM 1446 O LEU A 94 6.286 3.419 4.466 1.00 0.65 O ATOM 1447 CB LEU A 94 6.326 5.898 2.706 1.00 0.48 C ATOM 1448 CG LEU A 94 6.135 5.383 1.287 1.00 0.52 C ATOM 1449 CD1 LEU A 94 4.850 5.925 0.683 1.00 1.39 C ATOM 1450 CD2 LEU A 94 7.336 5.761 0.441 1.00 1.37 C ATOM 0 H LEU A 94 6.034 5.628 5.668 1.00 0.80 H new ATOM 0 HA LEU A 94 4.275 5.718 3.364 1.00 0.54 H new ATOM 0 HB2 LEU A 94 6.349 6.987 2.675 1.00 0.48 H new ATOM 0 HB3 LEU A 94 7.302 5.569 3.062 1.00 0.48 H new ATOM 0 HG LEU A 94 6.052 4.296 1.313 1.00 0.52 H new ATOM 0 HD11 LEU A 94 4.735 5.543 -0.331 1.00 1.39 H new ATOM 0 HD12 LEU A 94 4.001 5.607 1.288 1.00 1.39 H new ATOM 0 HD13 LEU A 94 4.891 7.014 0.658 1.00 1.39 H new ATOM 0 HD21 LEU A 94 7.197 5.391 -0.575 1.00 1.37 H new ATOM 0 HD22 LEU A 94 7.440 6.846 0.421 1.00 1.37 H new ATOM 0 HD23 LEU A 94 8.236 5.318 0.868 1.00 1.37 H new ATOM 1462 N ASP A 95 4.255 3.271 3.505 1.00 0.49 N ATOM 1463 CA ASP A 95 4.170 1.819 3.648 1.00 0.56 C ATOM 1464 C ASP A 95 3.825 1.161 2.315 1.00 0.48 C ATOM 1465 O ASP A 95 2.852 1.538 1.658 1.00 0.65 O ATOM 1466 CB ASP A 95 3.123 1.449 4.703 1.00 0.87 C ATOM 1467 CG ASP A 95 3.062 -0.044 4.969 1.00 1.51 C ATOM 1468 OD1 ASP A 95 3.855 -0.788 4.355 1.00 1.92 O ATOM 1469 OD2 ASP A 95 2.221 -0.471 5.788 1.00 2.19 O ATOM 0 H ASP A 95 3.443 3.699 3.059 1.00 0.49 H new ATOM 0 HA ASP A 95 5.144 1.452 3.971 1.00 0.56 H new ATOM 0 HB2 ASP A 95 3.350 1.971 5.633 1.00 0.87 H new ATOM 0 HB3 ASP A 95 2.143 1.796 4.374 1.00 0.87 H new ATOM 1474 N LEU A 96 4.636 0.178 1.921 1.00 0.48 N ATOM 1475 CA LEU A 96 4.430 -0.539 0.662 1.00 0.63 C ATOM 1476 C LEU A 96 4.399 -2.047 0.885 1.00 0.60 C ATOM 1477 O LEU A 96 5.408 -2.647 1.254 1.00 0.76 O ATOM 1478 CB LEU A 96 5.540 -0.209 -0.341 1.00 0.97 C ATOM 1479 CG LEU A 96 5.605 1.241 -0.825 1.00 0.98 C ATOM 1480 CD1 LEU A 96 4.267 1.676 -1.407 1.00 1.91 C ATOM 1481 CD2 LEU A 96 6.034 2.169 0.300 1.00 2.04 C ATOM 0 H LEU A 96 5.443 -0.140 2.457 1.00 0.48 H new ATOM 0 HA LEU A 96 3.469 -0.216 0.262 1.00 0.63 H new ATOM 0 HB2 LEU A 96 6.498 -0.462 0.113 1.00 0.97 H new ATOM 0 HB3 LEU A 96 5.419 -0.855 -1.210 1.00 0.97 H new ATOM 0 HG LEU A 96 6.354 1.301 -1.615 1.00 0.98 H new ATOM 0 HD11 LEU A 96 4.336 2.710 -1.745 1.00 1.91 H new ATOM 0 HD12 LEU A 96 4.012 1.035 -2.251 1.00 1.91 H new ATOM 0 HD13 LEU A 96 3.494 1.595 -0.643 1.00 1.91 H new ATOM 0 HD21 LEU A 96 6.073 3.194 -0.069 1.00 2.04 H new ATOM 0 HD22 LEU A 96 5.317 2.105 1.118 1.00 2.04 H new ATOM 0 HD23 LEU A 96 7.020 1.875 0.658 1.00 2.04 H new ATOM 1493 N ASP A 97 3.245 -2.654 0.640 1.00 0.55 N ATOM 1494 CA ASP A 97 3.095 -4.097 0.795 1.00 0.62 C ATOM 1495 C ASP A 97 2.084 -4.635 -0.206 1.00 0.56 C ATOM 1496 O ASP A 97 0.983 -4.103 -0.348 1.00 0.70 O ATOM 1497 CB ASP A 97 2.671 -4.448 2.222 1.00 0.79 C ATOM 1498 CG ASP A 97 2.698 -5.941 2.485 1.00 1.45 C ATOM 1499 OD1 ASP A 97 2.019 -6.686 1.748 1.00 2.17 O ATOM 1500 OD2 ASP A 97 3.398 -6.367 3.428 1.00 1.98 O ATOM 0 H ASP A 97 2.400 -2.172 0.334 1.00 0.55 H new ATOM 0 HA ASP A 97 4.061 -4.564 0.601 1.00 0.62 H new ATOM 0 HB2 ASP A 97 3.332 -3.946 2.928 1.00 0.79 H new ATOM 0 HB3 ASP A 97 1.665 -4.069 2.402 1.00 0.79 H new ATOM 1505 N ILE A 98 2.476 -5.688 -0.904 1.00 0.69 N ATOM 1506 CA ILE A 98 1.628 -6.311 -1.908 1.00 0.63 C ATOM 1507 C ILE A 98 0.441 -7.044 -1.295 1.00 0.67 C ATOM 1508 O ILE A 98 0.575 -7.758 -0.299 1.00 0.93 O ATOM 1509 CB ILE A 98 2.441 -7.292 -2.778 1.00 0.74 C ATOM 1510 CG1 ILE A 98 3.373 -8.139 -1.906 1.00 1.91 C ATOM 1511 CG2 ILE A 98 3.234 -6.539 -3.832 1.00 1.40 C ATOM 1512 CD1 ILE A 98 2.700 -9.319 -1.249 1.00 2.73 C ATOM 0 H ILE A 98 3.387 -6.134 -0.792 1.00 0.69 H new ATOM 0 HA ILE A 98 1.240 -5.503 -2.528 1.00 0.63 H new ATOM 0 HB ILE A 98 1.744 -7.960 -3.285 1.00 0.74 H new ATOM 0 HG12 ILE A 98 4.198 -8.501 -2.520 1.00 1.91 H new ATOM 0 HG13 ILE A 98 3.805 -7.504 -1.133 1.00 1.91 H new ATOM 0 HG21 ILE A 98 3.801 -7.247 -4.436 1.00 1.40 H new ATOM 0 HG22 ILE A 98 2.550 -5.982 -4.473 1.00 1.40 H new ATOM 0 HG23 ILE A 98 3.921 -5.846 -3.345 1.00 1.40 H new ATOM 0 HD11 ILE A 98 3.428 -9.866 -0.650 1.00 2.73 H new ATOM 0 HD12 ILE A 98 1.893 -8.966 -0.606 1.00 2.73 H new ATOM 0 HD13 ILE A 98 2.292 -9.978 -2.015 1.00 2.73 H new ATOM 1524 N MET A 99 -0.718 -6.883 -1.917 1.00 0.53 N ATOM 1525 CA MET A 99 -1.926 -7.547 -1.476 1.00 0.63 C ATOM 1526 C MET A 99 -2.312 -8.562 -2.538 1.00 0.63 C ATOM 1527 O MET A 99 -3.308 -9.270 -2.426 1.00 0.87 O ATOM 1528 CB MET A 99 -3.055 -6.533 -1.266 1.00 0.70 C ATOM 1529 CG MET A 99 -3.994 -6.890 -0.123 1.00 0.93 C ATOM 1530 SD MET A 99 -4.810 -8.485 -0.333 1.00 1.77 S ATOM 1531 CE MET A 99 -5.876 -8.153 -1.731 1.00 2.48 C ATOM 0 H MET A 99 -0.843 -6.290 -2.738 1.00 0.53 H new ATOM 0 HA MET A 99 -1.754 -8.045 -0.522 1.00 0.63 H new ATOM 0 HB2 MET A 99 -2.619 -5.552 -1.074 1.00 0.70 H new ATOM 0 HB3 MET A 99 -3.633 -6.450 -2.187 1.00 0.70 H new ATOM 0 HG2 MET A 99 -3.431 -6.899 0.810 1.00 0.93 H new ATOM 0 HG3 MET A 99 -4.752 -6.112 -0.030 1.00 0.93 H new ATOM 0 HE1 MET A 99 -5.952 -9.047 -2.351 1.00 2.48 H new ATOM 0 HE2 MET A 99 -6.867 -7.873 -1.374 1.00 2.48 H new ATOM 0 HE3 MET A 99 -5.459 -7.337 -2.321 1.00 2.48 H new ATOM 1541 N LEU A 100 -1.504 -8.611 -3.593 1.00 0.51 N ATOM 1542 CA LEU A 100 -1.744 -9.525 -4.697 1.00 0.55 C ATOM 1543 C LEU A 100 -0.559 -9.523 -5.663 1.00 0.54 C ATOM 1544 O LEU A 100 0.044 -8.480 -5.904 1.00 0.76 O ATOM 1545 CB LEU A 100 -3.043 -9.116 -5.404 1.00 0.75 C ATOM 1546 CG LEU A 100 -3.376 -9.873 -6.686 1.00 1.12 C ATOM 1547 CD1 LEU A 100 -3.192 -11.365 -6.496 1.00 1.87 C ATOM 1548 CD2 LEU A 100 -4.805 -9.579 -7.115 1.00 1.69 C ATOM 0 H LEU A 100 -0.676 -8.025 -3.704 1.00 0.51 H new ATOM 0 HA LEU A 100 -1.850 -10.542 -4.319 1.00 0.55 H new ATOM 0 HB2 LEU A 100 -3.869 -9.245 -4.705 1.00 0.75 H new ATOM 0 HB3 LEU A 100 -2.986 -8.053 -5.638 1.00 0.75 H new ATOM 0 HG LEU A 100 -2.692 -9.537 -7.465 1.00 1.12 H new ATOM 0 HD11 LEU A 100 -3.436 -11.883 -7.424 1.00 1.87 H new ATOM 0 HD12 LEU A 100 -2.157 -11.572 -6.226 1.00 1.87 H new ATOM 0 HD13 LEU A 100 -3.851 -11.715 -5.702 1.00 1.87 H new ATOM 0 HD21 LEU A 100 -5.030 -10.125 -8.031 1.00 1.69 H new ATOM 0 HD22 LEU A 100 -5.492 -9.891 -6.329 1.00 1.69 H new ATOM 0 HD23 LEU A 100 -4.919 -8.510 -7.293 1.00 1.69 H new ATOM 1560 N PHE A 101 -0.208 -10.694 -6.199 1.00 0.46 N ATOM 1561 CA PHE A 101 0.925 -10.794 -7.123 1.00 0.46 C ATOM 1562 C PHE A 101 0.552 -11.563 -8.388 1.00 0.51 C ATOM 1563 O PHE A 101 0.711 -12.783 -8.458 1.00 0.58 O ATOM 1564 CB PHE A 101 2.119 -11.465 -6.435 1.00 0.45 C ATOM 1565 CG PHE A 101 3.347 -11.563 -7.297 1.00 0.51 C ATOM 1566 CD1 PHE A 101 3.872 -10.439 -7.916 1.00 0.56 C ATOM 1567 CD2 PHE A 101 3.983 -12.781 -7.480 1.00 0.58 C ATOM 1568 CE1 PHE A 101 5.005 -10.530 -8.703 1.00 0.65 C ATOM 1569 CE2 PHE A 101 5.115 -12.878 -8.265 1.00 0.68 C ATOM 1570 CZ PHE A 101 5.626 -11.752 -8.879 1.00 0.71 C ATOM 0 H PHE A 101 -0.685 -11.576 -6.013 1.00 0.46 H new ATOM 0 HA PHE A 101 1.202 -9.781 -7.414 1.00 0.46 H new ATOM 0 HB2 PHE A 101 2.365 -10.907 -5.532 1.00 0.45 H new ATOM 0 HB3 PHE A 101 1.828 -12.467 -6.121 1.00 0.45 H new ATOM 0 HD1 PHE A 101 3.390 -9.482 -7.782 1.00 0.56 H new ATOM 0 HD2 PHE A 101 3.588 -13.666 -7.002 1.00 0.58 H new ATOM 0 HE1 PHE A 101 5.404 -9.647 -9.180 1.00 0.65 H new ATOM 0 HE2 PHE A 101 5.600 -13.834 -8.398 1.00 0.68 H new ATOM 0 HZ PHE A 101 6.509 -11.826 -9.496 1.00 0.71 H new ATOM 1580 N GLY A 102 0.062 -10.837 -9.387 1.00 0.54 N ATOM 1581 CA GLY A 102 -0.323 -11.447 -10.646 1.00 0.65 C ATOM 1582 C GLY A 102 -1.667 -12.138 -10.578 1.00 0.67 C ATOM 1583 O GLY A 102 -2.334 -12.288 -11.602 1.00 0.99 O ATOM 0 H GLY A 102 -0.076 -9.827 -9.346 1.00 0.54 H new ATOM 0 HA2 GLY A 102 -0.353 -10.681 -11.421 1.00 0.65 H new ATOM 0 HA3 GLY A 