USER MOD reduce.3.24.130724 H: found=0, std=0, add=1328, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1330 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 164 ASN : amide:sc= -0.0301 K(o=-0.7,f=-1.2) USER MOD Set 1.2: A 165 ASN : amide:sc= -0.67 K(o=-0.7,f=-1.2) USER MOD Set 2.1: A 134 LYS NZ :NH3+ 178:sc= 0.0461 (180deg=0) USER MOD Set 2.2: A 138 TYR OH : rot -178:sc= 0.132 USER MOD Set 3.1: A 130 LYS NZ :NH3+ -152:sc= 1.12 (180deg=-0.303) USER MOD Set 3.2: A 132 TYR OH : rot 180:sc= 0.997 USER MOD Set 4.1: A 124 GLN :FLIP amide:sc= 0.695 F(o=0.83!,f=1.9) USER MOD Set 4.2: A 126 THR OG1 : rot 60:sc= 1.21 USER MOD Set 5.1: A 86 SER OG : rot -135:sc= 0.517 USER MOD Set 5.2: A 91 GLN : amide:sc= 0.0224 K(o=-6.2,f=-17!) USER MOD Set 5.3: A 109 GLN : amide:sc= -6.74! C(o=-6.2!,f=-11!) USER MOD Set 6.1: A 102 GLN : amide:sc= -0.257 K(o=-0.33,f=-1.6) USER MOD Set 6.2: A 104 GLN : amide:sc= -0.077 K(o=-0.33,f=-3) USER MOD Set 7.1: A 96 ASN : amide:sc= 0.353 K(o=0.65,f=-0.027) USER MOD Set 7.2: A 99 SER OG : rot -110:sc= 0.298 USER MOD Set 8.1: A 59 GLN : amide:sc= -0.151 X(o=-1.2,f=-1) USER MOD Set 8.2: A 65 ASN : amide:sc= -1.02 X(o=-1.2,f=-1) USER MOD Set 9.1: A 50 THR OG1 : rot 180:sc= 0 USER MOD Set 9.2: A 172 THR OG1 : rot -162:sc= -0.0401 USER MOD Set 9.3: A 174 GLN : amide:sc= -1.47 X(o=-1.5,f=-1.4) USER MOD Single : A 15 SER OG : rot 79:sc= 1.07 USER MOD Single : A 19 GLN : amide:sc= -0.101 K(o=-0.1,f=-3.9!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0768 USER MOD Single : A 28 GLN : amide:sc= -0.191 K(o=-0.19,f=-3.7!) USER MOD Single : A 39 ASN : amide:sc= -1.67! C(o=-1.7!,f=-9!) USER MOD Single : A 42 GLN :FLIP amide:sc= -0.348 F(o=-2.9!,f=-0.35) USER MOD Single : A 43 LYS NZ :NH3+ 153:sc= -0.847 (180deg=-1.68) USER MOD Single : A 46 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 47 SER OG : rot 53:sc= 0.147 USER MOD Single : A 51 MET CE :methyl -147:sc= -1.71 (180deg=-2.97!) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -76:sc= -0.164 USER MOD Single : A 54 THR OG1 : rot 145:sc= 0.0425 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -1.76 K(o=-1.8,f=-6!) USER MOD Single : A 63 SER OG : rot 34:sc= 0.449 USER MOD Single : A 64 TYR OH : rot 180:sc= -1.97! USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 100:sc= 0.957 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -38:sc= -2.13! USER MOD Single : A 98 HIS : no HD1:sc= -0.157 X(o=-0.16,f=-0.54) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot -7:sc= 0.952 USER MOD Single : A 106 TYR OH : rot 180:sc= -1.22 USER MOD Single : A 113 THR OG1 : rot 177:sc= 1.27 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -1.19 X(o=-1.2,f=-0.77) USER MOD Single : A 120 MET CE :methyl 154:sc= -0.352 (180deg=-1.55!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 10:sc= 0.303 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 THR OG1 : rot -141:sc= 0.321 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0.0806 USER MOD Single : A 142 LYS NZ :NH3+ 166:sc= -0.0743 (180deg=-0.33) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 SER OG : rot 73:sc= 1.22 USER MOD Single : A 157 LYS NZ :NH3+ -163:sc= 0.682 (180deg=-0.502!) USER MOD Single : A 158 SER OG : rot 27:sc= -0.531! USER MOD Single : A 162 LYS NZ :NH3+ 171:sc= -2.02! (180deg=-2.3!) USER MOD Single : A 169 SER OG : rot -48:sc= 0.0202 USER MOD ----------------------------------------------------------------- ATOM 88 N LEU A 7 -16.915 7.913 -0.954 1.00 0.58 N ATOM 89 CA LEU A 7 -15.705 7.697 -0.182 1.00 0.51 C ATOM 90 C LEU A 7 -16.036 7.048 1.161 1.00 0.45 C ATOM 91 O LEU A 7 -17.065 7.342 1.775 1.00 0.49 O ATOM 92 CB LEU A 7 -14.947 9.022 0.013 1.00 0.52 C ATOM 93 CG LEU A 7 -15.769 10.189 0.570 1.00 0.80 C ATOM 94 CD1 LEU A 7 -15.791 10.162 2.091 1.00 1.73 C ATOM 95 CD2 LEU A 7 -15.217 11.513 0.064 1.00 1.08 C ATOM 0 HA LEU A 7 -15.056 7.016 -0.733 1.00 0.51 H new ATOM 0 HB2 LEU A 7 -14.107 8.842 0.684 1.00 0.52 H new ATOM 0 HB3 LEU A 7 -14.529 9.323 -0.947 1.00 0.52 H new ATOM 0 HG LEU A 7 -16.795 10.083 0.218 1.00 0.80 H new ATOM 0 HD11 LEU A 7 -16.381 11.001 2.461 1.00 1.73 H new ATOM 0 HD12 LEU A 7 -16.236 9.227 2.432 1.00 1.73 H new ATOM 0 HD13 LEU A 7 -14.772 10.239 2.471 1.00 1.73 H new ATOM 0 HD21 LEU A 7 -15.811 12.333 0.468 1.00 1.08 H new ATOM 0 HD22 LEU A 7 -14.181 11.622 0.386 1.00 1.08 H new ATOM 0 HD23 LEU A 7 -15.263 11.534 -1.025 1.00 1.08 H new ATOM 107 N ILE A 8 -15.185 6.133 1.582 1.00 0.43 N ATOM 108 CA ILE A 8 -15.280 5.554 2.903 1.00 0.40 C ATOM 109 C ILE A 8 -14.493 6.422 3.844 1.00 0.40 C ATOM 110 O ILE A 8 -13.474 6.974 3.444 1.00 0.62 O ATOM 111 CB ILE A 8 -14.761 4.088 2.920 1.00 0.41 C ATOM 112 CG1 ILE A 8 -15.946 3.119 2.916 1.00 0.48 C ATOM 113 CG2 ILE A 8 -13.805 3.793 4.093 1.00 0.67 C ATOM 114 CD1 ILE A 8 -15.555 1.681 2.660 1.00 0.47 C ATOM 0 H ILE A 8 -14.413 5.773 1.020 1.00 0.43 H new ATOM 0 HA ILE A 8 -16.323 5.514 3.216 1.00 0.40 H new ATOM 0 HB ILE A 8 -14.170 3.945 2.015 1.00 0.41 H new ATOM 0 HG12 ILE A 8 -16.458 3.181 3.876 1.00 0.48 H new ATOM 0 HG13 ILE A 8 -16.659 3.434 2.154 1.00 0.48 H new ATOM 0 HG21 ILE A 8 -13.481 2.754 4.045 1.00 0.67 H new ATOM 0 HG22 ILE A 8 -12.936 4.448 4.028 1.00 0.67 H new ATOM 0 HG23 ILE A 8 -14.322 3.969 5.037 1.00 0.67 H new ATOM 0 HD11 ILE A 8 -16.446 1.054 2.672 1.00 0.47 H new ATOM 0 HD12 ILE A 8 -15.070 1.604 1.687 1.00 0.47 H new ATOM 0 HD13 ILE A 8 -14.866 1.347 3.436 1.00 0.47 H new ATOM 126 N PRO A 9 -14.995 6.538 5.085 1.00 0.31 N ATOM 127 CA PRO A 9 -14.440 7.322 6.178 1.00 0.28 C ATOM 128 C PRO A 9 -13.029 7.845 5.925 1.00 0.32 C ATOM 129 O PRO A 9 -12.059 7.309 6.452 1.00 0.38 O ATOM 130 CB PRO A 9 -14.467 6.242 7.249 1.00 0.31 C ATOM 131 CG PRO A 9 -15.770 5.527 7.012 1.00 0.35 C ATOM 132 CD PRO A 9 -16.161 5.811 5.579 1.00 0.35 C ATOM 0 HA PRO A 9 -14.976 8.246 6.395 1.00 0.28 H new ATOM 0 HB2 PRO A 9 -13.618 5.565 7.155 1.00 0.31 H new ATOM 0 HB3 PRO A 9 -14.424 6.671 8.250 1.00 0.31 H new ATOM 0 HG2 PRO A 9 -15.661 4.455 7.179 1.00 0.35 H new ATOM 0 HG3 PRO A 9 -16.537 5.880 7.701 1.00 0.35 H new ATOM 0 HD2 PRO A 9 -16.340 4.895 5.016 1.00 0.35 H new ATOM 0 HD3 PRO A 9 -17.071 6.407 5.515 1.00 0.35 H new ATOM 140 N ALA A 10 -12.943 8.920 5.140 1.00 0.36 N ATOM 141 CA ALA A 10 -11.680 9.370 4.567 1.00 0.44 C ATOM 142 C ALA A 10 -10.824 10.113 5.585 1.00 0.42 C ATOM 143 O ALA A 10 -11.113 11.256 5.947 1.00 0.53 O ATOM 144 CB ALA A 10 -11.940 10.241 3.343 1.00 0.62 C ATOM 0 H ALA A 10 -13.744 9.498 4.886 1.00 0.36 H new ATOM 0 HA ALA A 10 -11.120 8.486 4.263 1.00 0.44 H new ATOM 0 HB1 ALA A 10 -10.990 10.571 2.923 1.00 0.62 H new ATOM 0 HB2 ALA A 10 -12.486 9.665 2.596 1.00 0.62 H new ATOM 0 HB3 ALA A 10 -12.530 11.110 3.634 1.00 0.62 H new ATOM 150 N PRO A 11 -9.762 9.458 6.060 1.00 0.35 N ATOM 151 CA PRO A 11 -8.825 10.009 7.015 1.00 0.35 C ATOM 152 C PRO A 11 -7.605 10.597 6.317 1.00 0.39 C ATOM 153 O PRO A 11 -7.017 9.964 5.443 1.00 0.45 O ATOM 154 CB PRO A 11 -8.436 8.771 7.842 1.00 0.35 C ATOM 155 CG PRO A 11 -8.859 7.579 7.030 1.00 0.41 C ATOM 156 CD PRO A 11 -9.374 8.097 5.716 1.00 0.38 C ATOM 0 HA PRO A 11 -9.239 10.825 7.608 1.00 0.35 H new ATOM 0 HB2 PRO A 11 -7.363 8.751 8.034 1.00 0.35 H new ATOM 0 HB3 PRO A 11 -8.933 8.778 8.812 1.00 0.35 H new ATOM 0 HG2 PRO A 11 -8.019 6.902 6.874 1.00 0.41 H new ATOM 0 HG3 PRO A 11 -9.632 7.014 7.550 1.00 0.41 H new ATOM 0 HD2 PRO A 11 -8.609 8.074 4.940 1.00 0.38 H new ATOM 0 HD3 PRO A 11 -10.218 7.512 5.349 1.00 0.38 H new ATOM 164 N PRO A 12 -7.225 11.829 6.662 1.00 0.42 N ATOM 165 CA PRO A 12 -6.012 12.444 6.131 1.00 0.46 C ATOM 166 C PRO A 12 -4.759 11.698 6.564 1.00 0.44 C ATOM 167 O PRO A 12 -4.803 10.903 7.507 1.00 0.41 O ATOM 168 CB PRO A 12 -6.007 13.858 6.721 1.00 0.50 C ATOM 169 CG PRO A 12 -6.954 13.805 7.875 1.00 0.55 C ATOM 170 CD PRO A 12 -7.957 12.730 7.564 1.00 0.48 C ATOM 0 HA PRO A 12 -6.008 12.432 5.041 1.00 0.46 H new ATOM 0 HB2 PRO A 12 -5.007 14.146 7.045 1.00 0.50 H new ATOM 0 HB3 PRO A 12 -6.327 14.594 5.983 1.00 0.50 H new ATOM 0 HG2 PRO A 12 -6.423 13.583 8.801 1.00 0.55 H new ATOM 0 HG3 PRO A 12 -7.448 14.766 8.014 1.00 0.55 H new ATOM 0 HD2 PRO A 12 -8.286 12.215 8.466 1.00 0.48 H new ATOM 0 HD3 PRO A 12 -8.848 13.138 7.087 1.00 0.48 H new ATOM 178 N LEU A 13 -3.658 11.972 5.884 1.00 0.50 N ATOM 179 CA LEU A 13 -2.348 11.404 6.211 1.00 0.51 C ATOM 180 C LEU A 13 -2.112 11.496 7.705 1.00 0.49 C ATOM 181 O LEU A 13 -1.657 10.561 8.346 1.00 0.48 O ATOM 182 CB LEU A 13 -1.287 12.236 5.475 1.00 0.61 C ATOM 183 CG LEU A 13 0.155 11.697 5.444 1.00 0.60 C ATOM 184 CD1 LEU A 13 0.747 11.622 6.835 1.00 0.50 C ATOM 185 CD2 LEU A 13 0.228 10.334 4.770 1.00 0.74 C ATOM 0 H LEU A 13 -3.642 12.600 5.081 1.00 0.50 H new ATOM 0 HA LEU A 13 -2.297 10.357 5.911 1.00 0.51 H new ATOM 0 HB2 LEU A 13 -1.618 12.365 4.445 1.00 0.61 H new ATOM 0 HB3 LEU A 13 -1.264 13.227 5.929 1.00 0.61 H new ATOM 0 HG LEU A 13 0.744 12.401 4.856 1.00 0.60 H new ATOM 0 HD11 LEU A 13 1.765 11.238 6.777 1.00 0.50 H new ATOM 0 HD12 LEU A 13 0.760 12.617 7.279 1.00 0.50 H new ATOM 0 HD13 LEU A 13 0.143 10.957 7.452 1.00 0.50 H new ATOM 0 HD21 LEU A 13 1.261 9.985 4.766 1.00 0.74 H new ATOM 0 HD22 LEU A 13 -0.393 9.624 5.316 1.00 0.74 H new ATOM 0 HD23 LEU A 13 -0.131 10.416 3.744 1.00 0.74 H new ATOM 197 N ILE A 14 -2.470 12.629 8.244 1.00 0.52 N ATOM 198 CA ILE A 14 -2.177 12.975 9.618 1.00 0.56 C ATOM 199 C ILE A 14 -2.799 11.987 10.620 1.00 0.54 C ATOM 200 O ILE A 14 -2.482 12.014 11.808 1.00 0.61 O ATOM 201 CB ILE A 14 -2.674 14.407 9.861 1.00 0.66 C ATOM 202 CG1 ILE A 14 -4.200 14.429 10.026 1.00 0.79 C ATOM 203 CG2 ILE A 14 -2.254 15.274 8.675 1.00 0.65 C ATOM 204 CD1 ILE A 14 -4.817 15.798 9.838 1.00 1.05 C ATOM 0 H ILE A 14 -2.981 13.352 7.738 1.00 0.52 H new ATOM 0 HA ILE A 14 -1.101 12.915 9.780 1.00 0.56 H new ATOM 0 HB ILE A 14 -2.235 14.797 10.779 1.00 0.66 H new ATOM 0 HG12 ILE A 14 -4.643 13.740 9.307 1.00 0.79 H new ATOM 0 HG13 ILE A 14 -4.454 14.060 11.020 1.00 0.79 H new ATOM 0 HG21 ILE A 14 -2.599 16.296 8.831 1.00 0.65 H new ATOM 0 HG22 ILE A 14 -1.168 15.268 8.586 1.00 0.65 H new ATOM 0 HG23 ILE A 14 -2.695 14.878 7.760 1.00 0.65 H new ATOM 0 HD11 ILE A 14 -5.897 15.732 9.970 1.00 1.05 H new ATOM 0 HD12 ILE A 14 -4.403 16.488 10.574 1.00 1.05 H new ATOM 0 HD13 ILE A 14 -4.596 16.162 8.835 1.00 1.05 H new ATOM 216 N SER A 15 -3.667 11.104 10.129 1.00 0.46 N ATOM 217 CA SER A 15 -4.273 10.077 10.964 1.00 0.46 C ATOM 218 C SER A 15 -3.296 8.923 11.201 1.00 0.46 C ATOM 219 O SER A 15 -3.368 8.236 12.220 1.00 0.51 O ATOM 220 CB SER A 15 -5.545 9.541 10.297 1.00 0.42 C ATOM 221 OG SER A 15 -6.333 10.602 9.775 1.00 0.92 O ATOM 0 H SER A 15 -3.965 11.082 9.154 1.00 0.46 H new ATOM 0 HA SER A 15 -4.526 10.525 11.925 1.00 0.46 H new ATOM 0 HB2 SER A 15 -5.277 8.854 9.495 1.00 0.42 H new ATOM 0 HB3 SER A 15 -6.128 8.973 11.022 1.00 0.42 H new ATOM 0 HG SER A 15 -5.950 10.907 8.926 1.00 0.92 H new ATOM 227 N VAL A 16 -2.373 8.725 10.266 1.00 0.43 N ATOM 228 CA VAL A 16 -1.465 7.587 10.320 1.00 0.43 C ATOM 229 C VAL A 16 -0.135 7.963 10.985 1.00 0.45 C ATOM 230 O VAL A 16 0.448 9.008 10.690 1.00 0.50 O ATOM 231 CB VAL A 16 -1.218 6.990 8.905 1.00 0.45 C ATOM 232 CG1 VAL A 16 -0.583 7.997 7.949 1.00 0.54 C ATOM 233 CG2 VAL A 16 -0.359 5.737 8.998 1.00 0.45 C ATOM 0 H VAL A 16 -2.235 9.338 9.462 1.00 0.43 H new ATOM 0 HA VAL A 16 -1.944 6.822 10.931 1.00 0.43 H new ATOM 0 HB VAL A 16 -2.194 6.729 8.496 1.00 0.45 H new ATOM 0 HG11 VAL A 16 -0.432 7.530 6.976 1.00 0.54 H new ATOM 0 HG12 VAL A 16 -1.241 8.859 7.839 1.00 0.54 H new ATOM 0 HG13 VAL A 16 0.378 8.322 8.348 1.00 0.54 H new ATOM 0 HG21 VAL A 16 -0.196 5.333 7.999 1.00 0.45 H new ATOM 0 HG22 VAL A 16 0.601 5.987 9.449 1.00 0.45 H new ATOM 0 HG23 VAL A 16 -0.866 4.993 9.612 1.00 0.45 H new ATOM 243 N PRO A 17 0.325 7.126 11.938 1.00 0.46 N ATOM 244 CA PRO A 17 1.614 7.311 12.623 1.00 0.50 C ATOM 245 C PRO A 17 2.812 7.109 11.696 1.00 0.43 C ATOM 246 O PRO A 17 2.727 6.399 10.695 1.00 0.48 O ATOM 247 CB PRO A 17 1.607 6.231 13.716 1.00 0.59 C ATOM 248 CG PRO A 17 0.191 5.780 13.819 1.00 0.53 C ATOM 249 CD PRO A 17 -0.386 5.944 12.446 1.00 0.50 C ATOM 0 HA PRO A 17 1.716 8.327 13.005 1.00 0.50 H new ATOM 0 HB2 PRO A 17 2.265 5.402 13.454 1.00 0.59 H new ATOM 0 HB3 PRO A 17 1.962 6.631 14.666 1.00 0.59 H new ATOM 0 HG2 PRO A 17 0.133 4.742 14.147 1.00 0.53 H new ATOM 0 HG3 PRO A 17 -0.358 6.376 14.548 1.00 0.53 H new ATOM 0 HD2 PRO A 17 -0.209 5.066 11.824 1.00 0.50 H new ATOM 0 HD3 PRO A 17 -1.464 6.101 12.476 1.00 0.50 H new ATOM 257 N LEU A 18 3.932 7.722 12.063 1.00 0.42 N ATOM 258 CA LEU A 18 5.133 7.719 11.237 1.00 0.38 C ATOM 259 C LEU A 18 6.160 6.719 11.754 1.00 0.33 C ATOM 260 O LEU A 18 6.287 6.522 12.963 1.00 0.35 O ATOM 261 CB LEU A 18 5.754 9.122 11.239 1.00 0.46 C ATOM 262 CG LEU A 18 7.063 9.271 10.462 1.00 0.63 C ATOM 263 CD1 LEU A 18 6.828 9.104 8.970 1.00 1.15 C ATOM 264 CD2 LEU A 18 7.699 10.619 10.755 1.00 1.07 C ATOM 0 H LEU A 18 4.033 8.234 12.940 1.00 0.42 H new ATOM 0 HA LEU A 18 4.849 7.429 10.225 1.00 0.38 H new ATOM 0 HB2 LEU A 18 5.027 9.821 10.826 1.00 0.46 H new ATOM 0 HB3 LEU A 18 5.931 9.419 12.273 1.00 0.46 H new ATOM 0 HG LEU A 18 7.746 8.486 10.786 1.00 0.63 H new ATOM 0 HD11 LEU A 18 7.773 9.214 8.438 1.00 1.15 H new ATOM 0 HD12 LEU A 18 6.415 8.114 8.775 1.00 1.15 H new ATOM 0 HD13 LEU A 18 6.127 9.864 8.625 1.00 1.15 H new ATOM 0 HD21 LEU A 18 8.630 10.711 10.195 1.00 1.07 H new ATOM 0 HD22 LEU A 18 7.017 11.415 10.458 1.00 1.07 H new ATOM 0 HD23 LEU A 18 7.908 10.699 11.822 1.00 1.07 H new ATOM 276 N GLN A 19 6.875 6.080 10.831 1.00 0.36 N ATOM 277 CA GLN A 19 8.059 5.305 11.179 1.00 0.47 C ATOM 278 C GLN A 19 9.151 6.272 11.646 1.00 0.62 C ATOM 279 O GLN A 19 9.724 6.999 10.832 1.00 0.68 O ATOM 280 CB GLN A 19 8.563 4.500 9.971 1.00 0.49 C ATOM 281 CG GLN A 19 9.751 3.613 10.286 1.00 1.04 C ATOM 282 CD GLN A 19 9.443 2.561 11.334 1.00 2.08 C ATOM 283 OE1 GLN A 19 8.315 2.082 11.449 1.00 2.68 O ATOM 284 NE2 GLN A 19 10.448 2.190 12.107 1.00 2.93 N ATOM 0 H GLN A 19 6.653 6.085 9.835 1.00 0.36 H new ATOM 0 HA GLN A 19 7.807 4.601 11.972 1.00 0.47 H new ATOM 0 HB2 GLN A 19 7.749 3.882 9.592 1.00 0.49 H new ATOM 0 HB3 GLN A 19 8.837 5.191 9.174 1.00 0.49 H new ATOM 0 HG2 GLN A 19 10.083 3.121 9.372 1.00 1.04 H new ATOM 0 HG3 GLN A 19 10.578 4.232 10.633 1.00 1.04 H new ATOM 0 HE21 GLN A 19 11.369 2.609 11.982 1.00 2.93 H new ATOM 0 HE22 GLN A 19 10.303 1.484 12.829 1.00 2.93 H new ATOM 293 N PRO A 20 9.447 6.306 12.956 1.00 0.92 N ATOM 294 CA PRO A 20 10.345 7.313 13.534 1.00 1.20 C ATOM 295 C PRO A 20 11.795 7.166 13.081 1.00 1.19 C ATOM 296 O PRO A 20 12.406 6.101 13.231 1.00 1.36 O ATOM 297 CB PRO A 20 10.231 7.077 15.040 1.00 1.58 C ATOM 298 CG PRO A 20 9.804 5.657 15.174 1.00 1.65 C ATOM 299 CD PRO A 20 8.944 5.366 13.973 1.00 1.15 C ATOM 0 HA PRO A 20 10.062 8.317 13.218 1.00 1.20 H new ATOM 0 HB2 PRO A 20 11.183 7.252 15.541 1.00 1.58 H new ATOM 0 HB3 PRO A 20 9.504 7.752 15.492 1.00 1.58 H new ATOM 0 HG2 PRO A 20 10.667 4.992 15.206 1.00 1.65 H new ATOM 0 HG3 PRO A 20 9.248 5.503 16.099 1.00 1.65 H new ATOM 0 HD2 PRO A 20 9.045 4.331 13.648 1.00 1.15 H new ATOM 0 HD3 PRO A 20 7.888 5.532 14.186 1.00 1.15 H new ATOM 307 N GLY A 21 12.328 8.252 12.529 1.00 1.32 N ATOM 308 CA GLY A 21 13.716 8.298 12.098 1.00 1.38 C ATOM 309 C GLY A 21 14.112 7.135 11.213 1.00 1.06 C ATOM 310 O GLY A 21 15.011 6.367 11.560 1.00 1.29 O ATOM 0 H GLY A 21 11.812 9.117 12.370 1.00 1.32 H new ATOM 0 HA2 GLY A 21 13.890 9.230 11.560 1.00 1.38 H new ATOM 0 HA3 GLY A 21 14.361 8.312 12.977 1.00 1.38 H new ATOM 314 N PHE A 22 13.447 6.993 10.078 1.00 0.69 N ATOM 315 CA PHE A 22 13.751 5.903 9.168 1.00 0.51 C ATOM 316 C PHE A 22 14.546 6.426 7.979 1.00 0.51 C ATOM 317 O PHE A 22 14.658 7.639 7.781 1.00 0.68 O ATOM 318 CB PHE A 22 12.470 5.208 8.707 1.00 0.71 C ATOM 319 CG PHE A 22 12.671 3.755 8.370 1.00 1.19 C ATOM 320 CD1 PHE A 22 13.619 2.998 9.045 1.00 2.08 C ATOM 321 CD2 PHE A 22 11.912 3.144 7.388 1.00 0.91 C ATOM 322 CE1 PHE A 22 13.805 1.662 8.746 1.00 2.66 C ATOM 323 CE2 PHE A 22 12.093 1.807 7.087 1.00 1.43 C ATOM 324 CZ PHE A 22 13.039 1.066 7.766 1.00 2.32 C ATOM 0 H PHE A 22 12.699 7.614 9.767 1.00 0.69 H new ATOM 0 HA PHE A 22 14.357 5.165 9.694 1.00 0.51 H new ATOM 0 HB2 PHE A 22 11.717 5.292 9.491 1.00 0.71 H new ATOM 0 HB3 PHE A 22 12.078 5.726 7.832 1.00 0.71 H new ATOM 0 HD1 PHE A 22 14.220 3.460 9.815 1.00 2.08 H new ATOM 0 HD2 PHE A 22 11.171 3.717 6.851 1.00 0.91 H new ATOM 0 HE1 PHE A 22 14.548 1.086 9.278 1.00 2.66 H new ATOM 0 HE2 PHE A 22 11.493 1.341 6.319 1.00 1.43 H new ATOM 0 HZ PHE A 22 13.179 0.021 7.530 1.00 2.32 H new ATOM 334 N TRP A 23 15.089 5.517 7.186 1.00 0.48 N ATOM 335 CA TRP A 23 16.028 5.896 6.144 1.00 0.57 C ATOM 336 C TRP A 23 15.559 5.442 4.772 1.00 0.50 C ATOM 337 O TRP A 23 14.906 4.405 4.649 1.00 0.51 O ATOM 338 CB TRP A 23 17.408 5.304 6.437 1.00 0.78 C ATOM 339 CG TRP A 23 17.898 5.597 7.819 1.00 1.35 C ATOM 340 CD1 TRP A 23 17.821 4.777 8.908 1.00 2.36 C ATOM 341 CD2 TRP A 23 18.529 6.799 8.264 1.00 2.01 C ATOM 342 NE1 TRP A 23 18.368 5.397 10.003 1.00 3.05 N ATOM 343 CE2 TRP A 23 18.813 6.639 9.632 1.00 2.82 C ATOM 344 CE3 TRP A 23 18.888 7.994 7.635 1.00 2.70 C ATOM 345 CZ2 TRP A 23 19.433 7.631 10.382 1.00 3.70 C ATOM 346 CZ3 TRP A 23 19.502 8.979 8.382 1.00 3.72 C ATOM 347 CH2 TRP A 23 19.772 8.791 9.741 1.00 4.03 C ATOM 0 H TRP A 23 14.897 4.517 7.243 1.00 0.48 H new ATOM 0 HA TRP A 23 16.089 6.984 6.138 1.00 0.57 H new ATOM 0 HB2 TRP A 23 17.370 4.224 6.294 1.00 0.78 H new ATOM 0 HB3 TRP A 23 18.124 5.696 5.715 1.00 0.78 H new ATOM 0 HD1 TRP A 23 17.392 3.786 8.908 1.00 2.36 H new ATOM 0 HE1 TRP A 23 18.433 4.999 10.940 1.00 3.05 H new ATOM 0 HE3 TRP A 23 18.689 8.144 6.584 1.00 2.70 H new ATOM 0 HZ2 TRP A 23 19.640 7.491 11.433 1.00 3.70 H new ATOM 0 HZ3 TRP A 23 19.778 9.910 7.909 1.00 3.72 H new ATOM 0 HH2 TRP A 23 20.259 9.579 10.297 1.00 4.03 H new ATOM 358 N THR A 24 15.903 6.221 3.756 1.00 0.50 N ATOM 359 CA THR A 24 15.598 5.894 2.368 1.00 0.47 C ATOM 360 C THR A 24 15.984 4.457 2.024 1.00 0.46 C ATOM 361 O THR A 24 15.148 3.649 1.613 1.00 0.48 O ATOM 362 CB THR A 24 16.367 6.843 1.443 1.00 0.50 C ATOM 363 OG1 THR A 24 17.515 7.360 2.131 1.00 0.58 O ATOM 364 CG2 THR A 24 15.481 7.976 0.969 1.00 0.53 C ATOM 0 H THR A 24 16.404 7.102 3.871 1.00 0.50 H new ATOM 0 HA THR A 24 14.522 6.003 2.231 1.00 0.47 H new ATOM 0 HB THR A 24 16.694 6.286 0.565 1.00 0.50 H new ATOM 0 HG1 THR A 24 18.007 7.965 1.538 1.00 0.58 H new ATOM 0 HG21 THR A 24 16.052 8.635 0.314 1.00 0.53 H new ATOM 0 HG22 THR A 24 14.631 7.569 0.422 1.00 0.53 H new ATOM 0 HG23 THR A 24 15.122 8.541 1.829 1.00 0.53 H new ATOM 372 N GLU A 25 17.254 4.149 2.239 1.00 0.53 N ATOM 373 CA GLU A 25 17.828 2.871 1.839 1.00 0.60 C ATOM 374 C GLU A 25 17.339 1.726 2.719 1.00 0.60 C ATOM 375 O GLU A 25 17.367 0.565 2.318 1.00 0.63 O ATOM 376 CB GLU A 25 19.344 2.962 1.909 1.00 0.71 C ATOM 377 CG GLU A 25 19.853 3.361 3.281 1.00 1.31 C ATOM 378 CD GLU A 25 21.338 3.623 3.291 1.00 1.63 C ATOM 379 OE1 GLU A 25 22.114 2.656 3.177 