USER MOD reduce.3.24.130724 H: found=0, std=0, add=1219, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1221 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 96 GLN : amide:sc= 0.0169 K(o=0.12,f=-1.3) USER MOD Set 1.2: A 100 LYS NZ :NH3+ -170:sc= 0.101 (180deg=-0.146) USER MOD Set 2.1: A 15 ASN : amide:sc= -2.66 X(o=-1.4,f=-1.6!) USER MOD Set 2.2: A 63 THR OG1 : rot -77:sc= 1.22 USER MOD Set 3.1: A 58 GLN : amide:sc= -2.93! C(o=-3!,f=-3.1!) USER MOD Set 3.2: A 62 GLN : amide:sc= -0.0287 X(o=-3,f=-2.9) USER MOD Set 4.1: A 20 SER OG : rot -66:sc= 0.484 USER MOD Set 4.2: A 28 HIS : no HE2:sc= 0.192 K(o=0.68,f=-0.25) USER MOD Single : A 9 LYS NZ :NH3+ -169:sc=-0.00575 (180deg=-0.151) USER MOD Single : A 21 HIS : no HD1:sc= -0.594 X(o=-0.59,f=-0.28) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 TYR OH : rot 130:sc= -0.142 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 158:sc= 1.16 USER MOD Single : A 54 ASN : amide:sc= -0.0239 X(o=-0.024,f=-0.42) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 30:sc= -0.118 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= -0.208 USER MOD Single : A 88 LYS NZ :NH3+ -173:sc=-0.00117 (180deg=-0.0955) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.456 USER MOD Single : A 98 GLN : amide:sc= 0.00614 K(o=0.0061,f=-0.82) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 107 ASN : amide:sc= -2.64! C(o=-2.6!,f=-0.97!) USER MOD Single : A 109 HIS : no HE2:sc= 0.0453 K(o=0.045,f=-0.59) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ -117:sc= 0.608 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -0.0191 X(o=-0.019,f=-0.019) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 3:sc= 0.391 USER MOD Single : A 127 HIS : no HE2:sc= -0.113 X(o=-0.11,f=-0.25) USER MOD Single : A 134 SER OG : rot 180:sc= -0.0298 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= -0.0613 USER MOD Single : A 143 GLN : amide:sc= -0.163 X(o=-0.16,f=0) USER MOD Single : A 147 SER OG : rot 30:sc= 0.0541 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.313) USER MOD Single : A 154 SER OG : rot 21:sc= 0.162 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 ASN : amide:sc= -5.22! C(o=-5.2!,f=-5.4!) USER MOD Single : A 166 LYS NZ :NH3+ -136:sc= -0.511 (180deg=-2.01!) USER MOD Single : A 168 CYS SG : rot 70:sc= 0.00964 USER MOD Single : A 173 MET CE :methyl 156:sc= -0.24 (180deg=-0.901) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= -0.0751 (180deg=-0.0751) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 55 N LEU A 6 12.692 -12.791 2.528 1.00 0.23 N ATOM 56 CA LEU A 6 11.784 -11.614 2.530 1.00 0.22 C ATOM 57 C LEU A 6 11.601 -10.985 3.949 1.00 0.17 C ATOM 58 O LEU A 6 11.719 -9.759 4.124 1.00 0.16 O ATOM 59 CB LEU A 6 10.429 -12.043 1.913 1.00 0.24 C ATOM 60 CG LEU A 6 9.450 -10.910 1.493 1.00 0.27 C ATOM 61 CD1 LEU A 6 10.077 -9.882 0.550 1.00 0.33 C ATOM 62 CD2 LEU A 6 8.164 -11.445 0.854 1.00 0.35 C ATOM 0 HA LEU A 6 12.235 -10.825 1.928 1.00 0.22 H new ATOM 0 HB2 LEU A 6 10.636 -12.654 1.034 1.00 0.24 H new ATOM 0 HB3 LEU A 6 9.917 -12.682 2.632 1.00 0.24 H new ATOM 0 HG LEU A 6 9.204 -10.412 2.431 1.00 0.27 H new ATOM 0 HD11 LEU A 6 9.338 -9.121 0.298 1.00 0.33 H new ATOM 0 HD12 LEU A 6 10.930 -9.412 1.040 1.00 0.33 H new ATOM 0 HD13 LEU A 6 10.410 -10.379 -0.361 1.00 0.33 H new ATOM 0 HD21 LEU A 6 7.519 -10.610 0.581 1.00 0.35 H new ATOM 0 HD22 LEU A 6 8.413 -12.018 -0.039 1.00 0.35 H new ATOM 0 HD23 LEU A 6 7.645 -12.088 1.565 1.00 0.35 H new ATOM 74 N ALA A 7 11.308 -11.865 4.952 1.00 0.17 N ATOM 75 CA ALA A 7 11.147 -11.522 6.413 1.00 0.16 C ATOM 76 C ALA A 7 12.421 -10.886 7.101 1.00 0.15 C ATOM 77 O ALA A 7 12.299 -10.141 8.084 1.00 0.15 O ATOM 78 CB ALA A 7 10.730 -12.804 7.167 1.00 0.20 C ATOM 0 H ALA A 7 11.172 -12.859 4.770 1.00 0.17 H new ATOM 0 HA ALA A 7 10.385 -10.745 6.466 1.00 0.16 H new ATOM 0 HB1 ALA A 7 10.608 -12.579 8.227 1.00 0.20 H new ATOM 0 HB2 ALA A 7 9.787 -13.173 6.763 1.00 0.20 H new ATOM 0 HB3 ALA A 7 11.500 -13.565 7.044 1.00 0.20 H new ATOM 84 N ASP A 8 13.634 -11.171 6.542 1.00 0.16 N ATOM 85 CA ASP A 8 14.927 -10.633 7.043 1.00 0.18 C ATOM 86 C ASP A 8 15.305 -9.242 6.437 1.00 0.17 C ATOM 87 O ASP A 8 16.228 -8.588 6.932 1.00 0.21 O ATOM 88 CB ASP A 8 16.060 -11.636 6.767 1.00 0.21 C ATOM 89 CG ASP A 8 16.337 -12.566 7.944 1.00 0.26 C ATOM 90 OD1 ASP A 8 15.637 -13.593 8.065 1.00 0.31 O ATOM 91 OD2 ASP A 8 17.254 -12.265 8.737 1.00 0.32 O ATOM 0 H ASP A 8 13.738 -11.781 5.731 1.00 0.16 H new ATOM 0 HA ASP A 8 14.798 -10.486 8.115 1.00 0.18 H new ATOM 0 HB2 ASP A 8 15.803 -12.234 5.892 1.00 0.21 H new ATOM 0 HB3 ASP A 8 16.970 -11.088 6.523 1.00 0.21 H new ATOM 96 N LYS A 9 14.584 -8.799 5.369 1.00 0.14 N ATOM 97 CA LYS A 9 14.851 -7.499 4.719 1.00 0.14 C ATOM 98 C LYS A 9 13.772 -6.416 5.006 1.00 0.10 C ATOM 99 O LYS A 9 14.055 -5.236 4.784 1.00 0.10 O ATOM 100 CB LYS A 9 15.063 -7.645 3.189 1.00 0.19 C ATOM 101 CG LYS A 9 15.984 -8.817 2.781 1.00 0.32 C ATOM 102 CD LYS A 9 16.202 -8.900 1.253 1.00 0.92 C ATOM 103 CE LYS A 9 17.180 -10.026 0.869 1.00 1.20 C ATOM 104 NZ LYS A 9 18.541 -9.795 1.432 1.00 1.73 N ATOM 0 H LYS A 9 13.819 -9.326 4.947 1.00 0.14 H new ATOM 0 HA LYS A 9 15.778 -7.150 5.174 1.00 0.14 H new ATOM 0 HB2 LYS A 9 14.092 -7.778 2.711 1.00 0.19 H new ATOM 0 HB3 LYS A 9 15.484 -6.717 2.803 1.00 0.19 H new ATOM 0 HG2 LYS A 9 16.949 -8.705 3.276 1.00 0.32 H new ATOM 0 HG3 LYS A 9 15.552 -9.753 3.134 1.00 0.32 H new ATOM 0 HD2 LYS A 9 15.245 -9.067 0.759 1.00 0.92 H new ATOM 0 HD3 LYS A 9 16.586 -7.947 0.889 1.00 0.92 H new ATOM 0 HE2 LYS A 9 16.795 -10.980 1.229 1.00 1.20 H new ATOM 0 HE3 LYS A 9 17.243 -10.097 -0.217 1.00 1.20 H new ATOM 0 HZ1 LYS A 9 19.212 -10.465 1.004 1.00 1.73 H new ATOM 0 HZ2 LYS A 9 18.843 -8.822 1.223 1.00 1.73 H new ATOM 0 HZ3 LYS A 9 18.519 -9.937 2.462 1.00 1.73 H new ATOM 118 N VAL A 10 12.522 -6.795 5.477 1.00 0.09 N ATOM 119 CA VAL A 10 11.439 -5.801 5.850 1.00 0.07 C ATOM 120 C VAL A 10 11.859 -4.735 6.959 1.00 0.06 C ATOM 121 O VAL A 10 12.487 -5.073 7.969 1.00 0.09 O ATOM 122 CB VAL A 10 10.055 -6.571 6.190 1.00 0.08 C ATOM 123 CG1 VAL A 10 10.031 -7.384 7.531 1.00 0.11 C ATOM 124 CG2 VAL A 10 8.802 -5.643 6.125 1.00 0.10 C ATOM 0 H VAL A 10 12.246 -7.769 5.605 1.00 0.09 H new ATOM 0 HA VAL A 10 11.274 -5.183 4.968 1.00 0.07 H new ATOM 0 HB VAL A 10 10.007 -7.306 5.386 1.00 0.08 H new ATOM 0 HG11 VAL A 10 9.056 -7.856 7.653 1.00 0.11 H new ATOM 0 HG12 VAL A 10 10.805 -8.151 7.505 1.00 0.11 H new ATOM 0 HG13 VAL A 10 10.215 -6.711 8.368 1.00 0.11 H new ATOM 0 HG21 VAL A 10 7.909 -6.221 6.363 1.00 0.10 H new ATOM 0 HG22 VAL A 10 8.912 -4.832 6.845 1.00 0.10 H new ATOM 0 HG23 VAL A 10 8.709 -5.227 5.122 1.00 0.10 H new ATOM 134 N ILE A 11 11.488 -3.465 6.709 1.00 0.06 N ATOM 135 CA ILE A 11 11.780 -2.366 7.665 1.00 0.07 C ATOM 136 C ILE A 11 10.498 -1.642 8.145 1.00 0.07 C ATOM 137 O ILE A 11 10.478 -1.119 9.264 1.00 0.08 O ATOM 138 CB ILE A 11 12.805 -1.287 7.121 1.00 0.10 C ATOM 139 CG1 ILE A 11 12.507 -0.894 5.631 1.00 0.10 C ATOM 140 CG2 ILE A 11 14.282 -1.774 7.311 1.00 0.13 C ATOM 141 CD1 ILE A 11 12.632 0.604 5.315 1.00 0.16 C ATOM 0 H ILE A 11 10.992 -3.171 5.867 1.00 0.06 H new ATOM 0 HA ILE A 11 12.250 -2.874 8.507 1.00 0.07 H new ATOM 0 HB ILE A 11 12.676 -0.381 7.713 1.00 0.10 H new ATOM 0 HG12 ILE A 11 13.189 -1.444 4.983 1.00 0.10 H new ATOM 0 HG13 ILE A 11 11.497 -1.219 5.381 1.00 0.10 H new ATOM 0 HG21 ILE A 11 14.967 -1.016 6.930 1.00 0.13 H new ATOM 0 HG22 ILE A 11 14.477 -1.940 8.371 1.00 0.13 H new ATOM 0 HG23 ILE A 11 14.431 -2.705 6.765 1.00 0.13 H new ATOM 0 HD11 ILE A 11 12.407 0.774 4.262 1.00 0.16 H new ATOM 0 HD12 ILE A 11 11.930 1.166 5.931 1.00 0.16 H new ATOM 0 HD13 ILE A 11 13.648 0.937 5.527 1.00 0.16 H new ATOM 153 N TRP A 12 9.429 -1.617 7.304 1.00 0.06 N ATOM 154 CA TRP A 12 8.175 -0.924 7.654 1.00 0.07 C ATOM 155 C TRP A 12 6.996 -1.396 6.749 1.00 0.08 C ATOM 156 O TRP A 12 7.038 -1.227 5.538 1.00 0.10 O ATOM 157 CB TRP A 12 8.457 0.589 7.525 1.00 0.10 C ATOM 158 CG TRP A 12 7.393 1.503 8.033 1.00 0.09 C ATOM 159 CD1 TRP A 12 7.295 2.085 9.265 1.00 0.19 C ATOM 160 CD2 TRP A 12 6.289 1.956 7.280 1.00 0.22 C ATOM 161 NE1 TRP A 12 6.181 2.882 9.312 1.00 0.26 N ATOM 162 CE2 TRP A 12 5.541 2.808 8.096 1.00 0.30 C ATOM 163 CE3 TRP A 12 5.871 1.705 5.978 1.00 0.35 C ATOM 164 CZ2 TRP A 12 4.386 3.418 7.640 1.00 0.44 C ATOM 165 CZ3 TRP A 12 4.740 2.296 5.517 1.00 0.51 C ATOM 166 CH2 TRP A 12 3.995 3.152 6.343 1.00 0.54 C ATOM 0 H TRP A 12 9.417 -2.067 6.389 1.00 0.06 H new ATOM 0 HA TRP A 12 7.862 -1.158 8.672 1.00 0.07 H new ATOM 0 HB2 TRP A 12 9.382 0.812 8.056 1.00 0.10 H new ATOM 0 HB3 TRP A 12 8.631 0.817 6.473 1.00 0.10 H new ATOM 0 HD1 TRP A 12 7.990 1.939 10.079 1.00 0.19 H new ATOM 0 HE1 TRP A 12 5.878 3.436 10.113 1.00 0.26 H new ATOM 0 HE3 TRP A 12 6.441 1.046 5.340 1.00 0.35 H new ATOM 0 HZ2 TRP A 12 3.812 4.077 8.275 1.00 0.44 H new ATOM 0 HZ3 TRP A 12 4.410 2.106 4.506 1.00 0.51 H new ATOM 0 HH2 TRP A 12 3.098 3.612 5.956 1.00 0.54 H new ATOM 177 N ALA A 13 5.930 -2.010 7.349 1.00 0.09 N ATOM 178 CA ALA A 13 4.733 -2.500 6.580 1.00 0.12 C ATOM 179 C ALA A 13 3.407 -2.200 7.332 1.00 0.16 C ATOM 180 O ALA A 13 3.274 -2.493 8.535 1.00 0.19 O ATOM 181 CB ALA A 13 4.833 -4.020 6.254 1.00 0.14 C ATOM 0 H ALA A 13 5.872 -2.178 8.353 1.00 0.09 H new ATOM 0 HA ALA A 13 4.726 -1.952 5.638 1.00 0.12 H new ATOM 0 HB1 ALA A 13 3.949 -4.332 5.698 1.00 0.14 H new ATOM 0 HB2 ALA A 13 5.723 -4.205 5.653 1.00 0.14 H new ATOM 0 HB3 ALA A 13 4.897 -4.588 7.182 1.00 0.14 H new ATOM 187 N VAL A 14 2.417 -1.583 6.622 1.00 0.20 N ATOM 188 CA VAL A 14 1.097 -1.229 7.253 1.00 0.26 C ATOM 189 C VAL A 14 -0.132 -1.522 6.311 1.00 0.27 C ATOM 190 O VAL A 14 -0.152 -1.143 5.144 1.00 0.28 O ATOM 191 CB VAL A 14 0.976 0.315 7.788 1.00 0.34 C ATOM 192 CG1 VAL A 14 -0.241 0.567 8.728 1.00 0.80 C ATOM 193 CG2 VAL A 14 2.189 0.833 8.579 1.00 1.05 C ATOM 0 H VAL A 14 2.497 -1.324 5.639 1.00 0.20 H new ATOM 0 HA VAL A 14 1.068 -1.886 8.123 1.00 0.26 H new ATOM 0 HB VAL A 14 0.878 0.846 6.841 1.00 0.34 H new ATOM 0 HG11 VAL A 14 -0.251 1.612 9.039 1.00 0.80 H new ATOM 0 HG12 VAL A 14 -1.165 0.338 8.197 1.00 0.80 H new ATOM 0 HG13 VAL A 14 -0.160 -0.072 9.607 1.00 0.80 H new ATOM 0 HG21 VAL A 14 2.009 1.863 8.888 1.00 1.05 H new ATOM 0 HG22 VAL A 14 2.341 0.211 9.461 1.00 1.05 H new ATOM 0 HG23 VAL A 14 3.078 0.793 7.950 1.00 1.05 H new ATOM 203 N ASN A 15 -1.176 -2.167 6.903 1.00 0.33 N ATOM 204 CA ASN A 15 -2.480 -2.394 6.233 1.00 0.43 C ATOM 205 C ASN A 15 -3.536 -1.568 7.004 1.00 0.46 C ATOM 206 O ASN A 15 -3.864 -1.871 8.151 1.00 0.55 O ATOM 207 CB ASN A 15 -2.893 -3.919 6.119 1.00 0.56 C ATOM 208 CG ASN A 15 -4.132 -4.187 5.255 1.00 1.40 C ATOM 209 OD1 ASN A 15 -4.963 -5.016 5.606 1.00 2.05 O ATOM 210 ND2 ASN A 15 -4.261 -3.493 4.138 1.00 2.11 N ATOM 0 H ASN A 15 -1.134 -2.540 7.851 1.00 0.33 H new ATOM 0 HA ASN A 15 -2.404 -2.068 5.196 1.00 0.43 H new ATOM 0 HB2 ASN A 15 -2.053 -4.479 5.708 1.00 0.56 H new ATOM 0 HB3 ASN A 15 -3.075 -4.307 7.121 1.00 0.56 H new ATOM 0 HD21 ASN A 15 -5.072 -3.640 3.537 1.00 2.11 H new ATOM 0 HD22 ASN A 15 -3.549 -2.811 3.877 1.00 2.11 H new ATOM 217 N ALA A 16 -4.083 -0.530 6.328 1.00 0.47 N ATOM 218 CA ALA A 16 -5.098 0.372 6.913 1.00 0.54 C ATOM 219 C ALA A 16 -6.524 -0.259 6.885 1.00 0.58 C ATOM 220 O ALA A 16 -7.216 -0.270 5.841 1.00 0.63 O ATOM 221 CB ALA A 16 -5.050 1.752 6.205 1.00 0.59 C ATOM 0 H ALA A 16 -3.833 -0.297 5.367 1.00 0.47 H new ATOM 0 HA ALA A 16 -4.860 0.524 7.966 1.00 0.54 H new ATOM 0 HB1 ALA A 16 -5.801 2.411 6.641 1.00 0.59 H new ATOM 0 HB2 ALA A 16 -4.061 2.193 6.333 1.00 0.59 H new ATOM 0 HB3 ALA A 16 -5.254 1.623 5.142 1.00 0.59 H new ATOM 227 N GLY A 17 -6.900 -0.848 8.049 1.00 0.58 N ATOM 228 CA GLY A 17 -8.189 -1.509 8.190 1.00 0.61 C ATOM 229 C GLY A 17 -8.426 -2.196 9.525 1.00 0.62 C ATOM 230 O GLY A 17 -9.262 -1.750 10.314 1.00 0.71 O ATOM 0 H GLY A 17 -6.321 -0.870 8.889 1.00 0.58 H new ATOM 0 HA2 GLY A 17 -8.976 -0.771 8.036 1.00 0.61 H new ATOM 0 HA3 GLY A 17 -8.287 -2.250 7.397 1.00 0.61 H new ATOM 234 N GLY A 18 -7.678 -3.294 9.778 1.00 0.72 N ATOM 235 CA GLY A 18 -7.842 -4.078 11.011 1.00 0.73 C ATOM 236 C GLY A 18 -6.821 -3.764 12.108 1.00 0.68 C ATOM 237 O GLY A 18 -6.807 -2.645 12.633 1.00 0.80 O ATOM 0 H GLY A 18 -6.961 -3.651 9.146 1.00 0.72 H new ATOM 0 HA2 GLY A 18 -8.843 -3.905 11.405 1.00 0.73 H new ATOM 0 HA3 GLY A 18 -7.775 -5.137 10.764 1.00 0.73 H new ATOM 241 N GLU A 19 -5.984 -4.758 12.467 1.00 0.59 N ATOM 242 CA GLU A 19 -4.944 -4.593 13.505 1.00 0.60 C ATOM 243 C GLU A 19 -3.992 -5.802 13.543 1.00 0.54 C ATOM 244 O GLU A 19 -4.405 -6.934 13.819 1.00 0.65 O ATOM 245 CB GLU A 19 -5.597 -4.312 14.913 1.00 0.77 C ATOM 246 CG GLU A 19 -4.944 -4.983 16.142 1.00 1.43 C ATOM 247 CD GLU A 19 -5.625 -4.613 17.446 1.00 1.39 C ATOM 248 OE1 GLU A 19 -6.668 -3.925 17.402 1.00 1.50 O ATOM 249 OE2 GLU A 19 -5.115 -5.012 18.515 1.00 1.63 O ATOM 0 H GLU A 19 -6.008 -5.689 12.051 1.00 0.59 H new ATOM 0 HA GLU A 19 -4.341 -3.723 13.245 1.00 0.60 H new ATOM 0 HB2 GLU A 19 -5.596 -3.234 15.077 1.00 0.77 H new ATOM 0 HB3 GLU A 19 -6.640 -4.627 14.871 1.00 0.77 H new ATOM 0 HG2 GLU A 19 -4.973 -6.065 16.017 1.00 1.43 H new ATOM 0 HG3 GLU A 19 -3.894 -4.696 16.192 1.00 1.43 H new ATOM 256 N SER A 20 -2.692 -5.499 13.274 1.00 0.48 N ATOM 257 CA SER A 20 -1.517 -6.438 13.285 1.00 0.45 C ATOM 258 C SER A 20 -1.642 -7.769 12.455 1.00 0.43 C ATOM 259 O SER A 20 -2.368 -8.680 12.874 1.00 0.51 O ATOM 260 CB SER A 20 -1.170 -6.802 14.744 1.00 0.52 C ATOM 261 OG SER A 20 0.221 -6.679 15.002 1.00 1.00 O ATOM 0 H SER A 20 -2.413 -4.548 13.031 1.00 0.48 H new ATOM 0 HA SER A 20 -0.733 -5.874 12.779 1.00 0.45 H new ATOM 0 HB2 SER A 20 -1.724 -6.153 15.422 1.00 0.52 H new ATOM 0 HB3 SER A 20 -1.489 -7.824 14.949 1.00 0.52 H new ATOM 0 HG SER A 20 0.711 -7.350 14.482 1.00 1.00 H new ATOM 267 N HIS A 21 -0.935 -7.899 11.306 1.00 0.39 N ATOM 268 CA HIS A 21 -1.009 -9.177 10.539 1.00 0.40 C ATOM 269 C HIS A 21 0.353 -9.667 10.011 1.00 0.40 C ATOM 270 O HIS A 21 1.118 -8.931 9.401 1.00 0.41 O ATOM 271 CB HIS A 21 -2.046 -9.125 9.377 1.00 0.43 C ATOM 272 CG HIS A 21 -2.156 -10.427 8.585 1.00 0.41 C ATOM 273 ND1 HIS A 21 -2.889 -11.507 9.026 1.00 0.39 N ATOM 274 CD2 HIS A 21 -1.553 -10.850 7.429 1.00 0.45 C ATOM 275 CE1 HIS A 21 -2.722 -12.514 8.187 1.00 0.40 C ATOM 276 NE2 HIS A 21 -1.920 -12.136 7.227 1.00 0.43 N ATOM 0 H HIS A 21 -0.336 -7.179 10.902 1.00 0.39 H new ATOM 0 HA HIS A 21 -1.351 -9.907 11.272 1.00 0.40 H new ATOM 0 HB2 HIS A 21 -3.025 -8.878 9.788 1.00 0.43 H new ATOM 0 HB3 HIS A 21 -1.773 -8.319 8.696 1.00 0.43 H new ATOM 0 HD2 HIS A 21 -0.904 -10.264 6.796 1.00 0.45 H new ATOM 0 HE1 HIS A 21 -3.175 -13.490 8.280 1.00 0.40 H new ATOM 0 HE2 HIS A 21 -1.618 -12.720 6.447 1.00 0.43 H new ATOM 285 N VAL A 22 0.570 -10.984 10.204 1.00 0.41 N ATOM 286 CA VAL A 22 1.784 -11.713 9.744 1.00 0.43 C ATOM 287 C VAL A 22 1.371 -12.556 8.488 1.00 0.44 C ATOM 288 O VAL A 22 0.572 -13.496 8.604 1.00 0.48 O ATOM 289 CB VAL A 22 2.399 -12.650 10.911 1.00 0.49 C ATOM 290 CG1 VAL A 22 3.584 -13.575 10.486 1.00 1.38 C ATOM 291 CG2 VAL A 22 2.915 -11.843 12.107 1.00 1.39 C ATOM 0 H VAL A 22 -0.097 -11.584 10.689 1.00 0.41 H new ATOM 0 HA VAL A 22 2.572 -11.006 9.485 1.00 0.43 H new ATOM 0 HB VAL A 22 1.538 -13.268 11.167 1.00 0.49 H new ATOM 0 HG11 VAL A 22 3.917 -14.157 11.345 1.00 1.38 H new ATOM 0 HG12 VAL A 22 3.254 -14.250 9.696 1.00 1.38 H new ATOM 0 HG13 VAL A 22 4.409 -12.964 10.120 1.00 1.38 H new ATOM 0 HG21 VAL A 22 3.316 -12.523 12.859 1.00 1.39 H new ATOM 0 HG22 VAL A 22 3.701 -11.164 11.776 1.00 1.39 H new ATOM 0 HG23 VAL A 22 2.096 -11.268 12.538 1.00 1.39 H new ATOM 301 N ASP A 23 1.935 -12.218 7.306 1.00 0.41 N ATOM 302 CA ASP A 23 1.638 -12.966 6.058 1.00 0.44 C ATOM 303 C ASP A 23 2.611 -14.177 5.868 1.00 0.43 C ATOM 304 O ASP A 23 3.711 -14.172 6.439 1.00 0.41 O ATOM 305 CB ASP A 23 1.523 -11.986 4.811 1.00 0.49 C ATOM 306 CG ASP A 23 2.806 -11.555 4.054 1.00 1.04 C ATOM 307 OD1 ASP A 23 3.875 -12.167 4.261 1.00 1.46 O ATOM 308 OD2 ASP A 23 2.710 -10.613 3.239 1.00 1.85 O ATOM 0 H ASP A 23 2.589 -11.444 7.188 1.00 0.41 H new ATOM 0 HA ASP A 23 0.652 -13.422 6.144 1.00 0.44 H new ATOM 0 HB2 ASP A 23 0.860 -12.457 4.086 1.00 0.49 H new ATOM 0 HB3 ASP A 23 1.027 -11.078 5.154 1.00 0.49 H new ATOM 313 N VAL A 24 2.184 -15.140 4.998 1.00 0.47 N ATOM 314 CA VAL A 24 2.883 -16.472 4.666 1.00 0.50 C ATOM 315 C VAL A 24 4.430 -16.477 4.398 1.00 0.47 C ATOM 316 O VAL A 24 5.076 -17.511 4.592 1.00 0.51 O ATOM 317 CB VAL A 24 2.171 -17.316 3.499 1.00 0.57 C ATOM 318 CG1 VAL A 24 1.064 -18.227 4.055 1.00 0.72 C ATOM 319 CG2 VAL A 24 1.565 -16.471 2.334 1.00 0.58 C ATOM 0 H VAL A 24 1.314 -15.030 4.477 1.00 0.47 H new ATOM 0 HA VAL A 24 2.757 -16.951 5.637 1.00 0.50 H new ATOM 0 HB VAL A 24 2.990 -17.900 3.078 1.00 0.57 H new ATOM 0 HG11 VAL A 24 0.605 -18.782 3.237 1.00 0.72 H new ATOM 0 HG12 VAL A 24 1.494 -18.926 4.772 1.00 0.72 H new ATOM 0 HG13 VAL A 24 0.307 -17.619 4.551 1.00 0.72 H new ATOM 0 HG21 VAL A 24 1.109 -17.136 1.601 1.00 0.58 H new ATOM 0 HG22 VAL A 24 0.808 -15.795 2.731 1.00 0.58 H new ATOM 0 HG23 VAL A 24 2.355 -15.891 1.856 1.00 0.58 H new ATOM 329 N HIS A 25 4.998 -15.345 3.959 1.00 0.42 N ATOM 330 CA HIS A 25 6.460 -15.214 3.741 1.00 0.40 C ATOM 331 C HIS A 25 7.181 -14.664 5.016 1.00 0.36 C ATOM 332 O HIS A 25 8.390 -14.841 5.186 1.00 0.39 O ATOM 333 CB HIS A 25 6.742 -14.274 2.559 1.00 0.38 C ATOM 334 CG HIS A 25 5.909 -14.537 1.331 1.00 0.42 C ATOM 335 ND1 HIS A 25 6.148 -15.584 0.465 1.00 0.45 N ATOM 336 CD2 HIS A 25 4.830 -13.881 0.833 1.00 0.48 C ATOM 337 CE1 HIS A 25 5.254 -15.560 -0.509 1.00 0.49 C ATOM 338 NE2 HIS A 25 4.445 -14.537 -0.309 1.00 0.51 N ATOM 0 H HIS A 25 4.471 -14.499 3.745 1.00 0.42 H new ATOM 0 HA HIS A 25 6.848 -16.209 3.522 1.00 0.40 H new ATOM 0 HB2 HIS A 25 6.574 -13.247 2.882 1.00 0.38 H new ATOM 0 HB3 HIS A 25 7.795 -14.356 2.291 1.00 0.38 H new ATOM 0 HD2 HIS A 25 4.361 -13.005 1.257 1.00 0.48 H new ATOM 0 HE1 HIS A 25 5.196 -16.260 -1.330 1.00 0.49 H new ATOM 0 HE2 HIS A 25 3.661 -14.276 -0.906 1.00 0.51 H new ATOM 347 N GLY A 26 6.389 -13.997 5.892 1.00 0.34 N ATOM 348 CA GLY A 26 6.855 -13.423 7.146 1.00 0.32 C ATOM 349 C GLY A 26 6.838 -11.898 7.174 1.00 0.27 C ATOM 350 O GLY A 26 7.748 -11.276 7.727 1.00 0.26 O ATOM 0 H GLY A 26 5.393 -13.849 5.729 1.00 0.34 H new ATOM 0 HA2 GLY A 26 6.233 -13.798 7.959 1.00 0.32 H new ATOM 0 HA3 GLY A 26 7.871 -13.768 7.337 1.00 0.32 H new ATOM 354 N ILE A 27 5.780 -11.296 6.589 1.00 0.26 N ATOM 355 CA ILE A 27 5.640 -9.818 6.548 1.00 0.23 C ATOM 356 C ILE A 27 4.542 -9.380 7.570 1.00 0.26 C ATOM 357 O ILE A 27 3.391 -9.799 7.486 1.00 0.33 O ATOM 358 CB ILE A 27 5.425 -9.320 5.038 1.00 0.22 C ATOM 359 CG1 ILE A 27 6.685 -9.604 4.124 1.00 0.18 C ATOM 360 CG2 ILE A 27 5.022 -7.818 4.849 1.00 0.26 C ATOM 361 CD1 ILE A 27 8.080 -9.200 4.629 1.00 0.55 C ATOM 0 H ILE A 27 5.015 -11.802 6.142 1.00 0.26 H new ATOM 0 HA ILE A 27 6.555 -9.319 6.868 1.00 0.23 H new ATOM 0 HB ILE A 27 4.567 -9.917 4.729 1.00 0.22 H new ATOM 0 HG12 ILE A 27 6.707 -10.674 3.918 1.00 0.18 H new ATOM 0 HG13 ILE A 27 6.521 -9.099 3.172 1.00 0.18 H new ATOM 0 HG21 ILE A 27 4.906 -7.603 3.787 1.00 0.26 H new ATOM 0 HG22 ILE A 27 4.080 -7.627 5.363 1.00 0.26 H new ATOM 0 HG23 ILE A 27 5.799 -7.178 5.266 1.00 0.26 H new ATOM 0 HD11 ILE A 27 8.828 -9.465 3.882 1.00 0.55 H new ATOM 0 HD12 ILE A 27 8.107 -8.124 4.803 1.00 0.55 H new ATOM 0 HD13 ILE A 27 8.296 -9.724 5.560 1.00 0.55 H new ATOM 373 N HIS A 28 4.922 -8.472 8.476 1.00 0.25 N ATOM 374 CA HIS A 28 4.035 -8.044 9.562 1.00 0.30 C ATOM 375 C HIS A 28 3.609 -6.554 9.534 1.00 0.28 C ATOM 376 O HIS A 28 4.435 -5.648 9.373 1.00 0.28 O ATOM 377 CB HIS A 28 4.775 -8.341 10.880 1.00 0.40 C ATOM 378 CG HIS A 28 3.945 -8.430 12.137 1.00 0.63 C ATOM 379 ND1 HIS A 28 4.467 -8.894 13.325 1.00 0.93 N ATOM 380 CD2 HIS A 28 2.640 -8.161 12.388 1.00 0.96 C ATOM 381 CE1 HIS A 28 3.522 -8.914 14.242 1.00 1.30 C ATOM 382 NE2 HIS A 28 2.407 -8.472 13.702 1.00 1.34 N ATOM 0 H HIS A 28 5.837 -8.020 8.478 1.00 0.25 H new ATOM 0 HA HIS A 28 3.100 -8.594 9.450 1.00 0.30 H new ATOM 0 HB2 HIS A 28 5.309 -9.284 10.761 1.00 0.40 H new ATOM 0 HB3 HIS A 28 5.526 -7.565 11.027 1.00 0.40 H new ATOM 0 HD1 HIS A 28 5.436 -9.178 13.471 1.00 0.93 H new ATOM 0 HD2 HIS A 28 1.919 -7.774 11.684 1.00 0.96 H new ATOM 0 HE1 HIS A 28 3.642 -9.239 15.265 1.00 1.30 H new ATOM 391 N TYR A 29 2.279 -6.339 9.720 1.00 0.33 N ATOM 392 CA TYR A 29 1.678 -4.984 9.850 1.00 0.38 C ATOM 393 C TYR A 29 1.485 -4.656 11.367 1.00 0.45 C ATOM 394 O TYR A 29 1.133 -5.534 12.163 1.00 0.46 O ATOM 395 CB TYR A 29 0.342 -4.860 8.996 1.00 0.45 C ATOM 396 CG TYR A 29 -0.887 -4.159 9.655 1.00 0.98 C ATOM 397 CD1 TYR A 29 -0.800 -2.849 10.142 1.00 1.31 C ATOM 398 CD2 TYR A 29 -2.132 -4.794 9.767 1.00 1.34 C ATOM 399 CE1 TYR A 29 -1.876 -2.209 10.712 1.00 1.91 C ATOM 400 CE2 TYR A 29 -3.219 -4.140 10.333 1.00 1.91 C ATOM 401 CZ TYR A 29 -3.074 -2.850 10.800 1.00 2.21 C ATOM 402 OH TYR A 29 -4.137 -2.188 11.355 1.00 2.79 O ATOM 0 H TYR A 29 1.597 -7.095 9.784 1.00 0.33 H new ATOM 0 HA TYR A 29 2.351 -4.234 9.434 1.00 0.38 H new ATOM 0 HB2 TYR A 29 0.581 -4.322 8.079 1.00 0.45 H new ATOM 0 HB3 TYR A 29 0.037 -5.865 8.706 1.00 0.45 H new ATOM 0 HD1 TYR A 29 0.141 -2.325 10.068 1.00 1.31 H new ATOM 0 HD2 TYR A 29 -2.248 -5.806 9.408 1.00 1.34 H new ATOM 0 HE1 TYR A 29 -1.771 -1.202 11.088 1.00 1.91 H new ATOM 0 HE2 TYR A 29 -4.174 -4.639 10.407 1.00 1.91 H new ATOM 0 HH TYR A 29 -4.913 -2.258 10.760 1.00 2.79 H new ATOM 412 N ARG A 30 1.673 -3.355 11.722 1.00 0.54 N ATOM 413 CA ARG A 30 1.593 -2.817 13.119 1.00 0.63 C ATOM 414 C ARG A 30 0.179 -2.838 13.791 1.00 0.91 C ATOM 415 O ARG A 30 -0.267 -3.891 14.226 1.00 1.87 O ATOM 416 CB ARG A 30 2.188 -1.388 13.136 1.00 0.72 C ATOM 417 CG ARG A 30 3.651 -1.291 12.650 1.00 0.68 C ATOM 418 CD ARG A 30 4.229 0.130 12.795 1.00 0.87 C ATOM 419 NE ARG A 30 4.346 0.530 14.198 1.00 1.70 N ATOM 420 CZ ARG A 30 4.859 1.690 14.599 1.00 2.08 C ATOM 421 NH1 ARG A 30 5.296 2.570 13.708 1.00 1.93 N ATOM 422 NH2 ARG A 30 4.934 1.969 15.892 1.00 3.00 N ATOM 0 H ARG A 30 1.889 -2.633 11.035 1.00 0.54 H new ATOM 0 HA ARG A 30 2.174 -3.505 13.733 1.00 0.63 H new ATOM 0 HB2 ARG A 30 1.569 -0.744 12.511 1.00 0.72 H new ATOM 0 HB3 ARG A 30 2.131 -0.997 14.152 1.00 0.72 H new ATOM 0 HG2 ARG A 30 4.266 -1.989 13.218 1.00 0.68 H new ATOM 0 HG3 ARG A 30 3.704 -1.596 11.605 1.00 0.68 H new ATOM 0 HD2 ARG A 30 5.210 0.173 12.322 1.00 0.87 H new ATOM 0 HD3 ARG A 30 3.590 0.838 12.268 1.00 0.87 H new ATOM 0 HE ARG A 30 4.014 -0.120 14.911 1.00 1.70 H new ATOM 0 HH11 ARG A 30 5.239 2.358 12.712 1.00 1.93 H new ATOM 0 HH12 ARG A 30 5.689 3.459 14.019 1.00 1.93 H new ATOM 0 HH21 ARG A 30 4.598 1.294 16.580 1.00 3.00 H new ATOM 0 HH22 ARG A 30 5.327 2.858 16.200 1.00 3.00 H new ATOM 436 N LYS A 31 -0.485 -1.672 13.895 1.00 0.57 N ATOM 437 CA LYS A 31 -1.816 -1.522 14.541 1.00 0.59 C ATOM 438 C LYS A 31 -2.275 -0.037 14.569 1.00 0.64 C ATOM 439 O LYS A 31 -1.913 0.697 15.497 1.00 0.79 O ATOM 440 CB LYS A 31 -1.762 -2.086 16.003 1.00 0.73 C ATOM 441 CG LYS A 31 -2.976 -1.755 16.905 1.00 1.15 C ATOM 442 CD LYS A 31 -2.847 -2.354 18.325 1.00 1.44 C ATOM 443 CE LYS A 31 -3.980 -1.899 19.261 1.00 1.70 C ATOM 444 NZ LYS A 31 -3.843 -2.494 20.620 1.00 2.30 N ATOM 0 H LYS A 31 -0.114 -0.794 13.531 1.00 0.57 H new ATOM 0 HA LYS A 31 -2.539 -2.086 13.952 1.00 0.59 H new ATOM 0 HB2 LYS A 31 -1.660 -3.170 15.949 1.00 0.73 H new ATOM 0 HB3 LYS A 31 -0.862 -1.704 16.485 1.00 0.73 H new ATOM 0 HG2 LYS A 31 -3.083 -0.673 16.980 1.00 1.15 H new ATOM 0 HG3 LYS A 31 -3.885 -2.133 16.437 1.00 1.15 H new ATOM 0 HD2 LYS A 31 -2.850 -3.442 18.259 1.00 1.44 H new ATOM 0 HD3 LYS A 31 -1.888 -2.063 18.753 1.00 1.44 H new ATOM 0 HE2 LYS A 31 -3.975 -0.812 19.337 1.00 1.70 H new ATOM 0 HE3 LYS A 31 -4.942 -2.184 18.834 1.00 1.70 H new ATOM 0 HZ1 LYS A 31 -4.624 -2.165 21.223 1.00 2.30 H new ATOM 0 HZ2 LYS A 31 -3.873 -3.531 20.550 1.00 2.30 H new ATOM 0 HZ3 LYS A 31 -2.936 -2.202 21.037 1.00 2.30 H new ATOM 458 N ASP A 32 -3.074 0.403 13.535 1.00 0.61 N ATOM 459 CA ASP A 32 -3.677 1.808 13.422 1.00 0.72 C ATOM 460 C ASP A 32 -2.716 3.029 13.701 1.00 0.75 C ATOM 461 O ASP A 32 -3.007 3.848 14.574 1.00 1.00 O ATOM 462 CB ASP A 32 -4.910 1.904 14.348 1.00 0.86 C ATOM 463 CG ASP A 32 -6.225 1.623 13.630 1.00 0.95 C ATOM 464 OD1 ASP A 32 -6.374 0.509 13.083 1.00 1.01 O ATOM 465 OD2 ASP A 32 -7.098 2.515 13.617 1.00 1.17 O ATOM 0 H ASP A 32 -3.325 -0.198 12.750 1.00 0.61 H new ATOM 0 HA ASP A 32 -3.930 1.908 12.367 1.00 0.72 H new ATOM 0 HB2 ASP A 32 -4.794 1.198 15.170 1.00 0.86 H new ATOM 0 HB3 ASP A 32 -4.949 2.901 14.787 1.00 0.86 H new ATOM 470 N PRO A 33 -1.580 3.183 12.951 1.00 0.59 N ATOM 471 CA PRO A 33 -0.596 4.272 13.184 1.00 0.66 C ATOM 472 C PRO A 33 -0.696 5.532 12.265 1.00 0.83 C ATOM 473 O PRO A 33 0.326 6.153 11.949 1.00 1.45 O ATOM 474 CB PRO A 33 0.720 3.517 12.934 1.00 0.59 C ATOM 475 CG PRO A 33 0.394 2.512 11.841 1.00 0.57 C ATOM 476 CD PRO A 33 -1.130 2.302 11.859 1.00 0.49 C ATOM 0 HA PRO A 33 -0.736 4.724 14.166 1.00 0.66 H new ATOM 0 HB2 PRO A 33 1.512 4.197 12.621 1.00 0.59 H new ATOM 0 HB3 PRO A 33 1.067 3.018 13.839 1.00 0.59 H new ATOM 0 HG2 PRO A 33 0.720 2.881 10.869 1.00 0.57 H new ATOM 0 HG3 PRO A 33 0.915 1.570 12.016 1.00 0.57 H new ATOM 0 HD2 PRO A 33 -1.585 2.576 10.907 1.00 0.49 H new ATOM 0 HD3 PRO A 33 -1.391 1.261 12.049 1.00 0.49 H new ATOM 715 N PRO A 49 -14.453 -10.921 -0.059 1.00 0.82 N ATOM 716 CA PRO A 49 -13.002 -11.291 -0.172 1.00 0.89 C ATOM 717 C PRO A 49 -12.296 -10.955 -1.506 1.00 0.75 C ATOM 718 O PRO A 49 -12.944 -10.785 -2.541 1.00 0.78 O ATOM 719 CB PRO A 49 -13.009 -12.828 -0.011 1.00 1.31 C ATOM 720 CG PRO A 49 -14.319 -13.144 0.645 1.00 1.37 C ATOM 721 CD PRO A 49 -15.290 -12.145 0.063 1.00 1.05 C ATOM 0 HA PRO A 49 -12.445 -10.716 0.568 1.00 0.89 H new ATOM 0 HB2 PRO A 49 -12.921 -13.326 -0.976 1.00 1.31 H new ATOM 0 HB3 PRO A 49 -12.171 -13.165 0.599 1.00 1.31 H new ATOM 0 HG2 PRO A 49 -14.630 -14.167 0.435 1.00 1.37 H new ATOM 0 HG3 PRO A 49 -14.253 -13.047 1.729 1.00 1.37 H new ATOM 0 HD2 PRO A 49 -15.678 -12.470 -0.902 1.00 1.05 H new ATOM 0 HD3 PRO A 49 -16.149 -11.986 0.715 1.00 1.05 H new ATOM 729 N ILE A 50 -10.939 -10.870 -1.442 1.00 0.67 N ATOM 730 CA ILE A 50 -10.085 -10.602 -2.604 1.00 0.60 C ATOM 731 C ILE A 50 -9.733 -11.962 -3.336 1.00 0.64 C ATOM 732 O ILE A 50 -9.342 -12.956 -2.707 1.00 0.69 O ATOM 733 CB ILE A 50 -8.853 -9.622 -2.132 1.00 0.57 C ATOM 734 CG1 ILE A 50 -9.104 -8.155 -2.605 1.00 0.54 C ATOM 735 CG2 ILE A 50 -7.432 -10.012 -2.621 1.00 0.59 C ATOM 736 CD1 ILE A 50 -10.283 -7.423 -1.972 1.00 0.59 C ATOM 0 H ILE A 50 -10.417 -10.988 -0.574 1.00 0.67 H new ATOM 0 HA ILE A 50 -10.582 -10.035 -3.391 1.00 0.60 H new ATOM 0 HB ILE A 50 -8.859 -9.732 -1.048 1.00 0.57 H new ATOM 0 HG12 ILE A 50 -8.201 -7.576 -2.412 1.00 0.54 H new ATOM 0 HG13 ILE A 50 -9.251 -8.166 -3.685 1.00 0.54 H new ATOM 0 HG21 ILE A 50 -6.707 -9.290 -2.245 1.00 0.59 H new ATOM 0 HG22 ILE A 50 -7.180 -11.006 -2.251 1.00 0.59 H new ATOM 0 HG23 ILE A 50 -7.410 -10.014 -3.711 1.00 0.59 H new ATOM 0 HD11 ILE A 50 -10.350 -6.416 -2.384 1.00 0.59 H new ATOM 0 HD12 ILE A 50 -11.205 -7.964 -2.186 1.00 0.59 H new ATOM 0 HD13 ILE A 50 -10.138 -7.365 -0.893 1.00 0.59 H new ATOM 748 N LEU A 51 -9.880 -11.939 -4.674 1.00 0.65 N ATOM 749 CA LEU A 51 -9.689 -13.121 -5.559 1.00 0.71 C ATOM 750 C LEU A 51 -8.231 -13.436 -6.012 1.00 0.78 C ATOM 751 O LEU A 51 -7.966 -14.563 -6.441 1.00 1.26 O ATOM 752 CB LEU A 51 -10.552 -12.909 -6.817 1.00 0.74 C ATOM 753 CG LEU A 51 -11.816 -13.801 -6.991 1.00 0.86 C ATOM 754 CD1 LEU A 51 -12.862 -13.098 -7.856 1.00 1.22 C ATOM 755 CD2 LEU A 51 -11.465 -15.152 -7.615 1.00 1.28 C ATOM 0 H LEU A 51 -10.137 -11.094 -5.184 1.00 0.65 H new ATOM 0 HA LEU A 51 -9.980 -13.980 -4.955 1.00 0.71 H new ATOM 0 HB2 LEU A 51 -10.873 -11.867 -6.831 1.00 0.74 H new ATOM 0 HB3 LEU A 51 -9.915 -13.058 -7.689 1.00 0.74 H new ATOM 0 HG LEU A 51 -12.228 -13.973 -5.997 1.00 0.86 H new ATOM 0 HD11 LEU A 51 -13.736 -13.740 -7.964 1.00 1.22 H new ATOM 0 HD12 LEU A 51 -13.156 -12.161 -7.382 1.00 1.22 H new ATOM 0 HD13 LEU A 51 -12.441 -12.891 -8.840 1.00 1.22 H new ATOM 0 HD21 LEU A 51 -12.370 -15.749 -7.722 1.00 1.28 H new ATOM 0 HD22 LEU A 51 -11.016 -14.994 -8.596 1.00 1.28 H new ATOM 0 HD23 LEU A 51 -10.758 -15.677 -6.973 1.00 1.28 H new ATOM 767 N ARG A 52 -7.298 -12.466 -5.918 1.00 0.58 N ATOM 768 CA ARG A 52 -5.889 -12.695 -6.342 1.00 0.58 C ATOM 769 C ARG A 52 -4.891 -12.897 -5.157 1.00 0.57 C ATOM 770 O ARG A 52 -3.685 -12.673 -5.316 1.00 0.65 O ATOM 771 CB ARG A 52 -5.393 -11.525 -7.228 1.00 0.57 C ATOM 772 CG ARG A 52 -6.415 -11.011 -8.267 1.00 0.70 C ATOM 773 CD ARG A 52 -6.558 -11.942 -9.483 1.00 0.64 C ATOM 774 NE ARG A 52 -5.339 -11.977 -10.292 1.00 0.87 N ATOM 775 CZ ARG A 52 -5.207 -12.701 -11.400 1.00 1.19 C ATOM 776 NH1 ARG A 52 -6.211 -13.455 -11.829 1.00 1.34 N ATOM 777 NH2 ARG A 52 -4.069 -12.672 -12.080 1.00 1.51 N ATOM 0 H ARG A 52 -7.484 -11.529 -5.559 1.00 0.58 H new ATOM 0 HA ARG A 52 -5.904 -13.628 -6.906 1.00 0.58 H new ATOM 0 HB2 ARG A 52 -5.107 -10.696 -6.581 1.00 0.57 H new ATOM 0 HB3 ARG A 52 -4.493 -11.844 -7.754 1.00 0.57 H new ATOM 0 HG2 ARG A 52 -7.387 -10.898 -7.787 1.00 0.70 H new ATOM 0 HG3 ARG A 52 -6.111 -10.021 -8.608 1.00 0.70 H new ATOM 0 HD2 ARG A 52 -6.796 -12.950 -9.142 1.00 0.64 H new ATOM 0 HD3 ARG A 52 -7.393 -11.608 -10.099 1.00 0.64 H new ATOM 0 HE ARG A 52 -4.545 -11.414 -9.989 1.00 0.87 H new ATOM 0 HH11 ARG A 52 -7.088 -13.481 -11.309 1.00 1.34 H new ATOM 0 HH12 ARG A 52 -6.106 -14.009 -12.679 1.00 1.34 H new ATOM 0 HH21 ARG A 52 -3.294 -12.094 -11.753 1.00 1.51 H new ATOM 0 HH22 ARG A 52 -3.968 -13.227 -12.930 1.00 1.51 H new ATOM 791 N SER A 53 -5.394 -13.333 -3.979 1.00 0.53 N ATOM 792 CA SER A 53 -4.545 -13.563 -2.799 1.00 0.54 C ATOM 793 C SER A 53 -4.919 -14.872 -2.029 1.00 0.57 C ATOM 794 O SER A 53 -5.656 -15.737 -2.523 1.00 0.67 O ATOM 795 CB SER A 53 -4.638 -12.328 -1.867 1.00 0.53 C ATOM 796 OG SER A 53 -3.445 -12.147 -1.115 1.00 1.09 O ATOM 0 H SER A 53 -6.383 -13.531 -3.826 1.00 0.53 H new ATOM 0 HA SER A 53 -3.519 -13.699 -3.141 1.00 0.54 H new ATOM 0 HB2 SER A 53 -4.832 -11.436 -2.463 1.00 0.53 H new ATOM 0 HB3 SER A 53 -5.482 -12.447 -1.188 1.00 0.53 H new ATOM 0 HG SER A 53 -3.382 -11.214 -0.820 1.00 1.09 H new ATOM 802 N ASN A 54 -4.366 -14.982 -0.802 1.00 0.59 N ATOM 803 CA ASN A 54 -4.574 -16.113 0.144 1.00 0.64 C ATOM 804 C ASN A 54 -5.728 -15.790 1.160 1.00 0.63 C ATOM 805 O ASN A 54 -6.357 -14.750 1.023 1.00 0.66 O ATOM 806 CB ASN A 54 -3.251 -16.275 0.921 1.00 0.80 C ATOM 807 CG ASN A 54 -2.614 -17.655 0.855 1.00 0.85 C ATOM 808 OD1 ASN A 54 -2.751 -18.388 -0.126 1.00 1.27 O ATOM 809 ND2 ASN A 54 -1.904 -17.999 1.923 1.00 1.12 N ATOM 0 H ASN A 54 -3.743 -14.268 -0.426 1.00 0.59 H new ATOM 0 HA ASN A 54 -4.850 -17.018 -0.398 1.00 0.64 H new ATOM 0 HB2 ASN A 54 -2.536 -15.546 0.541 1.00 0.80 H new ATOM 0 HB3 ASN A 54 -3.432 -16.028 1.967 1.00 0.80 H new ATOM 0 HD21 ASN A 54 -1.441 -18.907 1.957 1.00 1.12 H new ATOM 0 HD22 ASN A 54 -1.822 -17.355 2.710 1.00 1.12 H new ATOM 816 N PRO A 55 -6.088 -16.685 2.162 1.00 0.71 N ATOM 817 CA PRO A 55 -7.117 -16.360 3.225 1.00 0.75 C ATOM 818 C PRO A 55 -6.578 -15.333 4.265 1.00 0.74 C ATOM 819 O PRO A 55 -7.209 -14.296 4.568 1.00 0.80 O ATOM 820 CB PRO A 55 -7.381 -17.722 3.911 1.00 0.89 C ATOM 821 CG PRO A 55 -6.831 -18.743 2.951 1.00 0.95 C ATOM 822 CD PRO A 55 -5.624 -18.080 2.320 1.00 0.83 C ATOM 0 HA PRO A 55 -8.010 -15.905 2.797 1.00 0.75 H new ATOM 0 HB2 PRO A 55 -6.885 -17.781 4.880 1.00 0.89 H new ATOM 0 HB3 PRO A 55 -8.445 -17.877 4.088 1.00 0.89 H new ATOM 0 HG2 PRO A 55 -6.551 -19.661 3.469 1.00 0.95 H new ATOM 0 HG3 PRO A 55 -7.571 -19.015 2.198 1.00 0.95 H new ATOM 0 HD2 PRO A 55 -4.742 -18.147 2.957 1.00 0.83 H new ATOM 0 HD3 PRO A 55 -5.362 -18.534 1.364 1.00 0.83 H new ATOM 830 N GLU A 56 -5.321 -15.618 4.702 1.00 0.71 N ATOM 831 CA GLU A 56 -4.524 -14.802 5.665 1.00 0.73 C ATOM 832 C GLU A 56 -4.095 -13.441 5.053 1.00 0.65 C ATOM 833 O GLU A 56 -4.402 -12.350 5.590 1.00 0.67 O ATOM 834 CB GLU A 56 -3.261 -15.611 6.051 1.00 0.80 C ATOM 835 CG GLU A 56 -3.487 -16.733 7.083 1.00 0.97 C ATOM 836 CD GLU A 56 -3.788 -16.215 8.481 1.00 1.48 C ATOM 837 OE1 GLU A 56 -2.828 -15.983 9.248 1.00 1.63 O ATOM 838 OE2 GLU A 56 -4.981 -16.043 8.809 1.00 2.04 O ATOM 0 H GLU A 56 -4.818 -16.447 4.385 1.00 0.71 H new ATOM 0 HA GLU A 56 -5.141 -14.589 6.538 1.00 0.73 H new ATOM 0 HB2 GLU A 56 -2.841 -16.051 5.146 1.00 0.80 H new ATOM 0 HB3 GLU A 56 -2.515 -14.922 6.446 1.00 0.80 H new ATOM 0 HG2 GLU A 56 -4.313 -17.361 6.751 1.00 0.97 H new ATOM 0 HG3 GLU A 56 -2.600 -17.366 7.121 1.00 0.97 H new ATOM 845 N ASP A 57 -3.466 -13.516 3.853 1.00 0.62 N ATOM 846 CA ASP A 57 -3.025 -12.328 3.100 1.00 0.58 C ATOM 847 C ASP A 57 -4.228 -11.572 2.388 1.00 0.52 C ATOM 848 O ASP A 57 -4.045 -10.483 1.853 1.00 0.53 O ATOM 849 CB ASP A 57 -1.925 -12.747 2.118 1.00 0.60 C ATOM 850 CG ASP A 57 -0.795 -11.728 1.949 1.00 1.08 C ATOM 851 OD1 ASP A 57 -1.049 -10.520 2.135 1.00 1.62 O ATOM 852 OD2 ASP A 57 0.335 -12.145 1.617 1.00 1.62 O ATOM 0 H ASP A 57 -3.254 -14.399 3.388 1.00 0.62 H new ATOM 0 HA ASP A 57 -2.616 -11.598 3.799 1.00 0.58 H new ATOM 0 HB2 ASP A 57 -1.497 -13.691 2.455 1.00 0.60 H new ATOM 0 HB3 ASP A 57 -2.378 -12.932 1.144 1.00 0.60 H new ATOM 857 N GLN A 58 -5.472 -12.184 2.439 1.00 0.52 N ATOM 858 CA GLN A 58 -6.763 -11.579 1.974 1.00 0.51 C ATOM 859 C GLN A 58 -7.171 -10.483 2.987 1.00 0.50 C ATOM 860 O GLN A 58 -7.572 -9.398 2.608 1.00 0.49 O ATOM 861 CB GLN A 58 -7.867 -12.662 1.910 1.00 0.60 C ATOM 862 CG GLN A 58 -9.307 -12.153 1.736 1.00 0.84 C ATOM 863 CD GLN A 58 -10.330 -13.213 2.093 1.00 0.91 C ATOM 864 OE1 GLN A 58 -11.384 -12.906 2.650 1.00 1.16 O ATOM 865 NE2 GLN A 58 -10.032 -14.466 1.770 1.00 1.77 N ATOM 0 H GLN A 58 -5.594 -13.125 2.812 1.00 0.52 H new ATOM 0 HA GLN A 58 -6.638 -11.153 0.978 1.00 0.51 H new ATOM 0 HB2 GLN A 58 -7.639 -13.335 1.083 1.00 0.60 H new ATOM 0 HB3 GLN A 58 -7.821 -13.253 2.825 1.00 0.60 H new ATOM 0 HG2 GLN A 58 -9.460 -11.275 2.364 1.00 0.84 H new ATOM 0 HG3 GLN A 58 -9.458 -11.837 0.704 1.00 0.84 H new ATOM 0 HE21 GLN A 58 -9.147 -14.677 1.309 1.00 1.77 H new ATOM 0 HE22 GLN A 58 -10.688 -15.217 1.983 1.00 1.77 H new ATOM 874 N VAL A 59 -6.999 -10.811 4.308 1.00 0.52 N ATOM 875 CA VAL A 59 -7.207 -9.850 5.467 1.00 0.54 C ATOM 876 C VAL A 59 -6.204 -8.638 5.328 1.00 0.52 C ATOM 877 O VAL A 59 -6.601 -7.495 5.508 1.00 0.55 O ATOM 878 CB VAL A 59 -7.027 -10.555 6.912 1.00 0.55 C ATOM 879 CG1 VAL A 59 -7.332 -9.631 8.126 1.00 0.80 C ATOM 880 CG2 VAL A 59 -7.923 -11.783 7.082 1.00 0.81 C ATOM 0 H VAL A 59 -6.713 -11.743 4.608 1.00 0.52 H new ATOM 0 HA VAL A 59 -8.238 -9.499 5.417 1.00 0.54 H new ATOM 0 HB VAL A 59 -5.971 -10.823 6.914 1.00 0.55 H new ATOM 0 HG11 VAL A 59 -7.185 -10.187 9.052 1.00 0.80 H new ATOM 0 HG12 VAL A 59 -6.660 -8.773 8.108 1.00 0.80 H new ATOM 0 HG13 VAL A 59 -8.364 -9.285 8.070 1.00 0.80 H new ATOM 0 HG21 VAL A 59 -7.762 -12.217 8.069 1.00 0.81 H new ATOM 0 HG22 VAL A 59 -8.967 -11.488 6.981 1.00 0.81 H new ATOM 0 HG23 VAL A 59 -7.679 -12.520 6.317 1.00 0.81 H new ATOM 890 N LEU A 60 -4.923 -8.922 4.960 1.00 0.49 N ATOM 891 CA LEU A 60 -3.917 -7.846 4.727 1.00 0.48 C ATOM 892 C LEU A 60 -4.015 -7.176 3.304 1.00 0.49 C ATOM 893 O LEU A 60 -3.307 -6.229 3.028 1.00 0.65 O ATOM 894 CB LEU A 60 -2.512 -8.422 4.946 1.00 0.52 C ATOM 895 CG LEU A 60 -1.324 -7.420 4.931 1.00 0.71 C ATOM 896 CD1 LEU A 60 -0.952 -6.962 6.329 1.00 1.15 C ATOM 897 CD2 LEU A 60 -0.089 -8.016 4.271 1.00 0.90 C ATOM 0 H LEU A 60 -4.568 -9.868 4.821 1.00 0.49 H new ATOM 0 HA LEU A 60 -4.129 -7.051 5.442 1.00 0.48 H new ATOM 0 HB2 LEU A 60 -2.505 -8.940 5.905 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -2.331 -9.173 4.177 1.00 0.52 H new ATOM 0 HG LEU A 60 -1.665 -6.563 4.351 1.00 0.71 H new ATOM 0 HD11 LEU A 60 -0.118 -6.263 6.273 1.00 1.15 H new ATOM 0 HD12 LEU A 60 -1.808 -6.469 6.790 1.00 1.15 H new ATOM 0 HD13 LEU A 60 -0.663 -7.824 6.930 1.00 1.15 H new ATOM 0 HD21 LEU A 60 0.718 -7.284 4.281 1.00 0.90 H new ATOM 0 HD22 LEU A 60 0.222 -8.906 4.818 1.00 0.90 H new ATOM 0 HD23 LEU A 60 -0.321 -8.286 3.241 1.00 0.90 H new ATOM 909 N TYR A 61 -4.870 -7.712 2.435 1.00 0.44 N ATOM 910 CA TYR A 61 -5.135 -7.179 1.069 1.00 0.45 C ATOM 911 C TYR A 61 -6.659 -6.864 0.840 1.00 0.47 C ATOM 912 O TYR A 61 -7.106 -6.768 -0.306 1.00 0.52 O ATOM 913 CB TYR A 61 -4.637 -8.196 0.014 1.00 0.44 C ATOM 914 CG TYR A 61 -3.093 -8.345 -0.185 1.00 0.46 C ATOM 915 CD1 TYR A 61 -2.128 -7.638 0.561 1.00 0.70 C ATOM 916 CD2 TYR A 61 -2.607 -9.244 -1.131 1.00 0.76 C ATOM 917 CE1 TYR A 61 -0.770 -7.829 0.351 1.00 0.72 C ATOM 918 CE2 TYR A 61 -1.250 -9.437 -1.333 1.00 0.92 C ATOM 919 CZ TYR A 61 -0.342 -8.726 -0.593 1.00 0.72 C ATOM 920 OH TYR A 61 1.007 -8.918 -0.794 1.00 0.88 O ATOM 0 H TYR A 61 -5.417 -8.546 2.650 1.00 0.44 H new ATOM 0 HA TYR A 61 -4.593 -6.239 0.966 1.00 0.45 H new ATOM 0 HB2 TYR A 61 -5.036 -9.175 0.278 1.00 0.44 H new ATOM 0 HB3 TYR A 61 -5.073 -7.923 -0.947 1.00 0.44 H new ATOM 0 HD1 TYR A 61 -2.453 -6.933 1.312 1.00 0.70 H new ATOM 0 HD2 TYR A 61 -3.310 -9.808 -1.726 1.00 0.76 H new ATOM 0 HE1 TYR A 61 -0.050 -7.271 0.931 1.00 0.72 H new ATOM 0 HE2 TYR A 61 -0.909 -10.146 -2.072 1.00 0.92 H new ATOM 0 HH TYR A 61 1.141 -9.588 -1.497 1.00 0.88 H new ATOM 930 N GLN A 62 -7.437 -6.689 1.946 1.00 0.50 N ATOM 931 CA GLN A 62 -8.924 -6.435 1.868 1.00 0.57 C ATOM 932 C GLN A 62 -9.515 -5.495 2.953 1.00 0.70 C ATOM 933 O GLN A 62 -10.464 -4.761 2.663 1.00 1.33 O ATOM 934 CB GLN A 62 -9.698 -7.786 1.946 1.00 0.57 C ATOM 935 CG GLN A 62 -11.203 -7.748 1.547 1.00 0.75 C ATOM 936 CD GLN A 62 -12.146 -7.997 2.716 1.00 0.77 C ATOM 937 OE1 GLN A 62 -12.643 -7.056 3.335 1.00 1.26 O ATOM 938 NE2 GLN A 62 -12.384 -9.263 3.034 1.00 1.02 N ATOM 0 H GLN A 62 -7.073 -6.717 2.898 1.00 0.50 H new ATOM 0 HA GLN A 62 -9.052 -5.923 0.914 1.00 0.57 H new ATOM 0 HB2 GLN A 62 -9.193 -8.507 1.303 1.00 0.57 H new ATOM 0 HB3 GLN A 62 -9.625 -8.163 2.966 1.00 0.57 H new ATOM 0 HG2 GLN A 62 -11.430 -6.777 1.107 1.00 0.75 H new ATOM 0 HG3 GLN A 62 -11.386 -8.497 0.777 1.00 0.75 H new ATOM 0 HE21 GLN A 62 -11.952 -10.014 2.495 1.00 1.02 H new ATOM 0 HE22 GLN A 62 -12.999 -9.485 3.817 1.00 1.02 H new ATOM 947 N THR A 63 -8.988 -5.538 4.192 1.00 0.58 N ATOM 948 CA THR A 63 -9.511 -4.708 5.365 1.00 0.62 C ATOM 949 C THR A 63 -9.214 -3.164 5.273 1.00 0.76 C ATOM 950 O THR A 63 -8.081 -2.758 5.022 1.00 1.28 O ATOM 951 CB THR A 63 -9.002 -5.248 6.768 1.00 0.59 C ATOM 952 OG1 THR A 63 -7.571 -5.324 6.830 1.00 0.63 O ATOM 953 CG2 THR A 63 -9.597 -6.625 7.131 1.00 0.60 C ATOM 0 H THR A 63 -8.196 -6.132 4.437 1.00 0.58 H new ATOM 0 HA THR A 63 -10.591 -4.832 5.291 1.00 0.62 H new ATOM 0 HB THR A 63 -9.353 -4.519 7.498 1.00 0.59 H new ATOM 0 HG1 THR A 63 -7.263 -6.109 6.331 1.00 0.63 H new ATOM 0 HG21 THR A 63 -9.213 -6.943 8.100 1.00 0.60 H new ATOM 0 HG22 THR A 63 -10.683 -6.551 7.178 1.00 0.60 H new ATOM 0 HG23 THR A 63 -9.315 -7.355 6.372 1.00 0.60 H new ATOM 961 N GLU A 64 -10.280 -2.345 5.477 1.00 0.57 N ATOM 962 CA GLU A 64 -10.220 -0.844 5.444 1.00 0.60 C ATOM 963 C GLU A 64 -10.835 -0.233 6.734 1.00 0.64 C ATOM 964 O GLU A 64 -11.874 -0.705 7.204 1.00 0.69 O ATOM 965 CB GLU A 64 -11.009 -0.281 4.241 1.00 0.67 C ATOM 966 CG GLU A 64 -12.432 -0.850 4.061 1.00 0.84 C ATOM 967 CD GLU A 64 -13.329 0.081 3.270 1.00 1.07 C ATOM 968 OE1 GLU A 64 -13.069 0.278 2.067 1.00 1.53 O ATOM 969 OE2 GLU A 64 -14.296 0.614 3.856 1.00 1.50 O ATOM 0 H GLU A 64 -11.215 -2.703 5.671 1.00 0.57 H new ATOM 0 HA GLU A 64 -9.167 -0.575 5.362 1.00 0.60 H new ATOM 0 HB2 GLU A 64 -11.079 0.801 4.348 1.00 0.67 H new ATOM 0 HB3 GLU A 64 -10.440 -0.475 3.332 1.00 0.67 H new ATOM 0 HG2 GLU A 64 -12.374 -1.813 3.554 1.00 0.84 H new ATOM 0 HG3 GLU A 64 -12.875 -1.032 5.040 1.00 0.84 H new ATOM 1050 N ASP A 69 -9.301 13.782 4.649 1.00 0.76 N ATOM 1051 CA ASP A 69 -8.840 14.663 3.542 1.00 0.75 C ATOM 1052 C ASP A 69 -7.327 14.957 3.659 1.00 0.69 C ATOM 1053 O ASP A 69 -6.885 15.527 4.665 1.00 1.33 O ATOM 1054 CB ASP A 69 -9.609 16.001 3.575 1.00 1.17 C ATOM 1055 CG ASP A 69 -10.488 16.247 2.355 1.00 1.63 C ATOM 1056 OD1 ASP A 69 -11.226 15.323 1.953 1.00 2.06 O ATOM 1057 OD2 ASP A 69 -10.440 17.371 1.811 1.00 2.15 O ATOM 0 HA ASP A 69 -9.031 14.144 2.603 1.00 0.75 H new ATOM 0 HB2 ASP A 69 -10.232 16.027 4.469 1.00 1.17 H new ATOM 0 HB3 ASP A 69 -8.892 16.817 3.663 1.00 1.17 H new ATOM 1062 N SER A 70 -6.537 14.592 2.588 1.00 0.72 N ATOM 1063 CA SER A 70 -5.032 14.785 2.486 1.00 0.57 C ATOM 1064 C SER A 70 -4.241 14.155 3.667 1.00 0.53 C ATOM 1065 O SER A 70 -3.994 14.826 4.677 1.00 0.57 O ATOM 1066 CB SER A 70 -4.699 16.284 2.347 1.00 0.70 C ATOM 1067 OG SER A 70 -3.678 16.502 1.382 1.00 0.77 O ATOM 0 H SER A 70 -6.929 14.149 1.757 1.00 0.72 H new ATOM 0 HA SER A 70 -4.710 14.251 1.592 1.00 0.57 H new ATOM 0 HB2 SER A 70 -5.596 16.832 2.060 1.00 0.70 H new ATOM 0 HB3 SER A 70 -4.380 16.678 3.312 1.00 0.70 H new ATOM 0 HG SER A 70 -3.490 17.462 1.315 1.00 0.77 H new ATOM 1073 N PHE A 71 -3.845 12.876 3.533 1.00 0.49 N ATOM 1074 CA PHE A 71 -3.159 12.193 4.649 1.00 0.47 C ATOM 1075 C PHE A 71 -2.171 11.105 4.206 1.00 0.33 C ATOM 1076 O PHE A 71 -2.216 10.611 3.071 1.00 0.39 O ATOM 1077 CB PHE A 71 -4.198 11.621 5.670 1.00 0.66 C ATOM 1078 CG PHE A 71 -5.411 10.879 5.081 1.00 0.54 C ATOM 1079 CD1 PHE A 71 -6.514 11.593 4.616 1.00 0.75 C ATOM 1080 CD2 PHE A 71 -5.472 9.483 5.032 1.00 0.73 C ATOM 1081 CE1 PHE A 71 -7.625 10.941 4.117 1.00 0.81 C ATOM 1082 CE2 PHE A 71 -6.595 8.832 4.541 1.00 0.78 C ATOM 1083 CZ PHE A 71 -7.665 9.565 4.085 1.00 0.67 C ATOM 0 H PHE A 71 -3.981 12.310 2.696 1.00 0.49 H new ATOM 0 HA PHE A 71 -2.554 12.957 5.138 1.00 0.47 H new ATOM 0 HB2 PHE A 71 -3.675 10.939 6.341 1.00 0.66 H new ATOM 0 HB3 PHE A 71 -4.567 12.447 6.278 1.00 0.66 H new ATOM 0 HD1 PHE A 71 -6.500 12.672 4.646 1.00 0.75 H new ATOM 0 HD2 PHE A 71 -4.632 8.902 5.382 1.00 0.73 H new ATOM 0 HE1 PHE A 71 -8.465 11.512 3.751 1.00 0.81 H new ATOM 0 HE2 PHE A 71 -6.628 7.753 4.517 1.00 0.78 H new ATOM 0 HZ PHE A 71 -8.539 9.060 3.701 1.00 0.67 H new ATOM 1093 N GLY A 72 -1.256 10.753 5.131 1.00 0.31 N ATOM 1094 CA GLY A 72 -0.259 9.735 4.840 1.00 0.41 C ATOM 1095 C GLY A 72 0.683 9.361 5.981 1.00 0.33 C ATOM 1096 O GLY A 72 0.542 9.819 7.124 1.00 0.47 O ATOM 0 H GLY A 72 -1.196 11.157 6.066 1.00 0.31 H new ATOM 0 HA2 GLY A 72 -0.777 8.833 4.515 1.00 0.41 H new ATOM 0 HA3 GLY A 72 0.343 10.077 3.998 1.00 0.41 H new ATOM 1100 N TYR A 73 1.679 8.529 5.635 1.00 0.28 N ATOM 1101 CA TYR A 73 2.636 7.977 6.617 1.00 0.24 C ATOM 1102 C TYR A 73 4.074 8.542 6.566 1.00 0.21 C ATOM 1103 O TYR A 73 4.474 9.260 5.635 1.00 0.27 O ATOM 1104 CB TYR A 73 2.751 6.469 6.419 1.00 0.36 C ATOM 1105 CG TYR A 73 1.456 5.668 6.567 1.00 0.33 C ATOM 1106 CD1 TYR A 73 1.039 5.192 7.809 1.00 0.48 C ATOM 1107 CD2 TYR A 73 0.672 5.349 5.452 1.00 0.47 C ATOM 1108 CE1 TYR A 73 -0.106 4.430 7.932 1.00 0.62 C ATOM 1109 CE2 TYR A 73 -0.477 4.594 5.580 1.00 0.63 C ATOM 1110 CZ TYR A 73 -0.858 4.137 6.819 1.00 0.68 C ATOM 1111 OH TYR A 73 -1.997 3.378 6.946 1.00 0.89 O ATOM 0 H TYR A 73 1.846 8.220 4.677 1.00 0.28 H new ATOM 0 HA TYR A 73 2.219 8.268 7.581 1.00 0.24 H new ATOM 0 HB2 TYR A 73 3.157 6.284 5.424 1.00 0.36 H new ATOM 0 HB3 TYR A 73 3.476 6.084 7.136 1.00 0.36 H new ATOM 0 HD1 TYR A 73 1.621 5.423 8.689 1.00 0.48 H new ATOM 0 HD2 TYR A 73 0.971 5.699 4.475 1.00 0.47 H new ATOM 0 HE1 TYR A 73 -0.410 4.065 8.902 1.00 0.62 H new ATOM 0 HE2 TYR A 73 -1.074 4.363 4.710 1.00 0.63 H new ATOM 0 HH TYR A 73 -2.391 3.524 7.832 1.00 0.89 H new ATOM 1121 N ASP A 74 4.848 8.122 7.598 1.00 0.17 N ATOM 1122 CA ASP A 74 6.259 8.503 7.802 1.00 0.16 C ATOM 1123 C ASP A 74 7.155 7.250 8.008 1.00 0.15 C ATOM 1124 O ASP A 74 6.940 6.466 8.941 1.00 0.24 O ATOM 1125 CB ASP A 74 6.387 9.414 9.047 1.00 0.21 C ATOM 1126 CG ASP A 74 6.136 10.895 8.772 1.00 0.26 C ATOM 1127 OD1 ASP A 74 5.211 11.207 7.994 1.00 0.51 O ATOM 1128 OD2 ASP A 74 6.861 11.736 9.344 1.00 0.40 O ATOM 0 H ASP A 74 4.497 7.497 8.323 1.00 0.17 H new ATOM 0 HA ASP A 74 6.591 9.035 6.910 1.00 0.16 H new ATOM 0 HB2 ASP A 74 5.683 9.073 9.806 1.00 0.21 H new ATOM 0 HB3 ASP A 74 7.387 9.299 9.466 1.00 0.21 H new ATOM 1133 N ILE A 75 8.166 7.081 7.129 1.00 0.10 N ATOM 1134 CA ILE A 75 9.128 5.950 7.198 1.00 0.09 C ATOM 1135 C ILE A 75 10.563 6.509 7.479 1.00 0.08 C ATOM 1136 O ILE A 75 11.167 7.089 6.583 1.00 0.12 O ATOM 1137 CB ILE A 75 9.147 5.065 5.867 1.00 0.11 C ATOM 1138 CG1 ILE A 75 7.736 4.649 5.404 1.00 0.13 C ATOM 1139 CG2 ILE A 75 9.965 3.751 6.013 1.00 0.14 C ATOM 1140 CD1 ILE A 75 7.124 5.488 4.307 1.00 0.15 C ATOM 0 H ILE A 75 8.341 7.720 6.353 1.00 0.10 H new ATOM 0 HA ILE A 75 8.802 5.297 8.008 1.00 0.09 H new ATOM 0 HB ILE A 75 9.616 5.722 5.134 1.00 0.11 H new ATOM 0 HG12 ILE A 75 7.778 3.615 5.063 1.00 0.13 H new ATOM 0 HG13 ILE A 75 7.070 4.673 6.267 1.00 0.13 H new ATOM 0 HG21 ILE A 75 9.937 3.198 5.074 1.00 0.14 H new ATOM 0 HG22 ILE A 75 10.999 3.992 6.261 1.00 0.14 H new ATOM 0 HG23 ILE A 75 9.534 3.140 6.806 1.00 0.14 H new ATOM 0 HD11 ILE A 75 6.134 5.103 4.064 1.00 0.15 H new ATOM 0 HD12 ILE A 75 7.039 6.521 4.644 1.00 0.15 H new ATOM 0 HD13 ILE A 75 7.757 5.446 3.421 1.00 0.15 H new ATOM 1152 N PRO A 76 11.130 6.354 8.715 1.00 0.09 N ATOM 1153 CA PRO A 76 12.499 6.826 9.016 1.00 0.10 C ATOM 1154 C PRO A 76 13.638 5.833 8.617 1.00 0.09 C ATOM 1155 O PRO A 76 13.708 4.712 9.131 1.00 0.11 O ATOM 1156 CB PRO A 76 12.436 7.051 10.527 1.00 0.14 C ATOM 1157 CG PRO A 76 11.515 5.961 11.024 1.00 0.15 C ATOM 1158 CD PRO A 76 10.487 5.761 9.918 1.00 0.12 C ATOM 0 HA PRO A 76 12.760 7.711 8.436 1.00 0.10 H new ATOM 0 HB2 PRO A 76 13.423 6.977 10.983 1.00 0.14 H new ATOM 0 HB3 PRO A 76 12.048 8.041 10.767 1.00 0.14 H new ATOM 0 HG2 PRO A 76 12.066 5.041 11.219 1.00 0.15 H new ATOM 0 HG3 PRO A 76 11.034 6.249 11.959 1.00 0.15 H new ATOM 0 HD2 PRO A 76 10.261 4.705 9.770 1.00 0.12 H new ATOM 0 HD3 PRO A 76 9.546 6.258 10.153 1.00 0.12 H new ATOM 1166 N ILE A 77 14.508 6.273 7.687 1.00 0.09 N ATOM 1167 CA ILE A 77 15.646 5.455 7.190 1.00 0.10 C ATOM 1168 C ILE A 77 17.002 6.217 7.364 1.00 0.13 C ATOM 1169 O ILE A 77 17.057 7.451 7.446 1.00 0.19 O ATOM 1170 CB ILE A 77 15.455 5.011 5.668 1.00 0.12 C ATOM 1171 CG1 ILE A 77 13.966 4.800 5.312 1.00 0.11 C ATOM 1172 CG2 ILE A 77 16.202 3.673 5.319 1.00 0.18 C ATOM 1173 CD1 ILE A 77 13.325 5.828 4.406 1.00 0.19 C ATOM 0 H ILE A 77 14.448 7.197 7.258 1.00 0.09 H new ATOM 0 HA ILE A 77 15.668 4.549 7.796 1.00 0.10 H new ATOM 0 HB ILE A 77 15.881 5.831 5.090 1.00 0.12 H new ATOM 0 HG12 ILE A 77 13.866 3.823 4.840 1.00 0.11 H new ATOM 0 HG13 ILE A 77 13.397 4.765 6.241 1.00 0.11 H new ATOM 0 HG21 ILE A 77 16.034 3.425 4.271 1.00 0.18 H new ATOM 0 HG22 ILE A 77 17.271 3.796 5.496 1.00 0.18 H new ATOM 0 HG23 ILE A 77 15.821 2.869 5.948 1.00 0.18 H new ATOM 0 HD11 ILE A 77 12.282 5.563 4.236 1.00 0.19 H new ATOM 0 HD12 ILE A 77 13.378 6.810 4.876 1.00 0.19 H new ATOM 0 HD13 ILE A 77 13.853 5.853 3.453 1.00 0.19 H new ATOM 1185 N LYS A 78 18.086 5.429 7.400 1.00 0.15 N ATOM 1186 CA LYS A 78 19.464 5.930 7.548 1.00 0.20 C ATOM 1187 C LYS A 78 20.489 5.044 6.776 1.00 0.21 C ATOM 1188 O LYS A 78 21.690 5.091 7.070 1.00 0.25 O ATOM 1189 CB LYS A 78 19.858 5.985 9.046 1.00 0.27 C ATOM 1190 CG LYS A 78 19.232 7.161 9.838 1.00 0.87 C ATOM 1191 CD LYS A 78 19.373 7.018 11.378 1.00 1.32 C ATOM 1192 CE LYS A 78 20.833 7.035 11.869 1.00 1.91 C ATOM 1193 NZ LYS A 78 20.907 7.139 13.353 1.00 2.53 N ATOM 0 H LYS A 78 18.032 4.413 7.326 1.00 0.15 H new ATOM 0 HA LYS A 78 19.491 6.933 7.122 1.00 0.20 H new ATOM 0 HB2 LYS A 78 19.564 5.048 9.520 1.00 0.27 H new ATOM 0 HB3 LYS A 78 20.943 6.052 9.120 1.00 0.27 H new ATOM 0 HG2 LYS A 78 19.704 8.092 9.523 1.00 0.87 H new ATOM 0 HG3 LYS A 78 18.175 7.237 9.584 1.00 0.87 H new ATOM 0 HD2 LYS A 78 18.827 7.828 11.861 1.00 1.32 H new ATOM 0 HD3 LYS A 78 18.904 6.086 11.692 1.00 1.32 H new ATOM 0 HE2 LYS A 78 21.339 6.127 11.541 1.00 1.91 H new ATOM 0 HE3 LYS A 78 21.360 7.875 11.417 1.00 1.91 H new ATOM 0 HZ1 LYS A 78 21.903 7.148 13.651 1.00 2.53 H new ATOM 0 HZ2 LYS A 78 20.445 8.018 13.663 1.00 2.53 H new ATOM 0 HZ3 LYS A 78 20.424 6.324 13.783 1.00 2.53 H new ATOM 1207 N GLU A 79 20.018 4.245 5.778 1.00 0.19 N ATOM 1208 CA GLU A 79 20.887 3.357 4.993 1.00 0.22 C ATOM 1209 C GLU A 79 20.635 3.498 3.477 1.00 0.20 C ATOM 1210 O GLU A 79 19.568 3.958 3.041 1.00 0.18 O ATOM 1211 CB GLU A 79 20.655 1.903 5.442 1.00 0.24 C ATOM 1212 CG GLU A 79 21.287 1.551 6.800 1.00 0.55 C ATOM 1213 CD GLU A 79 20.963 0.142 7.251 1.00 1.17 C ATOM 1214 OE1 GLU A 79 19.911 -0.048 7.899 1.00 2.12 O ATOM 1215 OE2 GLU A 79 21.760 -0.774 6.959 1.00 1.03 O ATOM 0 H GLU A 79 19.036 4.207 5.507 1.00 0.19 H new ATOM 0 HA GLU A 79 21.924 3.642 5.172 1.00 0.22 H new ATOM 0 HB2 GLU A 79 19.582 1.718 5.495 1.00 0.24 H new ATOM 0 HB3 GLU A 79 21.057 1.232 4.683 1.00 0.24 H new ATOM 0 HG2 GLU A 79 22.369 1.666 6.733 1.00 0.55 H new ATOM 0 HG3 GLU A 79 20.937 2.258 7.552 1.00 0.55 H new ATOM 1222 N GLU A 80 21.625 3.074 2.674 1.00 0.26 N ATOM 1223 CA GLU A 80 21.541 3.173 1.208 1.00 0.25 C ATOM 1224 C GLU A 80 21.550 1.809 0.489 1.00 0.27 C ATOM 1225 O GLU A 80 22.181 0.839 0.929 1.00 0.32 O ATOM 1226 CB GLU A 80 22.705 4.028 0.680 1.00 0.27 C ATOM 1227 CG GLU A 80 22.671 5.519 1.074 1.00 0.28 C ATOM 1228 CD GLU A 80 23.826 5.902 1.982 1.00 0.36 C ATOM 1229 OE1 GLU A 80 24.915 6.215 1.457 1.00 0.40 O ATOM 1230 OE2 GLU A 80 23.640 5.886 3.218 1.00 0.42 O ATOM 0 H GLU A 80 22.492 2.660 3.016 1.00 0.26 H new ATOM 0 HA GLU A 80 20.579 3.637 0.989 1.00 0.25 H new ATOM 0 HB2 GLU A 80 23.640 3.597 1.039 1.00 0.27 H new ATOM 0 HB3 GLU A 80 22.719 3.959 -0.408 1.00 0.27 H new ATOM 0 HG2 GLU A 80 22.702 6.131 0.173 1.00 0.28 H new ATOM 0 HG3 GLU A 80 21.729 5.738 1.576 1.00 0.28 H new ATOM 1237 N GLY A 81 20.843 1.785 -0.647 1.00 0.22 N ATOM 1238 CA GLY A 81 20.736 0.591 -1.485 1.00 0.23 C ATOM 1239 C GLY A 81 19.516 0.631 -2.400 1.00 0.19 C ATOM 1240 O GLY A 81 19.226 1.682 -2.996 1.00 0.18 O ATOM 0 H GLY A 81 20.332 2.591 -1.008 1.00 0.22 H new ATOM 0 HA2 GLY A 81 21.637 0.493 -2.090 1.00 0.23 H new ATOM 0 HA3 GLY A 81 20.681 -0.292 -0.849 1.00 0.23 H new ATOM 1244 N GLU A 82 18.790 -0.509 -2.549 1.00 0.20 N ATOM 1245 CA GLU A 82 17.586 -0.512 -3.393 1.00 0.17 C ATOM 1246 C GLU A 82 16.325 -0.789 -2.551 1.00 0.18 C ATOM 1247 O GLU A 82 16.049 -1.926 -2.188 1.00 0.30 O ATOM 1248 CB GLU A 82 17.708 -1.560 -4.513 1.00 0.19 C ATOM 1249 CG GLU A 82 18.866 -1.361 -5.517 1.00 0.26 C ATOM 1250 CD GLU A 82 18.809 -0.037 -6.267 1.00 0.86 C ATOM 1251 OE1 GLU A 82 17.962 0.093 -7.175 1.00 0.78 O ATOM 1252 OE2 GLU A 82 19.612 0.864 -5.943 1.00 1.75 O ATOM 0 H GLU A 82 19.014 -1.402 -2.110 1.00 0.20 H new ATOM 0 HA GLU A 82 17.494 0.476 -3.844 1.00 0.17 H new ATOM 0 HB2 GLU A 82 17.820 -2.541 -4.052 1.00 0.19 H new ATOM 0 HB3 GLU A 82 16.771 -1.575 -5.070 1.00 0.19 H new ATOM 0 HG2 GLU A 82 19.813 -1.424 -4.982 1.00 0.26 H new ATOM 0 HG3 GLU A 82 18.853 -2.178 -6.239 1.00 0.26 H new ATOM 1259 N TYR A 83 15.531 0.264 -2.276 1.00 0.08 N ATOM 1260 CA TYR A 83 14.306 0.124 -1.460 1.00 0.08 C ATOM 1261 C TYR A 83 13.066 0.050 -2.348 1.00 0.08 C ATOM 1262 O TYR A 83 12.853 0.891 -3.208 1.00 0.12 O ATOM 1263 CB TYR A 83 14.174 1.266 -0.439 1.00 0.10 C ATOM 1264 CG TYR A 83 15.232 1.231 0.672 1.00 0.11 C ATOM 1265 CD1 TYR A 83 16.539 1.662 0.434 1.00 0.16 C ATOM 1266 CD2 TYR A 83 14.934 0.759 1.953 1.00 0.17 C ATOM 1267 CE1 TYR A 83 17.499 1.627 1.421 1.00 0.18 C ATOM 1268 CE2 TYR A 83 15.895 0.722 2.941 1.00 0.19 C ATOM 1269 CZ TYR A 83 17.172 1.158 2.672 1.00 0.16 C ATOM 1270 OH TYR A 83 18.127 1.112 3.657 1.00 0.21 O ATOM 0 H TYR A 83 15.712 1.213 -2.603 1.00 0.08 H new ATOM 0 HA TYR A 83 14.388 -0.810 -0.904 1.00 0.08 H new ATOM 0 HB2 TYR A 83 14.243 2.219 -0.963 1.00 0.10 H new ATOM 0 HB3 TYR A 83 13.184 1.223 0.014 1.00 0.10 H new ATOM 0 HD1 TYR A 83 16.803 2.031 -0.546 1.00 0.16 H new ATOM 0 HD2 TYR A 83 13.933 0.417 2.173 1.00 0.17 H new ATOM 0 HE1 TYR A 83 18.503 1.966 1.214 1.00 0.18 H new ATOM 0 HE2 TYR A 83 15.646 0.351 3.924 1.00 0.19 H new ATOM 0 HH TYR A 83 17.731 0.756 4.480 1.00 0.21 H new ATOM 1280 N VAL A 84 12.247 -0.977 -2.120 1.00 0.08 N ATOM 1281 CA VAL A 84 11.044 -1.222 -2.960 1.00 0.10 C ATOM 1282 C VAL A 84 9.747 -1.016 -2.144 1.00 0.10 C ATOM 1283 O VAL A 84 9.525 -1.661 -1.113 1.00 0.10 O ATOM 1284 CB VAL A 84 11.017 -2.672 -3.679 1.00 0.11 C ATOM 1285 CG1 VAL A 84 10.237 -2.658 -5.024 1.00 0.13 C ATOM 1286 CG2 VAL A 84 12.412 -3.262 -3.978 1.00 0.20 C ATOM 0 H VAL A 84 12.381 -1.655 -1.370 1.00 0.08 H new ATOM 0 HA VAL A 84 11.102 -0.484 -3.760 1.00 0.10 H new ATOM 0 HB VAL A 84 10.515 -3.299 -2.942 1.00 0.11 H new ATOM 0 HG11 VAL A 84 10.251 -3.656 -5.463 1.00 0.13 H new ATOM 0 HG12 VAL A 84 9.206 -2.355 -4.843 1.00 0.13 H new ATOM 0 HG13 VAL A 84 10.707 -1.953 -5.710 1.00 0.13 H new ATOM 0 HG21 VAL A 84 12.301 -4.234 -4.459 1.00 0.20 H new ATOM 0 HG22 VAL A 84 12.957 -2.589 -4.640 1.00 0.20 H new ATOM 0 HG23 VAL A 84 12.965 -3.380 -3.046 1.00 0.20 H new ATOM 1296 N LEU A 85 8.895 -0.111 -2.660 1.00 0.12 N ATOM 1297 CA LEU A 85 7.600 0.184 -2.041 1.00 0.15 C ATOM 1298 C LEU A 85 6.459 -0.381 -2.906 1.00 0.16 C ATOM 1299 O LEU A 85 6.130 0.145 -3.978 1.00 0.21 O ATOM 1300 CB LEU A 85 7.458 1.712 -1.813 1.00 0.25 C ATOM 1301 CG LEU A 85 6.406 2.196 -0.756 1.00 0.43 C ATOM 1302 CD1 LEU A 85 6.943 3.357 0.075 1.00 0.78 C ATOM 1303 CD2 LEU A 85 5.098 2.636 -1.405 1.00 0.61 C ATOM 0 H LEU A 85 9.085 0.427 -3.506 1.00 0.12 H new ATOM 0 HA LEU A 85 7.541 -0.301 -1.067 1.00 0.15 H new ATOM 0 HB2 LEU A 85 8.433 2.099 -1.517 1.00 0.25 H new ATOM 0 HB3 LEU A 85 7.209 2.172 -2.769 1.00 0.25 H new ATOM 0 HG LEU A 85 6.214 1.337 -0.113 1.00 0.43 H new ATOM 0 HD11 LEU A 85 6.188 3.667 0.797 1.00 0.78 H new ATOM 0 HD12 LEU A 85 7.842 3.041 0.603 1.00 0.78 H new ATOM 0 HD13 LEU A 85 7.183 4.194 -0.581 1.00 0.78 H new ATOM 0 HD21 LEU A 85 4.401 2.963 -0.633 1.00 0.61 H new ATOM 0 HD22 LEU A 85 5.292 3.460 -2.091 1.00 0.61 H new ATOM 0 HD23 LEU A 85 4.665 1.800 -1.955 1.00 0.61 H new ATOM 1315 N VAL A 86 5.889 -1.489 -2.407 1.00 0.17 N ATOM 1316 CA VAL A 86 4.765 -2.201 -3.060 1.00 0.21 C ATOM 1317 C VAL A 86 3.529 -2.081 -2.130 1.00 0.21 C ATOM 1318 O VAL A 86 3.567 -2.480 -0.959 1.00 0.27 O ATOM 1319 CB VAL A 86 5.033 -3.761 -3.401 1.00 0.25 C ATOM 1320 CG1 VAL A 86 4.172 -4.266 -4.593 1.00 0.44 C ATOM 1321 CG2 VAL A 86 6.512 -4.118 -3.718 1.00 0.32 C ATOM 0 H VAL A 86 6.192 -1.923 -1.535 1.00 0.17 H new ATOM 0 HA VAL A 86 4.616 -1.727 -4.030 1.00 0.21 H new ATOM 0 HB VAL A 86 4.750 -4.260 -2.474 1.00 0.25 H new ATOM 0 HG11 VAL A 86 4.390 -5.317 -4.780 1.00 0.44 H new ATOM 0 HG12 VAL A 86 3.115 -4.152 -4.352 1.00 0.44 H new ATOM 0 HG13 VAL A 86 4.406 -3.683 -5.484 1.00 0.44 H new ATOM 0 HG21 VAL A 86 6.591 -5.184 -3.933 1.00 0.32 H new ATOM 0 HG22 VAL A 86 6.847 -3.547 -4.584 1.00 0.32 H new ATOM 0 HG23 VAL A 86 7.137 -3.874 -2.859 1.00 0.32 H new ATOM 1331 N LEU A 87 2.451 -1.517 -2.673 1.00 0.20 N ATOM 1332 CA LEU A 87 1.213 -1.341 -1.903 1.00 0.22 C ATOM 1333 C LEU A 87 -0.014 -1.827 -2.680 1.00 0.22 C ATOM 1334 O LEU A 87 -0.157 -1.561 -3.885 1.00 0.26 O ATOM 1335 CB LEU A 87 1.059 0.139 -1.407 1.00 0.31 C ATOM 1336 CG LEU A 87 0.561 1.239 -2.398 1.00 0.50 C ATOM 1337 CD1 LEU A 87 0.073 2.458 -1.617 1.00 1.25 C ATOM 1338 CD2 LEU A 87 1.645 1.695 -3.375 1.00 0.88 C ATOM 0 H LEU A 87 2.406 -1.176 -3.633 1.00 0.20 H new ATOM 0 HA LEU A 87 1.283 -1.969 -1.015 1.00 0.22 H new ATOM 0 HB2 LEU A 87 0.373 0.129 -0.560 1.00 0.31 H new ATOM 0 HB3 LEU A 87 2.030 0.458 -1.027 1.00 0.31 H new ATOM 0 HG LEU A 87 -0.248 0.792 -2.976 1.00 0.50 H new ATOM 0 HD11 LEU A 87 -0.273 3.222 -2.313 1.00 1.25 H new ATOM 0 HD12 LEU A 87 -0.748 2.166 -0.962 1.00 1.25 H new ATOM 0 HD13 LEU A 87 0.891 2.857 -1.018 1.00 1.25 H new ATOM 0 HD21 LEU A 87 1.239 2.459 -4.038 1.00 0.88 H new ATOM 0 HD22 LEU A 87 2.487 2.107 -2.818 1.00 0.88 H new ATOM 0 HD23 LEU A 87 1.983 0.844 -3.967 1.00 0.88 H new ATOM 1350 N LYS A 88 -0.910 -2.548 -1.971 1.00 0.23 N ATOM 1351 CA LYS A 88 -2.138 -3.085 -2.602 1.00 0.26 C ATOM 1352 C LYS A 88 -3.364 -2.194 -2.355 1.00 0.27 C ATOM 1353 O LYS A 88 -3.744 -1.919 -1.215 1.00 0.29 O ATOM 1354 CB LYS A 88 -2.442 -4.526 -2.113 1.00 0.31 C ATOM 1355 CG LYS A 88 -3.239 -5.417 -3.102 1.00 0.46 C ATOM 1356 CD LYS A 88 -2.361 -6.001 -4.248 1.00 1.53 C ATOM 1357 CE LYS A 88 -1.665 -7.316 -3.889 1.00 2.13 C ATOM 1358 NZ LYS A 88 -0.771 -7.782 -4.984 1.00 2.52 N ATOM 0 H LYS A 88 -0.811 -2.769 -0.980 1.00 0.23 H new ATOM 0 HA LYS A 88 -1.941 -3.102 -3.674 1.00 0.26 H new ATOM 0 HB2 LYS A 88 -1.497 -5.020 -1.887 1.00 0.31 H new ATOM 0 HB3 LYS A 88 -3.000 -4.463 -1.179 1.00 0.31 H new ATOM 0 HG2 LYS A 88 -3.699 -6.238 -2.551 1.00 0.46 H new ATOM 0 HG3 LYS A 88 -4.049 -4.831 -3.536 1.00 0.46 H new ATOM 0 HD2 LYS A 88 -2.987 -6.161 -5.126 1.00 1.53 H new ATOM 0 HD3 LYS A 88 -1.606 -5.265 -4.524 1.00 1.53 H new ATOM 0 HE2 LYS A 88 -1.084 -7.183 -2.976 1.00 2.13 H new ATOM 0 HE3 LYS A 88 -2.415 -8.080 -3.681 1.00 2.13 H new ATOM 0 HZ1 LYS A 88 -0.410 -8.730 -4.757 1.00 2.52 H new ATOM 0 HZ2 LYS A 88 -1.305 -7.819 -5.876 1.00 2.52 H new ATOM 0 HZ3 LYS A 88 0.027 -7.123 -5.085 1.00 2.52 H new ATOM 1372 N PHE A 89 -3.988 -1.775 -3.464 1.00 0.27 N ATOM 1373 CA PHE A 89 -5.189 -0.937 -3.427 1.00 0.29 C ATOM 1374 C PHE A 89 -6.430 -1.781 -3.792 1.00 0.31 C ATOM 1375 O PHE A 89 -6.429 -2.535 -4.773 1.00 0.32 O ATOM 1376 CB PHE A 89 -5.045 0.236 -4.428 1.00 0.30 C ATOM 1377 CG PHE A 89 -4.351 1.483 -3.875 1.00 0.28 C ATOM 1378 CD1 PHE A 89 -4.929 2.177 -2.814 1.00 0.36 C ATOM 1379 CD2 PHE A 89 -3.137 1.971 -4.397 1.00 0.25 C ATOM 1380 CE1 PHE A 89 -4.335 3.303 -2.288 1.00 0.40 C ATOM 1381 CE2 PHE A 89 -2.551 3.102 -3.863 1.00 0.26 C ATOM 1382 CZ PHE A 89 -3.146 3.767 -2.809 1.00 0.31 C ATOM 0 H PHE A 89 -3.675 -2.007 -4.407 1.00 0.27 H new ATOM 0 HA PHE A 89 -5.310 -0.537 -2.420 1.00 0.29 H new ATOM 0 HB2 PHE A 89 -4.488 -0.115 -5.297 1.00 0.30 H new ATOM 0 HB3 PHE A 89 -6.038 0.518 -4.778 1.00 0.30 H new ATOM 0 HD1 PHE A 89 -5.861 1.825 -2.396 1.00 0.36 H new ATOM 0 HD2 PHE A 89 -2.662 1.458 -5.220 1.00 0.25 H new ATOM 0 HE1 PHE A 89 -4.802 3.824 -1.465 1.00 0.40 H new ATOM 0 HE2 PHE A 89 -1.621 3.469 -4.272 1.00 0.26 H new ATOM 0 HZ PHE A 89 -2.681 4.649 -2.394 1.00 0.31 H new ATOM 1392 N ALA A 90 -7.499 -1.633 -2.983 1.00 0.33 N ATOM 1393 CA ALA A 90 -8.767 -2.403 -3.159 1.00 0.36 C ATOM 1394 C ALA A 90 -10.026 -1.496 -2.949 1.00 0.39 C ATOM 1395 O ALA A 90 -9.950 -0.415 -2.310 1.00 0.37 O ATOM 1396 CB ALA A 90 -8.801 -3.634 -2.187 1.00 0.41 C ATOM 0 H ALA A 90 -7.518 -0.986 -2.195 1.00 0.33 H new ATOM 0 HA ALA A 90 -8.794 -2.768 -4.186 1.00 0.36 H new ATOM 0 HB1 ALA A 90 -9.732 -4.184 -2.328 1.00 0.41 H new ATOM 0 HB2 ALA A 90 -7.956 -4.289 -2.400 1.00 0.41 H new ATOM 0 HB3 ALA A 90 -8.739 -3.285 -1.156 1.00 0.41 H new ATOM 1402 N GLU A 91 -11.186 -1.947 -3.502 1.00 0.46 N ATOM 1403 CA GLU A 91 -12.473 -1.226 -3.389 1.00 0.53 C ATOM 1404 C GLU A 91 -13.601 -2.105 -2.775 1.00 0.63 C ATOM 1405 O GLU A 91 -13.452 -3.324 -2.607 1.00 1.23 O ATOM 1406 CB GLU A 91 -12.909 -0.682 -4.776 1.00 0.78 C ATOM 1407 CG GLU A 91 -13.012 -1.743 -5.885 1.00 1.80 C ATOM 1408 CD GLU A 91 -13.538 -1.167 -7.183 1.00 2.04 C ATOM 1409 OE1 GLU A 91 -14.762 -0.934 -7.270 1.00 1.94 O ATOM 1410 OE2 GLU A 91 -12.730 -0.946 -8.110 1.00 2.61 O ATOM 0 H GLU A 91 -11.249 -2.815 -4.034 1.00 0.46 H new ATOM 0 HA GLU A 91 -12.312 -0.392 -2.706 1.00 0.53 H new ATOM 0 HB2 GLU A 91 -13.877 -0.193 -4.670 1.00 0.78 H new ATOM 0 HB3 GLU A 91 -12.198 0.083 -5.090 1.00 0.78 H new ATOM 0 HG2 GLU A 91 -12.030 -2.183 -6.057 1.00 1.80 H new ATOM 0 HG3 GLU A 91 -13.668 -2.548 -5.555 1.00 1.80 H new ATOM 1417 N VAL A 92 -14.741 -1.459 -2.451 1.00 0.60 N ATOM 1418 CA VAL A 92 -15.912 -2.160 -1.839 1.00 0.76 C ATOM 1419 C VAL A 92 -17.227 -1.946 -2.654 1.00 0.66 C ATOM 1420 O VAL A 92 -17.685 -2.868 -3.335 1.00 1.19 O ATOM 1421 CB VAL A 92 -16.167 -1.859 -0.275 1.00 1.42 C ATOM 1422 CG1 VAL A 92 -15.438 -2.885 0.617 1.00 2.13 C ATOM 1423 CG2 VAL A 92 -15.785 -0.423 0.212 1.00 2.00 C ATOM 0 H VAL A 92 -14.885 -0.460 -2.598 1.00 0.60 H new ATOM 0 HA VAL A 92 -15.624 -3.210 -1.890 1.00 0.76 H new ATOM 0 HB VAL A 92 -17.249 -1.941 -0.176 1.00 1.42 H new ATOM 0 HG11 VAL A 92 -15.629 -2.656 1.665 1.00 2.13 H new ATOM 0 HG12 VAL A 92 -15.803 -3.887 0.392 1.00 2.13 H new ATOM 0 HG13 VAL A 92 -14.366 -2.838 0.425 1.00 2.13 H new ATOM 0 HG21 VAL A 92 -15.998 -0.331 1.277 1.00 2.00 H new ATOM 0 HG22 VAL A 92 -14.723 -0.250 0.038 1.00 2.00 H new ATOM 0 HG23 VAL A 92 -16.368 0.315 -0.339 1.00 2.00 H new ATOM 1433 N TYR A 93 -17.820 -0.734 -2.573 1.00 0.76 N ATOM 1434 CA TYR A 93 -19.072 -0.413 -3.295 1.00 0.80 C ATOM 1435 C TYR A 93 -18.965 0.922 -4.073 1.00 0.86 C ATOM 1436 O TYR A 93 -19.631 1.909 -3.743 1.00 1.46 O ATOM 1437 CB TYR A 93 -20.298 -0.381 -2.324 1.00 1.23 C ATOM 1438 CG TYR A 93 -19.975 0.018 -0.869 1.00 0.97 C ATOM 1439 CD1 TYR A 93 -19.676 1.342 -0.532 1.00 1.01 C ATOM 1440 CD2 TYR A 93 -19.962 -0.930 0.164 1.00 1.14 C ATOM 1441 CE1 TYR A 93 -19.378 1.702 0.770 1.00 1.43 C ATOM 1442 CE2 TYR A 93 -19.661 -0.566 1.466 1.00 1.47 C ATOM 1443 CZ TYR A 93 -19.371 0.746 1.761 1.00 1.67 C ATOM 1444 OH TYR A 93 -19.073 1.103 3.055 1.00 2.27 O ATOM 0 H TYR A 93 -17.452 0.037 -2.016 1.00 0.76 H new ATOM 0 HA TYR A 93 -19.229 -1.210 -4.021 1.00 0.80 H new ATOM 0 HB2 TYR A 93 -21.036 0.317 -2.720 1.00 1.23 H new ATOM 0 HB3 TYR A 93 -20.762 -1.367 -2.319 1.00 1.23 H new ATOM 0 HD1 TYR A 93 -19.678 2.098 -1.303 1.00 1.01 H new ATOM 0 HD2 TYR A 93 -20.191 -1.962 -0.059 1.00 1.14 H new ATOM 0 HE1 TYR A 93 -19.151 2.731 1.009 1.00 1.43 H new ATOM 0 HE2 TYR A 93 -19.654 -1.311 2.248 1.00 1.47 H new ATOM 0 HH TYR A 93 -19.113 0.311 3.630 1.00 2.27 H new ATOM 1454 N PHE A 94 -18.107 0.929 -5.116 1.00 0.78 N ATOM 1455 CA PHE A 94 -17.888 2.109 -5.973 1.00 0.82 C ATOM 1456 C PHE A 94 -17.645 1.674 -7.426 1.00 0.76 C ATOM 1457 O PHE A 94 -16.548 1.221 -7.775 1.00 0.79 O ATOM 1458 CB PHE A 94 -16.678 2.940 -5.486 1.00 1.01 C ATOM 1459 CG PHE A 94 -16.915 3.740 -4.204 1.00 1.11 C ATOM 1460 CD1 PHE A 94 -17.484 5.014 -4.250 1.00 1.31 C ATOM 1461 CD2 PHE A 94 -16.563 3.222 -2.955 1.00 1.13 C ATOM 1462 CE1 PHE A 94 -17.693 5.743 -3.088 1.00 1.46 C ATOM 1463 CE2 PHE A 94 -16.772 3.948 -1.795 1.00 1.23 C ATOM 1464 CZ PHE A 94 -17.336 5.210 -1.861 1.00 1.37 C ATOM 0 H PHE A 94 -17.549 0.118 -5.385 1.00 0.78 H new ATOM 0 HA PHE A 94 -18.784 2.727 -5.917 1.00 0.82 H new ATOM 0 HB2 PHE A 94 -15.836 2.267 -5.326 1.00 1.01 H new ATOM 0 HB3 PHE A 94 -16.388 3.630 -6.278 1.00 1.01 H new ATOM 0 HD1 PHE A 94 -17.765 5.438 -5.203 1.00 1.31 H new ATOM 0 HD2 PHE A 94 -16.120 2.239 -2.894 1.00 1.13 H new ATOM 0 HE1 PHE A 94 -18.135 6.727 -3.141 1.00 1.46 H new ATOM 0 HE2 PHE A 94 -16.495 3.530 -0.839 1.00 1.23 H new ATOM 0 HZ PHE A 94 -17.497 5.778 -0.957 1.00 1.37 H new ATOM 1474 N ALA A 95 -18.689 1.812 -8.283 1.00 0.73 N ATOM 1475 CA ALA A 95 -18.600 1.428 -9.712 1.00 0.73 C ATOM 1476 C ALA A 95 -18.535 2.675 -10.645 1.00 0.72 C ATOM 1477 O ALA A 95 -19.540 3.360 -10.912 1.00 0.84 O ATOM 1478 CB ALA A 95 -19.760 0.466 -10.097 1.00 0.82 C ATOM 0 H ALA A 95 -19.598 2.185 -8.009 1.00 0.73 H new ATOM 0 HA ALA A 95 -17.664 0.888 -9.856 1.00 0.73 H new ATOM 0 HB1 ALA A 95 -19.675 0.197 -11.150 1.00 0.82 H new ATOM 0 HB2 ALA A 95 -19.703 -0.435 -9.486 1.00 0.82 H new ATOM 0 HB3 ALA A 95 -20.716 0.961 -9.925 1.00 0.82 H new ATOM 1484 N GLN A 96 -17.298 2.987 -11.085 1.00 0.65 N ATOM 1485 CA GLN A 96 -17.019 4.130 -11.984 1.00 0.66 C ATOM 1486 C GLN A 96 -15.603 4.051 -12.585 1.00 0.58 C ATOM 1487 O GLN A 96 -14.632 3.718 -11.895 1.00 0.53 O ATOM 1488 CB GLN A 96 -17.159 5.475 -11.231 1.00 0.72 C ATOM 1489 CG GLN A 96 -18.475 6.234 -11.481 1.00 1.40 C ATOM 1490 CD GLN A 96 -18.602 7.492 -10.634 1.00 1.85 C ATOM 1491 OE1 GLN A 96 -17.609 8.146 -10.308 1.00 2.38 O ATOM 1492 NE2 GLN A 96 -19.833 7.840 -10.275 1.00 2.45 N ATOM 0 H GLN A 96 -16.466 2.456 -10.829 1.00 0.65 H new ATOM 0 HA GLN A 96 -17.752 4.078 -12.789 1.00 0.66 H new ATOM 0 HB2 GLN A 96 -17.065 5.286 -10.162 1.00 0.72 H new ATOM 0 HB3 GLN A 96 -16.327 6.120 -11.515 1.00 0.72 H new ATOM 0 HG2 GLN A 96 -18.539 6.504 -12.535 1.00 1.40 H new ATOM 0 HG3 GLN A 96 -19.316 5.573 -11.270 1.00 1.40 H new ATOM 0 HE21 GLN A 96 -20.629 7.272 -10.565 1.00 2.45 H new ATOM 0 HE22 GLN A 96 -19.982 8.675 -9.709 1.00 2.45 H new ATOM 1501 N SER A 97 -15.498 4.403 -13.880 1.00 0.64 N ATOM 1502 CA SER A 97 -14.215 4.393 -14.609 1.00 0.62 C ATOM 1503 C SER A 97 -13.918 5.751 -15.259 1.00 0.81 C ATOM 1504 O SER A 97 -14.648 6.205 -16.149 1.00 1.66 O ATOM 1505 CB SER A 97 -14.212 3.311 -15.690 1.00 0.68 C ATOM 1506 OG SER A 97 -13.957 2.026 -15.146 1.00 0.73 O ATOM 0 H SER A 97 -16.292 4.700 -14.447 1.00 0.64 H new ATOM 0 HA SER A 97 -13.438 4.180 -13.875 1.00 0.62 H new ATOM 0 HB2 SER A 97 -15.175 3.305 -16.201 1.00 0.68 H new ATOM 0 HB3 SER A 97 -13.455 3.546 -16.438 1.00 0.68 H new ATOM 0 HG SER A 97 -13.964 1.359 -15.864 1.00 0.73 H new ATOM 1512 N GLN A 98 -12.815 6.392 -14.786 1.00 0.55 N ATOM 1513 CA GLN A 98 -12.317 7.740 -15.244 1.00 0.54 C ATOM 1514 C GLN A 98 -13.200 8.925 -14.733 1.00 0.56 C ATOM 1515 O GLN A 98 -13.606 9.811 -15.492 1.00 0.67 O ATOM 1516 CB GLN A 98 -12.150 7.808 -16.787 1.00 0.62 C ATOM 1517 CG GLN A 98 -11.012 6.931 -17.352 1.00 1.06 C ATOM 1518 CD GLN A 98 -9.622 7.499 -17.084 1.00 1.14 C ATOM 1519 OE1 GLN A 98 -9.431 8.715 -17.011 1.00 1.89 O ATOM 1520 NE2 GLN A 98 -8.641 6.614 -16.942 1.00 1.60 N ATOM 0 H GLN A 98 -12.227 5.985 -14.059 1.00 0.55 H new ATOM 0 HA GLN A 98 -11.333 7.855 -14.790 1.00 0.54 H new ATOM 0 HB2 GLN A 98 -13.088 7.507 -17.254 1.00 0.62 H new ATOM 0 HB3 GLN A 98 -11.969 8.844 -17.074 1.00 0.62 H new ATOM 0 HG2 GLN A 98 -11.080 5.934 -16.916 1.00 1.06 H new ATOM 0 HG3 GLN A 98 -11.150 6.818 -18.427 1.00 1.06 H new ATOM 0 HE21 GLN A 98 -8.841 5.616 -17.009 1.00 1.60 H new ATOM 0 HE22 GLN A 98 -7.688 6.933 -16.766 1.00 1.60 H new ATOM 1529 N GLN A 99 -13.462 8.895 -13.421 1.00 0.53 N ATOM 1530 CA GLN A 99 -14.289 9.882 -12.693 1.00 0.58 C ATOM 1531 C GLN A 99 -13.807 9.969 -11.235 1.00 0.57 C ATOM 1532 O GLN A 99 -13.729 11.058 -10.662 1.00 0.62 O ATOM 1533 CB GLN A 99 -15.786 9.499 -12.730 1.00 0.61 C ATOM 1534 CG GLN A 99 -16.523 9.901 -14.016 1.00 1.18 C ATOM 1535 CD GLN A 99 -17.960 9.413 -14.036 1.00 1.71 C ATOM 1536 OE1 GLN A 99 -18.246 8.314 -14.508 1.00 2.56 O ATOM 1537 NE2 GLN A 99 -18.872 10.230 -13.521 1.00 2.02 N ATOM 0 H GLN A 99 -13.096 8.163 -12.812 1.00 0.53 H new ATOM 0 HA GLN A 99 -14.181 10.851 -13.180 1.00 0.58 H new ATOM 0 HB2 GLN A 99 -15.874 8.420 -12.600 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -16.287 9.964 -11.881 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -16.509 10.986 -14.115 1.00 1.18 H new ATOM 0 HG3 GLN A 99 -15.992 9.496 -14.877 1.00 1.18 H new ATOM 0 HE21 GLN A 99 -18.590 11.133 -13.140 1.00 2.02 H new ATOM 0 HE22 GLN A 99 -19.854 9.954 -13.507 1.00 2.02 H new ATOM 1546 N LYS A 100 -13.486 8.782 -10.642 1.00 0.53 N ATOM 1547 CA LYS A 100 -12.929 8.670 -9.286 1.00 0.55 C ATOM 1548 C LYS A 100 -11.401 8.455 -9.400 1.00 0.48 C ATOM 1549 O LYS A 100 -10.890 7.335 -9.276 1.00 0.49 O ATOM 1550 CB LYS A 100 -13.588 7.495 -8.527 1.00 0.64 C ATOM 1551 CG LYS A 100 -15.065 7.725 -8.112 1.00 1.11 C ATOM 1552 CD LYS A 100 -15.205 8.516 -6.790 1.00 1.52 C ATOM 1553 CE LYS A 100 -16.679 8.783 -6.430 1.00 2.14 C ATOM 1554 NZ LYS A 100 -17.347 9.649 -7.438 1.00 2.76 N ATOM 0 H LYS A 100 -13.612 7.881 -11.104 1.00 0.53 H new ATOM 0 HA LYS A 100 -13.131 9.583 -8.726 1.00 0.55 H new ATOM 0 HB2 LYS A 100 -13.537 6.604 -9.153 1.00 0.64 H new ATOM 0 HB3 LYS A 100 -13.003 7.288 -7.631 1.00 0.64 H new ATOM 0 HG2 LYS A 100 -15.581 8.263 -8.907 1.00 1.11 H new ATOM 0 HG3 LYS A 100 -15.561 6.760 -8.006 1.00 1.11 H new ATOM 0 HD2 LYS A 100 -14.730 7.959 -5.982 1.00 1.52 H new ATOM 0 HD3 LYS A 100 -14.676 9.465 -6.878 1.00 1.52 H new ATOM 0 HE2 LYS A 100 -17.212 7.835 -6.355 1.00 2.14 H new ATOM 0 HE3 LYS A 100 -16.733 9.258 -5.450 1.00 2.14 H new ATOM 0 HZ1 LYS A 100 -18.278 9.944 -7.080 1.00 2.76 H new ATOM 0 HZ2 LYS A 100 -16.762 10.490 -7.616 1.00 2.76 H new ATOM 0 HZ3 LYS A 100 -17.469 9.119 -8.324 1.00 2.76 H new ATOM 1568 N VAL A 101 -10.693 9.573 -9.648 1.00 0.45 N ATOM 1569 CA VAL A 101 -9.218 9.587 -9.856 1.00 0.40 C ATOM 1570 C VAL A 101 -8.482 10.232 -8.654 1.00 0.41 C ATOM 1571 O VAL A 101 -8.816 11.337 -8.211 1.00 0.47 O ATOM 1572 CB VAL A 101 -8.737 10.258 -11.233 1.00 0.38 C ATOM 1573 CG1 VAL A 101 -8.566 9.201 -12.342 1.00 0.69 C ATOM 1574 CG2 VAL A 101 -9.641 11.402 -11.789 1.00 0.68 C ATOM 0 H VAL A 101 -11.121 10.497 -9.711 1.00 0.45 H new ATOM 0 HA VAL A 101 -8.943 8.535 -9.929 1.00 0.40 H new ATOM 0 HB VAL A 101 -7.786 10.717 -10.963 1.00 0.38 H new ATOM 0 HG11 VAL A 101 -8.240 9.688 -13.261 1.00 0.69 H new ATOM 0 HG12 VAL A 101 -7.820 8.468 -12.035 1.00 0.69 H new ATOM 0 HG13 VAL A 101 -9.518 8.699 -12.516 1.00 0.69 H new ATOM 0 HG21 VAL A 101 -9.219 