USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 915 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 119 GLN : amide:sc= -2.53! K(o=-8.6!,f=-0.6) USER MOD Set 1.2: A 123 GLN : amide:sc= -6.07! K(o=-8.6!,f=-0.39) USER MOD Set 2.1: A 111 SER OG : rot 180:sc= 0.752 USER MOD Set 2.2: A 115 LYS NZ :NH3+ 179:sc= 0.866 (180deg=0) USER MOD Set 3.1: A 109 THR OG1 : rot -82:sc= 0.162 USER MOD Set 3.2: A 112 GLN : amide:sc= 1.02 K(o=1.2,f=-4.6!) USER MOD Set 4.1: A 98 GLN : amide:sc= -1.06 K(o=-4.7,f=-0.19) USER MOD Set 4.2: A 100 ASN : amide:sc= -3.59! K(o=-4.7!,f=-0.19) USER MOD Set 5.1: A 96 THR OG1 : rot 113:sc= 1.76 USER MOD Set 5.2: A 101 THR OG1 : rot 88:sc= 0.89 USER MOD Set 6.1: A 52 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 69 SER OG : rot 180:sc= 0.0772 USER MOD Set 7.1: A 24 THR OG1 : rot -150:sc= -1 USER MOD Set 7.2: A 26 GLN : amide:sc= -0.619 K(o=-1.6,f=-4.3!) USER MOD Single : A 27 GLN : amide:sc= 0.0128 K(o=0.013,f=-1.7) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 ASN : amide:sc= 0.991 K(o=0.99,f=-0.46) USER MOD Single : A 48 ASN : amide:sc= 0.768 K(o=0.77,f=0) USER MOD Single : A 49 GLN : amide:sc= 0.788 K(o=0.79,f=-0.13) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0247 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot -56:sc= 1.23 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0.00561 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 GLN : amide:sc= -1.04 X(o=-1,f=-1) USER MOD Single : A 90 THR OG1 : rot 71:sc= 0.963 USER MOD Single : A 94 LYS NZ :NH3+ -126:sc= 1.21 (180deg=-0.111) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0.022 USER MOD Single : A 102 LYS NZ :NH3+ -157:sc= 0.0034 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 176:sc= 0.0443 (180deg=0.0412) USER MOD Single : A 118 TYR OH : rot -12:sc= 0.373 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.174 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 TYR OH : rot 180:sc=-0.00841 USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N PHE A 23 -11.688 -9.555 -1.194 1.00 0.00 N ATOM 65 CA PHE A 23 -10.547 -8.661 -1.347 1.00 0.00 C ATOM 66 C PHE A 23 -9.512 -9.408 -2.197 1.00 0.00 C ATOM 67 O PHE A 23 -9.526 -10.643 -2.213 1.00 0.00 O ATOM 68 CB PHE A 23 -9.962 -8.345 0.034 1.00 0.00 C ATOM 69 CG PHE A 23 -10.776 -7.312 0.775 1.00 0.00 C ATOM 70 CD1 PHE A 23 -10.610 -5.961 0.442 1.00 0.00 C ATOM 71 CD2 PHE A 23 -11.735 -7.685 1.733 1.00 0.00 C ATOM 72 CE1 PHE A 23 -11.424 -4.982 1.030 1.00 0.00 C ATOM 73 CE2 PHE A 23 -12.520 -6.700 2.358 1.00 0.00 C ATOM 74 CZ PHE A 23 -12.367 -5.347 2.004 1.00 0.00 C ATOM 0 HA PHE A 23 -10.834 -7.722 -1.821 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -9.915 -9.260 0.625 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -8.939 -7.986 -0.080 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -9.852 -5.672 -0.271 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -11.868 -8.726 1.988 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -11.326 -3.948 0.734 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -13.241 -6.982 3.111 1.00 0.00 H new ATOM 0 HZ PHE A 23 -12.974 -4.591 2.480 1.00 0.00 H new ATOM 84 N THR A 24 -8.561 -8.703 -2.809 1.00 0.00 N ATOM 85 CA THR A 24 -7.354 -9.297 -3.384 1.00 0.00 C ATOM 86 C THR A 24 -6.141 -8.679 -2.689 1.00 0.00 C ATOM 87 O THR A 24 -6.265 -7.701 -1.949 1.00 0.00 O ATOM 88 CB THR A 24 -7.307 -9.129 -4.918 1.00 0.00 C ATOM 89 OG1 THR A 24 -7.035 -7.804 -5.270 1.00 0.00 O ATOM 90 CG2 THR A 24 -8.591 -9.594 -5.610 1.00 0.00 C ATOM 0 H THR A 24 -8.608 -7.690 -2.921 1.00 0.00 H new ATOM 0 HA THR A 24 -7.353 -10.374 -3.213 1.00 0.00 H new ATOM 0 HB THR A 24 -6.498 -9.771 -5.266 1.00 0.00 H new ATOM 0 HG1 THR A 24 -7.456 -7.601 -6.131 1.00 0.00 H new ATOM 0 HG21 THR A 24 -8.497 -9.451 -6.686 1.00 0.00 H new ATOM 0 HG22 THR A 24 -8.757 -10.650 -5.398 1.00 0.00 H new ATOM 0 HG23 THR A 24 -9.435 -9.013 -5.239 1.00 0.00 H new ATOM 98 N ASP A 25 -4.952 -9.224 -2.936 1.00 0.00 N ATOM 99 CA ASP A 25 -3.723 -8.724 -2.327 1.00 0.00 C ATOM 100 C ASP A 25 -3.466 -7.287 -2.770 1.00 0.00 C ATOM 101 O ASP A 25 -3.128 -6.436 -1.944 1.00 0.00 O ATOM 102 CB ASP A 25 -2.532 -9.604 -2.734 1.00 0.00 C ATOM 103 CG ASP A 25 -2.483 -10.953 -2.028 1.00 0.00 C ATOM 104 OD1 ASP A 25 -3.038 -11.104 -0.924 1.00 0.00 O ATOM 105 OD2 ASP A 25 -1.865 -11.882 -2.593 1.00 0.00 O ATOM 0 H ASP A 25 -4.814 -10.019 -3.560 1.00 0.00 H new ATOM 0 HA ASP A 25 -3.837 -8.753 -1.243 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -2.569 -9.771 -3.811 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -1.608 -9.064 -2.527 1.00 0.00 H new ATOM 110 N GLN A 26 -3.657 -7.016 -4.066 1.00 0.00 N ATOM 111 CA GLN A 26 -3.459 -5.698 -4.662 1.00 0.00 C ATOM 112 C GLN A 26 -4.393 -4.683 -4.006 1.00 0.00 C ATOM 113 O GLN A 26 -3.956 -3.612 -3.590 1.00 0.00 O ATOM 114 CB GLN A 26 -3.716 -5.704 -6.181 1.00 0.00 C ATOM 115 CG GLN A 26 -3.309 -6.964 -6.950 1.00 0.00 C ATOM 116 CD GLN A 26 -4.410 -8.005 -6.987 1.00 0.00 C ATOM 117 OE1 GLN A 26 -4.314 -9.018 -6.299 1.00 0.00 O ATOM 118 NE2 GLN A 26 -5.478 -7.772 -7.737 1.00 0.00 N ATOM 0 H GLN A 26 -3.959 -7.721 -4.738 1.00 0.00 H new ATOM 0 HA GLN A 26 -2.418 -5.422 -4.493 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -4.780 -5.536 -6.345 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -3.188 -4.856 -6.617 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -3.038 -6.691 -7.970 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -2.421 -7.396 -6.489 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -5.531 -6.922 -8.299 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -6.247 -8.442 -7.752 1.00 0.00 H new ATOM 127 N GLN A 27 -5.673 -5.047 -3.906 1.00 0.00 N ATOM 128 CA GLN A 27 -6.751 -4.212 -3.402 1.00 0.00 C ATOM 129 C GLN A 27 -6.421 -3.706 -2.003 1.00 0.00 C ATOM 130 O GLN A 27 -6.577 -2.518 -1.704 1.00 0.00 O ATOM 131 CB GLN A 27 -8.040 -5.048 -3.400 1.00 0.00 C ATOM 132 CG GLN A 27 -8.546 -5.379 -4.813 1.00 0.00 C ATOM 133 CD GLN A 27 -9.349 -4.286 -5.496 1.00 0.00 C ATOM 134 OE1 GLN A 27 -9.845 -3.357 -4.865 1.00 0.00 O ATOM 135 NE2 GLN A 27 -9.493 -4.405 -6.803 1.00 0.00 N ATOM 0 H GLN A 27 -5.994 -5.973 -4.188 1.00 0.00 H new ATOM 0 HA GLN A 27 -6.883 -3.337 -4.039 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -7.863 -5.976 -2.857 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -8.817 -4.506 -2.860 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -7.687 -5.620 -5.440 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -9.162 -6.277 -4.758 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -9.066 -5.191 -7.294 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -10.031 -3.711 -7.322 1.00 0.00 H new ATOM 144 N ILE A 28 -5.973 -4.608 -1.128 1.00 0.00 N ATOM 145 CA ILE A 28 -5.651 -4.265 0.250 1.00 0.00 C ATOM 146 C ILE A 28 -4.473 -3.277 0.266 1.00 0.00 C ATOM 147 O ILE A 28 -4.424 -2.382 1.108 1.00 0.00 O ATOM 148 CB ILE A 28 -5.386 -5.557 1.055 1.00 0.00 C ATOM 149 CG1 ILE A 28 -6.618 -6.498 1.062 1.00 0.00 C ATOM 150 CG2 ILE A 28 -5.038 -5.172 2.502 1.00 0.00 C ATOM 151 CD1 ILE A 28 -6.249 -7.940 1.436 1.00 0.00 C ATOM 0 H ILE A 28 -5.825 -5.591 -1.357 1.00 0.00 H new ATOM 0 HA ILE A 28 -6.488 -3.763 0.735 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.562 -6.091 0.582 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -7.357 -6.120 1.768 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -7.085 -6.489 0.077 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -4.848 -6.074 3.083 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.148 -4.543 2.507 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -5.871 -4.625 2.943 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -7.146 -8.559 1.427 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.531 -8.331 0.715 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -5.808 -7.956 2.432 1.00 0.00 H new ATOM 163 N GLY A 29 -3.545 -3.398 -0.685 1.00 0.00 N ATOM 164 CA GLY A 29 -2.395 -2.520 -0.803 1.00 0.00 C ATOM 165 C GLY A 29 -2.751 -1.083 -1.148 1.00 0.00 C ATOM 166 O GLY A 29 -2.031 -0.171 -0.728 1.00 0.00 O ATOM 0 H GLY A 29 -3.578 -4.122 -1.403 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -1.843 -2.532 0.137 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.727 -2.913 -1.570 1.00 0.00 H new ATOM 170 N VAL A 30 -3.837 -0.863 -1.889 1.00 0.00 N ATOM 171 CA VAL A 30 -4.248 0.482 -2.267 1.00 0.00 C ATOM 172 C VAL A 30 -4.880 1.134 -1.046 1.00 0.00 C ATOM 173 O VAL A 30 -4.529 2.258 -0.700 1.00 0.00 O ATOM 174 CB VAL A 30 -5.163 0.430 -3.507 1.00 0.00 C ATOM 175 CG1 VAL A 30 -5.808 1.783 -3.833 1.00 0.00 C ATOM 176 CG2 VAL A 30 -4.317 -0.020 -4.707 1.00 0.00 C ATOM 0 H VAL A 30 -4.446 -1.603 -2.238 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.401 1.099 -2.568 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.973 -0.267 -3.295 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.440 1.682 -4.715 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -6.414 2.110 -2.988 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -5.029 2.520 -4.028 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.944 -0.064 -5.598 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.507 0.691 -4.868 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.899 -1.007 -4.508 1.00 0.00 H new ATOM 186 N LEU A 31 -5.744 0.402 -0.339 1.00 0.00 N ATOM 187 CA LEU A 31 -6.310 0.846 0.925 1.00 0.00 C ATOM 188 C LEU A 31 -5.197 1.201 1.914 1.00 0.00 C ATOM 189 O LEU A 31 -5.265 2.247 2.556 1.00 0.00 O ATOM 190 CB LEU A 31 -7.282 -0.231 1.453 1.00 0.00 C ATOM 191 CG LEU A 31 -8.748 0.223 1.444 1.00 0.00 C ATOM 192 CD1 LEU A 31 -9.229 0.729 0.082 1.00 0.00 C ATOM 193 CD2 LEU A 31 -9.700 -0.896 1.855 1.00 0.00 C ATOM 0 H LEU A 31 -6.069 -0.519 -0.634 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.887 1.760 0.784 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.183 -1.130 0.845 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.998 -0.501 2.470 1.00 0.00 H new ATOM 0 HG LEU A 31 -8.768 1.041 2.164 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.274 1.032 0.155 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -8.624 1.583 -0.223 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -9.132 -0.067 -0.657 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.726 -0.527 1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -9.600 -1.731 1.162 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -9.455 -1.230 2.863 1.00 0.00 H new ATOM 205 N ALA A 32 -4.167 0.359 2.035 1.00 0.00 N ATOM 206 CA ALA A 32 -3.026 0.622 2.903 1.00 0.00 C ATOM 207 C ALA A 32 -2.293 1.908 2.501 1.00 0.00 C ATOM 208 O ALA A 32 -1.932 2.704 3.368 1.00 0.00 O ATOM 209 CB ALA A 32 -2.088 -0.588 2.894 1.00 0.00 C ATOM 0 H ALA A 32 -4.105 -0.525 1.531 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.388 0.778 3.919 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.235 -0.392 3.543 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -2.624 -1.466 3.255 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -1.737 -0.769 1.878 1.00 0.00 H new ATOM 215 N GLY A 33 -2.093 2.135 1.202 1.00 0.00 N ATOM 216 CA GLY A 33 -1.392 3.315 0.716 1.00 0.00 C ATOM 217 C GLY A 33 -2.248 4.576 0.820 1.00 0.00 C ATOM 218 O GLY A 33 -1.716 5.678 0.876 1.00 0.00 O ATOM 0 H GLY A 33 -2.412 1.507 0.464 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.474 3.452 1.288 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.100 3.160 -0.323 1.00 0.00 H new ATOM 222 N LEU A 34 -3.571 4.448 0.907 1.00 0.00 N ATOM 223 CA LEU A 34 -4.434 5.593 1.156 1.00 0.00 C ATOM 224 C LEU A 34 -4.271 6.129 2.582 1.00 0.00 C ATOM 225 O LEU A 34 -4.485 7.317 2.818 1.00 0.00 O ATOM 226 CB LEU A 34 -5.891 5.229 0.838 1.00 0.00 C ATOM 227 CG LEU A 34 -6.364 5.857 -0.480 1.00 0.00 C ATOM 228 CD1 LEU A 34 -5.551 5.446 -1.713 1.00 0.00 C ATOM 229 CD2 LEU A 34 -7.828 5.483 -0.717 1.00 0.00 C ATOM 0 H LEU A 34 -4.065 3.561 0.808 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.134 6.403 0.492 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.990 4.145 0.779 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.535 5.564 1.651 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.226 6.932 -0.363 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.957 5.938 -2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.511 5.743 -1.578 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.606 4.365 -1.842 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.170 5.926 -1.652 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.922 4.399 -0.774 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.437 5.857 0.106 1.00 0.00 H new ATOM 241 N ALA A 35 -3.874 5.280 3.533 1.00 0.00 N ATOM 242 CA ALA A 35 -3.510 5.714 4.883 1.00 0.00 C ATOM 243 C ALA A 35 -2.081 6.261 4.953 1.00 0.00 C ATOM 244 O ALA A 35 -1.794 7.080 5.828 1.00 0.00 O ATOM 245 CB ALA A 35 -3.680 4.564 5.887 1.00 0.00 C ATOM 0 H ALA A 35 -3.796 4.273 3.389 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.187 6.526 5.146 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.404 4.908 6.884 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.719 4.235 5.891 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -3.037 3.732 5.599 1.00 0.00 H new ATOM 251 N ILE A 36 -1.176 5.816 4.080 1.00 0.00 N ATOM 252 CA ILE A 36 0.240 6.148 4.102 1.00 0.00 C ATOM 253 C ILE A 36 0.574 6.669 2.703 1.00 0.00 C ATOM 254 O ILE A 36 0.912 5.889 1.813 1.00 0.00 O ATOM 255 CB ILE A 36 1.091 4.926 4.533 1.00 0.00 C ATOM 256 CG1 ILE A 36 0.973 4.519 6.025 1.00 0.00 C ATOM 257 CG2 ILE A 36 2.601 5.189 4.350 1.00 0.00 C ATOM 258 