1.00 1.88 O ATOM 380 OE2 GLU A 25 21.734 4.799 3.405 1.00 1.94 O ATOM 0 H GLU A 25 17.916 4.777 2.695 1.00 0.53 H new ATOM 0 HA GLU A 25 17.507 2.660 0.819 1.00 0.60 H new ATOM 0 HB2 GLU A 25 19.773 1.998 1.635 1.00 0.71 H new ATOM 0 HB3 GLU A 25 19.693 3.687 1.174 1.00 0.71 H new ATOM 0 HG2 GLU A 25 19.327 4.256 3.614 1.00 1.31 H new ATOM 0 HG3 GLU A 25 19.622 2.571 3.995 1.00 1.31 H new ATOM 387 N ARG A 26 16.893 2.053 3.918 1.00 0.64 N ATOM 388 CA ARG A 26 16.443 1.036 4.856 1.00 0.76 C ATOM 389 C ARG A 26 14.973 0.712 4.614 1.00 0.71 C ATOM 390 O ARG A 26 14.422 -0.212 5.208 1.00 0.87 O ATOM 391 CB ARG A 26 16.677 1.495 6.296 1.00 0.96 C ATOM 392 CG ARG A 26 18.129 1.858 6.580 1.00 1.62 C ATOM 393 CD ARG A 26 19.067 0.676 6.371 1.00 2.07 C ATOM 394 NE ARG A 26 18.984 -0.292 7.461 1.00 2.61 N ATOM 395 CZ ARG A 26 19.324 -1.574 7.352 1.00 3.42 C ATOM 396 NH1 ARG A 26 19.730 -2.064 6.184 1.00 3.88 N ATOM 397 NH2 ARG A 26 19.262 -2.364 8.417 1.00 4.18 N ATOM 0 H ARG A 26 16.832 3.010 4.266 1.00 0.64 H new ATOM 0 HA ARG A 26 17.023 0.127 4.696 1.00 0.76 H new ATOM 0 HB2 ARG A 26 16.046 2.359 6.502 1.00 0.96 H new ATOM 0 HB3 ARG A 26 16.367 0.703 6.978 1.00 0.96 H new ATOM 0 HG2 ARG A 26 18.431 2.679 5.930 1.00 1.62 H new ATOM 0 HG3 ARG A 26 18.219 2.215 7.606 1.00 1.62 H new ATOM 0 HD2 ARG A 26 18.824 0.183 5.430 1.00 2.07 H new ATOM 0 HD3 ARG A 26 20.092 1.038 6.286 1.00 2.07 H new ATOM 0 HE ARG A 26 18.643 0.036 8.365 1.00 2.61 H new ATOM 0 HH11 ARG A 26 19.782 -1.456 5.366 1.00 3.88 H new ATOM 0 HH12 ARG A 26 19.989 -3.047 6.106 1.00 3.88 H new ATOM 0 HH21 ARG A 26 18.955 -1.988 9.314 1.00 4.18 H new ATOM 0 HH22 ARG A 26 19.522 -3.347 8.338 1.00 4.18 H new ATOM 411 N PHE A 27 14.355 1.489 3.735 1.00 0.59 N ATOM 412 CA PHE A 27 12.996 1.224 3.284 1.00 0.61 C ATOM 413 C PHE A 27 13.064 0.707 1.844 1.00 0.51 C ATOM 414 O PHE A 27 12.084 0.708 1.112 1.00 0.72 O ATOM 415 CB PHE A 27 12.153 2.515 3.375 1.00 0.71 C ATOM 416 CG PHE A 27 10.653 2.308 3.399 1.00 1.11 C ATOM 417 CD1 PHE A 27 9.931 2.216 2.221 1.00 1.74 C ATOM 418 CD2 PHE A 27 9.962 2.228 4.606 1.00 0.95 C ATOM 419 CE1 PHE A 27 8.560 2.041 2.239 1.00 2.21 C ATOM 420 CE2 PHE A 27 8.589 2.057 4.626 1.00 1.39 C ATOM 421 CZ PHE A 27 7.889 1.961 3.442 1.00 2.03 C ATOM 0 H PHE A 27 14.779 2.317 3.316 1.00 0.59 H new ATOM 0 HA PHE A 27 12.520 0.473 3.915 1.00 0.61 H new ATOM 0 HB2 PHE A 27 12.443 3.056 4.276 1.00 0.71 H new ATOM 0 HB3 PHE A 27 12.402 3.152 2.526 1.00 0.71 H new ATOM 0 HD1 PHE A 27 10.447 2.282 1.274 1.00 1.74 H new ATOM 0 HD2 PHE A 27 10.504 2.300 5.537 1.00 0.95 H new ATOM 0 HE1 PHE A 27 8.013 1.967 1.310 1.00 2.21 H new ATOM 0 HE2 PHE A 27 8.066 1.999 5.569 1.00 1.39 H new ATOM 0 HZ PHE A 27 6.818 1.823 3.456 1.00 2.03 H new ATOM 431 N GLN A 28 14.255 0.269 1.444 1.00 0.40 N ATOM 432 CA GLN A 28 14.479 -0.235 0.097 1.00 0.31 C ATOM 433 C GLN A 28 14.484 -1.756 0.077 1.00 0.30 C ATOM 434 O GLN A 28 14.969 -2.403 1.005 1.00 0.37 O ATOM 435 CB GLN A 28 15.796 0.343 -0.449 1.00 0.28 C ATOM 436 CG GLN A 28 16.298 -0.245 -1.766 1.00 0.45 C ATOM 437 CD GLN A 28 17.265 -1.406 -1.586 1.00 0.77 C ATOM 438 OE1 GLN A 28 16.875 -2.574 -1.601 1.00 1.73 O ATOM 439 NE2 GLN A 28 18.540 -1.090 -1.419 1.00 1.23 N ATOM 0 H GLN A 28 15.083 0.254 2.040 1.00 0.40 H new ATOM 0 HA GLN A 28 13.662 0.087 -0.549 1.00 0.31 H new ATOM 0 HB2 GLN A 28 15.670 1.418 -0.580 1.00 0.28 H new ATOM 0 HB3 GLN A 28 16.570 0.203 0.305 1.00 0.28 H new ATOM 0 HG2 GLN A 28 15.444 -0.583 -2.353 1.00 0.45 H new ATOM 0 HG3 GLN A 28 16.789 0.540 -2.341 1.00 0.45 H new ATOM 0 HE21 GLN A 28 18.826 -0.111 -1.412 1.00 1.23 H new ATOM 0 HE22 GLN A 28 19.236 -1.826 -1.297 1.00 1.23 H new ATOM 448 N GLY A 29 13.927 -2.316 -0.985 1.00 0.29 N ATOM 449 CA GLY A 29 13.910 -3.758 -1.143 1.00 0.32 C ATOM 450 C GLY A 29 12.552 -4.309 -1.512 1.00 0.30 C ATOM 451 O GLY A 29 11.679 -3.579 -1.982 1.00 0.28 O ATOM 0 H GLY A 29 13.485 -1.797 -1.744 1.00 0.29 H new ATOM 0 HA2 GLY A 29 14.629 -4.040 -1.913 1.00 0.32 H new ATOM 0 HA3 GLY A 29 14.241 -4.221 -0.213 1.00 0.32 H new ATOM 455 N ARG A 30 12.381 -5.606 -1.296 1.00 0.35 N ATOM 456 CA ARG A 30 11.181 -6.312 -1.723 1.00 0.36 C ATOM 457 C ARG A 30 10.161 -6.394 -0.603 1.00 0.39 C ATOM 458 O ARG A 30 10.439 -6.953 0.456 1.00 0.51 O ATOM 459 CB ARG A 30 11.507 -7.743 -2.177 1.00 0.46 C ATOM 460 CG ARG A 30 12.281 -7.847 -3.485 1.00 0.51 C ATOM 461 CD ARG A 30 13.708 -7.342 -3.346 1.00 0.66 C ATOM 462 NE ARG A 30 14.393 -7.980 -2.220 1.00 1.20 N ATOM 463 CZ ARG A 30 15.437 -7.453 -1.580 1.00 1.70 C ATOM 464 NH1 ARG A 30 15.976 -6.314 -1.991 1.00 1.65 N ATOM 465 NH2 ARG A 30 15.952 -8.075 -0.528 1.00 2.57 N ATOM 0 H ARG A 30 13.066 -6.195 -0.823 1.00 0.35 H new ATOM 0 HA ARG A 30 10.769 -5.744 -2.557 1.00 0.36 H new ATOM 0 HB2 ARG A 30 12.083 -8.234 -1.392 1.00 0.46 H new ATOM 0 HB3 ARG A 30 10.573 -8.296 -2.281 1.00 0.46 H new ATOM 0 HG2 ARG A 30 12.295 -8.885 -3.816 1.00 0.51 H new ATOM 0 HG3 ARG A 30 11.767 -7.273 -4.256 1.00 0.51 H new ATOM 0 HD2 ARG A 30 14.257 -7.539 -4.267 1.00 0.66 H new ATOM 0 HD3 ARG A 30 13.701 -6.261 -3.205 1.00 0.66 H new ATOM 0 HE ARG A 30 14.049 -8.887 -1.905 1.00 1.20 H new ATOM 0 HH11 ARG A 30 15.592 -5.832 -2.804 1.00 1.65 H new ATOM 0 HH12 ARG A 30 16.775 -5.919 -1.494 1.00 1.65 H new ATOM 0 HH21 ARG A 30 15.549 -8.956 -0.209 1.00 2.57 H new ATOM 0 HH22 ARG A 30 16.751 -7.672 -0.038 1.00 2.57 H new ATOM 479 N TRP A 31 8.982 -5.849 -0.840 1.00 0.34 N ATOM 480 CA TRP A 31 7.875 -6.011 0.084 1.00 0.42 C ATOM 481 C TRP A 31 6.672 -6.608 -0.629 1.00 0.34 C ATOM 482 O TRP A 31 6.197 -6.085 -1.641 1.00 0.34 O ATOM 483 CB TRP A 31 7.515 -4.687 0.757 1.00 0.55 C ATOM 484 CG TRP A 31 8.273 -4.450 2.032 1.00 0.85 C ATOM 485 CD1 TRP A 31 7.848 -4.742 3.295 1.00 1.94 C ATOM 486 CD2 TRP A 31 9.585 -3.888 2.173 1.00 0.74 C ATOM 487 NE1 TRP A 31 8.809 -4.390 4.213 1.00 1.91 N ATOM 488 CE2 TRP A 31 9.884 -3.863 3.549 1.00 0.91 C ATOM 489 CE3 TRP A 31 10.534 -3.401 1.272 1.00 1.79 C ATOM 490 CZ2 TRP A 31 11.091 -3.370 4.041 1.00 0.90 C ATOM 491 CZ3 TRP A 31 11.728 -2.914 1.762 1.00 2.36 C ATOM 492 CH2 TRP A 31 11.999 -2.901 3.134 1.00 1.70 C ATOM 0 H TRP A 31 8.766 -5.290 -1.665 1.00 0.34 H new ATOM 0 HA TRP A 31 8.186 -6.701 0.868 1.00 0.42 H new ATOM 0 HB2 TRP A 31 7.714 -3.869 0.065 1.00 0.55 H new ATOM 0 HB3 TRP A 31 6.446 -4.673 0.969 1.00 0.55 H new ATOM 0 HD1 TRP A 31 6.894 -5.186 3.539 1.00 1.94 H new ATOM 0 HE1 TRP A 31 8.733 -4.503 5.224 1.00 1.91 H new ATOM 0 HE3 TRP A 31 10.337 -3.406 0.210 1.00 1.79 H new ATOM 0 HZ2 TRP A 31 11.301 -3.359 5.100 1.00 0.90 H new ATOM 0 HZ3 TRP A 31 12.468 -2.535 1.073 1.00 2.36 H new ATOM 0 HH2 TRP A 31 12.944 -2.513 3.483 1.00 1.70 H new ATOM 503 N PHE A 32 6.208 -7.727 -0.103 1.00 0.31 N ATOM 504 CA PHE A 32 5.081 -8.447 -0.662 1.00 0.30 C ATOM 505 C PHE A 32 3.793 -8.034 0.018 1.00 0.29 C ATOM 506 O PHE A 32 3.753 -7.860 1.235 1.00 0.33 O ATOM 507 CB PHE A 32 5.273 -9.954 -0.483 1.00 0.38 C ATOM 508 CG PHE A 32 6.345 -10.543 -1.347 1.00 0.63 C ATOM 509 CD1 PHE A 32 7.678 -10.483 -0.971 1.00 1.10 C ATOM 510 CD2 PHE A 32 6.013 -11.162 -2.534 1.00 0.68 C ATOM 511 CE1 PHE A 32 8.659 -11.034 -1.771 1.00 1.62 C ATOM 512 CE2 PHE A 32 6.984 -11.716 -3.338 1.00 1.17 C ATOM 513 CZ PHE A 32 8.312 -11.652 -2.956 1.00 1.64 C ATOM 0 H PHE A 32 6.606 -8.163 0.729 1.00 0.31 H new ATOM 0 HA PHE A 32 5.023 -8.207 -1.724 1.00 0.30 H new ATOM 0 HB2 PHE A 32 5.511 -10.157 0.561 1.00 0.38 H new ATOM 0 HB3 PHE A 32 4.331 -10.457 -0.699 1.00 0.38 H new ATOM 0 HD1 PHE A 32 7.951 -10.001 -0.044 1.00 1.10 H new ATOM 0 HD2 PHE A 32 4.978 -11.213 -2.837 1.00 0.68 H new ATOM 0 HE1 PHE A 32 9.695 -10.982 -1.471 1.00 1.62 H new ATOM 0 HE2 PHE A 32 6.710 -12.199 -4.264 1.00 1.17 H new ATOM 0 HZ PHE A 32 9.077 -12.085 -3.584 1.00 1.64 H new ATOM 523 N VAL A 33 2.745 -7.874 -0.767 1.00 0.28 N ATOM 524 CA VAL A 33 1.428 -7.595 -0.215 1.00 0.30 C ATOM 525 C VAL A 33 0.867 -8.857 0.415 1.00 0.31 C ATOM 526 O VAL A 33 0.530 -9.797 -0.290 1.00 0.52 O ATOM 527 CB VAL A 33 0.436 -7.113 -1.290 1.00 0.34 C ATOM 528 CG1 VAL A 33 -0.695 -6.312 -0.664 1.00 0.74 C ATOM 529 CG2 VAL A 33 1.150 -6.319 -2.360 1.00 0.74 C ATOM 0 H VAL A 33 2.776 -7.932 -1.785 1.00 0.28 H new ATOM 0 HA VAL A 33 1.549 -6.803 0.524 1.00 0.30 H new ATOM 0 HB VAL A 33 -0.006 -7.989 -1.766 1.00 0.34 H new ATOM 0 HG11 VAL A 33 -1.382 -5.983 -1.443 1.00 0.74 H new ATOM 0 HG12 VAL A 33 -1.230 -6.936 0.052 1.00 0.74 H new ATOM 0 HG13 VAL A 33 -0.284 -5.442 -0.151 1.00 0.74 H new ATOM 0 HG21 VAL A 33 0.430 -5.988 -3.109 1.00 0.74 H new ATOM 0 HG22 VAL A 33 1.630 -5.450 -1.909 1.00 0.74 H new ATOM 0 HG23 VAL A 33 1.906 -6.945 -2.834 1.00 0.74 H new ATOM 539 N VAL A 34 0.783 -8.886 1.729 1.00 0.20 N ATOM 540 CA VAL A 34 0.253 -10.050 2.422 1.00 0.25 C ATOM 541 C VAL A 34 -1.210 -9.812 2.801 1.00 0.28 C ATOM 542 O VAL A 34 -1.986 -10.751 2.993 1.00 0.47 O ATOM 543 CB VAL A 34 1.087 -10.380 3.681 1.00 0.30 C ATOM 544 CG1 VAL A 34 0.617 -11.676 4.327 1.00 0.40 C ATOM 545 CG2 VAL A 34 2.564 -10.465 3.329 1.00 0.29 C ATOM 0 H VAL A 34 1.073 -8.122 2.340 1.00 0.20 H new ATOM 0 HA VAL A 34 0.313 -10.904 1.748 1.00 0.25 H new ATOM 0 HB VAL A 34 0.944 -9.575 4.402 1.00 0.30 H new ATOM 0 HG11 VAL A 34 1.222 -11.883 5.210 1.00 0.40 H new ATOM 0 HG12 VAL A 34 -0.429 -11.579 4.618 1.00 0.40 H new ATOM 0 HG13 VAL A 34 0.721 -12.496 3.616 1.00 0.40 H new ATOM 0 HG21 VAL A 34 3.139 -10.698 4.225 1.00 0.29 H new ATOM 0 HG22 VAL A 34 2.717 -11.248 2.586 1.00 0.29 H new ATOM 0 HG23 VAL A 34 2.897 -9.510 2.923 1.00 0.29 H new ATOM 555 N GLY A 35 -1.582 -8.541 2.882 1.00 0.19 N ATOM 556 CA GLY A 35 -2.956 -8.178 3.173 1.00 0.19 C ATOM 557 C GLY A 35 -3.297 -6.806 2.629 1.00 0.17 C ATOM 558 O GLY A 35 -2.394 -6.022 2.313 1.00 0.18 O ATOM 0 H GLY A 35 -0.952 -7.750 2.750 1.00 0.19 H new ATOM 0 HA2 GLY A 35 -3.628 -8.919 2.740 1.00 0.19 H new ATOM 0 HA3 GLY A 35 -3.116 -8.193 4.251 1.00 0.19 H new ATOM 562 N LEU A 36 -4.585 -6.496 2.524 1.00 0.17 N ATOM 563 CA LEU A 36 -5.000 -5.230 1.949 1.00 0.18 C ATOM 564 C LEU A 36 -6.387 -4.813 2.428 1.00 0.16 C ATOM 565 O LEU A 36 -7.332 -5.586 2.389 1.00 0.18 O ATOM 566 CB LEU A 36 -5.002 -5.320 0.430 1.00 0.20 C ATOM 567 CG LEU A 36 -5.071 -3.971 -0.277 1.00 0.24 C ATOM 568 CD1 LEU A 36 -3.725 -3.264 -0.230 1.00 0.31 C ATOM 569 CD2 LEU A 36 -5.546 -4.149 -1.701 1.00 0.30 C ATOM 0 H LEU A 36 -5.349 -7.100 2.827 1.00 0.17 H new ATOM 0 HA LEU A 36 -4.285 -4.476 2.279 1.00 0.18 H new ATOM 0 HB2 LEU A 36 -4.101 -5.841 0.107 1.00 0.20 H new ATOM 0 HB3 LEU A 36 -5.851 -5.927 0.114 1.00 0.20 H new ATOM 0 HG LEU A 36 -5.791 -3.342 0.246 1.00 0.24 H new ATOM 0 HD11 LEU A 36 -3.800 -2.304 -0.741 1.00 0.31 H new ATOM 0 HD12 LEU A 36 -3.436 -3.101 0.808 1.00 0.31 H new ATOM 0 HD13 LEU A 36 -2.973 -3.880 -0.724 1.00 0.31 H new ATOM 0 HD21 LEU A 36 -5.591 -3.178 -2.194 1.00 0.30 H new ATOM 0 HD22 LEU A 36 -4.853 -4.797 -2.238 1.00 0.30 H new ATOM 0 HD23 LEU A 36 -6.538 -4.601 -1.700 1.00 0.30 H new ATOM 581 N ALA A 37 -6.487 -3.572 2.846 1.00 0.17 N ATOM 582 CA ALA A 37 -7.741 -2.977 3.278 1.00 0.18 C ATOM 583 C ALA A 37 -7.917 -1.672 2.539 1.00 0.24 C ATOM 584 O ALA A 37 -6.931 -1.038 2.184 1.00 0.43 O ATOM 585 CB ALA A 37 -7.723 -2.701 4.775 1.00 0.25 C ATOM 0 H ALA A 37 -5.692 -2.935 2.898 1.00 0.17 H new ATOM 0 HA ALA A 37 -8.560 -3.664 3.065 1.00 0.18 H new ATOM 0 HB1 ALA A 37 -8.672 -2.256 5.074 1.00 0.25 H new ATOM 0 HB2 ALA A 37 -7.574 -3.636 5.316 1.00 0.25 H new ATOM 0 HB3 ALA A 37 -6.910 -2.013 5.008 1.00 0.25 H new ATOM 591 N GLY A 38 -9.145 -1.273 2.282 1.00 0.22 N ATOM 592 CA GLY A 38 -9.360 -0.014 1.600 1.00 0.26 C ATOM 593 C GLY A 38 -10.637 0.020 0.805 1.00 0.25 C ATOM 594 O GLY A 38 -11.096 -1.004 0.317 1.00 0.26 O ATOM 0 H GLY A 38 -9.991 -1.787 2.528 1.00 0.22 H new ATOM 0 HA2 GLY A 38 -9.375 0.791 2.334 1.00 0.26 H new ATOM 0 HA3 GLY A 38 -8.519 0.179 0.933 1.00 0.26 H new ATOM 598 N ASN A 39 -11.207 1.210 0.657 1.00 0.26 N ATOM 599 CA ASN A 39 -12.478 1.351 -0.035 1.00 0.27 C ATOM 600 C ASN A 39 -12.276 1.305 -1.549 1.00 0.32 C ATOM 601 O ASN A 39 -13.233 1.318 -2.320 1.00 0.40 O ATOM 602 CB ASN A 39 -13.209 2.642 0.361 1.00 0.31 C ATOM 603 CG ASN A 39 -12.419 3.910 0.075 1.00 1.08 C ATOM 604 OD1 ASN A 39 -11.201 3.957 0.237 1.00 1.94 O ATOM 605 ND2 ASN A 39 -13.114 4.946 -0.379 1.00 1.73 N ATOM 0 H ASN A 39 -10.811 2.084 1.005 1.00 0.26 H new ATOM 0 HA ASN A 39 -13.103 0.510 0.268 1.00 0.27 H new ATOM 0 HB2 ASN A 39 -14.158 2.689 -0.173 1.00 0.31 H new ATOM 0 HB3 ASN A 39 -13.443 2.604 1.425 1.00 0.31 H new ATOM 0 HD21 ASN A 39 -12.638 5.819 -0.606 1.00 1.73 H new ATOM 0 HD22 ASN A 39 -14.124 4.869 -0.500 1.00 1.73 H new ATOM 612 N ALA A 40 -11.014 1.274 -1.959 1.00 0.34 N ATOM 613 CA ALA A 40 -10.649 1.145 -3.366 1.00 0.41 C ATOM 614 C ALA A 40 -10.072 -0.242 -3.619 1.00 0.39 C ATOM 615 O ALA A 40 -9.642 -0.575 -4.727 1.00 0.45 O ATOM 616 CB ALA A 40 -9.631 2.205 -3.732 1.00 0.46 C ATOM 0 H ALA A 40 -10.215 1.337 -1.328 1.00 0.34 H new ATOM 0 HA ALA A 40 -11.537 1.281 -3.983 1.00 0.41 H new ATOM 0 HB1 ALA A 40 -9.362 2.104 -4.783 1.00 0.46 H new ATOM 0 HB2 ALA A 40 -10.057 3.193 -3.560 1.00 0.46 H new ATOM 0 HB3 ALA A 40 -8.740 2.082 -3.116 1.00 0.46 H new ATOM 622 N VAL A 41 -10.065 -1.029 -2.559 1.00 0.34 N ATOM 623 CA VAL A 41 -9.525 -2.382 -2.567 1.00 0.33 C ATOM 624 C VAL A 41 -10.406 -3.339 -3.362 1.00 0.42 C ATOM 625 O VAL A 41 -11.630 -3.210 -3.376 1.00 0.46 O ATOM 626 CB VAL A 41 -9.342 -2.869 -1.108 1.00 0.28 C ATOM 627 CG1 VAL A 41 -9.312 -4.393 -0.991 1.00 0.32 C ATOM 628 CG2 VAL A 41 -8.058 -2.269 -0.572 1.00 0.30 C ATOM 0 H VAL A 41 -10.439 -0.745 -1.654 1.00 0.34 H new ATOM 0 HA VAL A 41 -8.555 -2.366 -3.064 1.00 0.33 H new ATOM 0 HB VAL A 41 -10.200 -2.541 -0.522 1.00 0.28 H new ATOM 0 HG11 VAL A 41 -9.182 -4.675 0.054 1.00 0.32 H new ATOM 0 HG12 VAL A 41 -10.250 -4.805 -1.364 1.00 0.32 H new ATOM 0 HG13 VAL A 41 -8.483 -4.787 -1.579 1.00 0.32 H new ATOM 0 HG21 VAL A 41 -7.905 -2.597 0.456 1.00 0.30 H new ATOM 0 HG22 VAL A 41 -7.219 -2.597 -1.186 1.00 0.30 H new ATOM 0 HG23 VAL A 41 -8.125 -1.181 -0.600 1.00 0.30 H new ATOM 638 N GLN A 42 -9.764 -4.276 -4.060 1.00 0.55 N ATOM 639 CA GLN A 42 -10.478 -5.290 -4.821 1.00 0.69 C ATOM 640 C GLN A 42 -11.084 -6.313 -3.862 1.00 0.60 C ATOM 641 O GLN A 42 -10.561 -7.412 -3.669 1.00 0.70 O ATOM 642 CB GLN A 42 -9.525 -5.954 -5.819 1.00 0.93 C ATOM 643 CG GLN A 42 -10.196 -6.928 -6.770 1.00 1.49 C ATOM 644 CD GLN A 42 -9.286 -7.328 -7.911 1.00 1.84 C ATOM 645 OE1 GLN A 42 -8.497 -8.371 -7.706 1.00 2.44 O flip ATOM 646 NE2 GLN A 42 -9.283 -6.699 -8.966 1.00 2.35 N flip ATOM 0 H GLN A 42 -8.748 -4.350 -4.111 1.00 0.55 H new ATOM 0 HA GLN A 42 -11.289 -4.830 -5.386 1.00 0.69 H new ATOM 0 HB2 GLN A 42 -9.030 -5.178 -6.402 1.00 0.93 H new ATOM 0 HB3 GLN A 42 -8.748 -6.481 -5.266 1.00 0.93 H new ATOM 0 HG2 GLN A 42 -10.501 -7.819 -6.221 1.00 1.49 H new ATOM 0 HG3 GLN A 42 -11.103 -6.475 -7.172 1.00 1.49 H new ATOM 0 HE21 GLN A 42 -9.906 -5.901 -9.085 1.00 2.35 H new ATOM 0 HE22 GLN A 42 -8.657 -6.975 -9.723 1.00 2.35 H new ATOM 655 N LYS A 43 -12.197 -5.921 -3.274 1.00 0.50 N ATOM 656 CA LYS A 43 -12.861 -6.692 -2.241 1.00 0.48 C ATOM 657 C LYS A 43 -14.268 -7.044 -2.722 1.00 0.59 C ATOM 658 O LYS A 43 -15.148 -6.184 -2.747 1.00 0.69 O ATOM 659 CB LYS A 43 -12.919 -5.827 -0.977 1.00 0.43 C ATOM 660 CG LYS A 43 -12.900 -6.566 0.346 1.00 0.57 C ATOM 661 CD LYS A 43 -13.781 -7.790 0.405 1.00 0.55 C ATOM 662 CE LYS A 43 -13.385 -8.587 1.624 1.00 0.52 C ATOM 663 NZ LYS A 43 -14.231 -9.785 1.846 1.00 0.97 N ATOM 0 H LYS A 43 -12.672 -5.048 -3.503 1.00 0.50 H new ATOM 0 HA LYS A 43 -12.326 -7.617 -2.025 1.00 0.48 H new ATOM 0 HB2 LYS A 43 -12.075 -5.138 -0.996 1.00 0.43 H new ATOM 0 HB3 LYS A 43 -13.825 -5.222 -1.018 1.00 0.43 H new ATOM 0 HG2 LYS A 43 -11.874 -6.864 0.564 1.00 0.57 H new ATOM 0 HG3 LYS A 43 -13.206 -5.878 1.134 1.00 0.57 H new ATOM 0 HD2 LYS A 43 -14.831 -7.502 0.462 1.00 0.55 H new ATOM 0 HD3 LYS A 43 -13.663 -8.389 -0.498 1.00 0.55 H new ATOM 0 HE2 LYS A 43 -12.346 -8.899 1.523 1.00 0.52 H new ATOM 0 HE3 LYS A 43 -13.441 -7.944 2.503 1.00 0.52 H new ATOM 0 HZ1 LYS A 43 -13.685 -10.505 2.361 1.00 0.97 H new ATOM 0 HZ2 LYS A 43 -15.068 -9.520 2.404 1.00 0.97 H new ATOM 0 HZ3 LYS A 43 -14.534 -10.171 0.929 1.00 0.97 H new ATOM 677 N GLU A 44 -14.475 -8.290 -3.135 1.00 0.68 N ATOM 678 CA GLU A 44 -15.769 -8.694 -3.680 1.00 0.80 C ATOM 679 C GLU A 44 -16.772 -9.014 -2.577 1.00 0.76 C ATOM 680 O GLU A 44 -17.853 -8.430 -2.531 1.00 0.88 O ATOM 681 CB GLU A 44 -15.625 -9.869 -4.668 1.00 0.94 C ATOM 682 CG GLU A 44 -14.397 -10.750 -4.456 1.00 0.95 C ATOM 683 CD GLU A 44 -14.430 -11.539 -3.177 1.00 1.59 C ATOM 684 OE1 GLU A 44 -14.003 -10.992 -2.143 1.00 2.22 O ATOM 685 OE2 GLU A 44 -14.870 -12.699 -3.195 1.00 2.00 O ATOM 0 H GLU A 44 -13.774 -9.030 -3.104 1.00 0.68 H new ATOM 0 HA GLU A 44 -16.162 -7.844 -4.237 1.00 0.80 H new ATOM 0 HB2 GLU A 44 -16.516 -10.493 -4.598 1.00 0.94 H new ATOM 0 HB3 GLU A 44 -15.595 -9.469 -5.681 1.00 0.94 H new ATOM 0 HG2 GLU A 44 -14.307 -11.440 -5.295 1.00 0.95 H new ATOM 0 HG3 GLU A 44 -13.506 -10.123 -4.462 1.00 0.95 H new ATOM 692 N ARG A 45 -16.407 -9.922 -1.689 1.00 0.70 N ATOM 693 CA ARG A 45 -17.265 -10.308 -0.581 1.00 0.79 C ATOM 694 C ARG A 45 -16.515 -11.263 0.330 1.00 0.79 C ATOM 695 O ARG A 45 -16.665 -11.228 1.548 1.00 0.90 O ATOM 696 CB ARG A 45 -18.550 -10.972 -1.090 1.00 0.94 C ATOM 697 CG ARG A 45 -19.570 -11.235 0.006 1.00 1.54 C ATOM 698 CD ARG A 45 -20.871 -11.794 -0.548 1.00 1.86 C ATOM 699 NE ARG A 45 -20.695 -13.107 -1.167 1.00 2.25 N ATOM 700 CZ ARG A 45 -21.622 -14.064 -1.158 1.00 2.90 C ATOM 701 NH1 ARG A 45 -22.783 -13.867 -0.540 1.00 3.09 N ATOM 702 NH2 ARG A 45 -21.383 -15.219 -1.767 1.00 3.78 N ATOM 0 H ARG A 45 -15.512 -10.411 -1.714 1.00 0.70 H new ATOM 0 HA ARG A 45 -17.542 -9.412 -0.025 1.00 0.79 H new ATOM 0 HB2 ARG A 45 -19.002 -10.336 -1.851 1.00 0.94 H new ATOM 0 HB3 ARG A 45 -18.296 -11.915 -1.573 1.00 0.94 H new ATOM 0 HG2 ARG A 45 -19.153 -11.936 0.729 1.00 1.54 H new ATOM 0 HG3 ARG A 45 -19.773 -10.308 0.542 1.00 1.54 H new ATOM 0 HD2 ARG A 45 -21.602 -11.870 0.257 1.00 1.86 H new ATOM 0 HD3 ARG A 45 -21.277 -11.100 -1.284 1.00 1.86 H new ATOM 0 HE ARG A 45 -19.809 -13.302 -1.634 1.00 2.25 H new ATOM 0 HH11 ARG A 45 -22.967 -12.980 -0.070 1.00 3.09 H new ATOM 0 HH12 ARG A 45 -23.490 -14.602 -0.536 1.00 3.09 H new ATOM 0 HH21 ARG A 45 -20.492 -15.372 -2.240 1.00 3.78 H new ATOM 0 HH22 ARG A 45 -22.090 -15.954 -1.762 1.00 3.78 H new ATOM 716 N GLN A 46 -15.665 -12.083 -0.267 1.00 0.80 N ATOM 717 CA GLN A 46 -14.931 -13.092 0.478 1.00 0.94 C ATOM 718 C GLN A 46 -13.493 -12.661 0.700 1.00 0.86 C ATOM 719 O GLN A 46 -13.100 -12.327 1.817 1.00 0.94 O ATOM 720 CB GLN A 46 -14.938 -14.419 -0.272 1.00 1.13 C ATOM 721 CG GLN A 46 -16.295 -14.798 -0.814 1.00 1.36 C ATOM 722 CD GLN A 46 -16.250 -16.070 -1.635 1.00 1.85 C ATOM 723 OE1 GLN A 46 -15.249 -16.366 -2.290 1.00 2.42 O ATOM 724 NE2 GLN A 46 -17.327 -16.836 -1.598 1.00 2.45 N ATOM 0 H GLN A 46 -15.466 -12.069 -1.267 1.00 0.80 H new ATOM 0 HA GLN A 46 -15.423 -13.213 1.443 1.00 0.94 H new ATOM 0 HB2 GLN A 46 -14.228 -14.364 -1.098 1.00 1.13 H new ATOM 0 HB3 GLN A 46 -14.590 -15.207 0.396 1.00 1.13 H new ATOM 0 HG2 GLN A 46 -16.992 -14.927 0.014 1.00 1.36 H new ATOM 0 HG3 GLN A 46 -16.679 -13.984 -1.429 1.00 1.36 H new ATOM 0 HE21 GLN A 46 -18.135 -16.554 -1.043 1.00 2.45 H new ATOM 0 HE22 GLN A 46 -17.350 -17.709 -2.125 1.00 2.45 H new ATOM 733 N SER A 47 -12.731 -12.607 -0.387 1.00 0.79 N ATOM 734 CA SER A 47 -11.292 -12.383 -0.314 1.00 0.80 C ATOM 735 C SER A 47 -10.667 -12.466 -1.698 1.00 0.82 C ATOM 736 O SER A 47 -10.088 -13.485 -2.072 1.00 0.93 O ATOM 737 CB SER A 47 -10.639 -13.411 0.619 1.00 0.93 C ATOM 738 OG SER A 47 -11.064 -14.738 0.313 1.00 1.58 O ATOM 0 H SER A 47 -13.089 -12.716 -1.336 1.00 0.79 H new ATOM 0 HA SER A 47 -11.121 -11.384 0.086 1.00 0.80 H new ATOM 0 HB2 SER A 47 -9.554 -13.346 0.532 1.00 0.93 H new ATOM 0 HB3 SER A 47 -10.890 -13.177 1.653 1.00 0.93 H new ATOM 0 HG SER A 47 -10.926 -14.914 -0.641 1.00 1.58 H new ATOM 744 N ARG A 48 -10.803 -11.403 -2.467 1.00 0.81 N ATOM 745 CA ARG A 48 -10.213 -11.366 -3.786 1.00 0.90 C ATOM 746 C ARG A 48 -8.861 -10.677 -3.713 1.00 0.92 C ATOM 747 O ARG A 48 -8.095 -10.922 -2.782 1.00 1.64 O ATOM 748 CB ARG A 48 -11.144 -10.656 -4.768 1.00 0.95 C ATOM 749 CG ARG A 48 -11.013 -11.154 -6.202 1.00 1.22 C ATOM 750 CD ARG A 48 -11.195 -12.665 -6.291 1.00 1.72 C ATOM 751 NE ARG A 48 -12.436 -13.113 -5.656 1.00 2.25 N ATOM 752 CZ ARG A 48 -13.406 -13.773 -6.290 1.00 2.93 C ATOM 753 NH1 ARG A 48 -13.309 -14.018 -7.594 1.00 3.36 N ATOM 754 NH2 ARG A 48 -14.487 -14.163 -5.622 1.00 3.61 N ATOM 0 H ARG A 48 -11.313 -10.561 -2.202 1.00 0.81 H new ATOM 0 HA ARG A 48 -10.068 -12.384 -4.149 1.00 0.90 H new ATOM 0 HB2 ARG A 48 -12.175 -10.789 -4.439 1.00 0.95 H new ATOM 0 HB3 ARG A 48 -10.937 -9.586 -4.743 1.00 0.95 H new ATOM 0 HG2 ARG A 48 -11.756 -10.660 -6.828 1.00 1.22 H new ATOM 0 HG3 ARG A 48 -10.033 -10.881 -6.594 1.00 1.22 H new ATOM 0 HD2 ARG A 48 -11.195 -12.968 -7.338 1.00 1.72 H new ATOM 0 HD3 ARG A 48 -10.347 -13.160 -5.816 1.00 1.72 H new ATOM 0 HE ARG A 48 -12.567 -12.907 -4.666 1.00 2.25 H new ATOM 0 HH11 ARG A 48 -12.490 -13.701 -8.113 1.00 3.36 H new ATOM 0 HH12 ARG A 48 -14.053 -14.523 -8.075 1.00 3.36 H new ATOM 0 HH21 ARG A 48 -14.573 -13.957 -4.627 1.00 3.61 H new ATOM 0 HH22 ARG A 48 -15.230 -14.668 -6.105 1.00 3.61 H new ATOM 768 N PHE A 49 -8.584 -9.806 -4.679 1.00 0.49 N ATOM 769 CA PHE A 49 -7.268 -9.185 -4.815 1.00 0.42 C ATOM 770 C PHE A 49 -6.201 -10.270 -5.023 1.00 0.59 C ATOM 771 O PHE A 49 -6.481 -11.460 -4.920 1.00 1.46 O ATOM 772 CB PHE A 49 -6.970 -8.292 -3.590 1.00 0.35 C ATOM 773 CG PHE A 49 -5.644 -7.586 -3.611 1.00 0.32 C ATOM 774 CD1 PHE A 49 -5.268 -6.797 -4.686 1.00 0.40 C ATOM 775 CD2 PHE A 49 -4.771 -7.723 -2.543 1.00 0.27 C ATOM 776 CE1 PHE A 49 -4.044 -6.156 -4.697 1.00 0.42 C ATOM 777 CE2 PHE A 49 -3.544 -7.085 -2.549 1.00 0.30 C ATOM 778 CZ PHE A 49 -3.180 -6.302 -3.628 1.00 0.37 C ATOM 0 H PHE A 49 -9.259 -9.512 -5.385 1.00 0.49 H new ATOM 0 HA PHE A 49 -7.253 -8.538 -5.692 1.00 0.42 H new ATOM 0 HB2 PHE A 49 -7.759 -7.544 -3.507 1.00 0.35 H new ATOM 0 HB3 PHE A 49 -7.019 -8.908 -2.692 1.00 0.35 H new ATOM 0 HD1 PHE A 49 -5.939 -6.682 -5.524 1.00 0.40 H new ATOM 0 HD2 PHE A 49 -5.052 -8.334 -1.698 1.00 0.27 H new ATOM 0 HE1 PHE A 49 -3.763 -5.542 -5.540 1.00 0.42 H new ATOM 0 HE2 PHE A 49 -2.871 -7.199 -1.712 1.00 0.30 H new ATOM 0 HZ PHE A 49 -2.221 -5.805 -3.636 1.00 0.37 H new ATOM 788 N THR A 50 -4.997 -9.863 -5.346 1.00 0.46 N ATOM 789 CA THR A 50 -3.920 -10.797 -5.631 1.00 0.42 C ATOM 790 C THR A 50 -2.577 -10.119 -5.404 1.00 0.47 C ATOM 791 O THR A 50 -2.295 -9.073 -5.990 1.00 0.84 O ATOM 792 CB THR A 50 -4.012 -11.343 -7.075 1.00 0.42 C ATOM 793 OG1 THR A 50 -4.630 -10.369 -7.935 1.00 0.89 O ATOM 794 CG2 THR A 50 -4.802 -12.652 -7.123 1.00 0.82 C ATOM 0 H THR A 50 -4.731 -8.881 -5.420 1.00 0.46 H new ATOM 0 HA THR A 50 -4.015 -11.645 -4.952 1.00 0.42 H new ATOM 0 HB THR A 50 -2.999 -11.542 -7.423 1.00 0.42 H new ATOM 0 HG1 THR A 50 -4.682 -10.724 -8.847 1.00 0.89 H new ATOM 0 HG21 THR A 50 -4.849 -13.011 -8.151 1.00 0.82 H new ATOM 0 HG22 THR A 50 -4.308 -13.398 -6.501 1.00 0.82 H new ATOM 0 HG23 THR A 50 -5.812 -12.481 -6.752 1.00 0.82 H new ATOM 802 N MET A 51 -1.770 -10.708 -4.527 1.00 0.25 N ATOM 803 CA MET A 51 -0.508 -10.093 -4.105 1.00 0.24 C ATOM 804 C MET A 51 0.448 -9.850 -5.261 1.00 0.26 C ATOM 805 O MET A 51 0.537 -10.635 -6.204 1.00 0.29 O ATOM 806 CB MET A 51 0.208 -10.945 -3.057 1.00 0.25 C ATOM 807 CG MET A 51 0.740 -12.268 -3.576 1.00 0.31 C ATOM 808 SD MET A 51 1.175 -13.414 -2.250 1.00 0.50 S ATOM 809 CE MET A 51 2.113 -12.351 -1.151 1.00 1.00 C ATOM 0 H MET A 51 -1.964 -11.610 -4.093 1.00 0.25 H new ATOM 0 HA MET A 51 -0.787 -9.130 -3.677 1.00 0.24 H new ATOM 0 HB2 MET A 51 1.038 -10.371 -2.646 1.00 0.25 H new ATOM 0 HB3 MET A 51 -0.481 -11.142 -2.236 1.00 0.25 H new ATOM 0 HG2 MET A 51 -0.010 -12.730 -4.218 1.00 0.31 H new ATOM 0 HG3 MET A 51 1.619 -12.084 -4.194 1.00 0.31 H new ATOM 0 HE1 MET A 51 2.894 -12.933 -0.661 1.00 1.00 H new ATOM 0 HE2 MET A 51 2.568 -11.544 -1.726 1.00 1.00 H new ATOM 0 HE3 MET A 51 1.448 -11.929 -0.397 1.00 1.00 H new ATOM 819 N TYR A 52 1.155 -8.744 -5.162 1.00 0.28 N ATOM 820 CA TYR A 52 2.277 -8.456 -6.028 1.00 0.32 C ATOM 821 C TYR A 52 3.455 -8.005 -5.178 1.00 0.30 C ATOM 822 O TYR A 52 3.335 -7.887 -3.957 1.00 0.30 O ATOM 823 CB TYR A 52 1.921 -7.403 -7.093 1.00 0.42 C ATOM 824 CG TYR A 52 1.140 -6.191 -6.614 1.00 0.48 C ATOM 825 CD1 TYR A 52 1.462 -5.524 -5.440 1.00 0.49 C ATOM 826 CD2 TYR A 52 0.088 -5.695 -7.375 1.00 0.61 C ATOM 827 CE1 TYR A 52 0.756 -4.404 -5.037 1.00 0.61 C ATOM 828 CE2 TYR A 52 -0.625 -4.581 -6.976 1.00 0.72 C ATOM 829 CZ TYR A 52 -0.287 -3.939 -5.807 1.00 0.71 C ATOM 830 OH TYR A 52 -0.987 -2.820 -5.409 1.00 0.85 O ATOM 0 H TYR A 52 0.966 -8.015 -4.474 1.00 0.28 H new ATOM 0 HA TYR A 52 2.547 -9.363 -6.569 1.00 0.32 H new ATOM 0 HB2 TYR A 52 2.847 -7.053 -7.550 1.00 0.42 H new ATOM 0 HB3 TYR A 52 1.344 -7.893 -7.877 1.00 0.42 H new ATOM 0 HD1 TYR A 52 2.277 -5.885 -4.831 1.00 0.49 H new ATOM 0 HD2 TYR A 52 -0.177 -6.191 -8.297 1.00 0.61 H new ATOM 0 HE1 TYR A 52 1.022 -3.896 -4.122 1.00 0.61 H new ATOM 0 HE2 TYR A 52 -1.444 -4.216 -7.579 1.00 0.72 H new ATOM 0 HH TYR A 52 -1.690 -2.624 -6.063 1.00 0.85 H new ATOM 840 N SER A 53 4.590 -7.772 -5.805 1.00 0.33 N ATOM 841 CA SER A 53 5.763 -7.334 -5.077 1.00 0.33 C ATOM 842 C SER A 53 6.004 -5.858 -5.305 1.00 0.37 C ATOM 843 O SER A 53 6.205 -5.432 -6.439 1.00 0.52 O ATOM 844 CB SER A 53 7.000 -8.127 -5.502 1.00 0.40 C ATOM 845 OG SER A 53 6.801 -9.512 -5.337 1.00 0.93 O ATOM 0 H SER A 53 4.725 -7.878 -6.810 1.00 0.33 H new ATOM 0 HA SER A 53 5.583 -7.510 -4.017 1.00 0.33 H new ATOM 0 HB2 SER A 53 7.232 -7.912 -6.545 1.00 0.40 H new ATOM 0 HB3 SER A 53 7.860 -7.808 -4.912 1.00 0.40 H new ATOM 0 HG SER A 53 6.866 -9.741 -4.386 1.00 0.93 H new ATOM 851 N THR A 54 5.972 -5.095 -4.225 1.00 0.31 N ATOM 852 CA THR A 54 6.309 -3.687 -4.272 1.00 0.33 C ATOM 853 C THR A 54 7.776 -3.559 -3.886 1.00 0.29 C ATOM 854 O THR A 54 8.140 -3.666 -2.715 1.00 0.27 O ATOM 855 CB THR A 54 5.422 -2.891 -3.288 1.00 0.37 C ATOM 856 OG1 THR A 54 4.135 -3.520 -3.198 1.00 0.43 O ATOM 857 CG2 THR A 54 5.230 -1.453 -3.749 1.00 0.43 C ATOM 0 H THR A 54 5.713 -5.434 -3.298 1.00 0.31 H new ATOM 0 HA THR A 54 6.139 -3.284 -5.270 1.00 0.33 H new ATOM 0 HB THR A 54 5.919 -2.881 -2.318 1.00 0.37 H new ATOM 0 HG1 THR A 54 3.791 -3.431 -2.285 1.00 0.43 H new ATOM 0 HG21 THR A 54 4.601 -0.922 -3.034 1.00 0.43 H new ATOM 0 HG22 THR A 54 6.200 -0.960 -3.816 1.00 0.43 H new ATOM 0 HG23 THR A 54 4.751 -1.446 -4.728 1.00 0.43 H new ATOM 865 N ILE A 55 8.621 -3.362 -4.885 1.00 0.30 N ATOM 866 CA ILE A 55 10.059 -3.327 -4.661 1.00 0.28 C ATOM 867 C ILE A 55 10.542 -1.896 -4.711 1.00 0.24 C ATOM 868 O ILE A 55 10.749 -1.353 -5.790 1.00 0.26 O ATOM 869 CB ILE A 55 10.852 -4.129 -5.720 1.00 0.34 C ATOM 870 CG1 ILE A 55 10.109 -5.401 -6.156 1.00 0.50 C ATOM 871 CG2 ILE A 55 12.237 -4.470 -5.176 1.00 0.32 C ATOM 872 CD1 ILE A 55 9.823 -6.377 -5.041 1.00 0.72 C ATOM 0 H ILE A 55 8.339 -3.224 -5.855 1.00 0.30 H new ATOM 0 HA ILE A 55 10.233 -3.780 -3.685 1.00 0.28 H new ATOM 0 HB ILE A 55 10.956 -3.504 -6.607 1.00 0.34 H new ATOM 0 HG12 ILE A 55 9.165 -5.113 -6.620 1.00 0.50 H new ATOM 0 HG13 ILE A 55 10.699 -5.906 -6.921 1.00 0.50 H new ATOM 0 HG21 ILE A 55 12.793 -5.035 -5.924 1.00 0.32 H new ATOM 0 HG22 ILE A 55 12.773 -3.550 -4.944 1.00 0.32 H new ATOM 0 HG23 ILE A 55 12.135 -5.069 -4.271 1.00 0.32 H new ATOM 0 HD11 ILE A 55 9.297 -7.243 -5.442 1.00 0.72 H new ATOM 0 HD12 ILE A 55 10.761 -6.699 -4.590 1.00 0.72 H new ATOM 0 HD13 ILE A 55 9.204 -5.894 -4.285 1.00 0.72 H new ATOM 884 N TYR A 56 10.703 -1.284 -3.557 1.00 0.25 N ATOM 885 CA TYR A 56 11.114 0.104 -3.506 1.00 0.27 C ATOM 886 C TYR A 56 12.616 0.204 -3.723 1.00 0.30 C ATOM 887 O TYR A 56 13.399 -0.156 -2.848 1.00 0.36 O ATOM 888 CB TYR A 56 10.741 0.742 -2.168 1.00 0.32 C ATOM 889 CG TYR A 56 9.529 0.136 -1.472 1.00 0.39 C ATOM 890 CD1 TYR A 56 8.273 0.069 -2.077 1.00 0.32 C ATOM 891 CD2 TYR A 56 9.646 -0.351 -0.178 1.00 0.79 C ATOM 892 CE1 TYR A 56 7.190 -0.466 -1.407 1.00 0.43 C ATOM 893 CE2 TYR A 56 8.564 -0.891 0.490 1.00 1.01 C ATOM 894 CZ TYR A 56 7.340 -0.945 -0.128 1.00 0.79 C ATOM 895 OH TYR A 56 6.259 -1.478 0.531 1.00 1.02 O ATOM 0 H TYR A 56 10.557 -1.721 -2.647 1.00 0.25 H new ATOM 0 HA TYR A 56 10.592 0.643 -4.297 1.00 0.27 H new ATOM 0 HB2 TYR A 56 11.598 0.669 -1.498 1.00 0.32 H new ATOM 0 HB3 TYR A 56 10.553 1.803 -2.330 1.00 0.32 H new ATOM 0 HD1 TYR A 56 8.146 0.441 -3.083 1.00 0.32 H new ATOM 0 HD2 TYR A 56 10.604 -0.307 0.318 1.00 0.79 H new ATOM 0 HE1 TYR A 56 6.224 -0.508 -1.889 1.00 0.43 H new ATOM 0 HE2 TYR A 56 8.681 -1.269 1.495 1.00 1.01 H new ATOM 0 HH TYR A 56 6.533 -1.772 1.425 1.00 1.02 H new ATOM 905 N GLU A 57 13.015 0.663 -4.898 1.00 0.33 N ATOM 906 CA GLU A 57 14.430 0.799 -5.216 1.00 0.41 C ATOM 907 C GLU A 57 14.863 2.255 -5.176 1.00 0.36 C ATOM 908 O GLU A 57 14.409 3.075 -5.971 1.00 0.42 O ATOM 909 CB GLU A 57 14.745 0.202 -6.580 1.00 0.52 C ATOM 910 CG GLU A 57 14.496 -1.292 -6.660 1.00 1.13 C ATOM 911 CD GLU A 57 15.110 -1.905 -7.895 1.00 1.56 C ATOM 912 OE1 GLU A 57 14.444 -1.905 -8.952 1.00 1.84 O ATOM 913 OE2 GLU A 57 16.247 -2.408 -7.817 1.00 2.33 O ATOM 0 H GLU A 57 12.383 0.947 -5.646 1.00 0.33 H new ATOM 0 HA GLU A 57 14.988 0.249 -4.458 1.00 0.41 H new ATOM 0 HB2 GLU A 57 14.140 0.704 -7.336 1.00 0.52 H new ATOM 0 HB3 GLU A 57 15.789 0.402 -6.823 1.00 0.52 H new ATOM 0 HG2 GLU A 57 14.907 -1.775 -5.774 1.00 1.13 H new ATOM 0 HG3 GLU A 57 13.422 -1.481 -6.658 1.00 1.13 H new ATOM 920 N LEU A 58 15.763 2.552 -4.258 1.00 0.41 N ATOM 921 CA LEU A 58 16.205 3.912 -4.006 1.00 0.42 C ATOM 922 C LEU A 58 17.159 4.412 -5.095 1.00 0.43 C ATOM 923 O LEU A 58 18.010 3.668 -5.586 1.00 0.60 O ATOM 924 CB LEU A 58 16.874 3.962 -2.627 1.00 0.62 C ATOM 925 CG LEU A 58 17.554 5.276 -2.246 1.00 0.58 C ATOM 926 CD1 LEU A 58 16.580 6.439 -2.300 1.00 1.24 C ATOM 927 CD2 LEU A 58 18.143 5.152 -0.856 1.00 1.24 C ATOM 0 H LEU A 58 16.210 1.855 -3.663 1.00 0.41 H new ATOM 0 HA LEU A 58 15.339 4.574 -4.023 1.00 0.42 H new ATOM 0 HB2 LEU A 58 16.119 3.738 -1.873 1.00 0.62 H new ATOM 0 HB3 LEU A 58 17.618 3.167 -2.580 1.00 0.62 H new ATOM 0 HG LEU A 58 18.348 5.476 -2.966 1.00 0.58 H new ATOM 0 HD11 LEU A 58 17.096 7.359 -2.023 1.00 1.24 H new ATOM 0 HD12 LEU A 58 16.184 6.535 -3.311 1.00 1.24 H new ATOM 0 HD13 LEU A 58 15.760 6.260 -1.604 1.00 1.24 H new ATOM 0 HD21 LEU A 58 18.629 6.088 -0.582 1.00 1.24 H new ATOM 0 HD22 LEU A 58 17.349 4.933 -0.142 1.00 1.24 H new ATOM 0 HD23 LEU A 58 18.876 4.345 -0.842 1.00 1.24 H new ATOM 939 N GLN A 59 16.977 5.669 -5.489 1.00 0.37 N ATOM 940 CA GLN A 59 17.877 6.332 -6.420 1.00 0.48 C ATOM 941 C GLN A 59 18.652 7.424 -5.691 1.00 0.57 C ATOM 942 O GLN A 59 18.525 7.562 -4.475 1.00 0.58 O ATOM 943 CB GLN A 59 17.100 6.938 -7.590 1.00 0.53 C ATOM 944 CG GLN A 59 16.416 5.906 -8.479 1.00 1.13 C ATOM 945 CD GLN A 59 17.399 4.997 -9.196 1.00 1.75 C ATOM 946 OE1 GLN A 59 18.522 5.394 -9.505 1.00 2.50 O ATOM 947 NE2 GLN A 59 16.976 3.778 -9.485 1.00 2.33 N ATOM 0 H GLN A 59 16.203 6.253 -5.172 1.00 0.37 H new ATOM 0 HA GLN A 59 18.573 5.593 -6.817 1.00 0.48 H new ATOM 0 HB2 GLN A 59 16.347 7.621 -7.198 1.00 0.53 H new ATOM 0 HB3 GLN A 59 17.783 7.531 -8.198 1.00 0.53 H new ATOM 0 HG2 GLN A 59 15.745 5.299 -7.872 1.00 1.13 H new ATOM 0 HG3 GLN A 59 15.801 6.421 -9.217 1.00 1.13 H new ATOM 0 HE21 GLN A 59 16.038 3.486 -9.212 1.00 2.33 H new ATOM 0 HE22 GLN A 59 17.588 3.130 -9.981 1.00 2.33 H new ATOM 956 N GLU A 60 19.444 8.199 -6.415 1.00 0.69 N ATOM 957 CA GLU A 60 20.231 9.266 -5.802 1.00 0.82 C ATOM 958 C GLU A 60 19.348 10.319 -5.127 1.00 0.75 C ATOM 959 O GLU A 60 19.764 10.962 -4.162 1.00 0.89 O ATOM 960 CB GLU A 60 21.103 9.955 -6.847 1.00 1.05 C ATOM 961 CG GLU A 60 20.302 10.632 -7.945 1.00 1.11 C ATOM 962 CD GLU A 60 21.112 11.653 -8.702 1.00 1.47 C ATOM 963 OE1 GLU A 60 21.195 12.808 -8.249 1.00 1.79 O ATOM 964 OE2 GLU A 60 21.660 11.302 -9.768 1.00 1.73 O ATOM 0 H GLU A 60 19.561 8.113 -7.425 1.00 0.69 H new ATOM 0 HA GLU A 60 20.855 8.797 -5.041 1.00 0.82 H new ATOM 0 HB2 GLU A 60 21.731 10.697 -6.354 1.00 1.05 H new ATOM 0 HB3 GLU A 60 21.771 9.219 -7.295 1.00 1.05 H new ATOM 0 HG2 GLU A 60 19.933 9.877 -8.640 1.00 1.11 H new ATOM 0 HG3 GLU A 60 19.429 11.117 -7.508 1.00 1.11 H new ATOM 971 N ASP A 61 18.129 10.485 -5.629 1.00 0.64 N ATOM 972 CA ASP A 61 17.279 11.590 -5.202 1.00 0.70 C ATOM 973 C ASP A 61 16.086 11.070 -4.410 1.00 0.54 C ATOM 974 O ASP A 61 14.984 11.601 -4.511 1.00 0.50 O ATOM 975 CB ASP A 61 16.804 12.380 -6.428 1.00 0.92 C ATOM 976 CG ASP A 61 16.465 13.822 -6.107 1.00 1.18 C ATOM 977 OD1 ASP A 61 17.403 14.641 -6.013 1.00 1.41 O ATOM 978 OD2 ASP A 61 15.268 14.152 -5.967 1.00 1.26 O ATOM 0 H ASP A 61 17.709 9.872 -6.328 1.00 0.64 H new ATOM 0 HA ASP A 61 17.856 12.251 -4.555 1.00 0.70 H new ATOM 0 HB2 ASP A 61 17.581 12.356 -7.192 1.00 0.92 H new ATOM 0 HB3 ASP A 61 15.926 11.891 -6.851 1.00 0.92 H new ATOM 983 N ASN A 62 16.331 10.000 -3.644 1.00 0.52 N ATOM 984 CA ASN A 62 15.318 9.302 -2.819 1.00 0.46 C ATOM 985 C ASN A 62 14.040 8.942 -3.573 1.00 0.36 C ATOM 986 O ASN A 62 13.084 8.460 -2.973 1.00 0.41 O ATOM 987 CB ASN A 62 14.970 10.029 -1.502 1.00 0.57 C ATOM 988 CG ASN A 62 14.701 11.518 -1.633 1.00 0.70 C ATOM 989 OD1 ASN A 62 13.570 11.941 -1.879 1.00 1.36 O ATOM 990 ND2 ASN A 62 15.735 12.324 -1.443 1.00 1.35 N ATOM 0 H ASN A 62 17.258 9.580 -3.574 1.00 0.52 H new ATOM 0 HA ASN A 62 15.818 8.369 -2.558 1.00 0.46 H new ATOM 0 HB2 ASN A 62 14.091 9.555 -1.066 1.00 0.57 H new ATOM 0 HB3 ASN A 62 15.791 9.885 -0.799 1.00 0.57 H new ATOM 0 HD21 ASN A 62 15.611 13.335 -1.498 1.00 1.35 H new ATOM 0 HD22 ASN A 62 16.656 11.934 -1.241 1.00 1.35 H new ATOM 997 N SER A 63 14.018 9.144 -4.877 1.00 0.34 N ATOM 998 CA SER A 63 12.919 8.662 -5.676 1.00 0.30 C ATOM 999 C SER A 63 13.079 7.167 -5.849 1.00 0.29 C ATOM 1000 O SER A 63 14.079 6.704 -6.400 1.00 0.31 O ATOM 1001 CB SER A 63 12.886 9.356 -7.038 1.00 0.35 C ATOM 1002 OG SER A 63 14.096 9.144 -7.743 1.00 0.96 O ATOM 0 H SER A 63 14.745 9.635 -5.398 1.00 0.34 H new ATOM 0 HA SER A 63 11.977 8.884 -5.174 1.00 0.30 H new ATOM 0 HB2 SER A 63 12.048 8.977 -7.623 1.00 0.35 H new ATOM 0 HB3 SER A 63 12.722 10.425 -6.902 1.00 0.35 H new ATOM 0 HG SER A 63 14.445 8.252 -7.534 1.00 0.96 H new ATOM 1008 N TYR A 64 12.124 6.412 -5.361 1.00 0.28 N ATOM 1009 CA TYR A 64 12.209 4.979 -5.462 1.00 0.28 C ATOM 1010 C TYR A 64 11.581 4.541 -6.765 1.00 0.29 C ATOM 1011 O TYR A 64 10.492 4.990 -7.119 1.00 0.30 O ATOM 1012 CB TYR A 64 11.459 4.292 -4.311 1.00 0.28 C ATOM 1013 CG TYR A 64 11.858 4.716 -2.907 1.00 0.31 C ATOM 1014 CD1 TYR A 64 13.151 5.126 -2.597 1.00 0.31 C ATOM 1015 CD2 TYR A 64 10.923 4.680 -1.881 1.00 0.39 C ATOM 1016 CE1 TYR A 64 13.495 5.490 -1.301 1.00 0.36 C ATOM 1017 CE2 TYR A 64 11.257 5.044 -0.593 1.00 0.45 C ATOM 1018 CZ TYR A 64 12.539 5.446 -0.308 1.00 0.42 C ATOM 1019 OH TYR A 64 12.867 5.800 0.979 1.00 0.49 O ATOM 0 H TYR A 64 11.288 6.764 -4.895 1.00 0.28 H new ATOM 0 HA TYR A 64 13.261 4.696 -5.415 1.00 0.28 H new ATOM 0 HB2 TYR A 64 10.393 4.479 -4.436 1.00 0.28 H new ATOM 0 HB3 TYR A 64 11.606 3.216 -4.399 1.00 0.28 H new ATOM 0 HD1 TYR A 64 13.899 5.162 -3.376 1.00 0.31 H new ATOM 0 HD2 TYR A 64 9.914 4.361 -2.096 1.00 0.39 H new ATOM 0 HE1 TYR A 64 14.503 5.805 -1.073 1.00 0.36 H new ATOM 0 HE2 TYR A 64 10.513 5.013 0.189 1.00 0.45 H new ATOM 0 HH TYR A 64 12.078 5.713 1.553 1.00 0.49 H new ATOM 1029 N ASN A 65 12.265 3.674 -7.476 1.00 0.32 N ATOM 1030 CA ASN A 65 11.659 3.002 -8.596 1.00 0.36 C ATOM 1031 C ASN A 65 11.081 1.720 -8.063 1.00 0.32 C ATOM 1032 O ASN A 65 11.801 0.752 -7.836 1.00 0.37 O ATOM 1033 CB ASN A 65 12.673 2.701 -9.706 1.00 0.48 C ATOM 1034 CG ASN A 65 13.290 3.950 -10.315 1.00 1.24 C ATOM 1035 OD1 ASN A 65 14.444 3.936 -10.742 1.00 2.02 O ATOM 1036 ND2 ASN A 65 12.527 5.031 -10.381 1.00 1.96 N ATOM 0 H ASN A 65 13.237 3.420 -7.298 1.00 0.32 H new ATOM 0 HA ASN A 65 10.895 3.639 -9.043 1.00 0.36 H new ATOM 0 HB2 ASN A 65 13.467 2.073 -9.302 1.00 0.48 H new ATOM 0 HB3 ASN A 65 12.181 2.128 -10.492 1.00 0.48 H new ATOM 0 HD21 ASN A 65 12.892 5.888 -10.796 1.00 1.96 H new ATOM 0 HD22 ASN A 65 11.575 5.006 -10.017 1.00 1.96 H new ATOM 1043 N VAL A 66 9.791 1.720 -7.822 1.00 0.31 N ATOM 1044 CA VAL A 66 9.171 0.591 -7.183 1.00 0.29 C ATOM 1045 C VAL A 66 8.485 -0.302 -8.181 1.00 0.31 C ATOM 1046 O VAL A 66 7.709 0.150 -9.016 1.00 0.37 O ATOM 1047 CB VAL A 66 8.160 0.987 -6.104 1.00 0.37 C ATOM 1048 CG1 VAL A 66 7.492 -0.275 -5.589 1.00 0.67 C ATOM 1049 CG2 VAL A 66 8.846 1.730 -4.969 1.00 0.65 C ATOM 0 H VAL A 66 9.158 2.484 -8.058 1.00 0.31 H new ATOM 0 HA VAL A 66 9.989 0.054 -6.702 1.00 0.29 H new ATOM 0 HB VAL A 66 7.412 1.657 -6.528 1.00 0.37 H new ATOM 0 HG11 VAL A 66 6.767 -0.014 -4.818 1.00 0.67 H new ATOM 0 HG12 VAL A 66 6.983 -0.778 -6.411 1.00 0.67 H new ATOM 0 HG13 VAL A 66 8.246 -0.940 -5.168 1.00 0.67 H new ATOM 0 HG21 VAL A 66 8.108 2.002 -4.214 1.00 0.65 H new ATOM 0 HG22 VAL A 66 9.605 1.089 -4.521 1.00 0.65 H new ATOM 0 HG23 VAL A 66 9.317 2.633 -5.357 1.00 0.65 H new ATOM 1059 N THR A 67 8.749 -1.575 -8.047 1.00 0.34 N ATOM 1060 CA THR A 67 8.195 -2.561 -8.935 1.00 0.39 C ATOM 1061 C THR A 67 6.797 -2.957 -8.455 1.00 0.47 C ATOM 1062 O THR A 67 6.530 -2.942 -7.256 1.00 0.71 O ATOM 1063 CB THR A 67 9.108 -3.804 -8.974 1.00 0.48 C ATOM 1064 OG1 THR A 67 10.390 -3.455 -9.513 1.00 0.58 O ATOM 1065 CG2 THR A 67 8.493 -4.937 -9.784 1.00 0.74 C ATOM 0 H THR A 67 9.354 -1.957 -7.320 1.00 0.34 H new ATOM 0 HA THR A 67 8.125 -2.141 -9.939 1.00 0.39 H new ATOM 0 HB THR A 67 9.226 -4.158 -7.950 1.00 0.48 H new ATOM 0 HG1 THR A 67 10.964 -4.249 -9.533 1.00 0.58 H new ATOM 0 HG21 THR A 67 9.169 -5.792 -9.785 1.00 0.74 H new ATOM 0 HG22 THR A 67 7.541 -5.227 -9.339 1.00 0.74 H new ATOM 0 HG23 THR A 67 8.328 -4.604 -10.809 1.00 0.74 