102 0.437 -12.170 -10.941 1.00 0.65 H new ATOM 1587 N ASN A 103 -2.029 -12.579 -9.368 1.00 0.58 N ATOM 1588 CA ASN A 103 -3.275 -13.298 -9.095 1.00 0.64 C ATOM 1589 C ASN A 103 -2.928 -14.756 -8.930 1.00 0.71 C ATOM 1590 O ASN A 103 -3.592 -15.654 -9.447 1.00 1.08 O ATOM 1591 CB ASN A 103 -4.333 -13.090 -10.186 1.00 0.78 C ATOM 1592 CG ASN A 103 -5.681 -13.665 -9.805 1.00 1.18 C ATOM 1593 OD1 ASN A 103 -5.979 -14.825 -10.089 1.00 2.12 O ATOM 1594 ND2 ASN A 103 -6.490 -12.861 -9.125 1.00 1.38 N ATOM 0 H ASN A 103 -1.453 -12.443 -8.537 1.00 0.58 H new ATOM 0 HA ASN A 103 -3.727 -12.905 -8.184 1.00 0.64 H new ATOM 0 HB2 ASN A 103 -4.440 -12.024 -10.385 1.00 0.78 H new ATOM 0 HB3 ASN A 103 -3.992 -13.554 -11.111 1.00 0.78 H new ATOM 0 HD21 ASN A 103 -7.401 -13.198 -8.815 1.00 1.38 H new ATOM 0 HD22 ASN A 103 -6.200 -11.906 -8.913 1.00 1.38 H new ATOM 1601 N GLU A 104 -1.836 -14.959 -8.209 1.00 0.53 N ATOM 1602 CA GLU A 104 -1.301 -16.269 -7.946 1.00 0.61 C ATOM 1603 C GLU A 104 -1.316 -16.537 -6.446 1.00 0.64 C ATOM 1604 O GLU A 104 -1.353 -15.605 -5.656 1.00 0.84 O ATOM 1605 CB GLU A 104 0.129 -16.301 -8.475 1.00 0.70 C ATOM 1606 CG GLU A 104 0.799 -17.651 -8.359 1.00 1.16 C ATOM 1607 CD GLU A 104 0.136 -18.722 -9.207 1.00 1.28 C ATOM 1608 OE1 GLU A 104 -0.826 -18.398 -9.936 1.00 1.79 O ATOM 1609 OE2 GLU A 104 0.586 -19.886 -9.148 1.00 1.87 O ATOM 0 H GLU A 104 -1.296 -14.203 -7.788 1.00 0.53 H new ATOM 0 HA GLU A 104 -1.900 -17.037 -8.436 1.00 0.61 H new ATOM 0 HB2 GLU A 104 0.125 -15.998 -9.522 1.00 0.70 H new ATOM 0 HB3 GLU A 104 0.722 -15.565 -7.933 1.00 0.70 H new ATOM 0 HG2 GLU A 104 1.844 -17.558 -8.655 1.00 1.16 H new ATOM 0 HG3 GLU A 104 0.790 -17.966 -7.315 1.00 1.16 H new ATOM 1616 N VAL A 105 -1.267 -17.799 -6.050 1.00 0.62 N ATOM 1617 CA VAL A 105 -1.247 -18.128 -4.632 1.00 0.66 C ATOM 1618 C VAL A 105 0.177 -18.444 -4.221 1.00 0.70 C ATOM 1619 O VAL A 105 0.609 -19.597 -4.240 1.00 0.83 O ATOM 1620 CB VAL A 105 -2.163 -19.319 -4.292 1.00 0.75 C ATOM 1621 CG1 VAL A 105 -2.153 -19.592 -2.796 1.00 1.18 C ATOM 1622 CG2 VAL A 105 -3.580 -19.057 -4.783 1.00 0.95 C ATOM 0 H VAL A 105 -1.241 -18.602 -6.679 1.00 0.62 H new ATOM 0 HA VAL A 105 -1.625 -17.266 -4.082 1.00 0.66 H new ATOM 0 HB VAL A 105 -1.782 -20.204 -4.801 1.00 0.75 H new ATOM 0 HG11 VAL A 105 -2.806 -20.437 -2.576 1.00 1.18 H new ATOM 0 HG12 VAL A 105 -1.138 -19.825 -2.475 1.00 1.18 H new ATOM 0 HG13 VAL A 105 -2.508 -18.710 -2.263 1.00 1.18 H new ATOM 0 HG21 VAL A 105 -4.214 -19.908 -4.535 1.00 0.95 H new ATOM 0 HG22 VAL A 105 -3.972 -18.160 -4.303 1.00 0.95 H new ATOM 0 HG23 VAL A 105 -3.570 -18.915 -5.864 1.00 0.95 H new ATOM 1632 N ILE A 106 0.913 -17.396 -3.893 1.00 0.65 N ATOM 1633 CA ILE A 106 2.308 -17.522 -3.522 1.00 0.72 C ATOM 1634 C ILE A 106 2.618 -16.773 -2.236 1.00 0.77 C ATOM 1635 O ILE A 106 2.621 -15.543 -2.199 1.00 0.84 O ATOM 1636 CB ILE A 106 3.188 -16.999 -4.675 1.00 0.81 C ATOM 1637 CG1 ILE A 106 4.651 -16.869 -4.260 1.00 0.76 C ATOM 1638 CG2 ILE A 106 2.653 -15.665 -5.177 1.00 1.33 C ATOM 1639 CD1 ILE A 106 5.516 -16.299 -5.362 1.00 0.76 C ATOM 0 H ILE A 106 0.561 -16.439 -3.877 1.00 0.65 H new ATOM 0 HA ILE A 106 2.524 -18.575 -3.341 1.00 0.72 H new ATOM 0 HB ILE A 106 3.145 -17.728 -5.484 1.00 0.81 H new ATOM 0 HG12 ILE A 106 4.720 -16.229 -3.380 1.00 0.76 H new ATOM 0 HG13 ILE A 106 5.033 -17.849 -3.973 1.00 0.76 H new ATOM 0 HG21 ILE A 106 3.281 -15.304 -5.991 1.00 1.33 H new ATOM 0 HG22 ILE A 106 1.632 -15.794 -5.537 1.00 1.33 H new ATOM 0 HG23 ILE A 106 2.662 -14.940 -4.363 1.00 1.33 H new ATOM 0 HD11 ILE A 106 6.547 -16.227 -5.015 1.00 0.76 H new ATOM 0 HD12 ILE A 106 5.471 -16.951 -6.234 1.00 0.76 H new ATOM 0 HD13 ILE A 106 5.154 -15.307 -5.632 1.00 0.76 H new ATOM 1651 N ASN A 107 2.871 -17.535 -1.178 1.00 0.80 N ATOM 1652 CA ASN A 107 3.176 -16.957 0.122 1.00 0.91 C ATOM 1653 C ASN A 107 4.551 -17.404 0.610 1.00 0.92 C ATOM 1654 O ASN A 107 4.915 -18.574 0.482 1.00 1.03 O ATOM 1655 CB ASN A 107 2.112 -17.363 1.139 1.00 1.00 C ATOM 1656 CG ASN A 107 0.721 -17.359 0.541 1.00 1.11 C ATOM 1657 OD1 ASN A 107 0.355 -18.259 -0.215 1.00 1.79 O ATOM 1658 ND2 ASN A 107 -0.051 -16.328 0.849 1.00 1.12 N ATOM 0 H ASN A 107 2.871 -18.555 -1.197 1.00 0.80 H new ATOM 0 HA ASN A 107 3.182 -15.872 0.017 1.00 0.91 H new ATOM 0 HB2 ASN A 107 2.338 -18.358 1.522 1.00 1.00 H new ATOM 0 HB3 ASN A 107 2.143 -16.680 1.988 1.00 1.00 H new ATOM 0 HD21 ASN A 107 -0.989 -16.258 0.455 1.00 1.12 H new ATOM 0 HD22 ASN A 107 0.293 -15.604 1.480 1.00 1.12 H new ATOM 1665 N THR A 108 5.305 -16.468 1.171 1.00 0.92 N ATOM 1666 CA THR A 108 6.637 -16.766 1.683 1.00 1.01 C ATOM 1667 C THR A 108 6.984 -15.863 2.867 1.00 1.15 C ATOM 1668 O THR A 108 7.280 -16.349 3.960 1.00 1.79 O ATOM 1669 CB THR A 108 7.682 -16.622 0.572 1.00 1.00 C ATOM 1670 OG1 THR A 108 8.993 -16.759 1.091 1.00 1.66 O ATOM 1671 CG2 THR A 108 7.611 -15.299 -0.163 1.00 1.26 C ATOM 0 H THR A 108 5.017 -15.496 1.283 1.00 0.92 H new ATOM 0 HA THR A 108 6.642 -17.798 2.034 1.00 1.01 H new ATOM 0 HB THR A 108 7.453 -17.419 -0.136 1.00 1.00 H new ATOM 0 HG1 THR A 108 9.644 -16.665 0.364 1.00 1.66 H new ATOM 0 HG21 THR A 108 8.380 -15.270 -0.934 1.00 1.26 H new ATOM 0 HG22 THR A 108 6.630 -15.192 -0.625 1.00 1.26 H new ATOM 0 HG23 THR A 108 7.772 -14.483 0.541 1.00 1.26 H new ATOM 1679 N GLU A 109 6.937 -14.552 2.644 1.00 0.95 N ATOM 1680 CA GLU A 109 7.238 -13.577 3.690 1.00 1.05 C ATOM 1681 C GLU A 109 7.058 -12.160 3.161 1.00 1.06 C ATOM 1682 O GLU A 109 6.195 -11.418 3.629 1.00 1.32 O ATOM 1683 CB GLU A 109 8.665 -13.765 4.212 1.00 1.20 C ATOM 1684 CG GLU A 109 9.028 -12.822 5.349 1.00 1.46 C ATOM 1685 CD GLU A 109 8.121 -12.984 6.554 1.00 2.13 C ATOM 1686 OE1 GLU A 109 8.077 -14.098 7.119 1.00 2.74 O ATOM 1687 OE2 GLU A 109 7.455 -11.998 6.932 1.00 2.57 O ATOM 0 H GLU A 109 6.692 -14.139 1.744 1.00 0.95 H new ATOM 0 HA GLU A 109 6.544 -13.737 4.515 1.00 1.05 H new ATOM 0 HB2 GLU A 109 8.786 -14.794 4.552 1.00 1.20 H new ATOM 0 HB3 GLU A 109 9.366 -13.616 3.390 1.00 1.20 H new ATOM 0 HG2 GLU A 109 10.060 -13.002 5.649 1.00 1.46 H new ATOM 0 HG3 GLU A 109 8.974 -11.793 4.994 1.00 1.46 H new ATOM 1694 N ARG A 110 7.864 -11.797 2.168 1.00 0.93 N ATOM 1695 CA ARG A 110 7.774 -10.477 1.563 1.00 0.97 C ATOM 1696 C ARG A 110 6.818 -10.525 0.386 1.00 0.79 C ATOM 1697 O ARG A 110 6.373 -9.493 -0.112 1.00 0.87 O ATOM 1698 CB ARG A 110 9.145 -9.983 1.083 1.00 1.17 C ATOM 1699 CG ARG A 110 10.167 -9.789 2.192 1.00 1.05 C ATOM 1700 CD ARG A 110 10.661 -11.116 2.743 1.00 1.57 C ATOM 1701 NE ARG A 110 11.345 -11.914 1.728 1.00 2.14 N ATOM 1702 CZ ARG A 110 11.876 -13.110 1.966 1.00 2.68 C ATOM 1703 NH1 ARG A 110 11.801 -13.646 3.178 1.00 2.96 N ATOM 1704 NH2 ARG A 110 12.485 -13.772 0.992 1.00 3.52 N ATOM 0 H ARG A 110 8.584 -12.398 1.768 1.00 0.93 H new ATOM 0 HA ARG A 110 7.408 -9.783 2.320 1.00 0.97 H new ATOM 0 HB2 ARG A 110 9.542 -10.696 0.361 1.00 1.17 H new ATOM 0 HB3 ARG A 110 9.013 -9.037 0.558 1.00 1.17 H new ATOM 0 HG2 ARG A 110 11.013 -9.216 1.811 1.00 1.05 H new ATOM 0 HG3 ARG A 110 9.723 -9.204 2.997 1.00 1.05 H new ATOM 0 HD2 ARG A 110 11.339 -10.932 3.576 1.00 1.57 H new ATOM 0 HD3 ARG A 110 9.817 -11.680 3.138 1.00 1.57 H new ATOM 0 HE ARG A 110 11.419 -11.533 0.785 1.00 2.14 H new ATOM 0 HH11 ARG A 110 11.335 -13.140 3.931 1.00 2.96 H new ATOM 0 HH12 ARG A 110 12.210 -14.563 3.356 1.00 2.96 H new ATOM 0 HH21 ARG A 110 12.547 -13.364 0.059 1.00 3.52 H new ATOM 0 HH22 ARG A 110 12.892 -14.689 1.176 1.00 3.52 H new ATOM 1718 N LEU A 111 6.514 -11.740 -0.057 1.00 0.72 N ATOM 1719 CA LEU A 111 5.620 -11.932 -1.185 1.00 0.75 C ATOM 1720 C LEU A 111 4.424 -12.808 -0.825 1.00 0.66 C ATOM 1721 O LEU A 111 4.409 -14.011 -1.091 1.00 0.70 O ATOM 1722 CB LEU A 111 6.387 -12.528 -2.371 1.00 0.95 C ATOM 1723 CG LEU A 111 5.527 -12.941 -3.569 1.00 0.69 C ATOM 1724 CD1 LEU A 111 4.475 -11.890 -3.868 1.00 0.95 C ATOM 1725 CD2 LEU A 111 6.398 -13.160 -4.794 1.00 1.36 C ATOM 0 H LEU A 111 6.875 -12.603 0.349 1.00 0.72 H new ATOM 0 HA LEU A 111 5.229 -10.954 -1.466 1.00 0.75 H new ATOM 0 HB2 LEU A 111 7.124 -11.799 -2.708 1.00 0.95 H new ATOM 0 HB3 LEU A 111 6.939 -13.401 -2.023 1.00 0.95 H new ATOM 0 HG LEU A 111 5.024 -13.874 -3.317 1.00 0.69 H new ATOM 0 HD11 LEU A 111 3.877 -12.206 -4.723 1.00 0.95 H new ATOM 0 HD12 LEU A 111 3.828 -11.765 -2.999 1.00 0.95 H new ATOM 0 HD13 LEU A 111 4.962 -10.942 -4.097 1.00 0.95 H new ATOM 0 HD21 LEU A 111 5.773 -13.453 -5.637 1.00 1.36 H new ATOM 0 HD22 LEU A 111 6.924 -12.237 -5.036 1.00 1.36 H new ATOM 0 HD23 LEU A 111 7.123 -13.948 -4.589 1.00 1.36 H new ATOM 1737 N THR A 112 3.413 -12.179 -0.242 1.00 0.71 N ATOM 1738 CA THR A 112 2.183 -12.865 0.132 1.00 0.67 C ATOM 1739 C THR A 112 1.020 -12.279 -0.665 1.00 0.66 C ATOM 1740 O THR A 112 0.587 -11.154 -0.414 1.00 0.82 O ATOM 1741 CB THR A 112 1.930 -12.737 1.636 1.00 0.74 C ATOM 1742 OG1 THR A 112 0.667 -13.279 1.980 1.00 0.75 O ATOM 1743 CG2 THR A 112 1.972 -11.310 2.138 1.00 0.83 C ATOM 0 H THR A 112 3.421 -11.184 -0.016 1.00 0.71 H new ATOM 0 HA THR A 112 2.277 -13.926 -0.099 1.00 0.67 H new ATOM 0 HB THR A 112 2.741 -13.290 2.110 1.00 0.74 H new ATOM 0 HG1 THR A 112 0.524 -13.189 2.945 1.00 0.75 H new ATOM 0 HG21 THR A 112 1.784 -11.296 3.212 1.00 0.83 H new ATOM 0 HG22 THR A 112 2.954 -10.882 1.936 1.00 0.83 H new ATOM 0 HG23 THR A 112 1.208 -10.722 1.629 1.00 0.83 H new ATOM 1751 N VAL A 113 0.521 -13.039 -1.636 1.00 0.60 N ATOM 1752 CA VAL A 113 -0.579 -12.575 -2.469 1.00 0.61 C ATOM 1753 C VAL A 113 -1.829 -12.359 -1.635 1.00 0.64 C ATOM 1754 O VAL A 113 -2.308 -11.237 -1.522 1.00 0.80 O ATOM 1755 CB VAL A 113 -0.867 -13.549 -3.623 1.00 0.64 C ATOM 1756 CG1 VAL A 113 -2.248 -13.305 -4.206 1.00 1.27 C ATOM 1757 CG2 VAL A 113 0.201 -13.419 -4.694 1.00 1.38 C ATOM 0 H VAL A 113 0.860 -13.974 -1.863 1.00 0.60 H new ATOM 0 HA VAL A 113 -0.279 -11.622 -2.905 1.00 0.61 H new ATOM 0 HB VAL A 113 -0.846 -14.566 -3.231 1.00 0.64 H new ATOM 0 HG11 VAL A 113 -2.428 -14.006 -5.021 1.00 1.27 H new ATOM 0 HG12 VAL A 113 -3.001 -13.448 -3.431 1.00 1.27 H new ATOM 0 HG13 VAL A 113 -2.308 -12.285 -4.586 1.00 1.27 H new ATOM 0 HG21 VAL A 113 -0.012 -14.113 -5.507 1.00 1.38 H new ATOM 0 HG22 VAL A 113 0.207 -12.400 -5.080 1.00 1.38 H new ATOM 0 HG23 VAL A 113 1.176 -13.651 -4.266 1.00 1.38 H new ATOM 1767 N PRO A 114 -2.372 -13.417 -1.010 1.00 0.61 N ATOM 1768 CA PRO A 114 -3.558 -13.283 -0.168 1.00 0.70 C ATOM 1769 C PRO A 114 -3.352 -12.197 0.882 1.00 0.76 C ATOM 1770 O PRO A 114 -4.308 -11.669 1.449 1.00 0.88 O ATOM 1771 CB PRO A 114 -3.681 -14.661 0.480 1.00 0.68 C ATOM 1772 CG PRO A 114 -3.031 -15.582 -0.488 1.00 0.83 C ATOM 1773 CD PRO A 114 -1.875 -14.808 -1.039 1.00 0.63 C ATOM 0 HA PRO A 114 -4.451 -12.993 -0.721 1.00 0.70 H new ATOM 0 HB2 PRO A 114 -3.186 -14.690 1.450 1.00 0.68 H new ATOM 0 HB3 PRO A 114 -4.724 -14.930 0.647 1.00 0.68 H new ATOM 0 HG2 PRO A 114 -2.697 -16.497 0.001 1.00 0.83 H new ATOM 0 HG3 PRO A 114 -3.722 -15.877 -1.278 1.00 0.83 H new ATOM 0 HD2 PRO A 114 -0.979 -14.931 -0.431 1.00 0.63 H new ATOM 0 HD3 PRO A 114 -1.620 -15.126 -2.050 1.00 0.63 H new ATOM 1781 N HIS A 115 -2.081 -11.871 1.109 1.00 0.82 N ATOM 1782 CA HIS A 115 -1.681 -10.843 2.065 1.00 0.95 C ATOM 1783 C HIS A 115 -2.109 -11.187 3.478 1.00 0.86 C ATOM 1784 O HIS A 115 -3.168 -11.774 3.700 1.00 0.88 O ATOM 1785 CB HIS A 115 -2.261 -9.483 1.684 1.00 1.14 C ATOM 1786 CG HIS A 115 -1.771 -8.368 2.556 1.00 2.17 C ATOM 1787 ND1 HIS A 115 -0.434 -8.061 2.704 1.00 3.14 N ATOM 1788 CD2 HIS A 115 -2.443 -7.490 3.335 1.00 2.95 C ATOM 1789 CE1 HIS A 115 -0.308 -7.045 3.537 1.00 4.09 C ATOM 1790 NE2 HIS A 115 -1.511 -6.678 3.933 1.00 3.97 N ATOM 0 H HIS A 115 -1.297 -12.315 0.632 1.00 0.82 H new ATOM 0 HA HIS A 115 -0.592 -10.796 2.033 1.00 0.95 H new ATOM 0 HB2 HIS A 115 -2.006 -9.264 0.647 1.00 1.14 H new ATOM 0 HB3 HIS A 115 -3.348 -9.530 1.742 1.00 1.14 H new ATOM 0 HD1 HIS A 115 0.337 -8.544 2.242 1.00 3.14 H new ATOM 0 HD2 HIS A 115 -3.514 -7.437 3.463 1.00 2.95 H new ATOM 0 HE1 HIS A 115 0.623 -6.591 3.843 1.00 4.09 H new ATOM 1799 N TYR A 116 -1.286 -10.793 4.433 1.00 1.04 N ATOM 1800 CA TYR A 116 -1.589 -11.036 5.825 1.00 1.14 C ATOM 1801 C TYR A 116 -2.155 -9.777 6.466 1.00 1.04 C ATOM 1802 O TYR A 116 -1.406 -8.875 6.841 1.00 1.47 O ATOM 1803 CB TYR A 116 -0.331 -11.493 6.570 1.00 1.62 C ATOM 1804 CG TYR A 116 -0.559 -11.802 8.034 1.00 2.18 C ATOM 1805 CD1 TYR A 116 -1.670 -12.528 8.442 1.00 2.56 C ATOM 1806 CD2 TYR A 116 0.334 -11.364 9.009 1.00 3.06 C ATOM 1807 CE1 TYR A 116 -1.886 -12.812 9.776 1.00 3.50 C ATOM 1808 CE2 TYR A 116 0.123 -11.645 10.346 1.00 4.05 C ATOM 1809 CZ TYR A 116 -0.965 -12.369 10.728 1.00 4.18 C ATOM 1810 OH TYR A 116 -1.201 -12.650 12.055 1.00 5.29 O ATOM 0 H TYR A 116 -0.406 -10.305 4.267 1.00 1.04 H new ATOM 0 HA TYR A 116 -2.337 -11.827 5.888 1.00 1.14 H new ATOM 0 HB2 TYR A 116 0.066 -12.382 6.080 1.00 1.62 H new ATOM 0 HB3 TYR A 116 0.430 -10.717 6.488 1.00 1.62 H new ATOM 0 HD1 TYR A 116 -2.377 -12.876 7.704 1.00 2.56 H new ATOM 0 HD2 TYR A 116 1.205 -10.796 8.716 1.00 3.06 H new ATOM 0 HE1 TYR A 116 -2.758 -13.371 10.080 1.00 3.50 H new ATOM 0 HE2 TYR A 116 0.822 -11.290 11.089 1.00 4.05 H new ATOM 0 HH TYR A 116 -0.476 -12.281 12.601 1.00 5.29 H new ATOM 1820 N ASP A 117 -3.487 -9.751 6.591 1.00 0.77 N ATOM 1821 CA ASP A 117 -4.231 -8.639 7.203 1.00 0.80 C ATOM 1822 C ASP A 117 -4.752 -7.625 6.180 1.00 0.72 C ATOM 1823 O ASP A 117 -4.809 -6.428 6.469 1.00 0.82 O ATOM 1824 CB ASP A 117 -3.400 -7.912 8.270 1.00 1.03 C ATOM 1825 CG ASP A 117 -2.984 -8.827 9.406 1.00 1.77 C ATOM 1826 OD1 ASP A 117 -3.350 -10.020 9.375 1.00 2.46 O ATOM 1827 OD2 ASP A 117 -2.290 -8.348 10.328 1.00 2.22 O ATOM 0 H ASP A 117 -4.087 -10.509 6.267 1.00 0.77 H new ATOM 0 HA ASP A 117 -5.095 -9.103 7.678 1.00 0.80 H new ATOM 0 HB2 ASP A 117 -2.510 -7.487 7.806 1.00 1.03 H new ATOM 0 HB3 ASP A 117 -3.978 -7.080 8.671 1.00 1.03 H new ATOM 1832 N MET A 118 -5.180 -8.093 5.006 1.00 0.69 N ATOM 1833 CA MET A 118 -5.740 -7.182 4.004 1.00 0.72 C ATOM 1834 C MET A 118 -7.097 -6.700 4.484 1.00 0.71 C ATOM 1835 O MET A 118 -7.412 -5.513 4.411 1.00 0.73 O ATOM 1836 CB MET A 118 -5.867 -7.845 2.617 1.00 0.83 C ATOM 1837 CG MET A 118 -5.885 -9.365 2.661 1.00 1.15 C ATOM 1838 SD MET A 118 -7.383 -10.037 3.402 1.00 2.40 S ATOM 1839 CE MET A 118 -7.079 -11.795 3.245 1.00 3.10 C ATOM 0 H MET A 118 -5.152 -9.074 4.729 1.00 0.69 H new ATOM 0 HA MET A 118 -5.058 -6.340 3.888 1.00 0.72 H new ATOM 0 HB2 MET A 118 -6.782 -7.494 2.140 1.00 0.83 H new ATOM 0 HB3 MET A 118 -5.036 -7.519 1.992 1.00 0.83 H new ATOM 0 HG2 MET A 118 -5.784 -9.752 1.647 1.00 1.15 H new ATOM 0 HG3 MET A 118 -5.020 -9.716 3.224 1.00 1.15 H new ATOM 0 HE1 MET A 118 -8.025 -12.334 3.301 1.00 3.10 H new ATOM 0 HE2 MET A 118 -6.602 -11.998 2.286 1.00 3.10 H new ATOM 0 HE3 MET A 118 -6.425 -12.125 4.052 1.00 3.10 H new ATOM 1849 N LYS A 119 -7.881 -7.633 5.017 1.00 0.80 N ATOM 1850 CA LYS A 119 -9.192 -7.319 5.559 1.00 0.95 C ATOM 1851 C LYS A 119 -9.046 -6.293 6.669 1.00 0.99 C ATOM 1852 O LYS A 119 -10.009 -5.641 7.075 1.00 1.24 O ATOM 1853 CB LYS A 119 -9.843 -8.588 6.108 1.00 1.15 C ATOM 1854 CG LYS A 119 -8.959 -9.344 7.089 1.00 1.30 C ATOM 1855 CD LYS A 119 -9.660 -10.570 7.657 1.00 1.70 C ATOM 1856 CE LYS A 119 -10.067 -11.546 6.563 1.00 2.06 C ATOM 1857 NZ LYS A 119 -8.895 -12.025 5.780 1.00 2.67 N ATOM 0 H LYS A 119 -7.625 -8.618 5.083 1.00 0.80 H new ATOM 0 HA LYS A 119 -9.822 -6.911 4.769 1.00 0.95 H new ATOM 0 HB2 LYS A 119 -10.778 -8.323 6.602 1.00 1.15 H new ATOM 0 HB3 LYS A 119 -10.097 -9.246 5.277 1.00 1.15 H new ATOM 0 HG2 LYS A 119 -8.041 -9.650 6.588 1.00 1.30 H new ATOM 0 HG3 LYS A 119 -8.671 -8.680 7.904 1.00 1.30 H new ATOM 0 HD2 LYS A 119 -8.999 -11.072 8.364 1.00 1.70 H new ATOM 0 HD3 LYS A 119 -10.544 -10.258 8.213 1.00 1.70 H new ATOM 0 HE2 LYS A 119 -10.578 -12.399 7.010 1.00 2.06 H new ATOM 0 HE3 LYS A 119 -10.778 -11.064 5.893 1.00 2.06 H new ATOM 0 HZ1 LYS A 119 -9.198 -12.774 5.126 1.00 2.67 H new ATOM 0 HZ2 LYS A 119 -8.493 -11.234 5.238 1.00 2.67 H new ATOM 0 HZ3 LYS A 119 -8.175 -12.402 6.429 1.00 2.67 H new ATOM 1871 N ASN A 120 -7.817 -6.167 7.147 1.00 0.90 N ATOM 1872 CA ASN A 120 -7.487 -5.233 8.209 1.00 1.04 C ATOM 1873 C ASN A 120 -6.892 -3.954 7.638 1.00 1.08 C ATOM 1874 O ASN A 120 -6.155 -3.244 8.322 1.00 1.35 O ATOM 1875 CB ASN A 120 -6.488 -5.878 9.170 1.00 1.08 C ATOM 1876 CG ASN A 120 -7.103 -6.996 9.986 1.00 1.41 C ATOM 1877 OD1 ASN A 120 -8.058 -6.783 10.733 1.00 1.77 O ATOM 1878 ND2 ASN A 120 -6.557 -8.200 9.849 1.00 1.84 N ATOM 0 H ASN A 120 -7.022 -6.710 6.809 1.00 0.90 H new ATOM 0 HA ASN A 120 -8.402 -4.981 8.744 1.00 1.04 H new ATOM 0 HB2 ASN A 120 -5.644 -6.270 8.602 1.00 1.08 H new ATOM 0 HB3 ASN A 120 -6.093 -5.117 9.843 1.00 1.08 H new ATOM 0 HD21 ASN A 120 -6.929 -8.991 10.374 1.00 1.84 H new ATOM 0 HD22 ASN A 120 -5.766 -8.333 9.219 1.00 1.84 H new ATOM 1885 N ARG A 121 -7.206 -3.666 6.378 1.00 0.93 N ATOM 1886 CA ARG A 121 -6.683 -2.473 5.725 1.00 1.06 C ATOM 1887 C ARG A 121 -7.641 -1.920 4.679 1.00 0.84 C ATOM 1888 O ARG A 121 -7.296 -1.844 3.499 1.00 0.87 O ATOM 1889 CB ARG A 121 -5.340 -2.767 5.055 1.00 1.31 C ATOM 1890 CG ARG A 121 -4.253 -3.229 6.008 1.00 1.14 C ATOM 1891 CD ARG A 121 -2.926 -3.366 5.286 1.00 1.39 C ATOM 1892 NE ARG A 121 -1.908 -3.998 6.123 1.00 1.56 N ATOM 1893 CZ ARG A 121 -0.664 -4.238 5.720 1.00 1.73 C ATOM 1894 NH1 ARG A 121 -0.283 -3.899 4.496 1.00 2.29 N ATOM 1895 NH2 ARG A 121 0.200 -4.818 6.541 1.00 2.04 N ATOM 0 H ARG A 121 -7.815 -4.238 5.794 1.00 0.93 H new ATOM 0 HA ARG A 121 -6.556 -1.725 6.507 1.00 1.06 H new ATOM 0 HB2 ARG A 121 -5.488 -3.532 4.293 1.00 1.31 H new ATOM 0 HB3 ARG A 121 -4.999 -1.868 4.542 1.00 1.31 H new ATOM 0 HG2 ARG A 121 -4.155 -2.517 6.827 1.00 1.14 H new ATOM 0 HG3 ARG A 121 -4.533 -4.186 6.449 1.00 1.14 H new ATOM 0 HD2 ARG A 121 -3.066 -3.955 4.379 1.00 1.39 H new ATOM 0 HD3 ARG A 121 -2.579 -2.380 4.976 1.00 1.39 H new ATOM 0 HE ARG A 121 -2.167 -4.271 7.071 1.00 1.56 H new ATOM 0 HH11 ARG A 121 -0.945 -3.453 3.861 1.00 2.29 H new ATOM 0 HH12 ARG A 121 0.672 -4.084 4.189 1.00 2.29 H new ATOM 0 HH21 ARG A 121 -0.089 -5.081 7.483 1.00 2.04 H new ATOM 0 HH22 ARG A 121 1.154 -5.002 6.231 1.00 2.04 H new ATOM 1909 N GLY A 122 -8.825 -1.493 5.107 1.00 0.73 N ATOM 1910 CA GLY A 122 -9.764 -0.909 4.168 1.00 0.60 C ATOM 1911 C GLY A 122 -9.154 0.308 3.521 1.00 0.57 C ATOM 1912 O GLY A 122 -9.620 0.783 2.486 1.00 0.59 O ATOM 0 H GLY A 122 -9.148 -1.540 6.074 1.00 0.73 H new ATOM 0 HA2 GLY A 122 -10.032 -1.641 3.406 1.00 0.60 H new ATOM 0 HA3 GLY A 122 -10.684 -0.634 4.684 1.00 0.60 H new ATOM 1916 N PHE A 123 -8.077 0.789 4.133 1.00 0.65 N ATOM 1917 CA PHE A 123 -7.351 1.931 3.625 1.00 0.72 C ATOM 1918 C PHE A 123 -6.279 1.467 2.645 1.00 0.80 C ATOM 1919 O PHE A 123 -5.278 2.149 2.427 1.00 1.14 O ATOM 1920 CB PHE A 123 -6.742 2.741 4.775 1.00 0.84 C ATOM 1921 CG PHE A 123 -5.992 1.915 5.785 1.00 0.95 C ATOM 1922 CD1 PHE A 123 -4.816 1.268 5.445 1.00 1.47 C ATOM 1923 CD2 PHE A 123 -6.470 1.791 7.080 1.00 1.10 C ATOM 1924 CE1 PHE A 123 -4.129 0.512 6.376 1.00 2.04 C ATOM 1925 CE2 PHE A 123 -5.788 1.036 8.017 1.00 1.49 C ATOM 1926 CZ PHE A 123 -4.615 0.398 7.664 1.00 1.98 C ATOM 0 H PHE A 123 -7.690 0.395 4.991 1.00 0.65 H new ATOM 0 HA PHE A 123 -8.043 2.585 3.094 1.00 0.72 H new ATOM 0 HB2 PHE A 123 -6.066 3.488 4.359 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -7.539 3.282 5.285 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -4.431 1.355 4.440 1.00 1.47 H new ATOM 0 HD2 PHE A 123 -7.386 2.290 7.361 1.00 1.10 H new ATOM 0 HE1 PHE A 123 -3.214 0.011 6.097 1.00 2.04 H new ATOM 0 HE2 PHE A 123 -6.172 0.946 9.022 1.00 1.49 H new ATOM 0 HZ PHE A 123 -4.078 -0.189 8.394 1.00 1.98 H new ATOM 1936 N MET A 124 -6.516 0.300 2.047 1.00 0.62 N ATOM 1937 CA MET A 124 -5.601 -0.277 1.071 1.00 0.68 C ATOM 1938 C MET A 124 -6.372 -1.089 0.029 1.00 0.64 C ATOM 1939 O MET A 124 -6.024 -1.096 -1.157 1.00 0.68 O ATOM 1940 CB MET A 124 -4.579 -1.185 1.762 1.00 0.80 C ATOM 1941 CG MET A 124 -3.696 -0.469 2.769 1.00 1.00 C ATOM 1942 SD MET A 124 -2.675 0.814 2.016 1.00 1.91 S ATOM 1943 CE MET A 124 -1.810 1.442 3.453 1.00 2.23 C ATOM 0 H MET A 124 -7.344 -0.267 2.226 1.00 0.62 H new ATOM 0 HA MET A 124 -5.078 0.541 0.576 1.00 0.68 H new ATOM 0 HB2 MET A 124 -5.109 -1.992 2.268 1.00 0.80 H new ATOM 0 HB3 MET A 124 -3.947 -1.646 1.003 1.00 0.80 H new ATOM 0 HG2 MET A 124 -4.322 -0.022 3.541 1.00 1.00 H new ATOM 0 HG3 MET A 124 -3.052 -1.197 3.263 1.00 1.00 H new ATOM 0 HE1 MET A 124 -0.776 1.663 3.188 1.00 2.23 H new ATOM 0 HE2 MET A 124 -2.297 2.352 3.802 1.00 2.23 H new ATOM 0 HE3 MET A 124 -1.830 0.694 4.245 1.00 2.23 H new ATOM 1953 N LEU A 125 -7.416 -1.780 0.483 1.00 0.61 N ATOM 1954 CA LEU A 125 -8.226 -2.610 -0.385 1.00 0.62 C ATOM 1955 C LEU A 125 -9.293 -1.804 -1.114 1.00 0.56 C ATOM 1956 O LEU A 125 -9.560 -2.035 -2.291 1.00 0.63 O ATOM 1957 CB LEU A 125 -8.847 -3.735 0.439 1.00 0.67 C ATOM 1958 CG LEU A 125 -7.844 -4.716 1.045 1.00 0.77 C ATOM 1959 CD1 LEU A 125 -8.566 -5.821 1.796 1.00 1.24 C ATOM 1960 CD2 LEU A 125 -6.949 -5.302 -0.034 1.00 1.16 C ATOM 0 H LEU A 125 -7.717 -1.776 1.458 1.00 0.61 H new ATOM 0 HA LEU A 125 -7.585 -3.037 -1.157 1.00 0.62 H new ATOM 0 HB2 LEU A 125 -9.435 -3.294 1.244 1.00 0.67 H new ATOM 0 HB3 LEU A 125 -9.539 -4.290 -0.194 1.00 0.67 H new ATOM 0 HG LEU A 125 -7.217 -4.172 1.752 1.00 0.77 H new ATOM 0 HD11 LEU A 125 -7.836 -6.510 2.220 1.00 1.24 H new ATOM 0 HD12 LEU A 125 -9.163 -5.386 2.597 1.00 1.24 H new ATOM 0 HD13 LEU A 125 -9.218 -6.361 1.110 1.00 1.24 H new ATOM 0 HD21 LEU A 125 -6.242 -5.998 0.418 1.00 1.16 H new ATOM 0 HD22 LEU A 125 -7.560 -5.830 -0.766 1.00 1.16 H new ATOM 0 HD23 LEU A 125 -6.402 -4.499 -0.529 1.00 1.16 H new ATOM 1972 N TRP A 126 -9.889 -0.848 -0.417 1.00 0.48 N ATOM 1973 CA TRP A 126 -10.915 0.005 -1.007 1.00 0.48 C ATOM 1974 C TRP A 126 -10.335 0.823 -2.163 1.00 0.47 C ATOM 1975 O TRP A 126 -10.896 0.838 -3.258 1.00 0.48 O ATOM 1976 CB TRP A 126 -11.525 0.913 0.068 1.00 0.52 C ATOM 1977 CG TRP A 126 -12.181 2.148 -0.469 1.00 0.80 C ATOM 1978 CD1 TRP A 126 -11.997 3.415 -0.011 1.00 1.33 C ATOM 1979 CD2 TRP A 126 -13.122 2.241 -1.546 1.00 1.45 C ATOM 1980 NE1 TRP A 126 -12.753 4.298 -0.741 1.00 1.82 N ATOM 1981 CE2 TRP A 126 -13.455 3.601 -1.691 1.00 1.88 C ATOM 1982 CE3 TRP A 126 -13.711 1.308 -2.407 1.00 2.11 C ATOM 1983 CZ2 TRP A 126 -14.349 4.050 -2.660 1.00 2.60 C ATOM 1984 CZ3 TRP A 126 -14.599 1.755 -3.367 1.00 2.88 C ATOM 1985 CH2 TRP A 126 -14.911 3.117 -3.487 1.00 3.03 C ATOM 0 H TRP A 126 -9.681 -0.642 0.560 1.00 0.48 H new ATOM 0 HA TRP A 126 -11.708 -0.623 -1.413 1.00 0.48 H new ATOM 0 HB2 TRP A 126 -12.260 0.342 0.635 1.00 0.52 H new ATOM 0 HB3 TRP A 126 -10.742 1.206 0.767 1.00 0.52 H new ATOM 0 HD1 TRP A 126 -11.349 3.687 0.809 1.00 1.33 H new ATOM 0 HE1 TRP A 126 -12.787 5.308 -0.600 1.00 1.82 H new ATOM 0 HE3 TRP A 126 -13.476 0.257 -2.323 1.00 2.11 H new ATOM 0 HZ2 TRP A 126 -14.590 5.098 -2.755 1.00 2.60 H new ATOM 0 HZ3 TRP A 126 -15.060 1.044 -4.036 1.00 2.88 H new ATOM 0 HH2 TRP A 126 -15.609 3.435 -4.247 1.00 3.03 H new ATOM 1996 N PRO A 127 -9.191 1.499 -1.956 1.00 0.50 N ATOM 1997 CA PRO A 127 -8.544 2.287 -3.010 1.00 0.54 C ATOM 1998 