CD1 ILE A 36 -0.341 3.922 6.511 1.00 0.00 C ATOM 0 H ILE A 36 -1.423 5.192 3.312 1.00 0.00 H new ATOM 0 HA ILE A 36 0.474 6.914 4.841 1.00 0.00 H new ATOM 0 HB ILE A 36 0.692 4.139 3.894 1.00 0.00 H new ATOM 0 HG12 ILE A 36 1.763 3.798 6.236 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.179 5.404 6.628 1.00 0.00 H new ATOM 0 HG21 ILE A 36 3.164 4.310 4.663 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.809 5.399 3.301 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.898 6.044 4.957 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.265 3.691 7.573 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.147 4.639 6.353 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.553 3.009 5.955 1.00 0.00 H new ATOM 270 N SER A 37 0.541 7.993 2.540 1.00 0.00 N ATOM 271 CA SER A 37 0.843 8.700 1.299 1.00 0.00 C ATOM 272 C SER A 37 -0.204 8.442 0.184 1.00 0.00 C ATOM 273 O SER A 37 0.145 7.973 -0.904 1.00 0.00 O ATOM 274 CB SER A 37 2.311 8.443 0.893 1.00 0.00 C ATOM 275 OG SER A 37 3.190 9.435 1.399 1.00 0.00 O ATOM 0 H SER A 37 0.293 8.625 3.301 1.00 0.00 H new ATOM 0 HA SER A 37 0.753 9.772 1.472 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.621 7.464 1.259 1.00 0.00 H new ATOM 0 HB3 SER A 37 2.386 8.415 -0.194 1.00 0.00 H new ATOM 0 HG SER A 37 4.107 9.232 1.120 1.00 0.00 H new ATOM 281 N PRO A 38 -1.475 8.856 0.393 1.00 0.00 N ATOM 282 CA PRO A 38 -2.532 8.735 -0.609 1.00 0.00 C ATOM 283 C PRO A 38 -2.201 9.520 -1.878 1.00 0.00 C ATOM 284 O PRO A 38 -2.442 9.038 -2.981 1.00 0.00 O ATOM 285 CB PRO A 38 -3.811 9.282 0.041 1.00 0.00 C ATOM 286 CG PRO A 38 -3.314 10.132 1.206 1.00 0.00 C ATOM 287 CD PRO A 38 -2.009 9.456 1.607 1.00 0.00 C ATOM 0 HA PRO A 38 -2.649 7.695 -0.913 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -4.392 9.876 -0.664 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -4.457 8.475 0.386 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -3.154 11.168 0.908 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -4.029 10.144 2.028 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -1.308 10.179 2.025 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -2.181 8.699 2.372 1.00 0.00 H new ATOM 295 N GLU A 39 -1.672 10.740 -1.752 1.00 0.00 N ATOM 296 CA GLU A 39 -1.456 11.596 -2.914 1.00 0.00 C ATOM 297 C GLU A 39 -0.342 11.032 -3.797 1.00 0.00 C ATOM 298 O GLU A 39 -0.525 10.951 -5.014 1.00 0.00 O ATOM 299 CB GLU A 39 -1.206 13.054 -2.499 1.00 0.00 C ATOM 300 CG GLU A 39 -2.414 13.593 -1.720 1.00 0.00 C ATOM 301 CD GLU A 39 -2.468 15.122 -1.692 1.00 0.00 C ATOM 302 OE1 GLU A 39 -1.865 15.729 -0.792 1.00 0.00 O ATOM 303 OE2 GLU A 39 -3.199 15.680 -2.560 1.00 0.00 O ATOM 0 H GLU A 39 -1.388 11.152 -0.863 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.367 11.604 -3.513 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -0.309 13.117 -1.883 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -1.030 13.667 -3.383 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.330 13.210 -2.169 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.379 13.217 -0.698 1.00 0.00 H new ATOM 310 N TRP A 40 0.756 10.560 -3.196 1.00 0.00 N ATOM 311 CA TRP A 40 1.841 9.901 -3.920 1.00 0.00 C ATOM 312 C TRP A 40 1.352 8.649 -4.650 1.00 0.00 C ATOM 313 O TRP A 40 1.816 8.341 -5.750 1.00 0.00 O ATOM 314 CB TRP A 40 2.960 9.523 -2.945 1.00 0.00 C ATOM 315 CG TRP A 40 3.969 8.533 -3.454 1.00 0.00 C ATOM 316 CD1 TRP A 40 5.092 8.836 -4.140 1.00 0.00 C ATOM 317 CD2 TRP A 40 3.941 7.073 -3.374 1.00 0.00 C ATOM 318 NE1 TRP A 40 5.730 7.680 -4.532 1.00 0.00 N ATOM 319 CE2 TRP A 40 5.073 6.563 -4.077 1.00 0.00 C ATOM 320 CE3 TRP A 40 3.050 6.119 -2.830 1.00 0.00 C ATOM 321 CZ2 TRP A 40 5.319 5.191 -4.217 1.00 0.00 C ATOM 322 CZ3 TRP A 40 3.288 4.736 -2.968 1.00 0.00 C ATOM 323 CH2 TRP A 40 4.439 4.266 -3.635 1.00 0.00 C ATOM 0 H TRP A 40 0.914 10.626 -2.191 1.00 0.00 H new ATOM 0 HA TRP A 40 2.219 10.601 -4.666 1.00 0.00 H new ATOM 0 HB2 TRP A 40 3.486 10.433 -2.656 1.00 0.00 H new ATOM 0 HB3 TRP A 40 2.506 9.117 -2.041 1.00 0.00 H new ATOM 0 HD1 TRP A 40 5.439 9.837 -4.350 1.00 0.00 H new ATOM 0 HE1 TRP A 40 6.583 7.656 -5.090 1.00 0.00 H new ATOM 0 HE3 TRP A 40 2.172 6.456 -2.299 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 6.181 4.847 -4.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 2.582 4.029 -2.559 1.00 0.00 H new ATOM 0 HH2 TRP A 40 4.640 3.207 -3.697 1.00 0.00 H new ATOM 334 N LEU A 41 0.437 7.897 -4.042 1.00 0.00 N ATOM 335 CA LEU A 41 -0.225 6.776 -4.690 1.00 0.00 C ATOM 336 C LEU A 41 -0.974 7.305 -5.913 1.00 0.00 C ATOM 337 O LEU A 41 -0.610 6.971 -7.043 1.00 0.00 O ATOM 338 CB LEU A 41 -1.052 6.016 -3.640 1.00 0.00 C ATOM 339 CG LEU A 41 -1.841 4.805 -4.173 1.00 0.00 C ATOM 340 CD1 LEU A 41 -2.157 3.866 -3.004 1.00 0.00 C ATOM 341 CD2 LEU A 41 -3.184 5.187 -4.809 1.00 0.00 C ATOM 0 H LEU A 41 0.135 8.052 -3.080 1.00 0.00 H new ATOM 0 HA LEU A 41 0.463 6.028 -5.084 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.381 5.673 -2.852 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.754 6.712 -3.181 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.216 4.341 -4.936 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -2.716 3.005 -3.370 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -1.227 3.528 -2.547 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -2.753 4.397 -2.262 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -3.688 4.288 -5.163 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -3.809 5.685 -4.068 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -3.011 5.860 -5.648 1.00 0.00 H new ATOM 353 N LYS A 42 -1.968 8.173 -5.721 1.00 0.00 N ATOM 354 CA LYS A 42 -2.846 8.649 -6.792 1.00 0.00 C ATOM 355 C LYS A 42 -2.062 9.261 -7.957 1.00 0.00 C ATOM 356 O LYS A 42 -2.436 9.047 -9.115 1.00 0.00 O ATOM 357 CB LYS A 42 -3.832 9.674 -6.208 1.00 0.00 C ATOM 358 CG LYS A 42 -4.815 9.075 -5.188 1.00 0.00 C ATOM 359 CD LYS A 42 -5.422 10.151 -4.277 1.00 0.00 C ATOM 360 CE LYS A 42 -6.353 11.084 -5.052 1.00 0.00 C ATOM 361 NZ LYS A 42 -6.843 12.193 -4.216 1.00 0.00 N ATOM 0 H LYS A 42 -2.189 8.570 -4.808 1.00 0.00 H new ATOM 0 HA LYS A 42 -3.388 7.794 -7.196 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -3.269 10.475 -5.729 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.398 10.126 -7.023 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -5.614 8.554 -5.716 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -4.299 8.333 -4.579 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.975 9.674 -3.468 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -4.623 10.733 -3.817 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -5.825 11.487 -5.916 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -7.201 10.515 -5.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -7.471 12.801 -4.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -7.369 11.810 -3.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -6.036 12.752 -3.873 1.00 0.00 H new ATOM 375 N GLN A 43 -0.960 9.973 -7.675 1.00 0.00 N ATOM 376 CA GLN A 43 -0.206 10.651 -8.715 1.00 0.00 C ATOM 377 C GLN A 43 0.407 9.652 -9.691 1.00 0.00 C ATOM 378 O GLN A 43 0.308 9.811 -10.902 1.00 0.00 O ATOM 379 CB GLN A 43 0.745 11.721 -8.168 1.00 0.00 C ATOM 380 CG GLN A 43 1.879 11.161 -7.367 1.00 0.00 C ATOM 381 CD GLN A 43 3.227 11.795 -7.682 1.00 0.00 C ATOM 382 OE1 GLN A 43 3.842 11.493 -8.701 1.00 0.00 O ATOM 383 NE2 GLN A 43 3.716 12.679 -6.832 1.00 0.00 N ATOM 0 H GLN A 43 -0.580 10.088 -6.735 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.903 11.237 -9.314 1.00 0.00 H new ATOM 0 HB2 GLN A 43 1.149 12.297 -9.001 1.00 0.00 H new ATOM 0 HB3 GLN A 43 0.179 12.415 -7.546 1.00 0.00 H new ATOM 0 HG2 GLN A 43 1.664 11.295 -6.307 1.00 0.00 H new ATOM 0 HG3 GLN A 43 1.942 10.088 -7.546 1.00 0.00 H new ATOM 0 HE21 GLN A 43 3.194 12.920 -5.990 1.00 0.00 H new ATOM 0 HE22 GLN A 43 4.616 13.121 -7.018 1.00 0.00 H new ATOM 392 N ASN A 44 1.002 8.593 -9.161 1.00 0.00 N ATOM 393 CA ASN A 44 1.702 7.581 -9.931 1.00 0.00 C ATOM 394 C ASN A 44 0.722 6.766 -10.760 1.00 0.00 C ATOM 395 O ASN A 44 1.043 6.455 -11.906 1.00 0.00 O ATOM 396 CB ASN A 44 2.605 6.764 -9.008 1.00 0.00 C ATOM 397 CG ASN A 44 3.869 7.564 -8.737 1.00 0.00 C ATOM 398 OD1 ASN A 44 4.723 7.681 -9.607 1.00 0.00 O ATOM 399 ND2 ASN A 44 3.985 8.201 -7.582 1.00 0.00 N ATOM 0 H ASN A 44 1.010 8.411 -8.157 1.00 0.00 H new ATOM 0 HA ASN A 44 2.366 8.044 -10.661 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.090 6.542 -8.073 1.00 0.00 H new ATOM 0 HB3 ASN A 44 2.853 5.808 -9.470 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.793 8.798 -7.408 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.266 8.094 -6.866 1.00 0.00 H new ATOM 406 N ILE A 45 -0.498 6.521 -10.263 1.00 0.00 N ATOM 407 CA ILE A 45 -1.580 6.005 -11.098 1.00 0.00 C ATOM 408 C ILE A 45 -1.863 6.960 -12.258 1.00 0.00 C ATOM 409 O ILE A 45 -1.963 6.490 -13.385 1.00 0.00 O ATOM 410 CB ILE A 45 -2.850 5.708 -10.275 1.00 0.00 C ATOM 411 CG1 ILE A 45 -2.602 4.665 -9.168 1.00 0.00 C ATOM 412 CG2 ILE A 45 -3.992 5.258 -11.202 1.00 0.00 C ATOM 413 CD1 ILE A 45 -2.189 3.281 -9.685 1.00 0.00 C ATOM 0 H ILE A 45 -0.756 6.673 -9.288 1.00 0.00 H new ATOM 0 HA ILE A 45 -1.255 5.053 -11.518 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.138 6.634 -9.777 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -1.824 5.038 -8.502 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.509 4.562 -8.573 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.883 5.052 -10.608 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.210 6.048 -11.921 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -3.694 4.355 -11.735 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.035 2.609 -8.841 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.975 2.883 -10.327 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -1.264 3.367 -10.255 1.00 0.00 H new ATOM 425 N ALA A 46 -1.944 8.274 -12.026 1.00 0.00 N ATOM 426 CA ALA A 46 -2.273 9.250 -13.065 1.00 0.00 C ATOM 427 C ALA A 46 -1.229 9.364 -14.187 1.00 0.00 C ATOM 428 O ALA A 46 -1.449 10.114 -15.136 1.00 0.00 O ATOM 429 CB ALA A 46 -2.520 10.623 -12.433 1.00 0.00 C ATOM 0 H ALA A 46 -1.782 8.690 -11.109 1.00 0.00 H new ATOM 0 HA ALA A 46 -3.179 8.880 -13.544 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.764 11.344 -13.213 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -3.349 10.555 -11.729 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.623 10.948 -11.907 1.00 0.00 H new ATOM 435 N ALA A 47 -0.096 8.662 -14.099 1.00 0.00 N ATOM 436 CA ALA A 47 0.872 8.522 -15.185 1.00 0.00 C ATOM 437 C ALA A 47 1.186 7.047 -15.478 1.00 0.00 C ATOM 438 O ALA A 47 2.117 6.727 -16.221 1.00 0.00 O ATOM 439 CB ALA A 47 2.106 9.371 -14.865 1.00 0.00 C ATOM 0 H ALA A 47 0.178 8.165 -13.251 1.00 0.00 H new ATOM 0 HA ALA A 47 0.447 8.901 -16.115 1.00 0.00 H new ATOM 0 HB1 ALA A 47 2.834 9.273 -15.670 1.00 0.00 H new ATOM 0 HB2 ALA A 47 1.813 10.416 -14.766 1.00 0.00 H new ATOM 0 HB3 ALA A 47 2.550 9.029 -13.930 1.00 0.00 H new ATOM 445 N ASN A 48 0.417 6.131 -14.886 1.00 0.00 N ATOM 446 CA ASN A 48 0.595 4.683 -14.896 1.00 0.00 C ATOM 447 C ASN A 48 2.037 4.245 -14.536 1.00 0.00 C ATOM 448 O ASN A 48 2.527 3.249 -15.071 1.00 0.00 O ATOM 449 CB ASN A 48 0.031 4.089 -16.204 1.00 0.00 C ATOM 450 CG ASN A 48 -0.550 2.686 -16.021 1.00 0.00 C ATOM 451 OD1 ASN A 48 -1.739 2.475 -16.238 1.00 0.00 O ATOM 452 ND2 ASN A 48 0.220 1.715 -15.564 1.00 0.00 N ATOM 0 H ASN A 48 -0.406 6.405 -14.349 1.00 0.00 H new ATOM 0 HA ASN A 48 0.006 4.251 -14.087 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -0.744 4.750 -16.592 1.00 0.00 H new ATOM 0 HB3 ASN A 48 0.823 4.054 -16.952 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -0.174 0.790 -15.392 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.209 1.890 -15.384 1.00 0.00 H new ATOM 459 N GLN A 49 2.741 5.010 -13.687 1.00 0.00 N ATOM 460 CA GLN A 49 4.159 4.828 -13.321 1.00 0.00 C ATOM 461 C GLN A 49 4.421 3.946 -12.086 1.00 0.00 C ATOM 462 O GLN A 49 5.576 3.813 -11.679 1.00 0.00 O ATOM 463 CB GLN A 49 4.836 6.202 -13.107 1.00 0.00 C ATOM 464 CG GLN A 49 4.939 7.067 -14.367 1.00 0.00 C ATOM 465 CD GLN A 49 5.580 6.316 -15.530 1.00 0.00 C ATOM 466 OE1 GLN A 49 6.803 6.207 -15.625 1.00 0.00 O ATOM 467 NE2 GLN A 49 4.765 5.740 -16.393 1.00 0.00 N ATOM 0 H GLN A 49 2.320 5.810 -13.214 1.00 0.00 H new ATOM 0 HA GLN A 49 4.590 4.292 -14.166 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.279 6.753 -12.349 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.838 6.040 -12.711 1.00 0.00 H new ATOM 0 HG2 GLN A 49 3.944 7.403 -14.658 1.00 0.00 H new ATOM 0 HG3 GLN A 49 5.524 7.960 -14.146 1.00 0.00 H new ATOM 0 HE21 GLN A 49 3.756 5.847 -16.291 1.00 0.00 H new ATOM 0 HE22 GLN A 49 5.144 5.188 -17.162 1.00 0.00 H new ATOM 476 N LEU A 50 3.408 3.351 -11.465 1.00 0.00 N ATOM 477 CA LEU A 50 3.568 2.530 -10.255 1.00 0.00 C ATOM 478 C LEU A 50 3.873 1.078 -10.622 1.00 0.00 C ATOM 479 O LEU A 50 3.183 0.531 -11.476 1.00 0.00 O ATOM 480 CB LEU A 50 2.253 2.572 -9.460 1.00 0.00 C ATOM 481 CG LEU A 50 2.238 1.694 -8.186 1.00 0.00 C ATOM 482 CD1 LEU A 50 3.202 2.227 -7.120 1.00 0.00 C ATOM 483 CD2 LEU A 50 0.818 1.562 -7.626 1.00 0.00 C ATOM 0 H LEU A 50 2.442 3.421 -11.785 1.00 0.00 H new ATOM 0 HA LEU A 50 4.395 2.924 -9.665 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.049 3.604 -9.175 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.440 2.255 -10.113 1.00 0.00 H new ATOM 0 HG LEU A 50 2.584 0.700 -8.471 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.163 1.584 -6.241 