USER MOD reduce.3.24.130724 H: found=0, std=0, add=1219, rem=0, adj=35 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 73 TYR OH : rot 22:sc= 0.676 USER MOD Set 1.2: A 168 CYS SG : rot 71:sc= 0.815 USER MOD Set 2.1: A 123 HIS : no HD1:sc= -0.164 X(o=-0.14,f=-0.17) USER MOD Set 2.2: A 125 THR OG1 : rot -108:sc= 0.0211 USER MOD Set 3.1: A 15 ASN : amide:sc= -3.36! C(o=-2.3!,f=-2.1!) USER MOD Set 3.2: A 63 THR OG1 : rot -78:sc= 1.02 USER MOD Set 4.1: A 58 GLN : amide:sc= -3.2! C(o=-4.7!,f=-2.6!) USER MOD Set 4.2: A 62 GLN : amide:sc= -1.54 K(o=-4.7,f=-1.8) USER MOD Set 5.1: A 20 SER OG : rot -68:sc= 0.215 USER MOD Set 5.2: A 28 HIS : no HE2:sc= -0.496 X(o=-0.28,f=-0.057) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 HIS : no HD1:sc= -0.757 K(o=-0.76,f=-0.2) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 TYR OH : rot 105:sc= -2.43! USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 133:sc= -0.289 USER MOD Single : A 54 ASN : amide:sc= -1.28 K(o=-1.3,f=-0.32) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 11:sc= 0.0764 USER MOD Single : A 78 LYS NZ :NH3+ 167:sc=-0.00809 (180deg=-0.184) USER MOD Single : A 83 TYR OH : rot -15:sc= -0.939 USER MOD Single : A 88 LYS NZ :NH3+ -140:sc= 1.24 (180deg=0.579) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.864 K(o=-0.86,f=-2.5!) USER MOD Single : A 97 SER OG : rot 180:sc= -0.401 USER MOD Single : A 98 GLN : amide:sc= 0.328 K(o=0.33,f=-0.88) USER MOD Single : A 99 GLN : amide:sc= -0.172 K(o=-0.17,f=-2.7!) USER MOD Single : A 100 LYS NZ :NH3+ 154:sc= 0.787 (180deg=0.523) USER MOD Single : A 107 ASN : amide:sc= -5.3! C(o=-5.3!,f=-8.1!) USER MOD Single : A 109 HIS : no HE2:sc= 0.0724 X(o=0.072,f=-0.33) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0479) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -0.0718 X(o=-0.072,f=-0.32) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -167:sc= -0.197 (180deg=-0.326) USER MOD Single : A 137 LYS NZ :NH3+ -130:sc= -0.0937 (180deg=-1.06) USER MOD Single : A 139 LYS NZ :NH3+ 147:sc= -0.047 (180deg=-0.225) USER MOD Single : A 141 SER OG : rot 180:sc= -0.46 USER MOD Single : A 143 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 147 SER OG : rot 35:sc= 0.0264 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 SER OG : rot 19:sc= 0.00289 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= -1.45 K(o=-1.4,f=-5.2!) USER MOD Single : A 166 LYS NZ :NH3+ -116:sc= -0.657 (180deg=-2.61!) USER MOD Single : A 173 MET CE :methyl 156:sc= -0.225 (180deg=-0.824) USER MOD Single : A 174 LYS NZ :NH3+ -160:sc= -0.0923 (180deg=-0.436) USER MOD Single : A 176 THR OG1 : rot 104:sc= 0.132 USER MOD ----------------------------------------------------------------- ATOM 55 N LEU A 6 12.402 -12.946 2.465 1.00 0.23 N ATOM 56 CA LEU A 6 11.587 -11.702 2.448 1.00 0.22 C ATOM 57 C LEU A 6 11.457 -11.030 3.854 1.00 0.17 C ATOM 58 O LEU A 6 11.638 -9.807 3.996 1.00 0.16 O ATOM 59 CB LEU A 6 10.205 -12.037 1.835 1.00 0.24 C ATOM 60 CG LEU A 6 9.290 -10.845 1.430 1.00 0.27 C ATOM 61 CD1 LEU A 6 9.978 -9.827 0.519 1.00 0.33 C ATOM 62 CD2 LEU A 6 7.989 -11.300 0.761 1.00 0.35 C ATOM 0 HA LEU A 6 12.097 -10.959 1.834 1.00 0.22 H new ATOM 0 HB2 LEU A 6 10.370 -12.650 0.949 1.00 0.24 H new ATOM 0 HB3 LEU A 6 9.659 -12.651 2.551 1.00 0.24 H new ATOM 0 HG LEU A 6 9.059 -10.358 2.377 1.00 0.27 H new ATOM 0 HD11 LEU A 6 9.281 -9.025 0.278 1.00 0.33 H new ATOM 0 HD12 LEU A 6 10.847 -9.411 1.029 1.00 0.33 H new ATOM 0 HD13 LEU A 6 10.297 -10.319 -0.400 1.00 0.33 H new ATOM 0 HD21 LEU A 6 7.390 -10.428 0.500 1.00 0.35 H new ATOM 0 HD22 LEU A 6 8.222 -11.864 -0.142 1.00 0.35 H new ATOM 0 HD23 LEU A 6 7.428 -11.933 1.449 1.00 0.35 H new ATOM 74 N ALA A 7 11.129 -11.865 4.885 1.00 0.17 N ATOM 75 CA ALA A 7 11.016 -11.476 6.338 1.00 0.16 C ATOM 76 C ALA A 7 12.335 -10.881 6.980 1.00 0.15 C ATOM 77 O ALA A 7 12.275 -10.137 7.969 1.00 0.15 O ATOM 78 CB ALA A 7 10.547 -12.711 7.137 1.00 0.20 C ATOM 0 H ALA A 7 10.930 -12.853 4.732 1.00 0.17 H new ATOM 0 HA ALA A 7 10.294 -10.661 6.386 1.00 0.16 H new ATOM 0 HB1 ALA A 7 10.459 -12.450 8.192 1.00 0.20 H new ATOM 0 HB2 ALA A 7 9.578 -13.040 6.762 1.00 0.20 H new ATOM 0 HB3 ALA A 7 11.273 -13.516 7.022 1.00 0.20 H new ATOM 84 N ASP A 8 13.521 -11.203 6.377 1.00 0.16 N ATOM 85 CA ASP A 8 14.846 -10.699 6.827 1.00 0.18 C ATOM 86 C ASP A 8 15.230 -9.311 6.213 1.00 0.17 C ATOM 87 O ASP A 8 16.185 -8.679 6.677 1.00 0.21 O ATOM 88 CB ASP A 8 15.942 -11.726 6.492 1.00 0.21 C ATOM 89 CG ASP A 8 16.314 -12.610 7.677 1.00 0.26 C ATOM 90 OD1 ASP A 8 17.184 -12.200 8.474 1.00 0.32 O ATOM 91 OD2 ASP A 8 15.735 -13.710 7.805 1.00 0.31 O ATOM 0 H ASP A 8 13.578 -11.819 5.566 1.00 0.16 H new ATOM 0 HA ASP A 8 14.767 -10.558 7.905 1.00 0.18 H new ATOM 0 HB2 ASP A 8 15.603 -12.355 5.669 1.00 0.21 H new ATOM 0 HB3 ASP A 8 16.831 -11.200 6.145 1.00 0.21 H new ATOM 96 N LYS A 9 14.479 -8.848 5.175 1.00 0.14 N ATOM 97 CA LYS A 9 14.738 -7.542 4.523 1.00 0.14 C ATOM 98 C LYS A 9 13.699 -6.449 4.902 1.00 0.10 C ATOM 99 O LYS A 9 14.011 -5.265 4.748 1.00 0.10 O ATOM 100 CB LYS A 9 14.821 -7.654 2.976 1.00 0.19 C ATOM 101 CG LYS A 9 15.416 -8.977 2.434 1.00 0.32 C ATOM 102 CD LYS A 9 16.924 -9.129 2.746 1.00 0.92 C ATOM 103 CE LYS A 9 17.523 -10.410 2.140 1.00 1.20 C ATOM 104 NZ LYS A 9 18.974 -10.536 2.449 1.00 1.73 N ATOM 0 H LYS A 9 13.693 -9.361 4.776 1.00 0.14 H new ATOM 0 HA LYS A 9 15.710 -7.234 4.908 1.00 0.14 H new ATOM 0 HB2 LYS A 9 13.818 -7.532 2.566 1.00 0.19 H new ATOM 0 HB3 LYS A 9 15.422 -6.825 2.601 1.00 0.19 H new ATOM 0 HG2 LYS A 9 14.874 -9.818 2.866 1.00 0.32 H new ATOM 0 HG3 LYS A 9 15.267 -9.022 1.355 1.00 0.32 H new ATOM 0 HD2 LYS A 9 17.461 -8.262 2.360 1.00 0.92 H new ATOM 0 HD3 LYS A 9 17.069 -9.139 3.826 1.00 0.92 H new ATOM 0 HE2 LYS A 9 16.991 -11.279 2.527 1.00 1.20 H new ATOM 0 HE3 LYS A 9 17.380 -10.404 1.059 1.00 1.20 H new ATOM 0 HZ1 LYS A 9 19.345 -11.410 2.025 1.00 1.73 H new ATOM 0 HZ2 LYS A 9 19.484 -9.718 2.058 1.00 1.73 H new ATOM 0 HZ3 LYS A 9 19.108 -10.567 3.480 1.00 1.73 H new ATOM 118 N VAL A 10 12.452 -6.832 5.379 1.00 0.09 N ATOM 119 CA VAL A 10 11.386 -5.852 5.833 1.00 0.07 C ATOM 120 C VAL A 10 11.849 -4.808 6.945 1.00 0.06 C ATOM 121 O VAL A 10 12.528 -5.162 7.917 1.00 0.09 O ATOM 122 CB VAL A 10 10.030 -6.646 6.226 1.00 0.08 C ATOM 123 CG1 VAL A 10 10.067 -7.463 7.563 1.00 0.11 C ATOM 124 CG2 VAL A 10 8.760 -5.742 6.205 1.00 0.10 C ATOM 0 H VAL A 10 12.165 -7.808 5.457 1.00 0.09 H new ATOM 0 HA VAL A 10 11.178 -5.210 4.977 1.00 0.07 H new ATOM 0 HB VAL A 10 9.968 -7.382 5.425 1.00 0.08 H new ATOM 0 HG11 VAL A 10 9.104 -7.950 7.719 1.00 0.11 H new ATOM 0 HG12 VAL A 10 10.851 -8.218 7.506 1.00 0.11 H new ATOM 0 HG13 VAL A 10 10.272 -6.790 8.395 1.00 0.11 H new ATOM 0 HG21 VAL A 10 7.887 -6.335 6.477 1.00 0.10 H new ATOM 0 HG22 VAL A 10 8.882 -4.927 6.918 1.00 0.10 H new ATOM 0 HG23 VAL A 10 8.622 -5.331 5.205 1.00 0.10 H new ATOM 134 N ILE A 11 11.459 -3.538 6.737 1.00 0.06 N ATOM 135 CA ILE A 11 11.776 -2.456 7.702 1.00 0.07 C ATOM 136 C ILE A 11 10.507 -1.715 8.190 1.00 0.07 C ATOM 137 O ILE A 11 10.487 -1.218 9.320 1.00 0.08 O ATOM 138 CB ILE A 11 12.810 -1.382 7.162 1.00 0.10 C ATOM 139 CG1 ILE A 11 12.476 -0.935 5.691 1.00 0.10 C ATOM 140 CG2 ILE A 11 14.283 -1.899 7.298 1.00 0.13 C ATOM 141 CD1 ILE A 11 12.680 0.561 5.398 1.00 0.16 C ATOM 0 H ILE A 11 10.929 -3.232 5.921 1.00 0.06 H new ATOM 0 HA ILE A 11 12.245 -2.981 8.534 1.00 0.07 H new ATOM 0 HB ILE A 11 12.717 -0.493 7.786 1.00 0.10 H new ATOM 0 HG12 ILE A 11 13.096 -1.511 5.004 1.00 0.10 H new ATOM 0 HG13 ILE A 11 11.439 -1.192 5.477 1.00 0.10 H new ATOM 0 HG21 ILE A 11 14.971 -1.142 6.920 1.00 0.13 H new ATOM 0 HG22 ILE A 11 14.503 -2.098 8.347 1.00 0.13 H new ATOM 0 HG23 ILE A 11 14.401 -2.817 6.722 1.00 0.13 H new ATOM 0 HD11 ILE A 11 12.423 0.767 4.359 1.00 0.16 H new ATOM 0 HD12 ILE A 11 12.040 1.151 6.054 1.00 0.16 H new ATOM 0 HD13 ILE A 11 13.722 0.827 5.573 1.00 0.16 H new ATOM 153 N TRP A 12 9.448 -1.651 7.340 1.00 0.06 N ATOM 154 CA TRP A 12 8.209 -0.931 7.683 1.00 0.07 C ATOM 155 C TRP A 12 7.025 -1.370 6.766 1.00 0.08 C ATOM 156 O TRP A 12 7.074 -1.188 5.559 1.00 0.10 O ATOM 157 CB TRP A 12 8.543 0.572 7.562 1.00 0.10 C ATOM 158 CG TRP A 12 7.512 1.526 8.071 1.00 0.09 C ATOM 159 CD1 TRP A 12 7.446 2.140 9.290 1.00 0.19 C ATOM 160 CD2 TRP A 12 6.421 2.000 7.319 1.00 0.22 C ATOM 161 NE1 TRP A 12 6.356 2.973 9.327 1.00 0.26 N ATOM 162 CE2 TRP A 12 5.710 2.895 8.118 1.00 0.30 C ATOM 163 CE3 TRP A 12 5.988 1.734 6.032 1.00 0.35 C ATOM 164 CZ2 TRP A 12 4.574 3.533 7.656 1.00 0.44 C ATOM 165 CZ3 TRP A 12 4.881 2.349 5.565 1.00 0.51 C ATOM 166 CH2 TRP A 12 4.168 3.251 6.368 1.00 0.54 C ATOM 0 H TRP A 12 9.435 -2.089 6.419 1.00 0.06 H new ATOM 0 HA TRP A 12 7.873 -1.160 8.694 1.00 0.07 H new ATOM 0 HB2 TRP A 12 9.474 0.759 8.096 1.00 0.10 H new ATOM 0 HB3 TRP A 12 8.728 0.797 6.512 1.00 0.10 H new ATOM 0 HD1 TRP A 12 8.145 1.992 10.100 1.00 0.19 H new ATOM 0 HE1 TRP A 12 6.074 3.552 10.118 1.00 0.26 H new ATOM 0 HE3 TRP A 12 6.531 1.041 5.407 1.00 0.35 H new ATOM 0 HZ2 TRP A 12 4.026 4.225 8.279 1.00 0.44 H new ATOM 0 HZ3 TRP A 12 4.540 2.144 4.561 1.00 0.51 H new ATOM 0 HH2 TRP A 12 3.286 3.733 5.972 1.00 0.54 H new ATOM 177 N ALA A 13 5.951 -1.977 7.353 1.00 0.09 N ATOM 178 CA ALA A 13 4.742 -2.427 6.574 1.00 0.12 C ATOM 179 C ALA A 13 3.424 -2.044 7.303 1.00 0.16 C ATOM 180 O ALA A 13 3.260 -2.319 8.506 1.00 0.19 O ATOM 181 CB ALA A 13 4.771 -3.955 6.284 1.00 0.14 C ATOM 0 H ALA A 13 5.892 -2.167 8.353 1.00 0.09 H new ATOM 0 HA ALA A 13 4.774 -1.904 5.618 1.00 0.12 H new ATOM 0 HB1 ALA A 13 3.881 -4.235 5.721 1.00 0.14 H new ATOM 0 HB2 ALA A 13 5.660 -4.198 5.702 1.00 0.14 H new ATOM 0 HB3 ALA A 13 4.792 -4.504 7.226 1.00 0.14 H new ATOM 187 N VAL A 14 2.473 -1.382 6.576 1.00 0.20 N ATOM 188 CA VAL A 14 1.180 -0.936 7.205 1.00 0.26 C ATOM 189 C VAL A 14 -0.080 -1.210 6.297 1.00 0.27 C ATOM 190 O VAL A 14 -0.113 -0.833 5.131 1.00 0.28 O ATOM 191 CB VAL A 14 1.173 0.639 7.666 1.00 0.34 C ATOM 192 CG1 VAL A 14 -0.079 1.079 8.479 1.00 0.80 C ATOM 193 CG2 VAL A 14 2.358 1.030 8.553 1.00 1.05 C ATOM 0 H VAL A 14 2.567 -1.150 5.587 1.00 0.20 H new ATOM 0 HA VAL A 14 1.110 -1.552 8.101 1.00 0.26 H new ATOM 0 HB VAL A 14 1.204 1.137 6.697 1.00 0.34 H new ATOM 0 HG11 VAL A 14 0.008 2.134 8.738 1.00 0.80 H new ATOM 0 HG12 VAL A 14 -0.975 0.925 7.878 1.00 0.80 H new ATOM 0 HG13 VAL A 14 -0.147 0.486 9.391 1.00 0.80 H new ATOM 0 HG21 VAL A 14 2.283 2.085 8.816 1.00 1.05 H new ATOM 0 HG22 VAL A 14 2.347 0.428 9.461 1.00 1.05 H new ATOM 0 HG23 VAL A 14 3.289 0.856 8.014 1.00 1.05 H new ATOM 203 N ASN A 15 -1.132 -1.829 6.907 1.00 0.33 N ATOM 204 CA ASN A 15 -2.449 -2.014 6.252 1.00 0.43 C ATOM 205 C ASN A 15 -3.481 -1.168 7.028 1.00 0.46 C ATOM 206 O ASN A 15 -3.917 -1.539 8.115 1.00 0.55 O ATOM 207 CB ASN A 15 -2.932 -3.526 6.111 1.00 0.56 C ATOM 208 CG ASN A 15 -4.227 -3.718 5.302 1.00 1.40 C ATOM 209 OD1 ASN A 15 -5.106 -4.471 5.711 1.00 2.05 O ATOM 210 ND2 ASN A 15 -4.352 -3.035 4.179 1.00 2.11 N ATOM 0 H ASN A 15 -1.087 -2.207 7.853 1.00 0.33 H new ATOM 0 HA ASN A 15 -2.349 -1.681 5.219 1.00 0.43 H new ATOM 0 HB2 ASN A 15 -2.137 -4.104 5.640 1.00 0.56 H new ATOM 0 HB3 ASN A 15 -3.079 -3.940 7.109 1.00 0.56 H new ATOM 0 HD21 ASN A 15 -5.200 -3.124 3.620 1.00 2.11 H new ATOM 0 HD22 ASN A 15 -3.600 -2.419 3.871 1.00 2.11 H new ATOM 217 N ALA A 16 -3.884 -0.028 6.417 1.00 0.47 N ATOM 218 CA ALA A 16 -4.888 0.881 6.998 1.00 0.54 C ATOM 219 C ALA A 16 -6.326 0.338 6.740 1.00 0.58 C ATOM 220 O ALA A 16 -6.832 0.306 5.571 1.00 0.63 O ATOM 221 CB ALA A 16 -4.702 2.324 6.473 1.00 0.59 C ATOM 0 H ALA A 16 -3.523 0.281 5.515 1.00 0.47 H new ATOM 0 HA ALA A 16 -4.743 0.920 8.078 1.00 0.54 H new ATOM 0 HB1 ALA A 16 -5.456 2.973 6.918 1.00 0.59 H new ATOM 0 HB2 ALA A 16 -3.709 2.684 6.742 1.00 0.59 H new ATOM 0 HB3 ALA A 16 -4.810 2.333 5.388 1.00 0.59 H new ATOM 227 N GLY A 17 -6.880 -0.190 7.862 1.00 0.58 N ATOM 228 CA GLY A 17 -8.205 -0.794 7.906 1.00 0.61 C ATOM 229 C GLY A 17 -8.502 -1.550 9.201 1.00 0.62 C ATOM 230 O GLY A 17 -9.461 -1.225 9.903 1.00 0.71 O ATOM 0 H GLY A 17 -6.401 -0.200 8.762 1.00 0.58 H new ATOM 0 HA2 GLY A 17 -8.954 -0.013 7.774 1.00 0.61 H new ATOM 0 HA3 GLY A 17 -8.308 -1.480 7.065 1.00 0.61 H new ATOM 234 N GLY A 18 -7.662 -2.561 9.513 1.00 0.72 N ATOM 235 CA GLY A 18 -7.835 -3.386 10.727 1.00 0.73 C ATOM 236 C GLY A 18 -6.798 -3.083 11.813 1.00 0.68 C ATOM 237 O GLY A 18 -6.642 -1.919 12.191 1.00 0.80 O ATOM 0 H GLY A 18 -6.859 -2.824 8.942 1.00 0.72 H new ATOM 0 HA2 GLY A 18 -8.834 -3.222 11.131 1.00 0.73 H new ATOM 0 HA3 GLY A 18 -7.770 -4.440 10.455 1.00 0.73 H new ATOM 241 N GLU A 19 -6.109 -4.128 12.334 1.00 0.59 N ATOM 242 CA GLU A 19 -5.050 -3.958 13.361 1.00 0.60 C ATOM 243 C GLU A 19 -4.138 -5.201 13.458 1.00 0.54 C ATOM 244 O GLU A 19 -4.595 -6.289 13.826 1.00 0.65 O ATOM 245 CB GLU A 19 -5.636 -3.698 14.772 1.00 0.77 C ATOM 246 CG GLU A 19 -6.133 -2.269 15.045 1.00 1.43 C ATOM 247 CD GLU A 19 -6.689 -2.110 16.447 1.00 1.39 C ATOM 248 OE1 GLU A 19 -7.836 -2.544 16.688 1.00 1.50 O ATOM 249 OE2 GLU A 19 -5.976 -1.552 17.308 1.00 1.63 O ATOM 0 H GLU A 19 -6.267 -5.098 12.060 1.00 0.59 H new ATOM 0 HA GLU A 19 -4.473 -3.092 13.036 1.00 0.60 H new ATOM 0 HB2 GLU A 19 -6.466 -4.386 14.931 1.00 0.77 H new ATOM 0 HB3 GLU A 19 -4.873 -3.943 15.511 1.00 0.77 H new ATOM 0 HG2 GLU A 19 -5.311 -1.567 14.901 1.00 1.43 H new ATOM 0 HG3 GLU A 19 -6.904 -2.010 14.319 1.00 1.43 H new ATOM 256 N SER A 20 -2.820 -4.997 13.143 1.00 0.48 N ATOM 257 CA SER A 20 -1.704 -6.021 13.201 1.00 0.45 C ATOM 258 C SER A 20 -1.900 -7.349 12.386 1.00 0.43 C ATOM 259 O SER A 20 -2.718 -8.189 12.781 1.00 0.51 O ATOM 260 CB SER A 20 -1.417 -6.407 14.666 1.00 0.52 C ATOM 261 OG SER A 20 -0.023 -6.432 14.943 1.00 1.00 O ATOM 0 H SER A 20 -2.485 -4.086 12.830 1.00 0.48 H new ATOM 0 HA SER A 20 -0.874 -5.504 12.718 1.00 0.45 H new ATOM 0 HB2 SER A 20 -1.907 -5.696 15.332 1.00 0.52 H new ATOM 0 HB3 SER A 20 -1.846 -7.387 14.874 1.00 0.52 H new ATOM 0 HG SER A 20 0.395 -7.171 14.454 1.00 1.00 H new ATOM 267 N HIS A 21 -1.155 -7.556 11.270 1.00 0.39 N ATOM 268 CA HIS A 21 -1.290 -8.851 10.526 1.00 0.40 C ATOM 269 C HIS A 21 0.028 -9.362 9.908 1.00 0.40 C ATOM 270 O HIS A 21 0.778 -8.616 9.290 1.00 0.41 O ATOM 271 CB HIS A 21 -2.399 -8.799 9.431 1.00 0.43 C ATOM 272 CG HIS A 21 -2.532 -10.089 8.626 1.00 0.41 C ATOM 273 ND1 HIS A 21 -3.178 -11.207 9.101 1.00 0.39 N ATOM 274 CD2 HIS A 21 -2.016 -10.463 7.418 1.00 0.45 C ATOM 275 CE1 HIS A 21 -3.038 -12.188 8.225 1.00 0.40 C ATOM 276 NE2 HIS A 21 -2.348 -11.757 7.210 1.00 0.43 N ATOM 0 H HIS A 21 -0.489 -6.891 10.877 1.00 0.39 H new ATOM 0 HA HIS A 21 -1.585 -9.567 11.293 1.00 0.40 H new ATOM 0 HB2 HIS A 21 -3.355 -8.578 9.906 1.00 0.43 H new ATOM 0 HB3 HIS A 21 -2.184 -7.977 8.749 1.00 0.43 H new ATOM 0 HD2 HIS A 21 -1.445 -9.837 6.749 1.00 0.45 H new ATOM 0 HE1 HIS A 21 -3.433 -13.187 8.335 1.00 0.40 H new ATOM 0 HE2 HIS A 21 -2.097 -12.307 6.389 1.00 0.43 H new ATOM 285 N VAL A 22 0.228 -10.695 10.019 1.00 0.41 N ATOM 286 CA VAL A 22 1.409 -11.384 9.455 1.00 0.43 C ATOM 287 C VAL A 22 1.010 -12.241 8.190 1.00 0.44 C ATOM 288 O VAL A 22 0.196 -13.169 8.260 1.00 0.48 O ATOM 289 CB VAL A 22 2.269 -12.147 10.609 1.00 0.49 C ATOM 290 CG1 VAL A 22 1.630 -13.429 11.217 1.00 1.38 C ATOM 291 CG2 VAL A 22 3.725 -12.460 10.174 1.00 1.39 C ATOM 0 H VAL A 22 -0.421 -11.319 10.499 1.00 0.41 H new ATOM 0 HA VAL A 22 2.114 -10.649 9.066 1.00 0.43 H new ATOM 0 HB VAL A 22 2.269 -11.404 11.407 1.00 0.49 H new ATOM 0 HG11 VAL A 22 2.297 -13.845 11.972 1.00 1.38 H new ATOM 0 HG12 VAL A 22 0.674 -13.176 11.676 1.00 1.38 H new ATOM 0 HG13 VAL A 22 1.471 -14.165 10.429 1.00 1.38 H new ATOM 0 HG21 VAL A 22 4.246 -12.968 10.985 1.00 1.39 H new ATOM 0 HG22 VAL A 22 3.712 -13.102 9.293 1.00 1.39 H new ATOM 0 HG23 VAL A 22 4.242 -11.530 9.937 1.00 1.39 H new ATOM 301 N ASP A 23 1.625 -11.868 7.047 1.00 0.41 N ATOM 302 CA ASP A 23 1.418 -12.518 5.729 1.00 0.44 C ATOM 303 C ASP A 23 2.337 -13.784 5.579 1.00 0.43 C ATOM 304 O ASP A 23 3.402 -13.856 6.204 1.00 0.41 O ATOM 305 CB ASP A 23 1.586 -11.379 4.623 1.00 0.49 C ATOM 306 CG ASP A 23 2.205 -11.729 3.244 1.00 1.04 C ATOM 307 OD1 ASP A 23 1.631 -12.580 2.534 1.00 1.46 O ATOM 308 OD2 ASP A 23 3.249 -11.144 2.894 1.00 1.85 O ATOM 0 H ASP A 23 2.290 -11.095 7.011 1.00 0.41 H new ATOM 0 HA ASP A 23 0.418 -12.935 5.609 1.00 0.44 H new ATOM 0 HB2 ASP A 23 0.598 -10.957 4.438 1.00 0.49 H new ATOM 0 HB3 ASP A 23 2.194 -10.588 5.061 1.00 0.49 H new ATOM 313 N VAL A 24 1.884 -14.717 4.685 1.00 0.47 N ATOM 314 CA VAL A 24 2.511 -16.089 4.355 1.00 0.50 C ATOM 315 C VAL A 24 4.071 -16.200 4.207 1.00 0.47 C ATOM 316 O VAL A 24 4.634 -17.250 4.531 1.00 0.51 O ATOM 317 CB VAL A 24 1.836 -16.815 3.083 1.00 0.57 C ATOM 318 CG1 VAL A 24 0.481 -17.451 3.436 1.00 0.72 C ATOM 319 CG2 VAL A 24 1.630 -15.908 1.825 1.00 0.58 C ATOM 0 H VAL A 24 1.039 -14.551 4.139 1.00 0.47 H new ATOM 0 HA VAL A 24 2.276 -16.602 5.288 1.00 0.50 H new ATOM 0 HB VAL A 24 2.570 -17.576 2.818 1.00 0.57 H new ATOM 0 HG11 VAL A 24 0.062 -17.929 2.551 1.00 0.72 H new ATOM 0 HG12 VAL A 24 0.622 -18.197 4.218 1.00 0.72 H new ATOM 0 HG13 VAL A 24 -0.202 -16.679 3.789 1.00 0.72 H new ATOM 0 HG21 VAL A 24 1.170 -16.491 1.027 1.00 0.58 H new ATOM 0 HG22 VAL A 24 0.981 -15.071 2.082 1.00 0.58 H new ATOM 0 HG23 VAL