USER MOD reduce.3.24.130724 H: found=0, std=0, add=1219, rem=0, adj=32 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 21:sc= 0.0543 USER MOD Set 1.2: A 168 CYS SG : rot 58:sc= 0.747 USER MOD Set 2.1: A 15 ASN : amide:sc= -2.05 X(o=-0.97,f=-1.2!) USER MOD Set 2.2: A 63 THR OG1 : rot -79:sc= 1.09 USER MOD Set 3.1: A 58 GLN : amide:sc= -0.572 K(o=-3.3,f=-0.92) USER MOD Set 3.2: A 62 GLN : amide:sc= -2.76! K(o=-3.3!,f=-0.92) USER MOD Single : A 9 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0317) USER MOD Single : A 20 SER OG : rot 7:sc= 0.141 USER MOD Single : A 21 HIS : no HD1:sc= -2.01 K(o=-2,f=-0.42) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.0114 K(o=-0.011,f=-0.64) USER MOD Single : A 29 TYR OH : rot 130:sc= -0.0477 USER MOD Single : A 31 LYS NZ :NH3+ 170:sc= -0.0714 (180deg=-0.251) USER MOD Single : A 53 SER OG : rot 140:sc= 0.956 USER MOD Single : A 54 ASN : amide:sc= -0.78 K(o=-0.78,f=-0.13) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 170:sc=-0.00658 (180deg=-0.121) USER MOD Single : A 83 TYR OH : rot 180:sc= -0.341 USER MOD Single : A 88 LYS NZ :NH3+ -176:sc= -1.28 (180deg=-1.72!) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.0484 X(o=-0.048,f=0) USER MOD Single : A 97 SER OG : rot 180:sc= -0.501 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.288) USER MOD Single : A 107 ASN : amide:sc= -4.61! C(o=-4.6!,f=-7.9!) USER MOD Single : A 109 HIS : no HE2:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.0018) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -0.0691 X(o=-0.069,f=-0.46) USER MOD Single : A 134 SER OG : rot 180:sc= -0.0273 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= -0.0217 USER MOD Single : A 143 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 147 SER OG : rot 25:sc= 0.0483 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 18:sc= 0.0237 USER MOD Single : A 159 LYS NZ :NH3+ -168:sc= -0.0102 (180deg=-0.158) 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= 0.357 K(o=0.36,f=-3.4!) USER MOD Single : A 166 LYS NZ :NH3+ 168:sc= -0.996 (180deg=-1.19) USER MOD Single : A 173 MET CE :methyl 153:sc= -0.238 (180deg=-0.959) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 55 N LEU A 6 12.620 -12.784 2.497 1.00 0.23 N ATOM 56 CA LEU A 6 11.766 -11.568 2.488 1.00 0.22 C ATOM 57 C LEU A 6 11.537 -10.964 3.909 1.00 0.17 C ATOM 58 O LEU A 6 11.675 -9.747 4.107 1.00 0.16 O ATOM 59 CB LEU A 6 10.432 -11.907 1.781 1.00 0.24 C ATOM 60 CG LEU A 6 9.519 -10.714 1.375 1.00 0.27 C ATOM 61 CD1 LEU A 6 10.239 -9.649 0.542 1.00 0.33 C ATOM 62 CD2 LEU A 6 8.262 -11.162 0.623 1.00 0.35 C ATOM 0 HA LEU A 6 12.288 -10.786 1.936 1.00 0.22 H new ATOM 0 HB2 LEU A 6 10.662 -12.478 0.881 1.00 0.24 H new ATOM 0 HB3 LEU A 6 9.859 -12.563 2.437 1.00 0.24 H new ATOM 0 HG LEU A 6 9.229 -10.267 2.326 1.00 0.27 H new ATOM 0 HD11 LEU A 6 9.542 -8.848 0.295 1.00 0.33 H new ATOM 0 HD12 LEU A 6 11.072 -9.242 1.114 1.00 0.33 H new ATOM 0 HD13 LEU A 6 10.615 -10.099 -0.377 1.00 0.33 H new ATOM 0 HD21 LEU A 6 7.662 -10.289 0.365 1.00 0.35 H new ATOM 0 HD22 LEU A 6 8.551 -11.687 -0.288 1.00 0.35 H new ATOM 0 HD23 LEU A 6 7.677 -11.829 1.256 1.00 0.35 H new ATOM 74 N ALA A 7 11.173 -11.847 4.889 1.00 0.17 N ATOM 75 CA ALA A 7 10.974 -11.510 6.348 1.00 0.16 C ATOM 76 C ALA A 7 12.248 -10.918 7.077 1.00 0.15 C ATOM 77 O ALA A 7 12.124 -10.199 8.081 1.00 0.15 O ATOM 78 CB ALA A 7 10.489 -12.782 7.078 1.00 0.20 C ATOM 0 H ALA A 7 11.005 -12.833 4.690 1.00 0.17 H new ATOM 0 HA ALA A 7 10.234 -10.711 6.387 1.00 0.16 H new ATOM 0 HB1 ALA A 7 10.339 -12.560 8.135 1.00 0.20 H new ATOM 0 HB2 ALA A 7 9.548 -13.116 6.640 1.00 0.20 H new ATOM 0 HB3 ALA A 7 11.237 -13.568 6.975 1.00 0.20 H new ATOM 84 N ASP A 8 13.467 -11.209 6.531 1.00 0.16 N ATOM 85 CA