11.779 -12.721 1.00 0.68 H new ATOM 0 HG22 VAL A 101 -10.643 11.016 -11.975 1.00 0.68 H new ATOM 0 HG23 VAL A 101 -9.693 12.211 -11.061 1.00 0.68 H new ATOM 1584 N PHE A 102 -7.461 9.514 -8.167 1.00 0.39 N ATOM 1585 CA PHE A 102 -6.689 9.926 -6.978 1.00 0.40 C ATOM 1586 C PHE A 102 -5.201 10.249 -7.245 1.00 0.38 C ATOM 1587 O PHE A 102 -4.680 10.032 -8.343 1.00 0.41 O ATOM 1588 CB PHE A 102 -6.774 8.780 -5.965 1.00 0.42 C ATOM 1589 CG PHE A 102 -8.192 8.477 -5.469 1.00 0.49 C ATOM 1590 CD1 PHE A 102 -8.934 9.442 -4.789 1.00 0.60 C ATOM 1591 CD2 PHE A 102 -8.795 7.234 -5.709 1.00 0.60 C ATOM 1592 CE1 PHE A 102 -10.226 9.177 -4.365 1.00 0.67 C ATOM 1593 CE2 PHE A 102 -10.085 6.972 -5.279 1.00 0.70 C ATOM 1594 CZ PHE A 102 -10.801 7.944 -4.608 1.00 0.69 C ATOM 0 H PHE A 102 -7.145 8.636 -8.580 1.00 0.39 H new ATOM 0 HA PHE A 102 -7.126 10.857 -6.617 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -6.361 7.879 -6.418 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -6.146 9.022 -5.107 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -8.496 10.409 -4.590 1.00 0.60 H new ATOM 0 HD2 PHE A 102 -8.245 6.469 -6.237 1.00 0.60 H new ATOM 0 HE1 PHE A 102 -10.787 9.938 -3.842 1.00 0.67 H new ATOM 0 HE2 PHE A 102 -10.531 6.007 -5.468 1.00 0.70 H new ATOM 0 HZ PHE A 102 -11.808 7.741 -4.274 1.00 0.69 H new ATOM 1604 N ASP A 103 -4.512 10.775 -6.199 1.00 0.36 N ATOM 1605 CA ASP A 103 -3.073 11.120 -6.307 1.00 0.34 C ATOM 1606 C ASP A 103 -2.234 10.390 -5.251 1.00 0.32 C ATOM 1607 O ASP A 103 -2.618 10.291 -4.085 1.00 0.34 O ATOM 1608 CB ASP A 103 -2.810 12.638 -6.219 1.00 0.37 C ATOM 1609 CG ASP A 103 -3.128 13.416 -7.497 1.00 0.85 C ATOM 1610 OD1 ASP A 103 -3.928 12.920 -8.317 1.00 1.30 O ATOM 1611 OD2 ASP A 103 -2.574 14.522 -7.669 1.00 1.33 O ATOM 0 H ASP A 103 -4.923 10.967 -5.285 1.00 0.36 H new ATOM 0 HA ASP A 103 -2.767 10.787 -7.299 1.00 0.34 H new ATOM 0 HB2 ASP A 103 -3.403 13.049 -5.402 1.00 0.37 H new ATOM 0 HB3 ASP A 103 -1.762 12.797 -5.964 1.00 0.37 H new ATOM 1616 N VAL A 104 -1.067 9.892 -5.690 1.00 0.29 N ATOM 1617 CA VAL A 104 -0.149 9.109 -4.833 1.00 0.28 C ATOM 1618 C VAL A 104 1.334 9.663 -4.976 1.00 0.26 C ATOM 1619 O VAL A 104 1.871 9.767 -6.099 1.00 0.25 O ATOM 1620 CB VAL A 104 -0.394 7.534 -5.168 1.00 0.33 C ATOM 1621 CG1 VAL A 104 0.833 6.603 -5.091 1.00 0.31 C ATOM 1622 CG2 VAL A 104 -1.468 6.933 -4.235 1.00 0.48 C ATOM 0 H VAL A 104 -0.730 10.018 -6.645 1.00 0.29 H new ATOM 0 HA VAL A 104 -0.347 9.218 -3.767 1.00 0.28 H new ATOM 0 HB VAL A 104 -0.699 7.565 -6.214 1.00 0.33 H new ATOM 0 HG11 VAL A 104 0.533 5.584 -5.336 1.00 0.31 H new ATOM 0 HG12 VAL A 104 1.590 6.939 -5.800 1.00 0.31 H new ATOM 0 HG13 VAL A 104 1.245 6.627 -4.082 1.00 0.31 H new ATOM 0 HG21 VAL A 104 -1.614 5.881 -4.478 1.00 0.48 H new ATOM 0 HG22 VAL A 104 -1.142 7.024 -3.199 1.00 0.48 H new ATOM 0 HG23 VAL A 104 -2.407 7.470 -4.368 1.00 0.48 H new ATOM 1632 N ARG A 105 1.970 9.961 -3.803 1.00 0.26 N ATOM 1633 CA ARG A 105 3.345 10.543 -3.743 1.00 0.26 C ATOM 1634 C ARG A 105 4.343 9.803 -2.801 1.00 0.23 C ATOM 1635 O ARG A 105 3.945 9.220 -1.783 1.00 0.26 O ATOM 1636 CB ARG A 105 3.270 12.000 -3.224 1.00 0.33 C ATOM 1637 CG ARG A 105 2.197 12.890 -3.880 1.00 0.53 C ATOM 1638 CD ARG A 105 2.347 14.366 -3.477 1.00 0.51 C ATOM 1639 NE ARG A 105 1.160 15.132 -3.827 1.00 0.92 N ATOM 1640 CZ ARG A 105 1.161 16.444 -4.071 1.00 1.25 C ATOM 1641 NH1 ARG A 105 2.275 17.154 -3.943 1.00 1.15 N ATOM 1642 NH2 ARG A 105 0.039 17.051 -4.431 1.00 1.69 N ATOM 0 H ARG A 105 1.550 9.807 -2.886 1.00 0.26 H new ATOM 0 HA ARG A 105 3.718 10.456 -4.764 1.00 0.26 H new ATOM 0 HB2 ARG A 105 3.087 11.974 -2.150 1.00 0.33 H new ATOM 0 HB3 ARG A 105 4.243 12.469 -3.370 1.00 0.33 H new ATOM 0 HG2 ARG A 105 2.266 12.802 -4.964 1.00 0.53 H new ATOM 0 HG3 ARG A 105 1.207 12.535 -3.594 1.00 0.53 H new ATOM 0 HD2 ARG A 105 2.525 14.436 -2.404 1.00 0.51 H new ATOM 0 HD3 ARG A 105 3.218 14.794 -3.973 1.00 0.51 H new ATOM 0 HE ARG A 105 0.272 14.635 -3.890 1.00 0.92 H new ATOM 0 HH11 ARG A 105 3.141 16.697 -3.656 1.00 1.15 H new ATOM 0 HH12 ARG A 105 2.265 18.156 -4.132 1.00 1.15 H new ATOM 0 HH21 ARG A 105 -0.824 16.515 -4.521 1.00 1.69 H new ATOM 0 HH22 ARG A 105 0.039 18.054 -4.618 1.00 1.69 H new ATOM 1656 N VAL A 106 5.667 9.891 -3.146 1.00 0.23 N ATOM 1657 CA VAL A 106 6.781 9.294 -2.321 1.00 0.23 C ATOM 1658 C VAL A 106 7.933 10.320 -2.042 1.00 0.22 C ATOM 1659 O VAL A 106 8.648 10.738 -2.955 1.00 0.23 O ATOM 1660 CB VAL A 106 7.402 7.904 -2.833 1.00 0.29 C ATOM 1661 CG1 VAL A 106 6.600 6.702 -2.296 1.00 0.57 C ATOM 1662 CG2 VAL A 106 7.537 7.753 -4.374 1.00 0.60 C ATOM 0 H VAL A 106 5.992 10.368 -3.987 1.00 0.23 H new ATOM 0 HA VAL A 106 6.264 9.045 -1.394 1.00 0.23 H new ATOM 0 HB VAL A 106 8.416 7.918 -2.432 1.00 0.29 H new ATOM 0 HG11 VAL A 106 7.045 5.776 -2.660 1.00 0.57 H new ATOM 0 HG12 VAL A 106 6.619 6.710 -1.206 1.00 0.57 H new ATOM 0 HG13 VAL A 106 5.568 6.769 -2.642 1.00 0.57 H new ATOM 0 HG21 VAL A 106 7.967 6.779 -4.608 1.00 0.60 H new ATOM 0 HG22 VAL A 106 6.553 7.836 -4.835 1.00 0.60 H new ATOM 0 HG23 VAL A 106 8.186 8.538 -4.761 1.00 0.60 H new ATOM 1672 N ASN A 107 8.079 10.702 -0.727 1.00 0.23 N ATOM 1673 CA ASN A 107 9.080 11.708 -0.169 1.00 0.23 C ATOM 1674 C ASN A 107 8.861 13.164 -0.667 1.00 0.24 C ATOM 1675 O ASN A 107 9.793 13.980 -0.692 1.00 0.25 O ATOM 1676 CB ASN A 107 10.532 11.302 -0.461 1.00 0.23 C ATOM 1677 CG ASN A 107 11.381 11.160 0.788 1.00 0.27 C ATOM 1678 OD1 ASN A 107 11.318 11.985 1.697 1.00 1.05 O ATOM 1679 ND2 ASN A 107 12.173 10.113 0.821 1.00 1.12 N ATOM 0 H ASN A 107 7.487 10.310 0.005 1.00 0.23 H new ATOM 0 HA ASN A 107 8.898 11.692 0.906 1.00 0.23 H new ATOM 0 HB2 ASN A 107 10.535 10.356 -1.003 1.00 0.23 H new ATOM 0 HB3 ASN A 107 10.985 12.046 -1.116 1.00 0.23 H new ATOM 0 HD21 ASN A 107 12.775 9.954 1.629 1.00 1.12 H new ATOM 0 HD22 ASN A 107 12.186 9.459 0.039 1.00 1.12 H new ATOM 1686 N GLY A 108 7.615 13.465 -1.039 1.00 0.25 N ATOM 1687 CA GLY A 108 7.268 14.769 -1.586 1.00 0.29 C ATOM 1688 C GLY A 108 7.072 14.767 -3.122 1.00 0.29 C ATOM 1689 O GLY A 108 6.497 15.704 -3.680 1.00 0.32 O ATOM 0 H GLY A 108 6.830 12.817 -0.969 1.00 0.25 H new ATOM 0 HA2 GLY A 108 6.351 15.120 -1.112 1.00 0.29 H new ATOM 0 HA3 GLY A 108 8.052 15.481 -1.330 1.00 0.29 H new ATOM 1693 N HIS A 109 7.567 13.685 -3.790 1.00 0.27 N ATOM 1694 CA HIS A 109 7.514 13.482 -5.242 1.00 0.28 C ATOM 1695 C HIS A 109 6.184 12.879 -5.758 1.00 0.30 C ATOM 1696 O HIS A 109 5.599 12.027 -5.105 1.00 0.57 O ATOM 1697 CB HIS A 109 8.625 12.486 -5.557 1.00 0.29 C ATOM 1698 CG HIS A 109 10.024 13.009 -5.383 1.00 0.31 C ATOM 1699 ND1 HIS A 109 10.648 13.815 -6.308 1.00 0.43 N ATOM 1700 CD2 HIS A 109 10.928 12.816 -4.384 1.00 0.27 C ATOM 1701 CE1 HIS A 109 11.870 14.094 -5.894 1.00 0.46 C ATOM 1702 NE2 HIS A 109 12.064 13.503 -4.730 1.00 0.36 N ATOM 0 H HIS A 109 8.025 12.914 -3.304 1.00 0.27 H new ATOM 0 HA HIS A 109 7.615 14.454 -5.726 1.00 0.28 H new ATOM 0 HB2 HIS A 109 8.499 11.612 -4.918 1.00 0.29 H new ATOM 0 HB3 HIS A 109 8.506 12.148 -6.586 1.00 0.29 H new ATOM 0 HD1 HIS A 109 10.231 14.145 -7.178 1.00 0.43 H new ATOM 0 HD2 HIS A 109 10.779 12.232 -3.488 1.00 0.27 H new ATOM 0 HE1 HIS A 109 12.590 14.704 -6.420 1.00 0.46 H new ATOM 1711 N THR A 110 5.733 13.299 -6.962 1.00 0.31 N ATOM 1712 CA THR A 110 4.486 12.739 -7.568 1.00 0.32 C ATOM 1713 C THR A 110 4.819 11.619 -8.572 1.00 0.35 C ATOM 1714 O THR A 110 5.610 11.806 -9.506 1.00 0.47 O ATOM 1715 CB THR A 110 3.554 13.773 -8.299 1.00 0.43 C ATOM 1716 OG1 THR A 110 4.194 15.047 -8.498 1.00 0.55 O ATOM 1717 CG2 THR A 110 2.215 13.981 -7.567 1.00 0.47 C ATOM 0 H THR A 110 6.197 14.008 -7.529 1.00 0.31 H new ATOM 0 HA THR A 110 3.932 12.369 -6.706 1.00 0.32 H new ATOM 0 HB THR A 110 3.350 13.332 -9.275 1.00 0.43 H new ATOM 0 HG1 THR A 110 3.577 15.655 -8.957 1.00 0.55 H new ATOM 0 HG21 THR A 110 1.610 14.704 -8.114 1.00 0.47 H new ATOM 0 HG22 THR A 110 1.681 13.032 -7.508 1.00 0.47 H new ATOM 0 HG23 THR A 110 2.405 14.354 -6.561 1.00 0.47 H new ATOM 1725 N VAL A 111 4.181 10.463 -8.364 1.00 0.29 N ATOM 1726 CA VAL A 111 4.418 9.270 -9.216 1.00 0.35 C ATOM 1727 C VAL A 111 3.144 8.789 -9.959 1.00 0.35 C ATOM 1728 O VAL A 111 3.146 8.729 -11.192 1.00 0.39 O ATOM 1729 CB VAL A 111 5.128 8.040 -8.473 1.00 0.38 C ATOM 1730 CG1 VAL A 111 6.662 8.191 -8.508 1.00 1.06 C ATOM 1731 CG2 VAL A 111 4.677 7.787 -7.002 1.00 1.00 C ATOM 0 H VAL A 111 3.498 10.318 -7.620 1.00 0.29 H new ATOM 0 HA VAL A 111 5.131 9.633 -9.956 1.00 0.35 H new ATOM 0 HB VAL A 111 4.802 7.168 -9.040 1.00 0.38 H new ATOM 0 HG11 VAL A 111 7.123 7.345 -7.998 1.00 1.06 H new ATOM 0 HG12 VAL A 111 7.001 8.219 -9.543 1.00 1.06 H new ATOM 0 HG13 VAL A 111 6.948 9.116 -8.007 1.00 1.06 H new ATOM 0 HG21 VAL A 111 5.220 6.933 -6.597 1.00 1.00 H new ATOM 0 HG22 VAL A 111 4.888 8.670 -6.400 1.00 1.00 H new ATOM 0 HG23 VAL A 111 3.607 7.580 -6.980 1.00 1.00 H new ATOM 1741 N VAL A 112 2.062 8.444 -9.213 1.00 0.33 N ATOM 1742 CA VAL A 112 0.810 7.972 -9.861 1.00 0.35 C ATOM 1743 C VAL A 112 -0.322 8.966 -9.510 1.00 0.34 C ATOM 1744 O VAL A 112 -1.037 8.797 -8.518 1.00 0.32 O ATOM 1745 CB VAL A 112 0.369 6.436 -9.534 1.00 0.37 C ATOM 1746 CG1 VAL A 112 -0.230 5.750 -10.786 1.00 0.44 C ATOM 1747 CG2 VAL A 112 1.513 5.521 -9.029 1.00 0.40 C ATOM 0 H VAL A 112 2.029 8.481 -8.194 1.00 0.33 H new ATOM 0 HA VAL A 112 1.009 7.949 -10.933 1.00 0.35 H new ATOM 0 HB VAL A 112 -0.361 6.544 -8.732 1.00 0.37 H new ATOM 0 HG11 VAL A 112 -0.515 4.727 -10.539 1.00 0.44 H new ATOM 0 HG12 VAL A 112 -1.109 6.302 -11.118 1.00 0.44 H new ATOM 0 HG13 VAL A 112 0.512 5.737 -11.584 1.00 0.44 H new ATOM 0 HG21 VAL A 112 1.122 4.521 -8.839 1.00 0.40 H new ATOM 0 HG22 VAL A 112 2.296 5.467 -9.785 1.00 0.40 H new ATOM 0 HG23 VAL A 112 1.926 5.930 -8.107 1.00 0.40 H new ATOM 1757 N LYS A 113 -0.471 10.000 -10.375 1.00 0.36 N ATOM 1758 CA LYS A 113 -1.491 11.041 -10.183 1.00 0.38 C ATOM 1759 C LYS A 113 -2.632 10.948 -11.230 1.00 0.43 C ATOM 1760 O LYS A 113 -2.784 11.771 -12.137 1.00 0.70 O ATOM 1761 CB LYS A 113 -0.804 12.449 -10.113 1.00 0.42 C ATOM 1762 CG LYS A 113 -0.377 13.120 -11.460 1.00 1.12 C ATOM 1763 CD LYS A 113 0.517 12.241 -12.379 1.00 1.27 C ATOM 1764 CE LYS A 113 1.918 11.974 -11.806 1.00 1.50 C ATOM 1765 NZ LYS A 113 2.767 11.225 -12.772 1.00 2.30 N ATOM 0 H LYS A 113 0.104 10.128 -11.207 1.00 0.36 H new ATOM 0 HA LYS A 113 -1.989 10.878 -9.227 1.00 0.38 H new ATOM 0 HB2 LYS A 113 -1.485 13.129 -9.601 1.00 0.42 H new ATOM 0 HB3 LYS A 113 0.084 12.358 -9.488 1.00 0.42 H new ATOM 0 HG2 LYS A 113 -1.276 13.397 -12.011 1.00 1.12 H new ATOM 0 HG3 LYS A 113 0.157 14.043 -11.235 1.00 1.12 H new ATOM 0 HD2 LYS A 113 0.018 11.288 -12.553 1.00 1.27 H new ATOM 0 HD3 LYS A 113 0.618 12.730 -13.348 1.00 1.27 H new ATOM 0 HE2 LYS A 113 2.397 12.921 -11.556 1.00 1.50 H new ATOM 0 HE3 LYS A 113 1.832 11.407 -10.879 1.00 1.50 H new ATOM 0 HZ1 LYS A 113 3.019 10.300 -12.368 1.00 2.30 H new ATOM 0 HZ2 LYS A 113 2.242 11.084 -13.659 1.00 2.30 H new ATOM 0 HZ3 LYS A 113 3.634 11.767 -12.965 1.00 2.30 H new ATOM 1779 N ASP A 114 -3.453 9.915 -10.992 1.00 0.37 N ATOM 1780 CA ASP A 114 -4.655 9.500 -11.775 1.00 0.42 C ATOM 1781 C ASP A 114 -4.914 8.005 -11.461 1.00 0.38 C ATOM 1782 O ASP A 114 -4.872 7.141 -12.344 1.00 0.40 O ATOM 1783 CB ASP A 114 -4.629 9.794 -13.352 1.00 0.50 C ATOM 1784 CG ASP A 114 -3.435 9.246 -14.184 1.00 1.70 C ATOM 1785 OD1 ASP A 114 -3.494 8.072 -14.607 1.00 2.48 O ATOM 1786 OD2 ASP A 114 -2.465 10.003 -14.404 1.00 2.09 O ATOM 0 H ASP A 114 -3.295 9.297 -10.196 1.00 0.37 H new ATOM 0 HA ASP A 114 -5.480 10.135 -11.452 1.00 0.42 H new ATOM 0 HB2 ASP A 114 -5.546 9.390 -13.781 1.00 0.50 H new ATOM 0 HB3 ASP A 114 -4.662 10.875 -13.489 1.00 0.50 H new ATOM 1791 N LEU A 115 -5.205 7.716 -10.175 1.00 0.36 N ATOM 1792 CA LEU A 115 -5.395 6.344 -9.724 1.00 0.36 C ATOM 1793 C LEU A 115 -6.870 5.938 -9.542 1.00 0.38 C ATOM 1794 O LEU A 115 -7.529 6.292 -8.560 1.00 0.42 O ATOM 1795 CB LEU A 115 -4.549 6.083 -8.460 1.00 0.38 C ATOM 1796 CG LEU A 115 -4.173 4.599 -8.138 1.00 0.35 C ATOM 1797 CD1 LEU A 115 -3.493 3.851 -9.296 1.00 1.13 C ATOM 1798 CD2 LEU A 115 -3.266 4.542 -6.925 1.00 1.06 C ATOM 0 H LEU A 115 -5.311 8.419 -9.443 1.00 0.36 H new ATOM 0 HA LEU A 115 -5.040 5.695 -10.524 1.00 0.36 H new ATOM 0 HB2 LEU A 115 -3.624 6.653 -8.550 1.00 0.38 H new ATOM 0 HB3 LEU A 115 -5.090 6.487 -7.604 1.00 0.38 H new ATOM 0 HG LEU A 115 -5.122 4.096 -7.950 1.00 0.35 H new ATOM 0 HD11 LEU A 115 -3.267 2.830 -8.987 1.00 1.13 H new ATOM 0 HD12 LEU A 115 -4.161 3.830 -10.157 1.00 1.13 H new ATOM 0 HD13 LEU A 115 -2.569 4.362 -9.566 1.00 1.13 H new ATOM 0 HD21 LEU A 115 -3.011 3.504 -6.710 1.00 1.06 H new ATOM 0 HD22 LEU A 115 -2.355 5.106 -7.125 1.00 1.06 H new ATOM 0 HD23 LEU A 115 -3.779 4.975 -6.066 1.00 1.06 H new ATOM 1810 N ASP A 116 -7.355 5.208 -10.567 1.00 0.39 N ATOM 1811 CA ASP A 116 -8.726 4.647 -10.626 1.00 0.43 C ATOM 1812 C ASP A 116 -8.660 3.092 -10.555 1.00 0.42 C ATOM 1813 O ASP A 116 -8.248 2.429 -11.517 1.00 0.43 O ATOM 1814 CB ASP A 116 -9.549 5.133 -11.891 1.00 0.46 C ATOM 1815 CG ASP A 116 -8.785 5.252 -13.233 1.00 1.55 C ATOM 1816 OD1 ASP A 116 -7.900 4.410 -13.492 1.00 2.35 O ATOM 1817 OD2 ASP A 116 -9.082 6.190 -14.003 1.00 1.83 O ATOM 0 H ASP A 116 -6.798 4.986 -11.392 1.00 0.39 H new ATOM 0 HA ASP A 116 -9.270 5.027 -9.761 1.00 0.43 H new ATOM 0 HB2 ASP A 116 -10.381 4.444 -12.037 1.00 0.46 H new ATOM 0 HB3 ASP A 116 -9.978 6.108 -11.660 1.00 0.46 H new ATOM 1822 N ILE A 117 -9.092 2.522 -9.399 1.00 0.42 N ATOM 1823 CA ILE A 117 -9.057 1.037 -9.128 1.00 0.42 C ATOM 1824 C ILE A 117 -10.086 0.184 -9.978 1.00 0.44 C ATOM 1825 O ILE A 117 -9.807 -0.985 -10.275 1.00 0.44 O ATOM 1826 CB ILE A 117 -9.195 0.712 -7.571 1.00 0.43 C ATOM 1827 CG1 ILE A 117 -8.815 1.934 -6.673 1.00 0.55 C ATOM 1828 CG2 ILE A 117 -8.315 -0.506 -7.148 1.00 0.49 C ATOM 1829 CD1 ILE A 117 -9.984 2.594 -5.945 1.00 0.68 C ATOM 0 H ILE A 117 -9.475 3.065 -8.625 1.00 0.42 H new ATOM 0 HA ILE A 117 -8.069 0.723 -9.465 1.00 0.42 H new ATOM 0 HB ILE A 117 -10.247 0.471 -7.418 1.00 0.43 H new ATOM 0 HG12 ILE A 117 -8.085 1.607 -5.933 1.00 0.55 H new ATOM 0 HG13 ILE A 117 -8.325 2.683 -7.295 1.00 0.55 H new ATOM 0 HG21 ILE A 117 -8.439 -0.692 -6.081 1.00 0.49 H new ATOM 0 HG22 ILE A 117 -8.622 -1.389 -7.708 1.00 0.49 H new ATOM 0 HG23 ILE A 117 -7.268 -0.289 -7.359 1.00 0.49 H new ATOM 0 HD11 ILE A 117 -9.617 3.430 -5.350 1.00 0.68 H new ATOM 0 HD12 ILE A 117 -10.708 2.958 -6.674 1.00 0.68 H new ATOM 0 HD13 ILE A 117 -10.463 1.866 -5.291 1.00 0.68 H new ATOM 1841 N PHE A 118 -11.225 0.797 -10.414 1.00 0.48 N ATOM 1842 CA PHE A 118 -12.260 0.110 -11.249 1.00 0.51 C ATOM 1843 C PHE A 118 -11.816 -0.039 -12.744 1.00 0.53 C ATOM 1844 O PHE A 118 -12.001 -1.100 -13.340 1.00 0.56 O ATOM 1845 CB PHE A 118 -13.593 0.885 -11.163 1.00 0.56 C ATOM 1846 CG PHE A 118 -14.824 0.091 -11.608 1.00 0.62 C ATOM 1847 CD1 PHE A 118 -15.385 -0.872 -10.773 1.00 0.65 C ATOM 1848 CD2 PHE A 118 -15.413 0.304 -12.858 1.00 0.68 C ATOM 1849 CE1 PHE A 118 -16.498 -1.596 -11.167 1.00 0.72 C ATOM 1850 CE2 PHE A 118 -16.526 -0.421 -13.253 1.00 0.75 C ATOM 1851 CZ PHE A 118 -17.068 -1.370 -12.408 1.00 0.77 C ATOM 0 H PHE A 118 -11.451 1.769 -10.201 1.00 0.48 H new ATOM 0 HA PHE A 118 -12.390 -0.897 -10.853 1.00 0.51 H new ATOM 0 HB2 PHE A 118 -13.741 1.213 -10.134 1.00 0.56 H new ATOM 0 HB3 PHE A 118 -13.516 1.783 -11.776 1.00 0.56 H new ATOM 0 HD1 PHE A 118 -14.946 -1.057 -9.804 1.00 0.65 H new ATOM 0 HD2 PHE A 118 -14.995 1.044 -13.525 1.00 0.68 H new ATOM 0 HE1 PHE A 118 -16.921 -2.337 -10.506 1.00 0.72 H new ATOM 0 HE2 PHE A 118 -16.970 -0.244 -14.222 1.00 0.75 H new ATOM 0 HZ PHE A 118 -17.936 -1.935 -12.715 1.00 0.77 H new ATOM 1861 N ASP A 119 -11.211 1.042 -13.322 1.00 0.52 N ATOM 1862 CA ASP A 119 -10.666 1.055 -14.717 1.00 0.54 C ATOM 1863 C ASP A 119 -9.323 0.247 -14.876 1.00 0.53 C ATOM 1864 O ASP A 119 -9.025 -0.235 -15.973 1.00 0.57 O ATOM 1865 CB ASP A 119 -10.468 2.519 -15.184 1.00 0.55 C ATOM 1866 CG ASP A 119 -10.737 2.754 -16.678 1.00 0.57 C ATOM 1867 OD1 ASP A 119 -11.628 2.085 -17.243 1.00 0.72 O ATOM 1868 OD2 ASP A 119 -10.042 3.601 -17.277 1.00 0.91 O ATOM 0 H ASP A 119 -11.087 1.929 -12.834 1.00 0.52 H new ATOM 0 HA ASP A 119 -11.399 0.551 -15.347 1.00 0.54 H new ATOM 0 HB2 ASP A 119 -11.127 3.164 -14.603 1.00 0.55 H new ATOM 0 HB3 ASP A 119 -9.446 2.823 -14.960 1.00 0.55 H new ATOM 1873 N ARG A 120 -8.527 0.112 -13.772 1.00 0.49 N ATOM 1874 CA ARG A 120 -7.242 -0.639 -13.777 1.00 0.48 C ATOM 1875 C ARG A 120 -7.418 -2.184 -13.702 1.00 0.50 C ATOM 1876 O ARG A 120 -6.945 -2.889 -14.599 1.00 0.54 O ATOM 1877 CB ARG A 120 -6.345 -0.174 -12.619 1.00 0.46 C ATOM 1878 CG ARG A 120 -5.675 1.215 -12.808 1.00 0.45 C ATOM 1879 CD ARG A 120 -4.565 1.225 -13.885 1.00 0.52 C ATOM 1880 NE ARG A 120 -5.110 1.201 -15.243 1.00 1.23 N ATOM 1881 CZ ARG A 120 -4.391 0.928 -16.330 1.00 1.49 C ATOM 1882 NH1 ARG A 120 -3.097 0.648 -16.226 1.00 1.03 N ATOM 1883 NH2 ARG A 120 -4.967 0.936 -17.524 1.00 2.43 N ATOM 0 H ARG A 120 -8.759 0.518 -12.865 1.00 0.49 H new ATOM 0 HA ARG A 120 -6.774 -0.418 -14.736 1.00 0.48 H new ATOM 0 HB2 ARG A 120 -6.942 -0.149 -11.707 1.00 0.46 H new ATOM 0 HB3 ARG A 120 -5.563 -0.918 -12.467 1.00 0.46 H new ATOM 0 HG2 ARG A 120 -6.439 1.944 -13.079 1.00 0.45 