C PRO A 127 -8.247 1.432 -4.229 1.00 0.53 C ATOM 1999 O PRO A 127 -8.625 1.770 -5.351 1.00 0.56 O ATOM 2000 CB PRO A 127 -7.234 2.753 -2.365 1.00 0.61 C ATOM 2001 CG PRO A 127 -7.037 1.828 -1.218 1.00 0.61 C ATOM 2002 CD PRO A 127 -8.416 1.545 -0.710 1.00 0.55 C ATOM 0 HA PRO A 127 -9.172 3.108 -3.357 1.00 0.54 H new ATOM 0 HB2 PRO A 127 -6.403 2.697 -3.068 1.00 0.61 H new ATOM 0 HB3 PRO A 127 -7.301 3.789 -2.033 1.00 0.61 H new ATOM 0 HG2 PRO A 127 -6.536 0.912 -1.531 1.00 0.61 H new ATOM 0 HG3 PRO A 127 -6.417 2.283 -0.446 1.00 0.61 H new ATOM 0 HD2 PRO A 127 -8.465 0.604 -0.163 1.00 0.55 H new ATOM 0 HD3 PRO A 127 -8.771 2.324 -0.036 1.00 0.55 H new ATOM 2010 N LEU A 128 -7.577 0.306 -3.993 1.00 0.53 N ATOM 2011 CA LEU A 128 -7.241 -0.618 -5.063 1.00 0.56 C ATOM 2012 C LEU A 128 -8.515 -1.190 -5.653 1.00 0.54 C ATOM 2013 O LEU A 128 -8.540 -1.632 -6.800 1.00 0.61 O ATOM 2014 CB LEU A 128 -6.356 -1.740 -4.521 1.00 0.63 C ATOM 2015 CG LEU A 128 -5.791 -2.704 -5.573 1.00 0.79 C ATOM 2016 CD1 LEU A 128 -5.020 -1.944 -6.641 1.00 1.42 C ATOM 2017 CD2 LEU A 128 -4.897 -3.735 -4.904 1.00 1.55 C ATOM 0 H LEU A 128 -7.258 0.015 -3.069 1.00 0.53 H new ATOM 0 HA LEU A 128 -6.693 -0.089 -5.843 1.00 0.56 H new ATOM 0 HB2 LEU A 128 -5.523 -1.292 -3.980 1.00 0.63 H new ATOM 0 HB3 LEU A 128 -6.933 -2.317 -3.798 1.00 0.63 H new ATOM 0 HG LEU A 128 -6.622 -3.218 -6.057 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -4.628 -2.647 -7.376 1.00 1.42 H new ATOM 0 HD12 LEU A 128 -5.685 -1.235 -7.135 1.00 1.42 H new ATOM 0 HD13 LEU A 128 -4.193 -1.405 -6.179 1.00 1.42 H new ATOM 0 HD21 LEU A 128 -4.500 -4.416 -5.657 1.00 1.55 H new ATOM 0 HD22 LEU A 128 -4.073 -3.230 -4.401 1.00 1.55 H new ATOM 0 HD23 LEU A 128 -5.476 -4.300 -4.174 1.00 1.55 H new ATOM 2029 N PHE A 129 -9.580 -1.165 -4.855 1.00 0.50 N ATOM 2030 CA PHE A 129 -10.869 -1.666 -5.297 1.00 0.51 C ATOM 2031 C PHE A 129 -11.384 -0.762 -6.404 1.00 0.53 C ATOM 2032 O PHE A 129 -12.065 -1.207 -7.321 1.00 0.70 O ATOM 2033 CB PHE A 129 -11.855 -1.719 -4.128 1.00 0.49 C ATOM 2034 CG PHE A 129 -13.115 -2.482 -4.420 1.00 0.54 C ATOM 2035 CD1 PHE A 129 -14.180 -1.867 -5.062 1.00 0.62 C ATOM 2036 CD2 PHE A 129 -13.238 -3.812 -4.048 1.00 0.60 C ATOM 2037 CE1 PHE A 129 -15.340 -2.567 -5.329 1.00 0.73 C ATOM 2038 CE2 PHE A 129 -14.397 -4.514 -4.314 1.00 0.71 C ATOM 2039 CZ PHE A 129 -15.446 -3.896 -4.963 1.00 0.75 C ATOM 0 H PHE A 129 -9.571 -0.803 -3.901 1.00 0.50 H new ATOM 0 HA PHE A 129 -10.762 -2.682 -5.678 1.00 0.51 H new ATOM 0 HB2 PHE A 129 -11.360 -2.173 -3.270 1.00 0.49 H new ATOM 0 HB3 PHE A 129 -12.118 -0.700 -3.843 1.00 0.49 H new ATOM 0 HD1 PHE A 129 -14.101 -0.831 -5.356 1.00 0.62 H new ATOM 0 HD2 PHE A 129 -12.419 -4.304 -3.545 1.00 0.60 H new ATOM 0 HE1 PHE A 129 -16.165 -2.076 -5.824 1.00 0.73 H new ATOM 0 HE2 PHE A 129 -14.482 -5.548 -4.014 1.00 0.71 H new ATOM 0 HZ PHE A 129 -16.347 -4.449 -5.184 1.00 0.75 H new ATOM 2049 N GLU A 130 -11.006 0.511 -6.330 1.00 0.43 N ATOM 2050 CA GLU A 130 -11.386 1.477 -7.349 1.00 0.49 C ATOM 2051 C GLU A 130 -10.539 1.227 -8.589 1.00 0.53 C ATOM 2052 O GLU A 130 -11.040 1.231 -9.713 1.00 0.68 O ATOM 2053 CB GLU A 130 -11.183 2.907 -6.841 1.00 0.54 C ATOM 2054 CG GLU A 130 -11.577 3.974 -7.850 1.00 0.99 C ATOM 2055 CD GLU A 130 -13.041 3.902 -8.237 1.00 1.63 C ATOM 2056 OE1 GLU A 130 -13.899 4.037 -7.341 1.00 2.40 O ATOM 2057 OE2 GLU A 130 -13.328 3.710 -9.436 1.00 2.04 O ATOM 0 H GLU A 130 -10.438 0.895 -5.575 1.00 0.43 H new ATOM 0 HA GLU A 130 -12.442 1.360 -7.591 1.00 0.49 H new ATOM 0 HB2 GLU A 130 -11.767 3.046 -5.931 1.00 0.54 H new ATOM 0 HB3 GLU A 130 -10.135 3.043 -6.572 1.00 0.54 H new ATOM 0 HG2 GLU A 130 -11.364 4.958 -7.433 1.00 0.99 H new ATOM 0 HG3 GLU A 130 -10.963 3.867 -8.744 1.00 0.99 H new ATOM 2064 N ILE A 131 -9.249 0.982 -8.359 1.00 0.48 N ATOM 2065 CA ILE A 131 -8.314 0.690 -9.433 1.00 0.56 C ATOM 2066 C ILE A 131 -8.818 -0.483 -10.266 1.00 0.52 C ATOM 2067 O ILE A 131 -8.883 -0.411 -11.493 1.00 0.64 O ATOM 2068 CB ILE A 131 -6.926 0.324 -8.870 1.00 0.77 C ATOM 2069 CG1 ILE A 131 -6.384 1.452 -7.988 1.00 0.77 C ATOM 2070 CG2 ILE A 131 -5.959 0.010 -10.000 1.00 1.55 C ATOM 2071 CD1 ILE A 131 -6.178 2.760 -8.723 1.00 1.41 C ATOM 0 H ILE A 131 -8.830 0.981 -7.429 1.00 0.48 H new ATOM 0 HA ILE A 131 -8.232 1.584 -10.051 1.00 0.56 H new ATOM 0 HB ILE A 131 -7.031 -0.567 -8.252 1.00 0.77 H new ATOM 0 HG12 ILE A 131 -7.074 1.616 -7.160 1.00 0.77 H new ATOM 0 HG13 ILE A 131 -5.435 1.137 -7.554 1.00 0.77 H new ATOM 0 HG21 ILE A 131 -4.984 -0.246 -9.584 1.00 1.55 H new ATOM 0 HG22 ILE A 131 -6.338 -0.831 -10.580 1.00 1.55 H new ATOM 0 HG23 ILE A 131 -5.860 0.882 -10.647 1.00 1.55 H new ATOM 0 HD11 ILE A 131 -5.793 3.509 -8.031 1.00 1.41 H new ATOM 0 HD12 ILE A 131 -5.464 2.613 -9.534 1.00 1.41 H new ATOM 0 HD13 ILE A 131 -7.129 3.100 -9.134 1.00 1.41 H new ATOM 2083 N ALA A 132 -9.173 -1.564 -9.576 1.00 0.53 N ATOM 2084 CA ALA A 132 -9.675 -2.768 -10.227 1.00 0.58 C ATOM 2085 C ALA A 132 -10.636 -3.528 -9.313 1.00 0.56 C ATOM 2086 O ALA A 132 -10.233 -4.454 -8.608 1.00 0.63 O ATOM 2087 CB ALA A 132 -8.515 -3.664 -10.640 1.00 0.73 C ATOM 0 H ALA A 132 -9.121 -1.629 -8.559 1.00 0.53 H new ATOM 0 HA ALA A 132 -10.226 -2.468 -11.119 1.00 0.58 H new ATOM 0 HB1 ALA A 132 -8.902 -4.560 -11.125 1.00 0.73 H new ATOM 0 HB2 ALA A 132 -7.869 -3.126 -11.334 1.00 0.73 H new ATOM 0 HB3 ALA A 132 -7.942 -3.948 -9.757 1.00 0.73 H new ATOM 2093 N PRO A 133 -11.929 -3.150 -9.322 1.00 0.63 N ATOM 2094 CA PRO A 133 -12.956 -3.803 -8.502 1.00 0.66 C ATOM 2095 C PRO A 133 -13.408 -5.120 -9.119 1.00 0.88 C ATOM 2096 O PRO A 133 -14.604 -5.405 -9.191 1.00 1.24 O ATOM 2097 CB PRO A 133 -14.104 -2.795 -8.523 1.00 0.79 C ATOM 2098 CG PRO A 133 -13.967 -2.097 -9.832 1.00 0.82 C ATOM 2099 CD PRO A 133 -12.492 -2.061 -10.144 1.00 0.81 C ATOM 0 HA PRO A 133 -12.600 -4.049 -7.502 1.00 0.66 H new ATOM 0 HB2 PRO A 133 -15.070 -3.293 -8.438 1.00 0.79 H new ATOM 0 HB3 PRO A 133 -14.032 -2.095 -7.691 1.00 0.79 H new ATOM 0 HG2 PRO A 133 -14.516 -2.624 -10.612 1.00 0.82 H new ATOM 0 HG3 PRO A 133 -14.377 -1.089 -9.779 1.00 0.82 H new ATOM 0 HD2 PRO A 133 -12.304 -2.223 -11.205 1.00 0.81 H new ATOM 0 HD3 PRO A 133 -12.052 -1.097 -9.886 1.00 0.81 H new ATOM 2107 N GLU A 134 -12.447 -5.912 -9.579 1.00 0.90 N ATOM 2108 CA GLU A 134 -12.750 -7.187 -10.207 1.00 1.12 C ATOM 2109 C GLU A 134 -11.749 -8.261 -9.804 1.00 1.08 C ATOM 2110 O GLU A 134 -11.988 -9.449 -10.025 1.00 1.25 O ATOM 2111 CB GLU A 134 -12.781 -7.034 -11.731 1.00 1.34 C ATOM 2112 CG GLU A 134 -11.519 -6.416 -12.322 1.00 1.87 C ATOM 2113 CD GLU A 134 -10.301 -7.309 -12.188 1.00 2.20 C ATOM 2114 OE1 GLU A 134 -10.329 -8.436 -12.723 1.00 2.50 O ATOM 2115 OE2 GLU A 134 -9.319 -6.879 -11.547 1.00 2.61 O ATOM 0 H GLU A 134 -11.452 -5.692 -9.528 1.00 0.90 H new ATOM 0 HA GLU A 134 -13.734 -7.503 -9.860 1.00 1.12 H new ATOM 0 HB2 GLU A 134 -12.937 -8.015 -12.180 1.00 1.34 H new ATOM 0 HB3 GLU A 134 -13.637 -6.418 -12.006 1.00 1.34 H new ATOM 0 HG2 GLU A 134 -11.688 -6.198 -13.376 1.00 1.87 H new ATOM 0 HG3 GLU A 134 -11.321 -5.465 -11.827 1.00 1.87 H new ATOM 2122 N LEU A 135 -10.628 -7.850 -9.210 1.00 0.99 N ATOM 2123 CA LEU A 135 -9.624 -8.813 -8.789 1.00 1.03 C ATOM 2124 C LEU A 135 -10.228 -9.759 -7.757 1.00 1.50 C ATOM 2125 O LEU A 135 -10.545 -9.363 -6.639 1.00 2.32 O ATOM 2126 CB LEU A 135 -8.377 -8.100 -8.242 1.00 1.00 C ATOM 2127 CG LEU A 135 -8.566 -7.305 -6.949 1.00 1.43 C ATOM 2128 CD1 LEU A 135 -8.170 -8.143 -5.741 1.00 2.07 C ATOM 2129 CD2 LEU A 135 -7.759 -6.017 -7.002 1.00 2.26 C ATOM 0 H LEU A 135 -10.400 -6.875 -9.015 1.00 0.99 H new ATOM 0 HA LEU A 135 -9.305 -9.400 -9.650 1.00 1.03 H new ATOM 0 HB2 LEU A 135 -7.601 -8.847 -8.074 1.00 1.00 H new ATOM 0 HB3 LEU A 