ASP A 8 14.760 -10.709 7.064 1.00 0.18 C ATOM 86 C ASP A 8 15.170 -9.308 6.502 1.00 0.17 C ATOM 87 O ASP A 8 16.059 -8.660 7.063 1.00 0.21 O ATOM 88 CB ASP A 8 15.878 -11.725 6.775 1.00 0.21 C ATOM 89 CG ASP A 8 16.169 -12.646 7.956 1.00 0.26 C ATOM 90 OD1 ASP A 8 15.512 -13.701 8.063 1.00 0.31 O ATOM 91 OD2 ASP A 8 17.057 -12.308 8.767 1.00 0.32 O ATOM 0 H ASP A 8 13.574 -11.799 5.706 1.00 0.16 H new ATOM 0 HA ASP A 8 14.620 -10.589 8.138 1.00 0.18 H new ATOM 0 HB2 ASP A 8 15.598 -12.328 5.912 1.00 0.21 H new ATOM 0 HB3 ASP A 8 16.788 -11.188 6.507 1.00 0.21 H new ATOM 96 N LYS A 9 14.517 -8.850 5.397 1.00 0.14 N ATOM 97 CA LYS A 9 14.821 -7.537 4.786 1.00 0.14 C ATOM 98 C LYS A 9 13.748 -6.447 5.068 1.00 0.10 C ATOM 99 O LYS A 9 14.055 -5.267 4.883 1.00 0.10 O ATOM 100 CB LYS A 9 15.072 -7.643 3.263 1.00 0.19 C ATOM 101 CG LYS A 9 16.093 -8.732 2.859 1.00 0.32 C ATOM 102 CD LYS A 9 16.280 -8.835 1.328 1.00 0.92 C ATOM 103 CE LYS A 9 17.452 -9.757 0.946 1.00 1.20 C ATOM 104 NZ LYS A 9 17.298 -11.121 1.520 1.00 1.73 N ATOM 0 H LYS A 9 13.783 -9.372 4.919 1.00 0.14 H new ATOM 0 HA LYS A 9 15.741 -7.217 5.276 1.00 0.14 H new ATOM 0 HB2 LYS A 9 14.125 -7.847 2.764 1.00 0.19 H new ATOM 0 HB3 LYS A 9 15.424 -6.678 2.897 1.00 0.19 H new ATOM 0 HG2 LYS A 9 17.054 -8.514 3.325 1.00 0.32 H new ATOM 0 HG3 LYS A 9 15.763 -9.696 3.246 1.00 0.32 H new ATOM 0 HD2 LYS A 9 15.362 -9.211 0.876 1.00 0.92 H new ATOM 0 HD3 LYS A 9 16.454 -7.840 0.917 1.00 0.92 H new ATOM 0 HE2 LYS A 9 17.520 -9.826 -0.140 1.00 1.20 H new ATOM 0 HE3 LYS A 9 18.387 -9.319 1.297 1.00 1.20 H new ATOM 0 HZ1 LYS A 9 18.053 -11.738 1.157 1.00 1.73 H new ATOM 0 HZ2 LYS A 9 17.361 -11.070 2.557 1.00 1.73 H new ATOM 0 HZ3 LYS A 9 16.373 -11.510 1.248 1.00 1.73 H new ATOM 118 N VAL A 10 12.480 -6.822 5.494 1.00 0.09 N ATOM 119 CA VAL A 10 11.396 -5.831 5.864 1.00 0.07 C ATOM 120 C VAL A 10 11.813 -4.779 6.985 1.00 0.06 C ATOM 121 O VAL A 10 12.418 -5.133 8.006 1.00 0.09 O ATOM 122 CB VAL A 10 10.009 -6.602 6.194 1.00 0.08 C ATOM 123 CG1 VAL A 10 9.976 -7.424 7.529 1.00 0.11 C ATOM 124 CG2 VAL A 10 8.756 -5.676 6.125 1.00 0.10 C ATOM 0 H VAL A 10 12.191 -7.796 5.587 1.00 0.09 H new ATOM 0 HA VAL A 10 11.234 -5.208 4.984 1.00 0.07 H new ATOM 0 HB VAL A 10 9.967 -7.332 5.386 1.00 0.08 H new ATOM 0 HG11 VAL A 10 8.999 -7.895 7.642 1.00 0.11 H new ATOM 0 HG12 VAL A 10 10.748 -8.193 7.502 1.00 0.11 H new ATOM 0 HG13 VAL A 10 10.157 -6.757 8.372 1.00 0.11 H new ATOM 0 HG21 VAL A 10 7.862 -6.255 6.356 1.00 0.10 H new ATOM 0 HG22 VAL A 10 8.861 -4.867 6.848 1.00 0.10 H new ATOM 0 HG23 VAL A 10 8.668 -5.257 5.122 1.00 0.10 H new ATOM 134 N ILE A 11 11.471 -3.505 6.733 1.00 0.06 N ATOM 135 CA ILE A 11 11.772 -2.419 7.697 1.00 0.07 C ATOM 136 C ILE A 11 10.499 -1.676 8.166 1.00 0.07 C ATOM 137 O ILE A 11 10.476 -1.157 9.286 1.00 0.08 O ATOM 138 CB ILE A 11 12.819 -1.356 7.166 1.00 0.10 C ATOM 139 CG1 ILE A 11 12.520 -0.933 5.684 1.00 0.10 C ATOM 140 CG2 ILE A 11 14.286 -1.881 7.342 1.00 0.13 C ATOM 141 CD1 ILE A 11 12.698 0.563 5.383 1.00 0.16 C ATOM 0 H ILE A 11 10.993 -3.198 5.886 1.00 0.06 H new ATOM 0 HA ILE A 11 12.224 -2.938 8.542 1.00 0.07 H new ATOM 0 HB ILE A 11 12.716 -0.456 7.773 1.00 0.10 H new ATOM 0 HG12 ILE A 11 13.174 -1.501 5.022 1.00 0.10 H new ATOM 0 HG13 ILE A 11 11.496 -1.217 5.441 1.00 0.10 H new ATOM 0 HG21 ILE A 11 14.987 -1.134 6.970 1.00 0.13 H new ATOM 0 HG22 ILE A 11 14.481 -2.068 8.398 1.00 0.13 H new ATOM 0 HG23 ILE A 11 14.411 -2.807 6.780 1.00 0.13 H new ATOM 0 HD11 ILE A 11 12.468 0.753 4.335 1.00 0.16 H new ATOM 0 HD12 ILE A 11 12.024 1.144 6.013 1.00 0.16 H new ATOM 0 HD13 ILE A 11 13.728 0.855 5.587 1.00 0.16 H new ATOM 153 N TRP A 12 9.439 -1.632 7.314 1.00 0.06 N ATOM 154 CA TRP A 12 8.196 -0.919 7.657 1.00 