H new ATOM 0 HG3 ARG A 120 -5.250 1.537 -11.857 1.00 0.45 H new ATOM 0 HD2 ARG A 120 -3.947 2.114 -13.759 1.00 0.52 H new ATOM 0 HD3 ARG A 120 -3.914 0.362 -13.741 1.00 0.52 H new ATOM 0 HE ARG A 120 -6.102 1.406 -15.364 1.00 1.23 H new ATOM 0 HH11 ARG A 120 -2.649 0.641 -15.310 1.00 1.03 H new ATOM 0 HH12 ARG A 120 -2.551 0.440 -17.062 1.00 1.03 H new ATOM 0 HH21 ARG A 120 -5.960 1.151 -17.610 1.00 2.43 H new ATOM 0 HH22 ARG A 120 -4.417 0.727 -18.357 1.00 2.43 H new ATOM 1897 N VAL A 121 -8.096 -2.712 -12.645 1.00 0.48 N ATOM 1898 CA VAL A 121 -8.319 -4.198 -12.530 1.00 0.51 C ATOM 1899 C VAL A 121 -9.729 -4.692 -13.025 1.00 0.56 C ATOM 1900 O VAL A 121 -9.831 -5.817 -13.524 1.00 0.62 O ATOM 1901 CB VAL A 121 -7.993 -4.845 -11.098 1.00 0.53 C ATOM 1902 CG1 VAL A 121 -6.498 -5.207 -10.981 1.00 0.92 C ATOM 1903 CG2 VAL A 121 -8.393 -3.984 -9.861 1.00 0.93 C ATOM 0 H VAL A 121 -8.488 -2.161 -11.881 1.00 0.48 H new ATOM 0 HA VAL A 121 -7.565 -4.570 -13.224 1.00 0.51 H new ATOM 0 HB VAL A 121 -8.622 -5.735 -11.069 1.00 0.53 H new ATOM 0 HG11 VAL A 121 -6.305 -5.643 -10.001 1.00 0.92 H new ATOM 0 HG12 VAL A 121 -6.236 -5.927 -11.757 1.00 0.92 H new ATOM 0 HG13 VAL A 121 -5.895 -4.307 -11.103 1.00 0.92 H new ATOM 0 HG21 VAL A 121 -8.128 -4.515 -8.947 1.00 0.93 H new ATOM 0 HG22 VAL A 121 -7.863 -3.032 -9.894 1.00 0.93 H new ATOM 0 HG23 VAL A 121 -9.468 -3.802 -9.876 1.00 0.93 H new ATOM 1913 N GLY A 122 -10.792 -3.861 -12.889 1.00 0.57 N ATOM 1914 CA GLY A 122 -12.135 -4.262 -13.327 1.00 0.63 C ATOM 1915 C GLY A 122 -13.175 -4.169 -12.216 1.00 0.66 C ATOM 1916 O GLY A 122 -13.478 -3.077 -11.732 1.00 0.85 O ATOM 0 H GLY A 122 -10.739 -2.926 -12.485 1.00 0.57 H new ATOM 0 HA2 GLY A 122 -12.443 -3.630 -14.160 1.00 0.63 H new ATOM 0 HA3 GLY A 122 -12.099 -5.286 -13.699 1.00 0.63 H new ATOM 1920 N HIS A 123 -13.724 -5.329 -11.817 1.00 0.72 N ATOM 1921 CA HIS A 123 -14.725 -5.396 -10.733 1.00 0.87 C ATOM 1922 C HIS A 123 -14.164 -6.173 -9.526 1.00 0.73 C ATOM 1923 O HIS A 123 -14.009 -7.399 -9.569 1.00 1.34 O ATOM 1924 CB HIS A 123 -16.060 -6.021 -11.235 1.00 1.38 C ATOM 1925 CG HIS A 123 -15.913 -7.238 -12.121 1.00 1.76 C ATOM 1926 ND1 HIS A 123 -15.859 -7.161 -13.498 1.00 2.62 N ATOM 1927 CD2 HIS A 123 -15.814 -8.557 -11.820 1.00 2.27 C ATOM 1928 CE1 HIS A 123 -15.736 -8.375 -14.003 1.00 3.18 C ATOM 1929 NE2 HIS A 123 -15.705 -9.239 -13.006 1.00 3.01 N ATOM 0 H HIS A 123 -13.493 -6.234 -12.227 1.00 0.72 H new ATOM 0 HA HIS A 123 -14.943 -4.378 -10.410 1.00 0.87 H new ATOM 0 HB2 HIS A 123 -16.662 -6.294 -10.368 1.00 1.38 H new ATOM 0 HB3 HIS A 123 -16.615 -5.259 -11.782 1.00 1.38 H new ATOM 0 HD2 HIS A 123 -15.820 -8.990 -10.831 1.00 2.27 H new ATOM 0 HE1 HIS A 123 -15.672 -8.619 -15.053 1.00 3.18 H new ATOM 0 HE2 HIS A 123 -15.615 -10.250 -13.101 1.00 3.01 H new ATOM 1938 N SER A 124 -13.853 -5.409 -8.438 1.00 0.86 N ATOM 1939 CA SER A 124 -13.263 -5.917 -7.152 1.00 0.70 C ATOM 1940 C SER A 124 -11.748 -6.302 -7.313 1.00 0.99 C ATOM 1941 O SER A 124 -10.964 -5.470 -7.783 1.00 2.08 O ATOM 1942 CB SER A 124 -14.121 -7.071 -6.559 1.00 0.73 C ATOM 1943 OG SER A 124 -14.048 -7.107 -5.139 1.00 1.20 O ATOM 0 H SER A 124 -14.007 -4.401 -8.426 1.00 0.86 H new ATOM 0 HA SER A 124 -13.288 -5.102 -6.428 1.00 0.70 H new ATOM 0 HB2 SER A 124 -15.159 -6.947 -6.867 1.00 0.73 H new ATOM 0 HB3 SER A 124 -13.780 -8.023 -6.965 1.00 0.73 H new ATOM 0 HG SER A 124 -14.600 -7.843 -4.802 1.00 1.20 H new ATOM 1949 N THR A 125 -11.342 -7.549 -6.884 1.00 0.56 N ATOM 1950 CA THR A 125 -9.926 -8.130 -7.000 1.00 0.51 C ATOM 1951 C THR A 125 -8.788 -7.291 -6.297 1.00 0.48 C ATOM 1952 O THR A 125 -9.063 -6.351 -5.541 1.00 0.51 O ATOM 1953 CB THR A 125 -9.505 -8.486 -8.507 1.00 0.55 C ATOM 1954 OG1 THR A 125 -9.662 -7.377 -9.410 1.00 0.62 O ATOM 1955 CG2 THR A 125 -10.281 -9.693 -9.078 1.00 0.62 C ATOM 0 H THR A 125 -11.991 -8.198 -6.439 1.00 0.56 H new ATOM 0 HA THR A 125 -10.008 -9.059 -6.435 1.00 0.51 H new ATOM 0 HB THR A 125 -8.448 -8.741 -8.437 1.00 0.55 H new ATOM 0 HG1 THR A 125 -9.964 -6.589 -8.911 1.00 0.62 H new ATOM 0 HG21 THR A 125 -9.953 -9.886 -10.100 1.00 0.62 H new ATOM 0 HG22 THR A 125 -10.089 -10.573 -8.463 1.00 0.62 H new ATOM 0 HG23 THR A 125 -11.349 -9.474 -9.075 1.00 0.62 H new ATOM 1963 N ALA A 126 -7.502 -7.673 -6.538 1.00 0.46 N ATOM 1964 CA ALA A 126 -6.333 -6.968 -5.955 1.00 0.43 C ATOM 1965 C ALA A 126 -5.555 -6.109 -7.002 1.00 0.38 C ATOM 1966 O ALA A 126 -5.205 -6.582 -8.098 1.00 0.41 O ATOM 1967 CB ALA A 126 -5.379 -7.987 -5.281 1.00 0.46 C ATOM 0 H ALA A 126 -7.253 -8.464 -7.132 1.00 0.46 H new ATOM 0 HA ALA A 126 -6.721 -6.276 -5.208 1.00 0.43 H new ATOM 0 HB1 ALA A 126 -4.525 -7.460 -4.856 1.00 0.46 H new ATOM 0 HB2 ALA A 126 -5.911 -8.514 -4.489 1.00 0.46 H new ATOM 0 HB3 ALA A 126 -5.030 -8.705 -6.023 1.00 0.46 H new ATOM 1973 N HIS A 127 -5.310 -4.821 -6.648 1.00 0.34 N ATOM 1974 CA HIS A 127 -4.540 -3.875 -7.497 1.00 0.32 C ATOM 1975 C HIS A 127 -3.130 -3.661 -6.889 1.00 0.31 C ATOM 1976 O HIS A 127 -2.997 -3.451 -5.683 1.00 0.35 O ATOM 1977 CB HIS A 127 -5.278 -2.523 -7.620 1.00 0.32 C ATOM 1978 CG HIS A 127 -4.685 -1.570 -8.640 1.00 0.33 C ATOM 1979 ND1 HIS A 127 -4.114 -1.989 -9.828 1.00 0.35 N ATOM 1980 CD2 HIS A 127 -4.536 -0.221 -8.616 1.00 0.36 C ATOM 1981 CE1 HIS A 127 -3.638 -0.943 -10.479 1.00 0.38 C ATOM 1982 NE2 HIS A 127 -3.884 0.138 -9.767 1.00 0.38 N ATOM 0 H HIS A 127 -5.638 -4.412 -5.773 1.00 0.34 H new ATOM 0 HA HIS A 127 -4.443 -4.300 -8.496 1.00 0.32 H new ATOM 0 HB2 HIS A 127 -6.318 -2.715 -7.883 1.00 0.32 H new ATOM 0 HB3 HIS A 127 -5.280 -2.035 -6.645 1.00 0.32 H new ATOM 0 HD1 HIS A 127 -4.068 -2.955 -10.151 1.00 0.35 H new ATOM 0 HD2 HIS A 127 -4.869 0.446 -7.835 1.00 0.36 H new ATOM 0 HE1 HIS A 127 -3.133 -0.969 -11.433 1.00 0.38 H new ATOM 1991 N ASP A 128 -2.092 -3.663 -7.733 1.00 0.32 N ATOM 1992 CA ASP A 128 -0.707 -3.544 -7.230 1.00 0.33 C ATOM 1993 C ASP A 128 0.136 -2.435 -7.904 1.00 0.30 C ATOM 1994 O ASP A 128 0.156 -2.289 -9.132 1.00 0.42 O ATOM 1995 CB ASP A 128 0.045 -4.937 -7.261 1.00 0.45 C ATOM 1996 CG ASP A 128 0.144 -5.657 -8.631 1.00 1.70 C ATOM 1997 OD1 ASP A 128 -0.815 -6.369 -8.998 1.00 2.10 O ATOM 1998 OD2 ASP A 128 1.176 -5.494 -9.315 1.00 2.50 O ATOM 0 H ASP A 128 -2.174 -3.744 -8.747 1.00 0.32 H new ATOM 0 HA ASP A 128 -0.815 -3.226 -6.193 1.00 0.33 H new ATOM 0 HB2 ASP A 128 1.057 -4.783 -6.886 1.00 0.45 H new ATOM 0 HB3 ASP A 128 -0.456 -5.607 -6.562 1.00 0.45 H new ATOM 2003 N GLU A 129 0.829 -1.667 -7.048 1.00 0.25 N ATOM 2004 CA GLU A 129 1.732 -0.592 -7.481 1.00 0.30 C ATOM 2005 C GLU A 129 3.182 -0.878 -7.032 1.00 0.27 C ATOM 2006 O GLU A 129 3.472 -0.976 -5.826 1.00 0.25 O ATOM 2007 CB GLU A 129 1.263 0.760 -6.905 1.00 0.43 C ATOM 2008 CG GLU A 129 0.613 1.731 -7.914 1.00 0.91 C ATOM 2009 CD GLU A 129 -0.703 1.224 -8.482 1.00 0.76 C ATOM 2010 OE1 GLU A 129 -1.652 1.026 -7.695 1.00 1.56 O ATOM 2011 OE2 GLU A 129 -0.782 1.021 -9.712 1.00 1.12 O ATOM 0 H GLU A 129 0.778 -1.775 -6.035 1.00 0.25 H new ATOM 0 HA GLU A 129 1.709 -0.546 -8.570 1.00 0.30 H new ATOM 0 HB2 GLU A 129 0.548 0.565 -6.106 1.00 0.43 H new ATOM 0 HB3 GLU A 129 2.120 1.257 -6.452 1.00 0.43 H new ATOM 0 HG2 GLU A 129 0.443 2.690 -7.425 1.00 0.91 H new ATOM 0 HG3 GLU A 129 1.309 1.910 -8.734 1.00 0.91 H new ATOM 2018 N ILE A 130 4.080 -1.005 -8.034 1.00 0.28 N ATOM 2019 CA ILE A 130 5.522 -1.291 -7.820 1.00 0.28 C ATOM 2020 C ILE A 130 6.383 -0.051 -8.172 1.00 0.29 C ATOM 2021 O ILE A 130 6.485 0.345 -9.340 1.00 0.39 O ATOM 2022 CB ILE A 130 6.043 -2.536 -8.662 1.00 0.31 C ATOM 2023 CG1 ILE A 130 4.890 -3.322 -9.361 1.00 0.37 C ATOM 2024 CG2 ILE A 130 6.883 -3.518 -7.791 1.00 0.37 C ATOM 2025 CD1 ILE A 130 4.662 -2.967 -10.828 1.00 0.45 C ATOM 0 H ILE A 130 3.827 -0.912 -9.018 1.00 0.28 H new ATOM 0 HA ILE A 130 5.625 -1.537 -6.763 1.00 0.28 H new ATOM 0 HB ILE A 130 6.681 -2.111 -9.437 1.00 0.31 H new ATOM 0 HG12 ILE A 130 5.103 -4.389 -9.290 1.00 0.37 H new ATOM 0 HG13 ILE A 130 3.965 -3.144 -8.812 1.00 0.37 H new ATOM 0 HG21 ILE A 130 7.219 -4.353 -8.406 1.00 0.37 H new ATOM 0 HG22 ILE A 130 7.749 -2.995 -7.385 1.00 0.37 H new ATOM 0 HG23 ILE A 130 6.270 -3.894 -6.972 1.00 0.37 H new ATOM 0 HD11 ILE A 130 3.841 -3.565 -11.224 1.00 0.45 H new ATOM 0 HD12 ILE A 130 4.413 -1.909 -10.912 1.00 0.45 H new ATOM 0 HD13 ILE A 130 5.569 -3.173 -11.397 1.00 0.45 H new ATOM 2037 N ILE A 131 6.999 0.541 -7.133 1.00 0.21 N ATOM 2038 CA ILE A 131 7.847 1.738 -7.286 1.00 0.26 C ATOM 2039 C ILE A 131 9.259 1.503 -6.645 1.00 0.18 C ATOM 2040 O ILE A 131 9.411 1.698 -5.429 1.00 0.18 O ATOM 2041 CB ILE A 131 7.172 3.029 -6.640 1.00 0.34 C ATOM 2042 CG1 ILE A 131 5.611 2.891 -6.561 1.00 0.30 C ATOM 2043 CG2 ILE A 131 7.543 4.322 -7.445 1.00 0.62 C ATOM 2044 CD1 ILE A 131 4.979 3.261 -5.220 1.00 0.84 C ATOM 0 H ILE A 131 6.925 0.207 -6.172 1.00 0.21 H new ATOM 0 HA ILE A 131 7.961 1.914 -8.356 1.00 0.26 H new ATOM 0 HB ILE A 131 7.563 3.115 -5.626 1.00 0.34 H new ATOM 0 HG12 ILE A 131 5.170 3.519 -7.335 1.00 0.30 H new ATOM 0 HG13 ILE A 131 5.344 1.861 -6.796 1.00 0.30 H new ATOM 0 HG21 ILE A 131 7.069 5.187 -6.982 1.00 0.62 H new ATOM 0 HG22 ILE A 131 8.625 4.455 -7.441 1.00 0.62 H new ATOM 0 HG23 ILE A 131 7.194 4.224 -8.473 1.00 0.62 H new ATOM 0 HD11 ILE A 131 3.899 3.129 -5.278 1.00 0.84 H new ATOM 0 HD12 ILE A 131 5.382 2.617 -4.438 1.00 0.84 H new ATOM 0 HD13 ILE A 131 5.205 4.301 -4.986 1.00 0.84 H new ATOM 2056 N PRO A 132 10.313 1.033 -7.432 1.00 0.13 N ATOM 2057 CA PRO A 132 11.714 0.863 -6.910 1.00 0.09 C ATOM 2058 C PRO A 132 12.473 2.197 -6.722 1.00 0.08 C ATOM 2059 O PRO A 132 12.392 3.098 -7.562 1.00 0.16 O ATOM 2060 CB PRO A 132 12.420 0.017 -7.992 1.00 0.13 C ATOM 2061 CG PRO A 132 11.299 -0.577 -8.793 1.00 0.16 C ATOM 2062 CD PRO A 132 10.227 0.499 -8.816 1.00 0.16 C ATOM 0 HA PRO A 132 11.696 0.406 -5.921 1.00 0.09 H new ATOM 0 HB2 PRO A 132 13.071 0.631 -8.614 1.00 0.13 H new ATOM 0 HB3 PRO A 132 13.044 -0.758 -7.546 1.00 0.13 H new ATOM 0 HG2 PRO A 132 11.625 -0.832 -9.801 1.00 0.16 H new ATOM 0 HG3 PRO A 132 10.929 -1.495 -8.336 1.00 0.16 H new ATOM 0 HD2 PRO A 132 10.431 1.265 -9.564 1.00 0.16 H new ATOM 0 HD3 PRO A 132 9.241 0.091 -9.038 1.00 0.16 H new ATOM 2070 N ILE A 133 13.202 2.287 -5.603 1.00 0.07 N ATOM 2071 CA ILE A 133 13.957 3.490 -5.216 1.00 0.08 C ATOM 2072 C ILE A 133 15.477 3.157 -5.063 1.00 0.08 C ATOM 2073 O ILE A 133 15.858 2.053 -4.658 1.00 0.10 O ATOM 2074 CB ILE A 133 13.365 4.107 -3.861 1.00 0.15 C ATOM 2075 CG1 ILE A 133 11.800 3.946 -3.791 1.00 0.23 C ATOM 2076 CG2 ILE A 133 13.740 5.615 -3.688 1.00 0.30 C ATOM 2077 CD1 ILE A 133 11.211 3.604 -2.413 1.00 0.38 C ATOM 0 H ILE A 133 13.287 1.522 -4.934 1.00 0.07 H new ATOM 0 HA ILE A 133 13.853 4.236 -6.004 1.00 0.08 H new ATOM 0 HB ILE A 133 13.819 3.544 -3.046 1.00 0.15 H new ATOM 0 HG12 ILE A 133 11.345 4.874 -4.137 1.00 0.23 H new ATOM 0 HG13 ILE A 133 11.505 3.166 -4.492 1.00 0.23 H new ATOM 0 HG21 ILE A 133 13.317 5.990 -2.756 1.00 0.30 H new ATOM 0 HG22 ILE A 133 14.825 5.720 -3.663 1.00 0.30 H new ATOM 0 HG23 ILE A 133 13.340 6.188 -4.525 1.00 0.30 H new ATOM 0 HD11 ILE A 133 10.127 3.519 -2.492 1.00 0.38 H new ATOM 0 HD12 ILE A 133 11.625 2.658 -2.065 1.00 0.38 H new ATOM 0 HD13 ILE A 133 11.463 4.393 -1.704 1.00 0.38 H new ATOM 2089 N SER A 134 16.323 4.145 -5.396 1.00 0.10 N ATOM 2090 CA SER A 134 17.780 3.994 -5.283 1.00 0.12 C ATOM 2091 C SER A 134 18.423 5.199 -4.561 1.00 0.13 C ATOM 2092 O SER A 134 18.444 6.320 -5.079 1.00 0.15 O ATOM 2093 CB SER A 134 18.440 3.746 -6.673 1.00 0.15 C ATOM 2094 OG SER A 134 18.031 4.686 -7.668 1.00 1.31 O ATOM 0 H SER A 134 16.022 5.055 -5.745 1.00 0.10 H new ATOM 0 HA SER A 134 17.966 3.111 -4.671 1.00 0.12 H new ATOM 0 HB2 SER A 134 19.524 3.789 -6.566 1.00 0.15 H new ATOM 0 HB3 SER A 134 18.193 2.739 -7.010 1.00 0.15 H new ATOM 0 HG SER A 134 18.478 4.481 -8.515 1.00 1.31 H new ATOM 2100 N ILE A 135 18.939 4.931 -3.346 1.00 0.13 N ATOM 2101 CA ILE A 135 19.616 5.944 -2.505 1.00 0.15 C ATOM 2102 C ILE A 135 21.137 5.585 -2.421 1.00 0.18 C ATOM 2103 O ILE A 135 21.501 4.478 -2.007 1.00 0.18 O ATOM 2104 CB ILE A 135 18.920 6.054 -1.058 1.00 0.16 C ATOM 2105 CG1 ILE A 135 17.385 6.267 -1.190 1.00 0.13 C ATOM 2106 CG2 ILE A 135 19.513 7.185 -0.138 1.00 0.25 C ATOM 2107 CD1 ILE A 135 16.521 5.361 -0.298 1.00 0.15 C ATOM 0 H ILE A 135 18.900 4.006 -2.917 1.00 0.13 H new ATOM 0 HA ILE A 135 19.520 6.932 -2.955 1.00 0.15 H new ATOM 0 HB ILE A 135 19.135 5.101 -0.575 1.00 0.16 H new ATOM 0 HG12 ILE A 135 17.157 7.306 -0.955 1.00 0.13 H new ATOM 0 HG13 ILE A 135 17.100 6.106 -2.230 1.00 0.13 H new ATOM 0 HG21 ILE A 135 18.988 7.190 0.817 1.00 0.25 H new ATOM 0 HG22 ILE A 135 20.573 6.997 0.032 1.00 0.25 H new ATOM 0 HG23 ILE A 135 19.389 8.152 -0.625 1.00 0.25 H new ATOM 0 HD11 ILE A 135 15.467 5.586 -0.463 1.00 0.15 H new ATOM 0 HD12 ILE A 135 16.712 4.317 -0.546 1.00 0.15 H new ATOM 0 HD13 ILE A 135 16.770 5.537 0.749 1.00 0.15 H new ATOM 2119 N LYS A 136 21.993 6.545 -2.836 1.00 0.20 N ATOM 2120 CA LYS A 136 23.461 6.365 -2.837 1.00 0.23 C ATOM 2121 C LYS A 136 24.177 7.658 -2.442 1.00 0.28 C ATOM 2122 O LYS A 136 23.865 8.743 -2.957 1.00 0.29 O ATOM 2123 CB LYS A 136 23.947 5.902 -4.223 1.00 0.22 C ATOM 2124 CG LYS A 136 23.566 4.445 -4.549 1.00 0.25 C ATOM 2125 CD LYS A 136 23.694 4.110 -6.053 1.00 0.94 C ATOM 2126 CE LYS A 136 23.396 2.632 -6.352 1.00 1.23 C ATOM 2127 NZ LYS A 136 23.434 2.350 -7.815 1.00 2.05 N ATOM 0 H LYS A 136 21.689 7.457 -3.176 1.00 0.20 H new ATOM 0 HA LYS A 136 23.701 5.599 -2.100 1.00 0.23 H new ATOM 0 HB2 LYS A 136 23.528 6.559 -4.985 1.00 0.22 H new ATOM 0 HB3 LYS A 136 25.031 6.006 -4.274 1.00 0.22 H new ATOM 0 HG2 LYS A 136 24.204 3.772 -3.977 1.00 0.25 H new ATOM 0 HG3 LYS A 136 22.541 4.263 -4.228 1.00 0.25 H new ATOM 0 HD2 LYS A 136 23.009 4.738 -6.622 1.00 0.94 H new ATOM 0 HD3 LYS A 136 24.702 4.350 -6.391 1.00 0.94 H new ATOM 0 HE2 LYS A 136 24.124 2.003 -5.840 1.00 1.23 H new ATOM 0 HE3 LYS A 136 22.415 2.371 -5.956 1.00 1.23 H new ATOM 0 HZ1 LYS A 136 23.229 1.344 -7.980 1.00 2.05 H new ATOM 0 HZ2 LYS A 136 22.722 2.933 -8.300 1.00 2.05 H new ATOM 0 HZ3 LYS A 136 24.378 2.576 -8.188 1.00 2.05 H new ATOM 2141 N LYS A 137 25.127 7.533 -1.464 1.00 0.33 N ATOM 2142 CA LYS A 137 25.953 8.672 -0.901 1.00 0.40 C ATOM 2143 C LYS A 137 25.132 9.720 -0.073 1.00 0.39 C ATOM 2144 O LYS A 137 25.619 10.820 0.210 1.00 0.42 O ATOM 2145 CB LYS A 137 26.736 9.397 -2.025 1.00 0.44 C ATOM 2146 CG LYS A 137 27.792 8.515 -2.733 1.00 0.99 C ATOM 2147 CD LYS A 137 28.403 9.186 -3.995 1.00 1.59 C ATOM 2148 CE LYS A 137 27.524 9.032 -5.252 1.00 2.70 C ATOM 2149 NZ LYS A 137 28.132 9.707 -6.431 1.00 3.55 N ATOM 0 H LYS A 137 25.349 6.635 -1.035 1.00 0.33 H new ATOM 0 HA LYS A 137 26.645 8.200 -0.203 1.00 0.40 H new ATOM 0 HB2 LYS A 137 26.027 9.763 -2.768 1.00 0.44 H new ATOM 0 HB3 LYS A 137 27.233 10.270 -1.601 1.00 0.44 H new ATOM 0 HG2 LYS A 137 28.592 8.282 -2.030 1.00 0.99 H new ATOM 0 HG3 LYS A 137 27.333 7.569 -3.019 1.00 0.99 H new ATOM 0 HD2 LYS A 137 28.558 10.246 -3.796 1.00 1.59 H new ATOM 0 HD3 LYS A 137 29.384 8.752 -4.190 1.00 1.59 H new ATOM 0 HE2 LYS A 137 27.383 7.974 -5.471 1.00 2.70 H new ATOM 0 HE3 LYS A 137 26.537 9.452 -5.060 1.00 2.70 H new ATOM 0 HZ1 LYS A 137 27.514 9.583 -7.259 1.00 3.55 H new ATOM 0 HZ2 LYS A 137 28.244 10.721 -6.231 1.00 3.55 H new ATOM 0 HZ3 LYS A 137 29.063 9.289 -6.629 1.00 3.55 H new ATOM 2163 N GLY A 138 23.890 9.339 0.312 1.00 0.35 N ATOM 2164 CA GLY A 138 22.979 10.217 1.052 1.00 0.36 C ATOM 2165 C GLY A 138 21.920 10.937 0.181 1.00 0.33 C ATOM 2166 O GLY A 138 21.310 11.900 0.651 1.00 0.37 O ATOM 0 H GLY A 138 23.502 8.417 0.115 1.00 0.35 H new ATOM 0 HA2 GLY A 138 22.465 9.627 1.811 1.00 0.36 H new ATOM 0 HA3 GLY A 138 23.568 10.968 1.578 1.00 0.36 H new ATOM 2170 N LYS A 139 21.698 10.477 -1.087 1.00 0.29 N ATOM 2171 CA LYS A 139 20.699 11.112 -1.976 1.00 0.29 C ATOM 2172 C LYS A 139 19.716 10.100 -2.593 1.00 0.26 C ATOM 2173 O LYS A 139 20.052 8.939 -2.816 1.00 0.25 O ATOM 2174 CB LYS A 139 21.365 11.890 -3.119 1.00 0.33 C ATOM 2175 CG LYS A 139 22.449 12.910 -2.689 1.00 0.65 C ATOM 2176 CD LYS A 139 22.726 14.004 -3.757 1.00 0.67 C ATOM 2177 CE LYS A 139 23.012 13.434 -5.156 1.00 1.00 C ATOM 2178 NZ LYS A 139 23.648 14.451 -6.040 1.00 1.56 N ATOM 0 H LYS A 139 22.190 9.686 -1.501 1.00 0.29 H new ATOM 0 HA LYS A 139 20.144 11.795 -1.333 1.00 0.29 H new ATOM 0 HB2 LYS A 139 21.816 11.175 -3.807 1.00 0.33 H new ATOM 0 HB3 LYS A 139 20.591 12.421 -3.673 1.00 0.33 H new ATOM 0 HG2 LYS A 139 22.138 13.389 -1.761 1.00 0.65 H new ATOM 0 HG3 LYS A 139 23.376 12.377 -2.477 1.00 0.65 H new ATOM 0 HD2 LYS A 139 21.866 14.672 -3.814 1.00 0.67 H new ATOM 0 HD3 LYS A 139 23.577 14.606 -3.437 1.00 0.67 H new ATOM 0 HE2 LYS A 139 23.665 12.566 -5.070 1.00 1.00 H new ATOM 0 HE3 LYS A 139 22.081 13.089 -5.607 1.00 1.00 H new ATOM 0 HZ1 LYS A 139 23.827 14.034 -6.976 1.00 1.56 H new ATOM 0 HZ2 LYS A 139 23.013 15.269 -6.141 1.00 1.56 H new ATOM 0 HZ3 LYS A 139 24.548 14.761 -5.621 1.00 1.56 H new ATOM 2192 N LEU A 140 18.524 10.598 -2.970 1.00 0.25 N ATOM 2193 CA LEU A 140 17.439 9.762 -3.514 1.00 0.24 C ATOM 2194 C LEU A 140 17.247 9.882 -5.046 1.00 0.26 C ATOM 2195 O LEU A 140 17.476 10.931 -5.653 1.00 0.34 O ATOM 2196 CB LEU A 140 16.129 10.164 -2.803 1.00 0.24 C ATOM 2197 CG LEU A 140 15.013 