A 24 2.595 -15.529 1.488 1.00 0.58 H new ATOM 329 N HIS A 25 4.745 -15.141 3.724 1.00 0.42 N ATOM 330 CA HIS A 25 6.231 -15.123 3.606 1.00 0.40 C ATOM 331 C HIS A 25 6.902 -14.634 4.931 1.00 0.36 C ATOM 332 O HIS A 25 8.065 -14.941 5.208 1.00 0.39 O ATOM 333 CB HIS A 25 6.665 -14.215 2.446 1.00 0.38 C ATOM 334 CG HIS A 25 5.941 -14.472 1.149 1.00 0.42 C ATOM 335 ND1 HIS A 25 6.185 -15.571 0.353 1.00 0.45 N ATOM 336 CD2 HIS A 25 4.969 -13.764 0.519 1.00 0.48 C ATOM 337 CE1 HIS A 25 5.396 -15.528 -0.708 1.00 0.49 C ATOM 338 NE2 HIS A 25 4.650 -14.443 -0.630 1.00 0.51 N ATOM 0 H HIS A 25 4.293 -14.283 3.407 1.00 0.42 H new ATOM 0 HA HIS A 25 6.557 -16.144 3.410 1.00 0.40 H new ATOM 0 HB2 HIS A 25 6.508 -13.176 2.736 1.00 0.38 H new ATOM 0 HB3 HIS A 25 7.735 -14.342 2.282 1.00 0.38 H new ATOM 0 HD2 HIS A 25 4.529 -12.838 0.859 1.00 0.48 H new ATOM 0 HE1 HIS A 25 5.368 -16.258 -1.504 1.00 0.49 H new ATOM 0 HE2 HIS A 25 3.949 -14.155 -1.313 1.00 0.51 H new ATOM 347 N GLY A 26 6.119 -13.865 5.721 1.00 0.34 N ATOM 348 CA GLY A 26 6.527 -13.341 7.018 1.00 0.32 C ATOM 349 C GLY A 26 6.568 -11.817 7.098 1.00 0.27 C ATOM 350 O GLY A 26 7.481 -11.251 7.702 1.00 0.26 O ATOM 0 H GLY A 26 5.171 -13.594 5.459 1.00 0.34 H new ATOM 0 HA2 GLY A 26 5.842 -13.714 7.779 1.00 0.32 H new ATOM 0 HA3 GLY A 26 7.515 -13.732 7.260 1.00 0.32 H new ATOM 354 N ILE A 27 5.559 -11.153 6.494 1.00 0.26 N ATOM 355 CA ILE A 27 5.474 -9.673 6.492 1.00 0.23 C ATOM 356 C ILE A 27 4.332 -9.205 7.466 1.00 0.26 C ATOM 357 O ILE A 27 3.148 -9.408 7.199 1.00 0.33 O ATOM 358 CB ILE A 27 5.349 -9.137 4.982 1.00 0.22 C ATOM 359 CG1 ILE A 27 6.614 -9.495 4.090 1.00 0.18 C ATOM 360 CG2 ILE A 27 5.058 -7.606 4.815 1.00 0.26 C ATOM 361 CD1 ILE A 27 8.025 -9.213 4.627 1.00 0.55 C ATOM 0 H ILE A 27 4.794 -11.615 6.003 1.00 0.26 H new ATOM 0 HA ILE A 27 6.387 -9.224 6.882 1.00 0.23 H new ATOM 0 HB ILE A 27 4.466 -9.673 4.634 1.00 0.22 H new ATOM 0 HG12 ILE A 27 6.560 -10.559 3.859 1.00 0.18 H new ATOM 0 HG13 ILE A 27 6.511 -8.958 3.147 1.00 0.18 H new ATOM 0 HG21 ILE A 27 4.995 -7.361 3.755 1.00 0.26 H new ATOM 0 HG22 ILE A 27 4.114 -7.360 5.301 1.00 0.26 H new ATOM 0 HG23 ILE A 27 5.863 -7.031 5.273 1.00 0.26 H new ATOM 0 HD11 ILE A 27 8.764 -9.520 3.887 1.00 0.55 H new ATOM 0 HD12 ILE A 27 8.132 -8.147 4.827 1.00 0.55 H new ATOM 0 HD13 ILE A 27 8.182 -9.772 5.549 1.00 0.55 H new ATOM 373 N HIS A 28 4.733 -8.529 8.559 1.00 0.25 N ATOM 374 CA HIS A 28 3.799 -8.061 9.605 1.00 0.30 C ATOM 375 C HIS A 28 3.504 -6.535 9.599 1.00 0.28 C ATOM 376 O HIS A 28 4.414 -5.702 9.528 1.00 0.28 O ATOM 377 CB HIS A 28 4.390 -8.454 10.974 1.00 0.40 C ATOM 378 CG HIS A 28 3.403 -8.742 12.080 1.00 0.63 C ATOM 379 ND1 HIS A 28 3.583 -9.767 12.987 1.00 0.93 N ATOM 380 CD2 HIS A 28 2.251 -8.128 12.439 1.00 0.96 C ATOM 381 CE1 HIS A 28 2.585 -9.767 13.854 1.00 1.30 C ATOM 382 NE2 HIS A 28 1.765 -8.783 13.544 1.00 1.34 N ATOM 0 H HIS A 28 5.708 -8.292 8.743 1.00 0.25 H new ATOM 0 HA HIS A 28 2.840 -8.538 9.400 1.00 0.30 H new ATOM 0 HB2 HIS A 28 5.013 -9.338 10.835 1.00 0.40 H new ATOM 0 HB3 HIS A 28 5.047 -7.650 11.305 1.00 0.40 H new ATOM 0 HD1 HIS A 28 4.365 -10.422 12.988 1.00 0.93 H new ATOM 0 HD2 HIS A 28 1.798 -7.280 11.947 1.00 0.96 H new ATOM 0 HE1 HIS A 28 2.463 -10.456 14.676 1.00 1.30 H new ATOM 391 N TYR A 29 2.183 -6.206 9.691 1.00 0.33 N ATOM 392 CA TYR A 29 1.679 -4.817 9.805 1.00 0.38 C ATOM 393 C TYR A 29 1.501 -4.438 11.308 1.00 0.45 C ATOM 394 O TYR A 29 1.103 -5.272 12.134 1.00 0.46 O ATOM 395 CB TYR A 29 0.353 -4.629 8.949 1.00 0.45 C ATOM 396 CG TYR A 29 -0.842 -3.861 9.598 1.00 0.98 C ATOM 397 CD1 TYR A 29 -0.703 -2.566 10.114 1.00 1.31 C ATOM 398 CD2 TYR A 29 -2.101 -4.458 9.724 1.00 1.34 C ATOM 399 CE1 TYR A 29 -1.779 -1.917 10.706 1.00 1.91 C ATOM 400 CE2 TYR A 29 -3.156 -3.813 10.312 1.00 1.91 C ATOM 401 CZ TYR A 29 -2.953 -2.424 10.720 1.00 2.21 C ATOM 402 OH TYR A 29 -4.065 -1.943 11.383 1.00 2.79 O ATOM 0 H TYR A 29 1.440 -6.905 9.688 1.00 0.33 H new ATOM 0 HA TYR A 29 2.410 -4.125 9.387 1.00 0.38 H new ATOM 0 HB2 TYR A 29 0.622 -4.110 8.029 1.00 0.45 H new ATOM 0 HB3 TYR A 29 -0.003 -5.619 8.665 1.00 0.45 H new ATOM 0 HD1 TYR A 29 0.252 -2.066 10.051 1.00 1.31 H new ATOM 0 HD2 TYR A 29 -2.245 -5.459 9.346 1.00 1.34 H new ATOM 0 HE1 TYR A 29 -1.619 -0.954 11.169 1.00 1.91 H new ATOM 0 HE2 TYR A 29 -4.101 -4.311 10.468 1.00 1.91 H new ATOM 0 HH TYR A 29 -4.676 -1.529 10.739 1.00 2.79 H new ATOM 412 N ARG A 30 1.746 -3.130 11.589 1.00 0.54 N ATOM 413 CA ARG A 30 1.700 -2.460 12.930 1.00 0.63 C ATOM 414 C ARG A 30 0.337 -2.537 13.712 1.00 0.91 C ATOM 415 O ARG A 30 -0.039 -3.610 14.175 1.00 1.87 O ATOM 416 CB ARG A 30 2.116 -0.982 12.723 1.00 0.72 C ATOM 417 CG ARG A 30 3.629 -0.700 12.498 1.00 0.68 C ATOM 418 CD ARG A 30 4.302 -1.611 11.457 1.00 0.87 C ATOM 419 NE ARG A 30 5.674 -1.183 11.161 1.00 1.70 N ATOM 420 CZ ARG A 30 6.762 -1.633 11.795 1.00 2.08 C ATOM 421 NH1 ARG A 30 6.656 -2.512 12.784 1.00 1.93 N ATOM 422 NH2 ARG A 30 7.961 -1.193 11.440 1.00 3.00 N ATOM 0 H ARG A 30 1.995 -2.473 10.850 1.00 0.54 H new ATOM 0 HA ARG A 30 2.385 -3.014 13.571 1.00 0.63 H new ATOM 0 HB2 ARG A 30 1.567 -0.592 11.865 1.00 0.72 H new ATOM 0 HB3 ARG A 30 1.791 -0.413 13.594 1.00 0.72 H new ATOM 0 HG2 ARG A 30 3.749 0.337 12.186 1.00 0.68 H new ATOM 0 HG3 ARG A 30 4.151 -0.809 13.449 1.00 0.68 H new ATOM 0 HD2 ARG A 30 4.313 -2.637 11.825 1.00 0.87 H new ATOM 0 HD3 ARG A 30 3.715 -1.609 10.539 1.00 0.87 H new ATOM 0 HE ARG A 30 5.807 -0.494 10.420 1.00 1.70 H new ATOM 0 HH11 ARG A 30 5.737 -2.852 13.068 1.00 1.93 H new ATOM 0 HH12 ARG A 30 7.493 -2.848 13.260 1.00 1.93 H new ATOM 0 HH21 ARG A 30 8.052 -0.513 10.685 1.00 3.00 H new ATOM 0 HH22 ARG A 30 8.793 -1.534 11.922 1.00 3.00 H new ATOM 436 N LYS A 31 -0.363 -1.392 13.875 1.00 0.57 N ATOM 437 CA LYS A 31 -1.639 -1.312 14.627 1.00 0.59 C ATOM 438 C LYS A 31 -2.259 0.119 14.636 1.00 0.64 C ATOM 439 O LYS A 31 -2.106 0.851 15.623 1.00 0.79 O ATOM 440 CB LYS A 31 -1.400 -1.747 16.096 1.00 0.73 C ATOM 441 CG LYS A 31 -2.516 -2.611 16.718 1.00 1.15 C ATOM 442 CD LYS A 31 -2.300 -2.865 18.227 1.00 1.44 C ATOM 443 CE LYS A 31 -3.377 -3.785 18.827 1.00 1.70 C ATOM 444 NZ LYS A 31 -3.131 -4.049 20.270 1.00 2.30 N ATOM 0 H LYS A 31 -0.061 -0.497 13.490 1.00 0.57 H new ATOM 0 HA LYS A 31 -2.340 -1.975 14.120 1.00 0.59 H new ATOM 0 HB2 LYS A 31 -0.463 -2.302 16.145 1.00 0.73 H new ATOM 0 HB3 LYS A 31 -1.273 -0.853 16.706 1.00 0.73 H new ATOM 0 HG2 LYS A 31 -3.477 -2.118 16.570 1.00 1.15 H new ATOM 0 HG3 LYS A 31 -2.564 -3.567 16.196 1.00 1.15 H new ATOM 0 HD2 LYS A 31 -1.318 -3.312 18.380 1.00 1.44 H new ATOM 0 HD3 LYS A 31 -2.303 -1.913 18.757 1.00 1.44 H new ATOM 0 HE2 LYS A 31 -4.358 -3.327 18.703 1.00 1.70 H new ATOM 0 HE3 LYS A 31 -3.395 -4.729 18.282 1.00 1.70 H new ATOM 0 HZ1 LYS A 31 -3.876 -4.672 20.641 1.00 2.30 H new ATOM 0 HZ2 LYS A 31 -2.205 -4.509 20.386 1.00 2.30 H new ATOM 0 HZ3 LYS A 31 -3.139 -3.150 20.794 1.00 2.30 H new ATOM 458 N ASP A 32 -2.952 0.528 13.522 1.00 0.61 N ATOM 459 CA ASP A 32 -3.680 1.852 13.388 1.00 0.72 C ATOM 460 C ASP A 32 -2.814 3.170 13.408 1.00 0.75 C ATOM 461 O ASP A 32 -3.183 4.124 14.105 1.00 1.00 O ATOM 462 CB ASP A 32 -4.781 1.953 14.472 1.00 0.86 C ATOM 463 CG ASP A 32 -6.176 1.656 13.945 1.00 0.95 C ATOM 464 OD1 ASP A 32 -6.392 0.540 13.432 1.00 1.01 O ATOM 465 OD2 ASP A 32 -7.051 2.542 14.053 1.00 1.17 O ATOM 0 H ASP A 32 -3.025 -0.050 12.685 1.00 0.61 H new ATOM 0 HA ASP A 32 -4.082 1.817 12.375 1.00 0.72 H new ATOM 0 HB2 ASP A 32 -4.550 1.258 15.280 1.00 0.86 H new ATOM 0 HB3 ASP A 32 -4.768 2.955 14.900 1.00 0.86 H new ATOM 470 N PRO A 33 -1.670 3.271 12.656 1.00 0.59 N ATOM 471 CA PRO A 33 -0.844 4.484 12.613 1.00 0.66 C ATOM 472 C PRO A 33 -0.931 5.279 11.279 1.00 0.83 C ATOM 473 O PRO A 33 -1.228 4.726 10.216 1.00 1.45 O ATOM 474 CB PRO A 33 0.553 3.877 12.779 1.00 0.59 C ATOM 475 CG PRO A 33 0.477 2.562 12.019 1.00 0.57 C ATOM 476 CD PRO A 33 -1.020 2.238 11.847 1.00 0.49 C ATOM 0 HA PRO A 33 -1.147 5.220 13.358 1.00 0.66 H new ATOM 0 HB2 PRO A 33 1.323 4.531 12.369 1.00 0.59 H new ATOM 0 HB3 PRO A 33 0.796 3.717 13.829 1.00 0.59 H new ATOM 0 HG2 PRO A 33 0.969 2.646 11.050 1.00 0.57 H new ATOM 0 HG3 PRO A 33 0.985 1.768 12.567 1.00 0.57 H new ATOM 0 HD2 PRO A 33 -1.328 2.289 10.803 1.00 0.49 H new ATOM 0 HD3 PRO A 33 -1.260 1.236 12.201 1.00 0.49 H new ATOM 715 N PRO A 49 -15.000 -10.341 -0.136 1.00 0.82 N ATOM 716 CA PRO A 49 -13.550 -10.730 -0.153 1.00 0.89 C ATOM 717 C PRO A 49 -12.756 -10.428 -1.445 1.00 0.75 C ATOM 718 O PRO A 49 -13.330 -10.287 -2.528 1.00 0.78 O ATOM 719 CB PRO A 49 -13.587 -12.264 0.031 1.00 1.31 C ATOM 720 CG PRO A 49 -14.924 -12.546 0.645 1.00 1.37 C ATOM 721 CD PRO A 49 -15.862 -11.548 0.005 1.00 1.05 C ATOM 0 HA PRO A 49 -13.034 -10.147 0.610 1.00 0.89 H new ATOM 0 HB2 PRO A 49 -13.474 -12.779 -0.923 1.00 1.31 H new ATOM 0 HB3 PRO A 49 -12.776 -12.604 0.675 1.00 1.31 H new ATOM 0 HG2 PRO A 49 -15.242 -13.570 0.448 1.00 1.37 H new ATOM 0 HG3 PRO A 49 -14.896 -12.424 1.728 1.00 1.37 H new ATOM 0 HD2 PRO A 49 -16.231 -11.898 -0.959 1.00 1.05 H new ATOM 0 HD3 PRO A 49 -16.734 -11.353 0.629 1.00 1.05 H new ATOM 729 N ILE A 50 -11.408 -10.343 -1.290 1.00 0.67 N ATOM 730 CA ILE A 50 -10.470 -10.113 -2.396 1.00 0.60 C ATOM 731 C ILE A 50 -10.070 -11.504 -3.028 1.00 0.64 C ATOM 732 O ILE A 50 -9.597 -12.417 -2.338 1.00 0.69 O ATOM 733 CB ILE A 50 -9.267 -9.107 -1.888 1.00 0.57 C ATOM 734 CG1 ILE A 50 -9.445 -7.687 -2.508 1.00 0.54 C ATOM 735 CG2 ILE A 50 -7.796 -9.545 -2.158 1.00 0.59 C ATOM 736 CD1 ILE A 50 -10.577 -6.854 -1.938 1.00 0.59 C ATOM 0 H ILE A 50 -10.949 -10.434 -0.384 1.00 0.67 H new ATOM 0 HA ILE A 50 -10.907 -9.571 -3.235 1.00 0.60 H new ATOM 0 HB ILE A 50 -9.390 -9.131 -0.805 1.00 0.57 H new ATOM 0 HG12 ILE A 50 -8.513 -7.136 -2.379 1.00 0.54 H new ATOM 0 HG13 ILE A 50 -9.605 -7.797 -3.581 1.00 0.54 H new ATOM 0 HG21 ILE A 50 -7.114 -8.788 -1.770 1.00 0.59 H new ATOM 0 HG22 ILE A 50 -7.603 -10.496 -1.662 1.00 0.59 H new ATOM 0 HG23 ILE A 50 -7.641 -9.658 -3.231 1.00 0.59 H new ATOM 0 HD11 ILE A 50 -10.607 -5.888 -2.442 1.00 0.59 H new ATOM 0 HD12 ILE A 50 -11.523 -7.373 -2.091 1.00 0.59 H new ATOM 0 HD13 ILE A 50 -10.415 -6.701 -0.871 1.00 0.59 H new ATOM 748 N LEU A 51 -10.292 -11.611 -4.353 1.00 0.65 N ATOM 749 CA LEU A 51 -10.065 -12.857 -5.142 1.00 0.71 C ATOM 750 C LEU A 51 -8.603 -13.141 -5.579 1.00 0.78 C ATOM 751 O LEU A 51 -8.276 -14.285 -5.905 1.00 1.26 O ATOM 752 CB LEU A 51 -10.954 -12.811 -6.395 1.00 0.74 C ATOM 753 CG LEU A 51 -12.314 -13.570 -6.347 1.00 0.86 C ATOM 754 CD1 LEU A 51 -13.406 -12.711 -5.709 1.00 1.22 C ATOM 755 CD2 LEU A 51 -12.755 -13.998 -7.745 1.00 1.28 C ATOM 0 H LEU A 51 -10.636 -10.835 -4.918 1.00 0.65 H new ATOM 0 HA LEU A 51 -10.318 -13.672 -4.463 1.00 0.71 H new ATOM 0 HB2 LEU A 51 -11.162 -11.765 -6.621 1.00 0.74 H new ATOM 0 HB3 LEU A 51 -10.377 -13.209 -7.230 1.00 0.74 H new ATOM 0 HG LEU A 51 -12.163 -14.459 -5.735 1.00 0.86 H new ATOM 0 HD11 LEU A 51 -14.343 -13.268 -5.690 1.00 1.22 H new ATOM 0 HD12 LEU A 51 -13.117 -12.452 -4.690 1.00 1.22 H new ATOM 0 HD13 LEU A 51 -13.538 -11.799 -6.291 1.00 1.22 H new ATOM 0 HD21 LEU A 51 -13.707 -14.525 -7.681 1.00 1.28 H new ATOM 0 HD22 LEU A 51 -12.870 -13.117 -8.376 1.00 1.28 H new ATOM 0 HD23 LEU A 51 -12.003 -14.658 -8.178 1.00 1.28 H new ATOM 767 N ARG A 52 -7.732 -12.110 -5.585 1.00 0.58 N ATOM 768 CA ARG A 52 -6.302 -12.278 -5.952 1.00 0.58 C ATOM 769 C ARG A 52 -5.354 -12.491 -4.719 1.00 0.57 C ATOM 770 O ARG A 52 -4.150 -12.222 -4.797 1.00 0.65 O ATOM 771 CB ARG A 52 -5.827 -11.061 -6.779 1.00 0.57 C ATOM 772 CG ARG A 52 -5.474 -11.353 -8.263 1.00 0.70 C ATOM 773 CD ARG A 52 -6.702 -11.714 -9.119 1.00 0.64 C ATOM 774 NE ARG A 52 -6.333 -11.956 -10.511 1.00 0.87 N ATOM 775 CZ ARG A 52 -7.144 -12.515 -11.407 1.00 1.19 C ATOM 776 NH1 ARG A 52 -8.369 -12.888 -11.062 1.00 1.34 N ATOM 777 NH2 ARG A 52 -6.728 -12.699 -12.652 1.00 1.51 N ATOM 0 H ARG A 52 -7.989 -11.153 -5.341 1.00 0.58 H new ATOM 0 HA ARG A 52 -6.241 -13.190 -6.546 1.00 0.58 H new ATOM 0 HB2 ARG A 52 -6.607 -10.300 -6.753 1.00 0.57 H new ATOM 0 HB3 ARG A 52 -4.950 -10.635 -6.293 1.00 0.57 H new ATOM 0 HG2 ARG A 52 -4.984 -10.479 -8.692 1.00 0.70 H new ATOM 0 HG3 ARG A 52 -4.757 -12.173 -8.305 1.00 0.70 H new ATOM 0 HD2 ARG A 52 -7.183 -12.602 -8.710 1.00 0.64 H new ATOM 0 HD3 ARG A 52 -7.431 -10.905 -9.070 1.00 0.64 H new ATOM 0 HE ARG A 52 -5.399 -11.681 -10.815 1.00 0.87 H new ATOM 0 HH11 ARG A 52 -8.695 -12.747 -10.106 1.00 1.34 H new ATOM 0 HH12 ARG A 52 -8.986 -13.316 -11.753 1.00 1.34 H new ATOM 0 HH21 ARG A 52 -5.787 -12.412 -12.923 1.00 1.51 H new ATOM 0 HH22 ARG A 52 -7.349 -13.127 -13.339 1.00 1.51 H new ATOM 791 N SER A 53 -5.921 -12.990 -3.593 1.00 0.53 N ATOM 792 CA SER A 53 -5.177 -13.269 -2.357 1.00 0.54 C ATOM 793 C SER A 53 -5.783 -14.499 -1.605 1.00 0.57 C ATOM 794 O SER A 53 -6.674 -15.191 -2.118 1.00 0.67 O ATOM 795 CB SER A 53 -5.208 -12.005 -1.466 1.00 0.53 C ATOM 796 OG SER A 53 -4.017 -11.874 -0.703 1.00 1.09 O ATOM 0 H SER A 53 -6.915 -13.209 -3.525 1.00 0.53 H new ATOM 0 HA SER A 53 -4.144 -13.518 -2.601 1.00 0.54 H new ATOM 0 HB2 SER A 53 -5.339 -11.122 -2.091 1.00 0.53 H new ATOM 0 HB3 SER A 53 -6.067 -12.052 -0.796 1.00 0.53 H new ATOM 0 HG SER A 53 -3.682 -10.956 -0.774 1.00 1.09 H new ATOM 802 N ASN A 54 -5.275 -14.771 -0.378 1.00 0.59 N ATOM 803 CA ASN A 54 -5.774 -15.896 0.500 1.00 0.64 C ATOM 804 C ASN A 54 -6.830 -15.334 1.520 1.00 0.63 C ATOM 805 O ASN A 54 -7.181 -14.166 1.412 1.00 0.66 O ATOM 806 CB ASN A 54 -4.631 -16.624 1.326 1.00 0.80 C ATOM 807 CG ASN A 54 -3.158 -16.324 0.995 1.00 0.85 C ATOM 808 OD1 ASN A 54 -2.759 -16.219 -0.167 1.00 1.27 O ATOM 809 ND2 ASN A 54 -2.355 -16.205 2.047 1.00 1.12 N ATOM 0 H ASN A 54 -4.517 -14.233 0.041 1.00 0.59 H new ATOM 0 HA ASN A 54 -6.208 -16.633 -0.175 1.00 0.64 H new ATOM 0 HB2 ASN A 54 -4.785 -16.387 2.379 1.00 0.80 H new ATOM 0 HB3 ASN A 54 -4.780 -17.698 1.216 1.00 0.80 H new ATOM 0 HD21 ASN A 54 -1.361 -16.019 1.912 1.00 1.12 H new ATOM 0 HD22 ASN A 54 -2.732 -16.300 2.990 1.00 1.12 H new ATOM 816 N PRO A 55 -7.420 -16.133 2.504 1.00 0.71 N ATOM 817 CA PRO A 55 -8.372 -15.576 3.549 1.00 0.75 C ATOM 818 C PRO A 55 -7.672 -14.645 4.587 1.00 0.74 C ATOM 819 O PRO A 55 -8.175 -13.557 4.938 1.00 0.80 O ATOM 820 CB PRO A 55 -8.914 -16.839 4.255 1.00 0.89 C ATOM 821 CG PRO A 55 -8.665 -17.951 3.275 1.00 0.95 C ATOM 822 CD PRO A 55 -7.338 -17.611 2.626 1.00 0.83 C ATOM 0 HA PRO A 55 -9.140 -14.954 3.089 1.00 0.75 H new ATOM 0 HB2 PRO A 55 -8.399 -17.018 5.199 1.00 0.89 H new ATOM 0 HB3 PRO A 55 -9.975 -16.742 4.484 1.00 0.89 H new ATOM 0 HG2 PRO A 55 -8.623 -18.918 3.777 1.00 0.95 H new ATOM 0 HG3 PRO A 55 -9.463 -18.011 2.535 1.00 0.95 H new ATOM 0 HD2 PRO A 55 -6.493 -17.923 3.239 1.00 0.83 H new ATOM 0 HD3 PRO A 55 -7.223 -18.094 1.656 1.00 0.83 H new ATOM 830 N GLU A 56 -6.441 -15.071 4.978 1.00 0.71 N ATOM 831 CA GLU A 56 -5.532 -14.345 5.929 1.00 0.73 C ATOM 832 C GLU A 56 -4.966 -13.024 5.307 1.00 0.65 C ATOM 833 O GLU A 56 -5.097 -11.908 5.872 1.00 0.67 O ATOM 834 CB GLU A 56 -4.363 -15.293 6.354 1.00 0.80 C ATOM 835 CG GLU A 56 -3.743 -16.142 5.240 1.00 0.97 C ATOM 836 CD GLU A 56 -2.624 -17.025 5.755 1.00 1.48 C ATOM 837 OE1 GLU A 56 -1.558 -16.483 6.120 1.00 1.63 O ATOM 838 OE2 GLU A 56 -2.810 -18.260 5.790 1.00 2.04 O ATOM 0 H GLU A 56 -6.038 -15.944 4.639 1.00 0.71 H new ATOM 0 HA GLU A 56 -6.114 -14.061 6.805 1.00 0.73 H new ATOM 0 HB2 GLU A 56 -3.575 -14.687 6.802 1.00 0.80 H new ATOM 0 HB3 GLU A 56 -4.730 -15.963 7.131 1.00 0.80 H new ATOM 0 HG2 GLU A 56 -4.515 -16.763 4.785 1.00 0.97 H new ATOM 0 HG3 GLU A 56 -3.358 -15.488 4.457 1.00 0.97 H new ATOM 845 N ASP A 57 -4.437 -13.158 4.066 1.00 0.62 N ATOM 846 CA ASP A 57 -3.907 -12.021 3.287 1.00 0.58 C ATOM 847 C ASP A 57 -5.040 -11.185 2.591 1.00 0.52 C ATOM 848 O ASP A 57 -4.774 -10.131 2.020 1.00 0.53 O ATOM 849 CB ASP A 57 -2.895 -12.529 2.276 1.00 0.60 C ATOM 850 CG ASP A 57 -1.469 -12.164 2.637 1.00 1.08 C ATOM 851 OD1 ASP A 57 -0.831 -12.942 3.376 1.00 1.62 O ATOM 852 OD2 ASP A 57 -0.991 -11.104 2.181 1.00 1.62 O ATOM 0 H ASP A 57 -4.368 -14.054 3.583 1.00 0.62 H new ATOM 0 HA ASP A 57 -3.414 -11.339 3.980 1.00 0.58 H new ATOM 0 HB2 ASP A 57 -2.979 -13.613 2.198 1.00 0.60 H new ATOM 0 HB3 ASP A 57 -3.132 -12.120 1.294 1.00 0.60 H new ATOM 857 N GLN A 58 -6.323 -11.682 2.702 1.00 0.52 N ATOM 858 CA GLN A 58 -7.563 -10.995 2.241 1.00 0.51 C ATOM 859 C GLN A 58 -7.867 -9.846 3.230 1.00 0.50 C ATOM 860 O GLN A 58 -8.174 -8.744 2.825 1.00 0.49 O ATOM 861 CB GLN A 58 -8.747 -11.987 2.215 1.00 0.60 C ATOM 862 CG GLN A 58 -10.091 -11.429 1.708 1.00 0.84 C ATOM 863 CD GLN A 58 -11.227 -11.750 2.662 1.00 0.91 C ATOM 864 OE1 GLN A 58 -11.844 -12.813 2.577 1.00 1.16 O ATOM 865 NE2 GLN A 58 -11.511 -10.831 3.577 1.00 1.77 N ATOM 0 H GLN A 58 -6.514 -12.590 3.125 1.00 0.52 H new ATOM 0 HA GLN A 58 -7.421 -10.606 1.233 1.00 0.51 H new ATOM 0 HB2 GLN A 58 -8.470 -12.835 1.589 1.00 0.60 H new ATOM 0 HB3 GLN A 58 -8.894 -12.371 3.224 1.00 0.60 H new ATOM 0 HG2 GLN A 58 -10.013 -10.349 1.585 1.00 0.84 H new ATOM 0 HG3 GLN A 58 -10.311 -11.847 0.726 1.00 0.84 H new ATOM 0 HE21 GLN A 58 -10.975 -9.964 3.613 1.00 1.77 H new ATOM 0 HE22 GLN A 58 -12.265 -10.992 4.244 1.00 1.77 H new ATOM 874 N VAL A 59 -7.693 -10.139 4.560 1.00 0.52 N ATOM 875 CA VAL A 59 -7.814 -9.122 5.685 1.00 0.54 C ATOM 876 C VAL A 59 -6.733 -7.993 5.493 1.00 0.52 C ATOM 877 O VAL A 59 -7.053 -6.814 5.600 1.00 0.55 O ATOM 878 CB VAL A 59 -7.658 -9.770 7.158 1.00 0.55 C ATOM 879 CG1 VAL A 59 -7.932 -8.783 8.326 1.00 0.80 C ATOM 880 CG2 VAL A 59 -8.590 -10.955 7.383 1.00 0.81 C ATOM 0 H VAL A 59 -7.466 -11.077 4.890 1.00 0.52 H new ATOM 0 HA VAL A 59 -8.822 -8.710 5.627 1.00 0.54 H new ATOM 0 HB VAL A 59 -6.612 -10.076 7.172 1.00 0.55 H new ATOM 0 HG11 VAL A 59 -7.805 -9.300 9.277 1.00 0.80 H new ATOM 0 HG12 VAL A 59 -7.232 -7.950 8.270 1.00 0.80 H new ATOM 0 HG13 VAL A 59 -8.952 -8.405 8.252 1.00 0.80 H new ATOM 0 HG21 VAL A 59 -8.441 -11.349 8.388 1.00 0.81 H new ATOM 0 HG22 VAL A 59 -9.625 -10.631 7.270 1.00 0.81 H new ATOM 0 HG23 VAL A 59 -8.372 -11.734 6.652 1.00 0.81 H new ATOM 890 N LEU A 60 -5.465 -8.387 5.177 1.00 0.49 N ATOM 891 CA LEU A 60 -4.389 -7.390 4.904 1.00 0.48 C ATOM 892 C LEU A 60 -4.426 -6.773 3.449 1.00 0.49 C ATOM 893 O LEU A 60 -3.640 -5.900 3.130 1.00 0.65 O ATOM 894 CB LEU A 60 -3.033 -8.043 5.205 1.00 0.52 C ATOM 895 CG LEU A 60 -1.758 -7.174 5.013 1.00 0.71 C ATOM 896 CD1 LEU A 60 -1.214 -6.680 6.343 1.00 1.15 C ATOM 897 CD2 LEU A 60 -0.654 -7.924 4.268 1.00 0.90 C ATOM 0 H LEU A 60 -5.169 -9.361 5.106 1.00 0.49 H new ATOM 0 HA LEU A 60 -4.558 -6.537 5.561 1.00 0.48 H new ATOM 0 HB2 LEU A 60 -3.050 -8.392 6.238 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -2.937 -8.925 4.572 1.00 0.52 H new ATOM 0 HG LEU A 60 -2.065 -6.320 4.410 1.00 0.71 H new ATOM 0 HD11 LEU A 60 -0.323 -6.076 6.170 1.00 1.15 H new ATOM 0 HD12 LEU A 60 -1.970 -6.076 6.844 1.00 1.15 H new ATOM 0 HD13 LEU A 60 -0.958 -7.533 6.971 1.00 1.15 H new ATOM 0 HD21 LEU A 60 0.216 -7.276 4.158 1.00 0.90 H new ATOM 0 HD22 LEU A 60 -0.375 -8.814 4.832 1.00 0.90 H new ATOM 0 HD23 LEU A 60 -1.015 -8.217 3.282 1.00 0.90 H new ATOM 909 N TYR A 61 -5.318 -7.276 2.596 1.00 0.44 N ATOM 910 CA TYR A 61 -5.545 -6.766 1.216 1.00 0.45 C ATOM 911 C TYR A 61 -7.048 -6.358 0.980 1.00 0.47 C ATOM 912 O TYR A 61 -7.489 -6.268 -0.169 1.00 0.52 O ATOM 913 CB TYR A 61 -5.146 -7.846 0.181 1.00 0.44 C ATOM 914 CG TYR A 61 -3.636 -8.069 -0.108 1.00 0.46 C ATOM 915 CD1 TYR A 61 -2.608 -7.594 0.726 1.00 0.70 C ATOM 916 CD2 TYR A 61 -3.244 -8.791 -1.241 1.00 0.76 C ATOM 917 CE1 TYR A 61 -1.273 -7.828 0.428 1.00 0.72 C ATOM 918 CE2 TYR A 61 -1.910 -9.025 -1.530 1.00 0.92 C ATOM 919 CZ TYR A 61 -0.935 -8.541 -0.695 1.00 0.72 C ATOM 920 OH TYR A 61 0.391 -8.773 -0.984 1.00 0.88 O ATOM 0 H TYR A 61 -5.921 -8.063 2.835 1.00 0.44 H new ATOM 0 HA TYR A 61 -4.926 -5.877 1.092 1.00 0.45 H new ATOM 0 HB2 TYR A 61 -5.564 -8.796 0.514 1.00 0.44 H new ATOM 0 HB3 TYR A 61 -5.632 -7.597 -0.763 1.00 0.44 H new ATOM 0 HD1 TYR A 61 -2.862 -7.037 1.615 1.00 0.70 H new ATOM 0 HD2 TYR A 61 -4.002 -9.176 -1.907 1.00 0.76 H new ATOM 0 HE1 TYR A 61 -0.500 -7.449 1.080 1.00 0.72 H new ATOM 0 HE2 TYR A 61 -1.638 -9.587 -2.411 1.00 0.92 H new ATOM 0 HH TYR A 61 0.459 -9.293 -1.812 1.00 0.88 H new ATOM 930 N GLN A 62 -7.820 -6.096 2.078 1.00 0.50 N ATOM 931 CA GLN A 62 -9.302 -5.775 1.972 1.00 0.57 C ATOM 932 C GLN A 62 -9.889 -4.805 3.036 1.00 0.70 C ATOM 933 O GLN A 62 -10.882 -4.134 2.749 1.00 1.33 O ATOM 934 CB GLN A 62 -10.134 -7.089 2.045 1.00 0.57 C ATOM 935 CG GLN A 62 -11.606 -7.024 1.540 1.00 0.75 C ATOM 936 CD GLN A 62 -12.642 -7.154 2.650 1.00 0.77 C ATOM 937 OE1 GLN A 62 -13.159 -6.155 3.149 1.00 1.26 O ATOM 938 NE2 GLN A 62 -12.936 -8.383 3.057 1.00 1.02 N ATOM 0 H GLN A 62 -7.462 -6.097 3.033 1.00 0.50 H new ATOM 0 HA GLN A 62 -9.377 -5.259 1.015 1.00 0.57 H new ATOM 0 HB2 GLN A 62 -9.612 -7.853 1.469 1.00 0.57 H new ATOM 0 HB3 GLN A 62 -10.146 -7.425 3.082 1.00 0.57 H new ATOM 0 HG2 GLN A 62 -11.761 -6.079 1.020 1.00 0.75 H new ATOM 0 HG3 GLN A 62 -11.766 -7.819 0.811 1.00 0.75 H new ATOM 0 HE21 GLN A 62 -12.486 -9.187 2.618 1.00 1.02 H new ATOM 0 HE22 GLN A 62 -13.612 -8.524 3.808 1.00 1.02 H new ATOM 947 N THR A 63 -9.314 -4.747 4.251 1.00 0.58 N ATOM 948 CA THR A 63 -9.844 -3.865 5.388 1.00 0.62 C ATOM 949 C THR A 63 -9.569 -2.319 5.192 1.00 0.76 C ATOM 950 O THR A 63 -8.464 -1.931 4.818 1.00 1.28 O ATOM 951 CB THR A 63 -9.326 -4.341 6.809 1.00 0.59 C ATOM 952 OG1 THR A 63 -7.892 -4.429 6.851 1.00 0.63 O ATOM 953 CG2 THR A 63 -9.925 -5.696 7.235 1.00 0.60 C ATOM 0 H THR A 63 -8.485 -5.285 4.502 1.00 0.58 H new ATOM 0 HA THR A 63 -10.926 -3.995 5.349 1.00 0.62 H new ATOM 0 HB THR A 63 -9.662 -3.579 7.512 1.00 0.59 H new ATOM 0 HG1 THR A 63 -7.601 -5.251 6.403 1.00 0.63 H new ATOM 0 HG21 THR A 63 -9.536 -5.974 8.215 1.00 0.60 H new ATOM 0 HG22 THR A 63 -11.011 -5.614 7.285 1.00 0.60 H new ATOM 0 HG23 THR A 63 -9.652 -6.460 6.507 1.00 0.60 H new ATOM 961 N GLU A 64 -10.587 -1.458 5.500 1.00 0.57 N ATOM 962 CA GLU A 64 -10.500 0.029 5.273 1.00 0.60 C ATOM 963 C GLU A 64 -10.468 0.936 6.537 1.00 0.64 C ATOM 964 O GLU A 64 -11.186 0.714 7.513 1.00 0.69 O ATOM 965 CB GLU A 64 -11.718 0.501 4.430 1.00 0.67 C ATOM 966 CG GLU A 64 -13.099 0.178 5.046 1.00 0.84 C ATOM 967 CD GLU A 64 -14.224 0.991 4.427 1.00 1.07 C ATOM 968 OE1 GLU A 64 -14.109 2.234 4.390 1.00 1.50 O ATOM 969 OE2 GLU A 64 -15.213 0.384 3.966 1.00 1.53 O ATOM 0 H GLU A 64 -11.473 -1.761 5.904 1.00 0.57 H new ATOM 0 HA GLU A 64 -9.536 0.147 4.779 1.00 0.60 H new ATOM 0 HB2 GLU A 64 -11.645 1.579 4.284 1.00 0.67 H new ATOM 0 HB3 GLU A 64 -11.659 0.041 3.444 1.00 0.67 H new ATOM 0 HG2 GLU A 64 -13.310 -0.884 4.917 1.00 0.84 H new ATOM 0 HG3 GLU A 64 -13.067 0.368 6.119 1.00 0.84 H new ATOM 1050 N ASP A 69 -9.436 14.399 5.261 1.00 0.76 N ATOM 1051 CA ASP A 69 -8.633 15.194 4.283 1.00 0.75 C ATOM 1052 C ASP A 69 -7.311 14.502 3.853 1.00 0.69 C ATOM 1053 O ASP A 69 -7.194 13.281 3.923 1.00 1.33 O ATOM 1054 CB ASP A 69 -8.350 16.585 4.892 1.00 1.17 C ATOM 1055 CG ASP A 69 -9.138 17.703 4.220 1.00 1.63 C ATOM 1056 OD1 ASP A 69 -10.311 17.913 4.596 1.00 2.06 O ATOM 1057 OD2 ASP A 69 -8.580 18.366 3.320 1.00 2.15 O ATOM 0 HA ASP A 69 -9.221 15.285 3.370 1.00 0.75 H new ATOM 0 HB2 ASP A 69 -8.592 16.566 5.955 1.00 1.17 H new ATOM 0 HB3 ASP A 69 -7.285 16.800 4.812 1.00 1.17 H new ATOM 1062 N SER A 70 -6.333 15.309 3.312 1.00 0.72 N ATOM 1063 CA SER A 70 -4.966 14.839 2.879 1.00 0.57 C ATOM 1064 C SER A 70 -4.163 14.227 4.051 1.00 0.53 C ATOM 1065 O SER A 70 -3.733 14.933 4.972 1.00 0.57 O ATOM 1066 CB SER A 70 -4.187 16.019 2.274 1.00 0.70 C ATOM 1067 OG SER A 70 -3.305 15.596 1.244 1.00 0.77 O ATOM 0 H SER A 70 -6.473 16.308 3.164 1.00 0.72 H new ATOM 0 HA SER A 70 -5.103 14.056 2.133 1.00 0.57 H new ATOM 0 HB2 SER A 70 -4.889 16.751 1.874 1.00 0.70 H new ATOM 0 HB3 SER A 70 -3.618 16.519 3.058 1.00 0.70 H new ATOM 0 HG SER A 70 -3.499 14.664 1.010 1.00 0.77 H new ATOM 1073 N PHE A 71 -3.983 12.904 3.981 1.00 0.49 N ATOM 1074 CA PHE A 71 -3.324 12.161 5.060 1.00 0.47 C ATOM 1075 C PHE A 71 -2.331 11.103 4.542 1.00 0.33 C ATOM 1076 O PHE A 71 -2.443 10.602 3.407 1.00 0.39 O ATOM 1077 CB PHE A 71 -4.392 11.530 6.027 1.00 0.66 C ATOM 1078 CG PHE A 71 -5.647 10.907 5.376 1.00 0.54 C ATOM 1079 CD1 PHE A 71 -5.548 10.071 4.252 1.00 0.73 C ATOM 1080 CD2 PHE A 71 -6.920 11.159 5.881 1.00 0.75 C ATOM 1081 CE1 PHE A 71 -6.686 9.517 3.671 1.00 0.78 C ATOM 1082 CE2 PHE A 71 -8.050 10.602 5.293 1.00 0.81 C ATOM 1083 CZ PHE A 71 -7.920 9.763 4.197 1.00 0.67 C ATOM 0 H PHE A 71 -4.282 12.329 3.194 1.00 0.49 H new ATOM 0 HA PHE A 71 -2.727 12.878 5.624 1.00 0.47 H new ATOM 0 HB2 PHE A 71 -3.899 10.759 6.619 1.00 0.66 H new ATOM 0 HB3 PHE A 71 -4.719 12.304 6.721 1.00 0.66 H new ATOM 0 HD1 PHE A 71 -4.577 9.855 3.833 1.00 0.73 H new ATOM 0 HD2 PHE A 71 -7.031 11.798 6.744 1.00 0.75 H new ATOM 0 HE1 PHE A 71 -6.591 8.888 2.798 1.00 0.78 H new ATOM 0 HE2 PHE A 71 -9.030 10.823 5.690 1.00 0.81 H new ATOM 0 HZ PHE A 71 -8.795 9.305 3.760 1.00 0.67 H new ATOM 1093 N GLY A 72 -1.342 10.791 5.388 1.00 0.31 N ATOM 1094 CA GLY A 72 -0.335 9.803 5.034 1.00 0.41 C ATOM 1095 C GLY A 72 0.566 9.356 6.182 1.00 0.33 C ATOM 1096 O GLY A 72 0.381 9.744 7.344 1.00 0.47 O ATOM 0 H GLY A 72 -1.224 11.207 6.312 1.00 0.31 H new ATOM 0 HA2 GLY A 72 -0.837 8.926 4.624 1.00 0.41 H new ATOM 0 HA3 GLY A 72 0.290 10.212 4.240 1.00 0.41 H new ATOM 1100 N TYR A 73 1.562 8.533 5.830 1.00 0.28 N ATOM 1101 CA TYR A 73 2.500 7.961 6.817 1.00 0.24 C ATOM 1102 C TYR A 73 3.959 8.472 6.699 1.00 0.21 C ATOM 1103 O TYR A 73 4.352 9.138 5.723 1.00 0.27 O ATOM 1104 CB TYR A 73 2.552 6.421 6.723 1.00 0.36 C ATOM 1105 CG TYR A 73 1.282 5.709 6.230 1.00 0.33 C ATOM 1106 CD1 TYR A 73 0.946 5.729 4.882 1.00 0.47 C ATOM 1107 CD2 TYR A 73 0.447 4.992 7.095 1.00 0.48 C ATOM 1108 CE1 TYR A 73 -0.168 5.078 4.409 1.00 0.63 C ATOM 1109 CE2 TYR A 73 -0.674 4.330 6.615 1.00 0.62 C ATOM 1110 CZ TYR A 73 -0.971 4.380 5.273 1.00 0.68 C ATOM 1111 OH TYR A 73 -2.076 3.728 4.787 1.00 0.89 O ATOM 0 H TYR A 73 1.743 8.245 4.868 1.00 0.28 H new ATOM 0 HA TYR A 73 2.097 8.294 7.773 1.00 0.24 H new ATOM 0 HB2 TYR A 73 3.372 6.150 6.058 1.00 0.36 H new ATOM 0 HB3 TYR A 73 2.799 6.029 7.710 1.00 0.36 H new ATOM 0 HD1 TYR A 73 1.575 6.269 4.190 1.00 0.47 H new ATOM 0 HD2 TYR A 73 0.678 4.954 8.149 1.00 0.48 H new ATOM 0 HE1 TYR A 73 -0.411 5.116 3.357 1.00 0.63 H new ATOM 0 HE2 TYR A 73 -1.310 3.778 7.292 1.00 0.62 H new ATOM 0 HH TYR A 73 -1.964 3.566 3.827 1.00 0.89 H new ATOM 1121 N ASP A 74 4.756 8.074 7.718 1.00 0.17 N ATOM 1122 CA ASP A 74 6.183 8.435 7.851 1.00 0.16 C ATOM 1123 C ASP A 74 7.084 7.178 7.998 1.00 0.15 C ATOM 1124 O ASP A 74 6.828 6.311 8.844 1.00 0.24 O ATOM 1125 CB ASP A 74 6.376 9.334 9.093 1.00 0.21 C ATOM 1126 CG ASP A 74 6.180 10.824 8.821 1.00 0.26 C ATOM 1127 OD1 ASP A 74 5.233 11.174 8.086 1.00 0.51 O ATOM 1128 OD2 ASP A 74 6.969 11.633 9.353 1.00 0.40 O ATOM 0 H ASP A 74 4.419 7.485 8.480 1.00 0.17 H new ATOM 0 HA ASP A 74 6.475 8.964 6.944 1.00 0.16 H new ATOM 0 HB2 ASP A 74 5.675 9.022 9.867 1.00 0.21 H new ATOM 0 HB3 ASP A 74 7.379 9.177 9.490 1.00 0.21 H new ATOM 1133 N ILE A 75 8.148 7.103 7.170 1.00 0.10 N ATOM 1134 CA ILE A 75 9.116 5.978 7.197 1.00 0.09 C ATOM 1135 C ILE A 75 10.562 6.534 7.441 1.00 0.08 C ATOM 1136 O ILE A 75 11.183 7.029 6.502 1.00 0.12 O ATOM 1137 CB ILE A 75 9.102 5.112 5.851 1.00 0.11 C ATOM 1138 CG1 ILE A 75 7.685 4.717 5.406 1.00 0.13 C ATOM 1139 CG2 ILE A 75 9.890 3.781 5.962 1.00 0.14 C ATOM 1140 CD1 ILE A 75 7.104 5.548 4.292 1.00 0.15 C ATOM 0 H ILE A 75 8.362 7.812 6.469 1.00 0.10 H new ATOM 0 HA ILE A 75 8.814 5.318 8.010 1.00 0.09 H new ATOM 0 HB ILE A 75 9.572 5.779 5.128 1.00 0.11 H new ATOM 0 HG12 ILE A 75 7.699 3.674 5.089 1.00 0.13 H new ATOM 0 HG13 ILE A 75 7.021 4.780 6.268 1.00 0.13 H new ATOM 0 HG21 ILE A 75 9.837 3.247 5.013 1.00 0.14 H new ATOM 0 HG22 ILE A 75 10.932 3.994 6.201 1.00 0.14 H new ATOM 0 HG23 ILE A 75 9.455 3.165 6.750 1.00 0.14 H new ATOM 0 HD11 ILE A 75 6.103 5.188 4.054 1.00 0.15 H new ATOM 0 HD12 ILE A 75 7.050 6.590 4.606 1.00 0.15 H new ATOM 0 HD13 ILE A 75 7.738 5.468 3.409 1.00 0.15 H new ATOM 1152 N PRO A 76 11.122 6.463 8.689 1.00 0.09 N ATOM 1153 CA PRO A 76 12.501 6.935 8.966 1.00 0.10 C ATOM 1154 C PRO A 76 13.627 5.898 8.636 1.00 0.09 C ATOM 1155 O PRO A 76 13.682 4.819 9.232 1.00 0.11 O ATOM 1156 CB PRO A 76 12.441 7.254 10.462 1.00 0.14 C ATOM 1157 CG PRO A 76 11.487 6.229 11.026 1.00 0.15 C ATOM 1158 CD PRO A 76 10.463 5.968 9.927 1.00 0.12 C ATOM 0 HA PRO A 76 12.774 7.779 8.332 1.00 0.10 H new ATOM 0 HB2 PRO A 76 13.425 7.178 10.924 1.00 0.14 H new ATOM 0 HB3 PRO A 76 12.084 8.269 10.638 1.00 0.14 H new ATOM 0 HG2 PRO A 76 12.012 5.313 11.297 1.00 0.15 H new ATOM 0 HG3 PRO A 76 11.005 6.599 11.930 1.00 0.15 H new ATOM 0 HD2 PRO A 76 10.220 4.908 9.852 1.00 0.12 H new ATOM 0 HD3 PRO A 76 9.529 6.496 10.119 1.00 0.12 H new ATOM 1166 N ILE A 77 14.503 6.255 7.670 1.00 0.09 N ATOM 1167 CA ILE A 77 15.634 5.383 7.236 1.00 0.10 C ATOM 1168 C ILE A 77 16.996 6.149 7.330 1.00 0.13 C ATOM 1169 O ILE A 77 17.055 7.386 7.318 1.00 0.19 O ATOM 1170 CB ILE A 77 15.430 4.801 5.762 1.00 0.12 C ATOM 1171 CG1 ILE A 77 13.930 4.630 5.413 1.00 0.11 C ATOM 1172 CG2 ILE A 77 16.131 3.412 5.548 1.00 0.18 C ATOM 1173 CD1 ILE A 77 13.394 5.547 4.326 1.00 0.19 C ATOM 0 H ILE A 77 14.453 7.143 7.171 1.00 0.09 H new ATOM 0 HA ILE A 77 15.652 4.534 7.920 1.00 0.10 H new ATOM 0 HB ILE A 77 15.891 5.539 5.105 1.00 0.12 H new ATOM 0 HG12 ILE A 77 13.764 3.598 5.106 1.00 0.11 H new ATOM 0 HG13 ILE A 77 13.345 4.791 6.319 1.00 0.11 H new ATOM 0 HG21 ILE A 77 15.956 3.069 4.528 1.00 0.18 H new ATOM 0 HG22 ILE A 77 17.203 3.515 5.717 1.00 0.18 H new ATOM 0 HG23 ILE A 77 15.721 2.686 6.250 1.00 0.18 H new ATOM 0 HD11 ILE A 77 12.336 5.340 4.165 1.00 0.19 H new ATOM 0 HD12 ILE A 77 13.518 6.586 4.632 1.00 0.19 H new ATOM 0 HD13 ILE A 77 13.943 5.374 3.400 1.00 0.19 H new ATOM 1185 N LYS A 78 18.082 5.362 7.408 1.00 0.15 N ATOM 1186 CA LYS A 78 19.465 5.877 7.501 1.00 0.20 C ATOM 1187 C LYS A 78 20.475 4.996 6.703 1.00 0.21 C ATOM 1188 O LYS A 78 21.683 5.066 6.954 1.00 0.25 O ATOM 1189 CB LYS A 78 19.920 5.944 8.983 1.00 0.27 C ATOM 1190 CG LYS A 78 19.144 6.940 9.887 1.00 0.87 C ATOM 1191 CD LYS A 78 19.527 8.421 9.643 1.00 1.32 C ATOM 1192 CE LYS A 78 18.827 9.370 10.631 1.00 1.91 C ATOM 1193 NZ LYS A 78 19.239 9.106 12.038 1.00 2.53 N ATOM 0 H LYS A 78 18.028 4.343 7.409 1.00 0.15 H new ATOM 0 HA LYS A 78 19.459 6.876 7.064 1.00 0.20 H new ATOM 0 HB2 LYS A 78 19.832 4.947 9.415 1.00 0.27 H new ATOM 0 HB3 LYS A 78 20.977 6.210 9.007 1.00 0.27 H new ATOM 0 HG2 LYS A 78 18.075 6.816 9.716 1.00 0.87 H new ATOM 0 HG3 LYS A 78 19.331 6.692 10.932 1.00 0.87 H new ATOM 0 HD2 LYS A 78 20.607 8.535 9.734 1.00 1.32 H new ATOM 0 HD3 LYS A 78 19.262 8.700 8.623 1.00 1.32 H new ATOM 0 HE2 LYS A 78 19.061 10.402 10.371 1.00 1.91 H new ATOM 0 HE3 LYS A 78 17.747 9.256 10.541 1.00 1.91 H new ATOM 0 HZ1 LYS A 78 18.927 9.891 12.644 1.00 2.53 H new ATOM 0 HZ2 LYS A 78 18.804 8.220 12.367 1.00 2.53 H new ATOM 0 HZ3 LYS A 78 20.274 9.022 12.087 1.00 2.53 H new ATOM 1207 N GLU A 79 19.985 4.178 5.731 1.00 0.19 N ATOM 1208 CA GLU A 79 20.851 3.303 4.924 1.00 0.22 C ATOM 1209 C GLU A 79 20.647 3.532 3.413 1.00 0.20 C ATOM 1210 O GLU A 79 19.625 4.084 2.977 1.00 0.18 O ATOM 1211 CB GLU A 79 20.573 1.829 5.275 1.00 0.24 C ATOM 1212 CG GLU A 79 21.109 1.377 6.641 1.00 0.55 C ATOM 1213 CD GLU A 79 20.732 -0.056 6.965 1.00 1.17 C ATOM 1214 OE1 GLU A 79 19.657 -0.265 7.569 1.00 2.12 O ATOM 1215 OE2 GLU A 79 21.510 -0.969 6.619 1.00 1.03 O ATOM 0 H GLU A 79 18.995 4.114 5.495 1.00 0.19 H new ATOM 0 HA GLU A 79 21.887 3.549 5.158 1.00 0.22 H new ATOM 0 HB2 GLU A 79 19.496 1.662 5.250 1.00 0.24 H new ATOM 0 HB3 GLU A 79 21.011 1.198 4.502 1.00 0.24 H new ATOM 0 HG2 GLU A 79 22.194 1.476 6.653 1.00 0.55 H new ATOM 0 HG3 GLU A 79 20.720 2.036 7.417 1.00 0.55 H new ATOM 1222 N GLU A 80 21.626 3.083 2.612 1.00 0.26 N ATOM 1223 CA GLU A 80 21.575 3.251 1.154 1.00 0.25 C ATOM 1224 C GLU A 80 21.606 1.920 0.383 1.00 0.27 C ATOM 1225 O GLU A 80 22.340 0.983 0.725 1.00 0.32 O ATOM 1226 CB GLU A 80 22.739 4.138 0.685 1.00 0.27 C ATOM 1227 CG GLU A 80 22.676 5.612 1.139 1.00 0.28 C ATOM 1228 CD GLU A 80 23.825 5.976 2.061 1.00 0.36 C ATOM 1229 OE1 GLU A 80 24.947 6.194 1.555 1.00 0.40 O ATOM 1230 OE2 GLU A 80 23.605 6.044 3.288 1.00 0.42 O ATOM 0 H GLU A 80 22.460 2.602 2.950 1.00 0.26 H new ATOM 0 HA GLU A 80 20.618 3.725 0.934 1.00 0.25 H new ATOM 0 HB2 GLU A 80 23.672 3.704 1.046 1.00 0.27 H new ATOM 0 HB3 GLU A 80 22.776 4.113 -0.404 1.00 0.27 H new ATOM 0 HG2 GLU A 80 22.695 6.261 0.264 1.00 0.28 H new ATOM 0 HG3 GLU A 80 21.730 5.793 1.650 1.00 0.28 H new ATOM 1237 N GLY A 81 20.800 1.887 -0.682 1.00 0.22 N ATOM 1238 CA GLY A 81 20.696 0.713 -1.553 1.00 0.23 C ATOM 1239 C GLY A 81 19.459 0.762 -2.448 1.00 0.19 C ATOM 1240 O GLY A 81 19.156 1.821 -3.015 1.00 0.18 O ATOM 0 H GLY A 81 20.206 2.667 -0.963 1.00 0.22 H new ATOM 0 HA2 GLY A 81 21.589 0.644 -2.175 1.00 0.23 H new ATOM 0 HA3 GLY A 81 20.663 -0.189 -0.941 1.00 0.23 H new ATOM 1244 N GLU A 82 18.739 -0.378 -2.616 1.00 0.20 N ATOM 1245 CA GLU A 82 17.519 -0.358 -3.438 1.00 0.17 C ATOM 1246 C GLU A 82 16.281 -0.716 -2.600 1.00 0.18 C ATOM 1247 O GLU A 82 16.054 -1.870 -2.257 1.00 0.30 O ATOM 1248 CB GLU A 82 17.652 -1.302 -4.647 1.00 0.19 C ATOM 1249 CG GLU A 82 18.660 -0.865 -5.725 1.00 0.26 C ATOM 1250 CD GLU A 82 18.412 -1.540 -7.060 1.00 0.86 C ATOM 1251 OE1 GLU A 82 17.391 -1.223 -7.706 1.00 0.78 O ATOM 1252 OE2 GLU A 82 19.238 -2.387 -7.461 1.00 1.75 O ATOM 0 H GLU A 82 18.975 -1.283 -2.209 1.00 0.20 H new ATOM 0 HA GLU A 82 17.389 0.657 -3.814 1.00 0.17 H new ATOM 0 HB2 GLU A 82 17.940 -2.289 -4.285 1.00 0.19 H new ATOM 0 HB3 GLU A 82 16.672 -1.407 -5.113 1.00 0.19 H new ATOM 0 HG2 GLU A 82 18.605 0.216 -5.852 1.00 0.26 H new ATOM 0 HG3 GLU A 82 19.671 -1.095 -5.387 1.00 0.26 H new ATOM 1259 N TYR A 83 15.455 0.301 -2.299 1.00 0.08 N ATOM 1260 CA TYR A 83 14.238 0.115 -1.484 1.00 0.08 C ATOM 1261 C TYR A 83 12.993 0.014 -2.363 1.00 0.08 C ATOM 1262 O TYR A 83 12.762 0.844 -3.232 1.00 0.12 O ATOM 1263 CB TYR A 83 14.081 1.248 -0.459 1.00 0.10 C ATOM 1264 CG TYR A 83 15.157 1.240 0.635 1.00 0.11 C ATOM 1265 CD1 TYR A 83 16.445 1.708 0.373 1.00 0.16 C ATOM 1266 CD2 TYR A 83 14.897 0.749 1.915 1.00 0.17 C ATOM 1267 CE1 TYR A 83 17.425 1.695 1.340 1.00 0.18 C ATOM 1268 CE2 TYR A 83 15.880 0.732 2.884 1.00 0.19 C ATOM 1269 CZ TYR A 83 17.136 1.206 2.592 1.00 0.16 C ATOM 1270 OH TYR