0.07 C ATOM 155 C TRP A 12 7.011 -1.367 6.748 1.00 0.08 C ATOM 156 O TRP A 12 7.053 -1.188 5.538 1.00 0.10 O ATOM 157 CB TRP A 12 8.511 0.590 7.533 1.00 0.10 C ATOM 158 CG TRP A 12 7.464 1.527 8.040 1.00 0.09 C ATOM 159 CD1 TRP A 12 7.382 2.127 9.265 1.00 0.19 C ATOM 160 CD2 TRP A 12 6.363 1.985 7.288 1.00 0.22 C ATOM 161 NE1 TRP A 12 6.277 2.938 9.306 1.00 0.26 N ATOM 162 CE2 TRP A 12 5.633 2.859 8.095 1.00 0.30 C ATOM 163 CE3 TRP A 12 5.937 1.725 5.995 1.00 0.35 C ATOM 164 CZ2 TRP A 12 4.487 3.480 7.639 1.00 0.44 C ATOM 165 CZ3 TRP A 12 4.814 2.325 5.534 1.00 0.51 C ATOM 166 CH2 TRP A 12 4.084 3.202 6.348 1.00 0.54 C ATOM 0 H TRP A 12 9.428 -2.079 6.397 1.00 0.06 H new ATOM 0 HA TRP A 12 7.871 -1.151 8.671 1.00 0.07 H new ATOM 0 HB2 TRP A 12 9.439 0.791 8.068 1.00 0.10 H new ATOM 0 HB3 TRP A 12 8.694 0.817 6.483 1.00 0.10 H new ATOM 0 HD1 TRP A 12 8.080 1.984 10.076 1.00 0.19 H new ATOM 0 HE1 TRP A 12 5.983 3.504 10.102 1.00 0.26 H new ATOM 0 HE3 TRP A 12 6.495 1.051 5.362 1.00 0.35 H new ATOM 0 HZ2 TRP A 12 3.928 4.157 8.268 1.00 0.44 H new ATOM 0 HZ3 TRP A 12 4.477 2.125 4.528 1.00 0.51 H new ATOM 0 HH2 TRP A 12 3.191 3.668 5.959 1.00 0.54 H new ATOM 177 N ALA A 13 5.941 -1.976 7.344 1.00 0.09 N ATOM 178 CA ALA A 13 4.731 -2.435 6.570 1.00 0.12 C ATOM 179 C ALA A 13 3.412 -2.077 7.312 1.00 0.16 C ATOM 180 O ALA A 13 3.277 -2.332 8.523 1.00 0.19 O ATOM 181 CB ALA A 13 4.782 -3.959 6.260 1.00 0.14 C ATOM 0 H ALA A 13 5.886 -2.161 8.346 1.00 0.09 H new ATOM 0 HA ALA A 13 4.747 -1.901 5.620 1.00 0.12 H new ATOM 0 HB1 ALA A 13 3.891 -4.247 5.701 1.00 0.14 H new ATOM 0 HB2 ALA A 13 5.669 -4.180 5.667 1.00 0.14 H new ATOM 0 HB3 ALA A 13 4.821 -4.519 7.194 1.00 0.14 H new ATOM 187 N VAL A 14 2.431 -1.456 6.588 1.00 0.20 N ATOM 188 CA VAL A 14 1.131 -1.036 7.228 1.00 0.26 C ATOM 189 C VAL A 14 -0.131 -1.333 6.337 1.00 0.27 C ATOM 190 O VAL A 14 -0.207 -0.934 5.177 1.00 0.28 O ATOM 191 CB VAL A 14 1.093 0.540 7.683 1.00 0.34 C ATOM 192 CG1 VAL A 14 -0.175 0.967 8.479 1.00 0.80 C ATOM 193 CG2 VAL A 14 2.263 0.981 8.572 1.00 1.05 C ATOM 0 H VAL A 14 2.504 -1.238 5.594 1.00 0.20 H new ATOM 0 HA VAL A 14 1.085 -1.655 8.124 1.00 0.26 H new ATOM 0 HB VAL A 14 1.127 1.020 6.705 1.00 0.34 H new ATOM 0 HG11 VAL A 14 -0.106 2.025 8.734 1.00 0.80 H new ATOM 0 HG12 VAL A 14 -1.062 0.798 7.868 1.00 0.80 H new ATOM 0 HG13 VAL A 14 -0.246 0.378 9.393 1.00 0.80 H new ATOM 0 HG21 VAL A 14 2.153 2.036 8.822 1.00 1.05 H new ATOM 0 HG22 VAL A 14 2.267 0.390 9.488 1.00 1.05 H new ATOM 0 HG23 VAL A 14 3.202 0.831 8.039 1.00 1.05 H new ATOM 203 N ASN A 15 -1.133 -2.002 6.969 1.00 0.33 N ATOM 204 CA ASN A 15 -2.469 -2.225 6.369 1.00 0.43 C ATOM 205 C ASN A 15 -3.493 -1.477 7.257 1.00 0.46 C ATOM 206 O ASN A 15 -3.850 -1.951 8.333 1.00 0.55 O ATOM 207 CB ASN A 15 -2.859 -3.744 6.201 1.00 0.56 C ATOM 208 CG ASN A 15 -4.077 -4.003 5.301 1.00 1.40 C ATOM 209 OD1 ASN A 15 -4.832 -4.935 5.542 1.00 2.05 O ATOM 210 ND2 ASN A 15 -4.288 -3.172 4.294 1.00 2.11 N ATOM 0 H ASN A 15 -1.034 -2.398 7.904 1.00 0.33 H new ATOM 0 HA ASN A 15 -2.461 -1.840 5.349 1.00 0.43 H new ATOM 0 HB2 ASN A 15 -2.003 -4.281 5.792 1.00 0.56 H new ATOM 0 HB3 ASN A 15 -3.058 -4.164 7.187 1.00 0.56 H new ATOM 0 HD21 ASN A 15 -5.100 -3.298 3.690 1.00 2.11 H new ATOM 0 HD22 ASN A 15 -3.638 -2.405 4.121 1.00 2.11 H new ATOM 217 N ALA A 16 -3.982 -0.308 6.769 1.00 0.47 N ATOM 218 CA ALA A 16 -4.961 0.526 7.512 1.00 0.54 C ATOM 219 C ALA A 16 -6.410 -0.046 7.407 1.00 0.58 C ATOM 220 O ALA A 16 -7.088 0.048 6.358 1.00 0.63 O ATOM 221 CB ALA A 16 -4.872 2.002 7.047 1.00 0.59 C ATOM 0 H ALA A 16 -3.714 0.078 5.864 1.00 0.47 H new ATOM 0 HA ALA A 16 -4.703 0.496 8.571 1.00 0.54 H new ATOM 0 HB1 ALA A 16 -5.595 2.602 7.600 1.00 0.59 H new ATOM 0 HB2 ALA A 16 -3.867 2.382 7.233 1.00 0.59 H new ATOM 0 HB3 ALA A 16 -5.091 2.061 5.981 1.00 0.59 H new ATOM 227 N GLY A 17 -6.810 -0.716 8.508 1.00 0.58 N ATOM 228 CA GLY A 17 -8.119 -1.353 8.604 1.00 0.61 C ATOM 229 C GLY A 17 -8.339 -2.149 9.888 1.00 0.62 C ATOM 230 O GLY A 17 -9.286 -1.875 10.631 1.00 0.71 O ATOM 0 H GLY A 17 -6.233 -0.824 9.342 1.00 0.58 H new ATOM 0 HA2 GLY A 17 -8.890 -0.586 8.530 1.00 0.61 H new ATOM 0 HA3 GLY A 17 -8.249 -2.019 7.751 1.00 0.61 H new ATOM 234 N GLY A 18 -7.456 -3.138 10.148 1.00 0.72 N ATOM 235 CA GLY A 18 -7.563 -3.990 11.349 1.00 0.73 C ATOM 236 C GLY A 18 -6.536 -3.662 12.439 1.00 0.68 C ATOM 237 O GLY A 18 -6.560 -2.560 12.997 1.00 0.80 O ATOM 0 H GLY A 18 -6.665 -3.364 9.544 1.00 0.72 H new ATOM 0 HA2 GLY A 18 -8.565 -3.889 11.766 1.00 0.73 H new ATOM 0 HA3 GLY A 18 -7.444 -5.033 11.054 1.00 0.73 H new ATOM 241 N GLU A 19 -5.646 -4.631 12.754 1.00 0.59 N ATOM 242 CA GLU A 19 -4.580 -4.455 13.772 1.00 0.60 C ATOM 243 C GLU A 19 -3.604 -5.655 13.772 1.00 0.54 C ATOM 244 O GLU A 19 -4.002 -6.791 14.051 1.00 0.65 O ATOM 245 CB GLU A 19 -5.204 -4.194 15.194 1.00 0.77 C ATOM 246 CG GLU A 19 -4.516 -4.865 16.403 1.00 1.43 C ATOM 247 CD GLU A 19 -5.206 -4.543 17.716 1.00 1.39 C ATOM 248 OE1 GLU A 19 -5.294 -3.347 18.065 1.00 1.50 O ATOM 249 OE2 GLU A 19 -5.658 -5.488 18.396 1.00 1.63 O ATOM 0 H GLU A 19 -5.644 -5.551 12.314 1.00 0.59 H new ATOM 0 HA GLU A 19 -3.995 -3.574 13.509 1.00 0.60 H new ATOM 0 HB2 GLU A 19 -5.214 -3.118 15.366 1.00 0.77 H new ATOM 0 HB3 GLU A 19 -6.243 -4.523 15.172 1.00 0.77 H new ATOM 0 HG2 GLU A 19 -4.505 -5.945 16.257 1.00 1.43 H new ATOM 0 HG3 GLU A 19 -3.477 -4.539 16.453 1.00 1.43 H new ATOM 256 N SER A 20 -2.299 -5.346 13.476 1.00 0.48 N ATOM 257 CA SER A 20 -1.120 -6.297 13.432 1.00 0.45 C ATOM 258 C SER A 20 -1.306 -7.634 12.631 1.00 0.43 C ATOM 259 O SER A 20 -2.005 -8.534 13.114 1.00 0.51 O ATOM 260 CB SER A 20 -0.686 -6.641 14.873 1.00 0.52 C ATOM 261 OG SER A 20 0.729 -6.665 15.006 1.00 1.00 O ATOM 0 H SER A 20 -2.022 -4.390 13.252 1.00 0.48 H new ATOM 0 HA SER A 20 -0.362 -5.746 12.875 1.00 0.45 H new ATOM 0 HB2 SER A 20 -1.104 -5.908 15.563 1.00 0.52 H new ATOM 0 HB3 SER A 20 -1.094 -7.612 15.154 1.00 0.52 H new ATOM 0 HG SER A 20 1.141 -6.344 14.177 1.00 1.00 H new ATOM 267 N HIS A 21 -0.676 -7.793 11.438 1.00 0.39 N ATOM 268 CA HIS A 21 -0.853 -9.087 10.704 1.00 0.40 C ATOM 269 C HIS A 21 0.410 -9.588 9.980 1.00 0.40 C ATOM 270 O HIS A 21 0.994 -8.888 9.167 1.00 0.41 O ATOM 271 CB HIS A 21 -2.059 -9.024 9.707 1.00 0.43 C ATOM 272 CG HIS A 21 -2.195 -10.225 8.775 1.00 0.41 C ATOM 273 ND1 HIS A 21 -3.082 -11.264 8.963 1.00 0.39 N ATOM 274 CD2 HIS A 21 -1.508 -10.546 7.651 1.00 0.45 C ATOM 275 CE1 HIS A 21 -2.913 -12.151 7.987 1.00 0.40 C ATOM 276 NE2 HIS A 21 -1.972 -11.730 7.193 1.00 0.43 N ATOM 0 H HIS A 21 -0.081 -7.100 10.984 1.00 0.39 H new ATOM 0 HA HIS A 21 -1.066 -9.818 11.484 1.00 0.40 H new ATOM 0 HB2 HIS A 21 -2.980 -8.924 10.282 1.00 0.43 H new ATOM 0 HB3 HIS A 21 -1.962 -8.123 9.101 1.00 0.43 H new ATOM 0 HD2 HIS A 21 -0.724 -9.956 7.199 1.00 0.45 H new ATOM 0 HE1 HIS A 21 -3.467 -13.071 7.872 1.00 0.40 H new ATOM 0 HE2 HIS A 21 -1.639 -12.215 6.360 1.00 0.43 H new ATOM 285 N VAL A 22 0.694 -10.897 10.195 1.00 0.41 N ATOM 286 CA VAL A 22 1.828 -11.628 9.561 1.00 0.43 C ATOM 287 C VAL A 22 1.319 -12.423 8.286 1.00 0.44 C ATOM 288 O VAL A 22 0.530 -13.371 8.381 1.00 0.48 O ATOM 289 CB VAL A 22 2.668 -12.483 10.670 1.00 0.49 C ATOM 290 CG1 VAL A 22 1.995 -13.768 11.229 1.00 1.38 C ATOM 291 CG2 VAL A 22 4.103 -12.824 10.199 1.00 1.39 C ATOM 0 H VAL A 22 0.139 -11.483 10.819 1.00 0.41 H new ATOM 0 HA VAL A 22 2.568 -10.931 9.169 1.00 0.43 H new ATOM 0 HB VAL A 22 2.695 -11.783 11.505 1.00 0.49 H new ATOM 0 HG11 VAL