9.087 -2.661 1.00 0.22 C ATOM 2198 CD1 LEU A 140 14.462 9.041 -1.244 1.00 0.22 C ATOM 2199 CD2 LEU A 140 13.866 9.341 -3.624 1.00 0.25 C ATOM 0 H LEU A 140 18.287 11.588 -2.906 1.00 0.25 H new ATOM 0 HA LEU A 140 17.710 8.722 -3.331 1.00 0.24 H new ATOM 0 HB2 LEU A 140 16.386 10.513 -1.803 1.00 0.24 H new ATOM 0 HB3 LEU A 140 15.706 11.014 -3.338 1.00 0.24 H new ATOM 0 HG LEU A 140 15.476 8.130 -2.900 1.00 0.22 H new ATOM 0 HD11 LEU A 140 13.685 8.279 -1.180 1.00 0.22 H new ATOM 0 HD12 LEU A 140 15.266 8.799 -0.549 1.00 0.22 H new ATOM 0 HD13 LEU A 140 14.039 10.012 -0.986 1.00 0.22 H new ATOM 0 HD21 LEU A 140 13.106 8.570 -3.496 1.00 0.25 H new ATOM 0 HD22 LEU A 140 13.429 10.318 -3.420 1.00 0.25 H new ATOM 0 HD23 LEU A 140 14.239 9.317 -4.648 1.00 0.25 H new ATOM 2211 N SER A 141 16.808 8.764 -5.643 1.00 0.21 N ATOM 2212 CA SER A 141 16.520 8.675 -7.077 1.00 0.22 C ATOM 2213 C SER A 141 15.181 7.955 -7.316 1.00 0.19 C ATOM 2214 O SER A 141 15.054 6.748 -7.049 1.00 0.16 O ATOM 2215 CB SER A 141 17.644 7.925 -7.804 1.00 0.25 C ATOM 2216 OG SER A 141 18.686 8.800 -8.196 1.00 0.64 O ATOM 0 H SER A 141 16.643 7.893 -5.139 1.00 0.21 H new ATOM 0 HA SER A 141 16.453 9.689 -7.472 1.00 0.22 H new ATOM 0 HB2 SER A 141 18.046 7.149 -7.152 1.00 0.25 H new ATOM 0 HB3 SER A 141 17.239 7.424 -8.683 1.00 0.25 H new ATOM 0 HG SER A 141 19.386 8.290 -8.655 1.00 0.64 H new ATOM 2222 N VAL A 142 14.180 8.711 -7.815 1.00 0.21 N ATOM 2223 CA VAL A 142 12.838 8.160 -8.106 1.00 0.22 C ATOM 2224 C VAL A 142 12.583 8.157 -9.679 1.00 0.25 C ATOM 2225 O VAL A 142 12.128 9.148 -10.254 1.00 0.26 O ATOM 2226 CB VAL A 142 11.686 8.886 -7.185 1.00 0.27 C ATOM 2227 CG1 VAL A 142 11.318 10.351 -7.557 1.00 0.46 C ATOM 2228 CG2 VAL A 142 10.395 8.046 -7.096 1.00 0.41 C ATOM 0 H VAL A 142 14.275 9.705 -8.025 1.00 0.21 H new ATOM 0 HA VAL A 142 12.778 7.113 -7.809 1.00 0.22 H new ATOM 0 HB VAL A 142 12.175 8.944 -6.212 1.00 0.27 H new ATOM 0 HG11 VAL A 142 10.548 10.717 -6.877 1.00 0.46 H new ATOM 0 HG12 VAL A 142 12.204 10.981 -7.475 1.00 0.46 H new ATOM 0 HG13 VAL A 142 10.944 10.383 -8.580 1.00 0.46 H new ATOM 0 HG21 VAL A 142 9.664 8.567 -6.477 1.00 0.41 H new ATOM 0 HG22 VAL A 142 9.986 7.900 -8.096 1.00 0.41 H new ATOM 0 HG23 VAL A 142 10.621 7.077 -6.652 1.00 0.41 H new ATOM 2238 N GLN A 143 12.920 7.004 -10.344 1.00 0.31 N ATOM 2239 CA GLN A 143 12.767 6.768 -11.834 1.00 0.39 C ATOM 2240 C GLN A 143 13.632 7.716 -12.726 1.00 0.41 C ATOM 2241 O GLN A 143 14.735 7.349 -13.141 1.00 0.46 O ATOM 2242 CB GLN A 143 11.271 6.818 -12.278 1.00 0.44 C ATOM 2243 CG GLN A 143 10.421 5.569 -11.937 1.00 0.65 C ATOM 2244 CD GLN A 143 9.763 5.655 -10.572 1.00 0.87 C ATOM 2245 OE1 GLN A 143 8.630 6.113 -10.448 1.00 1.56 O ATOM 2246 NE2 GLN A 143 10.475 5.213 -9.540 1.00 1.12 N ATOM 0 H GLN A 143 13.312 6.197 -9.859 1.00 0.31 H new ATOM 0 HA GLN A 143 13.152 5.761 -11.996 1.00 0.39 H new ATOM 0 HB2 GLN A 143 10.804 7.688 -11.816 1.00 0.44 H new ATOM 0 HB3 GLN A 143 11.237 6.973 -13.356 1.00 0.44 H new ATOM 0 HG2 GLN A 143 9.651 5.441 -12.698 1.00 0.65 H new ATOM 0 HG3 GLN A 143 11.055 4.683 -11.973 1.00 0.65 H new ATOM 0 HE21 GLN A 143 11.413 4.840 -9.690 1.00 1.12 H new ATOM 0 HE22 GLN A 143 10.084 5.246 -8.599 1.00 1.12 H new ATOM 2255 N GLY A 144 13.100 8.927 -13.000 1.00 0.40 N ATOM 2256 CA GLY A 144 13.811 9.935 -13.793 1.00 0.45 C ATOM 2257 C GLY A 144 13.903 11.315 -13.107 1.00 0.42 C ATOM 2258 O GLY A 144 13.981 12.338 -13.794 1.00 0.49 O ATOM 0 H GLY A 144 12.178 9.224 -12.680 1.00 0.40 H new ATOM 0 HA2 GLY A 144 14.819 9.575 -14.002 1.00 0.45 H new ATOM 0 HA3 GLY A 144 13.308 10.050 -14.753 1.00 0.45 H new ATOM 2262 N GLU A 145 13.894 11.337 -11.751 1.00 0.33 N ATOM 2263 CA GLU A 145 13.992 12.577 -10.963 1.00 0.32 C ATOM 2264 C GLU A 145 14.954 12.375 -9.779 1.00 0.27 C ATOM 2265 O GLU A 145 14.714 11.540 -8.902 1.00 0.36 O ATOM 2266 CB GLU A 145 12.593 13.007 -10.457 1.00 0.37 C ATOM 2267 CG GLU A 145 12.386 14.527 -10.347 1.00 0.80 C ATOM 2268 CD GLU A 145 11.028 14.889 -9.774 1.00 1.16 C ATOM 2269 OE1 GLU A 145 10.006 14.513 -10.385 1.00 1.53 O ATOM 2270 OE2 GLU A 145 10.986 15.548 -8.713 1.00 1.82 O ATOM 0 H GLU A 145 13.819 10.495 -11.181 1.00 0.33 H new ATOM 0 HA GLU A 145 14.384 13.369 -11.601 1.00 0.32 H new ATOM 0 HB2 GLU A 145 11.838 12.599 -11.129 1.00 0.37 H new ATOM 0 HB3 GLU A 145 12.423 12.560 -9.478 1.00 0.37 H new ATOM 0 HG2 GLU A 145 13.167 14.952 -9.717 1.00 0.80 H new ATOM 0 HG3 GLU A 145 12.492 14.977 -11.334 1.00 0.80 H new ATOM 2277 N VAL A 146 16.038 13.174 -9.755 1.00 0.30 N ATOM 2278 CA VAL A 146 17.077 13.077 -8.700 1.00 0.27 C ATOM 2279 C VAL A 146 16.990 14.273 -7.662 1.00 0.28 C ATOM 2280 O VAL A 146 16.879 15.448 -8.035 1.00 0.32 O ATOM 2281 CB VAL A 146 18.541 12.832 -9.376 1.00 0.31 C ATOM 2282 CG1 VAL A 146 19.194 14.059 -10.090 1.00 1.02 C ATOM 2283 CG2 VAL A 146 19.565 12.202 -8.394 1.00 0.72 C ATOM 0 H VAL A 146 16.221 13.895 -10.452 1.00 0.30 H new ATOM 0 HA VAL A 146 16.890 12.199 -8.082 1.00 0.27 H new ATOM 0 HB VAL A 146 18.300 12.122 -10.167 1.00 0.31 H new ATOM 0 HG11 VAL A 146 20.162 13.770 -10.498 1.00 1.02 H new ATOM 0 HG12 VAL A 146 18.546 14.397 -10.899 1.00 1.02 H new ATOM 0 HG13 VAL A 146 19.330 14.868 -9.372 1.00 1.02 H new ATOM 0 HG21 VAL A 146 20.519 12.064 -8.903 1.00 0.72 H new ATOM 0 HG22 VAL A 146 19.702 12.863 -7.538 1.00 0.72 H new ATOM 0 HG23 VAL A 146 19.193 11.236 -8.051 1.00 0.72 H new ATOM 2293 N SER A 147 17.040 13.909 -6.369 1.00 0.27 N ATOM 2294 CA SER A 147 16.990 14.862 -5.248 1.00 0.29 C ATOM 2295 C SER A 147 17.770 14.294 -4.043 1.00 0.29 C ATOM 2296 O SER A 147 18.374 13.221 -4.129 1.00 0.30 O ATOM 2297 CB SER A 147 15.531 15.150 -4.844 1.00 0.31 C ATOM 2298 OG SER A 147 14.979 16.209 -5.611 1.00 0.56 O ATOM 0 H SER A 147 17.117 12.937 -6.071 1.00 0.27 H new ATOM 0 HA SER A 147 17.450 15.798 -5.566 1.00 0.29 H new ATOM 0 HB2 SER A 147 14.931 14.250 -4.979 1.00 0.31 H new ATOM 0 HB3 SER A 147 15.489 15.406 -3.785 1.00 0.31 H new ATOM 0 HG SER A 147 15.395 16.222 -6.498 1.00 0.56 H new ATOM 2304 N THR A 148 17.811 15.035 -2.929 1.00 0.30 N ATOM 2305 CA THR A 148 18.515 14.560 -1.715 1.00 0.31 C ATOM 2306 C THR A 148 17.546 14.024 -0.591 1.00 0.27 C ATOM 2307 O THR A 148 16.496 14.615 -0.310 1.00 0.32 O ATOM 2308 CB THR A 148 19.624 15.603 -1.193 1.00 0.44 C ATOM 2309 OG1 THR A 148 20.380 15.053 -0.098 1.00 1.25 O ATOM 2310 CG2 THR A 148 19.096 17.002 -0.771 1.00 0.99 C ATOM 0 H THR A 148 17.375 15.952 -2.835 1.00 0.30 H new ATOM 0 HA THR A 148 19.077 13.677 -2.020 1.00 0.31 H new ATOM 0 HB THR A 148 20.249 15.764 -2.071 1.00 0.44 H new ATOM 0 HG1 THR A 148 21.048 15.706 0.199 1.00 1.25 H new ATOM 0 HG21 THR A 148 19.930 17.620 -0.437 1.00 0.99 H new ATOM 0 HG22 THR A 148 18.609 17.479 -1.621 1.00 0.99 H new ATOM 0 HG23 THR A 148 18.379 16.890 0.042 1.00 0.99 H new ATOM 2318 N PHE A 149 17.957 12.888 0.037 1.00 0.26 N ATOM 2319 CA PHE A 149 17.215 12.224 1.156 1.00 0.24 C ATOM 2320 C PHE A 149 17.536 12.891 2.518 1.00 0.24 C ATOM 2321 O PHE A 149 18.705 12.971 2.918 1.00 0.29 O ATOM 2322 CB PHE A 149 17.591 10.707 1.226 1.00 0.23 C ATOM 2323 CG PHE A 149 16.960 9.937 2.409 1.00 0.22 C ATOM 2324 CD1 PHE A 149 15.594 9.637 2.438 1.00 0.22 C ATOM 2325 CD2 PHE A 149 17.732 9.562 3.517 1.00 0.24 C ATOM 2326 CE1 PHE A 149 15.029 8.999 3.525 1.00 0.24 C ATOM 2327 CE2 PHE A 149 17.163 8.914 4.596 1.00 0.26 C ATOM 2328 CZ PHE A 149 15.812 8.638 4.601 1.00 0.25 C ATOM 0 H PHE A 149 18.817 12.401 -0.217 1.00 0.26 H new ATOM 0 HA PHE A 149 16.149 12.333 0.957 1.00 0.24 H new ATOM 0 HB2 PHE A 149 17.287 10.228 0.295 1.00 0.23 H new ATOM 0 HB3 PHE A 149 18.676 10.618 1.290 1.00 0.23 H new ATOM 0 HD1 PHE A 149 14.972 9.908 1.598 1.00 0.22 H new ATOM 0 HD2 PHE A 149 18.789 9.783 3.527 1.00 0.24 H new ATOM 0 HE1 PHE A 149 13.971 8.782 3.532 1.00 0.24 H new ATOM 0 HE2 PHE A 149 17.776 8.623 5.436 1.00 0.26 H new ATOM 0 HZ PHE A 149 15.367 8.138 5.449 1.00 0.25 H new ATOM 2338 N THR A 150 16.490 13.354 3.224 1.00 0.25 N ATOM 2339 CA THR A 150 16.695 14.002 4.542 1.00 0.30 C ATOM 2340 C THR A 150 15.828 13.378 5.657 1.00 0.40 C ATOM 2341 O THR A 150 14.687 13.796 5.887 1.00 1.15 O ATOM 2342 CB THR A 150 16.453 15.565 4.521 1.00 0.66 C ATOM 2343 OG1 THR A 150 15.447 15.940 3.556 1.00 1.42 O ATOM 2344 CG2 THR A 150 17.746 16.363 4.237 1.00 1.18 C ATOM 0 H THR A 150 15.518 13.297 2.920 1.00 0.25 H new ATOM 0 HA THR A 150 17.747 13.821 4.764 1.00 0.30 H new ATOM 0 HB THR A 150 16.104 15.818 5.522 1.00 0.66 H new ATOM 0 HG1 THR A 150 15.324 16.912 3.573 1.00 1.42 H new ATOM 0 HG21 THR A 150 17.522 17.430 4.234 1.00 1.18 H new ATOM 0 HG22 THR A 150 18.483 16.149 5.011 1.00 1.18 H new ATOM 0 HG23 THR A 150 18.146 16.074 3.265 1.00 1.18 H new ATOM 2352 N GLY A 151 16.410 12.362 6.347 1.00 0.32 N ATOM 2353 CA GLY A 151 15.774 11.682 7.502 1.00 0.18 C ATOM 2354 C GLY A 151 14.673 10.636 7.240 1.00 0.20 C ATOM 2355 O GLY A 151 14.855 9.463 7.570 1.00 0.42 O ATOM 0 H GLY A 151 17.333 11.993 6.117 1.00 0.32 H new ATOM 0 HA2 GLY A 151 16.564 11.192 8.071 1.00 0.18 H new ATOM 0 HA3 GLY A 151 15.349 12.453 8.145 1.00 0.18 H new ATOM 2359 N LYS A 152 13.536 11.062 6.662 1.00 0.16 N ATOM 2360 CA LYS A 152 12.390 10.162 6.441 1.00 0.13 C ATOM 2361 C LYS A 152 11.788 10.252 5.013 1.00 0.13 C ATOM 2362 O LYS A 152 11.992 11.219 4.276 1.00 0.16 O ATOM 2363 CB LYS A 152 11.331 10.471 7.577 1.00 0.22 C ATOM 2364 CG LYS A 152 9.816 10.293 7.244 1.00 0.41 C ATOM 2365 CD LYS A 152 9.048 11.638 7.075 1.00 0.56 C ATOM 2366 CE LYS A 152 9.585 12.521 5.936 1.00 0.69 C ATOM 2367 NZ LYS A 152 8.600 13.561 5.534 1.00 1.10 N ATOM 0 H LYS A 152 13.386 12.019 6.341 1.00 0.16 H new ATOM 0 HA LYS A 152 12.724 9.127 6.504 1.00 0.13 H new ATOM 0 HB2 LYS A 152 11.562 9.832 8.429 1.00 0.22 H new ATOM 0 HB3 LYS A 152 11.482 11.501 7.901 1.00 0.22 H new ATOM 0 HG2 LYS A 152 9.721 9.713 6.326 1.00 0.41 H new ATOM 0 HG3 LYS A 152 9.345 9.713 8.038 1.00 0.41 H new ATOM 0 HD2 LYS A 152 7.995 11.424 6.891 1.00 0.56 H new ATOM 0 HD3 LYS A 152 9.101 12.196 8.010 1.00 0.56 H new ATOM 0 HE2 LYS A 152 10.511 13.000 6.253 1.00 0.69 H new ATOM 0 HE3 LYS A 152 9.827 11.897 5.075 1.00 0.69 H new ATOM 0 HZ1 LYS A 152 8.877 13.965 4.617 1.00 1.10 H new ATOM 0 HZ2 LYS A 152 7.656 13.132 5.453 1.00 1.10 H new ATOM 0 HZ3 LYS A 152 8.578 14.314 6.251 1.00 1.10 H new ATOM 2381 N LEU A 153 11.032 9.186 4.673 1.00 0.12 N ATOM 2382 CA LEU A 153 10.289 9.047 3.390 1.00 0.13 C ATOM 2383 C LEU A 153 8.779 9.219 3.646 1.00 0.13 C ATOM 2384 O LEU A 153 8.269 8.767 4.678 1.00 0.18 O ATOM 2385 CB LEU A 153 10.545 7.654 2.777 1.00 0.15 C ATOM 2386 CG LEU A 153 10.406 7.486 1.231 1.00 0.34 C ATOM 2387 CD1 LEU A 153 11.646 6.825 0.633 1.00 0.43 C ATOM 2388 CD2 LEU A 153 9.176 6.653 0.867 1.00 0.67 C ATOM 0 H LEU A 153 10.915 8.381 5.289 1.00 0.12 H new ATOM 0 HA LEU A 153 10.635 9.814 2.697 1.00 0.13 H new ATOM 0 HB2 LEU A 153 11.554 7.350 3.055 1.00 0.15 H new ATOM 0 HB3 LEU A 153 9.859 6.952 3.250 1.00 0.15 H new ATOM 0 HG LEU A 153 10.295 8.488 0.816 1.00 0.34 H new ATOM 0 HD11 LEU A 153 11.519 6.722 -0.445 1.00 0.43 H new ATOM 0 HD12 LEU A 153 12.521 7.441 0.838 1.00 0.43 H new ATOM 0 HD13 LEU A 153 11.784 5.840 1.078 1.00 0.43 H new ATOM 0 HD21 LEU A 153 9.110 6.556 -0.217 1.00 0.67 H new ATOM 0 HD22 LEU A 153 9.261 5.663 1.315 1.00 0.67 H new ATOM 0 HD23 LEU A 153 8.279 7.145 1.243 1.00 0.67 H new ATOM 2400 N SER A 154 8.042 9.855 2.716 1.00 0.14 N ATOM 2401 CA SER A 154 6.610 10.060 2.960 1.00 0.16 C ATOM 2402 C SER A 154 5.685 9.513 1.855 1.00 0.19 C ATOM 2403 O SER A 154 5.976 9.580 0.669 1.00 0.36 O ATOM 2404 CB SER A 154 6.341 11.568 3.151 1.00 0.21 C ATOM 2405 OG SER A 154 5.167 11.822 3.916 1.00 0.24 O ATOM 0 H SER A 154 8.396 10.219 1.831 1.00 0.14 H new ATOM 0 HA SER A 154 6.371 9.490 3.858 1.00 0.16 H new ATOM 0 HB2 SER A 154 7.198 12.027 3.644 1.00 0.21 H new ATOM 0 HB3 SER A 154 6.244 12.043 2.175 1.00 0.21 H new ATOM 0 HG SER A 154 4.947 11.030 4.450 1.00 0.24 H new ATOM 2411 N VAL A 155 4.543 8.970 2.290 1.00 0.16 N ATOM 2412 CA VAL A 155 3.499 8.472 1.351 1.00 0.19 C ATOM 2413 C VAL A 155 2.258 9.360 1.549 1.00 0.25 C ATOM 2414 O VAL A 155 1.465 9.139 2.470 1.00 0.30 O ATOM 2415 CB VAL A 155 3.057 6.932 1.471 1.00 0.28 C ATOM 2416 CG1 VAL A 155 3.205 6.201 0.118 1.00 0.39 C ATOM 2417 CG2 VAL A 155 3.799 6.100 2.547 1.00 0.74 C ATOM 0 H VAL A 155 4.307 8.859 3.276 1.00 0.16 H new ATOM 0 HA VAL A 155 3.951 8.528 0.361 1.00 0.19 H new ATOM 0 HB VAL A 155 2.015 6.995 1.785 1.00 0.28 H new ATOM 0 HG11 VAL A 155 2.898 5.161 0.231 1.00 0.39 H new ATOM 0 HG12 VAL A 155 2.576 6.686 -0.628 1.00 0.39 H new ATOM 0 HG13 VAL A 155 4.245 6.240 -0.204 1.00 0.39 H new ATOM 0 HG21 VAL A 155 3.422 5.077 2.540 1.00 0.74 H new ATOM 0 HG22 VAL A 155 4.867 6.094 2.330 1.00 0.74 H new ATOM 0 HG23 VAL A 155 3.631 6.542 3.529 1.00 0.74 H new ATOM 2427 N GLU A 156 2.113 10.366 0.669 1.00 0.28 N ATOM 2428 CA GLU A 156 1.016 11.325 0.768 1.00 0.36 C ATOM 2429 C GLU A 156 0.049 11.208 -0.404 1.00 0.34 C ATOM 2430 O GLU A 156 0.424 11.403 -1.568 1.00 0.38 O ATOM 2431 CB GLU A 156 1.582 12.758 0.837 1.00 0.53 C ATOM 2432 CG GLU A 156 0.963 13.656 1.920 1.00 0.73 C ATOM 2433 CD GLU A 156 1.487 15.078 1.858 1.00 1.26 C ATOM 2434 OE1 GLU A 156 2.569 15.337 2.429 1.00 1.66 O ATOM 2435 OE2 GLU A 156 0.818 15.933 1.241 1.00 1.67 O ATOM 0 H GLU A 156 2.744 10.530 -0.115 1.00 0.28 H new ATOM 0 HA GLU A 156 0.460 11.100 1.678 1.00 0.36 H new ATOM 0 HB2 GLU A 156 2.657 12.699 1.008 1.00 0.53 H new ATOM 0 HB3 GLU A 156 1.439 13.235 -0.133 1.00 0.53 H new ATOM 0 HG2 GLU A 156 -0.121 13.665 1.805 1.00 0.73 H new ATOM 0 HG3 GLU A 156 1.176 13.235 2.903 1.00 0.73 H new ATOM 2442 N PHE A 157 -1.204 10.878 -0.073 1.00 0.35 N ATOM 2443 CA PHE A 157 -2.258 10.750 -1.081 1.00 0.40 C ATOM 2444 C PHE A 157 -3.337 11.821 -0.893 1.00 0.41 C ATOM 2445 O PHE A 157 -3.833 12.081 0.225 1.00 0.43 O ATOM 2446 CB PHE A 157 -2.881 9.326 -1.142 1.00 0.51 C ATOM 2447 CG PHE A 157 -2.665 8.460 0.094 1.00 0.60 C ATOM 2448 CD1 PHE A 157 -3.534 8.530 1.175 1.00 1.03 C ATOM 2449 CD2 PHE A 157 -1.585 7.575 0.166 1.00 0.99 C ATOM 2450 CE1 PHE A 157 -3.335 7.739 2.296 1.00 1.60 C ATOM 2451 CE2 PHE A 157 -1.386 6.786 1.286 1.00 1.55 C ATOM 2452 CZ PHE A 157 -2.262 6.868 2.350 1.00 1.80 C ATOM 0 H PHE A 157 -1.511 10.695 0.882 1.00 0.35 H new ATOM 0 HA PHE A 157 -1.777 10.911 -2.046 1.00 0.40 H new ATOM 0 HB2 PHE A 157 -3.953 9.425 -1.312 1.00 0.51 H new ATOM 0 HB3 PHE A 157 -2.468 8.805 -2.006 1.00 0.51 H new ATOM 0 HD1 PHE A 157 -4.374 9.208 1.142 1.00 1.03 H new ATOM 0 HD2 PHE A 157 -0.897 7.506 -0.663 1.00 0.99 H new ATOM 0 HE1 PHE A 157 -4.019 7.803 3.129 1.00 1.60 H new ATOM 0 HE2 PHE A 157 -0.547 6.107 1.327 1.00 1.55 H new ATOM 0 HZ PHE A 157 -2.109 6.252 3.224 1.00 1.80 H new ATOM 2462 N VAL A 158 -3.672 12.434 -2.037 1.00 0.43 N ATOM 2463 CA VAL A 158 -4.661 13.549 -2.124 1.00 0.46 C ATOM 2464 C VAL A 158 -6.021 13.034 -2.712 1.00 0.48 C ATOM 2465 O VAL A 158 -6.060 12.153 -3.590 1.00 0.47 O ATOM 2466 CB VAL A 158 -4.143 14.842 -2.955 1.00 0.50 C ATOM 2467 CG1 VAL A 158 -4.724 16.170 -2.398 1.00 0.58 C ATOM 2468 CG2 VAL A 158 -2.601 15.022 -3.004 1.00 0.58 C ATOM 0 H VAL A 158 -3.270 12.179 -2.939 1.00 0.43 H new ATOM 0 HA VAL A 158 -4.803 13.893 -1.099 1.00 0.46 H new ATOM 0 HB VAL A 158 -4.502 14.633 -3.963 1.00 0.50 H new ATOM 0 HG11 VAL A 158 -4.348 17.007 -2.987 1.00 0.58 H new ATOM 0 HG12 VAL A 158 -5.812 16.144 -2.457 1.00 0.58 H new ATOM 0 HG13 VAL A 158 -4.420 16.293 -1.358 1.00 0.58 H new ATOM 0 HG21 VAL A 158 -2.357 15.913 -3.582 1.00 0.58 H new ATOM 0 HG22 VAL A 158 -2.215 15.130 -1.990 1.00 0.58 H new ATOM 0 HG23 VAL A 158 -2.148 14.149 -3.474 1.00 0.58 H new ATOM 2478 N LYS A 159 -7.122 13.648 -2.196 1.00 0.52 N ATOM 2479 CA LYS A 159 -8.557 13.349 -2.529 1.00 0.56 C ATOM 2480 C LYS A 159 -8.980 13.484 -4.028 1.00 0.66 C ATOM 2481 O LYS A 159 -8.425 14.290 -4.784 1.00 0.81 O ATOM 2482 CB LYS A 159 -9.479 14.292 -1.710 1.00 0.72 C ATOM 2483 CG LYS A 159 -9.161 15.804 -1.852 1.00 1.06 C ATOM 2484 CD LYS A 159 -10.342 16.700 -1.410 1.00 1.48 C ATOM 2485 CE LYS A 159 -9.959 18.186 -1.334 1.00 1.63 C ATOM 2486 NZ LYS A 159 -11.132 19.039 -0.994 1.00 2.18 N ATOM 0 H LYS A 159 -7.038 14.396 -1.508 1.00 0.52 H new ATOM 0 HA LYS A 159 -8.664 12.293 -2.281 1.00 0.56 H new ATOM 0 HB2 LYS A 159 -10.511 14.123 -2.016 1.00 0.72 H new ATOM 0 HB3 LYS A 159 -9.410 14.019 -0.657 1.00 0.72 H new ATOM 0 HG2 LYS A 159 -8.282 16.045 -1.254 1.00 1.06 H new ATOM 0 HG3 LYS A 159 -8.911 16.024 -2.890 1.00 1.06 H new ATOM 0 HD2 LYS A 159 -11.169 16.577 -2.110 1.00 1.48 H new ATOM 0 HD3 LYS A 159 -10.699 16.370 -0.434 1.00 1.48 H new ATOM 0 HE2 LYS A 159 -9.179 18.323 -0.585 1.00 1.63 H new ATOM 0 HE3 LYS A 159 -9.542 18.504 -2.290 1.00 1.63 H new ATOM 0 HZ1 LYS A 159 -10.836 20.035 -0.951 1.00 2.18 H new ATOM 0 HZ2 LYS A 159 -11.866 18.927 -1.722 1.00 2.18 H new ATOM 0 HZ3 LYS A 159 -11.514 18.752 -0.070 1.00 2.18 H new ATOM 2500 N GLY A 160 -9.994 12.683 -4.410 1.00 0.74 N ATOM 2501 CA GLY A 160 -10.539 12.697 -5.778 1.00 0.93 C ATOM 2502 C GLY A 160 -11.931 13.344 -5.882 1.00 0.96 C ATOM 2503 O GLY A 160 -12.097 14.336 -6.596 1.00 1.02 O ATOM 0 H GLY A 160 -10.452 12.017 -3.787 1.00 0.74 H new ATOM 0 HA2 GLY A 160 -9.849 13.234 -6.429 1.00 0.93 H new ATOM 0 HA3 GLY A 160 -10.595 11.673 -6.148 1.00 0.93 H