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.216 2.236 -7.519 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.913 3.240 -6.842 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.836 0.940 -6.731 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.433 2.550 -7.373 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.173 1.102 -8.375 1.00 0.00 H new ATOM 495 N VAL A 51 4.783 0.416 -9.901 1.00 0.00 N ATOM 496 CA VAL A 51 4.977 -1.035 -9.927 1.00 0.00 C ATOM 497 C VAL A 51 4.602 -1.579 -8.547 1.00 0.00 C ATOM 498 O VAL A 51 5.126 -1.150 -7.516 1.00 0.00 O ATOM 499 CB VAL A 51 6.419 -1.403 -10.351 1.00 0.00 C ATOM 500 CG1 VAL A 51 6.741 -2.893 -10.208 1.00 0.00 C ATOM 501 CG2 VAL A 51 6.680 -1.013 -11.819 1.00 0.00 C ATOM 0 H VAL A 51 5.424 0.890 -9.264 1.00 0.00 H new ATOM 0 HA VAL A 51 4.334 -1.496 -10.676 1.00 0.00 H new ATOM 0 HB VAL A 51 7.061 -0.843 -9.671 1.00 0.00 H new ATOM 0 HG11 VAL A 51 7.768 -3.075 -10.524 1.00 0.00 H new ATOM 0 HG12 VAL A 51 6.623 -3.192 -9.167 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.061 -3.474 -10.832 1.00 0.00 H new ATOM 0 HG21 VAL A 51 7.700 -1.283 -12.091 1.00 0.00 H new ATOM 0 HG22 VAL A 51 5.980 -1.542 -12.466 1.00 0.00 H new ATOM 0 HG23 VAL A 51 6.544 0.062 -11.940 1.00 0.00 H new ATOM 511 N TYR A 52 3.661 -2.520 -8.538 1.00 0.00 N ATOM 512 CA TYR A 52 3.475 -3.511 -7.491 1.00 0.00 C ATOM 513 C TYR A 52 4.621 -4.518 -7.592 1.00 0.00 C ATOM 514 O TYR A 52 4.931 -4.974 -8.695 1.00 0.00 O ATOM 515 CB TYR A 52 2.121 -4.193 -7.739 1.00 0.00 C ATOM 516 CG TYR A 52 1.783 -5.328 -6.794 1.00 0.00 C ATOM 517 CD1 TYR A 52 2.188 -6.649 -7.082 1.00 0.00 C ATOM 518 CD2 TYR A 52 1.045 -5.060 -5.628 1.00 0.00 C ATOM 519 CE1 TYR A 52 1.865 -7.696 -6.198 1.00 0.00 C ATOM 520 CE2 TYR A 52 0.733 -6.101 -4.737 1.00 0.00 C ATOM 521 CZ TYR A 52 1.138 -7.422 -5.017 1.00 0.00 C ATOM 522 OH TYR A 52 0.817 -8.404 -4.132 1.00 0.00 O ATOM 0 H TYR A 52 2.981 -2.613 -9.293 1.00 0.00 H new ATOM 0 HA TYR A 52 3.479 -3.069 -6.495 1.00 0.00 H new ATOM 0 HB2 TYR A 52 1.336 -3.440 -7.671 1.00 0.00 H new ATOM 0 HB3 TYR A 52 2.108 -4.576 -8.759 1.00 0.00 H new ATOM 0 HD1 TYR A 52 2.747 -6.857 -7.982 1.00 0.00 H new ATOM 0 HD2 TYR A 52 0.717 -4.053 -5.417 1.00 0.00 H new ATOM 0 HE1 TYR A 52 2.172 -8.707 -6.422 1.00 0.00 H new ATOM 0 HE2 TYR A 52 0.181 -5.888 -3.834 1.00 0.00 H new ATOM 0 HH TYR A 52 0.317 -8.018 -3.383 1.00 0.00 H new ATOM 532 N GLY A 53 5.239 -4.897 -6.473 1.00 0.00 N ATOM 533 CA GLY A 53 6.274 -5.921 -6.470 1.00 0.00 C ATOM 534 C GLY A 53 6.274 -6.735 -5.190 1.00 0.00 C ATOM 535 O GLY A 53 5.628 -6.373 -4.204 1.00 0.00 O ATOM 0 H GLY A 53 5.036 -4.505 -5.553 1.00 0.00 H new ATOM 0 HA2 GLY A 53 6.127 -6.586 -7.321 1.00 0.00 H new ATOM 0 HA3 GLY A 53 7.249 -5.450 -6.599 1.00 0.00 H new ATOM 539 N ILE A 54 7.013 -7.841 -5.227 1.00 0.00 N ATOM 540 CA ILE A 54 7.292 -8.714 -4.104 1.00 0.00 C ATOM 541 C ILE A 54 8.806 -8.670 -3.897 1.00 0.00 C ATOM 542 O ILE A 54 9.554 -8.749 -4.872 1.00 0.00 O ATOM 543 CB ILE A 54 6.769 -10.133 -4.412 1.00 0.00 C ATOM 544 CG1 ILE A 54 5.233 -10.179 -4.575 1.00 0.00 C ATOM 545 CG2 ILE A 54 7.243 -11.206 -3.411 1.00 0.00 C ATOM 546 CD1 ILE A 54 4.419 -10.042 -3.279 1.00 0.00 C ATOM 0 H ILE A 54 7.453 -8.164 -6.089 1.00 0.00 H new ATOM 0 HA ILE A 54 6.791 -8.399 -3.189 1.00 0.00 H new ATOM 0 HB ILE A 54 7.219 -10.384 -5.373 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.935 -9.381 -5.255 1.00 0.00 H new ATOM 0 HG13 ILE A 54 4.965 -11.122 -5.052 1.00 0.00 H new ATOM 0 HG21 ILE A 54 6.833 -12.175 -3.696 1.00 0.00 H new ATOM 0 HG22 ILE A 54 8.332 -11.256 -3.419 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.899 -10.947 -2.410 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.355 -10.088 -3.511 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.677 -10.854 -2.599 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.646 -9.087 -2.806 1.00 0.00 H new ATOM 558 N VAL A 55 9.225 -8.525 -2.640 1.00 0.00 N ATOM 559 CA VAL A 55 10.592 -8.461 -2.150 1.00 0.00 C ATOM 560 C VAL A 55 11.420 -9.597 -2.753 1.00 0.00 C ATOM 561 O VAL A 55 12.256 -9.327 -3.615 1.00 0.00 O ATOM 562 CB VAL A 55 10.561 -8.425 -0.596 1.00 0.00 C ATOM 563 CG1 VAL A 55 11.932 -8.731 0.013 1.00 0.00 C ATOM 564 CG2 VAL A 55 10.131 -7.028 -0.126 1.00 0.00 C ATOM 0 H VAL A 55 8.554 -8.443 -1.876 1.00 0.00 H new ATOM 0 HA VAL A 55 11.093 -7.548 -2.471 1.00 0.00 H new ATOM 0 HB VAL A 55 9.855 -9.188 -0.268 1.00 0.00 H new ATOM 0 HG11 VAL A 55 11.863 -8.695 1.100 1.00 0.00 H new ATOM 0 HG12 VAL A 55 12.254 -9.725 -0.297 1.00 0.00 H new ATOM 0 HG13 VAL A 55 12.656 -7.991 -0.330 1.00 0.00 H new ATOM 0 HG21 VAL A 55 10.109 -7.001 0.963 1.00 0.00 H new ATOM 0 HG22 VAL A 55 10.841 -6.286 -0.493 1.00 0.00 H new ATOM 0 HG23 VAL A 55 9.138 -6.803 -0.515 1.00 0.00 H new ATOM 574 N LYS A 56 11.153 -10.836 -2.311 1.00 0.00 N ATOM 575 CA LYS A 56 11.963 -12.037 -2.509 1.00 0.00 C ATOM 576 C LYS A 56 13.390 -11.907 -1.949 1.00 0.00 C ATOM 577 O LYS A 56 13.907 -10.803 -1.781 1.00 0.00 O ATOM 578 CB LYS A 56 11.898 -12.452 -3.992 1.00 0.00 C ATOM 579 CG LYS A 56 10.485 -12.944 -4.347 1.00 0.00 C ATOM 580 CD LYS A 56 10.498 -14.273 -5.103 1.00 0.00 C ATOM 581 CE LYS A 56 9.068 -14.804 -5.167 1.00 0.00 C ATOM 582 NZ LYS A 56 8.936 -15.994 -6.027 1.00 0.00 N ATOM 0 H LYS A 56 10.310 -11.033 -1.772 1.00 0.00 H new ATOM 0 HA LYS A 56 11.540 -12.850 -1.918 1.00 0.00 H new ATOM 0 HB2 LYS A 56 12.166 -11.606 -4.625 1.00 0.00 H new ATOM 0 HB3 LYS A 56 12.625 -13.240 -4.188 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.903 -13.056 -3.432 1.00 0.00 H new ATOM 0 HG3 LYS A 56 9.983 -12.190 -4.954 1.00 0.00 H new ATOM 0 HD2 LYS A 56 10.896 -14.134 -6.108 1.00 0.00 H new ATOM 0 HD3 LYS A 56 11.147 -14.990 -4.599 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.732 -15.051 -4.160 1.00 0.00 H new ATOM 0 HE3 LYS A 56 8.410 -14.018 -5.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.945 -16.310 -6.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 9.229 -15.756 -6.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 9.541 -16.756 -5.660 1.00 0.00 H new ATOM 596 N PRO A 57 14.077 -13.033 -1.679 1.00 0.00 N ATOM 597 CA PRO A 57 15.442 -12.998 -1.159 1.00 0.00 C ATOM 598 C PRO A 57 16.437 -12.525 -2.215 1.00 0.00 C ATOM 599 O PRO A 57 17.582 -12.216 -1.899 1.00 0.00 O ATOM 600 CB PRO A 57 15.745 -14.427 -0.733 1.00 0.00 C ATOM 601 CG PRO A 57 14.861 -15.278 -1.637 1.00 0.00 C ATOM 602 CD PRO A 57 13.617 -14.411 -1.787 1.00 0.00 C ATOM 0 HA PRO A 57 15.532 -12.294 -0.332 1.00 0.00 H new ATOM 0 HB2 PRO A 57 16.800 -14.668 -0.865 1.00 0.00 H new ATOM 0 HB3 PRO A 57 15.511 -14.588 0.319 1.00 0.00 H new ATOM 0 HG2 PRO A 57 15.335 -15.478 -2.598 1.00 0.00 H new ATOM 0 HG3 PRO A 57 14.631 -16.244 -1.188 1.00 0.00 H new ATOM 0 HD2 PRO A 57 13.131 -14.587 -2.747 1.00 0.00 H new ATOM 0 HD3 PRO A 57 12.885 -14.641 -1.013 1.00 0.00 H new ATOM 610 N SER A 58 16.004 -12.463 -3.471 1.00 0.00 N ATOM 611 CA SER A 58 16.763 -11.949 -4.591 1.00 0.00 C ATOM 612 C SER A 58 17.149 -10.470 -4.412 1.00 0.00 C ATOM 613 O SER A 58 18.004 -9.999 -5.160 1.00 0.00 O ATOM 614 CB SER A 58 15.929 -12.148 -5.867 1.00 0.00 C ATOM 615 OG SER A 58 15.305 -13.434 -5.906 1.00 0.00 O ATOM 0 H SER A 58 15.074 -12.785 -3.740 1.00 0.00 H new ATOM 0 HA SER A 58 17.702 -12.497 -4.660 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.165 -11.373 -5.925 1.00 0.00 H new ATOM 0 HB3 SER A 58 16.570 -12.030 -6.741 1.00 0.00 H new ATOM 0 HG SER A 58 14.784 -13.520 -6.731 1.00 0.00 H new ATOM 621 N ASP A 59 16.557 -9.728 -3.467 1.00 0.00 N ATOM 622 CA ASP A 59 16.765 -8.287 -3.331 1.00 0.00 C ATOM 623 C ASP A 59 17.083 -7.881 -1.892 1.00 0.00 C ATOM 624 O ASP A 59 17.411 -8.731 -1.057 1.00 0.00 O ATOM 625 CB ASP A 59 15.600 -7.513 -3.973 1.00 0.00 C ATOM 626 CG ASP A 59 15.949 -6.948 -5.354 1.00 0.00 C ATOM 627 OD1 ASP A 59 17.135 -6.634 -5.637 1.00 0.00 O ATOM 628 OD2 ASP A 59 15.001 -6.817 -6.158 1.00 0.00 O ATOM 0 H ASP A 59 15.918 -10.116 -2.773 1.00 0.00 H new ATOM 0 HA ASP A 59 17.659 -8.007 -3.889 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.738 -8.174 -4.064 1.00 0.00 H new ATOM 0 HB3 ASP A 59 15.307 -6.695 -3.315 1.00 0.00 H new ATOM 633 N THR A 60 17.161 -6.579 -1.626 1.00 0.00 N ATOM 634 CA THR A 60 18.013 -5.991 -0.603 1.00 0.00 C ATOM 635 C THR A 60 17.143 -5.066 0.257 1.00 0.00 C ATOM 636 O THR A 60 16.743 -3.969 -0.152 1.00 0.00 O ATOM 637 CB THR A 60 19.171 -5.287 -1.329 1.00 0.00 C ATOM 638 OG1 THR A 60 19.780 -6.168 -2.261 1.00 0.00 O ATOM 639 CG2 THR A 60 20.251 -4.776 -0.386 1.00 0.00 C ATOM 0 H THR A 60 16.614 -5.884 -2.135 1.00 0.00 H new ATOM 0 HA THR A 60 18.455 -6.719 0.077 1.00 0.00 H new ATOM 0 HB THR A 60 18.726 -4.429 -1.832 1.00 0.00 H new ATOM 0 HG1 THR A 60 20.514 -5.706 -2.717 1.00 0.00 H new ATOM 0 HG21 THR A 60 21.038 -4.290 -0.963 1.00 0.00 H new ATOM 0 HG22 THR A 60 19.816 -4.059 0.310 1.00 0.00 H new ATOM 0 HG23 THR A 60 20.673 -5.612 0.171 1.00 0.00 H new ATOM 647 N VAL A 61 16.771 -5.567 1.432 1.00 0.00 N ATOM 648 CA VAL A 61 15.583 -5.168 2.170 1.00 0.00 C ATOM 649 C VAL A 61 15.856 -5.153 3.674 1.00 0.00 C ATOM 650 O VAL A 61 16.779 -5.824 4.152 1.00 0.00 O ATOM 651 CB VAL A 61 14.418 -6.112 1.820 1.00 0.00 C ATOM 652 CG1 VAL A 61 13.867 -5.782 0.425 1.00 0.00 C ATOM 653 CG2 VAL A 61 14.822 -7.593 1.928 1.00 0.00 C ATOM 0 H VAL A 61 17.310 -6.288 1.911 1.00 0.00 H new ATOM 0 HA VAL A 61 15.307 -4.154 1.882 1.00 0.00 H new ATOM 0 HB VAL A 61 13.627 -5.951 2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 61 13.044 -6.457 0.190 1.00 0.00 H new ATOM 0 HG12 VAL A 61 13.508 -4.753 0.410 1.00 0.00 H new ATOM 0 HG13 VAL A 61 14.657 -5.902 -0.316 1.00 0.00 H new ATOM 0 HG21 VAL A 61 13.969 -8.222 1.672 1.00 0.00 H new ATOM 0 HG22 VAL A 61 15.643 -7.797 1.241 1.00 0.00 H new ATOM 0 HG23 VAL A 61 15.140 -7.810 2.948 1.00 0.00 H new ATOM 663 N PRO A 62 15.065 -4.388 4.442 1.00 0.00 N ATOM 664 CA PRO A 62 15.178 -4.364 5.889 1.00 0.00 C ATOM 665 C PRO A 62 14.764 -5.706 6.510 1.00 0.00 C ATOM 666 O PRO A 62 14.216 -6.592 5.851 1.00 0.00 O ATOM 667 CB PRO A 62 14.281 -3.211 6.358 1.00 0.00 C ATOM 668 CG PRO A 62 13.387 -2.862 5.178 1.00 0.00 C ATOM 669 CD PRO A 62 14.076 -3.440 3.955 1.00 0.00 C ATOM 0 HA PRO A 62 16.209 -4.210 6.206 1.00 0.00 H new ATOM 0 HB2 PRO A 62 13.687 -3.507 7.222 1.00 0.00 H new ATOM 0 HB3 PRO A 62 14.879 -2.351 6.661 1.00 0.00 H new ATOM 0 HG2 PRO A 62 12.391 -3.286 5.303 1.00 0.00 H new ATOM 0 HG3 PRO A 62 13.265 -1.783 5.085 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.356 -3.933 3.302 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.550 -2.652 3.369 1.00 0.00 H new ATOM 677 N ALA A 63 14.987 -5.842 7.814 1.00 0.00 N ATOM 678 CA ALA A 63 14.595 -7.011 8.583 1.00 0.00 C ATOM 679 C ALA A 63 13.068 -7.140 8.665 1.00 0.00 C ATOM 680 O ALA A 63 12.368 -6.137 8.859 1.00 0.00 O ATOM 681 CB ALA A 63 15.181 -6.878 9.986 1.00 0.00 C ATOM 0 H ALA A 63 15.454 -5.128 8.373 1.00 0.00 H new ATOM 0 HA ALA A 63 14.974 -7.907 8.091 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.899 -7.746 10.582 1.00 0.00 H new ATOM 0 HB2 ALA A 63 16.268 -6.819 9.922 1.00 0.00 H new ATOM 0 HB3 ALA A 63 14.796 -5.974 10.457 1.00 0.00 H new ATOM 687 N GLY A 64 12.558 -8.372 8.585 1.00 0.00 N ATOM 688 CA GLY A 64 11.139 -8.686 8.727 1.00 0.00 C ATOM 689 C GLY A 64 10.326 -8.266 7.557 1.00 0.00 C ATOM 690 O GLY A 64 9.224 -7.735 7.695 1.00 0.00 O ATOM 0 H GLY A 64 13.136 -9.195 8.416 1.00 0.00 H new ATOM 0 HA2 GLY A 64 11.024 -9.760 8.874 1.00 0.00 H new ATOM 0 HA3 GLY A 64 10.754 -8.199 9.623 1.00 0.00 H new ATOM 694 N VAL A 65 10.894 -8.542 6.401 1.00 0.00 N ATOM 695 CA VAL A 65 10.296 -8.276 5.145 1.00 0.00 C ATOM 696 C VAL A 65 11.182 -8.968 4.135 1.00 0.00 C ATOM 697 O VAL A 65 12.061 -8.378 3.520 1.00 0.00 O ATOM 698 CB VAL A 65 10.018 -6.781 5.022 1.00 0.00 C ATOM 699 CG1 VAL A 65 11.119 -5.800 5.472 1.00 0.00 C ATOM 700 CG2 VAL A 65 9.809 -6.395 3.611 1.00 0.00 C ATOM 0 H VAL A 65 11.816 -8.972 6.327 1.00 0.00 H new ATOM 0 HA VAL A 65 9.297 -8.680 4.978 1.00 0.00 H new ATOM 0 HB VAL A 65 9.158 -6.687 5.685 1.00 0.00 H new ATOM 0 HG11 VAL A 65 10.776 -4.776 5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 65 11.340 -5.960 6.527 1.00 0.00 H new ATOM 0 HG13 VAL A 65 12.020 -5.969 4.883 1.00 0.00 H new ATOM 0 HG21 VAL A 65 9.613 -5.324 3.552 1.00 0.00 H new ATOM 0 HG22 VAL A 65 10.702 -6.633 3.033 1.00 0.00 H new ATOM 0 HG23 VAL A 65 8.958 -6.943 3.206 1.00 0.00 H new ATOM 710 N ASP A 66 10.958 -10.268 4.023 1.00 0.00 N ATOM 711 CA ASP A 66 11.411 -11.057 2.877 1.00 0.00 C ATOM 712 C ASP A 66 10.296 -11.283 1.852 1.00 0.00 C ATOM 713 O ASP A 66 10.513 -11.802 0.757 1.00 0.00 O ATOM 714 CB ASP A 66 12.029 -12.371 3.364 1.00 0.00 C ATOM 715 CG ASP A 66 13.149 -12.795 2.422 1.00 0.00 C ATOM 716 OD1 ASP A 66 14.302 -12.367 2.663 1.00 0.00 O ATOM 717 OD2 ASP A 66 12.874 -13.575 1.489 1.00 0.00 O ATOM 0 H ASP A 66 10.455 -10.812 4.724 1.00 0.00 H new ATOM 0 HA ASP A 66 12.181 -10.491 2.353 1.00 0.00 H new ATOM 0 HB2 ASP A 66 12.418 -12.248 4.375 1.00 0.00 H new ATOM 0 HB3 ASP A 66 11.266 -13.148 3.409 1.00 0.00 H new ATOM 722 N ASP A 67 9.083 -10.862 2.213 1.00 0.00 N ATOM 723 CA ASP A 67 7.864 -11.200 1.480 1.00 0.00 C ATOM 724 C ASP A 67 6.749 -10.153 1.614 1.00 0.00 C ATOM 725 O ASP A 67 5.703 -10.300 0.981 1.00 0.00 O ATOM 726 CB ASP A 67 7.346 -12.560 1.964 1.00 0.00 C ATOM 727 CG ASP A 67 6.507 -12.416 3.233 1.00 0.00 C ATOM 728 OD1 ASP A 67 7.018 -11.838 4.220 1.00 0.00 O ATOM 729 OD2 ASP A 67 5.319 -12.815 3.222 1.00 0.00 O ATOM 0 H ASP A 67 8.919 -10.272 3.029 1.00 0.00 H new ATOM 0 HA ASP A 67 