H new ATOM 1073 N SER A 68 5.901 -3.238 -9.385 1.00 0.44 N ATOM 1074 CA SER A 68 4.610 -3.830 -9.065 1.00 0.52 C ATOM 1075 C SER A 68 4.278 -4.888 -10.111 1.00 0.53 C ATOM 1076 O SER A 68 3.733 -4.582 -11.167 1.00 0.65 O ATOM 1077 CB SER A 68 3.521 -2.754 -9.011 1.00 0.60 C ATOM 1078 OG SER A 68 3.837 -1.756 -8.049 1.00 1.14 O ATOM 0 H SER A 68 6.045 -3.064 -10.380 1.00 0.44 H new ATOM 0 HA SER A 68 4.657 -4.299 -8.082 1.00 0.52 H new ATOM 0 HB2 SER A 68 3.410 -2.295 -9.993 1.00 0.60 H new ATOM 0 HB3 SER A 68 2.564 -3.213 -8.763 1.00 0.60 H new ATOM 0 HG SER A 68 4.214 -0.973 -8.502 1.00 1.14 H new ATOM 1084 N ILE A 69 4.643 -6.130 -9.831 1.00 0.53 N ATOM 1085 CA ILE A 69 4.491 -7.200 -10.807 1.00 0.53 C ATOM 1086 C ILE A 69 3.063 -7.718 -10.877 1.00 0.60 C ATOM 1087 O ILE A 69 2.484 -8.160 -9.888 1.00 0.74 O ATOM 1088 CB ILE A 69 5.459 -8.374 -10.534 1.00 0.54 C ATOM 1089 CG1 ILE A 69 5.139 -9.536 -11.489 1.00 0.66 C ATOM 1090 CG2 ILE A 69 5.370 -8.813 -9.071 1.00 0.57 C ATOM 1091 CD1 ILE A 69 6.265 -10.528 -11.670 1.00 0.78 C ATOM 0 H ILE A 69 5.045 -6.422 -8.940 1.00 0.53 H new ATOM 0 HA ILE A 69 4.742 -6.760 -11.772 1.00 0.53 H new ATOM 0 HB ILE A 69 6.483 -8.049 -10.716 1.00 0.54 H new ATOM 0 HG12 ILE A 69 4.262 -10.065 -11.116 1.00 0.66 H new ATOM 0 HG13 ILE A 69 4.873 -9.126 -12.463 1.00 0.66 H new ATOM 0 HG21 ILE A 69 6.058 -9.640 -8.897 1.00 0.57 H new ATOM 0 HG22 ILE A 69 5.636 -7.977 -8.424 1.00 0.57 H new ATOM 0 HG23 ILE A 69 4.352 -9.135 -8.849 1.00 0.57 H new ATOM 0 HD11 ILE A 69 5.952 -11.312 -12.359 1.00 0.78 H new ATOM 0 HD12 ILE A 69 7.138 -10.017 -12.075 1.00 0.78 H new ATOM 0 HD13 ILE A 69 6.518 -10.971 -10.707 1.00 0.78 H new ATOM 1103 N LEU A 70 2.521 -7.670 -12.072 1.00 0.56 N ATOM 1104 CA LEU A 70 1.173 -8.124 -12.336 1.00 0.64 C ATOM 1105 C LEU A 70 1.142 -8.858 -13.666 1.00 0.64 C ATOM 1106 O LEU A 70 1.939 -8.566 -14.561 1.00 0.67 O ATOM 1107 CB LEU A 70 0.194 -6.938 -12.348 1.00 0.74 C ATOM 1108 CG LEU A 70 0.822 -5.533 -12.409 1.00 0.66 C ATOM 1109 CD1 LEU A 70 1.566 -5.305 -13.717 1.00 0.96 C ATOM 1110 CD2 LEU A 70 -0.245 -4.467 -12.223 1.00 1.18 C ATOM 0 H LEU A 70 3.006 -7.312 -12.895 1.00 0.56 H new ATOM 0 HA LEU A 70 0.862 -8.805 -11.544 1.00 0.64 H new ATOM 0 HB2 LEU A 70 -0.471 -7.053 -13.204 1.00 0.74 H new ATOM 0 HB3 LEU A 70 -0.425 -6.997 -11.453 1.00 0.74 H new ATOM 0 HG LEU A 70 1.545 -5.462 -11.597 1.00 0.66 H new ATOM 0 HD11 LEU A 70 1.995 -4.303 -13.722 1.00 0.96 H new ATOM 0 HD12 LEU A 70 2.364 -6.041 -13.815 1.00 0.96 H new ATOM 0 HD13 LEU A 70 0.873 -5.407 -14.552 1.00 0.96 H new ATOM 0 HD21 LEU A 70 0.215 -3.480 -12.269 1.00 1.18 H new ATOM 0 HD22 LEU A 70 -0.991 -4.557 -13.013 1.00 1.18 H new ATOM 0 HD23 LEU A 70 -0.726 -4.599 -11.254 1.00 1.18 H new ATOM 1122 N VAL A 71 0.247 -9.825 -13.796 1.00 0.70 N ATOM 1123 CA VAL A 71 0.135 -10.561 -15.040 1.00 0.74 C ATOM 1124 C VAL A 71 -0.650 -9.747 -16.051 1.00 0.83 C ATOM 1125 O VAL A 71 -1.856 -9.540 -15.915 1.00 0.99 O ATOM 1126 CB VAL A 71 -0.496 -11.955 -14.862 1.00 0.82 C ATOM 1127 CG1 VAL A 71 -0.724 -12.603 -16.213 1.00 0.88 C ATOM 1128 CG2 VAL A 71 0.415 -12.835 -14.032 1.00 0.84 C ATOM 0 H VAL A 71 -0.403 -10.114 -13.065 1.00 0.70 H new ATOM 0 HA VAL A 71 1.148 -10.727 -15.406 1.00 0.74 H new ATOM 0 HB VAL A 71 -1.452 -11.840 -14.352 1.00 0.82 H new ATOM 0 HG11 VAL A 71 -1.170 -13.588 -16.074 1.00 0.88 H new ATOM 0 HG12 VAL A 71 -1.395 -11.981 -16.806 1.00 0.88 H new ATOM 0 HG13 VAL A 71 0.229 -12.707 -16.732 1.00 0.88 H new ATOM 0 HG21 VAL A 71 -0.040 -13.818 -13.912 1.00 0.84 H new ATOM 0 HG22 VAL A 71 1.377 -12.939 -14.534 1.00 0.84 H new ATOM 0 HG23 VAL A 71 0.564 -12.382 -13.052 1.00 0.84 H new ATOM 1186 N GLY A 75 1.175 -13.432 -19.379 1.00 0.97 N ATOM 1187 CA GLY A 75 2.507 -13.451 -18.813 1.00 0.88 C ATOM 1188 C GLY A 75 2.627 -12.472 -17.672 1.00 0.81 C ATOM 1189 O GLY A 75 1.728 -11.667 -17.453 1.00 0.81 O ATOM 0 HA2 GLY A 75 2.741 -14.455 -18.460 1.00 0.88 H new ATOM 0 HA3 GLY A 75 3.237 -13.206 -19.585 1.00 0.88 H new ATOM 1193 N CYS A 76 3.750 -12.479 -16.989 1.00 0.79 N ATOM 1194 CA CYS A 76 3.899 -11.661 -15.800 1.00 0.73 C ATOM 1195 C CYS A 76 4.855 -10.525 -16.116 1.00 0.75 C ATOM 1196 O CYS A 76 5.936 -10.758 -16.647 1.00 0.92 O ATOM 1197 CB CYS A 76 4.499 -12.485 -14.656 1.00 0.78 C ATOM 1198 SG CYS A 76 3.760 -14.137 -14.439 1.00 1.26 S ATOM 0 H CYS A 76 4.569 -13.036 -17.231 1.00 0.79 H new ATOM 0 HA CYS A 76 2.921 -11.285 -15.501 1.00 0.73 H new ATOM 0 HB2 CYS A 76 5.569 -12.600 -14.832 1.00 0.78 H new ATOM 0 HB3 CYS A 76 4.387 -11.927 -13.727 1.00 0.78 H new ATOM 1203 N ARG A 77 4.469 -9.302 -15.803 1.00 0.65 N ATOM 1204 CA ARG A 77 5.312 -8.163 -16.115 1.00 0.67 C ATOM 1205 C ARG A 77 5.412 -7.230 -14.922 1.00 0.57 C ATOM 1206 O ARG A 77 4.431 -7.002 -14.210 1.00 0.56 O ATOM 1207 CB ARG A 77 4.764 -7.406 -17.329 1.00 0.79 C ATOM 1208 CG ARG A 77 5.691 -6.319 -17.856 1.00 1.22 C ATOM 1209 CD ARG A 77 7.002 -6.898 -18.369 1.00 1.46 C ATOM 1210 NE ARG A 77 6.805 -7.795 -19.507 1.00 2.14 N ATOM 1211 CZ ARG A 77 7.245 -9.054 -19.554 1.00 2.81 C ATOM 1212 NH1 ARG A 77 7.905 -9.575 -18.525 1.00 3.04 N ATOM 1213 NH2 ARG A 77 7.039 -9.786 -20.640 1.00 3.68 N ATOM 0 H ARG A 77 3.590 -9.073 -15.339 1.00 0.65 H new ATOM 0 HA ARG A 77 6.309 -8.533 -16.353 1.00 0.67 H new ATOM 0 HB2 ARG A 77 4.567 -8.119 -18.129 1.00 0.79 H new ATOM 0 HB3 ARG A 77 3.809 -6.955 -17.061 1.00 0.79 H new ATOM 0 HG2 ARG A 77 5.194 -5.775 -18.659 1.00 1.22 H new ATOM 0 HG3 ARG A 77 5.896 -5.600 -17.063 1.00 1.22 H new ATOM 0 HD2 ARG A 77 7.666 -6.085 -18.661 1.00 1.46 H new ATOM 0 HD3 ARG A 77 7.497 -7.440 -17.563 1.00 1.46 H new ATOM 0 HE ARG A 77 6.299 -7.435 -20.316 1.00 2.14 H new ATOM 0 HH11 ARG A 77 8.078 -9.012 -17.692 1.00 3.04 H new ATOM 0 HH12 ARG A 77 8.238 -10.538 -18.568 1.00 3.04 H new ATOM 0 HH21 ARG A 77 6.545 -9.387 -21.438 1.00 3.68 H new ATOM 0 HH22 ARG A 77 7.375 -10.748 -20.678 1.00 3.68 H new ATOM 1227 N TYR A 78 6.601 -6.706 -14.704 1.00 0.56 N ATOM 1228 CA TYR A 78 6.822 -5.742 -13.645 1.00 0.48 C ATOM 1229 C TYR A 78 6.321 -4.367 -14.083 1.00 0.47 C ATOM 1230 O TYR A 78 6.784 -3.822 -15.084 1.00 0.53 O ATOM 1231 CB TYR A 78 8.313 -5.669 -13.281 1.00 0.47 C ATOM 1232 CG TYR A 78 8.889 -6.972 -12.759 1.00 0.53 C ATOM 1233 CD1 TYR A 78 8.403 -7.555 -11.595 1.00 0.47 C ATOM 1234 CD2 TYR A 78 9.912 -7.623 -13.438 1.00 0.70 C ATOM 1235 CE1 TYR A 78 8.918 -8.749 -11.123 1.00 0.54 C ATOM 1236 CE2 TYR A 78 10.434 -8.814 -12.973 1.00 0.79 C ATOM 1237 CZ TYR A 78 9.934 -9.375 -11.816 1.00 0.70 C ATOM 1238 OH TYR A 78 10.449 -10.568 -11.357 1.00 0.80 O ATOM 0 H TYR A 78 7.433 -6.933 -15.249 1.00 0.56 H new ATOM 0 HA TYR A 78 6.268 -6.061 -12.762 1.00 0.48 H new ATOM 0 HB2 TYR A 78 8.876 -5.363 -14.162 1.00 0.47 H new ATOM 0 HB3 TYR A 78 8.454 -4.894 -12.527 1.00 0.47 H new ATOM 0 HD1 TYR A 78 7.609 -7.067 -11.049 1.00 0.47 H new ATOM 0 HD2 TYR A 78 10.306 -7.190 -14.346 1.00 0.70 H new ATOM 0 HE1 TYR A 78 8.527 -9.189 -10.217 1.00 0.54 H new ATOM 0 HE2 TYR A 78 11.231 -9.304 -13.513 1.00 0.79 H new ATOM 0 HH TYR A 78 11.156 -10.873 -11.962 1.00 0.80 H new ATOM 1248 N TRP A 79 5.346 -3.835 -13.365 1.00 0.47 N ATOM 1249 CA TRP A 79 4.876 -2.480 -13.608 1.00 0.51 C ATOM 1250 C TRP A 79 5.509 -1.559 -12.573 1.00 0.46 C ATOM 1251 O TRP A 79 5.126 -1.561 -11.408 1.00 0.45 O ATOM 1252 CB TRP A 79 3.348 -2.442 -13.512 1.00 0.61 C ATOM 1253 CG TRP A 79 2.737 -1.135 -13.921 1.00 0.72 C ATOM 1254 CD1 TRP A 79 3.016 -0.409 -15.043 1.00 1.33 C ATOM 1255 CD2 TRP A 79 1.722 -0.410 -13.216 1.00 1.44 C ATOM 1256 NE1 TRP A 79 2.249 0.731 -15.070 1.00 1.23 N ATOM 1257 CE2 TRP A 79 1.446 0.752 -13.959 1.00 1.32 C ATOM 1258 CE3 TRP A 79 1.025 -0.630 -12.024 1.00 2.64 C ATOM 1259 CZ2 TRP A 79 0.501 1.690 -13.552 1.00 2.09 C ATOM 1260 CZ3 TRP A 79 0.085 0.303 -11.621 1.00 3.53 C ATOM 1261 CH2 TRP A 79 -0.167 1.450 -12.382 1.00 3.20 C ATOM 0 H TRP A 79 4.864 -4.320 -12.609 1.00 0.47 H new ATOM 0 HA TRP A 79 5.161 -2.148 -14.607 1.00 0.51 H new ATOM 0 HB2 TRP A 79 2.936 -3.234 -14.138 1.00 0.61 H new ATOM 0 HB3 TRP A 79 3.054 -2.662 -12.486 1.00 0.61 H new ATOM 0 HD1 TRP A 79 3.735 -0.690 -15.799 1.00 1.33 H new ATOM 0 HE1 TRP A 79 2.273 1.445 -15.798 1.00 1.23 H new ATOM 0 HE3 TRP A 79 1.216 -1.511 -11.429 1.00 2.64 H new ATOM 0 HZ2 TRP A 79 0.302 2.575 -14.138 1.00 2.09 H new ATOM 0 HZ3 TRP A 79 -0.463 0.143 -10.704 1.00 3.53 H new ATOM 0 HH2 TRP A 79 -0.904 2.161 -12.039 1.00 3.20 H new ATOM 1272 N ILE A 80 6.488 -0.778 -12.996 1.00 0.46 N ATOM 1273 CA ILE A 80 7.292 -0.016 -12.054 1.00 0.42 C ATOM 1274 C ILE A 80 6.822 1.437 -11.959 1.00 0.42 C ATOM 1275 O ILE A 80 6.562 2.087 -12.970 1.00 0.49 O ATOM 1276 CB ILE A 80 8.804 -0.069 -12.411 1.00 0.43 C ATOM 1277 CG1 ILE A 80 9.295 -1.521 -12.526 1.00 0.48 C ATOM 1278 CG2 ILE A 80 9.632 0.661 -11.364 1.00 0.40 C ATOM 1279 CD1 ILE A 80 9.112 -2.129 -13.900 1.00 0.55 C ATOM 0 H ILE A 80 6.744 -0.655 -13.976 1.00 0.46 H new ATOM 0 HA ILE A 80 7.157 -0.484 -11.079 1.00 0.42 H new ATOM 0 HB ILE A 80 8.929 0.424 -13.375 1.00 0.43 H new ATOM 0 HG12 ILE A 80 10.352 -1.558 -12.262 1.00 0.48 H new ATOM 0 HG13 ILE A 80 8.763 -2.132 -11.797 1.00 0.48 H new ATOM 0 HG21 ILE A 80 10.687 0.611 -11.634 1.00 0.40 H new ATOM 0 HG22 ILE A 80 9.319 1.704 -11.315 1.00 0.40 H new ATOM 0 HG23 ILE A 80 9.484 0.192 -10.391 1.00 0.40 H new ATOM 0 HD11 ILE A 80 9.483 -3.154 -13.897 1.00 0.55 H new ATOM 0 HD12 ILE A 80 8.054 -2.127 -14.161 1.00 0.55 H new ATOM 0 HD13 ILE A 80 9.667 -1.544 -14.633 1.00 0.55 H new ATOM 1291 N ARG A 81 6.710 1.921 -10.728 1.00 0.41 N ATOM 1292 CA ARG A 81 6.276 3.285 -10.440 1.00 0.44 C ATOM 1293 C ARG A 81 7.337 4.010 -9.625 1.00 0.35 C ATOM 1294 O ARG A 81 8.343 3.413 -9.253 1.00 0.42 O ATOM 1295 CB ARG A 81 4.956 3.263 -9.670 1.00 0.57 C ATOM 1296 CG ARG A 81 3.747 3.081 -10.563 1.00 1.21 C ATOM 1297 CD ARG A 81 2.478 2.849 -9.758 1.00 1.97 C ATOM 1298 NE ARG A 81 2.497 1.565 -9.052 1.00 2.78 N ATOM 1299 CZ ARG A 81 1.426 1.020 -8.473 1.00 3.79 C ATOM 1300 NH1 ARG A 81 0.255 1.650 -8.502 1.00 4.16 N ATOM 1301 NH2 ARG A 81 1.524 -0.157 -7.870 1.00 4.76 N ATOM 0 H ARG A 81 6.919 1.374 -9.893 1.00 0.41 H new ATOM 0 HA ARG A 81 6.130 3.813 -11.382 1.00 0.44 H new ATOM 0 HB2 ARG A 81 4.983 2.456 -8.938 1.00 0.57 H new ATOM 0 HB3 ARG A 81 4.852 4.195 -9.114 1.00 0.57 H new ATOM 0 HG2 ARG A 81 3.623 3.964 -11.190 1.00 1.21 H new ATOM 0 HG3 ARG A 81 3.913 2.236 -11.231 1.00 1.21 H new ATOM 0 HD2 ARG A 81 2.355 3.657 -9.036 1.00 1.97 H new ATOM 0 HD3 ARG A 81 1.616 2.883 -10.424 1.00 1.97 H new ATOM 0 HE ARG A 81 3.381 1.058 -9.000 1.00 2.78 H new ATOM 0 HH11 ARG A 81 0.173 2.554 -8.968 1.00 4.16 H new ATOM 0 HH12 ARG A 81 -0.561 1.230 -8.058 1.00 4.16 H new ATOM 0 HH21 ARG A 81 2.419 -0.646 -7.849 1.00 4.76 H new ATOM 0 HH22 ARG A 81 0.705 -0.573 -7.427 1.00 4.76 H new ATOM 1315 N THR A 82 7.120 5.286 -9.345 1.00 0.41 N ATOM 1316 CA THR A 82 8.096 6.066 -8.588 1.00 0.35 C ATOM 1317 C THR A 82 7.511 6.512 -7.251 1.00 0.32 C ATOM 1318 O THR A 82 6.456 7.134 -7.204 1.00 0.36 O ATOM 1319 CB THR A 82 8.569 7.305 -9.382 1.00 0.38 C ATOM 1320 OG1 THR A 82 8.862 6.932 -10.736 1.00 0.45 O ATOM 1321 CG2 THR A 82 9.816 7.938 -8.751 1.00 0.36 C ATOM 0 H THR A 82 6.286 5.802 -9.626 1.00 0.41 H new ATOM 0 HA THR A 82 8.956 5.420 -8.408 1.00 0.35 H new ATOM 0 HB THR A 82 7.764 8.040 -9.361 1.00 0.38 H new ATOM 0 HG1 THR A 82 9.160 7.721 -11.236 1.00 0.45 H new ATOM 0 HG21 THR A 82 10.119 8.806 -9.336 1.00 0.36 H new ATOM 0 HG22 THR A 82 9.590 8.249 -7.731 1.00 0.36 H new ATOM 0 HG23 THR A 82 10.626 7.209 -8.737 1.00 0.36 H new ATOM 1329 N PHE A 83 8.196 6.178 -6.172 1.00 0.27 N ATOM 1330 CA PHE A 83 7.792 6.604 -4.839 1.00 0.26 C ATOM 1331 C PHE A 83 8.832 7.539 -4.254 1.00 0.26 C ATOM 1332 O PHE A 83 9.988 7.175 -4.091 1.00 0.36 O ATOM 1333 CB PHE A 83 7.600 5.400 -3.909 1.00 0.26 C ATOM 1334 CG PHE A 83 6.280 4.689 -4.060 1.00 0.29 C ATOM 1335 CD1 PHE A 83 5.083 5.378 -3.961 1.00 0.37 C ATOM 1336 CD2 PHE A 83 6.244 3.324 -4.279 1.00 0.33 C ATOM 1337 CE1 PHE A 83 3.876 4.715 -4.083 1.00 0.44 C ATOM 1338 CE2 PHE A 83 5.045 2.652 -4.400 1.00 0.38 C ATOM 1339 CZ PHE A 83 3.856 3.350 -4.302 1.00 0.42 C ATOM 0 H PHE A 83 9.042 5.608 -6.191 1.00 0.27 H new ATOM 0 HA PHE A 83 6.840 7.127 -4.927 1.00 0.26 H new ATOM 0 HB2 PHE A 83 8.404 4.687 -4.091 1.00 0.26 H new ATOM 0 HB3 PHE A 83 7.700 5.736 -2.877 1.00 0.26 H new ATOM 0 HD1 PHE A 83 5.092 6.444 -3.787 1.00 0.37 H new ATOM 0 HD2 PHE A 83 7.170 2.774 -4.357 1.00 0.33 H new ATOM 0 HE1 PHE A 83 2.949 5.263 -4.007 1.00 0.44 H new ATOM 0 HE2 PHE A 83 5.036 1.586 -4.570 1.00 0.38 H new ATOM 0 HZ PHE A 83 2.914 2.831 -4.396 1.00 0.42 H new ATOM 1349 N VAL A 84 8.410 8.740 -3.938 1.00 0.24 N ATOM 1350 CA VAL A 84 9.304 9.763 -3.431 1.00 0.24 C ATOM 1351 C VAL A 84 8.834 10.238 -2.058 1.00 0.24 C ATOM 1352 O VAL A 84 7.655 10.542 -1.868 1.00 0.27 O ATOM 1353 CB VAL A 84 9.379 10.960 -4.406 1.00 0.27 C ATOM 1354 CG1 VAL A 84 10.123 10.587 -5.680 1.00 0.30 C ATOM 1355 CG2 VAL A 84 7.986 11.438 -4.755 1.00 0.29 C ATOM 0 H VAL A 84 7.439 9.039 -4.024 1.00 0.24 H new ATOM 0 HA VAL A 84 10.300 9.331 -3.339 1.00 0.24 H new ATOM 0 HB VAL A 84 9.925 11.761 -3.908 1.00 0.27 H new ATOM 0 HG11 VAL A 84 10.159 11.449 -6.346 1.00 0.30 H new ATOM 0 HG12 VAL A 84 11.138 10.278 -5.431 1.00 0.30 H new ATOM 0 HG13 VAL A 84 9.605 9.767 -6.177 1.00 0.30 H new ATOM 0 HG21 VAL A 84 8.052 12.281 -5.442 1.00 0.29 H new ATOM 0 HG22 VAL A 84 7.431 10.628 -5.227 1.00 0.29 H new ATOM 0 HG23 VAL A 84 7.470 11.750 -3.847 1.00 0.29 H new ATOM 1365 N PRO A 85 9.741 10.264 -1.071 1.00 0.35 N ATOM 1366 CA PRO A 85 9.425 10.729 0.281 1.00 0.34 C ATOM 1367 C PRO A 85 8.916 12.166 0.284 1.00 0.38 C ATOM 1368 O PRO A 85 9.443 13.025 -0.422 1.00 0.52 O ATOM 1369 CB PRO A 85 10.765 10.629 1.020 1.00 0.49 C ATOM 1370 CG PRO A 85 11.562 9.647 0.237 1.00 0.78 C ATOM 1371 CD PRO A 85 11.142 9.834 -1.190 1.00 0.56 C ATOM 0 HA PRO A 85 8.632 10.141 0.742 1.00 0.34 H new ATOM 0 HB2 PRO A 85 11.264 11.597 1.065 1.00 0.49 H new ATOM 0 HB3 PRO A 85 10.625 10.294 2.048 1.00 0.49 H new ATOM 0 HG2 PRO A 85 12.631 9.824 0.358 1.00 0.78 H new ATOM 0 HG3 PRO A 85 11.368 8.628 0.572 1.00 0.78 H new ATOM 0 HD2 PRO A 85 11.752 10.583 -1.695 1.00 0.56 H new ATOM 0 HD3 PRO A 85 11.233 8.910 -1.762 1.00 0.56 H new ATOM 1379 N SER A 86 7.884 12.405 1.080 1.00 0.34 N ATOM 1380 CA SER A 86 7.274 13.718 1.201 1.00 0.46 C ATOM 1381 C SER A 86 8.183 14.649 2.020 1.00 0.58 C ATOM 1382 O SER A 86 9.412 14.585 1.925 1.00 0.93 O ATOM 1383 CB SER A 86 5.910 13.566 1.886 1.00 0.53 C ATOM 1384 OG SER A 86 5.168 14.777 1.875 1.00 1.27 O ATOM 0 H SER A 86 7.446 11.690 1.661 1.00 0.34 H new ATOM 0 HA SER A 86 7.140 14.156 0.212 1.00 0.46 H new ATOM 0 HB2 SER A 86 5.338 12.786 1.384 1.00 0.53 H new ATOM 0 HB3 SER A 86 6.056 13.241 2.916 1.00 0.53 H new ATOM 0 HG SER A 86 4.775 14.928 2.760 1.00 1.27 H new ATOM 1390 N SER A 87 7.573 15.500 2.836 1.00 0.75 N ATOM 1391 CA SER A 87 8.308 16.418 3.694 1.00 0.90 C ATOM 1392 C SER A 87 9.165 15.656 4.708 1.00 0.79 C ATOM 1393 O SER A 87 10.167 16.169 5.207 1.00 0.89 O ATOM 1394 CB SER A 87 7.324 17.355 4.409 1.00 1.12 C ATOM 1395 OG SER A 87 8.004 18.366 5.130 1.00 1.70 O ATOM 0 H SER A 87 6.559 15.572 2.921 1.00 0.75 H new ATOM 0 HA SER A 87 8.980 17.013 3.076 1.00 0.90 H new ATOM 0 HB2 SER A 87 6.658 17.813 3.677 1.00 1.12 H new ATOM 0 HB3 SER A 87 6.699 16.778 5.091 1.00 1.12 H new ATOM 0 HG SER A 87 7.351 18.947 5.573 1.00 1.70 H new ATOM 1401 N ARG A 88 8.777 14.420 4.990 1.00 0.64 N ATOM 1402 CA ARG A 88 9.493 13.589 5.949 1.00 0.58 C ATOM 1403 C ARG A 88 9.448 12.125 5.526 1.00 0.49 C ATOM 1404 O ARG A 88 8.425 11.643 5.034 1.00 0.46 O ATOM 1405 CB ARG A 88 8.915 13.753 7.370 1.00 0.66 C ATOM 1406 CG ARG A 88 7.409 13.547 7.475 1.00 0.75 C ATOM 1407 CD ARG A 88 6.642 14.839 7.222 1.00 1.11 C ATOM 1408 NE ARG A 88 5.194 14.645 7.297 1.00 1.51 N ATOM 1409 CZ ARG A 88 4.382 15.376 8.062 1.00 1.84 C ATOM 1410 NH1 ARG A 88 4.874 16.340 8.830 1.00 1.95 N ATOM 1411 NH2 ARG A 88 3.074 15.146 8.046 1.00 2.59 N ATOM 0 H ARG A 88 7.966 13.969 4.566 1.00 0.64 H new ATOM 0 HA ARG A 88 10.532 13.918 5.966 1.00 0.58 H new ATOM 0 HB2 ARG A 88 9.412 13.044 8.033 1.00 0.66 H new ATOM 0 HB3 ARG A 88 9.157 14.752 7.732 1.00 0.66 H new ATOM 0 HG2 ARG A 88 7.095 12.791 6.756 1.00 0.75 H new ATOM 0 HG3 ARG A 88 7.162 13.166 8.466 1.00 0.75 H new ATOM 0 HD2 ARG A 88 6.945 15.589 7.953 1.00 1.11 H new ATOM 0 HD3 ARG A 88 6.904 15.229 6.238 1.00 1.11 H new ATOM 0 HE ARG A 88 4.780 13.905 6.730 1.00 1.51 H new ATOM 0 HH11 ARG A 88 5.877 16.525 8.837 1.00 1.95 H new ATOM 0 HH12 ARG A 88 4.249 16.896 9.413 1.00 1.95 H new ATOM 0 HH21 ARG A 88 2.693 14.412 7.450 1.00 2.59 H new ATOM 0 HH22 ARG A 88 2.451 15.704 8.630 1.00 2.59 H new ATOM 1425 N PRO A 89 10.576 11.410 5.687 1.00 0.49 N ATOM 1426 CA PRO A 89 10.675 9.981 5.365 1.00 0.48 C ATOM 1427 C PRO A 89 9.668 9.154 6.156 1.00 0.48 C ATOM 1428 O PRO A 89 9.654 9.181 7.386 1.00 0.62 O ATOM 1429 CB PRO A 89 12.107 9.613 5.765 1.00 0.58 C ATOM 1430 CG PRO A 89 12.847 10.906 5.771 1.00 0.70 C ATOM 1431 CD PRO A 89 11.853 11.947 6.192 1.00 0.56 C ATOM 0 HA PRO A 89 10.458 9.781 4.316 1.00 0.48 H new ATOM 0 HB2 PRO A 89 12.134 9.138 6.746 1.00 0.58 H new ATOM 0 HB3 PRO A 89 12.546 8.909 5.058 1.00 0.58 H new ATOM 0 HG2 PRO A 89 13.690 10.870 6.460 1.00 0.70 H new ATOM 0 HG3 PRO A 89 13.252 11.129 4.784 1.00 0.70 H new ATOM 0 HD2 PRO A 89 11.837 12.075 7.274 1.00 0.56 H new ATOM 0 HD3 PRO A 89 12.081 12.921 5.759 1.00 0.56 H new ATOM 1439 N GLY A 90 8.836 8.420 5.437 1.00 0.41 N ATOM 1440 CA GLY A 90 7.743 7.697 6.052 1.00 0.42 C ATOM 1441 C GLY A 90 6.439 8.042 5.372 1.00 0.38 C ATOM 1442 O GLY A 90 5.625 7.169 5.087 1.00 0.43 O ATOM 0 H GLY A 90 8.899 8.311 4.425 1.00 0.41 H new ATOM 0 HA2 GLY A 90 7.924 6.624 5.984 1.00 0.42 H new ATOM 0 HA3 GLY A 90 7.685 7.944 7.112 1.00 0.42 H new ATOM 1446 N GLN A 91 6.261 9.332 5.112 1.00 0.33 N ATOM 1447 CA GLN A 91 5.172 9.821 4.280 1.00 0.31 C ATOM 1448 C GLN A 91 5.653 9.831 2.841 1.00 0.26 C ATOM 1449 O GLN A 91 6.574 10.571 2.500 1.00 0.30 O ATOM 1450 CB GLN A 91 4.772 11.234 4.709 1.00 0.39 C ATOM 1451 CG GLN A 91 3.580 11.792 3.950 1.00 0.61 C ATOM 1452 CD GLN A 91 3.144 13.141 4.482 1.00 0.61 C ATOM 1453 OE1 GLN A 91 3.313 13.435 5.665 1.00 1.11 O ATOM 1454 NE2 GLN A 91 2.574 13.965 3.621 1.00 1.03 N ATOM 0 H GLN A 91 6.869 10.067 5.473 1.00 0.33 H new ATOM 0 HA GLN A 91 4.299 9.176 4.384 1.00 0.31 H new ATOM 0 HB2 GLN A 91 4.542 11.229 5.774 1.00 0.39 H new ATOM 0 HB3 GLN A 91 5.623 11.900 4.570 1.00 0.39 H new ATOM 0 HG2 GLN A 91 3.835 11.885 2.894 1.00 0.61 H new ATOM 0 HG3 GLN A 91 2.748 11.091 4.017 1.00 0.61 H new ATOM 0 HE21 GLN A 91 2.453 13.682 2.648 1.00 1.03 H new ATOM 0 HE22 GLN A 91 2.255 14.884 3.929 1.00 1.03 H new ATOM 1463 N PHE A 92 5.066 9.000 2.006 1.00 0.24 N ATOM 1464 CA PHE A 92 5.541 8.855 0.648 1.00 0.24 C ATOM 1465 C PHE A 92 4.535 9.385 -0.355 1.00 0.26 C ATOM 1466 O PHE A 92 3.325 9.324 -0.144 1.00 0.35 O ATOM 1467 CB PHE A 92 5.875 7.393 0.353 1.00 0.31 C ATOM 1468 CG PHE A 