A 22 2.658 -14.240 11.955 1.00 1.38 H new ATOM 0 HG12 VAL A 22 1.055 -13.505 11.713 1.00 1.38 H new ATOM 0 HG13 VAL A 22 1.800 -14.462 10.411 1.00 1.38 H new ATOM 0 HG21 VAL A 22 4.615 -13.393 10.975 1.00 1.39 H new ATOM 0 HG22 VAL A 22 4.055 -13.418 9.286 1.00 1.39 H new ATOM 0 HG23 VAL A 22 4.651 -11.902 10.004 1.00 1.39 H new ATOM 301 N ASP A 23 1.785 -11.963 7.098 1.00 0.41 N ATOM 302 CA ASP A 23 1.426 -12.534 5.775 1.00 0.44 C ATOM 303 C ASP A 23 2.294 -13.779 5.404 1.00 0.43 C ATOM 304 O ASP A 23 3.369 -13.972 5.981 1.00 0.41 O ATOM 305 CB ASP A 23 1.549 -11.396 4.735 1.00 0.49 C ATOM 306 CG ASP A 23 0.512 -11.444 3.627 1.00 1.04 C ATOM 307 OD1 ASP A 23 -0.637 -11.016 3.865 1.00 1.85 O ATOM 308 OD2 ASP A 23 0.855 -11.914 2.527 1.00 1.46 O ATOM 0 H ASP A 23 2.429 -11.175 7.031 1.00 0.41 H new ATOM 0 HA ASP A 23 0.404 -12.911 5.797 1.00 0.44 H new ATOM 0 HB2 ASP A 23 1.468 -10.439 5.250 1.00 0.49 H new ATOM 0 HB3 ASP A 23 2.542 -11.434 4.288 1.00 0.49 H new ATOM 313 N VAL A 24 1.811 -14.543 4.366 1.00 0.47 N ATOM 314 CA VAL A 24 2.379 -15.876 3.838 1.00 0.50 C ATOM 315 C VAL A 24 3.932 -16.030 3.680 1.00 0.47 C ATOM 316 O VAL A 24 4.456 -17.126 3.901 1.00 0.51 O ATOM 317 CB VAL A 24 1.675 -16.402 2.483 1.00 0.57 C ATOM 318 CG1 VAL A 24 0.324 -17.098 2.754 1.00 0.72 C ATOM 319 CG2 VAL A 24 1.447 -15.317 1.384 1.00 0.58 C ATOM 0 H VAL A 24 0.985 -14.253 3.842 1.00 0.47 H new ATOM 0 HA VAL A 24 2.114 -16.504 4.689 1.00 0.50 H new ATOM 0 HB VAL A 24 2.405 -17.113 2.096 1.00 0.57 H new ATOM 0 HG11 VAL A 24 -0.108 -17.433 1.811 1.00 0.72 H new ATOM 0 HG12 VAL A 24 0.482 -17.957 3.406 1.00 0.72 H new ATOM 0 HG13 VAL A 24 -0.357 -16.396 3.236 1.00 0.72 H new ATOM 0 HG21 VAL A 24 0.969 -15.773 0.517 1.00 0.58 H new ATOM 0 HG22 VAL A 24 0.806 -14.528 1.779 1.00 0.58 H new ATOM 0 HG23 VAL A 24 2.406 -14.891 1.088 1.00 0.58 H new ATOM 329 N HIS A 25 4.642 -14.954 3.302 1.00 0.42 N ATOM 330 CA HIS A 25 6.129 -14.976 3.192 1.00 0.40 C ATOM 331 C HIS A 25 6.804 -14.592 4.550 1.00 0.36 C ATOM 332 O HIS A 25 7.956 -14.946 4.814 1.00 0.39 O ATOM 333 CB HIS A 25 6.598 -14.009 2.096 1.00 0.38 C ATOM 334 CG HIS A 25 5.909 -14.187 0.766 1.00 0.42 C ATOM 335 ND1 HIS A 25 6.145 -15.258 -0.071 1.00 0.45 N ATOM 336 CD2 HIS A 25 4.979 -13.424 0.140 1.00 0.48 C ATOM 337 CE1 HIS A 25 5.391 -15.145 -1.152 1.00 0.49 C ATOM 338 NE2 HIS A 25 4.676 -14.041 -1.048 1.00 0.51 N ATOM 0 H HIS A 25 4.221 -14.055 3.066 1.00 0.42 H new ATOM 0 HA HIS A 25 6.426 -15.992 2.932 1.00 0.40 H new ATOM 0 HB2 HIS A 25 6.439 -12.987 2.439 1.00 0.38 H new ATOM 0 HB3 HIS A 25 7.671 -14.134 1.954 1.00 0.38 H new ATOM 0 HD2 HIS A 25 4.555 -12.501 0.508 1.00 0.48 H new ATOM 0 HE1 HIS A 25 5.365 -15.839 -1.979 1.00 0.49 H new ATOM 0 HE2 HIS A 25 4.007 -13.701 -1.739 1.00 0.51 H new ATOM 347 N GLY A 26 6.030 -13.860 5.381 1.00 0.34 N ATOM 348 CA GLY A 26 6.432 -13.418 6.712 1.00 0.32 C ATOM 349 C GLY A 26 6.509 -11.904 6.860 1.00 0.27 C ATOM 350 O GLY A 26 7.421 -11.379 7.500 1.00 0.26 O ATOM 0 H GLY A 26 5.089 -13.559 5.128 1.00 0.34 H new ATOM 0 HA2 GLY A 26 5.725 -13.810 7.444 1.00 0.32 H new ATOM 0 HA3 GLY A 26 7.406 -13.847 6.948 1.00 0.32 H new ATOM 354 N ILE A 27 5.519 -11.208 6.269 1.00 0.26 N ATOM 355 CA ILE A 27 5.456 -9.730 6.300 1.00 0.23 C ATOM 356 C ILE A 27 4.302 -9.249 7.237 1.00 0.26 C ATOM 357 O ILE A 27 3.125 -9.414 6.914 1.00 0.33 O ATOM 358 CB ILE A 27 5.373 -9.176 4.795 1.00 0.22 C ATOM 359 CG1 ILE A 27 6.672 -9.502 3.948 1.00 0.18 C ATOM 360 CG2 ILE A 27 5.055 -7.648 4.620 1.00 0.26 C ATOM 361 CD1 ILE A 27 8.060 -9.177 4.526 1.00 0.55 C ATOM 0 H ILE A 27 4.749 -11.645 5.763 1.00 0.26 H new ATOM 0 HA ILE A 27 6.363 -9.310 6.735 1.00 0.23 H new ATOM 0 HB ILE A 27 4.508 -9.722 4.418 1.00 0.22 H new ATOM 0 HG12 ILE A 27 