8.133 -11.231 0.424 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.747 -13.023 1.180 1.00 0.00 H new ATOM 0 HB3 ASP A 67 8.188 -13.225 2.156 1.00 0.00 H new ATOM 734 N TYR A 68 6.943 -9.074 2.380 1.00 0.00 N ATOM 735 CA TYR A 68 5.929 -8.022 2.515 1.00 0.00 C ATOM 736 C TYR A 68 5.801 -7.303 1.174 1.00 0.00 C ATOM 737 O TYR A 68 6.798 -6.746 0.710 1.00 0.00 O ATOM 738 CB TYR A 68 6.281 -7.008 3.580 1.00 0.00 C ATOM 739 CG TYR A 68 5.893 -7.397 4.992 1.00 0.00 C ATOM 740 CD1 TYR A 68 6.063 -8.717 5.449 1.00 0.00 C ATOM 741 CD2 TYR A 68 5.264 -6.447 5.821 1.00 0.00 C ATOM 742 CE1 TYR A 68 5.676 -9.076 6.749 1.00 0.00 C ATOM 743 CE2 TYR A 68 4.854 -6.799 7.118 1.00 0.00 C ATOM 744 CZ TYR A 68 5.064 -8.115 7.598 1.00 0.00 C ATOM 745 OH TYR A 68 4.683 -8.425 8.868 1.00 0.00 O ATOM 0 H TYR A 68 7.794 -8.906 2.917 1.00 0.00 H new ATOM 0 HA TYR A 68 4.993 -8.495 2.811 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.356 -6.832 3.551 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.797 -6.063 3.334 1.00 0.00 H new ATOM 0 HD1 TYR A 68 6.495 -9.459 4.794 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.096 -5.444 5.458 1.00 0.00 H new ATOM 0 HE1 TYR A 68 5.843 -10.082 7.104 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.378 -6.064 7.750 1.00 0.00 H new ATOM 0 HH TYR A 68 4.080 -9.197 8.849 1.00 0.00 H new ATOM 755 N SER A 69 4.656 -7.371 0.504 1.00 0.00 N ATOM 756 CA SER A 69 4.426 -6.785 -0.806 1.00 0.00 C ATOM 757 C SER A 69 4.789 -5.298 -0.784 1.00 0.00 C ATOM 758 O SER A 69 4.490 -4.633 0.210 1.00 0.00 O ATOM 759 CB SER A 69 2.942 -6.985 -1.111 1.00 0.00 C ATOM 760 OG SER A 69 2.487 -8.278 -0.730 1.00 0.00 O ATOM 0 H SER A 69 3.836 -7.853 0.873 1.00 0.00 H new ATOM 0 HA SER A 69 5.043 -7.253 -1.573 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.359 -6.227 -0.587 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.769 -6.840 -2.177 1.00 0.00 H new ATOM 0 HG SER A 69 1.534 -8.364 -0.940 1.00 0.00 H new ATOM 766 N TYR A 70 5.436 -4.782 -1.838 1.00 0.00 N ATOM 767 CA TYR A 70 5.885 -3.392 -1.904 1.00 0.00 C ATOM 768 C TYR A 70 5.309 -2.644 -3.104 1.00 0.00 C ATOM 769 O TYR A 70 4.709 -3.241 -4.005 1.00 0.00 O ATOM 770 CB TYR A 70 7.416 -3.297 -1.837 1.00 0.00 C ATOM 771 CG TYR A 70 8.190 -3.760 -3.064 1.00 0.00 C ATOM 772 CD1 TYR A 70 8.344 -2.921 -4.187 1.00 0.00 C ATOM 773 CD2 TYR A 70 8.832 -5.011 -3.050 1.00 0.00 C ATOM 774 CE1 TYR A 70 9.135 -3.329 -5.278 1.00 0.00 C ATOM 775 CE2 TYR A 70 9.649 -5.403 -4.123 1.00 0.00 C ATOM 776 CZ TYR A 70 9.815 -4.563 -5.240 1.00 0.00 C ATOM 777 OH TYR A 70 10.649 -4.928 -6.250 1.00 0.00 O ATOM 0 H TYR A 70 5.662 -5.324 -2.672 1.00 0.00 H new ATOM 0 HA TYR A 70 5.489 -2.888 -1.022 1.00 0.00 H new ATOM 0 HB2 TYR A 70 7.683 -2.259 -1.639 1.00 0.00 H new ATOM 0 HB3 TYR A 70 7.755 -3.882 -0.982 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.852 -1.960 -4.210 1.00 0.00 H new ATOM 0 HD2 TYR A 70 8.696 -5.675 -2.209 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.221 -2.694 -6.147 1.00 0.00 H new ATOM 0 HE2 TYR A 70 10.154 -6.357 -4.091 1.00 0.00 H new ATOM 0 HH TYR A 70 11.032 -5.809 -6.056 1.00 0.00 H new ATOM 787 N LEU A 71 5.459 -1.319 -3.077 1.00 0.00 N ATOM 788 CA LEU A 71 4.922 -0.350 -4.022 1.00 0.00 C ATOM 789 C LEU A 71 5.984 0.736 -4.179 1.00 0.00 C ATOM 790 O LEU A 71 6.417 1.297 -3.167 1.00 0.00 O ATOM 791 CB LEU A 71 3.631 0.268 -3.445 1.00 0.00 C ATOM 792 CG LEU A 71 2.421 -0.683 -3.433 1.00 0.00 C ATOM 793 CD1 LEU A 71 1.335 -0.141 -2.498 1.00 0.00 C ATOM 794 CD2 LEU A 71 1.843 -0.889 -4.832 1.00 0.00 C ATOM 0 H LEU A 71 5.999 -0.867 -2.339 1.00 0.00 H new ATOM 0 HA LEU A 71 4.685 -0.814 -4.979 1.00 0.00 H new ATOM 0 HB2 LEU A 71 3.826 0.601 -2.426 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.376 1.154 -4.026 1.00 0.00 H new ATOM 0 HG LEU A 71 2.769 -1.650 -3.071 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.483 -0.821 -2.497 1.00 0.00 H new ATOM 0 HD12 LEU A 71 1.734 -0.057 -1.487 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.014 0.842 -2.844 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.991 -1.567 -4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.519 0.070 -5.236 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.606 -1.317 -5.482 1.00 0.00 H new ATOM 806 N VAL A 72 6.403 1.023 -5.412 1.00 0.00 N ATOM 807 CA VAL A 72 7.434 2.009 -5.744 1.00 0.00 C ATOM 808 C VAL A 72 7.232 2.450 -7.205 1.00 0.00 C ATOM 809 O VAL A 72 6.636 1.695 -7.985 1.00 0.00 O ATOM 810 CB VAL A 72 8.821 1.382 -5.462 1.00 0.00 C ATOM 811 CG1 VAL A 72 9.185 0.230 -6.411 1.00 0.00 C ATOM 812 CG2 VAL A 72 9.934 2.426 -5.469 1.00 0.00 C ATOM 0 H VAL A 72 6.021 0.559 -6.236 1.00 0.00 H new ATOM 0 HA VAL A 72 7.365 2.908 -5.131 1.00 0.00 H new ATOM 0 HB VAL A 72 8.734 0.960 -4.461 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.170 -0.158 -6.151 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.446 -0.565 -6.318 1.00 0.00 H new ATOM 0 HG13 VAL A 72 9.198 0.595 -7.438 1.00 0.00 H new ATOM 0 HG21 VAL A 72 10.889 1.941 -5.267 1.00 0.00 H new ATOM 0 HG22 VAL A 72 9.972 2.910 -6.445 1.00 0.00 H new ATOM 0 HG23 VAL A 72 9.737 3.173 -4.700 1.00 0.00 H new ATOM 822 N ALA A 73 7.686 3.643 -7.599 1.00 0.00 N ATOM 823 CA ALA A 73 7.512 4.171 -8.951 1.00 0.00 C ATOM 824 C ALA A 73 8.802 3.997 -9.764 1.00 0.00 C ATOM 825 O ALA A 73 9.890 3.838 -9.206 1.00 0.00 O ATOM 826 CB ALA A 73 7.082 5.639 -8.890 1.00 0.00 C ATOM 0 H ALA A 73 8.191 4.276 -6.978 1.00 0.00 H new ATOM 0 HA ALA A 73 6.725 3.610 -9.455 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.955 6.023 -9.902 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.139 5.720 -8.350 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.846 6.221 -8.374 1.00 0.00 H new ATOM 832 N ALA A 74 8.669 3.985 -11.095 1.00 0.00 N ATOM 833 CA ALA A 74 9.729 3.541 -11.999 1.00 0.00 C ATOM 834 C ALA A 74 11.033 4.327 -11.882 1.00 0.00 C ATOM 835 O ALA A 74 12.099 3.795 -12.210 1.00 0.00 O ATOM 836 CB ALA A 74 9.232 3.560 -13.450 1.00 0.00 C ATOM 0 H ALA A 74 7.820 4.284 -11.574 1.00 0.00 H new ATOM 0 HA ALA A 74 9.968 2.523 -11.691 1.00 0.00 H new ATOM 0 HB1 ALA A 74 10.031 3.227 -14.113 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.376 2.893 -13.550 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.935 4.574 -13.720 1.00 0.00 H new ATOM 842 N ASP A 75 10.950 5.568 -11.431 1.00 0.00 N ATOM 843 CA ASP A 75 12.073 6.500 -11.358 1.00 0.00 C ATOM 844 C ASP A 75 12.549 6.717 -9.938 1.00 0.00 C ATOM 845 O ASP A 75 13.569 7.378 -9.733 1.00 0.00 O ATOM 846 CB ASP A 75 11.677 7.897 -11.857 1.00 0.00 C ATOM 847 CG ASP A 75 11.307 8.071 -13.320 1.00 0.00 C ATOM 848 OD1 ASP A 75 10.919 7.107 -14.023 1.00 0.00 O ATOM 849 OD2 ASP A 75 11.305 9.252 -13.743 1.00 0.00 O ATOM 0 H ASP A 75 10.075 5.971 -11.095 1.00 0.00 H new ATOM 0 HA ASP A 75 12.850 6.046 -11.973 1.00 0.00 H new ATOM 0 HB2 ASP A 75 10.830 8.234 -11.259 1.00 0.00 H new ATOM 0 HB3 ASP A 75 12.506 8.572 -11.643 1.00 0.00 H new ATOM 854 N ASP A 76 11.810 6.205 -8.965 1.00 0.00 N ATOM 855 CA ASP A 76 12.057 6.435 -7.556 1.00 0.00 C ATOM 856 C ASP A 76 12.230 5.096 -6.852 1.00 0.00 C ATOM 857 O ASP A 76 11.945 4.953 -5.664 1.00 0.00 O ATOM 858 CB ASP A 76 11.025 7.416 -6.980 1.00 0.00 C ATOM 859 CG ASP A 76 9.611 6.914 -6.742 1.00 0.00 C ATOM 860 OD1 ASP A 76 9.337 5.702 -6.630 1.00 0.00 O ATOM 861 OD2 ASP A 76 8.744 7.804 -6.572 1.00 0.00 O ATOM 0 H ASP A 76 11.004 5.605 -9.141 1.00 0.00 H new ATOM 0 HA ASP A 76 13.000 6.952 -7.381 1.00 0.00 H new ATOM 0 HB2 ASP A 76 11.411 7.786 -6.030 1.00 0.00 H new ATOM 0 HB3 ASP A 76 10.966 8.271 -7.654 1.00 0.00 H new ATOM 866 N GLN A 77 12.793 4.124 -7.588 1.00 0.00 N ATOM 867 CA GLN A 77 13.176 2.810 -7.063 1.00 0.00 C ATOM 868 C GLN A 77 14.055 2.884 -5.799 1.00 0.00 C ATOM 869 O GLN A 77 14.091 1.919 -5.034 1.00 0.00 O ATOM 870 CB GLN A 77 13.884 1.974 -8.141 1.00 0.00 C ATOM 871 CG GLN A 77 12.952 1.464 -9.256 1.00 0.00 C ATOM 872 CD GLN A 77 13.677 0.436 -10.127 1.00 0.00 C ATOM 873 OE1 GLN A 77 14.848 0.611 -10.461 1.00 0.00 O ATOM 874 NE2 GLN A 77 13.058 -0.668 -10.515 1.00 0.00 N ATOM 0 H GLN A 77 12.997 4.235 -8.581 1.00 0.00 H new ATOM 0 HA GLN A 77 12.244 2.325 -6.773 1.00 0.00 H new ATOM 0 HB2 GLN A 77 14.675 2.575 -8.590 1.00 0.00 H new ATOM 0 HB3 GLN A 77 14.365 1.119 -7.665 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.061 1.015 -8.817 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.618 2.300 -9.870 1.00 0.00 H new ATOM 0 HE21 GLN A 77 12.087 -0.829 -10.247 1.00 0.00 H new ATOM 0 HE22 GLN A 77 13.552 -1.357 -11.082 1.00 0.00 H new ATOM 883 N ASP A 78 14.755 3.992 -5.547 1.00 0.00 N ATOM 884 CA ASP A 78 15.552 4.249 -4.338 1.00 0.00 C ATOM 885 C ASP A 78 15.022 5.435 -3.513 1.00 0.00 C ATOM 886 O ASP A 78 15.633 5.811 -2.511 1.00 0.00 O ATOM 887 CB ASP A 78 17.048 4.373 -4.683 1.00 0.00 C ATOM 888 CG ASP A 78 17.429 5.649 -5.435 1.00 0.00 C ATOM 889 OD1 ASP A 78 17.410 6.755 -4.857 1.00 0.00 O ATOM 890 OD2 ASP A 78 17.753 5.558 -6.643 1.00 0.00 O ATOM 0 H ASP A 78 14.785 4.770 -6.206 1.00 0.00 H new ATOM 0 HA ASP A 78 15.443 3.383 -3.685 1.00 0.00 H new ATOM 0 HB2 ASP A 78 17.625 4.327 -3.759 1.00 0.00 H new ATOM 0 HB3 ASP A 78 17.340 3.512 -5.285 1.00 0.00 H new ATOM 895 N GLY A 79 13.870 5.993 -3.890 1.00 0.00 N ATOM 896 CA GLY A 79 13.198 7.109 -3.241 1.00 0.00 C ATOM 897 C GLY A 79 12.313 6.612 -2.101 1.00 0.00 C ATOM 898 O GLY A 79 12.791 5.898 -1.214 1.00 0.00 O ATOM 0 H GLY A 79 13.356 5.655 -4.703 1.00 0.00 H new ATOM 0 HA2 GLY A 79 13.937 7.811 -2.856 1.00 0.00 H new ATOM 0 HA3 GLY A 79 12.593 7.650 -3.969 1.00 0.00 H new ATOM 902 N THR A 80 11.024 6.977 -2.104 1.00 0.00 N ATOM 903 CA THR A 80 10.038 6.400 -1.183 1.00 0.00 C ATOM 904 C THR A 80 9.902 4.899 -1.501 1.00 0.00 C ATOM 905 O THR A 80 10.235 4.446 -2.594 1.00 0.00 O ATOM 906 CB THR A 80 8.678 7.126 -1.288 1.00 0.00 C ATOM 907 OG1 THR A 80 8.851 8.508 -1.483 1.00 0.00 O ATOM 908 CG2 THR A 80 7.776 7.004 -0.064 1.00 0.00 C ATOM 0 H THR A 80 10.638 7.675 -2.740 1.00 0.00 H new ATOM 0 HA THR A 80 10.376 6.527 -0.155 1.00 0.00 H new ATOM 0 HB THR A 80 8.203 6.627 -2.132 1.00 0.00 H new ATOM 0 HG1 THR A 80 7.974 8.942 -1.548 1.00 0.00 H new ATOM 0 HG21 THR A 80 6.848 7.548 -0.240 1.00 0.00 H new ATOM 0 HG22 THR A 80 7.551 5.953 0.119 1.00 0.00 H new ATOM 0 HG23 THR A 80 8.283 7.423 0.805 1.00 0.00 H new ATOM 916 N ILE A 81 9.390 4.101 -0.568 1.00 0.00 N ATOM 917 CA ILE A 81 8.826 2.788 -0.843 1.00 0.00 C ATOM 918 C ILE A 81 7.886 2.496 0.321 1.00 0.00 C ATOM 919 O ILE A 81 8.117 2.938 1.456 1.00 0.00 O ATOM 920 CB ILE A 81 9.932 1.713 -1.039 1.00 0.00 C ATOM 921 CG1 ILE A 81 9.329 0.303 -1.221 1.00 0.00 C ATOM 922 CG2 ILE A 81 10.981 1.712 0.093 1.00 0.00 C ATOM 923 CD1 ILE A 81 10.286 -0.644 -1.965 1.00 0.00 C ATOM 0 H ILE A 81 9.356 4.356 0.419 1.00 0.00 H new ATOM 0 HA ILE A 81 8.277 2.766 -1.784 1.00 0.00 H new ATOM 0 HB ILE A 81 10.454 1.988 -1.956 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.090 -0.118 -0.244 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.392 0.378 -1.773 1.00 0.00 H new ATOM 0 HG21 ILE A 81 11.725 0.940 -0.102 1.00 0.00 H new ATOM 0 HG22 ILE A 81 11.470 2.685 0.137 1.00 0.00 H new ATOM 0 HG23 ILE A 81 10.489 1.510 1.045 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.820 -1.624 -2.070 1.00 0.00 H new ATOM 0 HD12 ILE A 81 10.504 -0.238 -2.953 1.00 0.00 H new ATOM 0 HD13 ILE A 81 11.213 -0.742 -1.400 1.00 0.00 H new ATOM 935 N ILE A 82 6.813 1.766 0.045 1.00 0.00 N ATOM 936 CA ILE A 82 5.872 1.322 1.051 1.00 0.00 C ATOM 937 C ILE A 82 5.750 -0.178 0.873 1.00 0.00 C ATOM 938 O ILE A 82 5.647 -0.670 -0.249 1.00 0.00 O ATOM 939 CB ILE A 82 4.536 2.092 0.932 1.00 0.00 C ATOM 940 CG1 ILE A 82 4.801 3.603 1.144 1.00 0.00 C ATOM 941 CG2 ILE A 82 3.505 1.546 1.948 1.00 0.00 C ATOM 942 CD1 ILE A 82 3.615 4.503 0.818 1.00 0.00 C ATOM 0 H ILE A 82 6.573 1.464 -0.899 1.00 0.00 H new ATOM 0 HA ILE A 82 6.208 1.533 2.066 1.00 0.00 H new ATOM 0 HB ILE A 82 4.115 1.949 -0.063 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.091 3.766 2.182 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.648 3.901 0.526 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.571 2.099 1.851 1.00 0.00 H new ATOM 0 HG22 ILE A 82 3.324 0.489 1.750 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.893 1.664 2.960 1.00 0.00 H new ATOM 0 HD11 ILE A 82 3.888 5.543 0.995 1.00 0.00 H new ATOM 0 HD12 ILE A 82 3.337 4.373 -0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 82 2.771 4.237 1.454 1.00 0.00 H new ATOM 954 N PHE A 83 5.779 -0.891 1.993 1.00 0.00 N ATOM 955 CA PHE A 83 5.614 -2.323 2.093 1.00 0.00 C ATOM 956 C PHE A 83 4.382 -2.572 2.975 1.00 0.00 C ATOM 957 O PHE A 83 4.020 -1.732 3.809 1.00 0.00 O ATOM 958 CB PHE A 83 6.845 -2.956 2.743 1.00 0.00 C ATOM 959 CG PHE A 83 8.218 -2.726 2.139 1.00 0.00 C ATOM 960 CD1 PHE A 83 8.857 -1.482 2.283 1.00 0.00 C ATOM 961 CD2 PHE A 83 8.936 -3.803 1.593 1.00 0.00 C ATOM 962 CE1 PHE A 83 10.190 -1.311 1.874 1.00 0.00 C ATOM 963 CE2 PHE A 83 10.261 -3.624 1.157 1.00 0.00 C ATOM 964 CZ PHE A 83 10.891 -2.378 1.292 1.00 0.00 C ATOM 0 H PHE A 83 5.927 -0.454 2.903 1.00 0.00 H new ATOM 0 HA PHE A 83 5.490 -2.764 1.104 1.00 0.00 H new ATOM 0 HB2 PHE A 83 6.882 -2.610 3.776 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.679 -4.033 2.774 1.00 0.00 H new ATOM 0 HD1 PHE A 83 8.318 -0.650 2.712 1.00 0.00 H new ATOM 0 HD2 PHE A 83 8.468 -4.773 1.508 1.00 0.00 H new ATOM 0 HE1 PHE A 83 10.676 -0.356 2.008 1.00 0.00 H new ATOM 0 HE2 PHE A 83 10.797 -4.451 0.715 1.00 0.00 H new ATOM 0 HZ PHE A 83 11.907 -2.241 0.951 1.00 0.00 H new ATOM 974 N