new ATOM 2507 N TYR A 161 -12.926 12.774 -5.169 1.00 0.96 N ATOM 2508 CA TYR A 161 -14.307 13.302 -5.169 1.00 1.02 C ATOM 2509 C TYR A 161 -14.956 13.210 -3.765 1.00 1.05 C ATOM 2510 O TYR A 161 -15.325 14.236 -3.186 1.00 1.11 O ATOM 2511 CB TYR A 161 -15.171 12.555 -6.210 1.00 1.14 C ATOM 2512 CG TYR A 161 -16.360 13.366 -6.754 1.00 1.34 C ATOM 2513 CD1 TYR A 161 -16.177 14.328 -7.753 1.00 1.63 C ATOM 2514 CD2 TYR A 161 -17.661 13.176 -6.268 1.00 1.81 C ATOM 2515 CE1 TYR A 161 -17.242 15.065 -8.245 1.00 2.07 C ATOM 2516 CE2 TYR A 161 -18.725 13.914 -6.762 1.00 2.26 C ATOM 2517 CZ TYR A 161 -18.509 14.853 -7.746 1.00 2.29 C ATOM 2518 OH TYR A 161 -19.566 15.586 -8.234 1.00 2.86 O ATOM 0 H TYR A 161 -12.798 11.947 -4.585 1.00 0.96 H new ATOM 0 HA TYR A 161 -14.256 14.356 -5.441 1.00 1.02 H new ATOM 0 HB2 TYR A 161 -14.536 12.260 -7.046 1.00 1.14 H new ATOM 0 HB3 TYR A 161 -15.550 11.638 -5.758 1.00 1.14 H new ATOM 0 HD1 TYR A 161 -15.187 14.499 -8.148 1.00 1.63 H new ATOM 0 HD2 TYR A 161 -17.837 12.442 -5.496 1.00 1.81 H new ATOM 0 HE1 TYR A 161 -17.080 15.803 -9.017 1.00 2.07 H new ATOM 0 HE2 TYR A 161 -19.721 13.753 -6.376 1.00 2.26 H new ATOM 0 HH TYR A 161 -20.390 15.315 -7.778 1.00 2.86 H new ATOM 2528 N TYR A 162 -15.092 11.975 -3.227 1.00 1.09 N ATOM 2529 CA TYR A 162 -15.691 11.739 -1.892 1.00 1.17 C ATOM 2530 C TYR A 162 -14.680 11.100 -0.904 1.00 1.10 C ATOM 2531 O TYR A 162 -14.524 11.581 0.222 1.00 1.71 O ATOM 2532 CB TYR A 162 -16.942 10.847 -2.028 1.00 1.54 C ATOM 2533 CG TYR A 162 -18.010 11.077 -0.945 1.00 1.88 C ATOM 2534 CD1 TYR A 162 -18.997 12.058 -1.100 1.00 2.57 C ATOM 2535 CD2 TYR A 162 -18.031 10.319 0.233 1.00 2.00 C ATOM 2536 CE1 TYR A 162 -19.958 12.270 -0.124 1.00 3.18 C ATOM 2537 CE2 TYR A 162 -18.993 10.533 1.207 1.00 2.64 C ATOM 2538 CZ TYR A 162 -19.951 11.506 1.023 1.00 3.16 C ATOM 2539 OH TYR A 162 -20.906 11.717 1.991 1.00 3.91 O ATOM 0 H TYR A 162 -14.793 11.122 -3.700 1.00 1.09 H new ATOM 0 HA TYR A 162 -15.976 12.708 -1.482 1.00 1.17 H new ATOM 0 HB2 TYR A 162 -17.391 11.020 -3.006 1.00 1.54 H new ATOM 0 HB3 TYR A 162 -16.633 9.802 -1.999 1.00 1.54 H new ATOM 0 HD1 TYR A 162 -19.010 12.660 -1.996 1.00 2.57 H new ATOM 0 HD2 TYR A 162 -17.284 9.554 0.385 1.00 2.00 H new ATOM 0 HE1 TYR A 162 -20.711 13.032 -0.262 1.00 3.18 H new ATOM 0 HE2 TYR A 162 -18.992 9.938 2.109 1.00 2.64 H new ATOM 0 HH TYR A 162 -20.761 11.095 2.734 1.00 3.91 H new ATOM 2549 N ASP A 163 -13.998 10.014 -1.342 1.00 1.04 N ATOM 2550 CA ASP A 163 -12.977 9.302 -0.526 1.00 0.99 C ATOM 2551 C ASP A 163 -11.533 9.674 -0.970 1.00 1.06 C ATOM 2552 O ASP A 163 -11.346 10.476 -1.896 1.00 1.74 O ATOM 2553 CB ASP A 163 -13.180 7.777 -0.642 1.00 1.11 C ATOM 2554 CG ASP A 163 -14.123 7.212 0.416 1.00 1.19 C ATOM 2555 OD1 ASP A 163 -15.345 7.449 0.306 1.00 1.34 O ATOM 2556 OD2 ASP A 163 -13.639 6.533 1.345 1.00 1.27 O ATOM 0 H ASP A 163 -14.137 9.606 -2.266 1.00 1.04 H new ATOM 0 HA ASP A 163 -13.103 9.611 0.512 1.00 0.99 H new ATOM 0 HB2 ASP A 163 -13.574 7.544 -1.631 1.00 1.11 H new ATOM 0 HB3 ASP A 163 -12.213 7.281 -0.559 1.00 1.11 H new ATOM 2561 N ASN A 164 -10.506 9.118 -0.289 1.00 0.83 N ATOM 2562 CA ASN A 164 -9.100 9.405 -0.651 1.00 0.83 C ATOM 2563 C ASN A 164 -8.366 8.078 -1.088 1.00 1.01 C ATOM 2564 O ASN A 164 -8.333 7.820 -2.290 1.00 1.68 O ATOM 2565 CB ASN A 164 -8.370 10.218 0.462 1.00 1.02 C ATOM 2566 CG ASN A 164 -8.702 11.700 0.561 1.00 0.88 C ATOM 2567 OD1 ASN A 164 -9.807 12.137 0.250 1.00 1.57 O ATOM 2568 ND2 ASN A 164 -7.736 12.471 1.051 1.00 0.82 N ATOM 0 H ASN A 164 -10.620 8.480 0.499 1.00 0.83 H new ATOM 0 HA ASN A 164 -9.078 10.061 -1.521 1.00 0.83 H new ATOM 0 HB2 ASN A 164 -8.594 9.755 1.423 1.00 1.02 H new ATOM 0 HB3 ASN A 164 -7.296 10.121 0.304 1.00 1.02 H new ATOM 0 HD21 ASN A 164 -7.898 13.470 1.182 1.00 0.82 H new ATOM 0 HD22 ASN A 164 -6.833 12.064 1.296 1.00 0.82 H new ATOM 2575 N PRO A 165 -7.754 7.199 -0.189 1.00 0.87 N ATOM 2576 CA PRO A 165 -7.139 5.908 -0.640 1.00 1.06 C ATOM 2577 C PRO A 165 -8.129 4.707 -0.694 1.00 0.93 C ATOM 2578 O PRO A 165 -8.048 3.861 -1.587 1.00 1.76 O ATOM 2579 CB PRO A 165 -6.091 5.644 0.457 1.00 1.45 C ATOM 2580 CG PRO A 165 -6.755 6.153 1.702 1.00 2.06 C ATOM 2581 CD PRO A 165 -7.485 7.410 1.260 1.00 1.41 C ATOM 0 HA PRO A 165 -6.759 5.993 -1.658 1.00 1.06 H new ATOM 0 HB2 PRO A 165 -5.849 4.584 0.535 1.00 1.45 H new ATOM 0 HB3 PRO A 165 -5.158 6.170 0.256 1.00 1.45 H new ATOM 0 HG2 PRO A 165 -7.446 5.417 2.112 1.00 2.06 H new ATOM 0 HG3 PRO A 165 -6.024 6.372 2.480 1.00 2.06 H new ATOM 0 HD2 PRO A 165 -8.411 7.548 1.819 1.00 1.41 H new ATOM 0 HD3 PRO A 165 -6.877 8.300 1.425 1.00 1.41 H new ATOM 2589 N LYS A 166 -9.056 4.671 0.316 1.00 0.54 N ATOM 2590 CA LYS A 166 -10.094 3.614 0.535 1.00 0.47 C ATOM 2591 C LYS A 166 -9.461 2.366 1.229 1.00 0.42 C ATOM 2592 O LYS A 166 -9.387 2.343 2.462 1.00 0.47 O ATOM 2593 CB LYS A 166 -10.878 3.295 -0.772 1.00 0.82 C ATOM 2594 CG LYS A 166 -12.105 2.359 -0.609 1.00 1.30 C ATOM 2595 CD LYS A 166 -13.230 2.635 -1.644 1.00 1.83 C ATOM 2596 CE LYS A 166 -12.733 2.663 -3.108 1.00 2.33 C ATOM 2597 NZ LYS A 166 -12.212 4.003 -3.501 1.00 3.00 N ATOM 0 H LYS A 166 -9.100 5.404 1.024 1.00 0.54 H new ATOM 0 HA LYS A 166 -10.850 3.993 1.223 1.00 0.47 H new ATOM 0 HB2 LYS A 166 -11.216 4.234 -1.209 1.00 0.82 H new ATOM 0 HB3 LYS A 166 -10.190 2.841 -1.485 1.00 0.82 H new ATOM 0 HG2 LYS A 166 -11.779 1.323 -0.705 1.00 1.30 H new ATOM 0 HG3 LYS A 166 -12.510 2.474 0.397 1.00 1.30 H new ATOM 0 HD2 LYS A 166 -13.999 1.869 -1.545 1.00 1.83 H new ATOM 0 HD3 LYS A 166 -13.700 3.590 -1.411 1.00 1.83 H new ATOM 0 HE2 LYS A 166 -11.948 1.918 -3.238 1.00 2.33 H new ATOM 0 HE3 LYS A 166 -13.551 2.384 -3.773 1.00 2.33 H new ATOM 0 HZ1 LYS A 166 -12.569 4.251 -4.446 1.00 3.00 H new ATOM 0 HZ2 LYS A 166 -12.530 4.715 -2.813 1.00 3.00 H new ATOM 0 HZ3 LYS A 166 -11.172 3.980 -3.519 1.00 3.00 H new ATOM 2611 N VAL A 167 -9.015 1.328 0.459 1.00 0.39 N ATOM 2612 CA VAL A 167 -8.290 0.176 1.076 1.00 0.38 C ATOM 2613 C VAL A 167 -6.781 0.315 0.695 1.00 0.34 C ATOM 2614 O VAL A 167 -6.431 0.428 -0.494 1.00 0.33 O ATOM 2615 CB VAL A 167 -8.857 -1.278 0.669 1.00 0.45 C ATOM 2616 CG1 VAL A 167 -8.235 -2.428 1.508 1.00 0.80 C ATOM 2617 CG2 VAL A 167 -10.401 -1.424 0.805 1.00 0.58 C ATOM 0 H VAL A 167 -9.139 1.265 -0.552 1.00 0.39 H new ATOM 0 HA VAL A 167 -8.443 0.225 2.154 1.00 0.38 H new ATOM 0 HB VAL A 167 -8.571 -1.358 -0.380 1.00 0.45 H new ATOM 0 HG11 VAL A 167 -8.656 -3.381 1.188 1.00 0.80 H new ATOM 0 HG12 VAL A 167 -7.155 -2.441 1.363 1.00 0.80 H new ATOM 0 HG13 VAL A 167 -8.457 -2.270 2.563 1.00 0.80 H new ATOM 0 HG21 VAL A 167 -10.698 -2.431 0.512 1.00 0.58 H new ATOM 0 HG22 VAL A 167 -10.694 -1.246 1.840 1.00 0.58 H new ATOM 0 HG23 VAL A 167 -10.893 -0.698 0.159 1.00 0.58 H new ATOM 2627 N CYS A 168 -5.920 0.189 1.726 1.00 0.35 N ATOM 2628 CA CYS A 168 -4.470 0.355 1.556 1.00 0.35 C ATOM 2629 C CYS A 168 -3.655 -0.746 2.262 1.00 0.36 C ATOM 2630 O CYS A 168 -3.842 -1.014 3.444 1.00 0.48 O ATOM 2631 CB CYS A 168 -4.091 1.720 2.115 1.00 0.37 C ATOM 2632 SG CYS A 168 -2.717 2.527 1.264 1.00 0.87 S ATOM 0 H CYS A 168 -6.207 -0.027 2.681 1.00 0.35 H new ATOM 0 HA CYS A 168 -4.234 0.277 0.495 1.00 0.35 H new ATOM 0 HB2 CYS A 168 -4.963 2.372 2.068 1.00 0.37 H new ATOM 0 HB3 CYS A 168 -3.833 1.608 3.168 1.00 0.37 H new ATOM 0 HG CYS A 168 -3.096 2.890 0.075 1.00 0.87 H new ATOM 2638 N ALA A 169 -2.714 -1.351 1.502 1.00 0.29 N ATOM 2639 CA ALA A 169 -1.845 -2.474 1.965 1.00 0.29 C ATOM 2640 C ALA A 169 -0.304 -2.224 1.868 1.00 0.25 C ATOM 2641 O ALA A 169 0.437 -2.979 1.197 1.00 0.26 O ATOM 2642 CB ALA A 169 -2.267 -3.846 1.411 1.00 0.34 C ATOM 0 H ALA A 169 -2.529 -1.075 0.538 1.00 0.29 H new ATOM 0 HA ALA A 169 -2.034 -2.503 3.038 1.00 0.29 H new ATOM 0 HB1 ALA A 169 -1.592 -4.614 1.789 1.00 0.34 H new ATOM 0 HB2 ALA A 169 -3.285 -4.069 1.729 1.00 0.34 H new ATOM 0 HB3 ALA A 169 -2.223 -3.828 0.322 1.00 0.34 H new ATOM 2648 N LEU A 170 0.143 -1.032 2.366 1.00 0.22 N ATOM 2649 CA LEU A 170 1.586 -0.575 2.425 1.00 0.21 C ATOM 2650 C LEU A 170 2.630 -1.658 2.822 1.00 0.19 C ATOM 2651 O LEU A 170 2.472 -2.354 3.827 1.00 0.34 O ATOM 2652 CB LEU A 170 1.709 0.544 3.482 1.00 0.31 C ATOM 2653 CG LEU A 170 1.912 2.019 3.010 1.00 0.38 C ATOM 2654 CD1 LEU A 170 3.061 2.178 2.002 1.00 0.50 C ATOM 2655 CD2 LEU A 170 0.627 2.611 2.428 1.00 0.70 C ATOM 0 H LEU A 170 -0.499 -0.338 2.750 1.00 0.22 H new ATOM 0 HA LEU A 170 1.815 -0.266 1.405 1.00 0.21 H new ATOM 0 HB2 LEU A 170 0.808 0.517 4.095 1.00 0.31 H new ATOM 0 HB3 LEU A 170 2.545 0.290 4.133 1.00 0.31 H new ATOM 0 HG LEU A 170 2.184 2.574 3.908 1.00 0.38 H new ATOM 0 HD11 LEU A 170 3.150 3.225 1.714 1.00 0.50 H new ATOM 0 HD12 LEU A 170 3.994 1.847 2.458 1.00 0.50 H new ATOM 0 HD13 LEU A 170 2.855 1.575 1.118 1.00 0.50 H new ATOM 0 HD21 LEU A 170 0.810 3.638 2.111 1.00 0.70 H new ATOM 0 HD22 LEU A 170 0.309 2.018 1.570 1.00 0.70 H new ATOM 0 HD23 LEU A 170 -0.155 2.599 3.187 1.00 0.70 H new ATOM 2667 N PHE A 171 3.662 -1.803 1.993 1.00 0.16 N ATOM 2668 CA PHE A 171 4.715 -2.786 2.233 1.00 0.14 C ATOM 2669 C PHE A 171 6.080 -2.279 1.710 1.00 0.14 C ATOM 2670 O PHE A 171 6.339 -2.342 0.504 1.00 0.19 O ATOM 2671 CB PHE A 171 4.293 -4.126 1.542 1.00 0.17 C ATOM 2672 CG PHE A 171 5.351 -5.232 1.446 1.00 0.16 C ATOM 2673 CD1 PHE A 171 6.282 -5.436 2.462 1.00 0.15 C ATOM 2674 CD2 PHE A 171 5.408 -6.068 0.325 1.00 0.20 C ATOM 2675 CE1 PHE A 171 7.230 -6.422 2.363 1.00 0.15 C ATOM 2676 CE2 PHE A 171 6.363 -7.062 0.232 1.00 0.21 C ATOM 2677 CZ PHE A 171 7.274 -7.236 1.254 1.00 0.17 C ATOM 0 H PHE A 171 3.791 -1.249 1.146 1.00 0.16 H new ATOM 0 HA PHE A 171 4.838 -2.950 3.304 1.00 0.14 H new ATOM 0 HB2 PHE A 171 3.434 -4.527 2.080 1.00 0.17 H new ATOM 0 HB3 PHE A 171 3.956 -3.893 0.532 1.00 0.17 H new ATOM 0 HD1 PHE A 171 6.257 -4.808 3.341 1.00 0.15 H new ATOM 0 HD2 PHE A 171 4.697 -5.934 -0.477 1.00 0.20 H new ATOM 0 HE1 PHE A 171 7.946 -6.561 3.160 1.00 0.15 H new ATOM 0 HE2 PHE A 171 6.397 -7.701 -0.638 1.00 0.21 H new ATOM 0 HZ PHE A 171 8.022 -8.012 1.183 1.00 0.17 H new ATOM 2687 N ILE A 172 6.957 -1.772 2.614 1.00 0.10 N ATOM 2688 CA ILE A 172 8.307 -1.360 2.182 1.00 0.10 C ATOM 2689 C ILE A 172 9.406 -2.344 2.744 1.00 0.08 C ATOM 2690 O ILE A 172 9.572 -2.540 3.985 1.00 0.08 O ATOM 2691 CB ILE A 172 8.686 0.203 2.365 1.00 0.13 C ATOM 2692 CG1 ILE A 172 9.908 0.544 1.374 1.00 0.14 C ATOM 2693 CG2 ILE A 172 8.937 0.630 3.857 1.00 0.22 C ATOM 2694 CD1 ILE A 172 10.437 2.001 1.300 1.00 0.31 C ATOM 0 H ILE A 172 6.761 -1.644 3.607 1.00 0.10 H new ATOM 0 HA ILE A 172 8.285 -1.450 1.096 1.00 0.10 H new ATOM 0 HB ILE A 172 7.824 0.810 2.088 1.00 0.13 H new ATOM 0 HG12 ILE A 172 10.745 -0.096 1.653 1.00 0.14 H new ATOM 0 HG13 ILE A 172 9.606 0.253 0.368 1.00 0.14 H new ATOM 0 HG21 ILE A 172 9.185 1.691 3.895 1.00 0.22 H new ATOM 0 HG22 ILE A 172 8.037 0.447 4.444 1.00 0.22 H new ATOM 0 HG23 ILE A 172 9.763 0.049 4.268 1.00 0.22 H new ATOM 0 HD11 ILE A 172 11.259 2.054 0.586 1.00 0.31 H new ATOM 0 HD12 ILE A 172 9.634 2.664 0.979 1.00 0.31 H new ATOM 0 HD13 ILE A 172 10.791 2.310 2.284 1.00 0.31 H new ATOM 2706 N MET A 173 10.140 -2.930 1.798 1.00 0.09 N ATOM 2707 CA MET A 173 11.226 -3.869 2.095 1.00 0.11 C ATOM 2708 C MET A 173 12.558 -3.385 1.465 1.00 0.13 C ATOM 2709 O MET A 173 12.556 -2.506 0.589 1.00 0.21 O ATOM 2710 CB MET A 173 10.840 -5.304 1.644 1.00 0.15 C ATOM 2711 CG MET A 173 10.281 -5.410 0.203 1.00 0.17 C ATOM 2712 SD MET A 173 11.553 -5.316 -1.079 1.00 0.44 S ATOM 2713 CE MET A 173 12.579 -6.729 -0.684 1.00 0.26 C ATOM 0 H MET A 173 9.999 -2.768 0.801 1.00 0.09 H new ATOM 0 HA MET A 173 11.382 -3.903 3.173 1.00 0.11 H new ATOM 0 HB2 MET A 173 11.720 -5.943 1.724 1.00 0.15 H new ATOM 0 HB3 MET A 173 10.096 -5.698 2.336 1.00 0.15 H new ATOM 0 HG2 MET A 173 9.743 -6.352 0.100 1.00 0.17 H new ATOM 0 HG3 MET A 173 9.557 -4.611 0.044 1.00 0.17 H new ATOM 0 HE1 MET A 173 13.115 -7.050 -1.577 1.00 0.26 H new ATOM 0 HE2 MET A 173 13.295 -6.453 0.090 1.00 0.26 H new ATOM 0 HE3 MET A 173 11.952 -7.545 -0.324 1.00 0.26 H new ATOM 2723 N LYS A 174 13.700 -3.959 1.886 1.00 0.12 N ATOM 2724 CA LYS A 174 14.990 -3.466 1.380 1.00 0.19 C ATOM 2725 C LYS A 174 15.925 -4.472 0.654 1.00 0.16 C ATOM 2726 O LYS A 174 15.856 -5.696 0.784 1.00 0.17 O ATOM 2727 CB LYS A 174 15.765 -2.759 2.536 1.00 0.38 C ATOM 2728 CG LYS A 174 16.487 -3.716 3.515 1.00 0.54 C ATOM 2729 CD LYS A 174 17.216 -2.992 4.677 1.00 0.57 C ATOM 2730 CE LYS A 174 18.521 -2.296 4.244 1.00 0.49 C ATOM 2731 NZ LYS A 174 19.306 -1.844 5.421 1.00 1.26 N ATOM 0 H LYS A 174 13.757 -4.733 2.548 1.00 0.12 H new ATOM 0 HA LYS A 174 14.704 -2.781 0.582 1.00 0.19 H new ATOM 0 HB2 LYS A 174 16.502 -2.084 2.101 1.00 0.38 H new ATOM 0 HB3 LYS A 174 15.064 -2.145 3.101 1.00 0.38 H new ATOM 0 HG2 LYS A 174 15.758 -4.411 3.933 1.00 0.54 H new ATOM 0 HG3 LYS A 174 17.212 -4.311 2.959 1.00 0.54 H new ATOM 0 HD2 LYS A 174 16.545 -2.251 5.111 1.00 0.57 H new ATOM 0 HD3 LYS A 174 17.442 -3.715 5.461 1.00 0.57 H new ATOM 0 HE2 LYS A 174 19.121 -2.982 3.646 1.00 0.49 H new ATOM 0 HE3 LYS A 174 18.287 -1.441 3.610 1.00 0.49 H new ATOM 0 HZ1 LYS A 174 20.179 -1.379 5.099 1.00 1.26 H new ATOM 0 HZ2 LYS A 174 18.741 -1.171 5.978 1.00 1.26 H new ATOM 0 HZ3 LYS A 174 19.549 -2.664 6.012 1.00 1.26 H new ATOM 2745 N GLY A 175 16.798 -3.817 -0.109 1.00 0.14 N ATOM 2746 CA GLY A 175 17.920 -4.383 -0.864 1.00 0.15 C ATOM 2747 C GLY A 175 17.796 -4.527 -2.396 1.00 0.13 C ATOM 2748 O GLY A 175 18.724 -4.048 -3.061 1.00 0.17 O ATOM 0 H GLY A 175 16.738 -2.805 -0.226 1.00 0.14 H new ATOM 0 HA2 GLY A 175 18.796 -3.767 -0.662 1.00 0.15 H new ATOM 0 HA3 GLY A 175 18.125 -5.373 -0.456 1.00 0.15 H new ATOM 2752 N THR A 176 16.622 -4.968 -2.971 1.00 0.11 N ATOM 2753 CA THR A 176 16.450 -5.145 -4.471 1.00 0.10 C ATOM 2754 C THR A 176 15.025 -5.594 -4.871 1.00 0.10 C ATOM 2755 O THR A 176 14.307 -6.240 -4.099 1.00 0.13 O ATOM 2756 CB THR A 176 17.435 -6.181 -5.160 1.00 0.12 C ATOM 2757 OG1 THR A 176 17.981 -7.139 -4.232 1.00 0.15 O ATOM 2758 CG2 THR A 176 18.589 -5.502 -5.939 1.00 0.15 C ATOM 0 H THR A 176 15.790 -5.205 -2.431 1.00 0.11 H new ATOM 0 HA THR A 176 16.678 -4.141 -4.828 1.00 0.10 H new ATOM 0 HB THR A 176 16.808 -6.712 -5.876 1.00 0.12 H new ATOM 0 HG1 THR A 176 18.578 -7.752 -4.709 1.00 0.15 H new ATOM 0 HG21 THR A 176 19.225 -6.266 -6.386 1.00 0.15 H new ATOM 0 HG22 THR A 176 18.175 -4.870 -6.725 1.00 0.15 H new ATOM 0 HG23 THR A 176 19.180 -4.892 -5.256 1.00 0.15 H new ATOM 2766 N ALA A 177 14.640 -5.247 -6.145 1.00 0.10 N ATOM 2767 CA ALA A 177 13.327 -5.612 -6.773 1.00 0.11 C ATOM 2768 C ALA A 177 13.251 -7.097 -7.308 1.00 0.15 C ATOM 2769 O ALA A 177 12.160 -7.606 -7.610 1.00 0.17 O ATOM 2770 CB ALA A 177 13.011 -4.603 -7.905 1.00 0.15 C ATOM 0 H ALA A 177 15.239 -4.703 -6.766 1.00 0.10 H new ATOM 0 HA ALA A 177 12.574 -5.558 -5.987 1.00 0.11 H new ATOM 0 HB1 ALA A 177 12.058 -4.861 -8.367 1.00 0.15 H new ATOM 0 HB2 ALA A 177 12.952 -3.597 -7.490 1.00 0.15 H new ATOM 0 HB3 ALA A 177 13.800 -4.640 -8.656 1.00 0.15 H new ATOM 2776 N ASP A 178 14.421 -7.791 -7.409 1.00 0.19 N ATOM 2777 CA ASP A 178 14.507 -9.208 -7.845 1.00 0.24 C ATOM 2778 C ASP A 178 14.371 -10.248 -6.666 1.00 0.26 C ATOM 2779 O ASP A 178 14.507 -11.455 -6.887 1.00 0.31 O ATOM 2780 CB ASP A 178 15.844 -9.409 -8.571 1.00 0.31 C ATOM 2781 CG ASP A 178 15.689 -9.986 -9.976 1.00 0.42 C ATOM 2782 OD1 ASP A 178 15.519 -9.196 -10.929 1.00 0.51 O ATOM 2783 OD2 ASP A 178 15.736 -11.227 -10.116 1.00 0.55 O ATOM 0 H ASP A 178 15.328 -7.380 -7.189 1.00 0.19 H new ATOM 0 HA ASP A 178 13.661 -9.399 -8.505 1.00 0.24 H new ATOM 0 HB2 ASP A 178 16.362 -8.452 -8.634 1.00 0.31 H new ATOM 0 HB3 ASP A 178 16.474 -10.074 -7.980 1.00 0.31 H new ATOM 2788 N ASP A 179 14.096 -9.757 -5.432 1.00 0.24 N ATOM 2789 CA ASP A 179 13.951 -10.604 -4.222 1.00 0.31 C ATOM 2790 C ASP A 179 12.485 -10.725 -3.693 1.00 0.32 C ATOM 2791 O ASP A 179 12.233 -11.525 -2.793 1.00 0.44 O ATOM 2792 CB ASP A 179 14.840 -10.041 -3.110 1.00 0.37 C ATOM 2793 CG ASP A 179 15.988 -10.972 -2.729 1.00 0.48 C ATOM 2794 OD1 ASP A 179 15.793 -11.817 -1.829 1.00 0.60 O ATOM 2795 OD2 ASP A 179 17.075 -10.854 -3.333 1.00 0.52 O ATOM 0 H ASP A 179 13.968 -8.762 -5.248 1.00 0.24 H new ATOM 0 HA ASP A 179 14.254 -11.610 -4.513 1.00 0.31 H new ATOM 0 HB2 ASP A 179 15.249 -9.083 -3.431 1.00 0.37 H new ATOM 0 HB3 ASP A 179 14.229 -9.848 -2.228 1.00 0.37 H new ATOM 2800 N VAL A 180 11.544 -9.908 -4.237 1.00 0.24 N ATOM 2801 CA VAL A 180 10.077 -9.917 -3.855 1.00 0.29 C ATOM 2802 C VAL A 180 9.240 -11.035 -4.603 1.00 0.50 C ATOM 2803 O VAL A 180 8.800 -10.806 -5.735 1.00 0.95 O ATOM 2804 CB VAL A 180 9.307 -8.513 -4.060 1.00 0.27 C ATOM 2805 CG1 VAL A 180 9.235 -7.712 -2.751 1.00 0.48 C ATOM 2806 CG2 VAL A 180 9.867 -7.576 -5.172 1.00 0.50 C ATOM 0 H VAL A 180 11.766 -9.218 -4.955 1.00 0.24 H new ATOM 0 HA VAL A 180 10.124 -10.130 -2.787 1.00 0.29 H new ATOM 0 HB VAL A 180 8.318 -8.830 -4.392 1.00 0.27 H new ATOM 0 HG11 VAL A 180 8.710 -6.773 -2.927 1.00 0.48 H new ATOM 0 HG12 VAL A 180 8.700 -8.291 -1.999 1.00 0.48 H new ATOM 0 HG13 VAL A 180 10.244 -7.502 -2.397 1.00 0.48 H new ATOM 0 HG21 VAL A 180 9.269 -6.666 -5.216 1.00 0.50 H new ATOM 0 HG22 VAL A 180 10.902 -7.320 -4.945 1.00 0.50 H new ATOM 0 HG23 VAL A 180 9.822 -8.086 -6.134 1.00 0.50 H new