135 -8.006 -7.422 -9.010 1.00 1.00 H new ATOM 0 HG LEU A 135 -9.620 -7.048 -6.849 1.00 1.43 H new ATOM 0 HD11 LEU A 135 -8.312 -7.560 -4.831 1.00 2.07 H new ATOM 0 HD12 LEU A 135 -8.792 -9.037 -5.699 1.00 2.07 H new ATOM 0 HD13 LEU A 135 -7.123 -8.433 -5.827 1.00 2.07 H new ATOM 0 HD21 LEU A 135 -7.902 -5.460 -6.076 1.00 2.26 H new ATOM 0 HD22 LEU A 135 -6.702 -6.255 -7.123 1.00 2.26 H new ATOM 0 HD23 LEU A 135 -8.094 -5.412 -7.845 1.00 2.26 H new ATOM 2141 N VAL A 136 -10.425 -11.005 -8.158 1.00 1.65 N ATOM 2142 CA VAL A 136 -11.024 -12.000 -7.283 1.00 2.11 C ATOM 2143 C VAL A 136 -10.273 -13.319 -7.355 1.00 1.98 C ATOM 2144 O VAL A 136 -10.432 -14.082 -8.308 1.00 2.82 O ATOM 2145 CB VAL A 136 -12.498 -12.251 -7.650 1.00 2.85 C ATOM 2146 CG1 VAL A 136 -13.092 -13.342 -6.769 1.00 3.55 C ATOM 2147 CG2 VAL A 136 -13.307 -10.971 -7.541 1.00 3.66 C ATOM 0 H VAL A 136 -10.178 -11.352 -9.085 1.00 1.65 H new ATOM 0 HA VAL A 136 -10.965 -11.604 -6.269 1.00 2.11 H new ATOM 0 HB VAL A 136 -12.538 -12.589 -8.686 1.00 2.85 H new ATOM 0 HG11 VAL A 136 -14.134 -13.505 -7.044 1.00 3.55 H new ATOM 0 HG12 VAL A 136 -12.532 -14.267 -6.907 1.00 3.55 H new ATOM 0 HG13 VAL A 136 -13.036 -13.037 -5.724 1.00 3.55 H new ATOM 0 HG21 VAL A 136 -14.345 -11.173 -7.805 1.00 3.66 H new ATOM 0 HG22 VAL A 136 -13.259 -10.596 -6.519 1.00 3.66 H new ATOM 0 HG23 VAL A 136 -12.899 -10.223 -8.221 1.00 3.66 H new ATOM 2157 N PHE A 137 -9.464 -13.584 -6.339 1.00 1.34 N ATOM 2158 CA PHE A 137 -8.695 -14.823 -6.282 1.00 1.66 C ATOM 2159 C PHE A 137 -7.866 -14.914 -5.009 1.00 1.18 C ATOM 2160 O PHE A 137 -7.895 -15.937 -4.333 1.00 1.57 O ATOM 2161 CB PHE A 137 -7.784 -14.964 -7.496 1.00 2.23 C ATOM 2162 CG PHE A 137 -7.111 -16.305 -7.587 1.00 3.15 C ATOM 2163 CD1 PHE A 137 -7.856 -17.459 -7.772 1.00 3.49 C ATOM 2164 CD2 PHE A 137 -5.733 -16.411 -7.496 1.00 3.88 C ATOM 2165 CE1 PHE A 137 -7.239 -18.693 -7.860 1.00 4.44 C ATOM 2166 CE2 PHE A 137 -5.111 -17.641 -7.584 1.00 4.85 C ATOM 2167 CZ PHE A 137 -5.864 -18.783 -7.766 1.00 5.09 C ATOM 0 H PHE A 137 -9.322 -12.961 -5.544 1.00 1.34 H new ATOM 0 HA PHE A 137 -9.417 -15.640 -6.283 1.00 1.66 H new ATOM 0 HB2 PHE A 137 -8.369 -14.798 -8.401 1.00 2.23 H new ATOM 0 HB3 PHE A 137 -7.022 -14.185 -7.461 1.00 2.23 H new ATOM 0 HD1 PHE A 137 -8.931 -17.393 -7.848 1.00 3.49 H new ATOM 0 HD2 PHE A 137 -5.138 -15.521 -7.355 1.00 3.88 H new ATOM 0 HE1 PHE A 137 -7.831 -19.585 -8.002 1.00 4.44 H new ATOM 0 HE2 PHE A 137 -4.036 -17.709 -7.510 1.00 4.85 H new ATOM 0 HZ PHE A 137 -5.379 -19.745 -7.835 1.00 5.09 H new ATOM 2177 N PRO A 138 -7.108 -13.851 -4.656 1.00 0.88 N ATOM 2178 CA PRO A 138 -6.288 -13.858 -3.445 1.00 0.92 C ATOM 2179 C PRO A 138 -7.157 -13.997 -2.198 1.00 1.20 C ATOM 2180 O PRO A 138 -7.437 -13.009 -1.519 1.00 1.94 O ATOM 2181 CB PRO A 138 -5.584 -12.496 -3.471 1.00 1.24 C ATOM 2182 CG PRO A 138 -6.435 -11.646 -4.347 1.00 1.68 C ATOM 2183 CD PRO A 138 -6.985 -12.577 -5.388 1.00 1.44 C ATOM 0 HA PRO A 138 -5.589 -14.694 -3.416 1.00 0.92 H new ATOM 0 HB2 PRO A 138 -5.502 -12.074 -2.469 1.00 1.24 H new ATOM 0 HB3 PRO A 138 -4.571 -12.581 -3.865 1.00 1.24 H new ATOM 0 HG2 PRO A 138 -7.236 -11.174 -3.779 1.00 1.68 H new ATOM 0 HG3 PRO A 138 -5.853 -10.845 -4.803 1.00 1.68 H new ATOM 0 HD2 PRO A 138 -7.947 -12.235 -5.769 1.00 1.44 H new ATOM 0 HD3 PRO A 138 -6.317 -12.666 -6.245 1.00 1.44 H new ATOM 2191 N ASP A 139 -7.600 -15.236 -1.942 1.00 1.07 N ATOM 2192 CA ASP A 139 -8.474 -15.579 -0.810 1.00 1.62 C ATOM 2193 C ASP A 139 -9.936 -15.581 -1.263 1.00 1.65 C ATOM 2194 O ASP A 139 -10.850 -15.353 -0.468 1.00 2.28 O ATOM 2195 CB ASP A 139 -8.279 -14.627 0.379 1.00 2.26 C ATOM 2196 CG ASP A 139 -8.975 -15.111 1.639 1.00 2.93 C ATOM 2197 OD1 ASP A 139 -9.555 -16.217 1.607 1.00 3.67 O ATOM 2198 OD2 ASP A 139 -8.946 -14.383 2.654 1.00 3.20 O ATOM 0 H ASP A 139 -7.358 -16.039 -2.523 1.00 1.07 H new ATOM 0 HA ASP A 139 -8.200 -16.577 -0.469 1.00 1.62 H new ATOM 0 HB2 ASP A 139 -7.213 -14.515 0.578 1.00 2.26 H new ATOM 0 HB3 ASP A 139 -8.660 -13.640 0.115 1.00 2.26 H new ATOM 2203 N GLY A 140 -10.139 -15.853 -2.551 1.00 1.25 N ATOM 2204 CA GLY A 140 -11.476 -15.900 -3.125 1.00 1.72 C ATOM 2205 C GLY A 140 -12.313 -14.687 -2.800 1.00 1.31 C ATOM 2206 O GLY A 140 -13.527 -14.791 -2.624 1.00 1.85 O ATOM 0 H GLY A 140 -9.390 -16.044 -3.216 1.00 1.25 H new ATOM 0 HA2 GLY A 140 -11.395 -15.996 -4.208 1.00 1.72 H new ATOM 0 HA3 GLY A 140 -11.987 -16.792 -2.763 1.00 1.72 H new ATOM 2210 N GLU A 141 -11.667 -13.533 -2.754 1.00 0.75 N ATOM 2211 CA GLU A 141 -12.350 -12.276 -2.481 1.00 0.94 C ATOM 2212 C GLU A 141 -11.532 -11.122 -3.003 1.00 0.82 C ATOM 2213 O GLU A 141 -10.301 -11.158 -2.965 1.00 1.19 O ATOM 2214 CB GLU A 141 -12.567 -12.047 -0.980 1.00 1.56 C ATOM 2215 CG GLU A 141 -13.289 -13.171 -0.261 1.00 1.38 C ATOM 2216 CD GLU A 141 -13.601 -12.834 1.183 1.00 2.16 C ATOM 2217 OE1 GLU A 141 -14.324 -11.843 1.418 1.00 2.97 O ATOM 2218 OE2 GLU A 141 -13.122 -13.561 2.079 1.00 2.47 O ATOM 0 H GLU A 141 -10.662 -13.440 -2.903 1.00 0.75 H new ATOM 0 HA GLU A 141 -13.319 -12.333 -2.977 1.00 0.94 H new ATOM 0 HB2 GLU A 141 -11.597 -11.896 -0.506 1.00 1.56 H new ATOM 0 HB3 GLU A 141 -13.134 -11.126 -0.846 1.00 1.56 H new ATOM 0 HG2 GLU A 141 -14.217 -13.396 -0.786 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -12.677 -14.072 -0.296 1.00 1.38 H new ATOM 2225 N MET A 142 -12.209 -10.081 -3.449 1.00 0.57 N ATOM 2226 CA MET A 142 -11.510 -8.901 -3.921 1.00 0.54 C ATOM 2227 C MET A 142 -10.785 -8.274 -2.755 1.00 0.58 C ATOM 2228 O MET A 142 -10.411 -8.944 -1.802 1.00 0.92 O ATOM 2229 CB MET A 142 -12.462 -7.860 -4.512 1.00 0.57 C ATOM 2230 CG MET A 142 -13.427 -8.412 -5.524 1.00 0.67 C ATOM 2231 SD MET A 142 -14.684 -7.227 -6.030 1.00 1.32 S ATOM 2232 CE MET A 142 -15.606 -8.197 -7.219 1.00 1.58 C ATOM 0 H MET A 142 -13.227 -10.027 -3.494 1.00 0.57 H new ATOM 0 HA MET A 142 -10.821 -9.213 -4.706 1.00 0.54 H new ATOM 0 HB2 MET A 142 -13.027 -7.399 -3.702 1.00 0.57 H new ATOM 0 HB3 MET A 142 -11.874 -7.071 -4.980 1.00 0.57 H new ATOM 0 HG2 MET A 142 -12.872 -8.740 -6.403 1.00 0.67 H new ATOM 0 HG3 MET A 142 -13.915 -9.293 -5.107 1.00 0.67 H new ATOM 0 HE1 MET A 142 -16.422 -7.598 -7.623 1.00 1.58 H new ATOM 0 HE2 MET A 142 -14.945 -8.503 -8.030 1.00 1.58 H new ATOM 0 HE3 MET A 142 -16.013 -9.081 -6.729 1.00 1.58 H new ATOM 2242 N LEU A 143 -10.618 -6.985 -2.834 1.00 0.55 N ATOM 2243 CA LEU A 143 -9.972 -6.232 -1.791 1.00 0.62 C ATOM 2244 C LEU A 143 -10.974 -5.816 -0.720 1.00 0.56 C ATOM 2245 O LEU A 143 -10.941 -6.279 0.417 1.00 0.60 O ATOM 2246 CB LEU A 143 -9.358 -4.998 -2.419 1.00 0.76 C ATOM 2247 CG LEU A 143 -8.642 -5.262 -3.728 1.00 0.81 C ATOM 2248 CD1 LEU A 143 -8.647 -4.021 -4.586 1.00 1.54 C ATOM 2249 CD2 LEU A 143 -7.221 -5.737 -3.482 1.00 1.70 C ATOM 0 H LEU A 143 -10.927 -6.422 -3.626 1.00 0.55 H new ATOM 0 HA LEU A 143 -9.208 -6.847 -1.315 1.00 0.62 H new ATOM 0 HB2 LEU A 143 -10.143 -4.261 -2.589 1.00 0.76 H new ATOM 0 HB3 LEU A 143 -8.653 -4.557 -1.714 1.00 0.76 H new ATOM 0 HG LEU A 143 -9.174 -6.053 -4.257 1.00 0.81 H new ATOM 0 HD11 LEU A 143 -8.129 -4.225 -5.523 1.00 1.54 H new ATOM 0 HD12 LEU A 143 -9.676 -3.728 -4.796 1.00 1.54 H new ATOM 0 HD13 LEU A 143 -8.140 -3.213 -4.060 1.00 1.54 H new ATOM 0 HD21 LEU A 143 -6.728 -5.920 -4.437 1.00 1.70 H new ATOM 0 HD22 LEU A 143 -6.672 -4.973 -2.931 1.00 1.70 H new ATOM 0 HD23 LEU A 143 -7.241 -6.659 -2.902 1.00 1.70 H new ATOM 2261 N ARG A 144 -11.823 -4.883 -1.113 1.00 0.53 N ATOM 2262 CA ARG A 144 -12.820 -4.288 -0.241 1.00 0.52 C ATOM 2263 C ARG A 144 -13.708 -5.265 0.527 1.00 0.61 C ATOM 2264 O ARG A 144 -13.723 -5.205 1.736 1.00 0.69 O ATOM 2265 CB ARG A 144 -13.670 -3.296 -1.014 1.00 0.53 C ATOM 2266 CG ARG A 144 -14.636 -2.521 -0.131 