PHE A 84 3.740 -3.730 2.864 1.00 0.00 N ATOM 975 CA PHE A 84 2.658 -4.134 3.758 1.00 0.00 C ATOM 976 C PHE A 84 2.500 -5.645 3.689 1.00 0.00 C ATOM 977 O PHE A 84 2.771 -6.257 2.651 1.00 0.00 O ATOM 978 CB PHE A 84 1.326 -3.439 3.388 1.00 0.00 C ATOM 979 CG PHE A 84 0.915 -3.620 1.938 1.00 0.00 C ATOM 980 CD1 PHE A 84 1.585 -2.908 0.923 1.00 0.00 C ATOM 981 CD2 PHE A 84 -0.094 -4.538 1.593 1.00 0.00 C ATOM 982 CE1 PHE A 84 1.313 -3.175 -0.424 1.00 0.00 C ATOM 983 CE2 PHE A 84 -0.388 -4.774 0.240 1.00 0.00 C ATOM 984 CZ PHE A 84 0.337 -4.120 -0.769 1.00 0.00 C ATOM 0 H PHE A 84 3.957 -4.421 2.146 1.00 0.00 H new ATOM 0 HA PHE A 84 2.912 -3.831 4.774 1.00 0.00 H new ATOM 0 HB2 PHE A 84 0.535 -3.827 4.030 1.00 0.00 H new ATOM 0 HB3 PHE A 84 1.414 -2.373 3.599 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.311 -2.153 1.185 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.640 -5.059 2.365 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.856 -2.652 -1.198 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.176 -5.463 -0.026 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.143 -4.344 -1.808 1.00 0.00 H new ATOM 994 N LYS A 85 1.984 -6.237 4.764 1.00 0.00 N ATOM 995 CA LYS A 85 1.508 -7.608 4.762 1.00 0.00 C ATOM 996 C LYS A 85 0.097 -7.574 5.292 1.00 0.00 C ATOM 997 O LYS A 85 -0.111 -7.221 6.453 1.00 0.00 O ATOM 998 CB LYS A 85 2.445 -8.519 5.553 1.00 0.00 C ATOM 999 CG LYS A 85 2.296 -10.023 5.292 1.00 0.00 C ATOM 1000 CD LYS A 85 2.517 -10.443 3.833 1.00 0.00 C ATOM 1001 CE LYS A 85 1.175 -10.734 3.159 1.00 0.00 C ATOM 1002 NZ LYS A 85 1.262 -10.748 1.687 1.00 0.00 N ATOM 0 H LYS A 85 1.886 -5.770 5.666 1.00 0.00 H new ATOM 0 HA LYS A 85 1.502 -8.035 3.759 1.00 0.00 H new ATOM 0 HB2 LYS A 85 3.473 -8.232 5.331 1.00 0.00 H new ATOM 0 HB3 LYS A 85 2.286 -8.337 6.616 1.00 0.00 H new ATOM 0 HG2 LYS A 85 3.005 -10.560 5.922 1.00 0.00 H new ATOM 0 HG3 LYS A 85 1.298 -10.335 5.599 1.00 0.00 H new ATOM 0 HD2 LYS A 85 3.039 -9.652 3.294 1.00 0.00 H new ATOM 0 HD3 LYS A 85 3.152 -11.328 3.794 1.00 0.00 H new ATOM 0 HE2 LYS A 85 0.802 -11.698 3.505 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.449 -9.982 3.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 0.324 -10.950 1.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 1.591 -9.821 1.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 1.933 -11.483 1.386 1.00 0.00 H new ATOM 1016 N ALA A 86 -0.864 -7.844 4.411 1.00 0.00 N ATOM 1017 CA ALA A 86 -2.195 -8.230 4.818 1.00 0.00 C ATOM 1018 C ALA A 86 -2.082 -9.647 5.369 1.00 0.00 C ATOM 1019 O ALA A 86 -2.230 -10.614 4.623 1.00 0.00 O ATOM 1020 CB ALA A 86 -3.143 -8.136 3.622 1.00 0.00 C ATOM 0 H ALA A 86 -0.733 -7.799 3.400 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.605 -7.574 5.585 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.147 -8.427 3.930 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.160 -7.111 3.251 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -2.798 -8.802 2.831 1.00 0.00 H new ATOM 1026 N GLU A 87 -1.720 -9.761 6.637 1.00 0.00 N ATOM 1027 CA GLU A 87 -1.775 -11.005 7.377 1.00 0.00 C ATOM 1028 C GLU A 87 -3.244 -11.283 7.740 1.00 0.00 C ATOM 1029 O GLU A 87 -4.173 -10.630 7.243 1.00 0.00 O ATOM 1030 CB GLU A 87 -0.868 -10.919 8.618 1.00 0.00 C ATOM 1031 CG GLU A 87 0.602 -10.593 8.300 1.00 0.00 C ATOM 1032 CD GLU A 87 1.535 -10.650 9.516 1.00 0.00 C ATOM 1033 OE1 GLU A 87 1.221 -11.361 10.500 1.00 0.00 O ATOM 1034 OE2 GLU A 87 2.609 -9.999 9.471 1.00 0.00 O ATOM 0 H GLU A 87 -1.374 -8.975 7.188 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.404 -11.835 6.776 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.261 -10.156 9.290 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.911 -11.868 9.153 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.963 -11.293 7.546 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.655 -9.596 7.862 1.00 0.00 H new ATOM 1041 N GLY A 88 -3.475 -12.268 8.603 1.00 0.00 N ATOM 1042 CA GLY A 88 -4.790 -12.646 9.072 1.00 0.00 C ATOM 1043 C GLY A 88 -5.504 -11.461 9.709 1.00 0.00 C ATOM 1044 O GLY A 88 -5.190 -11.056 10.831 1.00 0.00 O ATOM 0 H GLY A 88 -2.728 -12.836 9.002 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.381 -13.027 8.239 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -4.703 -13.455 9.797 1.00 0.00 H new ATOM 1048 N GLN A 89 -6.471 -10.895 8.974 1.00 0.00 N ATOM 1049 CA GLN A 89 -7.437 -9.913 9.461 1.00 0.00 C ATOM 1050 C GLN A 89 -6.746 -8.623 9.928 1.00 0.00 C ATOM 1051 O GLN A 89 -7.405 -7.771 10.530 1.00 0.00 O ATOM 1052 CB GLN A 89 -8.380 -10.591 10.479 1.00 0.00 C ATOM 1053 CG GLN A 89 -9.290 -11.690 9.883 1.00 0.00 C ATOM 1054 CD GLN A 89 -8.533 -12.903 9.341 1.00 0.00 C ATOM 1055 OE1 GLN A 89 -8.025 -13.725 10.092 1.00 0.00 O ATOM 1056 NE2 GLN A 89 -8.375 -13.014 8.028 1.00 0.00 N ATOM 0 H GLN A 89 -6.603 -11.120 7.988 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.080 -9.565 8.652 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -7.778 -11.029 11.276 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -9.008 -9.827 10.937 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -9.988 -12.024 10.651 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -9.885 -11.257 9.078 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -8.799 -12.328 7.403 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -7.830 -13.785 7.643 1.00 0.00 H new ATOM 1065 N THR A 90 -5.472 -8.432 9.568 1.00 0.00 N ATOM 1066 CA THR A 90 -4.596 -7.365 10.019 1.00 0.00 C ATOM 1067 C THR A 90 -3.690 -6.969 8.847 1.00 0.00 C ATOM 1068 O THR A 90 -3.184 -7.839 8.143 1.00 0.00 O ATOM 1069 CB THR A 90 -3.760 -7.875 11.213 1.00 0.00 C ATOM 1070 OG1 THR A 90 -4.539 -8.625 12.137 1.00 0.00 O ATOM 1071 CG2 THR A 90 -3.117 -6.721 11.988 1.00 0.00 C ATOM 0 H THR A 90 -5.005 -9.060 8.914 1.00 0.00 H new ATOM 0 HA THR A 90 -5.167 -6.495 10.344 1.00 0.00 H new ATOM 0 HB THR A 90 -2.993 -8.513 10.775 1.00 0.00 H new ATOM 0 HG1 THR A 90 -4.780 -9.487 11.738 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.537 -7.120 12.820 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.460 -6.159 11.325 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.896 -6.062 12.371 1.00 0.00 H new ATOM 1079 N VAL A 91 -3.442 -5.677 8.643 1.00 0.00 N ATOM 1080 CA VAL A 91 -2.443 -5.171 7.714 1.00 0.00 C ATOM 1081 C VAL A 91 -1.390 -4.454 8.550 1.00 0.00 C ATOM 1082 O VAL A 91 -1.682 -3.423 9.158 1.00 0.00 O ATOM 1083 CB VAL A 91 -3.049 -4.252 6.634 1.00 0.00 C ATOM 1084 CG1 VAL A 91 -1.990 -3.945 5.562 1.00 0.00 C ATOM 1085 CG2 VAL A 91 -4.245 -4.880 5.912 1.00 0.00 C ATOM 0 H VAL A 91 -3.945 -4.937 9.133 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.998 -5.995 7.156 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.384 -3.355 7.155 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -2.421 -3.295 4.800 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -1.138 -3.446 6.024 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.659 -4.875 5.101 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.626 -4.184 5.165 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.931 -5.802 5.422 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.030 -5.102 6.634 1.00 0.00 H new ATOM 1095 N ILE A 92 -0.178 -5.004 8.612 1.00 0.00 N ATOM 1096 CA ILE A 92 0.990 -4.316 9.119 1.00 0.00 C ATOM 1097 C ILE A 92 1.570 -3.554 7.930 1.00 0.00 C ATOM 1098 O ILE A 92 2.150 -4.149 7.018 1.00 0.00 O ATOM 1099 CB ILE A 92 1.983 -5.310 9.750 1.00 0.00 C ATOM 1100 CG1 ILE A 92 1.318 -6.213 10.814 1.00 0.00 C ATOM 1101 CG2 ILE A 92 3.131 -4.529 10.418 1.00 0.00 C ATOM 1102 CD1 ILE A 92 0.580 -7.435 10.259 1.00 0.00 C ATOM 0 H ILE A 92 0.014 -5.957 8.304 1.00 0.00 H new ATOM 0 HA ILE A 92 0.747 -3.621 9.923 1.00 0.00 H new ATOM 0 HB ILE A 92 2.354 -5.949 8.949 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.085 -6.556 11.508 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.613 -5.612 11.389 1.00 0.00 H new ATOM 0 HG21 ILE A 92 3.836 -5.230 10.866 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.645 -3.926 9.669 1.00 0.00 H new ATOM 0 HG23 ILE A 92 2.726 -3.878 11.192 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.148 -8.004 11.082 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.215 -7.107 9.589 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.280 -8.065 9.710 1.00 0.00 H new ATOM 1114 N ILE A 93 1.353 -2.243 7.906 1.00 0.00 N ATOM 1115 CA ILE A 93 1.862 -1.334 6.893 1.00 0.00 C ATOM 1116 C ILE A 93 3.264 -0.917 7.353 1.00 0.00 C ATOM 1117 O ILE A 93 3.439 -0.279 8.400 1.00 0.00 O ATOM 1118 CB ILE A 93 0.900 -0.140 6.661 1.00 0.00 C ATOM 1119 CG1 ILE A 93 -0.587 -0.580 6.627 1.00 0.00 C ATOM 1120 CG2 ILE A 93 1.286 0.538 5.329 1.00 0.00 C ATOM 1121 CD1 ILE A 93 -1.589 0.559 6.482 1.00 0.00 C ATOM 0 H ILE A 93 0.797 -1.770 8.619 1.00 0.00 H new ATOM 0 HA ILE A 93 1.927 -1.814 5.916 1.00 0.00 H new ATOM 0 HB ILE A 93 1.000 0.556 7.494 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.726 -1.275 5.799 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.810 -1.127 7.543 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.622 1.382 5.145 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.315 0.892 5.386 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.194 -0.181 4.515 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -2.601 0.154 6.468 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -1.484 1.245 7.323 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -1.399 1.094 5.552 1.00 0.00 H new ATOM 1133 N LYS A 94 4.275 -1.329 6.592 1.00 0.00 N ATOM 1134 CA LYS A 94 5.691 -1.108 6.846 1.00 0.00 C ATOM 1135 C LYS A 94 6.215 -0.084 5.836 1.00 0.00 C ATOM 1136 O LYS A 94 6.520 -0.416 4.697 1.00 0.00 O ATOM 1137 CB LYS A 94 6.430 -2.450 6.714 1.00 0.00 C ATOM 1138 CG LYS A 94 6.275 -3.441 7.874 1.00 0.00 C ATOM 1139 CD LYS A 94 7.342 -4.565 7.973 1.00 0.00 C ATOM 1140 CE LYS A 94 7.536 -4.875 9.463 1.00 0.00 C ATOM 1141 NZ LYS A 94 8.396 -6.037 9.758 1.00 0.00 N ATOM 0 H LYS A 94 4.116 -1.856 5.733 1.00 0.00 H new ATOM 0 HA LYS A 94 5.855 -0.720 7.851 1.00 0.00 H new ATOM 0 HB2 LYS A 94 6.087 -2.938 5.802 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.492 -2.242 6.584 1.00 0.00 H new ATOM 0 HG2 LYS A 94 6.285 -2.878 8.807 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.294 -3.908 7.794 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.015 -5.454 7.434 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.281 -4.245 7.521 1.00 0.00 H new ATOM 0 HE2 LYS A 94 7.962 -3.996 9.948 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.558 -5.044 9.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 7.885 -6.699 10.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.648 -6.516 8.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.262 -5.716 10.236 1.00 0.00 H new ATOM 1155 N TYR A 95 6.332 1.185 6.210 1.00 0.00 N ATOM 1156 CA TYR A 95 6.734 2.259 5.294 1.00 0.00 C ATOM 1157 C TYR A 95 7.948 2.994 5.835 1.00 0.00 C ATOM 1158 O TYR A 95 8.300 2.838 7.006 1.00 0.00 O ATOM 1159 CB TYR A 95 5.569 3.228 5.101 1.00 0.00 C ATOM 1160 CG TYR A 95 5.004 3.719 6.410 1.00 0.00 C ATOM 1161 CD1 TYR A 95 4.031 2.938 7.053 1.00 0.00 C ATOM 1162 CD2 TYR A 95 5.486 4.896 7.008 1.00 0.00 C ATOM 1163 CE1 TYR A 95 3.524 3.332 8.296 1.00 0.00 C ATOM 1164 CE2 TYR A 95 4.966 5.302 8.249 1.00 0.00 C ATOM 1165 CZ TYR A 95 3.970 4.531 8.887 1.00 0.00 C ATOM 1166 OH TYR A 95 3.484 4.902 10.096 1.00 0.00 O ATOM 0 H TYR A 95 6.151 1.505 7.161 1.00 0.00 H new ATOM 0 HA TYR A 95 7.001 1.823 4.331 1.00 0.00 H new ATOM 0 HB2 TYR A 95 5.904 4.081 4.511 1.00 0.00 H new ATOM 0 HB3 TYR A 95 4.781 2.735 4.531 1.00 0.00 H new ATOM 0 HD1 TYR A 95 3.673 2.032 6.588 1.00 0.00 H new ATOM 0 HD2 TYR A 95 6.249 5.483 6.518 1.00 0.00 H new ATOM 0 HE1 TYR A 95 2.793 2.719 8.801 1.00 0.00 H new ATOM 0 HE2 TYR A 95 5.329 6.206 8.716 1.00 0.00 H new ATOM 0 HH TYR A 95 3.892 5.751 10.366 1.00 0.00 H new ATOM 1176 N THR A 96 8.582 3.786 4.977 1.00 0.00 N ATOM 1177 CA THR A 96 9.788 4.539 5.256 1.00 0.00 C ATOM 1178 C THR A 96 9.836 5.748 4.331 1.00 0.00 C ATOM 1179 O THR A 96 8.997 5.895 3.434 1.00 0.00 O ATOM 1180 CB THR A 96 10.982 3.584 5.152 1.00 0.00 C ATOM 1181 OG1 THR A 96 12.130 4.141 5.724 1.00 0.00 O ATOM 1182 CG2 THR A 96 11.278 3.050 3.756 1.00 0.00 C ATOM 0 H THR A 96 8.248 3.923 4.023 1.00 0.00 H new ATOM 0 HA THR A 96 9.813 4.946 6.267 1.00 0.00 H new ATOM 0 HB THR A 96 10.674 2.709 5.725 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.373 3.636 6.528 1.00 0.00 H new ATOM 0 HG21 THR A 96 12.141 2.385 3.796 1.00 0.00 H new ATOM 0 HG22 THR A 96 10.413 2.500 3.386 1.00 0.00 H new ATOM 0 HG23 THR A 96 11.493 3.883 3.086 1.00 0.00 H new ATOM 1190 N SER A 97 10.798 6.619 4.608 1.00 0.00 N ATOM 1191 CA SER A 97 11.132 7.788 3.819 1.00 0.00 C ATOM 1192 C SER A 97 12.365 7.541 2.959 1.00 0.00 C ATOM 1193 O SER A 97 12.649 8.356 2.087 1.00 0.00 O ATOM 1194 CB SER A 97 11.345 9.010 4.732 1.00 0.00 C ATOM 1195 OG SER A 97 11.737 8.658 6.058 1.00 0.00 O ATOM 0 H SER A 97 11.393 6.520 5.430 1.00 0.00 H new ATOM 0 HA SER A 97 10.295 7.992 3.151 1.00 0.00 H new ATOM 0 HB2 SER A 97 12.107 9.655 4.294 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.423 9.589 4.774 1.00 0.00 H new ATOM 0 HG SER A 97 11.859 9.472 6.590 1.00 0.00 H new ATOM 1201 N GLN A 98 13.096 6.447 3.199 1.00 0.00 N ATOM 1202 CA GLN A 98 14.247 6.122 2.342 1.00 0.00 C ATOM 1203 C GLN A 98 14.434 4.615 2.221 1.00 0.00 C ATOM 1204 O GLN A 98 14.289 3.880 3.207 1.00 0.00 O ATOM 1205 CB GLN A 98 15.572 6.709 2.859 1.00 0.00 C ATOM 1206 CG GLN A 98 15.663 8.227 3.020 1.00 0.00 C ATOM 