92 6.972 6.852 1.222 1.00 0.33 C ATOM 1469 CD1 PHE A 92 8.258 7.356 1.124 1.00 0.32 C ATOM 1470 CD2 PHE A 92 6.718 5.843 2.136 1.00 0.42 C ATOM 1471 CE1 PHE A 92 9.273 6.863 1.921 1.00 0.40 C ATOM 1472 CE2 PHE A 92 7.728 5.348 2.935 1.00 0.50 C ATOM 1473 CZ PHE A 92 9.007 5.857 2.828 1.00 0.48 C ATOM 0 H PHE A 92 4.263 8.417 2.243 1.00 0.24 H new ATOM 0 HA PHE A 92 6.449 9.450 0.549 1.00 0.24 H new ATOM 0 HB2 PHE A 92 4.979 6.787 0.490 1.00 0.31 H new ATOM 0 HB3 PHE A 92 6.168 7.297 -0.693 1.00 0.31 H new ATOM 0 HD1 PHE A 92 8.470 8.144 0.416 1.00 0.32 H new ATOM 0 HD2 PHE A 92 5.720 5.440 2.224 1.00 0.42 H new ATOM 0 HE1 PHE A 92 10.272 7.264 1.835 1.00 0.40 H new ATOM 0 HE2 PHE A 92 7.518 4.562 3.645 1.00 0.50 H new ATOM 0 HZ PHE A 92 9.798 5.469 3.453 1.00 0.48 H new ATOM 1483 N THR A 93 5.067 9.928 -1.430 1.00 0.23 N ATOM 1484 CA THR A 93 4.285 10.445 -2.530 1.00 0.27 C ATOM 1485 C THR A 93 4.786 9.775 -3.813 1.00 0.26 C ATOM 1486 O THR A 93 5.722 8.978 -3.758 1.00 0.25 O ATOM 1487 CB THR A 93 4.415 11.986 -2.633 1.00 0.35 C ATOM 1488 OG1 THR A 93 5.744 12.344 -3.014 1.00 1.29 O ATOM 1489 CG2 THR A 93 4.094 12.666 -1.304 1.00 0.92 C ATOM 0 H THR A 93 6.074 10.023 -1.565 1.00 0.23 H new ATOM 0 HA THR A 93 3.229 10.224 -2.371 1.00 0.27 H new ATOM 0 HB THR A 93 3.701 12.321 -3.385 1.00 0.35 H new ATOM 0 HG1 THR A 93 6.383 11.746 -2.573 1.00 1.29 H new ATOM 0 HG21 THR A 93 4.195 13.746 -1.414 1.00 0.92 H new ATOM 0 HG22 THR A 93 3.072 12.426 -1.010 1.00 0.92 H new ATOM 0 HG23 THR A 93 4.785 12.313 -0.538 1.00 0.92 H new ATOM 1497 N LEU A 94 4.185 10.072 -4.956 1.00 0.34 N ATOM 1498 CA LEU A 94 4.641 9.466 -6.212 1.00 0.37 C ATOM 1499 C LEU A 94 5.611 10.399 -6.905 1.00 0.34 C ATOM 1500 O LEU A 94 5.439 11.619 -6.892 1.00 0.39 O ATOM 1501 CB LEU A 94 3.474 9.185 -7.175 1.00 0.54 C ATOM 1502 CG LEU A 94 2.609 7.959 -6.881 1.00 0.50 C ATOM 1503 CD1 LEU A 94 3.380 6.676 -7.152 1.00 0.88 C ATOM 1504 CD2 LEU A 94 2.117 7.993 -5.452 1.00 0.75 C ATOM 0 H LEU A 94 3.397 10.714 -5.047 1.00 0.34 H new ATOM 0 HA LEU A 94 5.119 8.520 -5.958 1.00 0.37 H new ATOM 0 HB2 LEU A 94 2.826 10.061 -7.186 1.00 0.54 H new ATOM 0 HB3 LEU A 94 3.883 9.078 -8.180 1.00 0.54 H new ATOM 0 HG LEU A 94 1.745 7.981 -7.546 1.00 0.50 H new ATOM 0 HD11 LEU A 94 2.745 5.817 -6.936 1.00 0.88 H new ATOM 0 HD12 LEU A 94 3.684 6.648 -8.198 1.00 0.88 H new ATOM 0 HD13 LEU A 94 4.265 6.642 -6.516 1.00 0.88 H new ATOM 0 HD21 LEU A 94 1.503 7.114 -5.258 1.00 0.75 H new ATOM 0 HD22 LEU A 94 2.970 7.997 -4.773 1.00 0.75 H new ATOM 0 HD23 LEU A 94 1.523 8.893 -5.293 1.00 0.75 H new ATOM 1516 N GLY A 95 6.634 9.784 -7.504 1.00 0.32 N ATOM 1517 CA GLY A 95 7.711 10.508 -8.155 1.00 0.34 C ATOM 1518 C GLY A 95 7.207 11.541 -9.141 1.00 0.46 C ATOM 1519 O GLY A 95 7.877 12.536 -9.409 1.00 0.88 O ATOM 0 H GLY A 95 6.732 8.770 -7.547 1.00 0.32 H new ATOM 0 HA2 GLY A 95 8.321 11.001 -7.398 1.00 0.34 H new ATOM 0 HA3 GLY A 95 8.357 9.800 -8.675 1.00 0.34 H new ATOM 1523 N ASN A 96 6.026 11.283 -9.687 1.00 0.57 N ATOM 1524 CA ASN A 96 5.327 12.242 -10.528 1.00 0.71 C ATOM 1525 C ASN A 96 3.841 12.246 -10.189 1.00 0.61 C ATOM 1526 O ASN A 96 2.995 12.298 -11.078 1.00 0.66 O ATOM 1527 CB ASN A 96 5.518 11.914 -12.011 1.00 0.98 C ATOM 1528 CG ASN A 96 6.876 12.331 -12.539 1.00 1.89 C ATOM 1529 OD1 ASN A 96 7.840 11.564 -12.489 1.00 2.72 O ATOM 1530 ND2 ASN A 96 6.960 13.545 -13.060 1.00 2.42 N ATOM 0 H ASN A 96 5.527 10.403 -9.559 1.00 0.57 H new ATOM 0 HA ASN A 96 5.746 13.230 -10.337 1.00 0.71 H new ATOM 0 HB2 ASN A 96 5.390 10.842 -12.160 1.00 0.98 H new ATOM 0 HB3 ASN A 96 4.740 12.411 -12.591 1.00 0.98 H new ATOM 0 HD21 ASN A 96 7.847 13.877 -13.440 1.00 2.42 H new ATOM 0 HD22 ASN A 96 6.138 14.149 -13.082 1.00 2.42 H new ATOM 1537 N ILE A 97 3.522 12.195 -8.896 1.00 0.55 N ATOM 1538 CA ILE A 97 2.127 12.120 -8.459 1.00 0.57 C ATOM 1539 C ILE A 97 1.333 13.330 -8.931 1.00 0.74 C ATOM 1540 O ILE A 97 0.169 13.216 -9.308 1.00 0.88 O ATOM 1541 CB ILE A 97 1.979 12.003 -6.920 1.00 0.54 C ATOM 1542 CG1 ILE A 97 0.502 11.870 -6.547 1.00 0.68 C ATOM 1543 CG2 ILE A 97 2.609 13.200 -6.213 1.00 0.60 C ATOM 1544 CD1 ILE A 97 -0.122 10.582 -7.037 1.00 1.20 C ATOM 0 H ILE A 97 4.204 12.204 -8.138 1.00 0.55 H new ATOM 0 HA ILE A 97 1.731 11.211 -8.912 1.00 0.57 H new ATOM 0 HB ILE A 97 2.508 11.109 -6.590 1.00 0.54 H new ATOM 0 HG12 ILE A 97 0.401 11.926 -5.463 1.00 0.68 H new ATOM 0 HG13 ILE A 97 -0.049 12.714 -6.962 1.00 0.68 H new ATOM 0 HG21 ILE A 97 2.490 13.090 -5.135 1.00 0.60 H new ATOM 0 HG22 ILE A 97 3.670 13.250 -6.457 1.00 0.60 H new ATOM 0 HG23 ILE A 97 2.118 14.116 -6.541 1.00 0.60 H new ATOM 0 HD11 ILE A 97 -1.170 10.549 -6.740 1.00 1.20 H new ATOM 0 HD12 ILE A 97 -0.051 10.534 -8.124 1.00 1.20 H new ATOM 0 HD13 ILE A 97 0.405 9.733 -6.601 1.00 1.20 H new ATOM 1556 N HIS A 98 1.972 14.483 -8.936 1.00 0.85 N ATOM 1557 CA HIS A 98 1.286 15.712 -9.271 1.00 1.12 C ATOM 1558 C HIS A 98 1.270 15.915 -10.782 1.00 1.14 C ATOM 1559 O HIS A 98 0.750 16.911 -11.286 1.00 1.38 O ATOM 1560 CB HIS A 98 1.945 16.882 -8.543 1.00 1.38 C ATOM 1561 CG HIS A 98 1.071 18.095 -8.437 1.00 2.01 C ATOM 1562 ND1 HIS A 98 -0.308 18.036 -8.447 1.00 2.88 N ATOM 1563 CD2 HIS A 98 1.385 19.405 -8.310 1.00 2.69 C ATOM 1564 CE1 HIS A 98 -0.800 19.254 -8.329 1.00 3.63 C ATOM 1565 NE2 HIS A 98 0.204 20.102 -8.246 1.00 3.56 N ATOM 0 H HIS A 98 2.961 14.593 -8.713 1.00 0.85 H new ATOM 0 HA HIS A 98 0.248 15.654 -8.943 1.00 1.12 H new ATOM 0 HB2 HIS A 98 2.229 16.561 -7.541 1.00 1.38 H new ATOM 0 HB3 HIS A 98 2.864 17.151 -9.064 1.00 1.38 H new ATOM 0 HD2 HIS A 98 2.379 19.824 -8.267 1.00 2.69 H new ATOM 0 HE1 HIS A 98 -1.848 19.512 -8.305 1.00 3.63 H new ATOM 0 HE2 HIS A 98 0.118 21.114 -8.150 1.00 3.56 H new ATOM 1574 N SER A 99 1.838 14.951 -11.500 1.00 0.99 N ATOM 1575 CA SER A 99 1.741 14.916 -12.949 1.00 1.16 C ATOM 1576 C SER A 99 0.454 14.196 -13.344 1.00 1.22 C ATOM 1577 O SER A 99 0.011 14.255 -14.491 1.00 1.30 O ATOM 1578 CB SER A 99 2.962 14.212 -13.551 1.00 1.24 C ATOM 1579 OG SER A 99 4.167 14.804 -13.087 1.00 1.79 O ATOM 0 H SER A 99 2.372 14.182 -11.096 1.00 0.99 H new ATOM 0 HA SER A 99 1.718 15.934 -13.337 1.00 1.16 H new ATOM 0 HB2 SER A 99 2.945 13.155 -13.285 1.00 1.24 H new ATOM 0 HB3 SER A 99 2.920 14.268 -14.639 1.00 1.24 H new ATOM 0 HG SER A 99 4.600 15.285 -13.823 1.00 1.79 H new ATOM 1585 N TYR A 100 -0.136 13.516 -12.368 1.00 1.23 N ATOM 1586 CA TYR A 100 -1.429 12.874 -12.545 1.00 1.30 C ATOM 1587 C TYR A 100 -2.534 13.915 -12.386 1.00 1.17 C ATOM 1588 O TYR A 100 -2.594 14.628 -11.383 1.00 1.30 O ATOM 1589 CB TYR A 100 -1.617 11.740 -11.537 1.00 1.63 C ATOM 1590 CG TYR A 100 -0.591 10.629 -11.640 1.00 2.74 C ATOM 1591 CD1 TYR A 100 -0.546 9.793 -12.747 1.00 3.75 C ATOM 1592 CD2 TYR A 100 0.328 10.415 -10.624 1.00 2.85 C ATOM 1593 CE1 TYR A 100 0.389 8.776 -12.836 1.00 4.83 C ATOM 1594 CE2 TYR A 100 1.264 9.403 -10.704 1.00 3.91 C ATOM 1595 CZ TYR A 100 1.292 8.587 -11.810 1.00 4.89 C ATOM 1596 OH TYR A 100 2.225 7.576 -11.890 1.00 5.98 O ATOM 0 H TYR A 100 0.267 13.396 -11.439 1.00 1.23 H new ATOM 0 HA TYR A 100 -1.477 12.443 -13.545 1.00 1.30 H new ATOM 0 HB2 TYR A 100 -1.583 12.157 -10.530 1.00 1.63 H new ATOM 0 HB3 TYR A 100 -2.611 11.313 -11.671 1.00 1.63 H new ATOM 0 HD1 TYR A 100 -1.252 9.938 -13.552 1.00 3.75 H new ATOM 0 HD2 TYR A 100 0.311 11.053 -9.753 1.00 2.85 H new ATOM 0 HE1 TYR A 100 0.412 8.134 -13.704 1.00 4.83 H new ATOM 0 HE2 TYR A 100 1.971 9.253 -9.901 1.00 3.91 H new ATOM 0 HH TYR A 100 2.784 7.582 -11.085 1.00 5.98 H new ATOM 1606 N PRO A 101 -3.423 14.000 -13.383 1.00 1.09 N ATOM 1607 CA PRO A 101 -4.389 15.101 -13.515 1.00 1.04 C ATOM 1608 C PRO A 101 -5.529 15.067 -12.499 1.00 0.89 C ATOM 1609 O PRO A 101 -5.877 16.094 -11.919 1.00 0.94 O ATOM 1610 CB PRO A 101 -4.936 14.911 -14.932 1.00 1.19 C ATOM 1611 CG PRO A 101 -4.782 13.456 -15.212 1.00 1.28 C ATOM 1612 CD PRO A 101 -3.554 13.011 -14.466 1.00 1.21 C ATOM 0 HA PRO A 101 -3.909 16.062 -13.332 1.00 1.04 H new ATOM 0 HB2 PRO A 101 -5.980 15.217 -14.996 1.00 1.19 H new ATOM 0 HB3 PRO A 101 -4.382 15.513 -15.653 1.00 1.19 H new ATOM 0 HG2 PRO A 101 -5.660 12.901 -14.882 1.00 1.28 H new ATOM 0 HG3 PRO A 101 -4.674 13.275 -16.281 1.00 1.28 H new ATOM 0 HD2 PRO A 101 -3.669 12.001 -14.073 1.00 1.21 H new ATOM 0 HD3 PRO A 101 -2.675 13.005 -15.110 1.00 1.21 H new ATOM 1620 N GLN A 102 -6.117 13.899 -12.289 1.00 0.82 N ATOM 1621 CA GLN A 102 -7.290 13.798 -11.432 1.00 0.74 C ATOM 1622 C GLN A 102 -6.897 13.640 -9.970 1.00 0.63 C ATOM 1623 O GLN A 102 -7.702 13.867 -9.066 1.00 0.59 O ATOM 1624 CB GLN A 102 -8.165 12.620 -11.856 1.00 0.83 C ATOM 1625 CG GLN A 102 -9.499 12.582 -11.136 1.00 0.98 C ATOM 1626 CD GLN A 102 -10.319 13.831 -11.400 1.00 1.30 C ATOM 1627 OE1 GLN A 102 -10.222 14.814 -10.669 1.00 1.95 O ATOM 1628 NE2 GLN A 102 -11.127 13.803 -12.444 1.00 1.73 N ATOM 0 H GLN A 102 -5.806 13.016 -12.695 1.00 0.82 H new ATOM 0 HA GLN A 102 -7.854 14.724 -11.541 1.00 0.74 H new ATOM 0 HB2 GLN A 102 -8.340 12.673 -12.931 1.00 0.83 H new ATOM 0 HB3 GLN A 102 -7.629 11.690 -11.666 1.00 0.83 H new ATOM 0 HG2 GLN A 102 -10.060 11.704 -11.457 1.00 0.98 H new ATOM 0 HG3 GLN A 102 -9.330 12.478 -10.064 1.00 0.98 H new ATOM 0 HE21 GLN A 102 -11.179 12.967 -13.027 1.00 1.73 H new ATOM 0 HE22 GLN A 102 -11.699 14.617 -12.668 1.00 1.73 H new ATOM 1637 N ILE A 103 -5.662 13.248 -9.742 1.00 0.60 N ATOM 1638 CA ILE A 103 -5.196 12.992 -8.396 1.00 0.51 C ATOM 1639 C ILE A 103 -5.084 14.299 -7.621 1.00 0.52 C ATOM 1640 O ILE A 103 -4.277 15.175 -7.938 1.00 0.65 O ATOM 1641 CB ILE A 103 -3.842 12.232 -8.380 1.00 0.54 C ATOM 1642 CG1 ILE A 103 -4.014 10.782 -8.874 1.00 0.63 C ATOM 1643 CG2 ILE A 103 -3.244 12.239 -6.978 1.00 0.43 C ATOM 1644 CD1 ILE A 103 -4.416 10.644 -10.332 1.00 1.10 C ATOM 0 H ILE A 103 -4.963 13.100 -10.470 1.00 0.60 H new ATOM 0 HA ILE A 103 -5.931 12.349 -7.911 1.00 0.51 H new ATOM 0 HB ILE A 103 -3.161 12.746 -9.058 1.00 0.54 H new ATOM 0 HG12 ILE A 103 -3.077 10.248 -8.719 1.00 0.63 H new ATOM 0 HG13 ILE A 103 -4.767 10.291 -8.257 1.00 0.63 H new ATOM 0 HG21 ILE A 103 -2.295 11.702 -6.984 1.00 0.43 H new ATOM 0 HG22 ILE A 103 -3.077 13.268 -6.659 1.00 0.43 H new ATOM 0 HG23 ILE A 103 -3.932 11.752 -6.287 1.00 0.43 H new ATOM 0 HD11 ILE A 103 -4.512 9.588 -10.585 1.00 1.10 H new ATOM 0 HD12 ILE A 103 -5.371 11.144 -10.495 1.00 1.10 H new ATOM 0 HD13 ILE A 103 -3.654 11.101 -10.964 1.00 1.10 H new ATOM 1656 N GLN A 104 -5.936 14.411 -6.619 1.00 0.45 N ATOM 1657 CA GLN A 104 -6.019 15.591 -5.779 1.00 0.48 C ATOM 1658 C GLN A 104 -4.783 15.667 -4.897 1.00 0.50 C ATOM 1659 O GLN A 104 -4.141 16.709 -4.783 1.00 0.63 O ATOM 1660 CB GLN A 104 -7.280 15.496 -4.917 1.00 0.46 C ATOM 1661 CG GLN A 104 -8.469 14.883 -5.648 1.00 0.43 C ATOM 1662 CD GLN A 104 -9.219 15.887 -6.495 1.00 0.52 C ATOM 1663 OE1 GLN A 104 -10.136 16.547 -6.021 1.00 1.40 O ATOM 1664 NE2 GLN A 104 -8.857 15.982 -7.760 1.00 0.98 N ATOM 0 H GLN A 104 -6.597 13.677 -6.363 1.00 0.45 H new ATOM 0 HA GLN A 104 -6.069 16.490 -6.394 1.00 0.48 H new ATOM 0 HB2 GLN A 104 -7.061 14.900 -4.031 1.00 0.46 H new ATOM 0 HB3 GLN A 104 -7.551 16.494 -4.571 1.00 0.46 H new ATOM 0 HG2 GLN A 104 -8.119 14.069 -6.283 1.00 0.43 H new ATOM 0 HG3 GLN A 104 -9.152 14.447 -4.919 1.00 0.43 H new ATOM 0 HE21 GLN A 104 -8.088 15.414 -8.114 1.00 0.98 H new ATOM 0 HE22 GLN A 104 -9.347 16.624 -8.384 1.00 0.98 H new ATOM 1673 N SER A 105 -4.467 14.536 -4.284 1.00 0.40 N ATOM 1674 CA SER A 105 -3.278 14.380 -3.467 1.00 0.41 C ATOM 1675 C SER A 105 -2.971 12.893 -3.331 1.00 0.36 C ATOM 1676 O SER A 105 -3.831 12.052 -3.613 1.00 0.39 O ATOM 1677 CB SER A 105 -3.478 14.998 -2.075 1.00 0.48 C ATOM 1678 OG SER A 105 -3.702 16.397 -2.152 1.00 1.13 O ATOM 0 H SER A 105 -5.037 13.692 -4.342 1.00 0.40 H new ATOM 0 HA SER A 105 -2.447 14.897 -3.947 1.00 0.41 H new ATOM 0 HB2 SER A 105 -4.325 14.520 -1.582 1.00 0.48 H new ATOM 0 HB3 SER A 105 -2.599 14.803 -1.460 1.00 0.48 H new ATOM 0 HG SER A 105 -3.576 16.698 -3.076 1.00 1.13 H new ATOM 1684 N TYR A 106 -1.755 12.569 -2.933 1.00 0.35 N ATOM 1685 CA TYR A 106 -1.406 11.190 -2.647 1.00 0.34 C ATOM 1686 C TYR A 106 -0.299 11.144 -1.615 1.00 0.36 C ATOM 1687 O TYR A 106 0.822 11.594 -1.866 1.00 0.40 O ATOM 1688 CB TYR A 106 -0.974 10.439 -3.908 1.00 0.37 C ATOM 1689 CG TYR A 106 -0.962 8.939 -3.723 1.00 0.38 C ATOM 1690 CD1 TYR A 106 0.114 8.299 -3.121 1.00 0.41 C ATOM 1691 CD2 TYR A 106 -2.034 8.165 -4.134 1.00 0.39 C ATOM 1692 CE1 TYR A 106 0.120 6.928 -2.937 1.00 0.45 C ATOM 1693 CE2 TYR A 106 -2.037 6.794 -3.958 1.00 0.43 C ATOM 1694 CZ TYR A 106 -0.961 6.180 -3.361 1.00 0.46 C ATOM 1695 OH TYR A 106 -0.966 4.815 -3.187 1.00 0.52 O ATOM 0 H TYR A 106 -0.996 13.238 -2.801 1.00 0.35 H new ATOM 0 HA TYR A 106 -2.296 10.696 -2.256 1.00 0.34 H new ATOM 0 HB2 TYR A 106 -1.648 10.694 -4.726 1.00 0.37 H new ATOM 0 HB3 TYR A 106 0.022 10.772 -4.200 1.00 0.37 H new ATOM 0 HD1 TYR A 106 0.961 8.882 -2.791 1.00 0.41 H new ATOM 0 HD2 TYR A 106 -2.884 8.641 -4.601 1.00 0.39 H new ATOM 0 HE1 TYR A 106 0.964 6.446 -2.465 1.00 0.45 H new ATOM 0 HE2 TYR A 106 -2.881 6.207 -4.288 1.00 0.43 H new ATOM 0 HH TYR A 106 -1.801 4.443 -3.540 1.00 0.52 H new ATOM 1705 N ASP A 107 -0.625 10.610 -0.456 1.00 0.34 N ATOM 1706 CA ASP A 107 0.323 10.493 0.634 1.00 0.36 C ATOM 1707 C ASP A 107 0.088 9.201 1.396 1.00 0.38 C ATOM 1708 O ASP A 107 -1.048 8.818 1.659 1.00 0.46 O ATOM 1709 CB ASP A 107 0.237 11.701 1.577 1.00 0.48 C ATOM 1710 CG ASP A 107 -1.178 12.225 1.756 1.00 1.27 C ATOM 1711 OD1 ASP A 107 -2.000 11.551 2.409 1.00 2.25 O ATOM 1712 OD2 ASP A 107 -1.470 13.327 1.249 1.00 1.31 O ATOM 0 H ASP A 107 -1.553 10.245 -0.243 1.00 0.34 H new ATOM 0 HA ASP A 107 1.327 10.474 0.211 1.00 0.36 H new ATOM 0 HB2 ASP A 107 0.640 11.422 2.551 1.00 0.48 H new ATOM 0 HB3 ASP A 107 0.867 12.501 1.189 1.00 0.48 H new ATOM 1717 N VAL A 108 1.166 8.514 1.707 1.00 0.38 N ATOM 1718 CA VAL A 108 1.092 7.273 2.460 1.00 0.44 C ATOM 1719 C VAL A 108 2.148 7.249 3.555 1.00 0.47 C ATOM 1720 O VAL A 108 3.292 7.620 3.325 1.00 0.58 O ATOM 1721 CB VAL A 108 1.250 6.031 1.533 1.00 0.48 C ATOM 1722 CG1 VAL A 108 1.796 6.429 0.175 1.00 0.68 C ATOM 1723 CG2 VAL A 108 2.145 4.966 2.153 1.00 0.70 C ATOM 0 H VAL A 108 2.112 8.794 1.449 1.00 0.38 H new ATOM 0 HA VAL A 108 0.104 7.225 2.919 1.00 0.44 H new ATOM 0 HB VAL A 108 0.254 5.607 1.407 1.00 0.48 H new ATOM 0 HG11 VAL A 108 1.896 5.542 -0.451 1.00 0.68 H new ATOM 0 HG12 VAL A 108 1.113 7.133 -0.300 1.00 0.68 H new ATOM 0 HG13 VAL A 108 2.772 6.898 0.299 1.00 0.68 H new ATOM 0 HG21 VAL A 108 2.227 4.118 1.473 1.00 0.70 H new ATOM 0 HG22 VAL A 108 3.136 5.383 2.334 1.00 0.70 H new ATOM 0 HG23 VAL A 108 1.714 4.633 3.097 1.00 0.70 H new ATOM 1733 N GLN A 109 1.753 6.835 4.748 1.00 0.44 N ATOM 1734 CA GLN A 109 2.698 6.640 5.837 1.00 0.50 C ATOM 1735 C GLN A 109 2.595 5.224 6.364 1.00 0.30 C ATOM 1736 O GLN A 109 1.513 4.630 6.379 1.00 0.29 O ATOM 1737 CB GLN A 109 2.477 7.629 6.983 1.00 0.85 C ATOM 1738 CG GLN A 109 2.967 9.035 6.695 1.00 0.92 C ATOM 1739 CD GLN A 109 3.412 9.760 7.950 1.00 2.08 C ATOM 1740 OE1 GLN A 109 3.768 9.138 8.940 1.00 2.86 O ATOM 1741 NE2 GLN A 109 3.441 11.081 7.900 1.00 2.81 N ATOM 0 H GLN A 109 0.784 6.627 4.988 1.00 0.44 H new ATOM 0 HA GLN A 109 3.695 6.819 5.434 1.00 0.50 H new ATOM 0 HB2 GLN A 109 1.413 7.668 7.214 1.00 0.85 H new ATOM 0 HB3 GLN A 109 2.983 7.255 7.873 1.00 0.85 H new ATOM 0 HG2 GLN A 109 3.798 8.990 5.991 1.00 0.92 H new ATOM 0 HG3 GLN A 109 2.171 9.603 6.213 1.00 0.92 H new ATOM 0 HE21 GLN A 109 3.136 11.566 7.056 1.00 2.81 H new ATOM 0 HE22 GLN A 109 3.768 11.615 8.705 1.00 2.81 H new ATOM 1750 N VAL A 110 3.717 4.684 6.787 1.00 0.33 N ATOM 1751 CA VAL A 110 3.753 3.341 7.315 1.00 0.27 C ATOM 1752 C VAL A 110 3.955 3.392 8.829 1.00 0.30 C ATOM 1753 O VAL A 110 4.972 3.885 9.320 1.00 0.41 O ATOM 1754 CB VAL A 110 4.852 2.497 6.618 1.00 0.37 C ATOM 1755 CG1 VAL A 110 6.215 3.152 6.738 1.00 0.76 C ATOM 1756 CG2 VAL A 110 4.893 1.081 7.169 1.00 0.77 C ATOM 0 H VAL A 110 4.620 5.158 6.775 1.00 0.33 H new ATOM 0 HA VAL A 110 2.801 2.851 7.110 1.00 0.27 H new ATOM 0 HB VAL A 110 4.594 2.444 5.560 1.00 0.37 H new ATOM 0 HG11 VAL A 110 6.961 2.534 6.239 1.00 0.76 H new ATOM 0 HG12 VAL A 110 6.188 4.136 6.271 1.00 0.76 H new ATOM 0 HG13 VAL A 110 6.477 3.257 7.791 1.00 0.76 H new ATOM 0 HG21 VAL A 110 5.673 0.515 6.660 1.00 0.77 H new ATOM 0 HG22 VAL A 110 5.106 1.112 8.238 1.00 0.77 H new ATOM 0 HG23 VAL A 110 3.929 0.599 7.005 1.00 0.77 H new ATOM 1766 N ALA A 111 2.959 2.908 9.561 1.00 0.29 N ATOM 1767 CA ALA A 111 2.953 3.000 11.017 1.00 0.36 C ATOM 1768 C ALA A 111 4.049 2.140 11.629 1.00 0.37 C ATOM 1769 O ALA A 111 4.609 2.479 12.672 1.00 0.44 O ATOM 1770 CB ALA A 111 1.590 2.593 11.563 1.00 0.42 C ATOM 0 H ALA A 111 2.140 2.445 9.168 1.00 0.29 H new ATOM 0 HA ALA A 111 3.150 4.036 11.292 1.00 0.36 H new ATOM 0 HB1 ALA A 111 1.597 2.666 12.651 1.00 0.42 H new ATOM 0 HB2 ALA A 111 0.824 3.256 11.160 1.00 0.42 H new ATOM 0 HB3 ALA A 111 1.372 1.566 11.269 1.00 0.42 H new ATOM 1776 N ASP A 112 4.341 1.026 10.973 1.00 0.35 N ATOM 1777 CA ASP A 112 5.399 0.123 11.409 1.00 0.46 C ATOM 1778 C ASP A 112 6.014 -0.545 10.201 1.00 0.37 C ATOM 1779 O ASP A 112 5.342 -1.289 9.494 1.00 0.35 O ATOM 1780 CB ASP A 112 4.873 -0.948 12.374 1.00 0.67 C ATOM 1781 CG ASP A 112 4.673 -0.432 13.785 1.00 1.36 C ATOM 1782 OD1 ASP A 112 5.678 -0.200 14.492 1.00 2.20 O ATOM 1783 OD2 ASP A 112 3.509 -0.248 14.197 1.00 1.88 O ATOM 0 H ASP A 112 3.855 0.723 10.129 1.00 0.35 H new ATOM 0 HA ASP A 112 6.147 0.712 11.940 1.00 0.46 H new ATOM 0 HB2 ASP A 112 3.926 -1.334 11.997 1.00 0.67 H new ATOM 0 HB3 ASP A 112 5.572 -1.784 12.395 1.00 0.67 H new ATOM 1788 N THR A 113 7.273 -0.251 9.944 1.00 0.37 N ATOM 1789 CA THR A 113 7.974 -0.819 8.807 1.00 0.36 C ATOM 1790 C THR A 113 9.351 -1.322 9.225 1.00 0.44 C ATOM 1791 O THR A 113 10.077 -0.649 9.969 1.00 0.55 O ATOM 1792 CB THR A 113 8.129 0.217 7.674 1.00 0.37 C ATOM 1793 OG1 THR A 113 8.814 -0.369 6.561 1.00 0.44 O ATOM 1794 CG2 THR A 113 8.898 1.429 8.180 1.00 0.51 C ATOM 0 H THR A 113 7.836 0.383 10.511 1.00 0.37 H new ATOM 0 HA THR A 113 7.380 -1.655 8.438 1.00 0.36 H new ATOM 0 HB THR A 113 7.139 0.536 7.349 1.00 0.37 H new ATOM 0 HG1 THR A 113 8.858 0.278 5.826 1.00 0.44 H new ATOM 0 HG21 THR A 113 9.003 2.156 7.374 1.00 0.51 H new ATOM 0 HG22 THR A 113 8.356 1.883 9.010 1.00 0.51 H new ATOM 0 HG23 THR A 113 9.886 1.118 8.519 1.00 0.51 H new ATOM 1802 N ASP A 114 9.690 -2.523 8.797 1.00 0.43 N ATOM 1803 CA ASP A 114 11.015 -3.059 9.040 1.00 0.57 C ATOM 1804 C ASP A 114 11.472 -3.874 7.833 1.00 0.64 C ATOM 1805 O ASP A 114 10.650 -4.410 7.090 1.00 0.61 O ATOM 1806 CB ASP A 114 11.016 -3.909 10.307 1.00 0.60 C ATOM 1807 CG ASP A 114 12.377 -3.955 10.966 1.00 1.24 C ATOM 1808 OD1 ASP A 114 13.328 -4.482 10.345 1.00 2.10 O ATOM 1809 OD2 ASP A 114 12.510 -3.445 12.093 1.00 1.17 O ATOM 0 H ASP A 114 9.068 -3.145 8.280 1.00 0.43 H new ATOM 0 HA ASP A 114 11.715 -2.236 9.186 1.00 0.57 H new ATOM 0 HB2 ASP A 114 10.287 -3.508 11.011 1.00 0.60 H new ATOM 