6.655 -10.568 3.723 1.00 0.18 H new ATOM 0 HG13 ILE A 27 6.583 -8.974 2.999 1.00 0.18 H new ATOM 0 HG21 ILE A 27 5.027 -7.401 3.559 1.00 0.26 H new ATOM 0 HG22 ILE A 27 4.088 -7.424 5.070 1.00 0.26 H new ATOM 0 HG23 ILE A 27 5.829 -7.057 5.109 1.00 0.26 H new ATOM 0 HD11 ILE A 27 8.829 -9.467 3.810 1.00 0.55 H new ATOM 0 HD12 ILE A 27 8.131 -8.107 4.721 1.00 0.55 H new ATOM 0 HD13 ILE A 27 8.204 -9.726 5.456 1.00 0.55 H new ATOM 373 N HIS A 28 4.667 -8.607 8.364 1.00 0.25 N ATOM 374 CA HIS A 28 3.656 -8.116 9.314 1.00 0.30 C ATOM 375 C HIS A 28 3.481 -6.587 9.383 1.00 0.28 C ATOM 376 O HIS A 28 4.418 -5.798 9.222 1.00 0.28 O ATOM 377 CB HIS A 28 3.870 -8.655 10.748 1.00 0.40 C ATOM 378 CG HIS A 28 5.270 -8.626 11.218 1.00 0.63 C ATOM 379 ND1 HIS A 28 6.050 -9.747 11.288 1.00 0.93 N ATOM 380 CD2 HIS A 28 6.016 -7.604 11.643 1.00 0.96 C ATOM 381 CE1 HIS A 28 7.232 -9.423 11.741 1.00 1.30 C ATOM 382 NE2 HIS A 28 7.250 -8.116 11.970 1.00 1.34 N ATOM 0 H HIS A 28 5.633 -8.420 8.633 1.00 0.25 H new ATOM 0 HA HIS A 28 2.735 -8.518 8.892 1.00 0.30 H new ATOM 0 HB2 HIS A 28 3.258 -8.071 11.436 1.00 0.40 H new ATOM 0 HB3 HIS A 28 3.508 -9.682 10.793 1.00 0.40 H new ATOM 0 HD2 HIS A 28 5.709 -6.571 11.716 1.00 0.96 H new ATOM 0 HE1 HIS A 28 8.055 -10.104 11.902 1.00 1.30 H new ATOM 0 HE2 HIS A 28 8.043 -7.583 12.327 1.00 1.34 H new ATOM 391 N TYR A 29 2.214 -6.226 9.665 1.00 0.33 N ATOM 392 CA TYR A 29 1.748 -4.838 9.859 1.00 0.38 C ATOM 393 C TYR A 29 1.687 -4.519 11.389 1.00 0.45 C ATOM 394 O TYR A 29 1.453 -5.416 12.210 1.00 0.46 O ATOM 395 CB TYR A 29 0.374 -4.643 9.090 1.00 0.45 C ATOM 396 CG TYR A 29 -0.796 -3.919 9.814 1.00 0.98 C ATOM 397 CD1 TYR A 29 -0.663 -2.605 10.279 1.00 1.31 C ATOM 398 CD2 TYR A 29 -2.042 -4.536 10.000 1.00 1.34 C ATOM 399 CE1 TYR A 29 -1.700 -1.947 10.900 1.00 1.91 C ATOM 400 CE2 TYR A 29 -3.086 -3.864 10.617 1.00 1.91 C ATOM 401 CZ TYR A 29 -2.901 -2.572 11.061 1.00 2.21 C ATOM 402 OH TYR A 29 -3.927 -1.897 11.667 1.00 2.79 O ATOM 0 H TYR A 29 1.465 -6.911 9.767 1.00 0.33 H new ATOM 0 HA TYR A 29 2.443 -4.115 9.432 1.00 0.38 H new ATOM 0 HB2 TYR A 29 0.585 -4.093 8.173 1.00 0.45 H new ATOM 0 HB3 TYR A 29 0.018 -5.630 8.795 1.00 0.45 H new ATOM 0 HD1 TYR A 29 0.279 -2.094 10.147 1.00 1.31 H new ATOM 0 HD2 TYR A 29 -2.190 -5.549 9.658 1.00 1.34 H new ATOM 0 HE1 TYR A 29 -1.563 -0.938 11.259 1.00 1.91 H new ATOM 0 HE2 TYR A 29 -4.041 -4.351 10.749 1.00 1.91 H new ATOM 0 HH TYR A 29 -4.734 -1.965 11.116 1.00 2.79 H new ATOM 412 N ARG A 30 1.875 -3.218 11.733 1.00 0.54 N ATOM 413 CA ARG A 30 1.915 -2.703 13.137 1.00 0.63 C ATOM 414 C ARG A 30 0.557 -2.708 13.908 1.00 0.91 C ATOM 415 O ARG A 30 0.166 -3.745 14.433 1.00 1.87 O ATOM 416 CB ARG A 30 2.550 -1.289 13.136 1.00 0.72 C ATOM 417 CG ARG A 30 3.961 -1.225 12.506 1.00 0.68 C ATOM 418 CD ARG A 30 4.584 0.180 12.569 1.00 0.87 C ATOM 419 NE ARG A 30 5.953 0.201 12.041 1.00 1.70 N ATOM 420 CZ ARG A 30 7.053 0.023 12.782 1.00 2.08 C ATOM 421 NH1 ARG A 30 6.963 -0.234 14.082 1.00 1.93 N ATOM 422 NH2 ARG A 30 8.249 0.088 12.213 1.00 3.00 N ATOM 0 H ARG A 30 2.005 -2.484 11.037 1.00 0.54 H new ATOM 0 HA ARG A 30 2.526 -3.412 13.696 1.00 0.63 H new ATOM 0 HB2 ARG A 30 1.892 -0.609 12.595 1.00 0.72 H new ATOM 0 HB3 ARG A 30 2.607 -0.928 14.163 1.00 0.72 H new ATOM 0 HG2 ARG A 30 4.615 -1.930 13.020 1.00 0.68 H new ATOM 0 HG3 ARG A 30 3.903 -1.545 11.465 1.00 0.68 H new ATOM 0 HD2 ARG A 30 3.966 0.876 12.001 1.00 0.87 H new ATOM 0 HD3 ARG A 30 4.589 0.528 13.602 1.00 0.87 H new ATOM 0 HE ARG A 30 6.074 0.362 11.041 1.00 1.70 H new ATOM 0 HH11 ARG A 30 6.047 -0.298 14.527 1.00 1.93 H new ATOM 0 HH12 ARG A 30 7.809 -0.368 14.635 1.00 1.93 H new ATOM 0 HH21 ARG A 30 8.329 0.273 11.213 1.00 3.00 H new ATOM 0 HH22 ARG A 30 9.089 -0.047 12.775 1.00 3.00 H new ATOM 436 N LYS A 31 -0.121 -1.551 13.990 1.00 0.57 N ATOM 437 CA LYS A 31 -1.408 -1.394 14.718 1.00 0.59 C ATOM 438 C LYS A 31 -1.928 0.073 14.673 1.00 0.64 C ATOM 439 O LYS A 31 -1.682 0.850 15.604 1.00 0.79 O ATOM 440 CB LYS A 31 -1.237 -1.861 16.202 1.00 0.73 C ATOM 441 CG LYS A 31 -2.459 -1.640 17.131 1.00 1.15 C ATOM 442 CD LYS A 31 -2.299 -2.283 18.535 1.00 1.44 C ATOM 443 CE LYS A 31 -1.139 -1.674 19.352 1.00 1.70 C ATOM 444 NZ LYS A 31 -1.168 -0.185 19.339 1.00 2.30 N ATOM 0 H LYS A 31 0.204 -0.688 13.553 1.00 0.57 H new ATOM 0 HA LYS A 31 -2.151 -2.018 14.220 1.00 0.59 H new ATOM 0 HB2 LYS A 31 -0.994 -2.924 16.202 1.00 0.73 H new ATOM 0 HB3 LYS A 31 -0.382 -1.338 16.630 1.00 0.73 H new ATOM 0 HG2 LYS A 31 -2.626 -0.569 17.248 1.00 1.15 H new ATOM 0 HG3 LYS A 31 -3.348 -2.051 16.652 1.00 1.15 H new ATOM 0 HD2 LYS A 31 -3.229 -2.163 19.091 1.00 1.44 H new ATOM 0 HD3 LYS A 31 -2.132 -3.354 18.421 1.00 1.44 H new ATOM 0 HE2 LYS A 31 -1.195 -2.029 20.381 1.00 1.70 H new ATOM 0 HE3 LYS A 31 -0.189 -2.022 18.947 1.00 1.70 H new ATOM 0 HZ1 LYS A 31 -0.482 0.182 20.030 1.00 2.30 H new ATOM 0 HZ2 LYS A 31 -0.920 0.159 18.389 1.00 2.30 H new ATOM 0 HZ3 LYS A 31 -2.122 0.146 19.589 1.00 2.30 H new ATOM 458 N ASP A 32 -2.643 0.446 13.564 1.00 0.61 N ATOM 459 CA ASP A 32 -3.312 1.803 13.349 1.00 0.72 C ATOM 460 C ASP A 32 -2.414 3.092 13.536 1.00 0.75 C ATOM 461 O ASP A 32 -2.763 3.975 14.330 1.00 1.00 O ATOM 462 CB ASP A 32 -4.550 1.926 14.281 1.00 0.86 C ATOM 463 CG ASP A 32 -5.697 0.967 13.969 1.00 0.95 C ATOM 464 OD1 ASP A 32 -5.484 0.013 13.192 1.00 1.01 O ATOM 465 OD2 ASP A 32 -6.800 1.170 14.513 1.00 1.17 O ATOM 0 H ASP A 32 -2.781 -0.186 12.775 1.00 0.61 H new ATOM 0 HA ASP A 32 -3.570 1.796 12.290 1.00 0.72 H new ATOM 0 HB2 ASP A 32 -4.229 1.760 15.309 1.00 0.86 H new ATOM 0 HB3 ASP A 32 -4.926 2.947 14.226 1.00 0.86 H new ATOM 470 N PRO A 33 -1.259 3.220 12.818 1.00 0.59 N ATOM 471 CA PRO A 33 -0.344 4.389 12.942 1.00 0.66 C ATOM 472 C PRO A 33 -0.434 5.469 11.809 1.00 0.83 C ATOM 473 O PRO A 33 0.549 5.713 11.100 1.00 1.45 O ATOM 474 CB PRO A 33 1.003 3.655 12.884 1.00 0.59 C ATOM 475 CG PRO A 33 0.786 2.626 11.796 1.00 0.57 C ATOM 476 CD PRO A 33 -0.690 2.213 11.897 1.00 0.49 C ATOM 0 HA PRO A 33 -0.560 4.990 13.825 1.00 0.66 H new ATOM 0 HB2 PRO A 33 1.821 4.333 12.641 1.00 0.59 H new ATOM 0 HB3 PRO A 33 1.249 3.188 13.838 1.00 0.59 H new ATOM 0 HG2 PRO A 33 1.009 3.043 10.814 1.00 0.57 H new ATOM 0 HG3 PRO A 33 1.443 1.767 11.934 1.00 0.57 H new ATOM 0 HD2 PRO A 33 -1.182 2.233 10.924 1.00 0.49 H new ATOM 0 HD3 PRO A 33 -0.800 1.202 12.288 1.00 0.49 H new ATOM 715 N PRO A 49 -14.268 -10.171 -0.185 1.00 0.82 N ATOM 716 CA PRO A 49 -14.065 -9.175 -1.281 1.00 0.89 C ATOM 717 C PRO A 49 -12.808 -9.269 -2.169 1.00 0.75 C ATOM 718 O PRO A 49 -12.907 -9.009 -3.370 1.00 0.78 O ATOM 719 CB PRO A 49 -14.121 -7.817 -0.570 1.00 1.31 C ATOM 720 CG PRO A 49 -14.736 -8.119 0.769 1.00 1.37 C ATOM 721 CD PRO A 49 -14.217 -9.494 1.123 1.00 1.05 C ATOM 0 HA PRO A 49 -14.837 -9.365 -2.027 1.00 0.89 H new ATOM 0 HB2 PRO A 49 -13.126 -7.384 -0.462 1.00 1.31 H new ATOM 0 HB3 PRO A 49 -14.721 -7.100 -1.130 1.00 1.31 H new ATOM 0 HG2 PRO A 49 -14.444 -7.380 1.515 1.00 1.37 H new ATOM 0 HG3 PRO A 49 -15.825 -8.107 0.717 1.00 1.37 H new ATOM 0 HD2 PRO A 49 -13.206 -9.459 1.528 1.00 1.05 H new ATOM 0 HD3 PRO A 49 -14.841 -9.990 1.866 1.00 1.05 H new ATOM 729 N ILE A 50 -11.638 -9.628 -1.609 1.00 0.67 N ATOM 730 CA ILE A 50 -10.407 -9.756 -2.425 1.00 0.60 C ATOM 731 C ILE A 50 -10.249 -11.233 -2.906 1.00 0.64 C ATOM 732 O ILE A 50 -9.921 -12.155 -2.154 1.00 0.69 O ATOM 733 CB ILE A 50 -9.129 -9.022 -1.713 1.00 0.57 C ATOM 734 CG1 ILE A 50 -9.199 -7.481 -2.008 1.00 0.54 C ATOM 