1207 CD GLN A 98 17.025 8.572 3.613 1.00 0.00 C ATOM 1208 OE1 GLN A 98 17.253 8.401 4.807 1.00 0.00 O ATOM 1209 NE2 GLN A 98 17.999 8.946 2.809 1.00 0.00 N ATOM 0 H GLN A 98 12.921 5.787 3.956 1.00 0.00 H new ATOM 0 HA GLN A 98 14.015 6.568 1.375 1.00 0.00 H new ATOM 0 HB2 GLN A 98 15.784 6.256 3.827 1.00 0.00 H new ATOM 0 HB3 GLN A 98 16.365 6.396 2.180 1.00 0.00 H new ATOM 0 HG2 GLN A 98 15.535 8.718 2.055 1.00 0.00 H new ATOM 0 HG3 GLN A 98 14.865 8.587 3.670 1.00 0.00 H new ATOM 0 HE21 GLN A 98 17.814 9.089 1.816 1.00 0.00 H new ATOM 0 HE22 GLN A 98 18.938 9.092 3.179 1.00 0.00 H new ATOM 1218 N ARG A 99 14.883 4.169 1.040 1.00 0.00 N ATOM 1219 CA ARG A 99 15.253 2.778 0.774 1.00 0.00 C ATOM 1220 C ARG A 99 16.274 2.308 1.807 1.00 0.00 C ATOM 1221 O ARG A 99 16.139 1.224 2.372 1.00 0.00 O ATOM 1222 CB ARG A 99 15.756 2.670 -0.683 1.00 0.00 C ATOM 1223 CG ARG A 99 15.555 1.300 -1.366 1.00 0.00 C ATOM 1224 CD ARG A 99 14.072 0.958 -1.604 1.00 0.00 C ATOM 1225 NE ARG A 99 13.868 0.172 -2.831 1.00 0.00 N ATOM 1226 CZ ARG A 99 13.820 -1.156 -2.999 1.00 0.00 C ATOM 1227 NH1 ARG A 99 13.981 -2.003 -1.985 1.00 0.00 N ATOM 1228 NH2 ARG A 99 13.607 -1.653 -4.209 1.00 0.00 N ATOM 0 H ARG A 99 15.000 4.778 0.230 1.00 0.00 H new ATOM 0 HA ARG A 99 14.394 2.115 0.872 1.00 0.00 H new ATOM 0 HB2 ARG A 99 15.249 3.429 -1.279 1.00 0.00 H new ATOM 0 HB3 ARG A 99 16.819 2.910 -0.699 1.00 0.00 H new ATOM 0 HG2 ARG A 99 16.081 1.296 -2.321 1.00 0.00 H new ATOM 0 HG3 ARG A 99 16.007 0.523 -0.749 1.00 0.00 H new ATOM 0 HD2 ARG A 99 13.689 0.399 -0.750 1.00 0.00 H new ATOM 0 HD3 ARG A 99 13.495 1.880 -1.666 1.00 0.00 H new ATOM 0 HE ARG A 99 13.745 0.721 -3.682 1.00 0.00 H new ATOM 0 HH11 ARG A 99 14.147 -1.646 -1.044 1.00 0.00 H new ATOM 0 HH12 ARG A 99 13.938 -3.009 -2.149 1.00 0.00 H new ATOM 0 HH21 ARG A 99 13.481 -1.025 -5.003 1.00 0.00 H new ATOM 0 HH22 ARG A 99 13.569 -2.663 -4.346 1.00 0.00 H new ATOM 1242 N ASN A 100 17.233 3.171 2.136 1.00 0.00 N ATOM 1243 CA ASN A 100 18.262 2.951 3.155 1.00 0.00 C ATOM 1244 C ASN A 100 17.791 3.154 4.609 1.00 0.00 C ATOM 1245 O ASN A 100 18.596 3.540 5.458 1.00 0.00 O ATOM 1246 CB ASN A 100 19.548 3.735 2.817 1.00 0.00 C ATOM 1247 CG ASN A 100 19.542 5.257 2.960 1.00 0.00 C ATOM 1248 OD1 ASN A 100 20.414 5.929 2.421 1.00 0.00 O ATOM 1249 ND2 ASN A 100 18.616 5.850 3.690 1.00 0.00 N ATOM 0 H ASN A 100 17.320 4.080 1.682 1.00 0.00 H new ATOM 0 HA ASN A 100 18.497 1.887 3.117 1.00 0.00 H new ATOM 0 HB2 ASN A 100 20.347 3.347 3.449 1.00 0.00 H new ATOM 0 HB3 ASN A 100 19.816 3.501 1.787 1.00 0.00 H new ATOM 0 HD21 ASN A 100 18.628 6.864 3.804 1.00 0.00 H new ATOM 0 HD22 ASN A 100 17.888 5.295 4.140 1.00 0.00 H new ATOM 1256 N THR A 101 16.509 2.979 4.942 1.00 0.00 N ATOM 1257 CA THR A 101 16.070 3.004 6.341 1.00 0.00 C ATOM 1258 C THR A 101 15.107 1.861 6.663 1.00 0.00 C ATOM 1259 O THR A 101 14.444 1.302 5.780 1.00 0.00 O ATOM 1260 CB THR A 101 15.481 4.377 6.739 1.00 0.00 C ATOM 1261 OG1 THR A 101 14.798 5.040 5.696 1.00 0.00 O ATOM 1262 CG2 THR A 101 16.548 5.358 7.216 1.00 0.00 C ATOM 0 H THR A 101 15.761 2.819 4.267 1.00 0.00 H new ATOM 0 HA THR A 101 16.961 2.849 6.950 1.00 0.00 H new ATOM 0 HB THR A 101 14.785 4.115 7.536 1.00 0.00 H new ATOM 0 HG1 THR A 101 13.859 4.758 5.689 1.00 0.00 H new ATOM 0 HG21 THR A 101 16.079 6.305 7.482 1.00 0.00 H new ATOM 0 HG22 THR A 101 17.056 4.947 8.088 1.00 0.00 H new ATOM 0 HG23 THR A 101 17.272 5.524 6.419 1.00 0.00 H new ATOM 1270 N LYS A 102 15.007 1.534 7.956 1.00 0.00 N ATOM 1271 CA LYS A 102 14.004 0.627 8.501 1.00 0.00 C ATOM 1272 C LYS A 102 12.610 1.217 8.290 1.00 0.00 C ATOM 1273 O LYS A 102 12.434 2.395 7.947 1.00 0.00 O ATOM 1274 CB LYS A 102 14.294 0.348 9.997 1.00 0.00 C ATOM 1275 CG LYS A 102 13.643 -0.926 10.586 1.00 0.00 C ATOM 1276 CD LYS A 102 14.216 -2.238 10.020 1.00 0.00 C ATOM 1277 CE LYS A 102 13.194 -3.368 9.801 1.00 0.00 C ATOM 1278 NZ LYS A 102 12.621 -3.918 11.042 1.00 0.00 N ATOM 0 H LYS A 102 15.639 1.904 8.666 1.00 0.00 H new ATOM 0 HA LYS A 102 14.047 -0.328 7.978 1.00 0.00 H new ATOM 0 HB2 LYS A 102 15.373 0.276 10.130 1.00 0.00 H new ATOM 0 HB3 LYS A 102 13.958 1.206 10.578 1.00 0.00 H new ATOM 0 HG2 LYS A 102 13.773 -0.921 11.668 1.00 0.00 H new ATOM 0 HG3 LYS A 102 12.571 -0.896 10.393 1.00 0.00 H new ATOM 0 HD2 LYS A 102 14.701 -2.021 9.068 1.00 0.00 H new ATOM 0 HD3 LYS A 102 14.990 -2.598 10.698 1.00 0.00 H new ATOM 0 HE2 LYS A 102 12.384 -2.993 9.176 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.675 -4.175 9.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 12.270 -4.881 10.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.354 -3.947 11.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 11.835 -3.315 11.358 1.00 0.00 H new ATOM 1292 N LEU A 103 11.618 0.360 8.493 1.00 0.00 N ATOM 1293 CA LEU A 103 10.220 0.605 8.222 1.00 0.00 C ATOM 1294 C LEU A 103 9.495 0.819 9.552 1.00 0.00 C ATOM 1295 O LEU A 103 9.957 0.355 10.602 1.00 0.00 O ATOM 1296 CB LEU A 103 9.651 -0.597 7.437 1.00 0.00 C ATOM 1297 CG LEU A 103 10.505 -1.044 6.227 1.00 0.00 C ATOM 1298 CD1 LEU A 103 9.828 -2.162 5.450 1.00 0.00 C ATOM 1299 CD2 LEU A 103 10.821 0.084 5.246 1.00 0.00 C ATOM 0 H LEU A 103 11.783 -0.573 8.872 1.00 0.00 H new ATOM 0 HA LEU A 103 10.081 1.499 7.615 1.00 0.00 H new ATOM 0 HB2 LEU A 103 9.543 -1.440 8.119 1.00 0.00 H new ATOM 0 HB3 LEU A 103 8.652 -0.342 7.084 1.00 0.00 H new ATOM 0 HG LEU A 103 11.441 -1.390 6.666 1.00 0.00 H new ATOM 0 HD11 LEU A 103 10.456 -2.451 4.607 1.00 0.00 H new ATOM 0 HD12 LEU A 103 9.680 -3.022 6.104 1.00 0.00 H new ATOM 0 HD13 LEU A 103 8.862 -1.816 5.081 1.00 0.00 H new ATOM 0 HD21 LEU A 103 11.422 -0.306 4.425 1.00 0.00 H new ATOM 0 HD22 LEU A 103 9.891 0.495 4.852 1.00 0.00 H new ATOM 0 HD23 LEU A 103 11.375 0.869 5.761 1.00 0.00 H new ATOM 1311 N LYS A 104 8.357 1.510 9.525 1.00 0.00 N ATOM 1312 CA LYS A 104 7.385 1.551 10.613 1.00 0.00 C ATOM 1313 C LYS A 104 6.658 0.204 10.703 1.00 0.00 C ATOM 1314 O LYS A 104 6.925 -0.697 9.908 1.00 0.00 O ATOM 1315 CB LYS A 104 6.417 2.713 10.340 1.00 0.00 C ATOM 1316 CG LYS A 104 6.869 4.041 10.963 1.00 0.00 C ATOM 1317 CD LYS A 104 8.181 4.578 10.396 1.00 0.00 C ATOM 1318 CE LYS A 104 8.344 6.044 10.800 1.00 0.00 C ATOM 1319 NZ LYS A 104 9.722 6.530 10.598 1.00 0.00 N ATOM 0 H LYS A 104 8.079 2.073 8.721 1.00 0.00 H new ATOM 0 HA LYS A 104 7.872 1.718 11.574 1.00 0.00 H new ATOM 0 HB2 LYS A 104 6.311 2.843 9.263 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.432 2.455 10.728 1.00 0.00 H new ATOM 0 HG2 LYS A 104 6.088 4.786 10.812 1.00 0.00 H new ATOM 0 HG3 LYS A 104 6.978 3.907 12.039 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.020 3.990 10.770 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.186 4.485 9.310 1.00 0.00 H new ATOM 0 HE2 LYS A 104 7.656 6.658 10.219 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.069 6.163 11.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 9.784 7.528 10.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 10.378 5.963 11.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 9.977 6.443 9.594 1.00 0.00 H new ATOM 1333 N ALA A 105 5.718 0.065 11.638 1.00 0.00 N ATOM 1334 CA ALA A 105 4.770 -1.041 11.688 1.00 0.00 C ATOM 1335 C ALA A 105 3.414 -0.504 12.168 1.00 0.00 C ATOM 1336 O ALA A 105 2.981 -0.770 13.291 1.00 0.00 O ATOM 1337 CB ALA A 105 5.317 -2.170 12.578 1.00 0.00 C ATOM 0 H ALA A 105 5.594 0.735 12.397 1.00 0.00 H new ATOM 0 HA ALA A 105 4.628 -1.474 10.698 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.600 -2.990 12.607 1.00 0.00 H new ATOM 0 HB2 ALA A 105 6.262 -2.529 12.171 1.00 0.00 H new ATOM 0 HB3 ALA A 105 5.477 -1.792 13.588 1.00 0.00 H new ATOM 1343 N LYS A 106 2.731 0.274 11.320 1.00 0.00 N ATOM 1344 CA LYS A 106 1.344 0.688 11.544 1.00 0.00 C ATOM 1345 C LYS A 106 0.503 -0.566 11.352 1.00 0.00 C ATOM 1346 O LYS A 106 0.322 -0.986 10.211 1.00 0.00 O ATOM 1347 CB LYS A 106 0.973 1.782 10.527 1.00 0.00 C ATOM 1348 CG LYS A 106 -0.482 2.276 10.513 1.00 0.00 C ATOM 1349 CD LYS A 106 -0.774 3.344 11.571 1.00 0.00 C ATOM 1350 CE LYS A 106 -1.878 4.292 11.084 1.00 0.00 C ATOM 1351 NZ LYS A 106 -2.080 5.428 12.008 1.00 0.00 N ATOM 0 H LYS A 106 3.130 0.636 10.454 1.00 0.00 H new ATOM 0 HA LYS A 106 1.182 1.106 12.537 1.00 0.00 H new ATOM 0 HB2 LYS A 106 1.618 2.642 10.708 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.211 1.409 9.531 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -0.711 2.680 9.527 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -1.147 1.427 10.672 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -1.080 2.868 12.503 1.00 0.00 H new ATOM 0 HD3 LYS A 106 0.132 3.910 11.785 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -1.620 4.671 10.095 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -2.811 3.739 10.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.834 6.044 11.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.351 5.069 12.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -1.197 5.972 12.088 1.00 0.00 H new ATOM 1365 N ALA A 107 0.071 -1.216 12.430 1.00 0.00 N ATOM 1366 CA ALA A 107 -0.821 -2.361 12.325 1.00 0.00 C ATOM 1367 C ALA A 107 -2.248 -1.867 12.498 1.00 0.00 C ATOM 1368 O ALA A 107 -2.518 -1.032 13.369 1.00 0.00 O ATOM 1369 CB ALA A 107 -0.464 -3.419 13.370 1.00 0.00 C ATOM 0 H ALA A 107 0.326 -0.967 13.386 1.00 0.00 H new ATOM 0 HA ALA A 107 -0.717 -2.833 11.348 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -1.142 -4.267 13.275 1.00 0.00 H new ATOM 0 HB2 ALA A 107 0.561 -3.755 13.213 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -0.556 -2.990 14.368 1.00 0.00 H new ATOM 1375 N LEU A 108 -3.145 -2.362 11.655 1.00 0.00 N ATOM 1376 CA LEU A 108 -4.548 -1.981 11.564 1.00 0.00 C ATOM 1377 C LEU A 108 -5.308 -3.238 11.159 1.00 0.00 C ATOM 1378 O LEU A 108 -4.740 -4.110 10.504 1.00 0.00 O ATOM 1379 CB LEU A 108 -4.721 -0.924 10.460 1.00 0.00 C ATOM 1380 CG LEU A 108 -3.910 0.372 10.638 1.00 0.00 C ATOM 1381 CD1 LEU A 108 -3.841 1.134 9.316 1.00 0.00 C ATOM 1382 CD2 LEU A 108 -4.456 1.269 11.751 1.00 0.00 C ATOM 0 H LEU A 108 -2.898 -3.083 10.977 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.909 -1.572 12.508 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -4.445 -1.374 9.506 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -5.777 -0.663 10.396 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.905 0.081 10.942 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -3.265 2.049 9.453 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -3.359 0.512 8.562 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -4.850 1.386 8.988 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.843 2.167 11.828 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -5.484 1.550 11.521 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.431 0.730 12.698 1.00 0.00 H new ATOM 1394 N THR A 109 -6.585 -3.346 11.495 1.00 0.00 N ATOM 1395 CA THR A 109 -7.395 -4.484 11.079 1.00 0.00 C ATOM 1396 C THR A 109 -7.801 -4.366 9.610 1.00 0.00 C ATOM 1397 O THR A 109 -7.959 -3.264 9.086 1.00 0.00 O ATOM 1398 CB THR A 109 -8.606 -4.626 12.012 1.00 0.00 C ATOM 1399 OG1 THR A 109 -9.273 -3.405 12.296 1.00 0.00 O ATOM 1400 CG2 THR A 109 -8.147 -5.273 13.316 1.00 0.00 C ATOM 0 H THR A 109 -7.085 -2.657 12.057 1.00 0.00 H new ATOM 0 HA THR A 109 -6.802 -5.395 11.160 1.00 0.00 H new ATOM 0 HB THR A 109 -9.333 -5.246 11.488 1.00 0.00 H new ATOM 0 HG1 THR A 109 -8.797 -2.931 13.010 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.998 -5.380 13.988 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.725 -6.256 13.106 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.390 -4.646 13.786 1.00 0.00 H new ATOM 1408 N LEU A 110 -8.077 -5.494 8.947 1.00 0.00 N ATOM 1409 CA LEU A 110 -8.695 -5.474 7.621 1.00 0.00 C ATOM 1410 C LEU A 110 -10.061 -4.781 7.675 1.00 0.00 C ATOM 1411 O LEU A 110 -10.519 -4.236 6.670 1.00 0.00 O ATOM 1412 CB LEU A 110 -8.821 -6.902 7.050 1.00 0.00 C ATOM 1413 CG LEU A 110 -7.612 -7.346 6.203 1.00 0.00 C ATOM 1414 CD1 LEU A 110 -7.731 -8.820 5.782 1.00 0.00 C ATOM 1415 CD2 LEU A 110 -7.512 -6.548 4.900 1.00 0.00 C ATOM 0 H LEU A 110 -7.882 -6.428 9.307 1.00 0.00 H new ATOM 0 HA LEU A 110 -8.050 -4.904 6.952 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.951 -7.602 7.875 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.721 -6.960 6.438 1.00 0.00 H new ATOM 0 HG LEU A 110 -6.738 -7.182 6.834 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -6.862 -9.100 5.186 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -7.780 -9.449 6.671 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -8.636 -8.957 5.190 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -6.648 -6.889 4.330 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -8.417 -6.697 4.311 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -7.400 -5.488 5.130 1.00 0.00 H new ATOM 1427 N SER A 111 -10.723 -4.776 8.837 1.00 0.00 N ATOM 1428 CA SER A 111 -11.925 -3.969 9.019 1.00 0.00 C ATOM 1429 C SER A 111 -11.630 -2.460 9.015 1.00 0.00 C ATOM 1430 O SER A 111 -12.345 -1.747 8.309 1.00 0.00 O ATOM 1431 CB SER A 111 -12.705 -4.410 10.257 1.00 0.00 C ATOM 1432 OG SER A 111 -14.094 -4.276 9.986 1.00 0.00 O ATOM 0 H SER A 111 -10.447 -5.318 9.656 1.00 0.00 H new ATOM 0 HA SER A 111 -12.565 -4.146 8.154 1.00 0.00 H new ATOM 0 HB2 SER A 111 -12.466 -5.444 10.507 1.00 0.00 H new ATOM 0 HB3 SER A 111 -12.426 -3.801 11.117 1.00 0.00 H new ATOM 0 HG SER A 111 -14.609 -4.557 10.771 1.00 0.00 H new ATOM 1438 N GLN A 112 -10.605 -1.978 9.739 1.00 0.00 N ATOM 1439 CA GLN A 112 -10.189 -0.574 9.778 1.00 0.00 C ATOM 1440 C GLN