A 83 18.110 1.181 3.556 1.00 0.21 O ATOM 0 H TYR A 83 15.607 1.261 -2.607 1.00 0.08 H new ATOM 0 HA TYR A 83 14.348 -0.824 -0.942 1.00 0.08 H new ATOM 0 HB2 TYR A 83 14.112 2.205 -0.980 1.00 0.10 H new ATOM 0 HB3 TYR A 83 13.099 1.171 0.008 1.00 0.10 H new ATOM 0 HD1 TYR A 83 16.678 2.089 -0.610 1.00 0.16 H new ATOM 0 HD2 TYR A 83 13.911 0.376 2.151 1.00 0.17 H new ATOM 0 HE1 TYR A 83 18.414 2.066 1.116 1.00 0.18 H new ATOM 0 HE2 TYR A 83 15.662 0.347 3.869 1.00 0.19 H new ATOM 0 HH TYR A 83 18.987 1.311 3.138 1.00 0.21 H new ATOM 1280 N VAL A 84 12.191 -1.022 -2.116 1.00 0.08 N ATOM 1281 CA VAL A 84 10.983 -1.285 -2.937 1.00 0.10 C ATOM 1282 C VAL A 84 9.695 -1.055 -2.107 1.00 0.10 C ATOM 1283 O VAL A 84 9.441 -1.725 -1.099 1.00 0.10 O ATOM 1284 CB VAL A 84 10.955 -2.743 -3.637 1.00 0.11 C ATOM 1285 CG1 VAL A 84 10.144 -2.748 -4.959 1.00 0.13 C ATOM 1286 CG2 VAL A 84 12.350 -3.318 -3.969 1.00 0.20 C ATOM 0 H VAL A 84 12.344 -1.694 -1.364 1.00 0.08 H new ATOM 0 HA VAL A 84 11.026 -0.567 -3.756 1.00 0.10 H new ATOM 0 HB VAL A 84 10.482 -3.370 -2.881 1.00 0.11 H new ATOM 0 HG11 VAL A 84 10.156 -3.749 -5.389 1.00 0.13 H new ATOM 0 HG12 VAL A 84 9.115 -2.453 -4.756 1.00 0.13 H new ATOM 0 HG13 VAL A 84 10.591 -2.046 -5.663 1.00 0.13 H new ATOM 0 HG21 VAL A 84 12.238 -4.297 -4.435 1.00 0.20 H new ATOM 0 HG22 VAL A 84 12.867 -2.646 -4.655 1.00 0.20 H new ATOM 0 HG23 VAL A 84 12.930 -3.417 -3.052 1.00 0.20 H new ATOM 1296 N LEU A 85 8.894 -0.091 -2.592 1.00 0.12 N ATOM 1297 CA LEU A 85 7.615 0.276 -1.977 1.00 0.15 C ATOM 1298 C LEU A 85 6.448 -0.235 -2.845 1.00 0.16 C ATOM 1299 O LEU A 85 6.156 0.300 -3.922 1.00 0.21 O ATOM 1300 CB LEU A 85 7.572 1.813 -1.789 1.00 0.25 C ATOM 1301 CG LEU A 85 6.580 2.404 -0.731 1.00 0.43 C ATOM 1302 CD1 LEU A 85 7.237 3.499 0.103 1.00 0.78 C ATOM 1303 CD2 LEU A 85 5.332 2.989 -1.382 1.00 0.61 C ATOM 0 H LEU A 85 9.119 0.455 -3.424 1.00 0.12 H new ATOM 0 HA LEU A 85 7.515 -0.191 -0.997 1.00 0.15 H new ATOM 0 HB2 LEU A 85 8.576 2.144 -1.524 1.00 0.25 H new ATOM 0 HB3 LEU A 85 7.333 2.259 -2.754 1.00 0.25 H new ATOM 0 HG LEU A 85 6.297 1.569 -0.090 1.00 0.43 H new ATOM 0 HD11 LEU A 85 6.519 3.886 0.826 1.00 0.78 H new ATOM 0 HD12 LEU A 85 8.098 3.088 0.630 1.00 0.78 H new ATOM 0 HD13 LEU A 85 7.564 4.307 -0.551 1.00 0.78 H new ATOM 0 HD21 LEU A 85 4.672 3.387 -0.611 1.00 0.61 H new ATOM 0 HD22 LEU A 85 5.619 3.790 -2.064 1.00 0.61 H new ATOM 0 HD23 LEU A 85 4.811 2.209 -1.937 1.00 0.61 H new ATOM 1315 N VAL A 86 5.814 -1.309 -2.348 1.00 0.17 N ATOM 1316 CA VAL A 86 4.668 -1.977 -3.023 1.00 0.21 C ATOM 1317 C VAL A 86 3.394 -1.770 -2.162 1.00 0.21 C ATOM 1318 O VAL A 86 3.383 -2.065 -0.959 1.00 0.27 O ATOM 1319 CB VAL A 86 4.856 -3.558 -3.307 1.00 0.25 C ATOM 1320 CG1 VAL A 86 4.209 -3.983 -4.647 1.00 0.44 C ATOM 1321 CG2 VAL A 86 6.323 -4.071 -3.321 1.00 0.32 C ATOM 0 H VAL A 86 6.076 -1.747 -1.465 1.00 0.17 H new ATOM 0 HA VAL A 86 4.591 -1.511 -4.005 1.00 0.21 H new ATOM 0 HB VAL A 86 4.356 -4.014 -2.453 1.00 0.25 H new ATOM 0 HG11 VAL A 86 4.358 -5.052 -4.800 1.00 0.44 H new ATOM 0 HG12 VAL A 86 3.141 -3.765 -4.621 1.00 0.44 H new ATOM 0 HG13 VAL A 86 4.672 -3.432 -5.465 1.00 0.44 H new ATOM 0 HG21 VAL A 86 6.332 -5.143 -3.520 1.00 0.32 H new ATOM 0 HG22 VAL A 86 6.882 -3.553 -4.100 1.00 0.32 H new ATOM 0 HG23 VAL A 86 6.785 -3.878 -2.353 1.00 0.32 H new ATOM 1331 N LEU A 87 2.329 -1.267 -2.800 1.00 0.20 N ATOM 1332 CA LEU A 87 1.057 -1.018 -2.091 1.00 0.22 C ATOM 1333 C LEU A 87 -0.152 -1.655 -2.786 1.00 0.22 C ATOM 1334 O LEU A 87 -0.295 -1.592 -4.020 1.00 0.26 O ATOM 1335 CB LEU A 87 0.771 0.508 -1.887 1.00 0.31 C ATOM 1336 CG LEU A 87 1.509 1.537 -2.806 1.00 0.50 C ATOM 1337 CD1 LEU A 87 0.916 1.614 -4.213 1.00 1.25 C ATOM 1338 CD2 LEU A 87 1.493 2.931 -2.180 1.00 0.88 C ATOM 0 H LEU A 87 2.317 -1.026 -3.791 1.00 0.20 H new ATOM 0 HA LEU A 87 1.191 -1.491 -1.118 1.00 0.22 H new ATOM 0 HB2 LEU A 87 -0.301 0.663 -2.010 1.00 0.31 H new ATOM 0 HB3 LEU A 87 1.012 0.755 -0.853 1.00 0.31 H new ATOM 0 HG LEU A 87 2.534 1.178 -2.896 1.00 0.50 H new ATOM 0 HD11 LEU A 87 1.471 2.344 -4.802 1.00 1.25 H new ATOM 0 HD12 LEU A 87 0.983 0.636 -4.690 1.00 1.25 H new ATOM 0 HD13 LEU A 87 -0.129 1.916 -4.151 1.00 1.25 H new ATOM 0 HD21 LEU A 87 2.012 3.630 -2.836 1.00 0.88 H new ATOM 0 HD22 LEU A 87 0.462 3.257 -2.044 1.00 0.88 H new ATOM 0 HD23 LEU A 87 1.994 2.901 -1.213 1.00 0.88 H new ATOM 1350 N LYS A 88 -1.040 -2.262 -1.964 1.00 0.23 N ATOM 1351 CA LYS A 88 -2.287 -2.875 -2.478 1.00 0.26 C ATOM 1352 C LYS A 88 -3.493 -1.972 -2.193 1.00 0.27 C ATOM 1353 O LYS A 88 -3.853 -1.735 -1.036 1.00 0.29 O ATOM 1354 CB LYS A 88 -2.555 -4.257 -1.843 1.00 0.31 C ATOM 1355 CG LYS A 88 -3.100 -5.358 -2.785 1.00 0.46 C ATOM 1356 CD LYS A 88 -1.952 -6.051 -3.569 1.00 1.53 C ATOM 1357 CE LYS A 88 -2.442 -7.094 -4.578 1.00 2.13 C ATOM 1358 NZ LYS A 88 -1.309 -7.774 -5.265 1.00 2.52 N ATOM 0 H LYS A 88 -0.919 -2.340 -0.954 1.00 0.23 H new ATOM 0 HA LYS A 88 -2.152 -2.998 -3.553 1.00 0.26 H new ATOM 0 HB2 LYS A 88 -1.625 -4.616 -1.402 1.00 0.31 H new ATOM 0 HB3 LYS A 88 -3.265 -4.125 -1.026 1.00 0.31 H new ATOM 0 HG2 LYS A 88 -3.645 -6.101 -2.202 1.00 0.46 H new ATOM 0 HG3 LYS A 88 -3.810 -4.920 -3.487 1.00 0.46 H new ATOM 0 HD2 LYS A 88 -1.373 -5.292 -4.095 1.00 1.53 H new ATOM 0 HD3 LYS A 88 -1.278 -6.532 -2.860 1.00 1.53 H new ATOM 0 HE2 LYS A 88 -3.054 -7.836 -4.065 1.00 2.13 H new ATOM 0 HE3 LYS A 88 -3.079 -6.612 -5.319 1.00 2.13 H new ATOM 0 HZ1 LYS A 88 -1.541 -7.906 -6.270 1.00 2.52 H new ATOM 0 HZ2 LYS A 88 -0.452 -7.191 -5.181 1.00 2.52 H new ATOM 0 HZ3 LYS A 88 -1.142 -8.701 -4.824 1.00 2.52 H new ATOM 1372 N PHE A 89 -4.123 -1.482 -3.265 1.00 0.27 N ATOM 1373 CA PHE A 89 -5.308 -0.618 -3.136 1.00 0.29 C ATOM 1374 C PHE A 89 -6.586 -1.399 -3.510 1.00 0.31 C ATOM 1375 O PHE A 89 -6.625 -2.125 -4.512 1.00 0.32 O ATOM 1376 CB PHE A 89 -5.182 0.626 -4.047 1.00 0.30 C ATOM 1377 CG PHE A 89 -4.371 1.801 -3.481 1.00 0.28 C ATOM 1378 CD1 PHE A 89 -4.687 2.396 -2.248 1.00 0.36 C ATOM 1379 CD2 PHE A 89 -3.264 2.297 -4.174 1.00 0.25 C ATOM 1380 CE1 PHE A 89 -3.919 3.433 -1.746 1.00 0.40 C ATOM 1381 CE2 PHE A 89 -2.510 3.338 -3.668 1.00 0.26 C ATOM 1382 CZ PHE A 89 -2.953 3.979 -2.446 1.00 0.31 C ATOM 0 H PHE A 89 -3.837 -1.665 -4.227 1.00 0.27 H new ATOM 0 HA PHE A 89 -5.374 -0.292 -2.098 1.00 0.29 H new ATOM 0 HB2 PHE A 89 -4.727 0.317 -4.988 1.00 0.30 H new ATOM 0 HB3 PHE A 89 -6.185 0.983 -4.280 1.00 0.30 H new ATOM 0 HD1 PHE A 89 -5.538 2.041 -1.686 1.00 0.36 H new ATOM 0 HD2 PHE A 89 -2.993 1.858 -5.123 1.00 0.25 H new ATOM 0 HE1 PHE A 89 -4.121 3.802 -0.751 1.00 0.40 H new ATOM 0 HE2 PHE A 89 -1.612 3.666 -4.171 1.00 0.26 H new ATOM 0 HZ PHE A 89 -2.492 4.898 -2.115 1.00 0.31 H new ATOM 1392 N ALA A 90 -7.639 -1.247 -2.676 1.00 0.33 N ATOM 1393 CA ALA A 90 -8.940 -1.961 -2.877 1.00 0.36 C ATOM 1394 C ALA A 90 -10.175 -1.028 -2.624 1.00 0.39 C ATOM 1395 O ALA A 90 -10.081 -0.007 -1.907 1.00 0.37 O ATOM 1396 CB ALA A 90 -9.014 -3.236 -1.971 1.00 0.41 C ATOM 0 H ALA A 90 -7.623 -0.640 -1.856 1.00 0.33 H new ATOM 0 HA ALA A 90 -8.981 -2.269 -3.922 1.00 0.36 H new ATOM 0 HB1 ALA A 90 -9.966 -3.741 -2.131 1.00 0.41 H new ATOM 0 HB2 ALA A 90 -8.197 -3.912 -2.226 1.00 0.41 H new ATOM 0 HB3 ALA A 90 -8.930 -2.944 -0.924 1.00 0.41 H new ATOM 1402 N GLU A 91 -11.335 -1.396 -3.240 1.00 0.46 N ATOM 1403 CA GLU A 91 -12.614 -0.654 -3.104 1.00 0.53 C ATOM 1404 C GLU A 91 -13.729 -1.563 -2.531 1.00 0.63 C ATOM 1405 O GLU A 91 -13.923 -2.694 -2.997 1.00 1.23 O ATOM 1406 CB GLU A 91 -13.055 -0.074 -4.474 1.00 0.78 C ATOM 1407 CG GLU A 91 -13.113 -1.100 -5.620 1.00 1.80 C ATOM 1408 CD GLU A 91 -13.375 -0.455 -6.964 1.00 2.04 C ATOM 1409 OE1 GLU A 91 -14.369 0.291 -7.083 1.00 1.94 O ATOM 1410 OE2 GLU A 91 -12.586 -0.698 -7.899 1.00 2.61 O ATOM 0 H GLU A 91 -11.405 -2.215 -3.843 1.00 0.46 H new ATOM 0 HA GLU A 91 -12.449 0.168 -2.407 1.00 0.53 H new ATOM 0 HB2 GLU A 91 -14.040 0.380 -4.361 1.00 0.78 H new ATOM 0 HB3 GLU A 91 -12.367 0.724 -4.754 1.00 0.78 H new ATOM 0 HG2 GLU A 91 -12.171 -1.647 -5.661 1.00 1.80 H new ATOM 0 HG3 GLU A 91 -13.896 -1.829 -5.412 1.00 1.80 H new ATOM 1417 N VAL A 92 -14.474 -1.055 -1.529 1.00 0.60 N ATOM 1418 CA VAL A 92 -15.562 -1.855 -0.871 1.00 0.76 C ATOM 1419 C VAL A 92 -16.928 -1.092 -0.704 1.00 0.66 C ATOM 1420 O VAL A 92 -17.697 -1.422 0.209 1.00 1.19 O ATOM 1421 CB VAL A 92 -15.150 -2.513 0.548 1.00 1.42 C ATOM 1422 CG1 VAL A 92 -14.458 -3.878 0.370 1.00 2.13 C ATOM 1423 CG2 VAL A 92 -14.254 -1.625 1.466 1.00 2.00 C ATOM 0 H VAL A 92 -14.357 -0.114 -1.153 1.00 0.60 H new ATOM 0 HA VAL A 92 -15.708 -2.661 -1.591 1.00 0.76 H new ATOM 0 HB VAL A 92 -16.110 -2.625 1.053 1.00 1.42 H new ATOM 0 HG11 VAL A 92 -14.198 -4.284 1.347 1.00 2.13 H new ATOM 0 HG12 VAL A 92 -15.133 -4.564 -0.141 1.00 2.13 H new ATOM 0 HG13 VAL A 92 -13.552 -3.752 -0.223 1.00 2.13 H new ATOM 0 HG21 VAL A 92 -14.037 -2.160 2.390 1.00 2.00 H new ATOM 0 HG22 VAL A 92 -13.321 -1.396 0.952 1.00 2.00 H new ATOM 0 HG23 VAL A 92 -14.778 -0.698 1.698 1.00 2.00 H new ATOM 1433 N TYR A 93 -17.244 -0.097 -1.572 1.00 0.76 N ATOM 1434 CA TYR A 93 -18.524 0.652 -1.454 1.00 0.80 C ATOM 1435 C TYR A 93 -18.972 1.371 -2.754 1.00 0.86 C ATOM 1436 O TYR A 93 -20.173 1.410 -3.036 1.00 1.46 O ATOM 1437 CB TYR A 93 -18.450 1.684 -0.306 1.00 1.23 C ATOM 1438 CG TYR A 93 -19.702 1.735 0.591 1.00 0.97 C ATOM 1439 CD1 TYR A 93 -19.852 0.878 1.689 1.00 1.14 C ATOM 1440 CD2 TYR A 93 -20.729 2.653 0.342 1.00 1.01 C ATOM 1441 CE1 TYR A 93 -20.978 0.936 2.496 1.00 1.47 C ATOM 1442 CE2 TYR A 93 -21.854 2.708 1.149 1.00 1.43 C ATOM 1443 CZ TYR A 93 -21.974 1.804 2.218 1.00 1.67 C ATOM 1444 OH TYR A 93 -23.087 1.908 3.022 1.00 2.27 O ATOM 0 H TYR A 93 -16.647 0.201 -2.344 1.00 0.76 H new ATOM 0 HA TYR A 93 -19.275 -0.109 -1.243 1.00 0.80 H new ATOM 0 HB2 TYR A 93 -17.583 1.456 0.315 1.00 1.23 H new ATOM 0 HB3 TYR A 93 -18.285 2.673 -0.734 1.00 1.23 H new ATOM 0 HD1 TYR A 93 -19.077 0.159 1.911 1.00 1.14 H new ATOM 0 HD2 TYR A 93 -20.643 3.331 -0.494 1.00 1.01 H new ATOM 0 HE1 TYR A 93 -21.059 0.283 3.352 1.00 1.47 H new ATOM 0 HE2 TYR A 93 -22.629 3.436 0.959 1.00 1.43 H new ATOM 0 HH TYR A 93 -23.691 2.588 2.658 1.00 2.27 H new ATOM 1454 N PHE A 94 -18.027 1.936 -3.547 1.00 0.78 N ATOM 1455 CA PHE A 94 -18.377 2.671 -4.781 1.00 0.82 C ATOM 1456 C PHE A 94 -17.786 2.035 -6.049 1.00 0.76 C ATOM 1457 O PHE A 94 -16.587 1.742 -6.121 1.00 0.79 O ATOM 1458 CB PHE A 94 -17.895 4.129 -4.691 1.00 1.01 C ATOM 1459 CG PHE A 94 -18.632 4.982 -3.661 1.00 1.11 C ATOM 1460 CD1 PHE A 94 -19.861 5.576 -3.959 1.00 1.31 C ATOM 1461 CD2 PHE A 94 -18.097 5.180 -2.387 1.00 1.13 C ATOM 1462 CE1 PHE A 94 -20.530 6.338 -3.016 1.00 1.46 C ATOM 1463 CE2 PHE A 94 -18.765 5.944 -1.445 1.00 1.23 C ATOM 1464 CZ PHE A 94 -19.980 6.565 -1.792 1.00 1.37 C ATOM 0 H PHE A 94 -17.026 1.896 -3.353 1.00 0.78 H new ATOM 0 HA PHE A 94 -19.463 2.628 -4.860 1.00 0.82 H new ATOM 0 HB2 PHE A 94 -16.832 4.132 -4.451 1.00 1.01 H new ATOM 0 HB3 PHE A 94 -18.002 4.594 -5.671 1.00 1.01 H new ATOM 0 HD1 PHE A 94 -20.295 5.439 -4.938 1.00 1.31 H new ATOM 0 HD2 PHE A 94 -17.148 4.731 -2.132 1.00 1.13 H new ATOM 0 HE1 PHE A 94 -21.497 6.756 -3.254 1.00 1.46 H new ATOM 0 HE2 PHE A 94 -18.357 6.063 -0.452 1.00 1.23 H new ATOM 0 HZ PHE A 94 -20.474 7.219 -1.089 1.00 1.37 H new ATOM 1474 N ALA A 95 -18.664 1.840 -7.067 1.00 0.73 N ATOM 1475 CA ALA A 95 -18.275 1.257 -8.371 1.00 0.73 C ATOM 1476 C ALA A 95 -18.425 2.309 -9.516 1.00 0.72 C ATOM 1477 O ALA A 95 -19.521 2.560 -10.056 1.00 0.84 O ATOM 1478 CB ALA A 95 -19.084 -0.043 -8.652 1.00 0.82 C ATOM 0 H ALA A 95 -19.653 2.081 -7.005 1.00 0.73 H new ATOM 0 HA ALA A 95 -17.222 0.979 -8.332 1.00 0.73 H new ATOM 0 HB1 ALA A 95 -18.784 -0.457 -9.615 1.00 0.82 H new ATOM 0 HB2 ALA A 95 -18.886 -0.772 -7.866 1.00 0.82 H new ATOM 0 HB3 ALA A 95 -20.149 0.188 -8.672 1.00 0.82 H new ATOM 1484 N GLN A 96 -17.297 2.979 -9.829 1.00 0.65 N ATOM 1485 CA GLN A 96 -17.252 4.012 -10.896 1.00 0.66 C ATOM 1486 C GLN A 96 -15.840 4.176 -11.508 1.00 0.58 C ATOM 1487 O GLN A 96 -14.821 4.001 -10.829 1.00 0.53 O ATOM 1488 CB GLN A 96 -17.770 5.381 -10.370 1.00 0.72 C ATOM 1489 CG GLN A 96 -17.145 5.850 -9.048 1.00 1.40 C ATOM 1490 CD GLN A 96 -17.824 7.092 -8.503 1.00 1.85 C ATOM 1491 OE1 GLN A 96 -17.420 8.216 -8.798 1.00 2.38 O ATOM 1492 NE2 GLN A 96 -18.870 6.893 -7.706 1.00 2.45 N ATOM 0 H GLN A 96 -16.404 2.827 -9.361 1.00 0.65 H new ATOM 0 HA GLN A 96 -17.912 3.662 -11.690 1.00 0.66 H new ATOM 0 HB2 GLN A 96 -17.584 6.139 -11.131 1.00 0.72 H new ATOM 0 HB3 GLN A 96 -18.850 5.318 -10.241 1.00 0.72 H new ATOM 0 HG2 GLN A 96 -17.212 5.049 -8.312 1.00 1.40 H new ATOM 0 HG3 GLN A 96 -16.085 6.055 -9.201 1.00 1.40 H new ATOM 0 HE21 GLN A 96 -19.171 5.943 -7.487 1.00 2.45 H new ATOM 0 HE22 GLN A 96 -19.371 7.690 -7.313 1.00 2.45 H new ATOM 1501 N SER A 97 -15.805 4.548 -12.805 1.00 0.64 N ATOM 1502 CA SER A 97 -14.540 4.733 -13.552 1.00 0.62 C ATOM 1503 C SER A 97 -14.425 6.124 -14.197 1.00 0.81 C ATOM 1504 O SER A 97 -15.307 6.551 -14.954 1.00 1.66 O ATOM 1505 CB SER A 97 -14.416 3.671 -14.651 1.00 0.68 C ATOM 1506 OG SER A 97 -14.088 2.399 -14.123 1.00 0.73 O ATOM 0 H SER A 97 -16.642 4.727 -13.360 1.00 0.64 H new ATOM 0 HA SER A 97 -13.735 4.633 -12.824 1.00 0.62 H new ATOM 0 HB2 SER A 97 -15.356 3.605 -15.199 1.00 0.68 H new ATOM 0 HB3 SER A 97 -13.651 3.976 -15.365 1.00 0.68 H new ATOM 0 HG SER A 97 -14.020 1.749 -14.854 1.00 0.73 H new ATOM 1512 N GLN A 98 -13.292 6.823 -13.882 1.00 0.55 N ATOM 1513 CA GLN A 98 -12.944 8.210 -14.377 1.00 0.54 C ATOM 1514 C GLN A 98 -13.880 9.321 -13.802 1.00 0.56 C ATOM 1515 O GLN A 98 -14.411 10.167 -14.531 1.00 0.67 O ATOM 1516 CB GLN A 98 -12.925 8.273 -15.929 1.00 0.62 C ATOM 1517 CG GLN A 98 -11.766 7.502 -16.593 1.00 1.06 C ATOM 1518 CD GLN A 98 -10.427 8.227 -16.499 1.00 1.14 C ATOM 1519 OE1 GLN A 98 -10.366 9.458 -16.488 1.00 1.89 O ATOM 1520 NE2 GLN A 98 -9.343 7.461 -16.435 1.00 1.60 N ATOM 0 H GLN A 98 -12.576 6.438 -13.266 1.00 0.55 H new ATOM 0 HA GLN A 98 -11.940 8.413 -14.003 1.00 0.54 H new ATOM 0 HB2 GLN A 98 -13.868 7.879 -16.306 1.00 0.62 H new ATOM 0 HB3 GLN A 98 -12.871 9.318 -16.236 1.00 0.62 H new ATOM 0 HG2 GLN A 98 -11.675 6.522 -16.124 1.00 1.06 H new ATOM 0 HG3 GLN A 98 -12.006 7.332 -17.642 1.00 1.06 H new ATOM 0 HE21 GLN A 98 -9.435 6.445 -16.447 1.00 1.60 H new ATOM 0 HE22 GLN A 98 -8.419 7.889 -16.374 1.00 1.60 H new ATOM 1529 N GLN A 99 -14.049 9.278 -12.477 1.00 0.53 N ATOM 1530 CA GLN A 99 -14.909 10.202 -11.711 1.00 0.58 C ATOM 1531 C GLN A 99 -14.286 10.470 -10.332 1.00 0.57 C ATOM 1532 O GLN A 99 -14.296 11.606 -9.851 1.00 0.62 O ATOM 1533 CB GLN A 99 -16.332 9.626 -11.535 1.00 0.61 C ATOM 1534 CG GLN A 99 -17.256 9.803 -12.753 1.00 1.18 C ATOM 1535 CD GLN A 99 -18.619 9.152 -12.565 1.00 1.71 C ATOM 1536 OE1 GLN A 99 -18.753 8.131 -11.889 1.00 2.56 O ATOM 1537 NE2 GLN A 99 -19.644 9.746 -13.168 1.00 2.02 N ATOM 0 H GLN A 99 -13.584 8.587 -11.889 1.00 0.53 H new ATOM 0 HA GLN A 99 -14.985 11.135 -12.269 1.00 0.58 H new ATOM 0 HB2 GLN A 99 -16.253 8.563 -11.308 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -16.797 10.102 -10.672 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -17.391 10.867 -12.948 1.00 1.18 H new ATOM 0 HG3 GLN A 99 -16.774 9.377 -13.633 1.00 1.18 H new ATOM 0 HE21 GLN A 99 -19.492 10.591 -13.719 1.00 2.02 H new ATOM 0 HE22 GLN A 99 -20.583 9.357 -13.079 1.00 2.02 H new ATOM 1546 N LYS A 100 -13.742 9.396 -9.701 1.00 0.53 N ATOM 1547 CA LYS A 100 -13.051 9.497 -8.414 1.00 0.55 C ATOM 1548 C LYS A 100 -11.560 9.203 -8.638 1.00 0.48 C ATOM 1549 O LYS A 100 -11.072 8.088 -8.422 1.00 0.49 O ATOM 1550 CB LYS A 100 -13.663 8.545 -7.366 1.00 0.64 C ATOM 1551 CG LYS A 100 -15.006 9.031 -6.774 1.00 1.11 C ATOM 1552 CD LYS A 100 -15.537 8.100 -5.661 1.00 1.52 C ATOM 1553 CE LYS A 100 -16.880 8.582 -5.086 1.00 2.14 C ATOM 1554 NZ LYS A 100 -17.324 7.731 -3.951 1.00 2.76 N ATOM 0 H LYS A 100 -13.776 8.449 -10.077 1.00 0.53 H new ATOM 0 HA LYS A 100 -13.168 10.505 -8.017 1.00 0.55 H new ATOM 0 HB2 LYS A 100 -13.814 7.567 -7.824 1.00 0.64 H new ATOM 0 HB3 LYS A 100 -12.949 8.410 -6.554 1.00 0.64 H new ATOM 0 HG2 LYS A 100 -14.879 10.036 -6.372 1.00 1.11 H new ATOM 0 HG3 LYS A 100 -15.747 9.098 -7.571 1.00 1.11 H new ATOM 0 HD2 LYS A 100 -15.656 7.092 -6.060 1.00 1.52 H new ATOM 0 HD3 LYS A 100 -14.801 8.041 -4.859 1.00 1.52 H new ATOM 0 HE2 LYS A 100 -16.784 9.615 -4.752 1.00 2.14 H new ATOM 0 HE3 LYS A 100 -17.638 8.570 -5.869 1.00 2.14 H new ATOM 0 HZ1 LYS A 100 -17.941 8.284 -3.323 1.00 2.76 H new ATOM 0 HZ2 LYS A 100 -17.848 6.910 -4.317 1.00 2.76 H new ATOM 0 HZ3 LYS A 100 -16.494 7.402 -3.418 1.00 2.76 H new ATOM 1568 N VAL A 101 -10.854 10.260 -9.072 1.00 0.45 N ATOM 1569 CA VAL A 101 -9.409 10.209 -9.408 1.00 0.40 C ATOM 1570 C VAL A 101 -8.579 10.943 -8.326 1.00 0.41 C ATOM 1571 O VAL A 101 -8.686 12.159 -8.135 1.00 0.47 O ATOM 1572 CB VAL A 101 -9.045 10.735 -10.884 1.00 0.38 C ATOM 1573 CG1 VAL A 101 -9.042 9.578 -11.902 1.00 0.69 C ATOM 1574 CG2 VAL A 101 -9.951 11.877 -11.445 1.00 0.68 C ATOM 0 H VAL A 101 -11.267 11.184 -9.203 1.00 0.45 H new ATOM 0 HA VAL A 101 -9.142 9.152 -9.417 1.00 0.40 H new ATOM 0 HB VAL A 101 -8.051 11.163 -10.758 1.00 0.38 H new ATOM 0 HG11 VAL A 101 -8.793 9.964 -12.891 1.00 0.69 H new ATOM 0 HG12 VAL A 101 -8.302 8.834 -11.606 1.00 0.69 H new ATOM 0 HG13 