1.00 0.58 C ATOM 2267 CD ARG A 144 -15.492 -1.560 -0.940 1.00 0.85 C ATOM 2268 NE ARG A 144 -16.372 -2.261 -1.870 1.00 1.18 N ATOM 2269 CZ ARG A 144 -17.267 -1.652 -2.641 1.00 1.39 C ATOM 2270 NH1 ARG A 144 -17.401 -0.332 -2.595 1.00 1.59 N ATOM 2271 NH2 ARG A 144 -18.030 -2.363 -3.461 1.00 2.16 N ATOM 0 H ARG A 144 -11.839 -4.511 -2.063 1.00 0.53 H new ATOM 0 HA ARG A 144 -12.241 -3.784 0.532 1.00 0.52 H new ATOM 0 HB2 ARG A 144 -13.017 -2.593 -1.532 1.00 0.53 H new ATOM 0 HB3 ARG A 144 -14.235 -3.829 -1.779 1.00 0.53 H new ATOM 0 HG2 ARG A 144 -15.280 -3.219 0.404 1.00 0.58 H new ATOM 0 HG3 ARG A 144 -14.076 -1.965 0.620 1.00 0.58 H new ATOM 0 HD2 ARG A 144 -16.091 -0.951 -0.263 1.00 0.85 H new ATOM 0 HD3 ARG A 144 -14.847 -0.879 -1.495 1.00 0.85 H new ATOM 0 HE ARG A 144 -16.296 -3.276 -1.932 1.00 1.18 H new ATOM 0 HH11 ARG A 144 -16.816 0.218 -1.966 1.00 1.59 H new ATOM 0 HH12 ARG A 144 -18.089 0.132 -3.188 1.00 1.59 H new ATOM 0 HH21 ARG A 144 -17.930 -3.377 -3.500 1.00 2.16 H new ATOM 0 HH22 ARG A 144 -18.717 -1.895 -4.053 1.00 2.16 H new ATOM 2285 N GLN A 145 -14.478 -6.136 -0.124 1.00 0.76 N ATOM 2286 CA GLN A 145 -15.361 -7.028 0.657 1.00 0.92 C ATOM 2287 C GLN A 145 -14.626 -7.600 1.867 1.00 0.89 C ATOM 2288 O GLN A 145 -15.233 -7.753 2.924 1.00 0.97 O ATOM 2289 CB GLN A 145 -15.989 -8.164 -0.170 1.00 1.21 C ATOM 2290 CG GLN A 145 -14.969 -9.053 -0.821 1.00 0.96 C ATOM 2291 CD GLN A 145 -14.027 -8.212 -1.604 1.00 1.54 C ATOM 2292 OE1 GLN A 145 -14.381 -7.701 -2.660 1.00 2.27 O ATOM 2293 NE2 GLN A 145 -12.859 -7.993 -1.037 1.00 1.87 N ATOM 0 H GLN A 145 -14.517 -6.249 -1.137 1.00 0.76 H new ATOM 0 HA GLN A 145 -16.187 -6.401 0.993 1.00 0.92 H new ATOM 0 HB2 GLN A 145 -16.627 -8.766 0.477 1.00 1.21 H new ATOM 0 HB3 GLN A 145 -16.631 -7.734 -0.939 1.00 1.21 H new ATOM 0 HG2 GLN A 145 -14.427 -9.622 -0.065 1.00 0.96 H new ATOM 0 HG3 GLN A 145 -15.460 -9.776 -1.473 1.00 0.96 H new ATOM 0 HE21 GLN A 145 -12.626 -8.451 -0.156 1.00 1.87 H new ATOM 0 HE22 GLN A 145 -12.187 -7.365 -1.479 1.00 1.87 H new ATOM 2302 N ILE A 146 -13.315 -7.880 1.749 1.00 0.85 N ATOM 2303 CA ILE A 146 -12.583 -8.390 2.906 1.00 0.90 C ATOM 2304 C ILE A 146 -12.440 -7.283 3.953 1.00 0.85 C ATOM 2305 O ILE A 146 -12.554 -7.532 5.153 1.00 1.01 O ATOM 2306 CB ILE A 146 -11.168 -8.911 2.572 1.00 0.95 C ATOM 2307 CG1 ILE A 146 -11.011 -9.226 1.090 1.00 1.06 C ATOM 2308 CG2 ILE A 146 -10.876 -10.158 3.394 1.00 1.24 C ATOM 2309 CD1 ILE A 146 -9.591 -9.600 0.722 1.00 1.06 C ATOM 0 H ILE A 146 -12.765 -7.766 0.898 1.00 0.85 H new ATOM 0 HA ILE A 146 -13.166 -9.233 3.277 1.00 0.90 H new ATOM 0 HB ILE A 146 -10.457 -8.123 2.820 1.00 0.95 H new ATOM 0 HG12 ILE A 146 -11.679 -10.045 0.824 1.00 1.06 H new ATOM 0 HG13 ILE A 146 -11.318 -8.360 0.504 1.00 1.06 H new ATOM 0 HG21 ILE A 146 -9.877 -10.524 3.157 1.00 1.24 H new ATOM 0 HG22 ILE A 146 -10.931 -9.915 4.455 1.00 1.24 H new ATOM 0 HG23 ILE A 146 -11.610 -10.929 3.159 1.00 1.24 H new ATOM 0 HD11 ILE A 146 -9.536 -9.814 -0.345 1.00 1.06 H new ATOM 0 HD12 ILE A 146 -8.923 -8.772 0.961 1.00 1.06 H new ATOM 0 HD13 ILE A 146 -9.290 -10.483 1.285 1.00 1.06 H new ATOM 2321 N LEU A 147 -12.192 -6.053 3.485 1.00 0.72 N ATOM 2322 CA LEU A 147 -12.038 -4.904 4.382 1.00 0.75 C ATOM 2323 C LEU A 147 -13.407 -4.431 4.870 1.00 0.71 C ATOM 2324 O LEU A 147 -13.637 -4.261 6.063 1.00 0.81 O ATOM 2325 CB LEU A 147 -11.298 -3.762 3.659 1.00 0.92 C ATOM 2326 CG LEU A 147 -12.153 -2.860 2.752 1.00 0.82 C ATOM 2327 CD1 LEU A 147 -12.861 -1.782 3.551 1.00 1.36 C ATOM 2328 CD2 LEU A 147 -11.307 -2.212 1.678 1.00 1.66 C ATOM 0 H LEU A 147 -12.094 -5.830 2.494 1.00 0.72 H new ATOM 0 HA LEU A 147 -11.447 -5.207 5.247 1.00 0.75 H new ATOM 0 HB2 LEU A 147 -10.819 -3.135 4.411 1.00 0.92 H new ATOM 0 HB3 LEU A 147 -10.503 -4.199 3.055 1.00 0.92 H new ATOM 0 HG LEU A 147 -12.902 -3.498 2.283 1.00 0.82 H new ATOM 0 HD11 LEU A 147 -13.456 -1.163 2.879 1.00 1.36 H new ATOM 0 HD12 LEU A 147 -13.514 -2.246 4.290 1.00 1.36 H new ATOM 0 HD13 LEU A 147 -12.123 -1.161 4.058 1.00 1.36 H new ATOM 0 HD21 LEU A 147 -11.936 -1.580 1.051 1.00 1.66 H new ATOM 0 HD22 LEU A 147 -10.531 -1.604 2.143 1.00 1.66 H new ATOM 0 HD23 LEU A 147 -10.843 -2.985 1.065 1.00 1.66 H new ATOM 2340 N HIS A 148 -14.301 -4.228 3.914 1.00 0.71 N ATOM 2341 CA HIS A 148 -15.661 -3.785 4.157 1.00 0.76 C ATOM 2342 C HIS A 148 -16.276 -4.563 5.313 1.00 0.83 C ATOM 2343 O HIS A 148 -17.147 -4.065 6.024 1.00 0.92 O ATOM 2344 CB HIS A 148 -16.461 -3.978 2.858 1.00 0.79 C ATOM 2345 CG HIS A 148 -17.923 -3.641 2.944 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -18.820 -3.961 1.947 1.00 1.04 N ATOM 2347 CD2 HIS A 148 -18.641 -2.988 3.892 1.00 1.02 C ATOM 2348 CE1 HIS A 148 -20.021 -3.520 2.276 1.00 1.20 C ATOM 2349 NE2 HIS A 148 -19.939 -2.927 3.451 1.00 1.19 N ATOM 0 H HIS A 148 -14.094 -4.371 2.926 1.00 0.71 H new ATOM 0 HA HIS A 148 -15.676 -2.733 4.440 1.00 0.76 H new ATOM 0 HB2 HIS A 148 -16.009 -3.364 2.079 1.00 0.79 H new ATOM 0 HB3 HIS A 148 -16.363 -5.017 2.542 1.00 0.79 H new ATOM 0 HD2 HIS A 148 -18.261 -2.590 4.821 1.00 1.02 H new ATOM 0 HE1 HIS A 148 -20.918 -3.627 1.683 1.00 1.20 H new ATOM 0 HE2 HIS A 148 -20.715 -2.493 3.951 1.00 1.19 H new ATOM 2358 N THR A 149 -15.807 -5.788 5.501 1.00 0.86 N ATOM 2359 CA THR A 149 -16.309 -6.632 6.572 1.00 0.97 C ATOM 2360 C THR A 149 -15.377 -6.642 7.784 1.00 1.00 C ATOM 2361 O THR A 149 -15.832 -6.826 8.914 1.00 1.13 O ATOM 2362 CB THR A 149 -16.509 -8.063 6.064 1.00 1.02 C ATOM 2363 OG1 THR A 149 -17.019 -8.893 7.092 1.00 1.35 O ATOM 2364 CG2 THR A 149 -15.236 -8.700 5.547 1.00 1.48 C ATOM 0 H THR A 149 -15.082 -6.218 4.927 1.00 0.86 H new ATOM 0 HA THR A 149 -17.264 -6.215 6.892 1.00 0.97 H new ATOM 0 HB THR A 149 -17.214 -7.979 5.237 1.00 1.02 H new ATOM 0 HG1 THR A 149 -17.141 -9.802 6.748 1.00 1.35 H new ATOM 0 HG21 THR A 149 -15.449 -9.712 5.203 1.00 1.48 H new ATOM 0 HG22 THR A 149 -14.845 -8.110 4.718 1.00 1.48 H new ATOM 0 HG23 THR A 149 -14.497 -8.737 6.347 1.00 1.48 H new ATOM 2372 N ARG A 150 -14.072 -6.483 7.557 1.00 0.91 N ATOM 2373 CA ARG A 150 -13.112 -6.524 8.661 1.00 0.97 C ATOM 2374 C ARG A 150 -12.373 -5.203 8.900 1.00 0.97 C ATOM 2375 O ARG A 150 -11.296 -5.206 9.495 1.00 1.16 O ATOM 2376 CB ARG A 150 -12.102 -7.643 8.421 1.00 1.01 C ATOM 2377 CG ARG A 150 -12.747 -9.000 8.188 1.00 1.12 C ATOM 2378 CD ARG A 150 -13.621 -9.416 9.361 1.00 1.43 C ATOM 2379 NE ARG A 150 -12.847 -9.586 10.589 1.00 1.84 N ATOM 2380 CZ ARG A 150 -11.924 -10.529 10.758 1.00 2.15 C ATOM 2381 NH1 ARG A 150 -11.688 -11.412 9.797 1.00 2.45 N ATOM 2382 NH2 ARG A 150 -11.244 -10.595 11.895 1.00 2.86 N ATOM 0 H ARG A 150 -13.661 -6.327 6.636 1.00 0.91 H new ATOM 0 HA ARG A 150 -13.695 -6.711 9.563 1.00 0.97 H new ATOM 0 HB2 ARG A 150 -11.487 -7.388 7.558 1.00 1.01 H new ATOM 0 HB3 ARG A 150 -11.434 -7.709 9.280 1.00 1.01 H new ATOM 0 HG2 ARG A 150 -13.349 -8.966 7.280 1.00 1.12 H new ATOM 0 HG3 ARG A 150 -11.971 -9.749 8.028 1.00 1.12 H new ATOM 0 HD2 ARG A 150 -14.394 -8.664 9.521 1.00 1.43 H new ATOM 0 HD3 ARG A 150 -14.129 -10.350 9.121 1.00 1.43 H new ATOM 0 HE ARG A 150 -13.025 -8.944 11.362 1.00 1.84 H new ATOM 0 HH11 ARG A 150 -12.215 -11.369 8.925 1.00 2.45 H new ATOM 0 HH12 ARG A 150 -10.980 -12.134 9.930 1.00 2.45 H new ATOM 0 HH21 ARG A 150 -11.429 -9.923 12.640 1.00 2.86 H new ATOM 0 HH22 ARG A 150 -10.536 -11.318 12.025 1.00 2.86 H new ATOM 2396 N ALA A 151 -12.932 -4.079 8.458 1.00 0.88 N ATOM 2397 CA ALA A 151 -12.282 -2.798 8.665 1.00 0.91 C ATOM 2398 C ALA A 151 -13.323 -1.697 8.688 1.00 0.92 C ATOM 2399 O ALA A 151 -13.975 -1.471 9.709 1.00 1.18 O ATOM 2400 CB ALA A 151 -11.241 -2.547 7.582 1.00 0.89 C ATOM 0 H ALA A 151 -13.822 -4.033 7.961 1.00 0.88 H new ATOM 0 HA ALA A 151 -11.765 -2.808 