A 112 -10.132 -0.002 8.356 1.00 0.00 C ATOM 1441 O GLN A 112 -10.866 0.925 8.019 1.00 0.00 O ATOM 1442 CB GLN A 112 -8.808 -0.448 10.464 1.00 0.00 C ATOM 1443 CG GLN A 112 -8.815 0.362 11.765 1.00 0.00 C ATOM 1444 CD GLN A 112 -8.613 -0.505 13.000 1.00 0.00 C ATOM 1445 OE1 GLN A 112 -7.667 -1.282 13.101 1.00 0.00 O ATOM 1446 NE2 GLN A 112 -9.519 -0.436 13.948 1.00 0.00 N ATOM 0 H GLN A 112 -10.028 -2.577 10.330 1.00 0.00 H new ATOM 0 HA GLN A 112 -10.918 -0.005 10.354 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -8.429 -1.448 10.676 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -8.111 0.016 9.766 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -8.028 1.115 11.723 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -9.762 0.894 11.851 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -10.302 0.211 13.859 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -9.439 -1.029 14.774 1.00 0.00 H new ATOM 1455 N LEU A 113 -9.287 -0.603 7.515 1.00 0.00 N ATOM 1456 CA LEU A 113 -9.011 -0.176 6.146 1.00 0.00 C ATOM 1457 C LEU A 113 -10.302 -0.153 5.319 1.00 0.00 C ATOM 1458 O LEU A 113 -10.539 0.797 4.569 1.00 0.00 O ATOM 1459 CB LEU A 113 -7.974 -1.142 5.526 1.00 0.00 C ATOM 1460 CG LEU A 113 -6.487 -0.931 5.887 1.00 0.00 C ATOM 1461 CD1 LEU A 113 -5.908 0.325 5.244 1.00 0.00 C ATOM 1462 CD2 LEU A 113 -6.186 -0.862 7.379 1.00 0.00 C ATOM 0 H LEU A 113 -8.757 -1.433 7.782 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.606 0.836 6.149 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -8.248 -2.157 5.814 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -8.067 -1.082 4.442 1.00 0.00 H new ATOM 0 HG LEU A 113 -6.014 -1.829 5.490 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -4.861 0.429 5.528 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -5.984 0.247 4.159 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -6.465 1.198 5.585 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -5.117 -0.712 7.528 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.734 -0.031 7.823 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -6.492 -1.794 7.855 1.00 0.00 H new ATOM 1474 N LYS A 114 -11.170 -1.166 5.462 1.00 0.00 N ATOM 1475 CA LYS A 114 -12.406 -1.263 4.704 1.00 0.00 C ATOM 1476 C LYS A 114 -13.355 -0.141 5.098 1.00 0.00 C ATOM 1477 O LYS A 114 -14.214 0.261 4.313 1.00 0.00 O ATOM 1478 CB LYS A 114 -13.006 -2.653 4.971 1.00 0.00 C ATOM 1479 CG LYS A 114 -14.367 -2.863 4.304 1.00 0.00 C ATOM 1480 CD LYS A 114 -15.553 -2.322 5.116 1.00 0.00 C ATOM 1481 CE LYS A 114 -16.663 -1.850 4.160 1.00 0.00 C ATOM 1482 NZ LYS A 114 -17.241 -0.541 4.535 1.00 0.00 N ATOM 0 H LYS A 114 -11.025 -1.939 6.112 1.00 0.00 H new ATOM 0 HA LYS A 114 -12.223 -1.151 3.635 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -12.313 -3.415 4.614 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -13.110 -2.796 6.047 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -14.359 -2.380 3.327 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -14.515 -3.929 4.132 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -15.936 -3.098 5.779 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -15.227 -1.495 5.747 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -16.259 -1.785 3.150 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -17.456 -2.597 4.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -17.933 -0.248 3.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -17.713 -0.622 5.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -16.483 0.169 4.595 1.00 0.00 H new ATOM 1496 N LYS A 115 -13.341 0.267 6.361 1.00 0.00 N ATOM 1497 CA LYS A 115 -14.143 1.382 6.802 1.00 0.00 C ATOM 1498 C LYS A 115 -13.560 2.609 6.118 1.00 0.00 C ATOM 1499 O LYS A 115 -14.184 3.128 5.194 1.00 0.00 O ATOM 1500 CB LYS A 115 -14.148 1.401 8.342 1.00 0.00 C ATOM 1501 CG LYS A 115 -15.554 1.195 8.927 1.00 0.00 C ATOM 1502 CD LYS A 115 -16.302 -0.078 8.491 1.00 0.00 C ATOM 1503 CE LYS A 115 -15.560 -1.396 8.746 1.00 0.00 C ATOM 1504 NZ LYS A 115 -15.520 -1.755 10.177 1.00 0.00 N ATOM 0 H LYS A 115 -12.778 -0.165 7.094 1.00 0.00 H new ATOM 0 HA LYS A 115 -15.196 1.330 6.527 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -13.485 0.620 8.714 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -13.748 2.353 8.692 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -15.473 1.187 10.014 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -16.164 2.057 8.659 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -17.259 -0.113 9.011 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -16.521 -0.004 7.426 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -16.045 -2.196 8.188 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -14.541 -1.315 8.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.023 -2.661 10.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -15.018 -1.014 10.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -16.491 -1.843 10.540 1.00 0.00 H new ATOM 1518 N GLU A 116 -12.336 2.960 6.490 1.00 0.00 N ATOM 1519 CA GLU A 116 -11.670 4.219 6.200 1.00 0.00 C ATOM 1520 C GLU A 116 -11.718 4.631 4.736 1.00 0.00 C ATOM 1521 O GLU A 116 -11.952 5.803 4.449 1.00 0.00 O ATOM 1522 CB GLU A 116 -10.224 4.097 6.693 1.00 0.00 C ATOM 1523 CG GLU A 116 -10.161 4.142 8.230 1.00 0.00 C ATOM 1524 CD GLU A 116 -10.309 5.563 8.758 1.00 0.00 C ATOM 1525 OE1 GLU A 116 -11.449 6.087 8.756 1.00 0.00 O ATOM 1526 OE2 GLU A 116 -9.284 6.129 9.216 1.00 0.00 O ATOM 0 H GLU A 116 -11.746 2.332 7.037 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.205 5.014 6.719 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -9.791 3.163 6.335 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -9.624 4.906 6.277 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.950 3.515 8.645 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -9.212 3.725 8.568 1.00 0.00 H new ATOM 1533 N PHE A 117 -11.514 3.693 3.811 1.00 0.00 N ATOM 1534 CA PHE A 117 -11.410 4.015 2.394 1.00 0.00 C ATOM 1535 C PHE A 117 -12.352 3.163 1.554 1.00 0.00 C ATOM 1536 O PHE A 117 -12.165 3.034 0.349 1.00 0.00 O ATOM 1537 CB PHE A 117 -9.958 3.878 1.951 1.00 0.00 C ATOM 1538 CG PHE A 117 -8.945 4.473 2.906 1.00 0.00 C ATOM 1539 CD1 PHE A 117 -8.982 5.849 3.199 1.00 0.00 C ATOM 1540 CD2 PHE A 117 -7.984 3.652 3.525 1.00 0.00 C ATOM 1541 CE1 PHE A 117 -8.044 6.413 4.078 1.00 0.00 C ATOM 1542 CE2 PHE A 117 -7.006 4.231 4.342 1.00 0.00 C ATOM 1543 CZ PHE A 117 -7.046 5.605 4.640 1.00 0.00 C ATOM 0 H PHE A 117 -11.418 2.700 4.023 1.00 0.00 H new ATOM 0 HA PHE A 117 -11.722 5.048 2.239 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.732 2.820 1.816 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -9.843 4.355 0.978 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -9.736 6.475 2.745 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.001 2.583 3.371 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.091 7.464 4.320 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -6.214 3.618 4.747 1.00 0.00 H new ATOM 0 HZ PHE A 117 -6.309 6.037 5.301 1.00 0.00 H new ATOM 1553 N TYR A 118 -13.368 2.557 2.174 1.00 0.00 N ATOM 1554 CA TYR A 118 -14.358 1.759 1.461 1.00 0.00 C ATOM 1555 C TYR A 118 -15.766 1.945 2.060 1.00 0.00 C ATOM 1556 O TYR A 118 -16.651 1.132 1.771 1.00 0.00 O ATOM 1557 CB TYR A 118 -13.871 0.296 1.376 1.00 0.00 C ATOM 1558 CG TYR A 118 -13.746 -0.356 0.005 1.00 0.00 C ATOM 1559 CD1 TYR A 118 -13.271 0.325 -1.143 1.00 0.00 C ATOM 1560 CD2 TYR A 118 -14.020 -1.733 -0.074 1.00 0.00 C ATOM 1561 CE1 TYR A 118 -13.099 -0.360 -2.366 1.00 0.00 C ATOM 1562 CE2 TYR A 118 -13.857 -2.417 -1.284 1.00 0.00 C ATOM 1563 CZ TYR A 118 -13.401 -1.737 -2.432 1.00 0.00 C ATOM 1564 OH TYR A 118 -13.237 -2.484 -3.557 1.00 0.00 O ATOM 0 H TYR A 118 -13.524 2.608 3.181 1.00 0.00 H new ATOM 0 HA TYR A 118 -14.459 2.108 0.433 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -12.894 0.245 1.856 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -14.551 -0.314 1.971 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -13.038 1.378 -1.082 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -14.358 -2.265 0.803 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -12.741 0.164 -3.240 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -14.082 -3.472 -1.339 1.00 0.00 H new ATOM 0 HH TYR A 118 -13.073 -1.893 -4.321 1.00 0.00 H new ATOM 1574 N GLN A 119 -16.009 3.005 2.862 1.00 0.00 N ATOM 1575 CA GLN A 119 -17.353 3.450 3.241 1.00 0.00 C ATOM 1576 C GLN A 119 -18.260 3.623 2.020 1.00 0.00 C ATOM 1577 O GLN A 119 -19.133 2.781 1.792 1.00 0.00 O ATOM 1578 CB GLN A 119 -17.402 4.671 4.203 1.00 0.00 C ATOM 1579 CG GLN A 119 -16.766 6.042 3.925 1.00 0.00 C ATOM 1580 CD GLN A 119 -15.281 6.107 4.241 1.00 0.00 C ATOM 1581 OE1 GLN A 119 -14.859 5.961 5.386 1.00 0.00 O ATOM 1582 NE2 GLN A 119 -14.467 6.289 3.218 1.00 0.00 N ATOM 0 H GLN A 119 -15.265 3.576 3.264 1.00 0.00 H new ATOM 0 HA GLN A 119 -17.755 2.634 3.842 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -18.459 4.864 4.387 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -16.972 4.327 5.144 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -16.916 6.295 2.875 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -17.286 6.799 4.512 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -14.847 6.407 2.279 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -13.458 6.311 3.367 1.00 0.00 H new ATOM 1591 N THR A 120 -18.072 4.678 1.223 1.00 0.00 N ATOM 1592 CA THR A 120 -19.052 5.005 0.179 1.00 0.00 C ATOM 1593 C THR A 120 -18.767 4.114 -1.024 1.00 0.00 C ATOM 1594 O THR A 120 -17.614 3.744 -1.256 1.00 0.00 O ATOM 1595 CB THR A 120 -19.047 6.516 -0.157 1.00 0.00 C ATOM 1596 OG1 THR A 120 -19.466 6.792 -1.486 1.00 0.00 O ATOM 1597 CG2 THR A 120 -17.669 7.128 0.057 1.00 0.00 C ATOM 0 H THR A 120 -17.271 5.308 1.275 1.00 0.00 H new ATOM 0 HA THR A 120 -20.065 4.806 0.528 1.00 0.00 H new ATOM 0 HB THR A 120 -19.766 6.966 0.528 1.00 0.00 H new ATOM 0 HG1 THR A 120 -19.445 7.759 -1.641 1.00 0.00 H new ATOM 0 HG21 THR A 120 -17.700 8.190 -0.188 1.00 0.00 H new ATOM 0 HG22 THR A 120 -17.374 7.005 1.099 1.00 0.00 H new ATOM 0 HG23 THR A 120 -16.945 6.628 -0.587 1.00 0.00 H new ATOM 1605 N ARG A 121 -19.794 3.789 -1.817 1.00 0.00 N ATOM 1606 CA ARG A 121 -19.615 3.063 -3.071 1.00 0.00 C ATOM 1607 C ARG A 121 -19.064 3.951 -4.183 1.00 0.00 C ATOM 1608 O ARG A 121 -18.452 3.408 -5.095 1.00 0.00 O ATOM 1609 CB ARG A 121 -20.925 2.360 -3.467 1.00 0.00 C ATOM 1610 CG ARG A 121 -20.848 1.618 -4.810 1.00 0.00 C ATOM 1611 CD ARG A 121 -22.077 0.729 -5.023 1.00 0.00 C ATOM 1612 NE ARG A 121 -22.166 0.263 -6.418 1.00 0.00 N ATOM 1613 CZ ARG A 121 -22.643 0.990 -7.438 1.00 0.00 C ATOM 1614 NH1 ARG A 121 -23.096 2.220 -7.230 1.00 0.00 N ATOM 1615 NH2 ARG A 121 -22.647 0.496 -8.665 1.00 0.00 N ATOM 0 H ARG A 121 -20.765 4.022 -1.606 1.00 0.00 H new ATOM 0 HA ARG A 121 -18.858 2.295 -2.914 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -21.196 1.650 -2.685 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -21.723 3.100 -3.517 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -20.773 2.340 -5.623 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -19.945 1.008 -4.840 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -22.028 -0.129 -4.353 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -22.979 1.284 -4.765 1.00 0.00 H new ATOM 0 HE ARG A 121 -21.841 -0.682 -6.622 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -23.082 2.616 -6.290 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -23.458 2.769 -8.010 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -22.286 -0.442 -8.838 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -23.011 1.053 -9.438 1.00 0.00 H new ATOM 1629 N SER A 122 -19.200 5.275 -4.106 1.00 0.00 N ATOM 1630 CA SER A 122 -18.606 6.160 -5.101 1.00 0.00 C ATOM 1631 C SER A 122 -17.098 5.936 -5.097 1.00 0.00 C ATOM 1632 O SER A 122 -16.536 5.612 -6.135 1.00 0.00 O ATOM 1633 CB SER A 122 -19.008 7.608 -4.799 1.00 0.00 C ATOM 1634 OG SER A 122 -19.036 8.419 -5.957 1.00 0.00 O ATOM 0 H SER A 122 -19.715 5.754 -3.367 1.00 0.00 H new ATOM 0 HA SER A 122 -18.970 5.943 -6.105 1.00 0.00 H new ATOM 0 HB2 SER A 122 -19.992 7.617 -4.330 1.00 0.00 H new ATOM 0 HB3 SER A 122 -18.308 8.033 -4.080 1.00 0.00 H new ATOM 0 HG SER A 122 -19.299 9.331 -5.712 1.00 0.00 H new ATOM 1640 N GLN A 123 -16.456 5.970 -3.923 1.00 0.00 N ATOM 1641 CA GLN A 123 -15.005 5.815 -3.837 1.00 0.00 C ATOM 1642 C GLN A 123 -14.543 4.451 -4.363 1.00 0.00 C ATOM 1643 O GLN A 123 -13.408 4.312 -4.798 1.00 0.00 O ATOM 1644 CB GLN A 123 -14.537 6.064 -2.395 1.00 0.00 C ATOM 1645 CG GLN A 123 -14.374 4.822 -1.516 1.00 0.00 C ATOM 1646 CD GLN A 123 -14.188 5.246 -0.076 1.00 0.00 C ATOM 1647 OE1 GLN A 123 -13.225 5.903 0.304 1.00 0.00 O ATOM 1648 NE2 GLN A 123 -15.137 4.878 0.757 1.00 0.00 N ATOM 0 H GLN A 123 -16.919 6.103 -3.024 1.00 0.00 H new ATOM 0 HA GLN A 123 -14.541 6.561 -4.481 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -13.581 6.587 -2.430 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -15.250 6.734 -1.914 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -15.251 4.181 -1.607 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -13.516 4.238 -1.848 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -15.929 4.332 0.419 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -15.081 5.139 1.741 1.00 0.00 H new ATOM 1657 N LYS A 124 -15.416 3.439 -4.339 1.00 0.00 N ATOM 1658 CA LYS A 124 -15.130 2.112 -4.885 1.00 0.00 C ATOM 1659 C LYS A 124 -15.048 2.108 -6.405 1.00 0.00 C ATOM 1660 O LYS A 124 -14.782 1.048 -6.966 1.00 0.00 O ATOM 1661 CB LYS A 124 -16.177 1.075 -4.462 1.00 0.00 C ATOM 1662 CG LYS A 124 -16.356 0.995 -2.951 1.00 0.00 C ATOM 1663 CD LYS A 124 -17.351 -0.102 -2.594 1.00 0.00 C ATOM 1664 CE LYS A 124 -17.313 -0.333 -1.087 1.00 0.00 C ATOM 1665 NZ LYS A 124 -18.328 -1.327 -0.702 1.00 0.00 N ATOM 0 H LYS A 124 -16.349 3.521 -3.936 1.00 0.00 H new ATOM 0 HA LYS A 124 -14.157 1.843 -4.473 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -17.133 1.322 -4.923 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -15.884 0.096 -4.840 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -15.396 0.794 -2.474 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -16.708 1.953 -2.568 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -18.355 0.184 -2.906 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -17.103 -1.022 -3.123 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -16.323 -0.678 -0.789 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -17.494 0.605 -0.