VAL A 101 -10.029 9.116 -11.931 1.00 0.69 H new ATOM 0 HG21 VAL A 101 -9.614 12.151 -12.445 1.00 0.68 H new ATOM 0 HG22 VAL A 101 -10.984 11.532 -11.493 1.00 0.68 H new ATOM 0 HG23 VAL A 101 -9.889 12.746 -10.790 1.00 0.68 H new ATOM 1584 N PHE A 102 -7.750 10.145 -7.641 1.00 0.39 N ATOM 1585 CA PHE A 102 -6.925 10.592 -6.494 1.00 0.40 C ATOM 1586 C PHE A 102 -5.461 10.949 -6.831 1.00 0.38 C ATOM 1587 O PHE A 102 -5.024 10.809 -7.959 1.00 0.41 O ATOM 1588 CB PHE A 102 -6.903 9.431 -5.498 1.00 0.42 C ATOM 1589 CG PHE A 102 -8.285 8.969 -5.021 1.00 0.49 C ATOM 1590 CD1 PHE A 102 -9.186 9.864 -4.447 1.00 0.60 C ATOM 1591 CD2 PHE A 102 -8.704 7.643 -5.196 1.00 0.60 C ATOM 1592 CE1 PHE A 102 -10.450 9.453 -4.065 1.00 0.67 C ATOM 1593 CE2 PHE A 102 -9.968 7.236 -4.802 1.00 0.70 C ATOM 1594 CZ PHE A 102 -10.840 8.141 -4.240 1.00 0.69 C ATOM 0 H PHE A 102 -7.627 9.158 -7.865 1.00 0.39 H new ATOM 0 HA PHE A 102 -7.374 11.510 -6.116 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -6.391 8.586 -5.958 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -6.314 9.726 -4.630 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -8.893 10.893 -4.298 1.00 0.60 H new ATOM 0 HD2 PHE A 102 -8.031 6.928 -5.645 1.00 0.60 H new ATOM 0 HE1 PHE A 102 -11.136 10.163 -3.627 1.00 0.67 H new ATOM 0 HE2 PHE A 102 -10.270 6.208 -4.936 1.00 0.70 H new ATOM 0 HZ PHE A 102 -11.827 7.825 -3.937 1.00 0.69 H new ATOM 1604 N ASP A 103 -4.710 11.440 -5.818 1.00 0.36 N ATOM 1605 CA ASP A 103 -3.272 11.771 -6.002 1.00 0.34 C ATOM 1606 C ASP A 103 -2.405 10.991 -4.994 1.00 0.32 C ATOM 1607 O ASP A 103 -2.723 10.936 -3.803 1.00 0.34 O ATOM 1608 CB ASP A 103 -2.956 13.282 -5.853 1.00 0.37 C ATOM 1609 CG ASP A 103 -3.569 14.198 -6.918 1.00 0.85 C ATOM 1610 OD1 ASP A 103 -4.469 13.731 -7.650 1.00 1.30 O ATOM 1611 OD2 ASP A 103 -3.150 15.367 -7.022 1.00 1.33 O ATOM 0 H ASP A 103 -5.066 11.615 -4.878 1.00 0.36 H new ATOM 0 HA ASP A 103 -3.037 11.483 -7.027 1.00 0.34 H new ATOM 0 HB2 ASP A 103 -3.302 13.612 -4.874 1.00 0.37 H new ATOM 0 HB3 ASP A 103 -1.874 13.411 -5.868 1.00 0.37 H new ATOM 1616 N VAL A 104 -1.287 10.413 -5.478 1.00 0.29 N ATOM 1617 CA VAL A 104 -0.374 9.601 -4.631 1.00 0.28 C ATOM 1618 C VAL A 104 1.124 10.086 -4.822 1.00 0.26 C ATOM 1619 O VAL A 104 1.676 10.074 -5.951 1.00 0.25 O ATOM 1620 CB VAL A 104 -0.661 8.017 -4.888 1.00 0.33 C ATOM 1621 CG1 VAL A 104 0.521 7.058 -4.638 1.00 0.31 C ATOM 1622 CG2 VAL A 104 -1.821 7.507 -4.005 1.00 0.48 C ATOM 0 H VAL A 104 -0.990 10.490 -6.451 1.00 0.29 H new ATOM 0 HA VAL A 104 -0.567 9.751 -3.569 1.00 0.28 H new ATOM 0 HB VAL A 104 -0.890 7.993 -5.953 1.00 0.33 H new ATOM 0 HG11 VAL A 104 0.208 6.034 -4.842 1.00 0.31 H new ATOM 0 HG12 VAL A 104 1.349 7.322 -5.295 1.00 0.31 H new ATOM 0 HG13 VAL A 104 0.842 7.139 -3.599 1.00 0.31 H new ATOM 0 HG21 VAL A 104 -1.988 6.448 -4.200 1.00 0.48 H new ATOM 0 HG22 VAL A 104 -1.567 7.647 -2.954 1.00 0.48 H new ATOM 0 HG23 VAL A 104 -2.728 8.066 -4.237 1.00 0.48 H new ATOM 1632 N ARG A 105 1.760 10.428 -3.664 1.00 0.26 N ATOM 1633 CA ARG A 105 3.149 10.962 -3.608 1.00 0.26 C ATOM 1634 C ARG A 105 4.135 10.139 -2.733 1.00 0.23 C ATOM 1635 O ARG A 105 3.739 9.502 -1.745 1.00 0.26 O ATOM 1636 CB ARG A 105 3.129 12.395 -3.037 1.00 0.33 C ATOM 1637 CG ARG A 105 2.096 13.344 -3.674 1.00 0.53 C ATOM 1638 CD ARG A 105 2.292 14.803 -3.232 1.00 0.51 C ATOM 1639 NE ARG A 105 1.086 15.587 -3.465 1.00 0.92 N ATOM 1640 CZ ARG A 105 1.078 16.879 -3.813 1.00 1.25 C ATOM 1641 NH1 ARG A 105 2.211 17.564 -3.917 1.00 1.15 N ATOM 1642 NH2 ARG A 105 -0.074 17.492 -4.045 1.00 1.69 N ATOM 0 H ARG A 105 1.323 10.340 -2.747 1.00 0.26 H new ATOM 0 HA ARG A 105 3.506 10.915 -4.637 1.00 0.26 H new ATOM 0 HB2 ARG A 105 2.934 12.339 -1.966 1.00 0.33 H new ATOM 0 HB3 ARG A 105 4.121 12.830 -3.158 1.00 0.33 H new ATOM 0 HG2 ARG A 105 2.171 13.283 -4.760 1.00 0.53 H new ATOM 0 HG3 ARG A 105 1.092 13.017 -3.405 1.00 0.53 H new ATOM 0 HD2 ARG A 105 2.551 14.834 -2.174 1.00 0.51 H new ATOM 0 HD3 ARG A 105 3.127 15.243 -3.778 1.00 0.51 H new ATOM 0 HE ARG A 105 0.186 15.119 -3.355 1.00 0.92 H new ATOM 0 HH11 ARG A 105 3.103 17.106 -3.731 1.00 1.15 H new ATOM 0 HH12 ARG A 105 2.189 18.548 -4.183 1.00 1.15 H new ATOM 0 HH21 ARG A 105 -0.951 16.979 -3.958 1.00 1.69 H new ATOM 0 HH22 ARG A 105 -0.083 18.477 -4.310 1.00 1.69 H new ATOM 1656 N VAL A 106 5.451 10.233 -3.089 1.00 0.23 N ATOM 1657 CA VAL A 106 6.561 9.525 -2.360 1.00 0.23 C ATOM 1658 C VAL A 106 7.774 10.461 -2.045 1.00 0.22 C ATOM 1659 O VAL A 106 8.570 10.789 -2.928 1.00 0.23 O ATOM 1660 CB VAL A 106 7.098 8.171 -3.036 1.00 0.29 C ATOM 1661 CG1 VAL A 106 6.357 6.936 -2.485 1.00 0.57 C ATOM 1662 CG2 VAL A 106 7.038 8.130 -4.590 1.00 0.60 C ATOM 0 H VAL A 106 5.774 10.793 -3.878 1.00 0.23 H new ATOM 0 HA VAL A 106 6.071 9.228 -1.433 1.00 0.23 H new ATOM 0 HB VAL A 106 8.153 8.151 -2.763 1.00 0.29 H new ATOM 0 HG11 VAL A 106 6.744 6.036 -2.963 1.00 0.57 H new ATOM 0 HG12 VAL A 106 6.511 6.870 -1.408 1.00 0.57 H new ATOM 0 HG13 VAL A 106 5.291 7.028 -2.694 1.00 0.57 H new ATOM 0 HG21 VAL A 106 7.423 7.174 -4.944 1.00 0.60 H new ATOM 0 HG22 VAL A 106 6.005 8.249 -4.917 1.00 0.60 H new ATOM 0 HG23 VAL A 106 7.643 8.939 -4.999 1.00 0.60 H new ATOM 1672 N ASN A 107 7.883 10.877 -0.735 1.00 0.23 N ATOM 1673 CA ASN A 107 8.944 11.801 -0.155 1.00 0.23 C ATOM 1674 C ASN A 107 8.893 13.250 -0.727 1.00 0.24 C ATOM 1675 O ASN A 107 9.909 13.959 -0.756 1.00 0.25 O ATOM 1676 CB ASN A 107 10.365 11.222 -0.344 1.00 0.23 C ATOM 1677 CG ASN A 107 11.259 11.327 0.894 1.00 0.27 C ATOM 1678 OD1 ASN A 107 12.098 10.467 1.145 1.00 1.05 O ATOM 1679 ND2 ASN A 107 11.095 12.404 1.653 1.00 1.12 N ATOM 0 H ASN A 107 7.216 10.572 -0.026 1.00 0.23 H new ATOM 0 HA ASN A 107 8.713 11.865 0.908 1.00 0.23 H new ATOM 0 HB2 ASN A 107 10.282 10.173 -0.630 1.00 0.23 H new ATOM 0 HB3 ASN A 107 10.849 11.741 -1.172 1.00 0.23 H new ATOM 0 HD21 ASN A 107 11.678 12.539 2.479 1.00 1.12 H new ATOM 0 HD22 ASN A 107 10.386 13.096 1.410 1.00 1.12 H new ATOM 1686 N GLY A 108 7.700 13.669 -1.163 1.00 0.25 N ATOM 1687 CA GLY A 108 7.539 14.967 -1.779 1.00 0.29 C ATOM 1688 C GLY A 108 7.303 14.895 -3.306 1.00 0.29 C ATOM 1689 O GLY A 108 6.798 15.846 -3.908 1.00 0.32 O ATOM 0 H GLY A 108 6.842 13.122 -1.096 1.00 0.25 H new ATOM 0 HA2 GLY A 108 6.699 15.481 -1.312 1.00 0.29 H new ATOM 0 HA3 GLY A 108 8.428 15.567 -1.584 1.00 0.29 H new ATOM 1693 N HIS A 109 7.684 13.732 -3.917 1.00 0.27 N ATOM 1694 CA HIS A 109 7.557 13.444 -5.357 1.00 0.28 C ATOM 1695 C HIS A 109 6.145 12.941 -5.776 1.00 0.30 C ATOM 1696 O HIS A 109 5.297 12.672 -4.934 1.00 0.57 O ATOM 1697 CB HIS A 109 8.575 12.344 -5.677 1.00 0.29 C ATOM 1698 CG HIS A 109 10.020 12.747 -5.535 1.00 0.31 C ATOM 1699 ND1 HIS A 109 10.739 13.326 -6.556 1.00 0.43 N ATOM 1700 CD2 HIS A 109 10.884 12.626 -4.489 1.00 0.27 C ATOM 1701 CE1 HIS A 109 11.978 13.540 -6.154 1.00 0.46 C ATOM 1702 NE2 HIS A 109 12.091 13.127 -4.905 1.00 0.36 N ATOM 0 H HIS A 109 8.097 12.958 -3.397 1.00 0.27 H new ATOM 0 HA HIS A 109 7.729 14.371 -5.904 1.00 0.28 H new ATOM 0 HB2 HIS A 109 8.385 11.494 -5.022 1.00 0.29 H new ATOM 0 HB3 HIS A 109 8.408 12.003 -6.699 1.00 0.29 H new ATOM 0 HD1 HIS A 109 10.372 13.554 -7.480 1.00 0.43 H new ATOM 0 HD2 HIS A 109 10.661 12.214 -3.516 1.00 0.27 H new ATOM 0 HE1 HIS A 109 12.767 13.979 -6.747 1.00 0.46 H new ATOM 1711 N THR A 110 5.907 12.826 -7.094 1.00 0.31 N ATOM 1712 CA THR A 110 4.609 12.321 -7.619 1.00 0.32 C ATOM 1713 C THR A 110 4.823 11.110 -8.540 1.00 0.35 C ATOM 1714 O THR A 110 5.548 11.198 -9.541 1.00 0.47 O ATOM 1715 CB THR A 110 3.746 13.379 -8.404 1.00 0.43 C ATOM 1716 OG1 THR A 110 4.569 14.316 -9.130 1.00 0.55 O ATOM 1717 CG2 THR A 110 2.769 14.156 -7.499 1.00 0.47 C ATOM 0 H THR A 110 6.584 13.071 -7.816 1.00 0.31 H new ATOM 0 HA THR A 110 4.051 12.053 -6.722 1.00 0.32 H new ATOM 0 HB THR A 110 3.158 12.794 -9.111 1.00 0.43 H new ATOM 0 HG1 THR A 110 3.997 14.954 -9.605 1.00 0.55 H new ATOM 0 HG21 THR A 110 2.205 14.869 -8.100 1.00 0.47 H new ATOM 0 HG22 THR A 110 2.081 13.458 -7.023 1.00 0.47 H new ATOM 0 HG23 THR A 110 3.330 14.692 -6.733 1.00 0.47 H new ATOM 1725 N VAL A 111 4.176 9.984 -8.199 1.00 0.29 N ATOM 1726 CA VAL A 111 4.287 8.758 -9.015 1.00 0.35 C ATOM 1727 C VAL A 111 2.910 8.389 -9.698 1.00 0.35 C ATOM 1728 O VAL A 111 2.884 8.131 -10.905 1.00 0.39 O ATOM 1729 CB VAL A 111 5.037 7.547 -8.228 1.00 0.38 C ATOM 1730 CG1 VAL A 111 4.241 6.863 -7.073 1.00 1.06 C ATOM 1731 CG2 VAL A 111 5.586 6.483 -9.210 1.00 1.00 C ATOM 0 H VAL A 111 3.579 9.894 -7.377 1.00 0.29 H new ATOM 0 HA VAL A 111 4.958 8.962 -9.850 1.00 0.35 H new ATOM 0 HB VAL A 111 5.859 8.056 -7.724 1.00 0.38 H new ATOM 0 HG11 VAL A 111 4.849 6.074 -6.630 1.00 1.06 H new ATOM 0 HG12 VAL A 111 3.996 7.604 -6.312 1.00 1.06 H new ATOM 0 HG13 VAL A 111 3.321 6.433 -7.470 1.00 1.06 H new ATOM 0 HG21 VAL A 111 6.080 5.690 -8.648 1.00 1.00 H new ATOM 0 HG22 VAL A 111 4.763 6.061 -9.786 1.00 1.00 H new ATOM 0 HG23 VAL A 111 6.302 6.948 -9.887 1.00 1.00 H new ATOM 1741 N VAL A 112 1.799 8.376 -8.928 1.00 0.33 N ATOM 1742 CA VAL A 112 0.479 8.048 -9.521 1.00 0.35 C ATOM 1743 C VAL A 112 -0.537 9.151 -9.171 1.00 0.34 C ATOM 1744 O VAL A 112 -1.231 9.084 -8.154 1.00 0.32 O ATOM 1745 CB VAL A 112 -0.150 6.596 -9.184 1.00 0.37 C ATOM 1746 CG1 VAL A 112 -0.516 5.843 -10.483 1.00 0.44 C ATOM 1747 CG2 VAL A 112 0.721 5.641 -8.332 1.00 0.40 C ATOM 0 H VAL A 112 1.784 8.581 -7.929 1.00 0.33 H new ATOM 0 HA VAL A 112 0.683 7.997 -10.591 1.00 0.35 H new ATOM 0 HB VAL A 112 -1.020 6.848 -8.577 1.00 0.37 H new ATOM 0 HG11 VAL A 112 -0.937 4.869 -10.233 1.00 0.44 H new ATOM 0 HG12 VAL A 112 -1.249 6.422 -11.045 1.00 0.44 H new ATOM 0 HG13 VAL A 112 0.380 5.706 -11.089 1.00 0.44 H new ATOM 0 HG21 VAL A 112 0.188 4.703 -8.177 1.00 0.40 H new ATOM 0 HG22 VAL A 112 1.659 5.443 -8.851 1.00 0.40 H new ATOM 0 HG23 VAL A 112 0.931 6.103 -7.367 1.00 0.40 H new ATOM 1757 N LYS A 113 -0.612 10.157 -10.066 1.00 0.36 N ATOM 1758 CA LYS A 113 -1.524 11.291 -9.920 1.00 0.38 C ATOM 1759 C LYS A 113 -2.691 11.199 -10.917 1.00 0.43 C ATOM 1760 O LYS A 113 -2.638 11.664 -12.059 1.00 0.70 O ATOM 1761 CB LYS A 113 -0.754 12.604 -10.070 1.00 0.42 C ATOM 1762 CG LYS A 113 -1.585 13.886 -9.783 1.00 1.12 C ATOM 1763 CD LYS A 113 -0.720 15.156 -9.610 1.00 1.27 C ATOM 1764 CE LYS A 113 0.109 15.475 -10.861 1.00 1.50 C ATOM 1765 NZ LYS A 113 -0.753 15.775 -12.036 1.00 2.30 N ATOM 0 H LYS A 113 -0.038 10.198 -10.908 1.00 0.36 H new ATOM 0 HA LYS A 113 -1.959 11.264 -8.921 1.00 0.38 H new ATOM 0 HB2 LYS A 113 0.102 12.585 -9.396 1.00 0.42 H new ATOM 0 HB3 LYS A 113 -0.360 12.663 -11.085 1.00 0.42 H new ATOM 0 HG2 LYS A 113 -2.289 14.044 -10.600 1.00 1.12 H new ATOM 0 HG3 LYS A 113 -2.175 13.732 -8.880 1.00 1.12 H new ATOM 0 HD2 LYS A 113 -1.366 16.003 -9.380 1.00 1.27 H new ATOM 0 HD3 LYS A 113 -0.052 15.024 -8.759 1.00 1.27 H new ATOM 0 HE2 LYS A 113 0.757 16.328 -10.659 1.00 1.50 H new ATOM 0 HE3 LYS A 113 0.757 14.630 -11.092 1.00 1.50 H new ATOM 0 HZ1 LYS A 113 -0.158 16.068 -12.837 1.00 2.30 H new ATOM 0 HZ2 LYS A 113 -1.292 14.925 -12.297 1.00 2.30 H new ATOM 0 HZ3 LYS A 113 -1.412 16.543 -11.796 1.00 2.30 H new ATOM 1779 N ASP A 114 -3.709 10.539 -10.379 1.00 0.37 N ATOM 1780 CA ASP A 114 -5.048 10.202 -10.959 1.00 0.42 C ATOM 1781 C ASP A 114 -5.237 8.698 -10.789 1.00 0.38 C ATOM 1782 O ASP A 114 -5.080 7.916 -11.735 1.00 0.40 O ATOM 1783 CB ASP A 114 -5.310 10.610 -12.438 1.00 0.50 C ATOM 1784 CG ASP A 114 -5.895 12.015 -12.584 1.00 1.70 C ATOM 1785 OD1 ASP A 114 -5.245 12.979 -12.131 1.00 2.09 O ATOM 1786 OD2 ASP A 114 -7.002 12.142 -13.149 1.00 2.48 O ATOM 0 H ASP A 114 -3.632 10.180 -9.427 1.00 0.37 H new ATOM 0 HA ASP A 114 -5.775 10.804 -10.414 1.00 0.42 H new ATOM 0 HB2 ASP A 114 -4.374 10.554 -12.994 1.00 0.50 H new ATOM 0 HB3 ASP A 114 -5.993 9.891 -12.890 1.00 0.50 H new ATOM 1791 N LEU A 115 -5.568 8.304 -9.545 1.00 0.36 N ATOM 1792 CA LEU A 115 -5.712 6.902 -9.193 1.00 0.36 C ATOM 1793 C LEU A 115 -7.175 6.467 -8.985 1.00 0.38 C ATOM 1794 O LEU A 115 -7.822 6.815 -7.994 1.00 0.42 O ATOM 1795 CB LEU A 115 -4.800 6.586 -7.981 1.00 0.38 C ATOM 1796 CG LEU A 115 -4.413 5.096 -7.731 1.00 0.35 C ATOM 1797 CD1 LEU A 115 -3.843 4.362 -8.956 1.00 1.13 C ATOM 1798 CD2 LEU A 115 -3.413 4.994 -6.599 1.00 1.06 C ATOM 0 H LEU A 115 -5.739 8.949 -8.773 1.00 0.36 H new ATOM 0 HA LEU A 115 -5.383 6.301 -10.041 1.00 0.36 H new ATOM 0 HB2 LEU A 115 -3.878 7.156 -8.098 1.00 0.38 H new ATOM 0 HB3 LEU A 115 -5.294 6.959 -7.084 1.00 0.38 H new ATOM 0 HG LEU A 115 -5.352 4.603 -7.480 1.00 0.35 H new ATOM 0 HD11 LEU A 115 -3.604 3.334 -8.685 1.00 1.13 H new ATOM 0 HD12 LEU A 115 -4.582 4.364 -9.757 1.00 1.13 H new ATOM 0 HD13 LEU A 115 -2.939 4.868 -9.295 1.00 1.13 H new ATOM 0 HD21 LEU A 115 -3.153 3.948 -6.437 1.00 1.06 H new ATOM 0 HD22 LEU A 115 -2.515 5.556 -6.855 1.00 1.06 H new ATOM 0 HD23 LEU A 115 -3.850 5.405 -5.689 1.00 1.06 H new ATOM 1810 N ASP A 116 -7.673 5.737 -10.007 1.00 0.39 N ATOM 1811 CA ASP A 116 -9.024 5.154 -10.039 1.00 0.43 C ATOM 1812 C ASP A 116 -8.895 3.603 -10.035 1.00 0.42 C ATOM 1813 O ASP A 116 -8.465 2.999 -11.032 1.00 0.43 O ATOM 1814 CB ASP A 116 -9.791 5.643 -11.289 1.00 0.46 C ATOM 1815 CG ASP A 116 -11.273 5.912 -11.033 1.00 1.55 C ATOM 1816 OD1 ASP A 116 -12.004 4.948 -10.722 1.00 2.35 O ATOM 1817 OD2 ASP A 116 -11.695 7.082 -11.145 1.00 1.83 O ATOM 0 H ASP A 116 -7.132 5.535 -10.848 1.00 0.39 H new ATOM 0 HA ASP A 116 -9.588 5.472 -9.162 1.00 0.43 H new ATOM 0 HB2 ASP A 116 -9.323 6.556 -11.657 1.00 0.46 H new ATOM 0 HB3 ASP A 116 -9.697 4.896 -12.077 1.00 0.46 H new ATOM 1822 N ILE A 117 -9.313 2.970 -8.912 1.00 0.42 N ATOM 1823 CA ILE A 117 -9.214 1.483 -8.688 1.00 0.42 C ATOM 1824 C ILE A 117 -10.164 0.613 -9.607 1.00 0.44 C ATOM 1825 O ILE A 117 -9.762 -0.479 -10.031 1.00 0.44 O ATOM 1826 CB ILE A 117 -9.404 1.118 -7.144 1.00 0.43 C ATOM 1827 CG1 ILE A 117 -8.945 2.287 -6.209 1.00 0.55 C ATOM 1828 CG2 ILE A 117 -8.618 -0.170 -6.739 1.00 0.49 C ATOM 1829 CD1 ILE A 117 -10.060 2.988 -5.435 1.00 0.68 C ATOM 0 H ILE A 117 -9.732 3.467 -8.126 1.00 0.42 H new ATOM 0 HA ILE A 117 -8.203 1.214 -8.993 1.00 0.42 H new ATOM 0 HB ILE A 117 -10.472 0.942 -7.016 1.00 0.43 H new ATOM 0 HG12 ILE A 117 -8.222 1.894 -5.494 1.00 0.55 H new ATOM 0 HG13 ILE A 117 -8.424 3.029 -6.814 1.00 0.55 H new ATOM 0 HG21 ILE A 117 -8.779 -0.377 -5.681 1.00 0.49 H new ATOM 0 HG22 ILE A 117 -8.972 -1.014 -7.331 1.00 0.49 H new ATOM 0 HG23 ILE A 117 -7.554 -0.020 -6.922 1.00 0.49 H new ATOM 0 HD11 ILE A 117 -9.633 3.780 -4.819 1.00 0.68 H new ATOM 0 HD12 ILE A 117 -10.775 3.419 -6.136 1.00 0.68 H new ATOM 0 HD13 ILE A 117 -10.569 2.266 -4.796 1.00 0.68 H new ATOM 1841 N PHE A 118 -11.378 1.127 -9.955 1.00 0.48 N ATOM 1842 CA PHE A 118 -12.349 0.402 -10.837 1.00 0.51 C ATOM 1843 C PHE A 118 -11.932 0.420 -12.347 1.00 0.53 C ATOM 1844 O PHE A 118 -12.164 -0.558 -13.061 1.00 0.56 O ATOM 1845 CB PHE A 118 -13.759 1.003 -10.664 1.00 0.56 C ATOM 1846 CG PHE A 118 -14.907 0.070 -11.067 1.00 0.62 C ATOM 1847 CD1 PHE A 118 -15.299 -0.975 -10.228 1.00 0.65 C ATOM 1848 CD2 PHE A 118 -15.587 0.233 -12.277 1.00 0.68 C ATOM 1849 CE1 PHE A 118 -16.335 -1.824 -10.582 1.00 0.72 C ATOM 1850 CE2 PHE A 118 -16.623 -0.618 -12.632 1.00 0.75 C ATOM 1851 CZ PHE A 118 -16.996 -1.646 -11.785 1.00 0.77 C ATOM 0 H PHE A 118 -11.710 2.039 -9.641 1.00 0.48 H new ATOM 0 HA PHE A 118 -12.349 -0.643 -10.526 1.00 0.51 H new ATOM 0 HB2 PHE A 118 -13.891 1.290 -9.621 1.00 0.56 H new ATOM 0 HB3 PHE A 118 -13.825 1.915 -11.257 1.00 0.56 H new ATOM 0 HD1 PHE A 118 -14.787 -1.124 -9.289 1.00 0.65 H new ATOM 0 HD2 PHE A 118 -15.302 1.033 -12.945 1.00 0.68 H new ATOM 0 HE1 PHE A 118 -16.627 -2.625 -9.919 1.00 0.72 H new ATOM 0 HE2 PHE A 118 -17.139 -0.478 -13.570 1.00 0.75 H new ATOM 0 HZ PHE A 118 -17.802 -2.309 -12.062 1.00 0.77 H new ATOM 1861 N ASP A 119 -11.310 1.549 -12.808 1.00 0.52 N ATOM 1862 CA ASP A 119 -10.787 1.710 -14.201 1.00 0.54 C ATOM 1863 C ASP A 119 -9.451 0.917 -14.460 1.00 0.53 C ATOM 1864 O ASP A 119 -9.178 0.537 -15.602 1.00 0.57 O ATOM 1865 CB ASP A 119 -10.593 3.215 -14.514 1.00 0.55 C ATOM 1866 CG ASP A 119 -10.852 3.603 -15.979 1.00 0.57 C ATOM 1867 OD1 ASP A 119 -11.760 3.017 -16.606 1.00 0.72 O ATOM 1868 OD2 ASP A 119 -10.130 4.483 -16.494 1.00 0.91 O ATOM 0 H ASP A 119 -11.158 2.371 -12.224 1.00 0.52 H new ATOM 0 HA ASP A 119 -11.530 1.281 -14.873 1.00 0.54 H new ATOM 0 HB2 ASP A 119 -11.260 3.794 -13.875 1.00 0.55 H new ATOM 0 HB3 ASP A 119 -9.574 3.499 -14.252 1.00 0.55 H new ATOM 1873 N ARG A 120 -8.629 0.681 -13.390 1.00 0.49 N ATOM 1874 CA ARG A 120 -7.351 -0.082 -13.499 1.00 0.48 C ATOM 1875 C ARG A 120 -7.555 -1.623 -13.543 1.00 0.50 C ATOM 1876 O ARG A 120 -7.083 -2.265 -14.485 1.00 0.54 O ATOM 1877 CB ARG A 120 -6.395 0.268 -12.343 1.00 0.46 C ATOM 1878 CG ARG A 120 -5.946 1.750 -12.268 1.00 0.45 C ATOM 1879 CD ARG A 120 -4.879 2.124 -13.323 1.00 0.52 C ATOM 1880 NE ARG A 120 -3.682 1.287 -13.231 1.00 1.23 N ATOM 1881 CZ ARG A 120 -2.570 1.509 -13.929 1.00 1.49 C ATOM 1882 NH1 ARG A 120 -2.501 2.539 -14.765 1.00 1.03 N ATOM 1883 NH2 ARG A 120 -1.527 0.704 -13.791 1.00 2.43 N ATOM 0 H ARG A 120 -8.832 1.009 -12.446 1.00 0.49 H new ATOM 0 HA ARG A 120 -6.912 0.220 -14.450 1.00 0.48 H new ATOM 0 HB2 ARG A 120 -6.880 0.006 -11.403 1.00 0.46 H new ATOM 0 HB3 ARG A 120 -5.507 -0.358 -12.428 