0 HB3 ASP A 114 10.699 -4.923 10.062 1.00 0.60 H new ATOM 1814 N TYR A 115 12.783 -3.947 7.644 1.00 0.84 N ATOM 1815 CA TYR A 115 13.382 -4.610 6.484 1.00 0.99 C ATOM 1816 C TYR A 115 13.323 -6.131 6.610 1.00 0.90 C ATOM 1817 O TYR A 115 13.624 -6.857 5.661 1.00 1.07 O ATOM 1818 CB TYR A 115 14.827 -4.136 6.315 1.00 1.25 C ATOM 1819 CG TYR A 115 15.454 -3.713 7.622 1.00 1.46 C ATOM 1820 CD1 TYR A 115 15.957 -4.658 8.508 1.00 1.67 C ATOM 1821 CD2 TYR A 115 15.578 -2.373 7.952 1.00 1.77 C ATOM 1822 CE1 TYR A 115 16.558 -4.277 9.689 1.00 2.05 C ATOM 1823 CE2 TYR A 115 16.182 -1.985 9.127 1.00 2.16 C ATOM 1824 CZ TYR A 115 16.546 -2.935 10.051 1.00 2.26 C ATOM 1825 OH TYR A 115 17.278 -2.556 11.165 1.00 2.75 O ATOM 0 H TYR A 115 13.465 -3.549 8.289 1.00 0.84 H new ATOM 0 HA TYR A 115 12.807 -4.340 5.599 1.00 0.99 H new ATOM 0 HB2 TYR A 115 15.420 -4.938 5.874 1.00 1.25 H new ATOM 0 HB3 TYR A 115 14.852 -3.300 5.616 1.00 1.25 H new ATOM 0 HD1 TYR A 115 15.876 -5.708 8.268 1.00 1.67 H new ATOM 0 HD2 TYR A 115 15.195 -1.622 7.277 1.00 1.77 H new ATOM 0 HE1 TYR A 115 17.032 -5.011 10.324 1.00 2.05 H new ATOM 0 HE2 TYR A 115 16.369 -0.939 9.322 1.00 2.16 H new ATOM 0 HH TYR A 115 17.184 -1.591 11.305 1.00 2.75 H new ATOM 1835 N ASP A 116 12.972 -6.603 7.797 1.00 0.77 N ATOM 1836 CA ASP A 116 12.869 -8.034 8.067 1.00 0.74 C ATOM 1837 C ASP A 116 11.466 -8.352 8.567 1.00 0.64 C ATOM 1838 O ASP A 116 10.797 -9.271 8.089 1.00 0.66 O ATOM 1839 CB ASP A 116 13.912 -8.433 9.117 1.00 0.82 C ATOM 1840 CG ASP A 116 13.958 -9.924 9.383 1.00 1.03 C ATOM 1841 OD1 ASP A 116 13.158 -10.403 10.219 1.00 1.40 O ATOM 1842 OD2 ASP A 116 14.763 -10.629 8.744 1.00 1.46 O ATOM 0 H ASP A 116 12.751 -6.011 8.598 1.00 0.77 H new ATOM 0 HA ASP A 116 13.057 -8.598 7.153 1.00 0.74 H new ATOM 0 HB2 ASP A 116 14.896 -8.100 8.786 1.00 0.82 H new ATOM 0 HB3 ASP A 116 13.696 -7.912 10.049 1.00 0.82 H new ATOM 1847 N GLN A 117 11.048 -7.555 9.536 1.00 0.59 N ATOM 1848 CA GLN A 117 9.699 -7.576 10.085 1.00 0.50 C ATOM 1849 C GLN A 117 8.681 -7.087 9.047 1.00 0.37 C ATOM 1850 O GLN A 117 9.043 -6.718 7.931 1.00 0.39 O ATOM 1851 CB GLN A 117 9.648 -6.724 11.362 1.00 0.56 C ATOM 1852 CG GLN A 117 8.432 -6.977 12.239 1.00 1.22 C ATOM 1853 CD GLN A 117 8.324 -8.420 12.693 1.00 1.68 C ATOM 1854 OE1 GLN A 117 7.226 -8.936 12.893 1.00 2.16 O ATOM 1855 NE2 GLN A 117 9.460 -9.080 12.859 1.00 2.51 N ATOM 0 H GLN A 117 11.650 -6.858 9.974 1.00 0.59 H new ATOM 0 HA GLN A 117 9.434 -8.602 10.342 1.00 0.50 H new ATOM 0 HB2 GLN A 117 10.548 -6.914 11.947 1.00 0.56 H new ATOM 0 HB3 GLN A 117 9.666 -5.671 11.082 1.00 0.56 H new ATOM 0 HG2 GLN A 117 8.480 -6.328 13.114 1.00 1.22 H new ATOM 0 HG3 GLN A 117 7.531 -6.705 11.689 1.00 1.22 H new ATOM 0 HE21 GLN A 117 10.350 -8.615 12.682 1.00 2.51 H new ATOM 0 HE22 GLN A 117 9.445 -10.053 13.164 1.00 2.51 H new ATOM 1864 N PHE A 118 7.414 -7.080 9.426 1.00 0.30 N ATOM 1865 CA PHE A 118 6.323 -6.830 8.502 1.00 0.25 C ATOM 1866 C PHE A 118 5.927 -5.356 8.610 1.00 0.26 C ATOM 1867 O PHE A 118 6.130 -4.731 9.654 1.00 0.40 O ATOM 1868 CB PHE A 118 5.132 -7.720 8.904 1.00 0.31 C ATOM 1869 CG PHE A 118 4.269 -7.117 9.981 1.00 0.30 C ATOM 1870 CD1 PHE A 118 4.720 -7.032 11.290 1.00 0.36 C ATOM 1871 CD2 PHE A 118 3.017 -6.609 9.674 1.00 0.32 C ATOM 1872 CE1 PHE A 118 3.936 -6.459 12.270 1.00 0.41 C ATOM 1873 CE2 PHE A 118 2.231 -6.028 10.651 1.00 0.38 C ATOM 1874 CZ PHE A 118 2.691 -5.955 11.949 1.00 0.42 C ATOM 0 H PHE A 118 7.113 -7.248 10.386 1.00 0.30 H new ATOM 0 HA PHE A 118 6.620 -7.056 7.478 1.00 0.25 H new ATOM 0 HB2 PHE A 118 4.519 -7.913 8.024 1.00 0.31 H new ATOM 0 HB3 PHE A 118 5.508 -8.684 9.248 1.00 0.31 H new ATOM 0 HD1 PHE A 118 5.696 -7.419 11.545 1.00 0.36 H new ATOM 0 HD2 PHE A 118 2.651 -6.668 8.660 1.00 0.32 H new ATOM 0 HE1 PHE A 118 4.295 -6.405 13.287 1.00 0.41 H new ATOM 0 HE2 PHE A 118 1.258 -5.632 10.398 1.00 0.38 H new ATOM 0 HZ PHE A 118 2.077 -5.504 12.715 1.00 0.42 H new ATOM 1884 N ALA A 119 5.397 -4.794 7.533 1.00 0.23 N ATOM 1885 CA ALA A 119 5.074 -3.375 7.504 1.00 0.23 C ATOM 1886 C ALA A 119 3.575 -3.142 7.360 1.00 0.21 C ATOM 1887 O ALA A 119 2.906 -3.773 6.542 1.00 0.28 O ATOM 1888 CB ALA A 119 5.835 -2.668 6.389 1.00 0.25 C ATOM 0 H ALA A 119 5.182 -5.296 6.672 1.00 0.23 H new ATOM 0 HA ALA A 119 5.385 -2.951 8.459 1.00 0.23 H new ATOM 0 HB1 ALA A 119 5.577 -1.609 6.387 1.00 0.25 H new ATOM 0 HB2 ALA A 119 6.907 -2.780 6.552 1.00 0.25 H new ATOM 0 HB3 ALA A 119 5.566 -3.108 5.429 1.00 0.25 H new ATOM 1894 N MET A 120 3.063 -2.225 8.163 1.00 0.19 N ATOM 1895 CA MET A 120 1.646 -1.897 8.168 1.00 0.21 C ATOM 1896 C MET A 120 1.469 -0.456 7.697 1.00 0.22 C ATOM 1897 O MET A 120 1.969 0.468 8.341 1.00 0.25 O ATOM 1898 CB MET A 120 1.105 -2.062 9.585 1.00 0.27 C ATOM 1899 CG MET A 120 -0.301 -2.628 9.650 1.00 0.48 C ATOM 1900 SD MET A 120 -0.900 -2.760 11.346 1.00 0.63 S ATOM 1901 CE MET A 120 -0.598 -1.095 11.930 1.00 1.47 C ATOM 0 H MET A 120 3.617 -1.687 8.830 1.00 0.19 H new ATOM 0 HA MET A 120 1.099 -2.560 7.498 1.00 0.21 H new ATOM 0 HB2 MET A 120 1.774 -2.716 10.144 1.00 0.27 H new ATOM 0 HB3 MET A 120 1.118 -1.092 10.082 1.00 0.27 H new ATOM 0 HG2 MET A 120 -0.975 -1.991 9.076 1.00 0.48 H new ATOM 0 HG3 MET A 120 -0.317 -3.612 9.182 1.00 0.48 H new ATOM 0 HE1 MET A 120 -1.289 -0.863 12.740 1.00 1.47 H new ATOM 0 HE2 MET A 120 0.427 -1.017 12.294 1.00 1.47 H new ATOM 0 HE3 MET A 120 -0.747 -0.390 11.112 1.00 1.47 H new ATOM 1911 N VAL A 121 0.768 -0.249 6.586 1.00 0.25 N ATOM 1912 CA VAL A 121 0.813 1.049 5.919 1.00 0.26 C ATOM 1913 C VAL A 121 -0.576 1.623 5.653 1.00 0.29 C ATOM 1914 O VAL A 121 -1.539 0.887 5.435 1.00 0.39 O ATOM 1915 CB VAL A 121 1.552 0.973 4.563 1.00 0.28 C ATOM 1916 CG1 VAL A 121 2.220 2.299 4.259 1.00 0.34 C ATOM 1917 CG2 VAL A 121 2.565 -0.160 4.528 1.00 0.28 C ATOM 0 H VAL A 121 0.174 -0.946 6.136 1.00 0.25 H new ATOM 0 HA VAL A 121 1.350 1.701 6.608 1.00 0.26 H new ATOM 0 HB VAL A 121 0.810 0.762 3.793 1.00 0.28 H new ATOM 0 HG11 VAL A 121 2.738 2.235 3.302 1.00 0.34 H new ATOM 0 HG12 VAL A 121 1.465 3.084 4.211 1.00 0.34 H new ATOM 0 HG13 VAL A 121 2.938 2.533 5.045 1.00 0.34 H new ATOM 0 HG21 VAL A 121 3.060 -0.176 3.557 1.00 0.28 H new ATOM 0 HG22 VAL A 121 3.308 -0.009 5.311 1.00 0.28 H new ATOM 0 HG23 VAL A 121 2.055 -1.109 4.690 1.00 0.28 H new ATOM 1927 N PHE A 122 -0.649 2.948 5.658 1.00 0.25 N ATOM 1928 CA PHE A 122 -1.845 3.682 5.268 1.00 0.27 C ATOM 1929 C PHE A 122 -1.541 4.473 3.992 1.00 0.27 C ATOM 1930 O PHE A 122 -0.647 5.316 3.979 1.00 0.26 O ATOM 1931 CB PHE A 122 -2.285 4.606 6.429 1.00 0.29 C ATOM 1932 CG PHE A 122 -3.254 5.720 6.069 1.00 0.37 C ATOM 1933 CD1 PHE A 122 -2.842 6.795 5.289 1.00 0.87 C ATOM 1934 CD2 PHE A 122 -4.569 5.704 6.517 1.00 0.33 C ATOM 1935 CE1 PHE A 122 -3.709 7.814 4.962 1.00 0.99 C ATOM 1936 CE2 PHE A 122 -5.439 6.726 6.190 1.00 0.38 C ATOM 1937 CZ PHE A 122 -5.009 7.779 5.413 1.00 0.63 C ATOM 0 H PHE A 122 0.128 3.548 5.935 1.00 0.25 H new ATOM 0 HA PHE A 122 -2.669 2.999 5.061 1.00 0.27 H new ATOM 0 HB2 PHE A 122 -2.743 3.990 7.203 1.00 0.29 H new ATOM 0 HB3 PHE A 122 -1.393 5.055 6.866 1.00 0.29 H new ATOM 0 HD1 PHE A 122 -1.823 6.832 4.933 1.00 0.87 H new ATOM 0 HD2 PHE A 122 -4.915 4.883 7.128 1.00 0.33 H new ATOM 0 HE1 PHE A 122 -3.370 8.639 4.353 1.00 0.99 H new ATOM 0 HE2 PHE A 122 -6.459 6.699 6.544 1.00 0.38 H new ATOM 0 HZ PHE A 122 -5.691 8.576 5.158 1.00 0.63 H new ATOM 1947 N PHE A 123 -2.260 4.164 2.922 1.00 0.34 N ATOM 1948 CA PHE A 123 -2.118 4.873 1.647 1.00 0.34 C ATOM 1949 C PHE A 123 -3.342 5.744 1.402 1.00 0.35 C ATOM 1950 O PHE A 123 -4.469 5.260 1.489 1.00 0.38 O ATOM 1951 CB PHE A 123 -1.982 3.885 0.479 1.00 0.37 C ATOM 1952 CG PHE A 123 -0.656 3.183 0.379 1.00 0.37 C ATOM 1953 CD1 PHE A 123 -0.223 2.326 1.374 1.00 0.32 C ATOM 1954 CD2 PHE A 123 0.145 3.361 -0.738 1.00 0.45 C ATOM 1955 CE1 PHE A 123 0.983 1.664 1.260 1.00 0.33 C ATOM 1956 CE2 PHE A 123 1.356 2.706 -0.855 1.00 0.47 C ATOM 1957 CZ PHE A 123 1.775 1.854 0.146 1.00 0.41 C ATOM 0 H PHE A 123 -2.957 3.419 2.907 1.00 0.34 H new ATOM 0 HA PHE A 123 -1.219 5.487 1.704 1.00 0.34 H new ATOM 0 HB2 PHE A 123 -2.766 3.133 0.568 1.00 0.37 H new ATOM 0 HB3 PHE A 123 -2.160 4.423 -0.452 1.00 0.37 H new ATOM 0 HD1 PHE A 123 -0.835 2.173 2.250 1.00 0.32 H new ATOM 0 HD2 PHE A 123 -0.182 4.021 -1.528 1.00 0.45 H new ATOM 0 HE1 PHE A 123 1.307 0.996 2.044 1.00 0.33 H new ATOM 0 HE2 PHE A 123 1.973 2.861 -1.728 1.00 0.47 H new ATOM 0 HZ PHE A 123 2.719 1.338 0.058 1.00 0.41 H new ATOM 1967 N GLN A 124 -3.132 7.013 1.098 1.00 0.36 N ATOM 1968 CA GLN A 124 -4.242 7.908 0.795 1.00 0.39 C ATOM 1969 C GLN A 124 -4.158 8.399 -0.652 1.00 0.34 C ATOM 1970 O GLN A 124 -3.147 8.963 -1.075 1.00 0.33 O ATOM 1971 CB GLN A 124 -4.267 9.086 1.780 1.00 0.45 C ATOM 1972 CG GLN A 124 -5.513 9.956 1.675 1.00 0.67 C ATOM 1973 CD GLN A 124 -5.379 11.072 0.653 1.00 0.82 C ATOM 1974 OE1 GLN A 124 -4.187 11.636 0.539 1.00 1.54 O flip ATOM 1975 NE2 GLN A 124 -6.353 11.446 -0.004 1.00 1.57 N flip ATOM 0 H GLN A 124 -2.210 7.448 1.054 1.00 0.36 H new ATOM 0 HA GLN A 124 -5.175 7.355 0.907 1.00 0.39 H new ATOM 0 HB2 GLN A 124 -4.192 8.698 2.796 1.00 0.45 H new ATOM 0 HB3 GLN A 124 -3.388 9.707 1.610 1.00 0.45 H new ATOM 0 HG2 GLN A 124 -6.365 9.329 1.410 1.00 0.67 H new ATOM 0 HG3 GLN A 124 -5.729 10.390 2.651 1.00 0.67 H new ATOM 0 HE21 GLN A 124 -7.255 10.984 0.113 1.00 1.57 H new ATOM 0 HE22 GLN A 124 -6.257 12.217 -0.665 1.00 1.57 H new ATOM 1984 N LYS A 125 -5.227 8.167 -1.404 1.00 0.37 N ATOM 1985 CA LYS A 125 -5.296 8.546 -2.808 1.00 0.38 C ATOM 1986 C LYS A 125 -6.548 9.372 -3.075 1.00 0.35 C ATOM 1987 O LYS A 125 -7.664 8.883 -2.932 1.00 0.41 O ATOM 1988 CB LYS A 125 -5.321 7.289 -3.682 1.00 0.53 C ATOM 1989 CG LYS A 125 -5.503 7.564 -5.167 1.00 0.98 C ATOM 1990 CD LYS A 125 -5.686 6.271 -5.945 1.00 1.06 C ATOM 1991 CE LYS A 125 -5.947 6.537 -7.418 1.00 1.36 C ATOM 1992 NZ LYS A 125 -6.183 5.280 -8.177 1.00 1.55 N ATOM 0 H LYS A 125 -6.070 7.711 -1.057 1.00 0.37 H new ATOM 0 HA LYS A 125 -4.418 9.145 -3.050 1.00 0.38 H new ATOM 0 HB2 LYS A 125 -4.390 6.741 -3.537 1.00 0.53 H new ATOM 0 HB3 LYS A 125 -6.129 6.640 -3.343 1.00 0.53 H new ATOM 0 HG2 LYS A 125 -6.369 8.208 -5.317 1.00 0.98 H new ATOM 0 HG3 LYS A 125 -4.636 8.102 -5.549 1.00 0.98 H new ATOM 0 HD2 LYS A 125 -4.795 5.652 -5.839 1.00 1.06 H new ATOM 0 HD3 LYS A 125 -6.518 5.707 -5.524 1.00 1.06 H new ATOM 0 HE2 LYS A 125 -6.813 7.191 -7.521 1.00 1.36 H new ATOM 0 HE3 LYS A 125 -5.096 7.066 -7.847 1.00 1.36 H new ATOM 0 HZ1 LYS A 125 -6.357 5.506 -9.177 1.00 1.55 H new ATOM 0 HZ2 LYS A 125 -5.347 4.666 -8.101 1.00 1.55 H new ATOM 0 HZ3 LYS A 125 -7.011 4.788 -7.784 1.00 1.55 H new ATOM 2006 N THR A 126 -6.372 10.618 -3.462 1.00 0.31 N ATOM 2007 CA THR A 126 -7.505 11.456 -3.803 1.00 0.31 C ATOM 2008 C THR A 126 -7.627 11.608 -5.316 1.00 0.34 C ATOM 2009 O THR A 126 -6.632 11.823 -6.003 1.00 0.39 O ATOM 2010 CB THR A 126 -7.368 12.850 -3.177 1.00 0.35 C ATOM 2011 OG1 THR A 126 -6.219 12.891 -2.322 1.00 0.42 O ATOM 2012 CG2 THR A 126 -8.607 13.219 -2.381 1.00 0.47 C ATOM 0 H THR A 126 -5.462 11.072 -3.548 1.00 0.31 H new ATOM 0 HA THR A 126 -8.398 10.970 -3.409 1.00 0.31 H new ATOM 0 HB THR A 126 -7.251 13.572 -3.985 1.00 0.35 H new ATOM 0 HG1 THR A 126 -5.416 12.683 -2.843 1.00 0.42 H new ATOM 0 HG21 THR A 126 -8.480 14.212 -1.950 1.00 0.47 H new ATOM 0 HG22 THR A 126 -9.476 13.218 -3.039 1.00 0.47 H new ATOM 0 HG23 THR A 126 -8.756 12.493 -1.582 1.00 0.47 H new ATOM 2020 N SER A 127 -8.839 11.480 -5.833 1.00 0.37 N ATOM 2021 CA SER A 127 -9.110 11.710 -7.248 1.00 0.45 C ATOM 2022 C SER A 127 -10.583 12.049 -7.436 1.00 0.51 C ATOM 2023 O SER A 127 -11.439 11.402 -6.843 1.00 0.52 O ATOM 2024 CB SER A 127 -8.763 10.465 -8.077 1.00 0.54 C ATOM 2025 OG SER A 127 -7.374 10.178 -8.030 1.00 0.87 O ATOM 0 H SER A 127 -9.660 11.215 -5.289 1.00 0.37 H new ATOM 0 HA SER A 127 -8.492 12.540 -7.589 1.00 0.45 H new ATOM 0 HB2 SER A 127 -9.325 9.609 -7.703 1.00 0.54 H new ATOM 0 HB3 SER A 127 -9.069 10.619 -9.112 1.00 0.54 H new ATOM 0 HG SER A 127 -6.947 10.737 -7.347 1.00 0.87 H new ATOM 2031 N GLU A 128 -10.871 13.075 -8.236 1.00 0.63 N ATOM 2032 CA GLU A 128 -12.254 13.443 -8.561 1.00 0.74 C ATOM 2033 C GLU A 128 -12.988 13.939 -7.312 1.00 0.66 C ATOM 2034 O GLU A 128 -14.199 13.764 -7.174 1.00 0.71 O ATOM 2035 CB GLU A 128 -12.985 12.232 -9.168 1.00 0.89 C ATOM 2036 CG GLU A 128 -14.305 12.562 -9.845 1.00 1.26 C ATOM 2037 CD GLU A 128 -14.120 13.234 -11.185 1.00 1.59 C ATOM 2038 OE1 GLU A 128 -13.970 12.524 -12.202 1.00 2.13 O ATOM 2039 OE2 GLU A 128 -14.114 14.482 -11.223 1.00 1.98 O ATOM 0 H GLU A 128 -10.166 13.669 -8.673 1.00 0.63 H new ATOM 0 HA GLU A 128 -12.241 14.253 -9.290 1.00 0.74 H new ATOM 0 HB2 GLU A 128 -12.328 11.755 -9.896 1.00 0.89 H new ATOM 0 HB3 GLU A 128 -13.169 11.503 -8.379 1.00 0.89 H new ATOM 0 HG2 GLU A 128 -14.879 11.645 -9.979 1.00 1.26 H new ATOM 0 HG3 GLU A 128 -14.890 13.212 -9.194 1.00 1.26 H new ATOM 2046 N ASN A 129 -12.231 14.548 -6.396 1.00 0.64 N ATOM 2047 CA ASN A 129 -12.756 15.009 -5.101 1.00 0.70 C ATOM 2048 C ASN A 129 -13.155 13.824 -4.232 1.00 0.59 C ATOM 2049 O ASN A 129 -13.630 13.983 -3.108 1.00 0.71 O ATOM 2050 CB ASN A 129 -13.946 15.966 -5.270 1.00 0.91 C ATOM 2051 CG ASN A 129 -13.563 17.269 -5.943 1.00 1.28 C ATOM 2052 OD1 ASN A 129 -13.123 18.213 -5.286 1.00 1.64 O ATOM 2053 ND2 ASN A 129 -13.744 17.337 -7.253 1.00 2.21 N ATOM 0 H ASN A 129 -11.237 14.737 -6.528 1.00 0.64 H new ATOM 0 HA ASN A 129 -11.956 15.561 -4.607 1.00 0.70 H new ATOM 0 HB2 ASN A 129 -14.721 15.474 -5.857 1.00 0.91 H new ATOM 0 HB3 ASN A 129 -14.375 16.181 -4.291 1.00 0.91 H new ATOM 0 HD21 ASN A 129 -13.516 18.195 -7.755 1.00 2.21 H new ATOM 0 HD22 ASN A 129 -14.111 16.531 -7.760 1.00 2.21 H new ATOM 2060 N LYS A 130 -12.944 12.635 -4.766 1.00 0.45 N ATOM 2061 CA LYS A 130 -13.228 11.408 -4.065 1.00 0.49 C ATOM 2062 C LYS A 130 -11.951 10.892 -3.437 1.00 0.42 C ATOM 2063 O LYS A 130 -10.942 10.706 -4.118 1.00 0.45 O ATOM 2064 CB LYS A 130 -13.788 10.367 -5.034 1.00 0.64 C ATOM 2065 CG LYS A 130 -15.137 10.731 -5.630 1.00 1.02 C ATOM 2066 CD LYS A 130 -16.262 10.518 -4.632 1.00 1.36 C ATOM 2067 CE LYS A 130 -16.376 9.055 -4.231 1.00 2.08 C ATOM 2068 NZ LYS A 130 -16.605 8.167 -5.404 1.00 2.80 N ATOM 0 H LYS A 130 -12.568 12.499 -5.704 1.00 0.45 H new ATOM 0 HA LYS A 130 -13.970 11.596 -3.289 1.00 0.49 H new ATOM 0 HB2 LYS A 130 -13.074 10.220 -5.844 1.00 0.64 H new ATOM 0 HB3 LYS A 130 -13.879 9.414 -4.513 1.00 0.64 H new ATOM 0 HG2 LYS A 130 -15.125 11.773 -5.950 1.00 1.02 H new ATOM 0 HG3 LYS A 130 -15.318 10.127 -6.519 1.00 1.02 H new ATOM 0 HD2 LYS A 130 -16.085 11.127 -3.746 1.00 1.36 H new ATOM 0 HD3 LYS A 130 -17.204 10.853 -5.066 1.00 1.36 H new ATOM 0 HE2 LYS A 130 -15.465 8.749 -3.718 1.00 2.08 H new ATOM 0 HE3 LYS A 130 -17.196 8.937 -3.522 1.00 2.08 H new ATOM 0 HZ1 LYS A 130 -17.129 7.321 -5.102 1.00 2.80 H new ATOM 0 HZ2 LYS A 130 -17.156 8.677 -6.123 1.00 2.80 H new ATOM 0 HZ3 LYS A 130 -15.690 7.882 -5.807 1.00 2.80 H new ATOM 2082 N GLN A 131 -11.982 10.683 -2.141 1.00 0.43 N ATOM 2083 CA GLN A 131 -10.826 10.170 -1.447 1.00 0.44 C ATOM 2084 C GLN A 131 -10.928 8.657 -1.320 1.00 0.48 C ATOM 2085 O GLN A 131 -11.936 8.125 -0.849 1.00 0.59 O ATOM 2086 CB GLN A 131 -10.706 10.797 -0.066 1.00 0.55 C ATOM 2087 CG GLN A 131 -10.519 12.302 -0.111 1.00 0.56 C ATOM 2088 CD GLN A 131 -10.746 12.966 1.230 1.00 0.77 C ATOM 2089 OE1 GLN A 131 -11.865 13.354 1.565 1.00 1.11 O ATOM 2090 NE2 GLN A 131 -9.685 13.109 2.008 1.00 1.57 N ATOM 0 H GLN A 131 -12.793 10.860 -1.548 1.00 0.43 H new ATOM 0 HA GLN A 131 -9.936 10.425 -2.022 1.00 0.44 H new ATOM 0 HB2 GLN A 131 -11.601 10.565 0.511 1.00 0.55 H new ATOM 0 HB3 GLN A 131 -9.863 10.347 0.459 1.00 0.55 H new ATOM 0 HG2 GLN A 131 -9.510 12.527 -0.456 1.00 0.56 H new ATOM 0 HG3 GLN A 131 -11.207 12.727 -0.842 1.00 0.56 H new ATOM 0 HE21 GLN A 131 -8.774 12.774 1.695 1.00 1.57 H new ATOM 0 HE22 GLN A 131 -9.778 13.554 2.921 1.00 1.57 H new ATOM 2099 N TYR A 132 -9.900 7.977 -1.759 1.00 0.45 N ATOM 2100 CA TYR A 132 -9.822 6.533 -1.634 1.00 0.50 C ATOM 2101 C TYR A 132 -8.531 6.176 -0.942 1.00 0.44 C ATOM 2102 O TYR A 132 -7.447 6.500 -1.417 1.00 0.51 O ATOM 2103 CB TYR A 132 -9.856 5.836 -2.989 1.00 0.57 C ATOM 2104 CG TYR A 132 -10.980 6.271 -3.902 1.00 0.68 C ATOM 2105 CD1 TYR A 132 -12.254 5.729 -3.776 1.00 0.87 C ATOM 2106 CD2 TYR A 132 -10.765 7.216 -4.896 1.00 0.68 C ATOM 2107 CE1 TYR A 132 -13.280 6.118 -4.614 1.00 1.01 C ATOM 2108 CE2 TYR A 132 -11.784 7.607 -5.741 1.00 0.81 C ATOM 2109 CZ TYR A 132 -13.041 7.056 -5.596 1.00 0.96 C ATOM 2110 OH TYR A 132 -14.062 7.443 -6.436 1.00 1.12 O ATOM 0 H TYR A 132 -9.092 8.402 -2.213 1.00 0.45 H new ATOM 0 HA TYR A 132 -10.687 6.199 -1.061 1.00 0.50 H new ATOM 0 HB2 TYR A 132 -8.907 6.013 -3.496 1.00 0.57 H new ATOM 0 HB3 TYR A 132 -9.935 4.761 -2.826 1.00 0.57 H new ATOM 0 HD1 TYR A 132 -12.444 4.992 -3.010 1.00 0.87 H new ATOM 0 HD2 TYR A 132 -9.784 7.653 -5.010 1.00 0.68 H new ATOM 0 HE1 TYR A 132 -14.265 5.690 -4.501 1.00 1.01 H new ATOM 0 HE2 TYR A 132 -11.599 8.340 -6.512 1.00 0.81 H new ATOM 0 HH TYR A 132 -13.728 8.111 -7.070 1.00 1.12 H new ATOM 2120 N PHE A 133 -8.642 5.497 0.161 1.00 0.40 N ATOM 2121 CA PHE A 133 -7.474 5.166 0.945 1.00 0.30 C ATOM 2122 C PHE A 133 -7.428 3.676 1.184 1.00 0.25 C ATOM 2123 O PHE A 133 -8.419 2.969 0.985 1.00 0.30 O ATOM 2124 CB PHE A 133 -7.453 5.932 2.275 1.00 0.45 C ATOM 2125 CG PHE A 133 -8.492 5.494 3.262 1.00 0.82 C ATOM 2126 CD1 PHE A 133 -9.838 5.707 3.014 1.00 1.20 C ATOM 2127 CD2 PHE A 133 -8.123 4.857 4.429 1.00 1.31 C ATOM 2128 CE1 PHE A 133 -10.794 5.293 3.918 1.00 1.74 C ATOM 2129 CE2 PHE A 133 -9.072 4.438 5.336 1.00 1.82 C ATOM 2130 CZ PHE A 133 -10.418 4.711 5.098 1.00 1.95 C ATOM 0 H PHE A 133 -9.525 5.159 0.544 1.00 0.40 H new ATOM 0 HA PHE A 133 -6.588 5.466 0.386 1.00 0.30 H new ATOM 0 HB2 PHE A 133 -6.469 5.819 2.729 1.00 0.45 H new ATOM 0 HB3 PHE A 133 -7.590 6.994 2.070 1.00 0.45 H new ATOM 0 HD1 PHE A 133 -10.142 6.202 2.104 1.00 1.20 H new ATOM 0 HD2 PHE A 133 -7.077 4.685 4.634 1.00 1.31 H new ATOM 0 HE1 PHE A 133 -11.842 5.429 3.694 1.00 1.74 H new ATOM 0 HE2 PHE A 133 -8.775 3.902 6.225 1.00 1.82 H new ATOM 0 HZ PHE A 133 -11.161 4.464 5.842 1.00 1.95 H new ATOM 2140 N LYS A 134 -6.278 3.201 1.596 1.00 0.21 N ATOM 2141 CA LYS A 134 -6.094 1.789 1.826 1.00 0.24 C ATOM 2142 C LYS A 134 -5.127 1.565 2.978 1.00 0.17 C ATOM 2143 O LYS A 134 -4.217 2.360 3.206 1.00 0.20 O ATOM 2144 CB LYS A 134 -5.574 1.097 0.553 1.00 0.38 C ATOM 2145 CG LYS A 134 -4.055 1.023 0.457 1.00 0.53 C ATOM 2146 CD LYS A 134 -3.595 0.276 -0.785 1.00 0.76 C ATOM 2147 CE LYS A 134 -2.156 -0.198 -0.635 1.00 0.61 C ATOM 2148 NZ LYS A 134 -1.638 -0.850 -1.874 1.00 1.30 N ATOM 0 H LYS A 134 -5.454 3.773 1.779 1.00 0.21 H new ATOM 0 HA LYS A 134 -7.059 1.353 2.087 1.00 0.24 H new ATOM 0 HB2 LYS A 134 -5.979 0.086 0.512 1.00 0.38 H new ATOM 0 HB3 LYS A 134 -5.956 1.629 -0.318 1.00 0.38 H new ATOM 0 HG2 LYS A 134 -3.644 2.032 0.445 1.00 0.53 H new ATOM 0 HG3 