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -18.294 -1.477 0.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -19.272 -0.982 -0.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -18.137 -2.225 -1.190 1.00 0.00 H new ATOM 1679 N ARG A 125 -15.330 3.209 -7.096 1.00 0.00 N ATOM 1680 CA ARG A 125 -14.768 3.397 -8.420 1.00 0.00 C ATOM 1681 C ARG A 125 -13.299 3.657 -8.187 1.00 0.00 C ATOM 1682 O ARG A 125 -12.510 2.741 -8.335 1.00 0.00 O ATOM 1683 CB ARG A 125 -15.473 4.528 -9.180 1.00 0.00 C ATOM 1684 CG ARG A 125 -16.683 4.027 -9.970 1.00 0.00 C ATOM 1685 CD ARG A 125 -17.665 3.180 -9.151 1.00 0.00 C ATOM 1686 NE ARG A 125 -18.896 2.924 -9.911 1.00 0.00 N ATOM 1687 CZ ARG A 125 -19.595 1.784 -9.967 1.00 0.00 C ATOM 1688 NH1 ARG A 125 -19.236 0.700 -9.288 1.00 0.00 N ATOM 1689 NH2 ARG A 125 -20.688 1.753 -10.711 1.00 0.00 N ATOM 0 H ARG A 125 -15.930 3.965 -6.767 1.00 0.00 H new ATOM 0 HA ARG A 125 -14.909 2.525 -9.059 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -15.794 5.293 -8.473 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -14.766 5.001 -9.862 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -17.216 4.885 -10.379 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -16.331 3.437 -10.816 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -17.197 2.234 -8.880 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -17.907 3.694 -8.221 1.00 0.00 H new ATOM 0 HE ARG A 125 -19.259 3.704 -10.458 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -18.403 0.719 -8.700 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -19.793 -0.152 -9.355 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -20.979 2.585 -11.224 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -21.240 0.897 -10.772 1.00 0.00 H new ATOM 1703 N GLU A 126 -12.941 4.853 -7.732 1.00 0.00 N ATOM 1704 CA GLU A 126 -11.577 5.356 -7.813 1.00 0.00 C ATOM 1705 C GLU A 126 -10.541 4.445 -7.172 1.00 0.00 C ATOM 1706 O GLU A 126 -9.497 4.192 -7.762 1.00 0.00 O ATOM 1707 CB GLU A 126 -11.477 6.718 -7.140 1.00 0.00 C ATOM 1708 CG GLU A 126 -12.002 7.802 -8.062 1.00 0.00 C ATOM 1709 CD GLU A 126 -13.505 7.669 -8.326 1.00 0.00 C ATOM 1710 OE1 GLU A 126 -14.276 7.541 -7.346 1.00 0.00 O ATOM 1711 OE2 GLU A 126 -13.927 7.622 -9.503 1.00 0.00 O ATOM 0 H GLU A 126 -13.594 5.503 -7.294 1.00 0.00 H new ATOM 0 HA GLU A 126 -11.357 5.414 -8.879 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -12.047 6.714 -6.211 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -10.440 6.926 -6.877 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -11.798 8.778 -7.623 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.465 7.761 -9.009 1.00 0.00 H new ATOM 1718 N VAL A 127 -10.839 3.992 -5.963 1.00 0.00 N ATOM 1719 CA VAL A 127 -10.022 3.065 -5.191 1.00 0.00 C ATOM 1720 C VAL A 127 -9.751 1.796 -6.004 1.00 0.00 C ATOM 1721 O VAL A 127 -8.613 1.351 -6.104 1.00 0.00 O ATOM 1722 CB VAL A 127 -10.700 2.786 -3.835 1.00 0.00 C ATOM 1723 CG1 VAL A 127 -10.017 1.672 -3.037 1.00 0.00 C ATOM 1724 CG2 VAL A 127 -10.718 4.049 -2.956 1.00 0.00 C ATOM 0 H VAL A 127 -11.689 4.270 -5.473 1.00 0.00 H new ATOM 0 HA VAL A 127 -9.049 3.506 -4.977 1.00 0.00 H new ATOM 0 HB VAL A 127 -11.713 2.468 -4.082 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -10.543 1.525 -2.094 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -10.039 0.746 -3.612 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -8.982 1.950 -2.836 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -11.202 3.824 -2.006 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -9.696 4.380 -2.773 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -11.269 4.839 -3.466 1.00 0.00 H new ATOM 1734 N ASP A 128 -10.801 1.180 -6.543 1.00 0.00 N ATOM 1735 CA ASP A 128 -10.716 -0.071 -7.294 1.00 0.00 C ATOM 1736 C ASP A 128 -10.115 0.166 -8.690 1.00 0.00 C ATOM 1737 O ASP A 128 -9.462 -0.711 -9.250 1.00 0.00 O ATOM 1738 CB ASP A 128 -12.128 -0.666 -7.374 1.00 0.00 C ATOM 1739 CG ASP A 128 -12.161 -2.178 -7.199 1.00 0.00 C ATOM 1740 OD1 ASP A 128 -11.607 -2.926 -8.034 1.00 0.00 O ATOM 1741 OD2 ASP A 128 -12.816 -2.630 -6.226 1.00 0.00 O ATOM 0 H ASP A 128 -11.752 1.543 -6.469 1.00 0.00 H new ATOM 0 HA ASP A 128 -10.052 -0.774 -6.790 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -12.751 -0.206 -6.607 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -12.567 -0.410 -8.338 1.00 0.00 H new ATOM 1746 N ASP A 129 -10.284 1.374 -9.234 1.00 0.00 N ATOM 1747 CA ASP A 129 -9.645 1.907 -10.436 1.00 0.00 C ATOM 1748 C ASP A 129 -8.129 1.898 -10.226 1.00 0.00 C ATOM 1749 O ASP A 129 -7.407 1.345 -11.051 1.00 0.00 O ATOM 1750 CB ASP A 129 -10.118 3.349 -10.720 1.00 0.00 C ATOM 1751 CG ASP A 129 -11.096 3.543 -11.872 1.00 0.00 C ATOM 1752 OD1 ASP A 129 -10.638 3.584 -13.033 1.00 0.00 O ATOM 1753 OD2 ASP A 129 -12.274 3.890 -11.611 1.00 0.00 O ATOM 0 H ASP A 129 -10.918 2.053 -8.813 1.00 0.00 H new ATOM 0 HA ASP A 129 -9.917 1.287 -11.290 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -10.581 3.738 -9.813 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -9.238 3.962 -10.916 1.00 0.00 H new ATOM 1758 N TYR A 130 -7.632 2.458 -9.110 1.00 0.00 N ATOM 1759 CA TYR A 130 -6.199 2.536 -8.811 1.00 0.00 C ATOM 1760 C TYR A 130 -5.550 1.139 -8.802 1.00 0.00 C ATOM 1761 O TYR A 130 -4.363 0.999 -9.097 1.00 0.00 O ATOM 1762 CB TYR A 130 -5.939 3.229 -7.457 1.00 0.00 C ATOM 1763 CG TYR A 130 -6.513 4.619 -7.176 1.00 0.00 C ATOM 1764 CD1 TYR A 130 -6.476 5.664 -8.123 1.00 0.00 C ATOM 1765 CD2 TYR A 130 -7.054 4.881 -5.903 1.00 0.00 C ATOM 1766 CE1 TYR A 130 -7.026 6.929 -7.822 1.00 0.00 C ATOM 1767 CE2 TYR A 130 -7.646 6.123 -5.606 1.00 0.00 C ATOM 1768 CZ TYR A 130 -7.649 7.152 -6.573 1.00 0.00 C ATOM 1769 OH TYR A 130 -8.234 8.351 -6.277 1.00 0.00 O ATOM 0 H TYR A 130 -8.221 2.871 -8.387 1.00 0.00 H new ATOM 0 HA TYR A 130 -5.747 3.132 -9.604 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -6.310 2.563 -6.678 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -4.858 3.295 -7.331 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -6.022 5.495 -9.088 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -7.014 4.116 -5.142 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -6.971 7.727 -8.547 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -8.098 6.289 -4.639 1.00 0.00 H new ATOM 0 HH TYR A 130 -8.611 8.317 -5.373 1.00 0.00 H new ATOM 1779 N VAL A 131 -6.313 0.089 -8.485 1.00 0.00 N ATOM 1780 CA VAL A 131 -5.833 -1.293 -8.486 1.00 0.00 C ATOM 1781 C VAL A 131 -5.689 -1.856 -9.909 1.00 0.00 C ATOM 1782 O VAL A 131 -4.883 -2.765 -10.128 1.00 0.00 O ATOM 1783 CB VAL A 131 -6.781 -2.164 -7.633 1.00 0.00 C ATOM 1784 CG1 VAL A 131 -6.296 -3.615 -7.587 1.00 0.00 C ATOM 1785 CG2 VAL A 131 -6.889 -1.667 -6.186 1.00 0.00 C ATOM 0 H VAL A 131 -7.293 0.178 -8.217 1.00 0.00 H new ATOM 0 HA VAL A 131 -4.835 -1.310 -8.048 1.00 0.00 H new ATOM 0 HB VAL A 131 -7.758 -2.096 -8.111 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -6.980 -4.208 -6.980 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -6.264 -4.020 -8.598 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -5.298 -3.651 -7.149 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.567 -2.313 -5.629 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -5.904 -1.687 -5.720 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -7.273 -0.647 -6.179 1.00 0.00 H new ATOM 1795 N ALA A 132 -6.439 -1.340 -10.885 1.00 0.00 N ATOM 1796 CA ALA A 132 -6.277 -1.702 -12.288 1.00 0.00 C ATOM 1797 C ALA A 132 -5.285 -0.765 -12.991 1.00 0.00 C ATOM 1798 O ALA A 132 -4.745 -1.117 -14.042 1.00 0.00 O ATOM 1799 CB ALA A 132 -7.642 -1.677 -12.974 1.00 0.00 C ATOM 0 H ALA A 132 -7.178 -0.657 -10.720 1.00 0.00 H new ATOM 0 HA ALA A 132 -5.865 -2.709 -12.352 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.527 -1.947 -14.024 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -8.307 -2.390 -12.487 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -8.067 -0.676 -12.901 1.00 0.00 H new ATOM 1805 N GLY A 133 -5.006 0.404 -12.415 1.00 0.00 N ATOM 1806 CA GLY A 133 -4.160 1.438 -12.990 1.00 0.00 C ATOM 1807 C GLY A 133 -2.673 1.301 -12.662 1.00 0.00 C ATOM 1808 O GLY A 133 -1.921 2.254 -12.898 1.00 0.00 O ATOM 0 H GLY A 133 -5.379 0.662 -11.501 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -4.282 1.428 -14.073 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -4.508 2.410 -12.639 1.00 0.00 H new ATOM 1812 N LEU A 134 -2.246 0.179 -12.073 1.00 0.00 N ATOM 1813 CA LEU A 134 -0.863 -0.084 -11.672 1.00 0.00 C ATOM 1814 C LEU A 134 -0.174 -1.060 -12.627 1.00 0.00 C ATOM 1815 O LEU A 134 -0.813 -1.690 -13.474 1.00 0.00 O ATOM 1816 CB LEU A 134 -0.803 -0.503 -10.188 1.00 0.00 C ATOM 1817 CG LEU A 134 -1.647 -1.718 -9.746 1.00 0.00 C ATOM 1818 CD1 LEU A 134 -1.100 -3.071 -10.213 1.00 0.00 C ATOM 1819 CD2 LEU A 134 -1.733 -1.732 -8.213 1.00 0.00 C ATOM 0 H LEU A 134 -2.875 -0.594 -11.856 1.00 0.00 H new ATOM 0 HA LEU A 134 -0.288 0.838 -11.752 1.00 0.00 H new ATOM 0 HB2 LEU A 134 0.238 -0.711 -9.941 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -1.108 0.353 -9.586 1.00 0.00 H new ATOM 0 HG LEU A 134 -2.623 -1.597 -10.215 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -1.753 -3.869 -9.859 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.060 -3.091 -11.302 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -0.098 -3.217 -9.810 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -2.327 -2.587 -7.890 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -0.730 -1.808 -7.793 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -2.203 -0.812 -7.867 1.00 0.00 H new ATOM 1831 N ARG A 135 1.148 -1.173 -12.509 1.00 0.00 N ATOM 1832 CA ARG A 135 1.980 -2.153 -13.202 1.00 0.00 C ATOM 1833 C ARG A 135 2.482 -3.168 -12.189 1.00 0.00 C ATOM 1834 O ARG A 135 2.263 -3.016 -10.989 1.00 0.00 O ATOM 1835 CB ARG A 135 3.192 -1.483 -13.861 1.00 0.00 C ATOM 1836 CG ARG A 135 2.854 -0.260 -14.729 1.00 0.00 C ATOM 1837 CD ARG A 135 4.125 0.309 -15.366 1.00 0.00 C ATOM 1838 NE ARG A 135 4.746 -0.657 -16.273 1.00 0.00 N ATOM 1839 CZ ARG A 135 4.310 -1.063 -17.465 1.00 0.00 C ATOM 1840 NH1 ARG A 135 3.335 -0.432 -18.115 1.00 0.00 N ATOM 1841 NH2 ARG A 135 4.873 -2.138 -17.988 1.00 0.00 N ATOM 0 H ARG A 135 1.690 -0.558 -11.902 1.00 0.00 H new ATOM 0 HA ARG A 135 1.380 -2.632 -13.976 1.00 0.00 H new ATOM 0 HB2 ARG A 135 3.890 -1.177 -13.082 1.00 0.00 H new ATOM 0 HB3 ARG A 135 3.706 -2.219 -14.478 1.00 0.00 H new ATOM 0 HG2 ARG A 135 2.145 -0.543 -15.507 1.00 0.00 H new ATOM 0 HG3 ARG A 135 2.371 0.504 -14.120 1.00 0.00 H new ATOM 0 HD2 ARG A 135 3.883 1.220 -15.913 1.00 0.00 H new ATOM 0 HD3 ARG A 135 4.833 0.584 -14.585 1.00 0.00 H new ATOM 0 HE ARG A 135 5.622 -1.071 -15.953 1.00 0.00 H new ATOM 0 HH11 ARG A 135 2.896 0.391 -17.702 1.00 0.00 H new ATOM 0 HH12 ARG A 135 3.027 -0.771 -19.026 1.00 0.00 H new ATOM 0 HH21 ARG A 135 5.613 -2.624 -17.481 1.00 0.00 H new ATOM 0 HH22 ARG A 135 4.568 -2.482 -18.899 1.00 0.00 H new ATOM 1855 N THR A 136 3.204 -4.176 -12.664 1.00 0.00 N ATOM 1856 CA THR A 136 3.567 -5.334 -11.858 1.00 0.00 C ATOM 1857 C THR A 136 5.007 -5.792 -12.157 1.00 0.00 C ATOM 1858 O THR A 136 5.476 -6.794 -11.617 1.00 0.00 O ATOM 1859 CB THR A 136 2.565 -6.467 -12.158 1.00 0.00 C ATOM 1860 OG1 THR A 136 1.832 -6.230 -13.357 1.00 0.00 O ATOM 1861 CG2 THR A 136 1.546 -6.585 -11.029 1.00 0.00 C ATOM 0 H THR A 136 3.555 -4.213 -13.621 1.00 0.00 H new ATOM 0 HA THR A 136 3.527 -5.068 -10.802 1.00 0.00 H new ATOM 0 HB THR A 136 3.154 -7.378 -12.261 1.00 0.00 H new ATOM 0 HG1 THR A 136 1.210 -6.971 -13.512 1.00 0.00 H new ATOM 0 HG21 THR A 136 0.845 -7.389 -11.254 1.00 0.00 H new ATOM 0 HG22 THR A 136 2.062 -6.805 -10.094 1.00 0.00 H new ATOM 0 HG23 THR A 136 1.002 -5.646 -10.930 1.00 0.00 H new ATOM 1869 N GLU A 137 5.694 -5.036 -13.009 1.00 0.00 N ATOM 1870 CA GLU A 137 6.862 -5.379 -13.803 1.00 0.00 C ATOM 1871 C GLU A 137 6.526 -6.518 -14.748 1.00 0.00 C ATOM 1872 O GLU A 137 6.194 -6.213 -15.910 1.00 0.00 O ATOM 1873 CB GLU A 137 8.146 -5.566 -12.977 1.00 0.00 C ATOM 1874 CG GLU A 137 9.349 -5.300 -13.898 1.00 0.00 C ATOM 1875 CD GLU A 137 10.699 -5.464 -13.196 1.00 0.00 C ATOM 1876 OE1 GLU A 137 11.072 -4.609 -12.362 1.00 0.00 O ATOM 1877 OE2 GLU A 137 11.438 -6.420 -13.552 1.00 0.00 O ATOM 0 H GLU A 137 5.414 -4.069 -13.174 1.00 0.00 H new ATOM 0 HA GLU A 137 7.119 -4.521 -14.424 1.00 0.00 H new ATOM 0 HB2 GLU A 137 8.157 -4.881 -12.129 1.00 0.00 H new ATOM 0 HB3 GLU A 137 8.194 -6.576 -12.571 1.00 0.00 H new ATOM 0 HG2 GLU A 137 9.304 -5.981 -14.748 1.00 0.00 H new ATOM 0 HG3 GLU A 137 9.275 -4.288 -14.297 1.00 0.00 H new