1.00 0.46 H new ATOM 0 HG2 ARG A 120 -6.817 2.393 -12.399 1.00 0.45 H new ATOM 0 HG3 ARG A 120 -5.549 1.951 -11.273 1.00 0.45 H new ATOM 0 HD2 ARG A 120 -5.309 2.028 -14.320 1.00 0.52 H new ATOM 0 HD3 ARG A 120 -4.598 3.169 -13.196 1.00 0.52 H new ATOM 0 HE ARG A 120 -3.701 0.489 -12.596 1.00 1.23 H new ATOM 0 HH11 ARG A 120 -3.301 3.162 -14.874 1.00 1.03 H new ATOM 0 HH12 ARG A 120 -1.648 2.707 -15.298 1.00 1.03 H new ATOM 0 HH21 ARG A 120 -1.575 -0.087 -13.149 1.00 2.43 H new ATOM 0 HH22 ARG A 120 -0.676 0.876 -14.326 1.00 2.43 H new ATOM 1897 N VAL A 121 -8.250 -2.222 -12.531 1.00 0.48 N ATOM 1898 CA VAL A 121 -8.519 -3.708 -12.546 1.00 0.51 C ATOM 1899 C VAL A 121 -9.858 -4.110 -13.272 1.00 0.56 C ATOM 1900 O VAL A 121 -9.877 -5.111 -13.994 1.00 0.62 O ATOM 1901 CB VAL A 121 -8.420 -4.465 -11.132 1.00 0.53 C ATOM 1902 CG1 VAL A 121 -6.972 -4.911 -10.843 1.00 0.92 C ATOM 1903 CG2 VAL A 121 -8.951 -3.676 -9.898 1.00 0.93 C ATOM 0 H VAL A 121 -8.625 -1.729 -11.721 1.00 0.48 H new ATOM 0 HA VAL A 121 -7.676 -4.064 -13.139 1.00 0.51 H new ATOM 0 HB VAL A 121 -9.086 -5.319 -11.255 1.00 0.53 H new ATOM 0 HG11 VAL A 121 -6.934 -5.421 -9.880 1.00 0.92 H new ATOM 0 HG12 VAL A 121 -6.637 -5.591 -11.627 1.00 0.92 H new ATOM 0 HG13 VAL A 121 -6.320 -4.038 -10.818 1.00 0.92 H new ATOM 0 HG21 VAL A 121 -8.834 -4.283 -9.000 1.00 0.93 H new ATOM 0 HG22 VAL A 121 -8.385 -2.751 -9.787 1.00 0.93 H new ATOM 0 HG23 VAL A 121 -10.006 -3.441 -10.043 1.00 0.93 H new ATOM 1913 N GLY A 122 -10.954 -3.330 -13.077 1.00 0.57 N ATOM 1914 CA GLY A 122 -12.245 -3.637 -13.727 1.00 0.63 C ATOM 1915 C GLY A 122 -13.324 -4.131 -12.761 1.00 0.66 C ATOM 1916 O GLY A 122 -14.282 -3.416 -12.463 1.00 0.85 O ATOM 0 H GLY A 122 -10.966 -2.500 -12.485 1.00 0.57 H new ATOM 0 HA2 GLY A 122 -12.607 -2.743 -14.234 1.00 0.63 H new ATOM 0 HA3 GLY A 122 -12.083 -4.395 -14.494 1.00 0.63 H new ATOM 1920 N HIS A 123 -13.143 -5.376 -12.284 1.00 0.72 N ATOM 1921 CA HIS A 123 -14.056 -6.045 -11.325 1.00 0.87 C ATOM 1922 C HIS A 123 -13.483 -6.030 -9.879 1.00 0.73 C ATOM 1923 O HIS A 123 -12.360 -5.559 -9.652 1.00 1.34 O ATOM 1924 CB HIS A 123 -14.372 -7.501 -11.778 1.00 1.38 C ATOM 1925 CG HIS A 123 -13.204 -8.269 -12.347 1.00 1.76 C ATOM 1926 ND1 HIS A 123 -12.409 -9.107 -11.592 1.00 2.62 N ATOM 1927 CD2 HIS A 123 -12.716 -8.335 -13.612 1.00 2.27 C ATOM 1928 CE1 HIS A 123 -11.485 -9.652 -12.366 1.00 3.18 C ATOM 1929 NE2 HIS A 123 -11.651 -9.200 -13.594 1.00 3.01 N ATOM 0 H HIS A 123 -12.350 -5.957 -12.554 1.00 0.72 H new ATOM 0 HA HIS A 123 -14.988 -5.479 -11.316 1.00 0.87 H new ATOM 0 HB2 HIS A 123 -14.766 -8.052 -10.924 1.00 1.38 H new ATOM 0 HB3 HIS A 123 -15.163 -7.467 -12.528 1.00 1.38 H new ATOM 0 HD2 HIS A 123 -13.096 -7.805 -14.473 1.00 2.27 H new ATOM 0 HE1 HIS A 123 -10.724 -10.349 -12.047 1.00 3.18 H new ATOM 0 HE2 HIS A 123 -11.080 -9.453 -14.400 1.00 3.01 H new ATOM 1938 N SER A 124 -14.284 -6.520 -8.887 1.00 0.86 N ATOM 1939 CA SER A 124 -13.884 -6.559 -7.440 1.00 0.70 C ATOM 1940 C SER A 124 -12.769 -7.601 -7.124 1.00 0.99 C ATOM 1941 O SER A 124 -13.031 -8.773 -6.829 1.00 2.08 O ATOM 1942 CB SER A 124 -15.115 -6.825 -6.561 1.00 0.73 C ATOM 1943 OG SER A 124 -15.871 -5.641 -6.357 1.00 1.20 O ATOM 0 H SER A 124 -15.216 -6.896 -9.061 1.00 0.86 H new ATOM 0 HA SER A 124 -13.461 -5.580 -7.214 1.00 0.70 H new ATOM 0 HB2 SER A 124 -15.742 -7.583 -7.030 1.00 0.73 H new ATOM 0 HB3 SER A 124 -14.797 -7.226 -5.599 1.00 0.73 H new ATOM 0 HG SER A 124 -16.649 -5.842 -5.796 1.00 1.20 H new ATOM 1949 N THR A 125 -11.526 -7.105 -7.211 1.00 0.56 N ATOM 1950 CA THR A 125 -10.279 -7.886 -6.997 1.00 0.51 C ATOM 1951 C THR A 125 -9.210 -6.996 -6.290 1.00 0.48 C ATOM 1952 O THR A 125 -9.536 -5.960 -5.690 1.00 0.51 O ATOM 1953 CB THR A 125 -9.692 -8.442 -8.372 1.00 0.55 C ATOM 1954 OG1 THR A 125 -10.099 -7.639 -9.500 1.00 0.62 O ATOM 1955 CG2 THR A 125 -10.096 -9.904 -8.636 1.00 0.62 C ATOM 0 H THR A 125 -11.346 -6.127 -7.437 1.00 0.56 H new ATOM 0 HA THR A 125 -10.524 -8.740 -6.365 1.00 0.51 H new ATOM 0 HB THR A 125 -8.609 -8.389 -8.264 1.00 0.55 H new ATOM 0 HG1 THR A 125 -10.752 -8.135 -10.036 1.00 0.62 H new ATOM 0 HG21 THR A 125 -9.671 -10.233 -9.584 1.00 0.62 H new ATOM 0 HG22 THR A 125 -9.721 -10.536 -7.831 1.00 0.62 H new ATOM 0 HG23 THR A 125 -11.183 -9.979 -8.680 1.00 0.62 H new ATOM 1963 N ALA A 126 -7.921 -7.418 -6.343 1.00 0.46 N ATOM 1964 CA ALA A 126 -6.803 -6.672 -5.723 1.00 0.43 C ATOM 1965 C ALA A 126 -5.984 -5.806 -6.746 1.00 0.38 C ATOM 1966 O ALA A 126 -5.642 -6.265 -7.850 1.00 0.41 O ATOM 1967 CB ALA A 126 -5.883 -7.677 -4.999 1.00 0.46 C ATOM 0 H ALA A 126 -7.632 -8.276 -6.812 1.00 0.46 H new ATOM 0 HA ALA A 126 -7.230 -5.961 -5.016 1.00 0.43 H new ATOM 0 HB1 ALA A 126 -5.053 -7.143 -4.536 1.00 0.46 H new ATOM 0 HB2 ALA A 126 -6.451 -8.201 -4.230 1.00 0.46 H new ATOM 0 HB3 ALA A 126 -5.494 -8.398 -5.718 1.00 0.46 H new ATOM 1973 N HIS A 127 -5.694 -4.527 -6.367 1.00 0.34 N ATOM 1974 CA HIS A 127 -4.887 -3.590 -7.203 1.00 0.32 C ATOM 1975 C HIS A 127 -3.466 -3.423 -6.598 1.00 0.31 C ATOM 1976 O HIS A 127 -3.303 -3.398 -5.375 1.00 0.35 O ATOM 1977 CB HIS A 127 -5.589 -2.211 -7.325 1.00 0.32 C ATOM 1978 CG HIS A 127 -4.976 -1.261 -8.343 1.00 0.33 C ATOM 1979 ND1 HIS A 127 -4.359 -1.687 -9.506 1.00 0.35 N ATOM 1980 CD2 HIS A 127 -4.848 0.096 -8.339 1.00 0.36 C ATOM 1981 CE1 HIS A 127 -3.879 -0.643 -10.159 1.00 0.38 C ATOM 1982 NE2 HIS A 127 -4.164 0.445 -9.474 1.00 0.38 N ATOM 0 H HIS A 127 -6.009 -4.122 -5.485 1.00 0.34 H new ATOM 0 HA HIS A 127 -4.797 -4.013 -8.204 1.00 0.32 H new ATOM 0 HB2 HIS A 127 -6.634 -2.375 -7.588 1.00 0.32 H new ATOM 0 HB3 HIS A 127 -5.578 -1.728 -6.348 1.00 0.32 H new ATOM 0 HD2 HIS A 127 -5.217 0.771 -7.581 1.00 0.36 H new ATOM 0 HE1 HIS A 127 -3.343 -0.677 -11.096 1.00 0.38 H new ATOM 0 HE2 HIS A 127 -3.915 1.396 -9.745 1.00 0.38 H new ATOM 1991 N ASP A 128 -2.442 -3.312 -7.460 1.00 0.32 N ATOM 1992 CA ASP A 128 -1.051 -3.194 -6.986 1.00 0.33 C ATOM 1993 C ASP A 128 -0.155 -2.308 -7.884 1.00 0.30 C ATOM 1994 O ASP A 128 -0.198 -2.387 -9.118 1.00 0.42 O ATOM 1995 CB ASP A 128 -0.435 -4.611 -6.895 1.00 0.45 C ATOM 1996 CG ASP A 128 0.450 -4.859 -5.669 1.00 1.70 C ATOM 1997 OD1 ASP A 128 0.746 -3.896 -4.939 1.00 2.50 O ATOM 1998 OD2 ASP A 128 0.844 -6.024 -5.453 1.00 2.10 O ATOM 0 H ASP A 128 -2.547 -3.301 -8.475 1.00 0.32 H new ATOM 0 HA ASP A 128 -1.090 -2.706 -6.012 1.00 0.33 H new ATOM 0 HB2 ASP A 128 -1.243 -5.342 -6.894 1.00 0.45 H new ATOM 0 HB3 ASP A 128 0.156 -4.791 -7.793 1.00 0.45 H new ATOM 2003 N GLU A 129 0.666 -1.473 -7.219 1.00 0.25 N ATOM 2004 CA GLU A 129 1.656 -0.620 -7.901 1.00 0.30 C ATOM 2005 C GLU A 129 3.063 -0.802 -7.275 1.00 0.27 C ATOM 2006 O GLU A 129 3.224 -0.816 -6.038 1.00 0.25 O ATOM 2007 CB GLU A 129 1.238 0.865 -7.866 1.00 0.43 C ATOM 2008 CG GLU A 129 1.562 1.661 -9.151 1.00 0.91 C ATOM 2009 CD GLU A 129 0.627 1.332 -10.305 1.00 0.76 C ATOM 2010 OE1 GLU A 129 -0.450 1.961 -10.396 1.00 1.56 O ATOM 2011 OE2 GLU A 129 0.971 0.446 -11.116 1.00 1.12 O ATOM 0 H GLU A 129 0.662 -1.371 -6.204 1.00 0.25 H new ATOM 0 HA GLU A 129 1.697 -0.933 -8.944 1.00 0.30 H new ATOM 0 HB2 GLU A 129 0.165 0.921 -7.681 1.00 0.43 H new ATOM 0 HB3 GLU A 129 1.732 1.347 -7.023 1.00 0.43 H new ATOM 0 HG2 GLU A 129 1.503 2.728 -8.936 1.00 0.91 H new ATOM 0 HG3 GLU A 129 2.589 1.453 -9.452 1.00 0.91 H new ATOM 2018 N ILE A 130 4.073 -0.927 -8.165 1.00 0.28 N ATOM 2019 CA ILE A 130 5.497 -1.146 -7.786 1.00 0.28 C ATOM 2020 C ILE A 130 6.355 0.128 -8.064 1.00 0.29 C ATOM 2021 O ILE A 130 6.389 0.643 -9.188 1.00 0.39 O ATOM 2022 CB ILE A 130 6.129 -2.401 -8.546 1.00 0.31 C ATOM 2023 CG1 ILE A 130 5.046 -3.434 -8.998 1.00 0.37 C ATOM 2024 CG2 ILE A 130 7.200 -3.144 -7.680 1.00 0.37 C ATOM 2025 CD1 ILE A 130 4.632 -3.345 -10.468 1.00 0.45 C ATOM 0 H ILE A 130 3.928 -0.879 -9.173 1.00 0.28 H new ATOM 0 HA ILE A 130 5.509 -1.355 -6.716 1.00 0.28 H new ATOM 0 HB ILE A 130 6.611 -1.983 -9.430 1.00 0.31 H new ATOM 0 HG12 ILE A 130 5.422 -4.438 -8.804 1.00 0.37 H new ATOM 0 HG13 ILE A 130 4.159 -3.300 -8.379 1.00 0.37 H new ATOM 0 HG21 ILE A 130 7.599 -3.989 -8.241 1.00 0.37 H new ATOM 0 HG22 ILE A 130 8.009 -2.457 -7.434 1.00 0.37 H new ATOM 0 HG23 ILE A 130 6.738 -3.505 -6.761 1.00 0.37 H new ATOM 0 HD11 ILE A 130 3.878 -4.103 -10.680 1.00 0.45 H new ATOM 0 HD12 ILE A 130 4.220 -2.356 -10.671 1.00 0.45 H new ATOM 0 HD13 ILE A 130 5.503 -3.512 -11.102 1.00 0.45 H new ATOM 2037 N ILE A 131 7.051 0.601 -7.008 1.00 0.21 N ATOM 2038 CA ILE A 131 7.908 1.803 -7.085 1.00 0.26 C ATOM 2039 C ILE A 131 9.343 1.507 -6.515 1.00 0.18 C ATOM 2040 O ILE A 131 9.561 1.679 -5.308 1.00 0.18 O ATOM 2041 CB ILE A 131 7.252 3.035 -6.307 1.00 0.34 C ATOM 2042 CG1 ILE A 131 5.687 3.005 -6.430 1.00 0.30 C ATOM 2043 CG2 ILE A 131 7.817 4.411 -6.826 1.00 0.62 C ATOM 2044 CD1 ILE A 131 4.904 3.315 -5.154 1.00 0.84 C ATOM 0 H ILE A 131 7.035 0.165 -6.086 1.00 0.21 H new ATOM 0 HA ILE A 131 7.998 2.072 -8.137 1.00 0.26 H new ATOM 0 HB ILE A 131 7.520 2.937 -5.255 1.00 0.34 H new ATOM 0 HG12 ILE A 131 5.390 3.720 -7.197 1.00 0.30 H new ATOM 0 HG13 ILE A 131 5.390 2.017 -6.783 1.00 0.30 H new ATOM 0 HG21 ILE A 131 7.349 5.227 -6.275 1.00 0.62 H new ATOM 0 HG22 ILE A 131 8.896 4.442 -6.674 1.00 0.62 H new ATOM 0 HG23 ILE A 131 7.597 4.517 -7.888 1.00 0.62 H new ATOM 0 HD11 ILE A 131 3.835 3.264 -5.362 1.00 0.84 H new ATOM 0 HD12 ILE A 131 5.159 2.586 -4.385 1.00 0.84 H new ATOM 0 HD13 ILE A 131 5.159 4.316 -4.805 1.00 0.84 H new ATOM 2056 N PRO A 132 10.344 1.023 -7.356 1.00 0.13 N ATOM 2057 CA PRO A 132 11.764 0.815 -6.904 1.00 0.09 C ATOM 2058 C PRO A 132 12.552 2.141 -6.759 1.00 0.08 C ATOM 2059 O PRO A 132 12.564 2.977 -7.667 1.00 0.16 O ATOM 2060 CB PRO A 132 12.391 -0.049 -8.019 1.00 0.13 C ATOM 2061 CG PRO A 132 11.214 -0.610 -8.761 1.00 0.16 C ATOM 2062 CD PRO A 132 10.177 0.502 -8.735 1.00 0.16 C ATOM 0 HA PRO A 132 11.795 0.354 -5.917 1.00 0.09 H new ATOM 0 HB2 PRO A 132 13.026 0.547 -8.674 1.00 0.13 H new ATOM 0 HB3 PRO A 132 13.014 -0.841 -7.605 1.00 0.13 H new ATOM 0 HG2 PRO A 132 11.481 -0.879 -9.783 1.00 0.16 H new ATOM 0 HG3 PRO A 132 10.838 -1.514 -8.282 1.00 0.16 H new ATOM 0 HD2 PRO A 132 10.373 1.264 -9.489 1.00 0.16 H new ATOM 0 HD3 PRO A 132 9.169 0.128 -8.914 1.00 0.16 H new ATOM 2070 N ILE A 133 13.197 2.296 -5.596 1.00 0.07 N ATOM 2071 CA ILE A 133 13.956 3.510 -5.233 1.00 0.08 C ATOM 2072 C ILE A 133 15.476 3.190 -5.049 1.00 0.08 C ATOM 2073 O ILE A 133 15.857 2.083 -4.656 1.00 0.10 O ATOM 2074 CB ILE A 133 13.346 4.156 -3.902 1.00 0.15 C ATOM 2075 CG1 ILE A 133 11.785 3.967 -3.835 1.00 0.23 C ATOM 2076 CG2 ILE A 133 13.690 5.675 -3.773 1.00 0.30 C ATOM 2077 CD1 ILE A 133 11.198 3.632 -2.454 1.00 0.38 C ATOM 0 H ILE A 133 13.210 1.579 -4.871 1.00 0.07 H new ATOM 0 HA ILE A 133 13.867 4.230 -6.046 1.00 0.08 H new ATOM 0 HB ILE A 133 13.807 3.627 -3.068 1.00 0.15 H new ATOM 0 HG12 ILE A 133 11.314 4.882 -4.194 1.00 0.23 H new ATOM 0 HG13 ILE A 133 11.507 3.172 -4.527 1.00 0.23 H new ATOM 0 HG21 ILE A 133 13.255 6.070 -2.855 1.00 0.30 H new ATOM 0 HG22 ILE A 133 14.772 5.802 -3.746 1.00 0.30 H new ATOM 0 HG23 ILE A 133 13.283 6.214 -4.628 1.00 0.30 H new ATOM 0 HD11 ILE A 133 10.116 3.526 -2.535 1.00 0.38 H new ATOM 0 HD12 ILE A 133 11.628 2.698 -2.093 1.00 0.38 H new ATOM 0 HD13 ILE A 133 11.433 4.434 -1.755 1.00 0.38 H new ATOM 2089 N SER A 134 16.325 4.190 -5.348 1.00 0.10 N ATOM 2090 CA SER A 134 17.774 4.053 -5.194 1.00 0.12 C ATOM 2091 C SER A 134 18.379 5.292 -4.497 1.00 0.13 C ATOM 2092 O SER A 134 18.306 6.421 -5.003 1.00 0.15 O ATOM 2093 CB SER A 134 18.435 3.791 -6.563 1.00 0.15 C ATOM 2094 OG SER A 134 19.721 3.190 -6.432 1.00 1.31 O ATOM 0 H SER A 134 16.026 5.100 -5.698 1.00 0.10 H new ATOM 0 HA SER A 134 17.975 3.194 -4.553 1.00 0.12 H new ATOM 0 HB2 SER A 134 17.791 3.143 -7.158 1.00 0.15 H new ATOM 0 HB3 SER A 134 18.529 4.732 -7.106 1.00 0.15 H new ATOM 0 HG SER A 134 20.104 3.039 -7.321 1.00 1.31 H new ATOM 2100 N ILE A 135 18.960 5.041 -3.308 1.00 0.13 N ATOM 2101 CA ILE A 135 19.629 6.069 -2.484 1.00 0.15 C ATOM 2102 C ILE A 135 21.150 5.711 -2.387 1.00 0.18 C ATOM 2103 O ILE A 135 21.514 4.589 -2.003 1.00 0.18 O ATOM 2104 CB ILE A 135 18.937 6.204 -1.038 1.00 0.16 C ATOM 2105 CG1 ILE A 135 17.398 6.376 -1.160 1.00 0.13 C ATOM 2106 CG2 ILE A 135 19.515 7.374 -0.163 1.00 0.25 C ATOM 2107 CD1 ILE A 135 16.571 5.471 -0.236 1.00 0.15 C ATOM 0 H ILE A 135 18.979 4.112 -2.888 1.00 0.13 H new ATOM 0 HA ILE A 135 19.526 7.047 -2.953 1.00 0.15 H new ATOM 0 HB ILE A 135 19.171 5.269 -0.528 1.00 0.16 H new ATOM 0 HG12 ILE A 135 17.145 7.415 -0.948 1.00 0.13 H new ATOM 0 HG13 ILE A 135 17.106 6.181 -2.192 1.00 0.13 H new ATOM 0 HG21 ILE A 135 18.998 7.401 0.796 1.00 0.25 H new ATOM 0 HG22 ILE A 135 20.580 7.212 0.003 1.00 0.25 H new ATOM 0 HG23 ILE A 135 19.368 8.322 -0.680 1.00 0.25 H new ATOM 0 HD11 ILE A 135 15.510 5.663 -0.393 1.00 0.15 H new ATOM 0 HD12 ILE A 135 16.788 4.427 -0.460 1.00 0.15 H new ATOM 0 HD13 ILE A 135 16.828 5.680 0.803 1.00 0.15 H new ATOM 2119 N LYS A 136 22.003 6.695 -2.748 1.00 0.20 N ATOM 2120 CA LYS A 136 23.472 6.541 -2.719 1.00 0.23 C ATOM 2121 C LYS A 136 24.148 7.818 -2.208 1.00 0.28 C ATOM 2122 O LYS A 136 23.886 8.922 -2.710 1.00 0.29 O ATOM 2123 CB LYS A 136 24.008 6.195 -4.122 1.00 0.22 C ATOM 2124 CG LYS A 136 23.786 4.721 -4.538 1.00 0.25 C ATOM 2125 CD LYS A 136 24.949 3.795 -4.102 1.00 0.94 C ATOM 2126 CE LYS A 136 24.598 2.305 -4.258 1.00 1.23 C ATOM 2127 NZ LYS A 136 23.560 1.882 -3.280 1.00 2.05 N ATOM 0 H LYS A 136 21.693 7.613 -3.066 1.00 0.20 H new ATOM 0 HA LYS A 136 23.707 5.725 -2.036 1.00 0.23 H new ATOM 0 HB2 LYS A 136 23.526 6.844 -4.853 1.00 0.22 H new ATOM 0 HB3 LYS A 136 25.075 6.414 -4.156 1.00 0.22 H new ATOM 0 HG2 LYS A 136 22.856 4.360 -4.099 1.00 0.25 H new ATOM 0 HG3 LYS A 136 23.670 4.667 -5.620 1.00 0.25 H new ATOM 0 HD2 LYS A 136 25.834 4.022 -4.697 1.00 0.94 H new ATOM 0 HD3 LYS A 136 25.203 3.999 -3.062 1.00 0.94 H new ATOM 0 HE2 LYS A 136 24.242 2.119 -5.271 1.00 1.23 H new ATOM 0 HE3 LYS A 136 25.496 1.703 -4.120 1.00 1.23 H new ATOM 0 HZ1 LYS A 136 23.505 0.844 -3.259 1.00 2.05 H new ATOM 0 HZ2 LYS A 136 23.810 2.234 -2.334 1.00 2.05 H new ATOM 0 HZ3 LYS A 136 22.638 2.272 -3.562 1.00 2.05 H new ATOM 2141 N LYS A 137 24.994 7.655 -1.142 1.00 0.33 N ATOM 2142 CA LYS A 137 25.765 8.769 -0.455 1.00 0.40 C ATOM 2143 C LYS A 137 24.870 9.809 0.303 1.00 0.39 C ATOM 2144 O LYS A 137 25.336 10.892 0.673 1.00 0.42 O ATOM 2145 CB LYS A 137 26.675 9.515 -1.459 1.00 0.44 C ATOM 2146 CG LYS A 137 27.753 8.626 -2.122 1.00 0.99 C ATOM 2147 CD LYS A 137 28.665 9.400 -3.110 1.00 1.59 C ATOM 2148 CE LYS A 137 27.891 10.058 -4.272 1.00 2.70 C ATOM 2149 NZ LYS A 137 27.432 11.432 -3.922 1.00 3.55 N ATOM 0 H LYS A 137 25.168 6.741 -0.724 1.00 0.33 H new ATOM 0 HA LYS A 137 26.365 8.264 0.302 1.00 0.40 H new ATOM 0 HB2 LYS A 137 26.053 9.954 -2.239 1.00 0.44 H new ATOM 0 HB3 LYS A 137 27.167 10.339 -0.943 1.00 0.44 H new ATOM 0 HG2 LYS A 137 28.371 8.176 -1.345 1.00 0.99 H new ATOM 0 HG3 LYS A 137 27.264 7.810 -2.653 1.00 0.99 H new ATOM 0 HD2 LYS A 137 29.209 10.170 -2.563 1.00 1.59 H new ATOM 0 HD3 LYS A 137 29.408 8.715 -3.520 1.00 1.59 H new ATOM 0 HE2 LYS A 137 28.528 10.101 -5.155 1.00 2.70 H new ATOM 0 HE3 LYS A 137 27.030 9.442 -4.530 1.00 2.70 H new ATOM 0 HZ1 LYS A 137 26.420 11.527 -4.143 1.00 3.55 H new ATOM 0 HZ2 LYS A 137 27.582 11.600 -2.907 1.00 3.55 H new ATOM 0 HZ3 LYS A 137 27.973 12.129 -4.472 1.00 3.55 H new ATOM 2163 N GLY A 138 23.592 9.438 0.531 1.00 0.35 N ATOM 2164 CA GLY A 138 22.610 10.302 1.186 1.00 0.36 C ATOM 2165 C GLY A 138 21.657 11.051 0.225 1.00 0.33 C ATOM 2166 O GLY A 138 21.061 12.052 0.629 1.00 0.37 O ATOM 0 H GLY A 138 23.220 8.527 0.262 1.00 0.35 H new ATOM 0 HA2 GLY A 138 22.013 9.697 1.868 1.00 0.36 H new ATOM 0 HA3 GLY A 138 23.141 11.036 1.793 1.00 0.36 H new ATOM 2170 N LYS A 139 21.513 10.577 -1.050 1.00 0.29 N ATOM 2171 CA LYS A 139 20.608 11.233 -2.019 1.00 0.29 C ATOM 2172 C LYS A 139 19.602 10.245 -2.646 1.00 0.26 C ATOM 2173 O LYS A 139 19.951 9.109 -2.975 1.00 0.25 O ATOM 2174 CB LYS A 139 21.398 11.959 -3.121 1.00 0.33 C ATOM 2175 CG LYS A 139 22.310 13.103 -2.612 1.00 0.65 C ATOM 2176 CD LYS A 139 23.259 13.669 -3.699 1.00 0.67 C ATOM 2177 CE LYS A 139 22.512 14.356 -4.862 1.00 1.00 C ATOM 2178 NZ LYS A 139 21.483 15.317 -4.376 1.00 1.56 N ATOM 0 H LYS A 139 22.004 9.761 -1.415 1.00 0.29 H new ATOM 0 HA LYS A 139 20.037 11.971 -1.455 1.00 0.29 H new ATOM 0 HB2 LYS A 139 22.012 11.230 -3.650 1.00 0.33 H new ATOM 0 HB3 LYS A 139 20.694 12.368 -3.845 1.00 0.33 H new ATOM 0 HG2 LYS A 139 21.686 13.911 -2.229 1.00 0.65 H new ATOM 0 HG3 LYS A 139 22.906 12.737 -1.776 1.00 0.65 H new ATOM 0 HD2 LYS A 139 23.940 14.385 -3.240 1.00 0.67 H new ATOM 0 HD3 LYS A 139 23.870 12.858 -4.097 1.00 0.67 H new ATOM 0 HE2 LYS A 139 23.229 14.881 -5.493 1.00 1.00 H new ATOM 0 HE3 LYS A 139 22.035 13.598 -5.484 1.00 1.00 H new ATOM 0 HZ1 LYS A 139 21.408 16.112 -5.043 1.00 1.56 H new ATOM 0 HZ2 LYS A 139 20.564 14.836 -4.306 1.00 1.56 H new ATOM 0 HZ3 LYS A 139 21.758 15.676 -3.439 1.00 1.56 H new ATOM 2192 N LEU A 140 18.363 10.730 -2.891 1.00 0.25 N ATOM 2193 CA LEU A 140 17.257 9.887 -3.407 1.00 0.24 C ATOM 2194 C LEU A 140 16.989 10.048 -4.917 1.00 0.26 C ATOM 2195 O LEU A 140 17.132 11.128 -5.488 1.00 0.34 O ATOM 2196 CB LEU A 140 15.961 10.242 -2.633 1.00 0.24 C ATOM 2197 CG LEU A 140 14.882 9.128 -2.463 1.00 0.22 C ATOM 2198 CD1 LEU A 140 14.393 9.034 -1.023 1.00 0.22 C ATOM 2199 CD2 LEU A 140 13.683 9.373 -3.365 1.00 0.25 C ATOM 0 H LEU A 140 18.102 11.704 -2.739 1.00 0.25 H new ATOM 0 HA LEU A 140 17.560 8.851 -3.255 1.00 0.24 H new ATOM 0 HB2 LEU A 140 16.249 10.583 -1.638 1.00 0.24 H new ATOM 0 HB3 LEU A 140 15.492 11.087 -3.137 1.00 0.24 H new ATOM 0 HG LEU A 140 15.364 8.191 -2.743 1.00 0.22 H new ATOM 0 HD11 LEU A 140 13.643 8.247 -0.944 1.00 0.22 H new ATOM 0 HD12 LEU A 140 15.233 8.801 -0.368 1.00 0.22 H new ATOM 0 HD13 LEU A 140 13.953 9.986 -0.725 1.00 0.22 H new ATOM 0 HD21 LEU A 140 12.951 8.578 -3.221 1.00 0.25 H new ATOM 0 HD22 LEU A 140 13.230 10.333 -3.116 1.00 0.25 H new ATOM 0 HD23 LEU A 140 14.007 9.384 -4.406 1.00 0.25 H new ATOM 2211 N SER A 141 16.581 8.932 -5.541 1.00 0.21 N ATOM 2212 CA SER A 141 16.232 8.907 -6.964 1.00 0.22 C ATOM 2213 C SER A 141 15.005 8.003 -7.207 1.00 0.19 C ATOM 2214 O SER A 141 15.045 6.788 -6.963 1.00 0.16 O ATOM 2215 CB SER A 141 17.443 8.450 -7.802 1.00 0.25 C ATOM 2216 OG SER A 141 17.293 8.762 -9.186 1.00 0.64 O ATOM 0 H SER A 141 16.485 8.030 -5.075 1.00 0.21 H new ATOM 0 HA SER A 141 15.966 9.916 -7.279 1.00 0.22 H new ATOM 0 HB2 SER A 141 18.346 8.926 -7.420 1.00 0.25 H new ATOM 0 HB3 SER A 141 17.576 7.374 -7.687 1.00 0.25 H new ATOM 0 HG SER A 141 18.084 8.456 -9.678 1.00 0.64 H new ATOM 2222 N VAL A 142 13.915 8.629 -7.700 1.00 0.21 N ATOM 2223 CA VAL A 142 12.656 7.926 -7.998 1.00 0.22 C ATOM 2224 C VAL A 142 12.416 7.866 -9.569 1.00 0.25 C ATOM 2225 O VAL A 142 12.008 8.852 -10.193 1.00 0.26 O ATOM 2226 CB VAL A 142 11.430 8.517 -7.087 1.00 0.27 C ATOM 2227 CG1 VAL A 142 10.724 9.814 -7.582 1.00 0.46 C ATOM 2228 CG2 VAL A 142 10.366 7.441 -6.805 1.00 0.41 C ATOM 0 H VAL A 142 13.886 9.629 -7.900 1.00 0.21 H new ATOM 0 HA VAL A 142 12.714 6.880 -7.698 1.00 0.22 H new ATOM 0 HB VAL A 142 11.951 8.816 -6.178 1.00 0.27 H new ATOM 0 HG11 VAL A 142 9.935 10.088 -6.882 1.00 0.46 H new ATOM 0 HG12 VAL A 142 11.452 10.623 -7.644 1.00 0.46 H new ATOM 0 HG13 VAL A 142 10.291 9.639 -8.567 1.00 0.46 H new ATOM 0 HG21 VAL A 142 9.568 7.869 -6.198 1.00 0.41 H new ATOM 0 HG22 VAL A 142 9.953 7.082 -7.748 1.00 0.41 H new ATOM 0 HG23 VAL A 142 10.823 6.609 -6.269 1.00 0.41 H new ATOM 2238 N GLN A 143 12.763 6.692 -10.183 1.00 0.31 N ATOM 2239 CA GLN A 143 12.625 6.404 -11.663 1.00 0.39 C ATOM 2240 C GLN A 143 13.616 7.219 -12.550 1.00 0.41 C ATOM 2241 O GLN A 143 14.669 6.709 -12.943 1.00 0.46 O ATOM 2242 CB GLN A 143 11.157 6.608 -12.159 1.00 0.44 C ATOM 2243 CG GLN A 143 10.246 5.356 -12.119 1.00 0.65 C ATOM 2244 CD GLN A 143 9.850 4.940 -10.711 1.00 0.87 C ATOM 2245 OE1 GLN A 143 8.831 5.385 -10.185 1.00 1.56 O ATOM 2246 NE2 GLN A 143 10.658 4.085 -10.095 1.00 1.12 N ATOM 0 H GLN A 143 13.152 5.905 -9.664 1.00 0.31 H new ATOM 0 HA GLN A 143 12.890 5.353 -11.777 1.00 0.39 H new ATOM 0 HB2 GLN A 143 10.695 7.388 -11.554 1.00 0.44 H new ATOM 0 HB3 GLN A 143 11.189 6.977 -13.184 1.00 0.44 H new ATOM 0 HG2 GLN A 143 9.344 5.554 -12.698 1.00 0.65 H new ATOM 0 HG3 GLN A 143 10.760 4.526 -12.604 1.00 0.65 H new ATOM 0 HE21 GLN A 143 11.493 3.741 -10.569 1.00 1.12 H new ATOM 0 HE22 GLN A 143 10.443 3.772 -9.148 1.00 1.12 H new ATOM 2255 N GLY A 144 13.247 8.480 -12.842 1.00 0.40 N ATOM 2256 CA GLY A 144 14.086 9.385 -13.629 1.00 0.45 C ATOM 2257 C GLY A 144 14.189 10.806 -13.037 1.00 0.42 C ATOM 2258 O GLY A 144 14.429 11.764 -13.779 1.00 0.49 O ATOM 0 H GLY A 144 12.365 8.892 -12.539 1.00 0.40 H new ATOM 0 HA2 GLY A 144 15.087 8.961 -13.709 1.00 0.45 H new ATOM 0 HA3 GLY A 144 13.685 9.450 -14.641 1.00 0.45 H new ATOM 2262 N GLU A 145 14.008 10.936 -11.698 1.00 0.33 N ATOM 2263 CA GLU A 145 14.090 12.230 -10.997 1.00 0.32 C ATOM 2264 C GLU A 145 15.027 12.125 -9.778 1.00 0.27 C ATOM 2265 O GLU A 145 14.764 11.362 -8.843 1.00 0.36 O ATOM 2266 CB GLU A 145 12.675 12.687 -10.556 1.00 0.37 C ATOM 2267 CG GLU A 145 12.483 14.211 -10.476 1.00 0.80 C ATOM 2268 CD GLU A 145 11.092 14.596 -10.009 1.00 1.16 C ATOM 2269 OE1 GLU A 145 10.118 14.305 -10.734 1.00 1.53 O ATOM 2270 OE2 GLU A 145 10.977 15.186 -8.914 1.00 1.82 O ATOM 0 H GLU A 145 13.803 10.149 -11.083 1.00 0.33 H new ATOM 0 HA GLU A 145 14.500 12.973 -11.681 1.00 0.32 H new ATOM 0 HB2 GLU A 145 11.943 12.279 -11.254 1.00 0.37 H new ATOM 0 HB3 GLU A 145 12.458 12.256 -9.579 1.00 0.37 H new ATOM 0 HG2 GLU A 145 13.222 14.632 -9.794 1.00 0.80 H new ATOM 0 HG3 GLU A 145 12.668 14.650 -11.457 1.00 0.80 H new ATOM 2277 N VAL A 146 16.118 12.918 -9.792 1.00 0.30 N ATOM 2278 CA VAL A 146 17.128 12.909 -8.698 1.00 0.27 C ATOM 2279 C VAL A 146 17.027 14.159 -7.781 1.00 0.28 C ATOM 2280 O VAL A 146 16.871 15.295 -8.244 1.00 0.32 O ATOM 2281 CB VAL A 146 18.659 12.770 -9.153 1.00 0.31 C ATOM 2282 CG1 VAL A 146 19.283 11.449 -8.690 1.00 1.02 C ATOM 2283 CG2 VAL A 146 18.954 12.959 -10.674 1.00 0.72 C ATOM 0 H VAL A 146 16.328 13.574 -10.545 1.00 0.30 H new ATOM 0 HA VAL A 146 16.862 11.999 -8.160 1.00 0.27 H new ATOM 0 HB VAL A 146 19.124 13.618 -8.650 1.00 0.31 H new ATOM 0 HG11 VAL A 146 20.320 11.401 -9.022 1.00 1.02 H new ATOM 0 HG12 VAL A 146 19.247 11.391 -7.602 1.00 1.02 H new ATOM 0 HG13 VAL A 146 18.726 10.614 -9.116 1.00 1.02 H new ATOM 0 HG21 VAL A 146 20.022 12.841 -10.855 1.00 0.72 H new ATOM 0 HG22 VAL A 146 18.405 12.212 -11.247 1.00 0.72 H new ATOM 0 HG23 VAL A 146 18.641 13.956 -10.984 1.00 0.72 H new ATOM 2293 N SER A 147 17.143 13.894 -6.472 1.00 0.27 N ATOM 2294 CA SER A 147 17.102 14.909 -5.421 1.00 0.29 C ATOM 2295 C SER A 147 17.888 14.391 -4.199 1.00 0.29 C ATOM 2296 O SER A 147 18.605 13.383 -4.283 1.00 0.30 O ATOM 2297 CB SER A 147 15.643 15.228 -5.035 1.00 0.31 C ATOM 2298 OG SER A 147 15.145 16.335 -5.770 1.00 0.56 O ATOM 0 H SER A 147 17.270 12.948 -6.112 1.00 0.27 H new ATOM 0 HA SER A 147 17.559 15.830 -5.783 1.00 0.29 H new ATOM 0 HB2 SER A 147 15.017 14.355 -5.219 1.00 0.31 H new ATOM 0 HB3 SER A 147 15.585 15.442 -3.968 1.00 0.31 H new ATOM 0 HG SER A 147 15.530 16.329 -6.671 1.00 0.56 H new ATOM 2304 N THR A 148 17.804 15.098 -3.071 1.00 0.30 N ATOM 2305 CA THR A 148 18.499 14.653 -1.847 1.00 0.31 C ATOM 2306 C THR A 148 17.535 13.988 -0.792 1.00 0.27 C ATOM 2307 O THR A 148 16.369 14.378 -0.651 1.00 0.32 O ATOM 2308 CB THR A 148 19.473 15.775 -1.244 1.00 0.44 C ATOM 2309 OG1 THR A 148 20.380 15.197 -0.289 1.00 1.25 O ATOM 2310 CG2 THR A 148 18.785 16.997 -0.583 1.00 0.99 C ATOM 0 H THR A 148 17.275 15.964 -2.972 1.00 0.30 H new ATOM 0 HA THR A 148 19.163 13.843 -2.149 1.00 0.31 H new ATOM 0 HB THR A 148 19.990 16.160 -2.123 1.00 0.44 H new ATOM 0 HG1 THR A 148 20.968 15.895 0.068 1.00 1.25 H new ATOM 0 HG21 THR A 148 19.544 17.686 -0.213 1.00 0.99 H new ATOM 0 HG22 THR A 148 18.161 17.505 -1.318 1.00 0.99 H new ATOM 0 HG23 THR A 148 18.165 16.660 0.248 1.00 0.99 H new ATOM 2318 N PHE A 149 18.072 12.985 -0.061 1.00 0.26 N ATOM 2319 CA PHE A 149 17.327 12.270 1.008 1.00 0.24 C ATOM 2320 C PHE A 149 17.508 12.951 2.378 1.00 0.24 C ATOM 2321 O PHE A 149 18.621 13.277 2.808 1.00 0.29 O ATOM 2322 CB PHE A 149 17.775 10.773 1.122 1.00 0.23 C ATOM 2323 CG PHE A 149 17.137 9.952 2.278 1.00 0.22 C ATOM 2324 CD1 PHE A 149 15.745 9.785 2.383 1.00 0.22 C ATOM 2325 CD2 PHE A 149 17.934 9.348 3.264 1.00 0.24 C ATOM 2326 CE1 PHE A 149 15.188 9.055 3.419 1.00 0.24 C ATOM 2327 CE2 PHE A 149 17.368 8.617 4.296 1.00 0.26 C ATOM 2328 CZ PHE A 149 15.996 8.472 4.373 1.00 0.25 C ATOM 0 H PHE A 149 19.026 12.648 -0.191 1.00 0.26 H new ATOM 0 HA PHE A 149 16.275 12.308 0.726 1.00 0.24 H new ATOM 0 HB2 PHE A 149 17.546 10.274 0.180 1.00 0.23 H new ATOM 0 HB3 PHE A 149 18.858 10.748 1.241 1.00 0.23 H new ATOM 0 HD1 PHE A 149 15.099 10.234 1.643 1.00 0.22 H new ATOM 0 HD2 PHE A 149 19.008 9.455 3.217 1.00 0.24 H new ATOM 0 HE1 PHE A 149 14.116 8.941 3.481 1.00 0.24 H new ATOM 0 HE2 PHE A 149 18.001 8.159 5.042 1.00 0.26 H new ATOM 0 HZ PHE A 149 15.557 7.903 5.179 1.00 0.25 H new ATOM 2338 N THR A 150 16.368 13.129 3.048 1.00 0.25 N ATOM 2339 CA THR A 150 16.297 13.705 4.413 1.00 0.30 C ATOM 2340 C THR A 150 16.202 12.539 5.450 1.00 0.40 C ATOM 2341 O THR A 150 16.544 11.402 5.121 1.00 1.15 O ATOM 2342 CB THR A 150 15.114 14.741 4.586 1.00 0.66 C ATOM 2343 OG1 THR A 150 13.910 14.294 3.930 1.00 1.42 O ATOM 2344 CG2 THR A 150 15.489 16.144 4.050 1.00 1.18 C ATOM 0 H THR A 150 15.456 12.879 2.665 1.00 0.25 H new ATOM 0 HA THR A 150 17.207 14.278 4.590 1.00 0.30 H new ATOM 0 HB THR A 150 14.931 14.810 5.658 1.00 0.66 H new ATOM 0 HG1 THR A 150 13.201 14.958 4.060 1.00 1.42 H new ATOM 0 HG21 THR A 150 14.648 16.823 4.189 1.00 1.18 H new ATOM 0 HG22 THR A 150 16.354 16.522 4.594 1.00 1.18 H new ATOM 0 HG23 THR A 150 15.729 16.076 2.989 1.00 1.18 H new ATOM 2352 N GLY A 151 15.791 12.785 6.704 1.00 0.32 N ATOM 2353 CA GLY A 151 15.695 11.672 7.684 1.00 0.18 C ATOM 2354 C GLY A 151 14.402 10.801 7.638 1.00 0.20 C ATOM 2355 O GLY A 151 14.214 9.948 8.510 1.00 0.42 O ATOM 0 H GLY A 151 15.528 13.703 7.061 1.00 0.32 H new ATOM 0 HA2 GLY A 151 16.552 11.015 7.536 1.00 0.18 H new ATOM 0 HA3 GLY A 151 15.785 12.093 8.685 1.00 0.18 H new ATOM 2359 N LYS A 152 13.526 11.015 6.620 1.00 0.16 N ATOM 2360 CA LYS A 152 12.284 10.241 6.454 1.00 0.13 C ATOM 2361 C LYS A 152 11.722 10.324 5.013 1.00 0.13 C ATOM 2362 O LYS A 152 11.930 11.297 4.277 1.00 0.16 O ATOM 2363 CB LYS A 152 11.231 10.673 7.550 1.00 0.22 C ATOM 2364 CG LYS A 152 9.715 10.481 7.215 1.00 0.41 C ATOM 2365 CD LYS A 152 8.947 11.816 6.985 1.00 0.56 C ATOM 2366 CE LYS A 152 9.422 12.600 5.753 1.00 0.69 C ATOM 2367 NZ LYS A 152 8.609 13.828 5.535 1.00 1.10 N ATOM 0 H LYS A 152 13.667 11.725 5.901 1.00 0.16 H new ATOM 0 HA LYS A 152 12.514 9.187 6.607 1.00 0.13 H new ATOM 0 HB2 LYS A 152 11.447 10.115 8.461 1.00 0.22 H new ATOM 0 HB3 LYS A 152 11.394 11.727 7.775 1.00 0.22 H new ATOM 0 HG2 LYS A 152 9.626 9.863 6.322 1.00 0.41 H new ATOM 0 HG3 LYS A 152 9.239 9.935 8.029 1.00 0.41 H new ATOM 0 HD2 LYS A 152 7.884 11.599 6.878 1.00 0.56 H new ATOM 0 HD3 LYS A 152 9.057 12.445 7.869 1.00 0.56 H new ATOM 0 HE2 LYS A 152 10.469 12.874 5.878 1.00 0.69 H new ATOM 0 HE3 LYS A 152 9.362 11.963 4.871 1.00 0.69 H new ATOM 0 HZ1 LYS A 152 8.959 14.331 4.695 1.00 1.10 H new ATOM 0 HZ2 LYS A 152 7.613 13.564 5.391 1.00 1.10 H new ATOM 0 HZ3 LYS A 152 8.686 14.448 6.367 1.00 1.10 H new ATOM 2381 N LEU A 153 10.990 9.254 4.653 1.00 0.12 N ATOM 2382 CA LEU A 153 10.286 9.110 3.351 1.00 0.13 C ATOM 2383 C LEU A 153 8.761 9.236 3.590 1.00 0.13 C ATOM 2384 O LEU A 153 8.246 8.675 4.563 1.00 0.18 O ATOM 2385 CB LEU A 153 10.633 7.736 2.724 1.00 0.15 C ATOM 2386 CG LEU A 153 10.893 7.662 1.185 1.00 0.34 C ATOM 2387 CD1 LEU A 153 11.801 6.484 0.838 1.00 0.43 C ATOM 2388 CD2 LEU A 153 9.593 7.539 0.382 1.00 0.67 C ATOM 0 H LEU A 153 10.865 8.447 5.264 1.00 0.12 H new ATOM 0 HA LEU A 153 10.603 9.892 2.661 1.00 0.13 H new ATOM 0 HB2 LEU A 153 11.521 7.356 3.229 1.00 0.15 H new ATOM 0 HB3 LEU A 153 9.818 7.051 2.956 1.00 0.15 H new ATOM 0 HG LEU A 153 11.382 8.598 0.913 1.00 0.34 H new ATOM 0 HD11 LEU A 153 11.965 6.456 -0.239 1.00 0.43 H new ATOM 0 HD12 LEU A 153 12.757 6.599 1.348 1.00 0.43 H new ATOM 0 HD13 LEU A 153 11.329 5.555 1.157 1.00 0.43 H new ATOM 0 HD21 LEU A 153 9.826 7.491 -0.682 1.00 0.67 H new ATOM 0 HD22 LEU A 153 9.066 6.632 0.679 1.00 0.67 H new ATOM 0 HD23 LEU A 153 8.962 8.406 0.577 1.00 0.67 H new ATOM 2400 N SER A 154 8.022 9.965 2.721 1.00 0.14 N ATOM 2401 CA SER A 154 6.578 10.141 2.972 1.00 0.16 C ATOM 2402 C SER A 154 5.643 9.576 1.884 1.00 0.19 C ATOM 2403 O SER A 154 5.937 9.577 0.699 1.00 0.36 O ATOM 2404 CB SER A 154 6.267 11.643 3.156 1.00 0.21 C ATOM 2405 OG SER A 154 5.086 11.868 3.923 1.00 0.24 O ATOM 0 H SER A 154 8.381 10.419 1.881 1.00 0.14 H new ATOM 0 HA SER A 154 6.375 9.562 3.873 1.00 0.16 H new ATOM 0 HB2 SER A 154 7.112 12.128 3.645 1.00 0.21 H new ATOM 0 HB3 SER A 154 6.155 12.110 2.177 1.00 0.21 H new ATOM 0 HG SER A 154 4.868 11.060 4.433 1.00 0.24 H new ATOM 2411 N VAL A 155 4.495 9.066 2.342 1.00 0.16 N ATOM 2412 CA VAL A 155 3.425 8.577 1.430 1.00 0.19 C ATOM 2413 C VAL A 155 2.182 9.441 1.722 1.00 0.25 C ATOM 2414 O VAL A 155 1.436 9.169 2.671 1.00 0.30 O ATOM 2415 CB VAL A 155 3.020 7.025 1.512 1.00 0.28 C ATOM 2416 CG1 VAL A 155 3.076 6.362 0.117 1.00 0.39 C ATOM 2417 CG2 VAL A 155 3.861 6.165 2.486 1.00 0.74 C ATOM 0 H VAL A 155 4.272 8.976 3.333 1.00 0.16 H new ATOM 0 HA VAL A 155 3.827 8.669 0.421 1.00 0.19 H new ATOM 0 HB VAL A 155 2.005 7.047 1.908 1.00 0.28 H new ATOM 0 HG11 VAL A 155 2.797 5.312 0.202 1.00 0.39 H new ATOM 0 HG12 VAL A 155 2.383 6.868 -0.555 1.00 0.39 H new ATOM 0 HG13 VAL A 155 4.088 6.438 -0.282 1.00 0.39 H new ATOM 0 HG21 VAL A 155 3.504 5.135 2.463 1.00 0.74 H new ATOM 0 HG22 VAL A 155 4.908 6.193 2.184 1.00 0.74 H new ATOM 0 HG23 VAL A 155 3.764 6.560 3.497 1.00 0.74 H new ATOM 2427 N GLU A 156 1.979 10.482 0.892 1.00 0.28 N ATOM 2428 CA GLU A 156 0.879 11.430 1.098 1.00 0.36 C ATOM 2429 C GLU A 156 -0.112 11.439 -0.059 1.00 0.34 C ATOM 2430 O GLU A 156 0.263 11.665 -1.218 1.00 0.38 O ATOM 2431 CB GLU A 156 1.454 12.847 1.299 1.00 0.53 C ATOM 2432 CG GLU A 156 0.759 13.686 2.382 1.00 0.73 C ATOM 2433 CD GLU A 156 1.260 15.118 2.414 1.00 1.26 C ATOM 2434 OE1 GLU A 156 2.268 15.380 3.103 1.00 1.66 O ATOM 2435 OE2 GLU A 156 0.645 15.978 1.747 1.00 1.67 O ATOM 0 H GLU A 156 2.561 10.683 0.079 1.00 0.28 H new ATOM 0 HA GLU A 156 0.334 11.109 1.986 1.00 0.36 H new ATOM 0 HB2 GLU A 156 2.511 12.761 1.551 1.00 0.53 H new ATOM 0 HB3 GLU A 156 1.395 13.384 0.352 1.00 0.53 H new ATOM 0 HG2 GLU A 156 -0.317 13.684 2.205 1.00 0.73 H new ATOM 0 HG3 GLU A 156 0.923 13.225 3.356 1.00 0.73 H new ATOM 2442 N PHE A 157 -1.390 11.205 0.272 1.00 0.35 N ATOM 2443 CA PHE A 157 -2.446 11.209 -0.741 1.00 0.40 C ATOM 2444 C PHE A 157 -3.497 12.297 -0.483 1.00 0.41 C ATOM 2445 O PHE A 157 -3.984 12.501 0.649 1.00 0.43 O ATOM 2446 CB PHE A 157 -3.114 9.821 -0.948 1.00 0.51 C ATOM 2447 CG PHE A 157 -2.928 8.791 0.167 1.00 0.60 C ATOM 2448 CD1 PHE A 157 -1.797 7.981 0.216 1.00 0.99 C ATOM 2449 CD2 PHE A 157 -3.869 8.671 1.193 1.00 1.03 C ATOM 2450 CE1 PHE A 157 -1.613 7.080 1.251 1.00 1.55 C ATOM 2451 CE2 PHE A 157 -3.678 7.776 2.229 1.00 1.60 C ATOM 2452 CZ PHE A 157 -2.629 6.843 2.142 1.00 1.80 C ATOM 0 H PHE A 157 -1.711 11.013 1.221 1.00 0.35 H new ATOM 0 HA PHE A 157 -1.940 11.449 -1.676 1.00 0.40 H new ATOM 0 HB2 PHE A 157 -4.183 9.977 -1.091 1.00 0.51 H new ATOM 0 HB3 PHE A 157 -2.728 9.393 -1.873 1.00 0.51 H new ATOM 0 HD1 PHE A 157 -1.053 8.056 -0.564 1.00 0.99 H new ATOM 0 HD2 PHE A 157 -4.757 9.285 1.176 1.00 1.03 H new ATOM 0 HE1 PHE A 157 -0.670 6.564 1.357 1.00 1.55 H new ATOM 0 HE2 PHE A 157 -4.325 7.793 3.093 1.00 1.60 H new ATOM 0 HZ PHE A 157 -2.623 5.959 2.763 1.00 1.80 H new ATOM 2462 N VAL A 158 -3.823 12.982 -1.597 1.00 0.43 N ATOM 2463 CA VAL A 158 -4.785 14.131 -1.629 1.00 0.46 C ATOM 2464 C VAL A 158 -6.130 13.697 -2.311 1.00 0.48 C ATOM 2465 O VAL A 158 -6.144 12.913 -3.273 1.00 0.47 O ATOM 2466 CB VAL A 158 -4.209 15.460 -2.362 1.00 0.50 C ATOM 2467 CG1 VAL A 158 -4.815 16.770 -1.788 1.00 0.58 C ATOM 2468 CG2 VAL A 158 -2.666 15.625 -2.307 1.00 0.58 C ATOM 0 H VAL A 158 -3.430 12.762 -2.512 1.00 0.43 H new ATOM 0 HA VAL A 158 -4.953 14.402 -0.587 1.00 0.46 H new ATOM 0 HB VAL A 158 -4.510 15.302 -3.398 1.00 0.50 H new ATOM 0 HG11 VAL A 158 -4.395 17.627 -2.315 1.00 0.58 H new ATOM 0 HG12 VAL A 158 -5.897 16.758 -1.919 1.00 0.58 H new ATOM 0 HG13 VAL A 158 -4.579 16.845 -0.726 1.00 0.58 H new ATOM 0 HG21 VAL A 158 -2.379 16.541 -2.823 1.00 0.58 H new ATOM 0 HG22 VAL A 158 -2.343 15.678 -1.267 1.00 0.58 H new ATOM 0 HG23 VAL A 158 -2.191 14.772 -2.792 1.00 0.58 H new ATOM 2478 N LYS A 159 -7.251 14.256 -1.793 1.00 0.52 N ATOM 2479 CA LYS A 159 -8.620 13.963 -2.285 1.00 0.56 C ATOM 2480 C LYS A 159 -9.122 14.956 -3.370 1.00 0.66 C ATOM 2481 O LYS A 159 -8.751 16.138 -3.385 1.00 0.81 O ATOM 2482 CB LYS A 159 -9.630 13.939 -1.102 1.00 0.72 C ATOM 2483 CG LYS A 159 -9.823 15.300 -0.382 1.00 1.06 C ATOM 2484 CD LYS A 159 -11.008 15.287 0.614 1.00 1.48 C ATOM 2485 CE LYS A 159 -11.264 16.669 1.240 1.00 1.63 C ATOM 2486 NZ LYS A 159 -12.394 16.633 2.209 1.00 2.18 N ATOM 0 H LYS A 159 -7.231 14.923 -1.022 1.00 0.52 H new ATOM 0 HA LYS A 159 -8.561 12.982 -2.756 1.00 0.56 H new ATOM 0 HB2 LYS A 159 -10.597 13.601 -1.475 1.00 0.72 H new ATOM 0 HB3 LYS A 159 -9.295 13.202 -0.372 1.00 0.72 H new ATOM 0 HG2 LYS A 159 -8.908 15.557 0.152 1.00 1.06 H new ATOM 0 HG3 LYS A 159 -9.988 16.080 -1.126 1.00 1.06 H new ATOM 0 HD2 LYS A 159 -11.908 14.952 0.099 1.00 1.48 H new ATOM 0 HD3 LYS A 159 -10.806 14.565 1.405 1.00 1.48 H new ATOM 0 HE2 LYS A 159 -10.362 17.012 1.746 1.00 1.63 H new ATOM 0 HE3 LYS A 159 -11.482 17.391 0.453 1.00 1.63 H new ATOM 0 HZ1 LYS A 159 -12.537 17.582 2.611 1.00 2.18 H new ATOM 0 HZ2 LYS A 159 -13.261 16.329 1.721 1.00 2.18 H new ATOM 0 HZ3 LYS A 159 -12.175 15.963 2.974 1.00 2.18 H new ATOM 2500 N GLY A 160 -9.990 14.440 -4.260 1.00 0.74 N ATOM 2501 CA GLY A 160 -10.575 15.243 -5.350 1.00 0.93 C ATOM 2502 C GLY A 160 -11.991 15.793 -5.066 1.00 0.96 C ATOM 2503 O GLY A 160 -12.310 16.907 -5.489 1.00 1.02 O ATOM 0 H GLY A 160 -10.302 13.469 -4.245 1.00 0.74 H new ATOM 0 HA2 GLY A 160 -9.911 16.081 -5.561 1.00 0.93 H new ATOM 0 HA3 GLY A 160 -10.613 14.632 -6.252 