LYS A 134 -3.660 0.528 1.344 1.00 0.53 H new ATOM 0 HD2 LYS A 134 -4.247 -0.580 -0.961 1.00 0.76 H new ATOM 0 HD3 LYS A 134 -3.679 0.926 -1.656 1.00 0.76 H new ATOM 0 HE2 LYS A 134 -1.521 0.651 -0.382 1.00 0.61 H new ATOM 0 HE3 LYS A 134 -2.093 -0.901 0.196 1.00 0.61 H new ATOM 0 HZ1 LYS A 134 -0.645 -1.124 -1.733 1.00 1.30 H new ATOM 0 HZ2 LYS A 134 -2.205 -1.696 -2.084 1.00 1.30 H new ATOM 0 HZ3 LYS A 134 -1.703 -0.184 -2.670 1.00 1.30 H new ATOM 2162 N VAL A 135 -5.342 0.491 3.699 1.00 0.16 N ATOM 2163 CA VAL A 135 -4.412 0.046 4.710 1.00 0.17 C ATOM 2164 C VAL A 135 -3.886 -1.319 4.305 1.00 0.20 C ATOM 2165 O VAL A 135 -4.623 -2.298 4.249 1.00 0.30 O ATOM 2166 CB VAL A 135 -5.063 0.036 6.116 1.00 0.24 C ATOM 2167 CG1 VAL A 135 -4.579 -1.128 6.968 1.00 0.39 C ATOM 2168 CG2 VAL A 135 -4.782 1.358 6.815 1.00 0.78 C ATOM 0 H VAL A 135 -6.168 -0.100 3.602 1.00 0.16 H new ATOM 0 HA VAL A 135 -3.576 0.742 4.779 1.00 0.17 H new ATOM 0 HB VAL A 135 -6.138 -0.092 5.986 1.00 0.24 H new ATOM 0 HG11 VAL A 135 -5.064 -1.091 7.944 1.00 0.39 H new ATOM 0 HG12 VAL A 135 -4.827 -2.068 6.475 1.00 0.39 H new ATOM 0 HG13 VAL A 135 -3.499 -1.060 7.097 1.00 0.39 H new ATOM 0 HG21 VAL A 135 -5.240 1.351 7.804 1.00 0.78 H new ATOM 0 HG22 VAL A 135 -3.705 1.495 6.915 1.00 0.78 H new ATOM 0 HG23 VAL A 135 -5.199 2.176 6.228 1.00 0.78 H new ATOM 2178 N THR A 136 -2.622 -1.365 3.964 1.00 0.20 N ATOM 2179 CA THR A 136 -2.049 -2.548 3.360 1.00 0.22 C ATOM 2180 C THR A 136 -1.036 -3.199 4.292 1.00 0.24 C ATOM 2181 O THR A 136 -0.458 -2.540 5.163 1.00 0.47 O ATOM 2182 CB THR A 136 -1.382 -2.204 2.014 1.00 0.43 C ATOM 2183 OG1 THR A 136 -0.832 -3.376 1.400 1.00 1.41 O ATOM 2184 CG2 THR A 136 -0.298 -1.159 2.196 1.00 0.65 C ATOM 0 H THR A 136 -1.966 -0.595 4.094 1.00 0.20 H new ATOM 0 HA THR A 136 -2.858 -3.255 3.180 1.00 0.22 H new ATOM 0 HB THR A 136 -2.153 -1.796 1.360 1.00 0.43 H new ATOM 0 HG1 THR A 136 0.027 -3.155 0.984 1.00 1.41 H new ATOM 0 HG21 THR A 136 0.157 -0.934 1.231 1.00 0.65 H new ATOM 0 HG22 THR A 136 -0.734 -0.251 2.612 1.00 0.65 H new ATOM 0 HG23 THR A 136 0.464 -1.540 2.876 1.00 0.65 H new ATOM 2192 N LEU A 137 -0.838 -4.491 4.106 1.00 0.18 N ATOM 2193 CA LEU A 137 0.111 -5.248 4.893 1.00 0.21 C ATOM 2194 C LEU A 137 1.225 -5.752 3.984 1.00 0.17 C ATOM 2195 O LEU A 137 0.968 -6.518 3.054 1.00 0.25 O ATOM 2196 CB LEU A 137 -0.605 -6.429 5.557 1.00 0.33 C ATOM 2197 CG LEU A 137 0.052 -6.995 6.818 1.00 0.34 C ATOM 2198 CD1 LEU A 137 1.429 -7.559 6.518 1.00 0.97 C ATOM 2199 CD2 LEU A 137 0.140 -5.922 7.886 1.00 0.68 C ATOM 0 H LEU A 137 -1.332 -5.043 3.405 1.00 0.18 H new ATOM 0 HA LEU A 137 0.541 -4.614 5.669 1.00 0.21 H new ATOM 0 HB2 LEU A 137 -1.619 -6.117 5.809 1.00 0.33 H new ATOM 0 HB3 LEU A 137 -0.691 -7.232 4.826 1.00 0.33 H new ATOM 0 HG LEU A 137 -0.569 -7.812 7.185 1.00 0.34 H new ATOM 0 HD11 LEU A 137 1.868 -7.953 7.434 1.00 0.97 H new ATOM 0 HD12 LEU A 137 1.342 -8.360 5.784 1.00 0.97 H new ATOM 0 HD13 LEU A 137 2.067 -6.770 6.120 1.00 0.97 H new ATOM 0 HD21 LEU A 137 0.609 -6.335 8.779 1.00 0.68 H new ATOM 0 HD22 LEU A 137 0.736 -5.088 7.516 1.00 0.68 H new ATOM 0 HD23 LEU A 137 -0.862 -5.570 8.132 1.00 0.68 H new ATOM 2211 N TYR A 138 2.447 -5.325 4.251 1.00 0.18 N ATOM 2212 CA TYR A 138 3.590 -5.761 3.469 1.00 0.26 C ATOM 2213 C TYR A 138 4.533 -6.607 4.313 1.00 0.20 C ATOM 2214 O TYR A 138 4.714 -6.356 5.501 1.00 0.25 O ATOM 2215 CB TYR A 138 4.353 -4.566 2.890 1.00 0.44 C ATOM 2216 CG TYR A 138 3.576 -3.764 1.872 1.00 0.59 C ATOM 2217 CD1 TYR A 138 2.964 -4.381 0.788 1.00 1.36 C ATOM 2218 CD2 TYR A 138 3.461 -2.389 1.995 1.00 0.54 C ATOM 2219 CE1 TYR A 138 2.256 -3.647 -0.144 1.00 2.04 C ATOM 2220 CE2 TYR A 138 2.758 -1.646 1.068 1.00 1.18 C ATOM 2221 CZ TYR A 138 2.156 -2.279 -0.002 1.00 1.94 C ATOM 2222 OH TYR A 138 1.450 -1.540 -0.931 1.00 2.64 O ATOM 0 H TYR A 138 2.673 -4.676 5.005 1.00 0.18 H new ATOM 0 HA TYR A 138 3.209 -6.365 2.646 1.00 0.26 H new ATOM 0 HB2 TYR A 138 4.646 -3.907 3.707 1.00 0.44 H new ATOM 0 HB3 TYR A 138 5.271 -4.927 2.427 1.00 0.44 H new ATOM 0 HD1 TYR A 138 3.043 -5.452 0.672 1.00 1.36 H new ATOM 0 HD2 TYR A 138 3.929 -1.890 2.830 1.00 0.54 H new ATOM 0 HE1 TYR A 138 1.783 -4.142 -0.979 1.00 2.04 H new ATOM 0 HE2 TYR A 138 2.679 -0.575 1.179 1.00 1.18 H new ATOM 0 HH TYR A 138 1.503 -0.589 -0.701 1.00 2.64 H new ATOM 2232 N GLY A 139 5.114 -7.614 3.690 1.00 0.28 N ATOM 2233 CA GLY A 139 6.109 -8.441 4.343 1.00 0.29 C ATOM 2234 C GLY A 139 7.273 -8.690 3.410 1.00 0.33 C ATOM 2235 O GLY A 139 7.091 -8.648 2.196 1.00 0.45 O ATOM 0 H GLY A 139 4.912 -7.880 2.726 1.00 0.28 H new ATOM 0 HA2 GLY A 139 6.460 -7.952 5.252 1.00 0.29 H new ATOM 0 HA3 GLY A 139 5.664 -9.390 4.643 1.00 0.29 H new ATOM 2239 N ARG A 140 8.457 -8.958 3.937 1.00 0.37 N ATOM 2240 CA ARG A 140 9.625 -9.151 3.075 1.00 0.49 C ATOM 2241 C ARG A 140 9.553 -10.505 2.366 1.00 0.38 C ATOM 2242 O ARG A 140 10.265 -10.753 1.391 1.00 0.51 O ATOM 2243 CB ARG A 140 10.923 -9.065 3.878 1.00 0.78 C ATOM 2244 CG ARG A 140 12.164 -8.966 2.999 1.00 1.61 C ATOM 2245 CD ARG A 140 13.416 -9.372 3.750 1.00 1.91 C ATOM 2246 NE ARG A 140 13.383 -10.782 4.135 1.00 2.46 N ATOM 2247 CZ ARG A 140 13.832 -11.241 5.298 1.00 3.13 C ATOM 2248 NH1 ARG A 140 14.352 -10.405 6.182 1.00 3.38 N ATOM 2249 NH2 ARG A 140 13.761 -12.536 5.569 1.00 3.99 N ATOM 0 H ARG A 140 8.639 -9.047 4.937 1.00 0.37 H new ATOM 0 HA ARG A 140 9.620 -8.354 2.331 1.00 0.49 H new ATOM 0 HB2 ARG A 140 10.880 -8.196 4.535 1.00 0.78 H new ATOM 0 HB3 ARG A 140 11.007 -9.944 4.517 1.00 0.78 H new ATOM 0 HG2 ARG A 140 12.042 -9.604 2.124 1.00 1.61 H new ATOM 0 HG3 ARG A 140 12.272 -7.944 2.636 1.00 1.61 H new ATOM 0 HD2 ARG A 140 14.291 -9.185 3.127 1.00 1.91 H new ATOM 0 HD3 ARG A 140 13.522 -8.754 4.641 1.00 1.91 H new ATOM 0 HE ARG A 140 12.993 -11.452 3.472 1.00 2.46 H new ATOM 0 HH11 ARG A 140 14.408 -9.409 5.970 1.00 3.38 H new ATOM 0 HH12 ARG A 140 14.697 -10.757 7.075 1.00 3.38 H new ATOM 0 HH21 ARG A 140 13.362 -13.179 4.885 1.00 3.99 H new ATOM 0 HH22 ARG A 140 14.105 -12.890 6.462 1.00 3.99 H new ATOM 2263 N THR A 141 8.687 -11.373 2.860 1.00 0.40 N ATOM 2264 CA THR A 141 8.551 -12.712 2.314 1.00 0.58 C ATOM 2265 C THR A 141 7.121 -13.214 2.517 1.00 0.64 C ATOM 2266 O THR A 141 6.280 -12.500 3.067 1.00 1.14 O ATOM 2267 CB THR A 141 9.569 -13.676 2.975 1.00 0.85 C ATOM 2268 OG1 THR A 141 9.512 -14.973 2.366 1.00 1.13 O ATOM 2269 CG2 THR A 141 9.315 -13.799 4.471 1.00 0.94 C ATOM 0 H THR A 141 8.064 -11.173 3.643 1.00 0.40 H new ATOM 0 HA THR A 141 8.762 -12.680 1.245 1.00 0.58 H new ATOM 0 HB THR A 141 10.564 -13.257 2.823 1.00 0.85 H new ATOM 0 HG1 THR A 141 10.163 -15.565 2.796 1.00 1.13 H new ATOM 0 HG21 THR A 141 10.044 -14.481 4.909 1.00 0.94 H new ATOM 0 HG22 THR A 141 9.410 -12.819 4.938 1.00 0.94 H new ATOM 0 HG23 THR A 141 8.310 -14.185 4.639 1.00 0.94 H new ATOM 2277 N LYS A 142 6.856 -14.441 2.083 1.00 0.79 N ATOM 2278 CA LYS A 142 5.515 -15.022 2.155 1.00 0.87 C ATOM 2279 C LYS A 142 5.249 -15.601 3.548 1.00 0.84 C ATOM 2280 O LYS A 142 4.295 -16.350 3.751 1.00 1.09 O ATOM 2281 CB LYS A 142 5.364 -16.138 1.109 1.00 1.02 C ATOM 2282 CG LYS A 142 5.810 -15.761 -0.300 1.00 1.17 C ATOM 2283 CD LYS A 142 4.790 -14.893 -1.020 1.00 0.84 C ATOM 2284 CE LYS A 142 5.269 -14.526 -2.420 1.00 0.85 C ATOM 2285 NZ LYS A 142 5.562 -15.728 -3.248 1.00 1.57 N ATOM 0 H LYS A 142 7.557 -15.059 1.674 1.00 0.79 H new ATOM 0 HA LYS A 142 4.793 -14.230 1.954 1.00 0.87 H new ATOM 0 HB2 LYS A 142 5.939 -17.004 1.437 1.00 1.02 H new ATOM 0 HB3 LYS A 142 4.319 -16.444 1.074 1.00 1.02 H new ATOM 0 HG2 LYS A 142 6.761 -15.231 -0.247 1.00 1.17 H new ATOM 0 HG3 LYS A 142 5.983 -16.669 -0.878 1.00 1.17 H new ATOM 0 HD2 LYS A 142 3.839 -15.422 -1.085 1.00 0.84 H new ATOM 0 HD3 LYS A 142 4.610 -13.985 -0.444 1.00 0.84 H new ATOM 0 HE2 LYS A 142 4.509 -13.922 -2.916 1.00 0.85 H new ATOM 0 HE3 LYS A 142 6.166 -13.911 -2.346 1.00 0.85 H new ATOM 0 HZ1 LYS A 142 5.652 -15.449 -4.246 1.00 1.57 H new ATOM 0 HZ2 LYS A 142 6.451 -16.162 -2.928 1.00 1.57 H new ATOM 0 HZ3 LYS A 142 4.787 -16.415 -3.150 1.00 1.57 H new ATOM 2299 N GLY A 143 6.089 -15.235 4.503 1.00 0.67 N ATOM 2300 CA GLY A 143 6.023 -15.833 5.819 1.00 0.70 C ATOM 2301 C GLY A 143 5.640 -14.846 6.901 1.00 0.62 C ATOM 2302 O GLY A 143 6.429 -14.575 7.807 1.00 0.74 O ATOM 0 H GLY A 143 6.818 -14.531 4.389 1.00 0.67 H new ATOM 0 HA2 GLY A 143 5.299 -16.647 5.806 1.00 0.70 H new ATOM 0 HA3 GLY A 143 6.991 -16.271 6.061 1.00 0.70 H new ATOM 2306 N LEU A 144 4.436 -14.307 6.805 1.00 0.52 N ATOM 2307 CA LEU A 144 3.914 -13.406 7.823 1.00 0.46 C ATOM 2308 C LEU A 144 2.742 -14.056 8.542 1.00 0.48 C ATOM 2309 O LEU A 144 1.839 -14.605 7.908 1.00 0.53 O ATOM 2310 CB LEU A 144 3.484 -12.079 7.201 1.00 0.43 C ATOM 2311 CG LEU A 144 4.619 -11.226 6.628 1.00 0.40 C ATOM 2312 CD1 LEU A 144 4.126 -9.817 6.355 1.00 0.56 C ATOM 2313 CD2 LEU A 144 5.810 -11.192 7.576 1.00 0.56 C ATOM 0 H LEU A 144 3.797 -14.478 6.028 1.00 0.52 H new ATOM 0 HA LEU A 144 4.705 -13.204 8.545 1.00 0.46 H new ATOM 0 HB2 LEU A 144 2.769 -12.285 6.405 1.00 0.43 H new ATOM 0 HB3 LEU A 144 2.959 -11.495 7.957 1.00 0.43 H new ATOM 0 HG LEU A 144 4.945 -11.678 5.691 1.00 0.40 H new ATOM 0 HD11 LEU A 144 4.941 -9.219 5.948 1.00 0.56 H new ATOM 0 HD12 LEU A 144 3.307 -9.851 5.637 1.00 0.56 H new ATOM 0 HD13 LEU A 144 3.775 -9.368 7.284 1.00 0.56 H new ATOM 0 HD21 LEU A 144 6.601 -10.579 7.144 1.00 0.56 H new ATOM 0 HD22 LEU A 144 5.502 -10.767 8.531 1.00 0.56 H new ATOM 0 HD23 LEU A 144 6.180 -12.205 7.732 1.00 0.56 H new ATOM 2325 N SER A 145 2.772 -13.998 9.866 1.00 0.51 N ATOM 2326 CA SER A 145 1.750 -14.614 10.696 1.00 0.56 C ATOM 2327 C SER A 145 0.393 -13.939 10.498 1.00 0.50 C ATOM 2328 O SER A 145 0.316 -12.770 10.121 1.00 0.49 O ATOM 2329 CB SER A 145 2.168 -14.521 12.162 1.00 0.65 C ATOM 2330 OG SER A 145 3.475 -15.037 12.355 1.00 1.43 O ATOM 0 H SER A 145 3.505 -13.523 10.393 1.00 0.51 H new ATOM 0 HA SER A 145 1.650 -15.659 10.403 1.00 0.56 H new ATOM 0 HB2 SER A 145 2.132 -13.482 12.488 1.00 0.65 H new ATOM 0 HB3 SER A 145 1.461 -15.073 12.781 1.00 0.65 H new ATOM 0 HG SER A 145 3.719 -14.964 13.301 1.00 1.43 H new ATOM 2336 N ASP A 146 -0.673 -14.682 10.771 1.00 0.53 N ATOM 2337 CA ASP A 146 -2.031 -14.162 10.628 1.00 0.51 C ATOM 2338 C ASP A 146 -2.273 -13.026 11.616 1.00 0.48 C ATOM 2339 O ASP A 146 -3.100 -12.147 11.376 1.00 0.46 O ATOM 2340 CB ASP A 146 -3.052 -15.285 10.841 1.00 0.62 C ATOM 2341 CG ASP A 146 -4.480 -14.841 10.588 1.00 1.15 C ATOM 2342 OD1 ASP A 146 -4.796 -14.454 9.443 1.00 1.24 O ATOM 2343 OD2 ASP A 146 -5.291 -14.862 11.538 1.00 2.08 O ATOM 0 H ASP A 146 -0.625 -15.649 11.093 1.00 0.53 H new ATOM 0 HA ASP A 146 -2.150 -13.770 9.618 1.00 0.51 H new ATOM 0 HB2 ASP A 146 -2.813 -16.117 10.179 1.00 0.62 H new ATOM 0 HB3 ASP A 146 -2.968 -15.657 11.862 1.00 0.62 H new ATOM 2348 N GLU A 147 -1.520 -13.044 12.715 1.00 0.51 N ATOM 2349 CA GLU A 147 -1.601 -12.009 13.740 1.00 0.53 C ATOM 2350 C GLU A 147 -1.314 -10.633 13.152 1.00 0.45 C ATOM 2351 O GLU A 147 -2.078 -9.694 13.359 1.00 0.46 O ATOM 2352 CB GLU A 147 -0.597 -12.301 14.856 1.00 0.62 C ATOM 2353 CG GLU A 147 -0.611 -11.284 15.983 1.00 0.72 C ATOM 2354 CD GLU A 147 0.581 -11.439 16.902 1.00 1.25 C ATOM 2355 OE1 GLU A 147 0.670 -12.467 17.602 1.00 1.48 O ATOM 2356 OE2 GLU A 147 1.450 -10.540 16.910 1.00 1.99 O ATOM 0 H GLU A 147 -0.839 -13.775 12.918 1.00 0.51 H new ATOM 0 HA GLU A 147 -2.614 -12.012 14.143 1.00 0.53 H new ATOM 0 HB2 GLU A 147 -0.806 -13.288 15.269 1.00 0.62 H new ATOM 0 HB3 GLU A 147 0.405 -12.340 14.428 1.00 0.62 H new ATOM 0 HG2 GLU A 147 -0.617 -10.278 15.563 1.00 0.72 H new ATOM 0 HG3 GLU A 147 -1.530 -11.394 16.559 1.00 0.72 H new ATOM 2363 N LEU A 148 -0.222 -10.524 12.401 1.00 0.41 N ATOM 2364 CA LEU A 148 0.182 -9.240 11.841 1.00 0.37 C ATOM 2365 C LEU A 148 -0.820 -8.777 10.788 1.00 0.31 C ATOM 2366 O LEU A 148 -0.995 -7.580 10.564 1.00 0.29 O ATOM 2367 CB LEU A 148 1.632 -9.277 11.306 1.00 0.37 C ATOM 2368 CG LEU A 148 1.972 -10.327 10.238 1.00 0.35 C ATOM 2369 CD1 LEU A 148 1.498 -9.887 8.864 1.00 0.33 C ATOM 2370 CD2 LEU A 148 3.473 -10.575 10.199 1.00 0.38 C ATOM 0 H LEU A 148 0.394 -11.303 12.168 1.00 0.41 H new ATOM 0 HA LEU A 148 0.177 -8.501 12.642 1.00 0.37 H new ATOM 0 HB2 LEU A 148 1.863 -8.294 10.896 1.00 0.37 H new ATOM 0 HB3 LEU A 148 2.299 -9.433 12.154 1.00 0.37 H new ATOM 0 HG LEU A 148 1.457 -11.249 10.505 1.00 0.35 H new ATOM 0 HD11 LEU A 148 1.753 -10.651 8.129 1.00 0.33 H new ATOM 0 HD12 LEU A 148 0.417 -9.745 8.880 1.00 0.33 H new ATOM 0 HD13 LEU A 148 1.983 -8.949 8.595 1.00 0.33 H new ATOM 0 HD21 LEU A 148 3.699 -11.321 9.437 1.00 0.38 H new ATOM 0 HD22 LEU A 148 3.989 -9.645 9.960 1.00 0.38 H new ATOM 0 HD23 LEU A 148 3.807 -10.936 11.171 1.00 0.38 H new ATOM 2382 N LYS A 149 -1.489 -9.726 10.149 1.00 0.31 N ATOM 2383 CA LYS A 149 -2.510 -9.388 9.173 1.00 0.29 C ATOM 2384 C LYS A 149 -3.763 -8.865 9.879 1.00 0.29 C ATOM 2385 O LYS A 149 -4.315 -7.843 9.495 1.00 0.28 O ATOM 2386 CB LYS A 149 -2.862 -10.592 8.297 1.00 0.35 C ATOM 2387 CG LYS A 149 -1.664 -11.189 7.577 1.00 0.78 C ATOM 2388 CD LYS A 149 -2.070 -12.279 6.595 1.00 0.80 C ATOM 2389 CE LYS A 149 -2.861 -13.390 7.268 1.00 0.83 C ATOM 2390 NZ LYS A 149 -3.067 -14.555 6.364 1.00 1.22 N ATOM 0 H LYS A 149 -1.344 -10.726 10.288 1.00 0.31 H new ATOM 0 HA LYS A 149 -2.111 -8.606 8.526 1.00 0.29 H new ATOM 0 HB2 LYS A 149 -3.323 -11.360 8.918 1.00 0.35 H new ATOM 0 HB3 LYS A 149 -3.605 -10.290 7.559 1.00 0.35 H new ATOM 0 HG2 LYS A 149 -1.133 -10.401 7.044 1.00 0.78 H new ATOM 0 HG3 LYS A 149 -0.970 -11.602 8.309 1.00 0.78 H new ATOM 0 HD2 LYS A 149 -2.668 -11.842 5.796 1.00 0.80 H new ATOM 0 HD3 LYS A 149 -1.178 -12.700 6.132 1.00 0.80 H new ATOM 0 HE2 LYS A 149 -2.336 -13.716 8.166 1.00 0.83 H new ATOM 0 HE3 LYS A 149 -3.829 -13.004 7.588 1.00 0.83 H new ATOM 0 HZ1 LYS A 149 -3.610 -15.289 6.862 1.00 1.22 H new ATOM 0 HZ2 LYS A 149 -3.591 -14.250 5.519 1.00 1.22 H new ATOM 0 HZ3 LYS A 149 -2.144 -14.941 6.079 1.00 1.22 H new ATOM 2404 N GLU A 150 -4.212 -9.553 10.920 1.00 0.33 N ATOM 2405 CA GLU A 150 -5.344 -9.063 11.701 1.00 0.35 C ATOM 2406 C GLU A 150 -5.002 -7.711 12.310 1.00 0.34 C ATOM 2407 O GLU A 150 -5.863 -6.845 12.480 1.00 0.35 O ATOM 2408 CB GLU A 150 -5.734 -10.041 12.803 1.00 0.42 C ATOM 2409 CG GLU A 150 -6.264 -11.363 12.289 1.00 1.02 C ATOM 2410 CD GLU A 150 -6.953 -12.154 13.375 1.00 1.39 C ATOM 2411 OE1 GLU A 150 -6.293 -12.495 14.377 1.00 2.00 O ATOM 2412 OE2 GLU A 150 -8.167 -12.418 13.240 1.00 1.83 O ATOM 0 H GLU A 150 -3.819 -10.438 11.241 1.00 0.33 H new ATOM 0 HA GLU A 150 -6.195 -8.961 11.028 1.00 0.35 H new ATOM 0 HB2 GLU A 150 -4.865 -10.229 13.433 1.00 0.42 H new ATOM 0 HB3 GLU A 150 -6.492 -9.578 13.435 1.00 0.42 H new ATOM 0 HG2 GLU A 150 -6.963 -11.181 11.473 1.00 1.02 H new ATOM 0 HG3 GLU A 150 -5.442 -11.949 11.879 1.00 1.02 H new ATOM 2419 N ARG A 151 -3.739 -7.554 12.657 1.00 0.33 N ATOM 2420 CA ARG A 151 -3.216 -6.288 13.134 1.00 0.35 C ATOM 2421 C ARG A 151 -3.516 -5.170 12.127 1.00 0.30 C ATOM 2422 O ARG A 151 -3.937 -4.079 12.513 1.00 0.32 O ATOM 2423 CB ARG A 151 -1.713 -6.435 13.374 1.00 0.41 C ATOM 2424 CG ARG A 151 -1.033 -5.236 14.003 1.00 1.21 C ATOM 2425 CD ARG A 151 0.388 -5.595 14.396 1.00 1.20 C ATOM 2426 NE ARG A 151 1.174 -4.433 14.797 1.00 1.71 N ATOM 2427 CZ ARG A 151 2.401 -4.514 15.311 1.00 1.97 C ATOM 2428 NH1 ARG A 151 2.950 -5.700 15.548 1.00 1.74 N ATOM 2429 NH2 ARG A 151 3.069 -3.407 15.597 1.00 2.88 N ATOM 0 H ARG A 151 -3.046 -8.301 12.616 1.00 0.33 H new ATOM 0 HA ARG A 151 -3.699 -6.016 14.072 1.00 0.35 H new ATOM 0 HB2 ARG A 151 -1.548 -7.302 14.014 1.00 0.41 H new ATOM 0 HB3 ARG A 151 -1.229 -6.646 12.420 1.00 0.41 H new ATOM 0 HG2 ARG A 151 -1.026 -4.402 13.302 1.00 1.21 H new ATOM 0 HG3 ARG A 151 -1.591 -4.910 14.881 1.00 1.21 H new ATOM 0 HD2 ARG A 151 0.363 -6.312 15.217 1.00 1.20 H new ATOM 0 HD3 ARG A 151 0.879 -6.088 13.557 1.00 1.20 H new ATOM 0 HE ARG A 151 0.762 -3.508 14.677 1.00 1.71 H new ATOM 0 HH11 ARG A 151 2.432 -6.553 15.337 1.00 1.74 H new ATOM 0 HH12 ARG A 151 3.889 -5.758 15.941 1.00 1.74 H new ATOM 0 HH21 ARG A 151 2.644 -2.496 15.424 1.00 2.88 H new ATOM 0 HH22 ARG A 151 4.008 -3.465 15.990 1.00 2.88 H new ATOM 2443 N PHE A 152 -3.338 -5.451 10.830 1.00 0.28 N ATOM 2444 CA PHE A 152 -3.630 -4.444 9.807 1.00 0.27 C ATOM 2445 C PHE A 152 -5.138 -4.268 9.628 1.00 0.23 C ATOM 2446 O PHE A 152 -5.607 -3.147 9.472 1.00 0.24 O ATOM 2447 CB PHE A 152 -2.942 -4.754 8.451 1.00 0.30 C ATOM 2448 CG PHE A 152 -3.804 -5.436 7.408 1.00 0.25 C ATOM 2449 CD1 PHE A 152 -4.819 -4.748 6.756 1.00 0.21 C ATOM 2450 CD2 PHE A 152 -3.595 -6.764 7.079 1.00 0.28 C ATOM 2451 CE1 PHE A 152 -5.606 -5.371 5.814 1.00 0.19 C ATOM 2452 CE2 PHE A 152 -4.380 -7.393 6.134 1.00 0.26 C ATOM 2453 CZ PHE A 152 -5.387 -6.695 5.502 1.00 0.21 C ATOM 0 H PHE A 152 -3.002 -6.345 10.472 1.00 0.28 H new ATOM 0 HA PHE A 152 -3.211 -3.503 10.164 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -2.572 -3.818 8.032 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -2.073 -5.383 8.643 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -4.993 -3.709 6.992 1.00 0.21 H new ATOM 0 HD2 PHE A 152 -2.806 -7.316 7.569 1.00 0.28 H new ATOM 0 HE1 PHE A 152 -6.394 -4.822 5.320 1.00 0.19 H new ATOM 0 HE2 PHE A 152 -4.206 -8.431 5.890 1.00 0.26 H new ATOM 0 HZ PHE A 152 -6.003 -7.185 4.763 1.00 0.21 H new ATOM 2463 N VAL A 153 -5.904 -5.363 9.641 1.00 0.22 N ATOM 2464 CA VAL A 153 -7.350 -5.265 9.430 1.00 0.22 C ATOM 2465 C VAL A 153 -7.979 -4.437 10.549 1.00 0.25 C ATOM 2466 O VAL A 153 -8.915 -3.676 10.318 1.00 0.28 O ATOM 2467 CB VAL A 153 -8.055 -6.649 9.330 1.00 0.23 C ATOM 2468 CG1 VAL A 153 -7.304 -7.584 8.400 1.00 0.23 C ATOM 2469 CG2 VAL A 153 -8.233 -7.298 10.692 1.00 0.28 C ATOM 0 H VAL A 153 -5.555 -6.310 9.792 1.00 0.22 H new ATOM 0 HA VAL A 153 -7.495 -4.774 8.468 1.00 0.22 H new ATOM 0 HB VAL A 153 -9.046 -6.465 8.915 1.00 0.23 H new ATOM 0 HG11 VAL A 153 -7.822 -8.542 8.352 1.00 0.23 H new ATOM 0 HG12 VAL A 153 -7.258 -7.146 7.403 1.00 0.23 H new ATOM 0 HG13 VAL A 153 -6.293 -7.737 8.777 1.00 0.23 H new ATOM 0 HG21 VAL A 153 -8.729 -8.261 10.574 1.00 0.28 H new ATOM 0 HG22 VAL A 153 -7.257 -7.446 11.155 1.00 0.28 H new ATOM 0 HG23 VAL A 153 -8.841 -6.652 11.326 1.00 0.28 H new ATOM 2479 N SER A 154 -7.439 -4.572 11.757 1.00 0.28 N ATOM 2480 CA SER A 154 -7.889 -3.776 12.885 1.00 0.33 C ATOM 2481 C SER A 154 -7.539 -2.311 12.652 1.00 0.32 C ATOM 2482 O SER A 154 -8.352 -1.415 12.895 1.00 0.35 O ATOM 2483 CB SER A 154 -7.244 -4.278 14.177 1.00 0.38 C ATOM 2484 OG SER A 154 -7.491 -5.666 14.364 1.00 1.05 O ATOM 0 H SER A 154 -6.688 -5.227 11.976 1.00 0.28 H new ATOM 0 HA SER A 154 -8.971 -3.871 12.980 1.00 0.33 H new ATOM 0 HB2 SER A 154 -6.170 -4.097 14.145 1.00 0.38 H new ATOM 0 HB3 SER A 154 -7.637 -3.718 15.025 1.00 0.38 H new ATOM 0 HG SER A 154 -6.952 -6.183 13.729 1.00 1.05 H new ATOM 2490 N PHE A 155 -6.330 -2.079 12.150 1.00 0.29 N ATOM 2491 CA PHE A 155 -5.879 -0.735 11.819 1.00 0.29 C ATOM 2492 C PHE A 155 -6.720 -0.163 10.677 1.00 0.28 C ATOM 2493 O PHE A 155 -6.988 1.037 10.626 1.00 0.30 O ATOM 2494 CB PHE A 155 -4.395 -0.759 11.441 1.00 0.29 C ATOM 2495 CG PHE A 155 -3.787 0.604 11.251 1.00 0.31 C ATOM 2496 CD1 PHE A 155 -3.337 1.334 12.339 1.00 0.41 C ATOM 2497 CD2 PHE A 155 -3.666 1.151 9.986 1.00 0.26 C ATOM 2498 CE1 PHE A 155 -2.777 2.587 12.165 1.00 0.45 C ATOM 2499 CE2 PHE A 155 -3.108 2.401 9.806 1.00 0.30 C ATOM 2500 CZ PHE A 155 -2.662 3.120 10.897 1.00 0.39 C ATOM 0 H PHE A 155 -5.643 -2.810 11.963 1.00 0.29 H new ATOM 0 HA PHE A 155 -6.003 -0.092 12.691 1.00 0.29 H new ATOM 0 HB2 PHE A 155 -3.842 -1.287 12.218 1.00 0.29 H new ATOM 0 HB3 PHE A 155 -4.275 -1.330 10.520 1.00 0.29 H new ATOM 0 HD1 PHE A 155 -3.424 0.921 13.333 1.00 0.41 H new ATOM 0 HD2 PHE A 155 -4.012 0.593 9.129 1.00 0.26 H new ATOM 0 HE1 PHE A 155 -2.430 3.148 13.020 1.00 0.45 H new ATOM 0 HE2 PHE A 155 -3.020 2.816 8.813 1.00 0.30 H new ATOM 0 HZ PHE A 155 -2.224 4.097 10.759 1.00 0.39 H new ATOM 2510 N ALA A 156 -7.157 -1.040 9.782 1.00 0.25 N ATOM 2511 CA ALA A 156 -8.016 -0.651 8.673 1.00 0.25 C ATOM 2512 C ALA A 156 -9.304 -0.023 9.196 1.00 0.28 C ATOM 2513 O ALA A 156 -9.767 1.007 8.700 1.00 0.28 O ATOM 2514 CB ALA A 156 -8.360 -1.861 7.808 1.00 0.25 C ATOM 0 H ALA A 156 -6.928 -2.034 9.804 1.00 0.25 H new ATOM 0 HA ALA A 156 -7.477 0.078 8.068 1.00 0.25 H new ATOM 0 HB1 ALA A 156 -9.003 -1.549 6.985 1.00 0.25 H new ATOM 0 HB2 ALA A 156 -7.443 -2.295 7.408 1.00 0.25 H new ATOM 0 HB3 ALA A 156 -8.880 -2.604 8.412 1.00 0.25 H new ATOM 2520 N LYS A 157 -9.863 -0.654 10.217 1.00 0.33 N ATOM 2521 CA LYS A 157 -11.146 -0.253 10.768 1.00 0.39 C ATOM 2522 C LYS A 157 -11.018 0.939 11.710 1.00 0.41 C ATOM 2523 O LYS A 157 -11.992 1.654 11.941 1.00 0.44 O ATOM 2524 CB LYS A 157 -11.793 -1.444 11.469 1.00 0.50 C ATOM 2525 CG LYS A 157 -12.167 -2.548 10.496 1.00 0.78 C ATOM 2526 CD LYS A 157 -11.785 -3.915 11.020 1.00 0.70 C ATOM 2527 CE LYS A 157 -11.997 -4.977 9.956 1.00 0.55 C ATOM 2528 NZ LYS A 157 -11.661 -6.336 10.456 1.00 0.75 N ATOM 0 H LYS A 157 -9.441 -1.456 10.685 1.00 0.33 H new ATOM 0 HA LYS A 157 -11.785 0.070 9.946 1.00 0.39 H new ATOM 0 HB2 LYS A 157 -11.107 -1.839 12.218 1.00 0.50 H new ATOM 0 HB3 LYS A 157 -12.686 -1.111 11.999 1.00 0.50 H new ATOM 0 HG2 LYS A 157 -13.240 -2.518 10.308 1.00 0.78 H new ATOM 0 HG3 LYS A 157 -11.671 -2.374 9.541 1.00 0.78 H new ATOM 0 HD2 LYS A 157 -10.741 -3.911 11.334 1.00 0.70 H new ATOM 0 HD3 LYS A 157 -12.382 -4.152 11.901 1.00 0.70 H new ATOM 0 HE2 LYS A 157 -13.036 -4.958 9.626 1.00 0.55 H new ATOM 0 HE3 LYS A 157 -11.382 -4.748 9.086 1.00 0.55 H new ATOM 0 HZ1 LYS A 157 -11.538 -6.982 9.650 1.00 0.75 H new ATOM 0 HZ2 LYS A 157 -10.779 -6.296 11.005 1.00 0.75 H new ATOM 0 HZ3 LYS A 157 -12.431 -6.683 11.063 1.00 0.75 H new ATOM 2542 N SER A 158 -9.823 1.166 12.246 1.00 0.48 N ATOM 2543 CA SER A 158 -9.593 2.336 13.078 1.00 0.58 C ATOM 2544 C SER A 158 -9.499 3.593 12.218 1.00 0.49 C ATOM 2545 O SER A 158 -9.731 4.704 12.697 1.00 0.55 O ATOM 2546 CB SER A 158 -8.346 2.154 13.950 1.00 0.81 C ATOM 2547 OG SER A 158 -7.299 1.520 13.237 1.00 1.39 O ATOM 0 H SER A 158 -9.010 0.563 12.120 1.00 0.48 H new ATOM 0 HA SER A 158 -10.443 2.454 13.750 1.00 0.58 H new ATOM 0 HB2 SER A 158 -8.007 3.126 14.308 1.00 0.81 H new ATOM 0 HB3 SER A 158 -8.599 1.561 14.829 1.00 0.81 H new ATOM 0 HG SER A 158 -7.396 1.705 12.280 1.00 1.39 H new ATOM 2553 N LEU A 159 -9.167 3.416 10.940 1.00 0.43 N ATOM 2554 CA LEU A 159 -9.257 4.512 9.984 1.00 0.46 C ATOM 2555 C LEU A 159 -10.717 4.751 9.616 1.00 0.38 C ATOM 2556 O LEU A 159 -11.126 5.882 9.368 1.00 0.55 O ATOM 2557 CB LEU A 159 -8.443 4.235 8.712 1.00 0.61 C ATOM 2558 CG LEU A 159 -6.968 4.673 8.728 1.00 0.30 C ATOM 2559 CD1 LEU A 159 -6.824 6.098 9.237 1.00 0.34 C ATOM 2560 CD2 LEU A 159 -6.120 3.729 9.554 1.00 0.76 C ATOM 0 H LEU A 159 -8.837 2.534 10.548 1.00 0.43 H new ATOM 0 HA LEU A 159 -8.838 5.400 10.458 1.00 0.46 H new ATOM 0 HB2 LEU A 159 -8.478 3.164 8.512 1.00 0.61 H new ATOM 0 HB3 LEU A 159 -8.937 4.732 7.877 1.00 0.61 H new ATOM 0 HG LEU A 159 -6.609 4.638 7.699 1.00 0.30 H new ATOM 0 HD11 LEU A 159 -5.771 6.380 9.237 1.00 0.34 H new ATOM 0 HD12 LEU A 159 -7.380 6.774 8.588 1.00 0.34 H new ATOM 0 HD13 LEU A 159 -7.217 6.163 10.252 1.00 0.34 H new ATOM 0 HD21 LEU A 159 -5.084 4.067 9.544 1.00 0.76 H new ATOM 0 HD22 LEU A 159 -6.487 3.714 10.580 1.00 0.76 H new ATOM 0 HD23 LEU A 159 -6.178 2.725 9.133 1.00 0.76 H new ATOM 2572 N GLY A 160 -11.502 3.679 9.597 1.00 0.31 N ATOM 2573 CA GLY A 160 -12.921 3.803 9.308 1.00 0.41 C ATOM 2574 C GLY A 160 -13.430 2.743 8.350 1.00 0.35 C ATOM 2575 O GLY A 160 -14.630 2.659 8.079 1.00 0.42 O ATOM 0 H GLY A 160 -11.183 2.727 9.776 1.00 0.31 H new ATOM 0 HA2 GLY A 160 -13.482 3.740 10.240 1.00 0.41 H new ATOM 0 HA3 GLY A 160 -13.114 4.789 8.885 1.00 0.41 H new ATOM 2579 N LEU A 161 -12.529 1.927 7.835 1.00 0.38 N ATOM 2580 CA LEU A 161 -12.903 0.887 6.890 1.00 0.35 C ATOM 2581 C LEU A 161 -13.452 -0.342 7.600 1.00 0.37 C ATOM 2582 O LEU A 161 -13.577 -0.371 8.819 1.00 0.58 O ATOM 2583 CB LEU A 161 -11.709 0.508 6.031 1.00 0.32 C ATOM 2584 CG LEU A 161 -11.630 1.223 4.683 1.00 0.33 C ATOM 2585 CD1 LEU A 161 -10.176 1.444 4.305 1.00 0.39 C ATOM 2586 CD2 LEU A 161 -12.338 0.395 3.618 1.00 0.35 C ATOM 0 H LEU A 161 -11.533 1.963 8.054 1.00 0.38 H new ATOM 0 HA LEU A 161 -13.693 1.283 6.252 1.00 0.35 H new ATOM 0 HB2 LEU A 161 -10.797 0.717 6.590 1.00 0.32 H new ATOM 0 HB3 LEU A 161 -11.735 -0.567 5.854 1.00 0.32 H new ATOM 0 HG LEU A 161 -12.124 2.192 4.757 1.00 0.33 H new ATOM 0 HD11 LEU A 161 -10.124 1.954 3.343 1.00 0.39 H new ATOM 0 HD12 LEU A 161 -9.691 2.055 5.066 1.00 0.39 H new ATOM 0 HD13 LEU A 161 -9.668 0.482 4.234 1.00 0.39 H new ATOM 0 HD21 LEU A 161 -12.279 0.909 2.659 1.00 0.35 H new ATOM 0 HD22 LEU A 161 -11.858 -0.581 3.537 1.00 0.35 H new ATOM 0 HD23 LEU A 161 -13.384 0.263 3.895 1.00 0.35 H new ATOM 2598 N LYS A 162 -13.790 -1.344 6.808 1.00 0.40 N ATOM 2599 CA LYS A 162 -14.491 -2.525 7.285 1.00 0.42 C ATOM 2600 C LYS A 162 -14.075 -3.736 6.465 1.00 0.36 C ATOM 2601 O LYS A 162 -13.641 -3.573 5.328 1.00 0.35 O ATOM 2602 CB LYS A 162 -16.016 -2.299 7.209 1.00 0.52 C ATOM 2603 CG LYS A 162 -16.568 -2.013 5.801 1.00 0.86 C ATOM 2604 CD LYS A 162 -15.979 -0.750 5.169 1.00 0.93 C ATOM 2605 CE LYS A 162 -16.637 0.543 5.648 1.00 0.77 C ATOM 2606 NZ LYS A 162 -16.820 0.616 7.126 1.00 1.46 N ATOM 0 H LYS A 162 -13.585 -1.362 5.809 1.00 0.40 H new ATOM 0 HA LYS A 162 -14.227 -2.709 8.326 1.00 0.42 H new ATOM 0 HB2 LYS A 162 -16.518 -3.181 7.606 1.00 0.52 H new ATOM 0 HB3 LYS A 162 -16.276 -1.464 7.860 1.00 0.52 H new ATOM 0 HG2 LYS A 162 -16.359 -2.866 5.155 1.00 0.86 H new ATOM 0 HG3 LYS A 162 -17.652 -1.913 5.856 1.00 0.86 H new ATOM 0 HD2 LYS A 162 -14.913 -0.708 5.390 1.00 0.93 H new ATOM 0 HD3 LYS A 162 -16.077 -0.817 4.086 1.00 0.93 H new ATOM 0 HE2 LYS A 162 -16.031 1.389 5.325 1.00 0.77 H new ATOM 0 HE3 LYS A 162 -17.609 0.645 5.166 1.00 0.77 H new ATOM 0 HZ1 LYS A 162 -17.128 1.573 7.391 1.00 1.46 H new ATOM 0 HZ2 LYS A 162 -17.541 -0.073 7.421 1.00 1.46 H new ATOM 0 HZ3 LYS A 162 -15.919 0.399 7.598 1.00 1.46 H new ATOM 2620 N ASP A 163 -14.191 -4.931 7.048 1.00 0.40 N ATOM 2621 CA ASP A 163 -13.868 -6.192 6.353 1.00 0.41 C ATOM 2622 C ASP A 163 -14.518 -6.257 4.980 1.00 0.39 C ATOM 2623 O ASP A 163 -14.000 -6.902 4.070 1.00 0.42 O ATOM 2624 CB ASP A 163 -14.336 -7.409 7.149 1.00 0.52 C ATOM 2625 CG ASP A 163 -13.618 -7.579 8.465 1.00 0.81 C ATOM 2626 OD1 ASP A 163 -12.415 -7.912 8.447 1.00 0.91 O ATOM 2627 OD2 ASP A 163 -14.249 -7.391 9.525 1.00 1.81 O ATOM 0 H ASP A 163 -14.509 -5.058 8.009 1.00 0.40 H new ATOM 0 HA ASP A 163 -12.783 -6.209 6.252 1.00 0.41 H new ATOM 0 HB2 ASP A 163 -15.406 -7.321 7.337 1.00 0.52 H new ATOM 0 HB3 ASP A 163 -14.191 -8.305 6.546 1.00 0.52 H new ATOM 2632 N ASN A 164 -15.655 -5.589 4.842 1.00 0.39 N ATOM 2633 CA ASN A 164 -16.377 -5.533 3.567 1.00 0.43 C ATOM 2634 C ASN A 164 -15.487 -4.948 2.465 1.00 0.38 C ATOM 2635 O ASN A 164 -15.718 -5.163 1.277 1.00 0.47 O ATOM 2636 CB ASN A 164 -17.659 -4.704 3.726 1.00 0.52 C ATOM 2637 CG ASN A 164 -18.421 -4.529 2.424 1.00 1.34 C ATOM 2638 OD1 ASN A 164 -18.224 -3.548 1.703 1.00 2.34 O ATOM 2639 ND2 ASN A 164 -19.291 -5.478 2.112 1.00 1.68 N ATOM 0 H ASN A 164 -16.104 -5.074 5.599 1.00 0.39 H new ATOM 0 HA ASN A 164 -16.650 -6.547 3.275 1.00 0.43 H new ATOM 0 HB2 ASN A 164 -18.308 -5.186 4.458 1.00 0.52 H new ATOM 0 HB3 ASN A 164 -17.403 -3.722 4.125 1.00 0.52 H new ATOM 0 HD21 ASN A 164 -19.828 -5.413 1.247 1.00 1.68 H new ATOM 0 HD22 ASN A 164 -19.424 -6.273 2.737 1.00 1.68 H new ATOM 2646 N ASN A 165 -14.456 -4.225 2.882 1.00 0.32 N ATOM 2647 CA ASN A 165 -13.482 -3.646 1.971 1.00 0.31 C ATOM 2648 C ASN A 165 -12.061 -3.944 2.455 1.00 0.26 C ATOM 2649 O ASN A 165 -11.168 -3.105 2.355 1.00 0.27 O ATOM 2650 CB ASN A 165 -13.709 -2.135 1.841 1.00 0.35 C ATOM 2651 CG ASN A 165 -14.532 -1.774 0.617 1.00 0.53 C ATOM 2652 OD1 ASN A 165 -13.993 -1.515 -0.456 1.00 1.40 O ATOM 2653 ND2 ASN A 165 -15.849 -1.754 0.765 1.00 0.61 N ATOM 0 H ASN A 165 -14.273 -4.024 3.865 1.00 0.32 H new ATOM 0 HA ASN A 165 -13.609 -4.096 0.986 1.00 0.31 H new ATOM 0 HB2 ASN A 165 -14.213 -1.768 2.735 1.00 0.35 H new ATOM 0 HB3 ASN A 165 -12.745 -1.629 1.789 1.00 0.35 H new ATOM 0 HD21 ASN A 165 -16.448 -1.518 -0.027 1.00 0.61 H new ATOM 0 HD22 ASN A 165 -16.264 -1.974 1.670 1.00 0.61 H new ATOM 2660 N ILE A 166 -11.868 -5.140 3.012 1.00 0.25 N ATOM 2661 CA ILE A 166 -10.538 -5.602 3.413 1.00 0.22 C ATOM 2662 C ILE A 166 -10.339 -7.053 2.987 1.00 0.24 C ATOM 2663 O ILE A 166 -11.117 -7.929 3.358 1.00 0.33 O ATOM 2664 CB ILE A 166 -10.317 -5.513 4.946 1.00 0.23 C ATOM 2665 CG1 ILE A 166 -10.653 -4.119 5.477 1.00 0.25 C ATOM 2666 CG2 ILE A 166 -8.882 -5.888 5.293 1.00 0.24 C ATOM 2667 CD1 ILE A 166 -10.588 -4.011 6.987 1.00 0.26 C ATOM 0 H ILE A 166 -12.617 -5.808 3.196 1.00 0.25 H new ATOM 0 HA ILE A 166 -9.819 -4.947 2.921 1.00 0.22 H new ATOM 0 HB ILE A 166 -10.992 -6.221 5.427 1.00 0.23 H new ATOM 0 HG12 ILE A 166 -9.963 -3.397 5.040 1.00 0.25 H new ATOM 0 HG13 ILE A 166 -11.654 -3.845 5.145 1.00 0.25 H new ATOM 0 HG21 ILE A 166 -8.739 -5.822 6.372 1.00 0.24 H new ATOM 0 HG22 ILE A 166 -8.682 -6.907 4.962 1.00 0.24 H new ATOM 0 HG23 ILE A 166 -8.196 -5.204 4.794 1.00 0.24 H new ATOM 0 HD11 ILE A 166 -10.838 -2.994 7.290 1.00 0.26 H new ATOM 0 HD12 ILE A 166 -11.298 -4.708 7.433 1.00 0.26 H new ATOM 0 HD13 ILE A 166 -9.581 -4.253 7.326 1.00 0.26 H new ATOM 2679 N VAL A 167 -9.296 -7.311 2.217 1.00 0.25 N ATOM 2680 CA VAL A 167 -9.032 -8.654 1.728 1.00 0.26 C ATOM 2681 C VAL A 167 -7.658 -9.137 2.195 1.00 0.26 C ATOM 2682 O VAL A 167 -6.848 -8.366 2.718 1.00 0.31 O ATOM 2683 CB VAL A 167 -9.141 -8.747 0.170 1.00 0.28 C ATOM 2684 CG1 VAL A 167 -9.800 -7.512 -0.426 1.00 0.57 C ATOM 2685 CG2 VAL A 167 -7.782 -8.982 -0.497 1.00 0.72 C ATOM 0 H VAL A 167 -8.619 -6.610 1.917 1.00 0.25 H new ATOM 0 HA VAL A 167 -9.799 -9.305 2.148 1.00 0.26 H new ATOM 0 HB VAL A 167 -9.772 -9.612 -0.033 1.00 0.28 H new ATOM 0 HG11 VAL A 167 -9.856 -7.617 -1.509 1.00 0.57 H new ATOM 0 HG12 VAL A 167 -10.805 -7.404 -0.019 1.00 0.57 H new ATOM 0 HG13 VAL A 167 -9.211 -6.629 -0.177 1.00 0.57 H new ATOM 0 HG21 VAL A 167 -7.912 -9.039 -1.578 1.00 0.72 H new ATOM 0 HG22 VAL A 167 -7.111 -8.158 -0.255 1.00 0.72 H new ATOM 0 HG23 VAL A 167 -7.355 -9.917 -0.133 1.00 0.72 H new ATOM 2695 N PHE A 168 -7.408 -10.417 1.998 1.00 0.26 N ATOM 2696 CA PHE A 168 -6.131 -11.018 2.322 1.00 0.28 C ATOM 2697 C PHE A 168 -5.493 -11.495 1.030 1.00 0.30 C ATOM 2698 O PHE A 168 -6.066 -12.324 0.321 1.00 0.42 O ATOM 2699 CB PHE A 168 -6.307 -12.176 3.309 1.00 0.33 C ATOM 2700 CG PHE A 168 -6.910 -11.752 4.619 1.00 0.34 C ATOM 2701 CD1 PHE A 168 -6.149 -11.077 5.563 1.00 0.33 C ATOM 2702 CD2 PHE A 168 -8.241 -12.018 4.902 1.00 0.41 C ATOM 2703 CE1 PHE A 168 -6.706 -10.676 6.764 1.00 0.35 C ATOM 2704 CE2 PHE A 168 -8.800 -11.622 6.101 1.00 0.45 C ATOM 2705 CZ PHE A 168 -8.034 -10.948 7.032 1.00 0.40 C ATOM 0 H PHE A 168 -8.087 -11.070 1.608 1.00 0.26 H new ATOM 0 HA PHE A 168 -5.485 -10.284 2.804 1.00 0.28 H new ATOM 0 HB2 PHE A 168 -6.940 -12.939 2.855 1.00 0.33 H new ATOM 0 HB3 PHE A 168 -5.337 -12.637 3.495 1.00 0.33 H new ATOM 0 HD1 PHE A 168 -5.111 -10.862 5.358 1.00 0.33 H new ATOM 0 HD2 PHE A 168 -8.847 -12.541 4.177 1.00 0.41 H new ATOM 0 HE1 PHE A 168 -6.104 -10.151 7.491 1.00 0.35 H new ATOM 0 HE2 PHE A 168 -9.837 -11.839 6.311 1.00 0.45 H new ATOM 0 HZ PHE A 168 -8.472 -10.634 7.968 1.00 0.40 H new ATOM 2715 N SER A 169 -4.327 -10.941 0.725 1.00 0.48 N ATOM 2716 CA SER A 169 -3.693 -11.110 -0.574 1.00 0.63 C ATOM 2717 C SER A 169 -3.577 -12.570 -0.994 1.00 0.50 C ATOM 2718 O SER A 169 -2.979 -13.394 -0.301 1.00 0.66 O ATOM 2719 CB SER A 169 -2.319 -10.466 -0.557 1.00 1.01 C ATOM 2720 OG SER A 169 -2.404 -9.111 -0.154 1.00 1.75 O ATOM 0 H SER A 169 -3.794 -10.361 1.373 1.00 0.48 H new ATOM 0 HA SER A 169 -4.332 -10.621 -1.309 1.00 0.63 H new ATOM 0 HB2 SER A 169 -1.665 -11.012 0.123 1.00 1.01 H new ATOM 0 HB3 SER A 169 -1.871 -10.528 -1.549 1.00 1.01 H new ATOM 0 HG SER A 169 -3.117 -8.664 -0.656 1.00 1.75 H new ATOM 2726 N VAL A 170 -4.167 -12.863 -2.138 1.00 0.46 N ATOM 2727 CA VAL A 170 -4.125 -14.188 -2.728 1.00 0.41 C ATOM 2728 C VAL A 170 -2.733 -14.520 -3.243 1.00 0.41 C ATOM 2729 O VAL A 170 -2.118 -13.710 -3.946 1.00 0.43 O ATOM 2730 CB VAL A 170 -5.141 -14.271 -3.885 1.00 0.47 C ATOM 2731 CG1 VAL A 170 -5.009 -15.563 -4.676 1.00 0.55 C ATOM 2732 CG2 VAL A 170 -6.544 -14.096 -3.346 1.00 0.57 C ATOM 0 H VAL A 170 -4.693 -12.183 -2.688 1.00 0.46 H new ATOM 0 HA VAL A 170 -4.382 -14.913 -1.956 1.00 0.41 H new ATOM 0 HB VAL A 170 -4.925 -13.462 -4.583 1.00 0.47 H new ATOM 0 HG11 VAL A 170 -5.745 -15.575 -5.479 1.00 0.55 H new ATOM 0 HG12 VAL A 170 -4.007 -15.629 -5.101 1.00 0.55 H new ATOM 0 HG13 VAL A 170 -5.179 -16.413 -4.015 1.00 0.55 H new ATOM 0 HG21 VAL A 170 -7.259 -14.155 -4.167 1.00 0.57 H new ATOM 0 HG22 VAL A 170 -6.756 -14.883 -2.622 1.00 0.57 H new ATOM 0 HG23 VAL A 170 -6.629 -13.124 -2.861 1.00 0.57 H new ATOM 2742 N PRO A 171 -2.212 -15.702 -2.862 1.00 0.47 N ATOM 2743 CA PRO A 171 -0.979 -16.263 -3.432 1.00 0.54 C ATOM 2744 C PRO A 171 -1.164 -16.584 -4.914 1.00 0.54 C ATOM 2745 O PRO A 171 -1.156 -17.745 -5.330 1.00 0.62 O ATOM 2746 CB PRO A 171 -0.747 -17.548 -2.626 1.00 0.66 C ATOM 2747 CG PRO A 171 -1.608 -17.421 -1.416 1.00 0.83 C ATOM 2748 CD PRO A 171 -2.777 -16.570 -1.820 1.00 0.57 C ATOM 0 HA PRO A 171 -0.139 -15.571 -3.373 1.00 0.54 H new ATOM 0 HB2 PRO A 171 -1.016 -18.430 -3.208 1.00 0.66 H new ATOM 0 HB3 PRO A 171 0.302 -17.655 -2.351 1.00 0.66 H new ATOM 0 HG2 PRO A 171 -1.940 -18.400 -1.070 1.00 0.83 H new ATOM 0 HG3 PRO A 171 -1.059 -16.962 -0.594 1.00 0.83 H new ATOM 0 HD2 PRO A 171 -3.602 -17.172 -2.201 1.00 0.57 H new ATOM 0 HD3 PRO A 171 -3.165 -15.993 -0.981 1.00 0.57 H new ATOM 2756 N THR A 172 -1.333 -15.530 -5.689 1.00 0.65 N ATOM 2757 CA THR A 172 -1.670 -15.614 -7.097 1.00 0.78 C ATOM 2758 C THR A 172 -0.529 -16.194 -7.926 1.00 0.73 C ATOM 2759 O THR A 172 0.633 -16.199 -7.509 1.00 0.72 O ATOM 2760 CB THR A 172 -2.018 -14.208 -7.625 1.00 1.07 C ATOM 2761 OG1 THR A 172 -2.356 -14.242 -9.020 1.00 1.78 O ATOM 2762 CG2 THR A 172 -0.858 -13.250 -7.397 1.00 0.81 C ATOM 0 H THR A 172 -1.238 -14.572 -5.351 1.00 0.65 H new ATOM 0 HA THR A 172 -2.526 -16.282 -7.193 1.00 0.78 H new ATOM 0 HB THR A 172 -2.888 -13.854 -7.071 1.00 1.07 H new ATOM 0 HG1 THR A 172 -2.297 -13.338 -9.393 1.00 1.78 H new ATOM 0 HG21 THR A 172 -1.122 -12.263 -7.776 1.00 0.81 H new ATOM 0 HG22 THR A 172 -0.645 -13.184 -6.330 1.00 0.81 H new ATOM 0 HG23 THR A 172 0.025 -13.616 -7.921 1.00 0.81 H new ATOM 2770 N ASP A 173 -0.870 -16.674 -9.110 1.00 0.75 N ATOM 2771 CA ASP A 173 0.129 -17.109 -10.059 1.00 0.80 C ATOM 2772 C ASP A 173 0.441 -15.927 -10.956 1.00 0.77 C ATOM 2773 O ASP A 173 -0.168 -15.737 -12.007 1.00 0.86 O ATOM 2774 CB ASP A 173 -0.364 -18.298 -10.886 1.00 0.99 C ATOM 2775 CG ASP A 173 0.774 -19.031 -11.575 1.00 1.34 C ATOM 2776 OD1 ASP A 173 1.336 -18.482 -12.545 1.00 1.55 O ATOM 2777 OD2 ASP A 173 1.095 -20.170 -11.172 1.00 1.94 O ATOM 0 H ASP A 173 -1.833 -16.771 -9.433 1.00 0.75 H new ATOM 0 HA ASP A 173 1.023 -17.445 -9.533 1.00 0.80 H new ATOM 0 HB2 ASP A 173 -0.900 -18.991 -10.238 1.00 0.99 H new ATOM 0 HB3 ASP A 173 -1.074 -17.948 -11.635 1.00 0.99 H new ATOM 2782 N GLN A 174 1.363 -15.114 -10.489 1.00 0.78 N ATOM 2783 CA GLN A 174 1.753 -13.895 -11.174 1.00 0.94 C ATOM 2784 C GLN A 174 3.250 -13.836 -11.259 1.00 0.89 C ATOM 2785 O GLN A 174 3.841 -12.770 -11.436 1.00 1.21 O ATOM 2786 CB GLN A 174 1.217 -12.687 -10.418 1.00 1.17 C ATOM 2787 CG GLN A 174 -0.090 -12.166 -10.971 1.00 1.69 C ATOM 2788 CD GLN A 174 -0.792 -11.200 -10.039 1.00 2.98 C ATOM 2789 OE1 GLN A 174 -2.020 -11.136 -10.009 1.00 3.60 O ATOM 2790 NE2 GLN A 174 -0.023 -10.437 -9.278 1.00 3.76 N ATOM 0 H GLN A 174 1.868 -15.279 -9.618 1.00 0.78 H new ATOM 0 HA GLN A 174 1.337 -13.887 -12.181 1.00 0.94 H new ATOM 0 HB2 GLN A 174 1.079 -12.955 -9.370 1.00 1.17 H new ATOM 0 HB3 GLN A 174 1.960 -11.890 -10.448 1.00 1.17 H new ATOM 0 HG2 GLN A 174 0.098 -11.670 -11.923 1.00 1.69 H new ATOM 0 HG3 GLN A 174 -0.751 -13.008 -11.176 1.00 1.69 H new ATOM 0 HE21 GLN A 174 0.992 -10.521 -9.333 1.00 3.76 H new ATOM 0 HE22 GLN A 174 -0.446 -9.765 -8.637 1.00 3.76 H new ATOM 2799 N CYS A 175 3.833 -15.014 -11.128 1.00 0.79 N ATOM 2800 CA CYS A 175 5.277 -15.197 -11.095 1.00 0.85 C ATOM 2801 C CYS A 175 5.838 -14.622 -9.798 1.00 1.02 C ATOM 2802 O CYS A 175 6.268 -15.378 -8.930 1.00 2.06 O ATOM 2803 CB CYS A 175 5.932 -14.573 -12.334 1.00 0.90 C ATOM 2804 SG CYS A 175 5.345 -15.294 -13.909 1.00 1.07 S ATOM 0 H CYS A 175 3.310 -15.885 -11.040 1.00 0.79 H new ATOM 0 HA CYS A 175 5.508 -16.262 -11.118 1.00 0.85 H new ATOM 0 HB2 CYS A 175 5.735 -13.501 -12.338 1.00 0.90 H new ATOM 0 HB3 CYS A 175 7.013 -14.698 -12.266 1.00 0.90 H new ATOM 2809 N ILE A 176 5.786 -13.292 -9.671 1.00 0.60 N ATOM 2810 CA ILE A 176 6.130 -12.564 -8.443 1.00 0.56 C ATOM 2811 C ILE A 176 7.522 -12.942 -7.896 1.00 0.80 C ATOM 2812 O ILE A 176 8.253 -13.717 -8.518 1.00 1.52 O ATOM 2813 CB ILE A 176 5.014 -12.732 -7.363 1.00 0.51 C ATOM 2814 CG1 ILE A 176 4.994 -11.518 -6.432 1.00 0.46 C ATOM 2815 CG2 ILE A 176 5.181 -14.014 -6.553 1.00 0.81 C ATOM 2816 CD1 ILE A 176 3.828 -11.500 -5.457 1.00 0.65 C ATOM 0 H ILE A 176 5.498 -12.678 -10.433 1.00 0.60 H new ATOM 0 HA ILE A 176 6.188 -11.507 -8.704 1.00 0.56 H new ATOM 0 HB ILE A 176 4.062 -12.803 -7.889 1.00 0.51 H new ATOM 0 HG12 ILE A 176 5.926 -11.492 -5.867 1.00 0.46 H new ATOM 0 HG13 ILE A 176 4.962 -10.611 -7.036 1.00 0.46 H new ATOM 0 HG21 ILE A 176 4.381 -14.085 -5.816 1.00 0.81 H new ATOM 0 HG22 ILE A 176 5.137 -14.875 -7.221 1.00 0.81 H new ATOM 0 HG23 ILE A 176 6.144 -13.999 -6.043 1.00 0.81 H new ATOM 0 HD11 ILE A 176 3.888 -10.607 -4.834 1.00 0.65 H new ATOM 0 HD12 ILE A 176 2.890 -11.493 -6.012 1.00 0.65 H new ATOM 0 HD13 ILE A 176 3.869 -12.387 -4.825 1.00 0.65 H new