9.625 1.00 0.91 H new ATOM 0 HB1 ALA A 151 -10.764 -1.582 7.753 1.00 0.89 H new ATOM 0 HB2 ALA A 151 -10.488 -3.335 7.611 1.00 0.89 H new ATOM 0 HB3 ALA A 151 -11.725 -2.544 6.605 1.00 0.89 H new ATOM 2406 N PHE A 152 -13.493 -1.022 7.562 1.00 0.79 N ATOM 2407 CA PHE A 152 -14.472 0.036 7.469 1.00 0.99 C ATOM 2408 C PHE A 152 -15.588 -0.346 6.499 1.00 0.88 C ATOM 2409 O PHE A 152 -16.414 -1.209 6.802 1.00 1.32 O ATOM 2410 CB PHE A 152 -13.807 1.332 7.031 1.00 1.26 C ATOM 2411 CG PHE A 152 -12.934 1.966 8.079 1.00 2.02 C ATOM 2412 CD1 PHE A 152 -11.891 1.252 8.649 1.00 2.81 C ATOM 2413 CD2 PHE A 152 -13.151 3.272 8.494 1.00 2.37 C ATOM 2414 CE1 PHE A 152 -11.083 1.827 9.613 1.00 3.76 C ATOM 2415 CE2 PHE A 152 -12.346 3.851 9.457 1.00 3.27 C ATOM 2416 CZ PHE A 152 -11.325 3.146 10.018 1.00 3.92 C ATOM 0 H PHE A 152 -12.965 -1.191 6.706 1.00 0.79 H new ATOM 0 HA PHE A 152 -14.913 0.186 8.455 1.00 0.99 H new ATOM 0 HB2 PHE A 152 -13.205 1.136 6.144 1.00 1.26 H new ATOM 0 HB3 PHE A 152 -14.580 2.043 6.741 1.00 1.26 H new ATOM 0 HD1 PHE A 152 -11.707 0.235 8.336 1.00 2.81 H new ATOM 0 HD2 PHE A 152 -13.958 3.843 8.060 1.00 2.37 H new ATOM 0 HE1 PHE A 152 -10.272 1.264 10.050 1.00 3.76 H new ATOM 0 HE2 PHE A 152 -12.528 4.870 9.767 1.00 3.27 H new ATOM 0 HZ PHE A 152 -10.703 3.603 10.774 1.00 3.92 H new ATOM 2426 N ASP A 153 -15.607 0.296 5.334 1.00 0.92 N ATOM 2427 CA ASP A 153 -16.618 0.021 4.322 1.00 1.10 C ATOM 2428 C ASP A 153 -16.315 0.791 3.042 1.00 1.14 C ATOM 2429 O ASP A 153 -16.363 0.233 1.946 1.00 1.88 O ATOM 2430 CB ASP A 153 -18.011 0.396 4.837 1.00 1.43 C ATOM 2431 CG ASP A 153 -18.114 1.860 5.218 1.00 2.10 C ATOM 2432 OD1 ASP A 153 -17.368 2.293 6.120 1.00 2.80 O ATOM 2433 OD2 ASP A 153 -18.941 2.574 4.612 1.00 2.58 O ATOM 0 H ASP A 153 -14.931 1.012 5.069 1.00 0.92 H new ATOM 0 HA ASP A 153 -16.599 -1.047 4.105 1.00 1.10 H new ATOM 0 HB2 ASP A 153 -18.751 0.171 4.070 1.00 1.43 H new ATOM 0 HB3 ASP A 153 -18.252 -0.220 5.704 1.00 1.43 H new ATOM 2438 N LYS A 154 -16.003 2.078 3.195 1.00 0.75 N ATOM 2439 CA LYS A 154 -15.694 2.933 2.056 1.00 0.78 C ATOM 2440 C LYS A 154 -15.332 4.343 2.527 1.00 0.91 C ATOM 2441 O LYS A 154 -16.213 5.162 2.792 1.00 1.80 O ATOM 2442 CB LYS A 154 -16.897 2.970 1.100 1.00 0.89 C ATOM 2443 CG LYS A 154 -16.625 3.654 -0.232 1.00 0.86 C ATOM 2444 CD LYS A 154 -16.822 5.159 -0.156 1.00 1.03 C ATOM 2445 CE LYS A 154 -18.270 5.520 0.137 1.00 1.54 C ATOM 2446 NZ LYS A 154 -19.196 4.983 -0.899 1.00 2.17 N ATOM 0 H LYS A 154 -15.958 2.549 4.099 1.00 0.75 H new ATOM 0 HA LYS A 154 -14.833 2.526 1.525 1.00 0.78 H new ATOM 0 HB2 LYS A 154 -17.224 1.948 0.909 1.00 0.89 H new ATOM 0 HB3 LYS A 154 -17.722 3.482 1.595 1.00 0.89 H new ATOM 0 HG2 LYS A 154 -15.604 3.439 -0.547 1.00 0.86 H new ATOM 0 HG3 LYS A 154 -17.287 3.241 -0.993 1.00 0.86 H new ATOM 0 HD2 LYS A 154 -16.179 5.572 0.621 1.00 1.03 H new ATOM 0 HD3 LYS A 154 -16.516 5.615 -1.098 1.00 1.03 H new ATOM 0 HE2 LYS A 154 -18.552 5.128 1.114 1.00 1.54 H new ATOM 0 HE3 LYS A 154 -18.371 6.604 0.188 1.00 1.54 H new ATOM 0 HZ1 LYS A 154 -19.889 5.714 -1.157 1.00 2.17 H new ATOM 0 HZ2 LYS A 154 -18.652 4.708 -1.742 1.00 2.17 H new ATOM 0 HZ3 LYS A 154 -19.694 4.151 -0.522 1.00 2.17 H new ATOM 2460 N LEU A 155 -14.029 4.618 2.635 1.00 0.61 N ATOM 2461 CA LEU A 155 -13.559 5.931 3.077 1.00 0.61 C ATOM 2462 C LEU A 155 -13.972 7.015 2.079 1.00 0.68 C ATOM 2463 O LEU A 155 -14.704 6.739 1.131 1.00 0.89 O ATOM 2464 CB LEU A 155 -12.034 5.928 3.267 1.00 0.60 C ATOM 2465 CG LEU A 155 -11.496 4.953 4.327 1.00 0.60 C ATOM 2466 CD1 LEU A 155 -10.033 5.242 4.617 1.00 1.18 C ATOM 2467 CD2 LEU A 155 -12.318 5.035 5.605 1.00 1.23 C ATOM 0 H LEU A 155 -13.286 3.952 2.423 1.00 0.61 H new ATOM 0 HA LEU A 155 -14.023 6.152 4.038 1.00 0.61 H new ATOM 0 HB2 LEU A 155 -11.568 5.690 2.311 1.00 0.60 H new ATOM 0 HB3 LEU A 155 -11.718 6.936 3.534 1.00 0.60 H new ATOM 0 HG LEU A 155 -11.580 3.940 3.933 1.00 0.60 H new ATOM 0 HD11 LEU A 155 -9.666 4.544 5.369 1.00 1.18 H new ATOM 0 HD12 LEU A 155 -9.451 5.128 3.702 1.00 1.18 H new ATOM 0 HD13 LEU A 155 -9.930 6.262 4.988 1.00 1.18 H new ATOM 0 HD21 LEU A 155 -11.918 4.336 6.340 1.00 1.23 H new ATOM 0 HD22 LEU A 155 -12.270 6.048 6.004 1.00 1.23 H new ATOM 0 HD23 LEU A 155 -13.355 4.779 5.388 1.00 1.23 H new ATOM 2479 N ASN A 156 -13.511 8.249 2.288 1.00 0.66 N ATOM 2480 CA ASN A 156 -13.865 9.340 1.384 1.00 0.77 C ATOM 2481 C ASN A 156 -12.627 10.013 0.803 1.00 0.65 C ATOM 2482 O ASN A 156 -11.769 10.510 1.533 1.00 0.69 O ATOM 2483 CB ASN A 156 -14.759 10.370 2.091 1.00 1.04 C ATOM 2484 CG ASN A 156 -14.171 10.929 3.381 1.00 1.66 C ATOM 2485 OD1 ASN A 156 -14.797 11.755 4.045 1.00 2.44 O ATOM 2486 ND2 ASN A 156 -12.971 10.492 3.750 1.00 2.12 N ATOM 0 H ASN A 156 -12.902 8.514 3.062 1.00 0.66 H new ATOM 0 HA ASN A 156 -14.426 8.907 0.556 1.00 0.77 H new ATOM 0 HB2 ASN A 156 -14.954 11.196 1.406 1.00 1.04 H new ATOM 0 HB3 ASN A 156 -15.720 9.907 2.314 1.00 1.04 H new ATOM 0 HD21 ASN A 156 -12.542 10.842 4.607 1.00 2.12 H new ATOM 0 HD22 ASN A 156 -12.479 9.807 3.176 1.00 2.12 H new ATOM 2493 N LYS A 157 -12.542 10.026 -0.524 1.00 0.64 N ATOM 2494 CA LYS A 157 -11.411 10.641 -1.204 1.00 0.64 C ATOM 2495 C LYS A 157 -11.260 12.092 -0.770 1.00 0.68 C ATOM 2496 O LYS A 157 -12.037 12.955 -1.179 1.00 0.95 O ATOM 2497 CB LYS A 157 -11.580 10.553 -2.718 1.00 0.79 C ATOM 2498 CG LYS A 157 -11.749 9.130 -3.224 1.00 0.96 C ATOM 2499 CD LYS A 157 -11.862 9.085 -4.738 1.00 1.67 C ATOM 2500 CE LYS A 157 -12.045 7.661 -5.239 1.00 1.70 C ATOM 2501 NZ LYS A 157 -12.140 7.601 -6.724 1.00 2.51 N ATOM 0 H LYS A 157 -13.241 9.619 -1.146 1.00 0.64 H new ATOM 0 HA LYS A 157 -10.507 10.098 -0.929 1.00 0.64 H new ATOM 0 HB2 LYS A 157 -12.448 11.142 -3.014 1.00 0.79 H new ATOM 0 HB3 LYS A 157 -10.711 11.002 -3.200 1.00 0.79 H new ATOM 0 HG2 LYS A 157 -10.900 8.526 -2.904 1.00 0.96 H new ATOM 0 HG3 LYS A 157 -12.640 8.688 -2.779 1.00 0.96 H new ATOM 0 HD2 LYS A 157 -12.705 9.697 -5.060 1.00 1.67 H new ATOM 0 HD3 LYS A 157 -10.966 9.517 -5.184 1.00 1.67 H new ATOM 0 HE2 LYS A 157 -11.208 7.048 -4.904 1.00 1.70 H new ATOM 0 HE3 LYS A 157 -12.947 7.235 -4.800 1.00 1.70 H new ATOM 0 HZ1 LYS A 157 -12.575 6.700 -7.008 1.00 2.51 H new ATOM 0 HZ2 LYS A 157 -12.723 8.391 -7.067 1.00 2.51 H new ATOM 0 HZ3 LYS A 157 -11.188 7.670 -7.136 1.00 2.51 H new ATOM 2515 N TRP A 158 -10.249 12.328 0.068 1.00 0.73 N ATOM 2516 CA TRP A 158 -9.940 13.645 0.613 1.00 0.83 C ATOM 2517 C TRP A 158 -11.110 14.619 0.487 1.00 1.08 C ATOM 2518 O TRP A 158 -11.144 15.381 -0.503 1.00 1.47 O ATOM 2519 CB TRP A 158 -8.696 14.213 -0.076 1.00 0.85 C ATOM 2520 CG TRP A 158 -8.262 15.547 0.459 1.00 1.04 C ATOM 2521 CD1 TRP A 158 -7.846 16.623 -0.273 1.00 1.51 C ATOM 2522 CD2 TRP A 158 -8.198 15.950 1.835 1.00 1.55 C ATOM 2523 NE1 TRP A 158 -7.529 17.667 0.560 1.00 1.52 N ATOM 2524 CE2 TRP A 158 -7.738 17.281 1.857 1.00 1.52 C ATOM 2525 CE3 TRP A 158 -8.488 15.319 3.050 1.00 2.50 C ATOM 2526 CZ2 TRP A 158 -7.560 17.989 3.044 1.00 2.07 C ATOM 2527 CZ3 TRP A 158 -8.311 16.023 4.227 1.00 3.24 C ATOM 2528 CH2 TRP A 158 -7.851 17.345 4.217 1.00 2.95 C ATOM 2529 OXT TRP A 158 -11.984 14.612 1.381 1.00 1.75 O ATOM 0 H TRP A 158 -9.615 11.597 0.390 1.00 0.73 H new ATOM 0 HA TRP A 158 -9.746 13.521 1.678 1.00 0.83 H new ATOM 0 HB2 TRP A 158 -7.876 13.504 0.034 1.00 0.85 H new ATOM 0 HB3 TRP A 158 -8.895 14.307 -1.144 1.00 0.85 H new ATOM 0 HD1 TRP A 158 -7.777 16.648 -1.350 1.00 1.51 H new ATOM 0 HE1 TRP A 158 -7.192 18.582 0.261 1.00 1.52 H new ATOM 0 HE3 TRP A 158 -8.844 14.300 3.068 1.00 2.50 H new ATOM 0 HZ2 TRP A 158 -7.205 19.009 3.039 1.00 2.07 H new ATOM 0 HZ3 TRP A 158 -8.531 15.545 5.170 1.00 3.24 H new ATOM 0 HH2 TRP A 158 -7.723 17.868 5.153 1.00 2.95 H new