1.00 0.93 H new ATOM 2507 N TYR A 161 -12.835 15.008 -4.355 1.00 0.96 N ATOM 2508 CA TYR A 161 -14.212 15.431 -4.015 1.00 1.02 C ATOM 2509 C TYR A 161 -14.507 15.307 -2.496 1.00 1.05 C ATOM 2510 O TYR A 161 -14.440 16.304 -1.773 1.00 1.11 O ATOM 2511 CB TYR A 161 -15.243 14.628 -4.840 1.00 1.14 C ATOM 2512 CG TYR A 161 -15.324 15.039 -6.318 1.00 1.34 C ATOM 2513 CD1 TYR A 161 -16.135 16.102 -6.727 1.00 1.81 C ATOM 2514 CD2 TYR A 161 -14.585 14.372 -7.304 1.00 1.63 C ATOM 2515 CE1 TYR A 161 -16.208 16.480 -8.059 1.00 2.26 C ATOM 2516 CE2 TYR A 161 -14.659 14.752 -8.635 1.00 2.07 C ATOM 2517 CZ TYR A 161 -15.470 15.803 -9.003 1.00 2.29 C ATOM 2518 OH TYR A 161 -15.542 16.179 -10.324 1.00 2.86 O ATOM 0 H TYR A 161 -12.586 14.082 -4.007 1.00 0.96 H new ATOM 0 HA TYR A 161 -14.299 16.487 -4.271 1.00 1.02 H new ATOM 0 HB2 TYR A 161 -14.992 13.569 -4.782 1.00 1.14 H new ATOM 0 HB3 TYR A 161 -16.227 14.748 -4.387 1.00 1.14 H new ATOM 0 HD1 TYR A 161 -16.716 16.639 -5.991 1.00 1.81 H new ATOM 0 HD2 TYR A 161 -13.947 13.548 -7.022 1.00 1.63 H new ATOM 0 HE1 TYR A 161 -16.842 17.303 -8.355 1.00 2.26 H new ATOM 0 HE2 TYR A 161 -14.083 14.226 -9.381 1.00 2.07 H new ATOM 0 HH TYR A 161 -14.960 15.601 -10.861 1.00 2.86 H new ATOM 2528 N TYR A 162 -14.830 14.081 -2.026 1.00 1.09 N ATOM 2529 CA TYR A 162 -15.134 13.816 -0.596 1.00 1.17 C ATOM 2530 C TYR A 162 -14.291 12.646 -0.036 1.00 1.10 C ATOM 2531 O TYR A 162 -13.648 12.782 1.007 1.00 1.71 O ATOM 2532 CB TYR A 162 -16.633 13.508 -0.408 1.00 1.54 C ATOM 2533 CG TYR A 162 -17.547 14.739 -0.498 1.00 1.88 C ATOM 2534 CD1 TYR A 162 -17.738 15.594 0.596 1.00 2.00 C ATOM 2535 CD2 TYR A 162 -18.223 15.046 -1.685 1.00 2.57 C ATOM 2536 CE1 TYR A 162 -18.566 16.702 0.503 1.00 2.64 C ATOM 2537 CE2 TYR A 162 -19.049 16.155 -1.774 1.00 3.18 C ATOM 2538 CZ TYR A 162 -19.209 16.982 -0.642 1.00 3.16 C ATOM 2539 OH TYR A 162 -20.035 18.076 -0.772 1.00 3.91 O ATOM 0 H TYR A 162 -14.888 13.253 -2.618 1.00 1.09 H new ATOM 0 HA TYR A 162 -14.876 14.718 -0.041 1.00 1.17 H new ATOM 0 HB2 TYR A 162 -16.941 12.785 -1.164 1.00 1.54 H new ATOM 0 HB3 TYR A 162 -16.776 13.034 0.563 1.00 1.54 H new ATOM 0 HD1 TYR A 162 -17.232 15.386 1.527 1.00 2.00 H new ATOM 0 HD2 TYR A 162 -18.098 14.407 -2.547 1.00 2.57 H new ATOM 0 HE1 TYR A 162 -18.695 17.346 1.360 1.00 2.64 H new ATOM 0 HE2 TYR A 162 -19.563 16.383 -2.696 1.00 3.18 H new ATOM 0 HH TYR A 162 -20.404 18.101 -1.680 1.00 3.91 H new ATOM 2549 N ASP A 163 -14.300 11.499 -0.763 1.00 1.04 N ATOM 2550 CA ASP A 163 -13.535 10.265 -0.417 1.00 0.99 C ATOM 2551 C ASP A 163 -12.097 10.306 -0.955 1.00 1.06 C ATOM 2552 O ASP A 163 -11.790 10.946 -1.966 1.00 1.74 O ATOM 2553 CB ASP A 163 -14.252 9.034 -1.002 1.00 1.11 C ATOM 2554 CG ASP A 163 -15.210 8.375 -0.016 1.00 1.19 C ATOM 2555 OD1 ASP A 163 -14.764 7.488 0.742 1.00 1.27 O ATOM 2556 OD2 ASP A 163 -16.404 8.747 -0.006 1.00 1.34 O ATOM 0 H ASP A 163 -14.846 11.401 -1.619 1.00 1.04 H new ATOM 0 HA ASP A 163 -13.488 10.204 0.670 1.00 0.99 H new ATOM 0 HB2 ASP A 163 -14.805 9.332 -1.893 1.00 1.11 H new ATOM 0 HB3 ASP A 163 -13.507 8.304 -1.319 1.00 1.11 H new ATOM 2561 N ASN A 164 -11.238 9.629 -0.210 1.00 0.83 N ATOM 2562 CA ASN A 164 -9.809 9.474 -0.515 1.00 0.83 C ATOM 2563 C ASN A 164 -9.545 7.977 -0.871 1.00 1.01 C ATOM 2564 O ASN A 164 -10.519 7.234 -1.077 1.00 1.68 O ATOM 2565 CB ASN A 164 -9.039 9.908 0.749 1.00 1.02 C ATOM 2566 CG ASN A 164 -8.102 11.093 0.537 1.00 0.88 C ATOM 2567 OD1 ASN A 164 -7.522 11.265 -0.534 1.00 1.57 O ATOM 2568 ND2 ASN A 164 -7.954 11.918 1.571 1.00 0.82 N ATOM 0 H ASN A 164 -11.515 9.156 0.650 1.00 0.83 H new ATOM 0 HA ASN A 164 -9.487 10.080 -1.362 1.00 0.83 H new ATOM 0 HB2 ASN A 164 -9.757 10.163 1.528 1.00 1.02 H new ATOM 0 HB3 ASN A 164 -8.458 9.061 1.115 1.00 1.02 H new ATOM 0 HD21 ASN A 164 -7.341 12.729 1.492 1.00 0.82 H new ATOM 0 HD22 ASN A 164 -8.454 11.739 2.442 1.00 0.82 H new ATOM 2575 N PRO A 165 -8.258 7.479 -1.033 1.00 0.87 N ATOM 2576 CA PRO A 165 -7.988 6.014 -1.261 1.00 1.06 C ATOM 2577 C PRO A 165 -8.387 5.161 -0.026 1.00 0.93 C ATOM 2578 O PRO A 165 -7.647 5.055 0.957 1.00 1.76 O ATOM 2579 CB PRO A 165 -6.469 5.965 -1.507 1.00 1.45 C ATOM 2580 CG PRO A 165 -6.134 7.346 -1.984 1.00 2.06 C ATOM 2581 CD PRO A 165 -7.006 8.260 -1.149 1.00 1.41 C ATOM 0 HA PRO A 165 -8.567 5.603 -2.088 1.00 1.06 H new ATOM 0 HB2 PRO A 165 -5.925 5.714 -0.596 1.00 1.45 H new ATOM 0 HB3 PRO A 165 -6.209 5.212 -2.251 1.00 1.45 H new ATOM 0 HG2 PRO A 165 -5.076 7.569 -1.842 1.00 2.06 H new ATOM 0 HG3 PRO A 165 -6.344 7.460 -3.047 1.00 2.06 H new ATOM 0 HD2 PRO A 165 -6.563 8.466 -0.175 1.00 1.41 H new ATOM 0 HD3 PRO A 165 -7.170 9.222 -1.635 1.00 1.41 H new ATOM 2589 N LYS A 166 -9.625 4.602 -0.133 1.00 0.54 N ATOM 2590 CA LYS A 166 -10.357 3.826 0.913 1.00 0.47 C ATOM 2591 C LYS A 166 -9.574 2.643 1.589 1.00 0.42 C ATOM 2592 O LYS A 166 -9.433 2.641 2.815 1.00 0.47 O ATOM 2593 CB LYS A 166 -11.681 3.354 0.280 1.00 0.82 C ATOM 2594 CG LYS A 166 -12.763 2.884 1.278 1.00 1.30 C ATOM 2595 CD LYS A 166 -14.026 2.310 0.584 1.00 1.83 C ATOM 2596 CE LYS A 166 -14.714 3.318 -0.362 1.00 2.33 C ATOM 2597 NZ LYS A 166 -14.034 3.400 -1.685 1.00 3.00 N ATOM 0 H LYS A 166 -10.168 4.684 -0.993 1.00 0.54 H new ATOM 0 HA LYS A 166 -10.518 4.496 1.758 1.00 0.47 H new ATOM 0 HB2 LYS A 166 -12.090 4.170 -0.316 1.00 0.82 H new ATOM 0 HB3 LYS A 166 -11.464 2.536 -0.407 1.00 0.82 H new ATOM 0 HG2 LYS A 166 -12.338 2.123 1.933 1.00 1.30 H new ATOM 0 HG3 LYS A 166 -13.053 3.723 1.911 1.00 1.30 H new ATOM 0 HD2 LYS A 166 -13.748 1.421 0.017 1.00 1.83 H new ATOM 0 HD3 LYS A 166 -14.738 1.993 1.346 1.00 1.83 H new ATOM 0 HE2 LYS A 166 -15.754 3.026 -0.507 1.00 2.33 H new ATOM 0 HE3 LYS A 166 -14.721 4.304 0.103 1.00 2.33 H new ATOM 0 HZ1 LYS A 166 -13.643 4.355 -1.816 1.00 3.00 H new ATOM 0 HZ2 LYS A 166 -13.264 2.702 -1.723 1.00 3.00 H new ATOM 0 HZ3 LYS A 166 -14.720 3.201 -2.441 1.00 3.00 H new ATOM 2611 N VAL A 167 -9.072 1.648 0.802 1.00 0.39 N ATOM 2612 CA VAL A 167 -8.260 0.528 1.391 1.00 0.38 C ATOM 2613 C VAL A 167 -6.766 0.729 1.001 1.00 0.34 C ATOM 2614 O VAL A 167 -6.443 0.845 -0.196 1.00 0.33 O ATOM 2615 CB VAL A 167 -8.775 -0.935 0.939 1.00 0.45 C ATOM 2616 CG1 VAL A 167 -7.966 -2.119 1.550 1.00 0.80 C ATOM 2617 CG2 VAL A 167 -10.255 -1.182 1.298 1.00 0.58 C ATOM 0 H VAL A 167 -9.205 1.592 -0.208 1.00 0.39 H new ATOM 0 HA VAL A 167 -8.378 0.565 2.474 1.00 0.38 H new ATOM 0 HB VAL A 167 -8.630 -0.918 -0.141 1.00 0.45 H new ATOM 0 HG11 VAL A 167 -8.378 -3.063 1.195 1.00 0.80 H new ATOM 0 HG12 VAL A 167 -6.922 -2.042 1.246 1.00 0.80 H new ATOM 0 HG13 VAL A 167 -8.031 -2.081 2.637 1.00 0.80 H new ATOM 0 HG21 VAL A 167 -10.547 -2.180 0.971 1.00 0.58 H new ATOM 0 HG22 VAL A 167 -10.386 -1.101 2.377 1.00 0.58 H new ATOM 0 HG23 VAL A 167 -10.879 -0.440 0.800 1.00 0.58 H new ATOM 2627 N CYS A 168 -5.875 0.624 2.022 1.00 0.35 N ATOM 2628 CA CYS A 168 -4.429 0.805 1.791 1.00 0.35 C ATOM 2629 C CYS A 168 -3.590 -0.309 2.453 1.00 0.36 C ATOM 2630 O CYS A 168 -3.681 -0.536 3.650 1.00 0.48 O ATOM 2631 CB CYS A 168 -4.019 2.172 2.321 1.00 0.37 C ATOM 2632 SG CYS A 168 -2.477 2.815 1.632 1.00 0.87 S ATOM 0 H CYS A 168 -6.130 0.420 2.988 1.00 0.35 H new ATOM 0 HA CYS A 168 -4.237 0.743 0.720 1.00 0.35 H new ATOM 0 HB2 CYS A 168 -4.819 2.883 2.113 1.00 0.37 H new ATOM 0 HB3 CYS A 168 -3.920 2.112 3.405 1.00 0.37 H new ATOM 0 HG CYS A 168 -2.660 3.139 0.386 1.00 0.87 H new ATOM 2638 N ALA A 169 -2.746 -0.985 1.637 1.00 0.29 N ATOM 2639 CA ALA A 169 -1.896 -2.138 2.072 1.00 0.29 C ATOM 2640 C ALA A 169 -0.350 -1.963 1.900 1.00 0.25 C ATOM 2641 O ALA A 169 0.321 -2.754 1.197 1.00 0.26 O ATOM 2642 CB ALA A 169 -2.415 -3.502 1.576 1.00 0.34 C ATOM 0 H ALA A 169 -2.629 -0.750 0.651 1.00 0.29 H new ATOM 0 HA ALA A 169 -2.021 -2.134 3.155 1.00 0.29 H new ATOM 0 HB1 ALA A 169 -1.752 -4.293 1.927 1.00 0.34 H new ATOM 0 HB2 ALA A 169 -3.420 -3.672 1.963 1.00 0.34 H new ATOM 0 HB3 ALA A 169 -2.441 -3.507 0.486 1.00 0.34 H new ATOM 2648 N LEU A 170 0.180 -0.792 2.368 1.00 0.22 N ATOM 2649 CA LEU A 170 1.647 -0.414 2.367 1.00 0.21 C ATOM 2650 C LEU A 170 2.648 -1.538 2.768 1.00 0.19 C ATOM 2651 O LEU A 170 2.436 -2.267 3.742 1.00 0.34 O ATOM 2652 CB LEU A 170 1.868 0.733 3.374 1.00 0.31 C ATOM 2653 CG LEU A 170 2.325 2.132 2.836 1.00 0.38 C ATOM 2654 CD1 LEU A 170 3.596 2.056 1.975 1.00 0.50 C ATOM 2655 CD2 LEU A 170 1.207 2.825 2.048 1.00 0.70 C ATOM 0 H LEU A 170 -0.408 -0.061 2.768 1.00 0.22 H new ATOM 0 HA LEU A 170 1.855 -0.155 1.329 1.00 0.21 H new ATOM 0 HB2 LEU A 170 0.935 0.878 3.919 1.00 0.31 H new ATOM 0 HB3 LEU A 170 2.612 0.399 4.097 1.00 0.31 H new ATOM 0 HG LEU A 170 2.560 2.725 3.720 1.00 0.38 H new ATOM 0 HD11 LEU A 170 3.863 3.055 1.631 1.00 0.50 H new ATOM 0 HD12 LEU A 170 4.413 1.646 2.568 1.00 0.50 H new ATOM 0 HD13 LEU A 170 3.414 1.413 1.114 1.00 0.50 H new ATOM 0 HD21 LEU A 170 1.560 3.792 1.690 1.00 0.70 H new ATOM 0 HD22 LEU A 170 0.923 2.205 1.198 1.00 0.70 H new ATOM 0 HD23 LEU A 170 0.342 2.971 2.695 1.00 0.70 H new ATOM 2667 N PHE A 171 3.721 -1.655 1.985 1.00 0.16 N ATOM 2668 CA PHE A 171 4.751 -2.665 2.213 1.00 0.14 C ATOM 2669 C PHE A 171 6.128 -2.172 1.703 1.00 0.14 C ATOM 2670 O PHE A 171 6.380 -2.190 0.494 1.00 0.19 O ATOM 2671 CB PHE A 171 4.310 -3.977 1.484 1.00 0.17 C ATOM 2672 CG PHE A 171 5.341 -5.108 1.371 1.00 0.16 C ATOM 2673 CD1 PHE A 171 6.300 -5.324 2.360 1.00 0.15 C ATOM 2674 CD2 PHE A 171 5.342 -5.957 0.260 1.00 0.20 C ATOM 2675 CE1 PHE A 171 7.219 -6.337 2.242 1.00 0.15 C ATOM 2676 CE2 PHE A 171 6.266 -6.976 0.147 1.00 0.21 C ATOM 2677 CZ PHE A 171 7.205 -7.163 1.142 1.00 0.17 C ATOM 0 H PHE A 171 3.899 -1.055 1.179 1.00 0.16 H new ATOM 0 HA PHE A 171 4.861 -2.857 3.280 1.00 0.14 H new ATOM 0 HB2 PHE A 171 3.435 -4.371 2.001 1.00 0.17 H new ATOM 0 HB3 PHE A 171 3.992 -3.711 0.476 1.00 0.17 H new ATOM 0 HD1 PHE A 171 6.320 -4.686 3.231 1.00 0.15 H new ATOM 0 HD2 PHE A 171 4.610 -5.813 -0.521 1.00 0.20 H new ATOM 0 HE1 PHE A 171 7.957 -6.486 3.017 1.00 0.15 H new ATOM 0 HE2 PHE A 171 6.255 -7.625 -0.716 1.00 0.21 H new ATOM 0 HZ PHE A 171 7.930 -7.959 1.056 1.00 0.17 H new ATOM 2687 N ILE A 172 7.023 -1.731 2.623 1.00 0.10 N ATOM 2688 CA ILE A 172 8.381 -1.332 2.204 1.00 0.10 C ATOM 2689 C ILE A 172 9.474 -2.325 2.771 1.00 0.08 C ATOM 2690 O ILE A 172 9.620 -2.533 4.011 1.00 0.08 O ATOM 2691 CB ILE A 172 8.767 0.227 2.402 1.00 0.13 C ATOM 2692 CG1 ILE A 172 10.007 0.563 1.427 1.00 0.14 C ATOM 2693 CG2 ILE A 172 8.983 0.644 3.902 1.00 0.22 C ATOM 2694 CD1 ILE A 172 10.613 1.992 1.428 1.00 0.31 C ATOM 0 H ILE A 172 6.835 -1.646 3.622 1.00 0.10 H new ATOM 0 HA ILE A 172 8.367 -1.425 1.118 1.00 0.10 H new ATOM 0 HB ILE A 172 7.919 0.849 2.113 1.00 0.13 H new ATOM 0 HG12 ILE A 172 10.810 -0.133 1.668 1.00 0.14 H new ATOM 0 HG13 ILE A 172 9.690 0.343 0.408 1.00 0.14 H new ATOM 0 HG21 ILE A 172 9.239 1.702 3.952 1.00 0.22 H new ATOM 0 HG22 ILE A 172 8.067 0.465 4.465 1.00 0.22 H new ATOM 0 HG23 ILE A 172 9.793 0.054 4.330 1.00 0.22 H new ATOM 0 HD11 ILE A 172 11.436 2.039 0.715 1.00 0.31 H new ATOM 0 HD12 ILE A 172 9.846 2.713 1.145 1.00 0.31 H new ATOM 0 HD13 ILE A 172 10.984 2.229 2.425 1.00 0.31 H new ATOM 2706 N MET A 173 10.220 -2.908 1.830 1.00 0.09 N ATOM 2707 CA MET A 173 11.310 -3.849 2.130 1.00 0.11 C ATOM 2708 C MET A 173 12.637 -3.366 1.486 1.00 0.13 C ATOM 2709 O MET A 173 12.624 -2.489 0.608 1.00 0.21 O ATOM 2710 CB MET A 173 10.922 -5.290 1.701 1.00 0.15 C ATOM 2711 CG MET A 173 10.312 -5.409 0.284 1.00 0.17 C ATOM 2712 SD MET A 173 11.533 -5.328 -1.046 1.00 0.44 S ATOM 2713 CE MET A 173 12.555 -6.757 -0.698 1.00 0.26 C ATOM 0 H MET A 173 10.087 -2.742 0.832 1.00 0.09 H new ATOM 0 HA MET A 173 11.474 -3.877 3.207 1.00 0.11 H new ATOM 0 HB2 MET A 173 11.810 -5.920 1.752 1.00 0.15 H new ATOM 0 HB3 MET A 173 10.208 -5.688 2.422 1.00 0.15 H new ATOM 0 HG2 MET A 173 9.770 -6.352 0.210 1.00 0.17 H new ATOM 0 HG3 MET A 173 9.583 -4.611 0.144 1.00 0.17 H new ATOM 0 HE1 MET A 173 13.051 -7.081 -1.613 1.00 0.26 H new ATOM 0 HE2 MET A 173 13.306 -6.495 0.048 1.00 0.26 H new ATOM 0 HE3 MET A 173 11.932 -7.566 -0.317 1.00 0.26 H new ATOM 2723 N LYS A 174 13.786 -3.936 1.897 1.00 0.12 N ATOM 2724 CA LYS A 174 15.068 -3.423 1.387 1.00 0.19 C ATOM 2725 C LYS A 174 16.023 -4.395 0.644 1.00 0.16 C ATOM 2726 O LYS A 174 15.986 -5.623 0.758 1.00 0.17 O ATOM 2727 CB LYS A 174 15.837 -2.720 2.550 1.00 0.38 C ATOM 2728 CG LYS A 174 16.610 -3.675 3.497 1.00 0.54 C ATOM 2729 CD LYS A 174 17.271 -2.958 4.706 1.00 0.57 C ATOM 2730 CE LYS A 174 18.591 -2.249 4.341 1.00 0.49 C ATOM 2731 NZ LYS A 174 19.610 -3.203 3.817 1.00 1.26 N ATOM 0 H LYS A 174 13.854 -4.716 2.551 1.00 0.12 H new ATOM 0 HA LYS A 174 14.761 -2.743 0.593 1.00 0.19 H new ATOM 0 HB2 LYS A 174 16.543 -2.009 2.121 1.00 0.38 H new ATOM 0 HB3 LYS A 174 15.124 -2.145 3.141 1.00 0.38 H new ATOM 0 HG2 LYS A 174 15.925 -4.437 3.868 1.00 0.54 H new ATOM 0 HG3 LYS A 174 17.382 -4.192 2.926 1.00 0.54 H new ATOM 0 HD2 LYS A 174 16.573 -2.226 5.113 1.00 0.57 H new ATOM 0 HD3 LYS A 174 17.463 -3.687 5.493 1.00 0.57 H new ATOM 0 HE2 LYS A 174 18.395 -1.481 3.593 1.00 0.49 H new ATOM 0 HE3 LYS A 174 18.987 -1.743 5.222 1.00 0.49 H new ATOM 0 HZ1 LYS A 174 20.557 -2.781 3.902 1.00 1.26 H new ATOM 0 HZ2 LYS A 174 19.574 -4.086 4.366 1.00 1.26 H new ATOM 0 HZ3 LYS A 174 19.411 -3.409 2.817 1.00 1.26 H new ATOM 2745 N GLY A 175 16.875 -3.703 -0.115 1.00 0.14 N ATOM 2746 CA GLY A 175 18.014 -4.224 -0.877 1.00 0.15 C ATOM 2747 C GLY A 175 17.888 -4.363 -2.406 1.00 0.13 C ATOM 2748 O GLY A 175 18.786 -3.839 -3.078 1.00 0.17 O ATOM 0 H GLY A 175 16.781 -2.693 -0.221 1.00 0.14 H new ATOM 0 HA2 GLY A 175 18.869 -3.578 -0.674 1.00 0.15 H new ATOM 0 HA3 GLY A 175 18.256 -5.208 -0.476 1.00 0.15 H new ATOM 2752 N THR A 176 16.723 -4.841 -2.965 1.00 0.11 N ATOM 2753 CA THR A 176 16.543 -5.025 -4.459 1.00 0.10 C ATOM 2754 C THR A 176 15.125 -5.513 -4.842 1.00 0.10 C ATOM 2755 O THR A 176 14.432 -6.168 -4.054 1.00 0.13 O ATOM 2756 CB THR A 176 17.539 -6.054 -5.145 1.00 0.12 C ATOM 2757 OG1 THR A 176 18.079 -7.013 -4.212 1.00 0.15 O ATOM 2758 CG2 THR A 176 18.698 -5.374 -5.912 1.00 0.15 C ATOM 0 H THR A 176 15.904 -5.103 -2.416 1.00 0.11 H new ATOM 0 HA THR A 176 16.746 -4.019 -4.825 1.00 0.10 H new ATOM 0 HB THR A 176 16.921 -6.581 -5.872 1.00 0.12 H new ATOM 0 HG1 THR A 176 17.628 -7.875 -4.331 1.00 0.15 H new ATOM 0 HG21 THR A 176 19.338 -6.137 -6.355 1.00 0.15 H new ATOM 0 HG22 THR A 176 18.291 -4.740 -6.700 1.00 0.15 H new ATOM 0 HG23 THR A 176 19.283 -4.765 -5.223 1.00 0.15 H new ATOM 2766 N ALA A 177 14.715 -5.189 -6.114 1.00 0.10 N ATOM 2767 CA ALA A 177 13.413 -5.611 -6.729 1.00 0.11 C ATOM 2768 C ALA A 177 13.375 -7.118 -7.205 1.00 0.15 C ATOM 2769 O ALA A 177 12.293 -7.679 -7.440 1.00 0.17 O ATOM 2770 CB ALA A 177 13.077 -4.657 -7.899 1.00 0.15 C ATOM 0 H ALA A 177 15.285 -4.624 -6.743 1.00 0.10 H new ATOM 0 HA ALA A 177 12.657 -5.544 -5.947 1.00 0.11 H new ATOM 0 HB1 ALA A 177 12.132 -4.956 -8.352 1.00 0.15 H new ATOM 0 HB2 ALA A 177 12.993 -3.637 -7.524 1.00 0.15 H new ATOM 0 HB3 ALA A 177 13.869 -4.705 -8.646 1.00 0.15 H new ATOM 2776 N ASP A 178 14.569 -7.773 -7.314 1.00 0.19 N ATOM 2777 CA ASP A 178 14.697 -9.210 -7.703 1.00 0.24 C ATOM 2778 C ASP A 178 14.616 -10.209 -6.490 1.00 0.26 C ATOM 2779 O ASP A 178 14.760 -11.421 -6.673 1.00 0.31 O ATOM 2780 CB ASP A 178 16.018 -9.429 -8.458 1.00 0.31 C ATOM 2781 CG ASP A 178 15.862 -9.352 -9.974 1.00 0.42 C ATOM 2782 OD1 ASP A 178 15.570 -10.397 -10.595 1.00 0.55 O ATOM 2783 OD2 ASP A 178 16.032 -8.249 -10.534 1.00 0.51 O ATOM 0 H ASP A 178 15.466 -7.321 -7.135 1.00 0.19 H new ATOM 0 HA ASP A 178 13.842 -9.428 -8.343 1.00 0.24 H new ATOM 0 HB2 ASP A 178 16.742 -8.681 -8.135 1.00 0.31 H new ATOM 0 HB3 ASP A 178 16.425 -10.404 -8.190 1.00 0.31 H new ATOM 2788 N ASP A 179 14.377 -9.675 -5.266 1.00 0.24 N ATOM 2789 CA ASP A 179 14.263 -10.479 -4.016 1.00 0.31 C ATOM 2790 C ASP A 179 12.809 -10.543 -3.449 1.00 0.32 C ATOM 2791 O ASP A 179 12.577 -11.195 -2.429 1.00 0.44 O ATOM 2792 CB ASP A 179 15.189 -9.895 -2.940 1.00 0.37 C ATOM 2793 CG ASP A 179 16.585 -10.512 -2.939 1.00 0.48 C ATOM 2794 OD1 ASP A 179 16.773 -11.554 -2.277 1.00 0.60 O ATOM 2795 OD2 ASP A 179 17.483 -9.950 -3.602 1.00 0.52 O ATOM 0 H ASP A 179 14.257 -8.673 -5.114 1.00 0.24 H new ATOM 0 HA ASP A 179 14.554 -11.497 -4.277 1.00 0.31 H new ATOM 0 HB2 ASP A 179 15.276 -8.819 -3.092 1.00 0.37 H new ATOM 0 HB3 ASP A 179 14.734 -10.043 -1.961 1.00 0.37 H new ATOM 2800 N VAL A 180 11.854 -9.839 -4.110 1.00 0.24 N ATOM 2801 CA VAL A 180 10.396 -9.805 -3.725 1.00 0.29 C ATOM 2802 C VAL A 180 9.586 -10.938 -4.473 1.00 0.50 C ATOM 2803 O VAL A 180 9.126 -10.712 -5.598 1.00 0.95 O ATOM 2804 CB VAL A 180 9.636 -8.404 -4.012 1.00 0.27 C ATOM 2805 CG1 VAL A 180 8.837 -7.924 -2.782 1.00 0.48 C ATOM 2806 CG2 VAL A 180 10.531 -7.225 -4.477 1.00 0.50 C ATOM 0 H VAL A 180 12.063 -9.272 -4.932 1.00 0.24 H new ATOM 0 HA VAL A 180 10.414 -9.955 -2.646 1.00 0.29 H new ATOM 0 HB VAL A 180 8.982 -8.659 -4.846 1.00 0.27 H new ATOM 0 HG11 VAL A 180 8.342 -6.981 -3.015 1.00 0.48 H new ATOM 0 HG12 VAL A 180 8.089 -8.672 -2.520 1.00 0.48 H new ATOM 0 HG13 VAL A 180 9.515 -7.779 -1.941 1.00 0.48 H new ATOM 0 HG21 VAL A 180 9.914 -6.341 -4.638 1.00 0.50 H new ATOM 0 HG22 VAL A 180 11.278 -7.012 -3.712 1.00 0.50 H new ATOM 0 HG23 VAL A 180 11.031 -7.493 -5.408 1.00 0.50 H new