735 CG2 ILE A 50 -7.706 -9.499 -2.160 1.00 0.59 C ATOM 736 CD1 ILE A 50 -10.299 -6.696 -1.312 1.00 0.59 C ATOM 0 H ILE A 50 -11.515 -9.832 -0.617 1.00 0.67 H new ATOM 0 HA ILE A 50 -10.478 -9.192 -3.355 1.00 0.60 H new ATOM 0 HB ILE A 50 -9.226 -9.286 -0.660 1.00 0.57 H new ATOM 0 HG12 ILE A 50 -8.241 -7.039 -1.733 1.00 0.54 H new ATOM 0 HG13 ILE A 50 -9.315 -7.347 -3.083 1.00 0.54 H new ATOM 0 HG21 ILE A 50 -6.946 -8.937 -1.616 1.00 0.59 H new ATOM 0 HG22 ILE A 50 -7.594 -10.562 -1.945 1.00 0.59 H new ATOM 0 HG23 ILE A 50 -7.585 -9.331 -3.230 1.00 0.59 H new ATOM 0 HD11 ILE A 50 -10.236 -5.647 -1.601 1.00 0.59 H new ATOM 0 HD12 ILE A 50 -11.271 -7.095 -1.603 1.00 0.59 H new ATOM 0 HD13 ILE A 50 -10.180 -6.783 -0.232 1.00 0.59 H new ATOM 748 N LEU A 51 -10.516 -11.363 -4.220 1.00 0.65 N ATOM 749 CA LEU A 51 -10.543 -12.636 -4.966 1.00 0.71 C ATOM 750 C LEU A 51 -9.203 -13.088 -5.609 1.00 0.78 C ATOM 751 O LEU A 51 -9.125 -14.206 -6.129 1.00 1.26 O ATOM 752 CB LEU A 51 -11.624 -12.491 -6.052 1.00 0.74 C ATOM 753 CG LEU A 51 -13.087 -12.265 -5.546 1.00 0.86 C ATOM 754 CD1 LEU A 51 -14.040 -11.936 -6.690 1.00 1.22 C ATOM 755 CD2 LEU A 51 -13.636 -13.453 -4.754 1.00 1.28 C ATOM 0 H LEU A 51 -10.726 -10.558 -4.811 1.00 0.65 H new ATOM 0 HA LEU A 51 -10.754 -13.422 -4.241 1.00 0.71 H new ATOM 0 HB2 LEU A 51 -11.352 -11.655 -6.697 1.00 0.74 H new ATOM 0 HB3 LEU A 51 -11.610 -13.388 -6.671 1.00 0.74 H new ATOM 0 HG LEU A 51 -13.028 -11.410 -4.872 1.00 0.86 H new ATOM 0 HD11 LEU A 51 -15.045 -11.787 -6.295 1.00 1.22 H new ATOM 0 HD12 LEU A 51 -13.708 -11.026 -7.190 1.00 1.22 H new ATOM 0 HD13 LEU A 51 -14.050 -12.760 -7.404 1.00 1.22 H new ATOM 0 HD21 LEU A 51 -14.654 -13.235 -4.430 1.00 1.28 H new ATOM 0 HD22 LEU A 51 -13.638 -14.341 -5.385 1.00 1.28 H new ATOM 0 HD23 LEU A 51 -13.008 -13.630 -3.881 1.00 1.28 H new ATOM 767 N ARG A 52 -8.159 -12.233 -5.572 1.00 0.58 N ATOM 768 CA ARG A 52 -6.825 -12.590 -6.109 1.00 0.58 C ATOM 769 C ARG A 52 -5.801 -12.927 -4.976 1.00 0.57 C ATOM 770 O ARG A 52 -4.588 -12.961 -5.208 1.00 0.65 O ATOM 771 CB ARG A 52 -6.288 -11.443 -6.993 1.00 0.57 C ATOM 772 CG ARG A 52 -6.235 -11.737 -8.517 1.00 0.70 C ATOM 773 CD ARG A 52 -7.617 -12.036 -9.130 1.00 0.64 C ATOM 774 NE ARG A 52 -7.584 -11.967 -10.589 1.00 0.87 N ATOM 775 CZ ARG A 52 -8.631 -12.233 -11.364 1.00 1.19 C ATOM 776 NH1 ARG A 52 -9.789 -12.587 -10.823 1.00 1.34 N ATOM 777 NH2 ARG A 52 -8.520 -12.147 -12.683 1.00 1.51 N ATOM 0 H ARG A 52 -8.212 -11.294 -5.178 1.00 0.58 H new ATOM 0 HA ARG A 52 -6.945 -13.490 -6.712 1.00 0.58 H new ATOM 0 HB2 ARG A 52 -6.911 -10.563 -6.833 1.00 0.57 H new ATOM 0 HB3 ARG A 52 -5.283 -11.188 -6.655 1.00 0.57 H new ATOM 0 HG2 ARG A 52 -5.796 -10.881 -9.030 1.00 0.70 H new ATOM 0 HG3 ARG A 52 -5.576 -12.587 -8.693 1.00 0.70 H new ATOM 0 HD2 ARG A 52 -7.947 -13.027 -8.819 1.00 0.64 H new ATOM 0 HD3 ARG A 52 -8.347 -11.323 -8.748 1.00 0.64 H new ATOM 0 HE ARG A 52 -6.708 -11.700 -11.038 1.00 0.87 H new ATOM 0 HH11 ARG A 52 -9.878 -12.656 -9.809 1.00 1.34 H new ATOM 0 HH12 ARG A 52 -10.590 -12.790 -11.421 1.00 1.34 H new ATOM 0 HH21 ARG A 52 -7.631 -11.877 -13.103 1.00 1.51 H new ATOM 0 HH22 ARG A 52 -9.324 -12.351 -13.277 1.00 1.51 H new ATOM 791 N SER A 53 -6.329 -13.185 -3.758 1.00 0.53 N ATOM 792 CA SER A 53 -5.538 -13.534 -2.573 1.00 0.54 C ATOM 793 C SER A 53 -6.240 -14.635 -1.721 1.00 0.57 C ATOM 794 O SER A 53 -7.460 -14.834 -1.816 1.00 0.67 O ATOM 795 CB SER A 53 -5.341 -12.259 -1.728 1.00 0.53 C ATOM 796 OG SER A 53 -4.045 -12.202 -1.169 1.00 1.09 O ATOM 0 H SER A 53 -7.332 -13.154 -3.576 1.00 0.53 H new ATOM 0 HA SER A 53 -4.576 -13.934 -2.893 1.00 0.54 H new ATOM 0 HB2 SER A 53 -5.509 -11.380 -2.350 1.00 0.53 H new ATOM 0 HB3 SER A 53 -6.084 -12.232 -0.931 1.00 0.53 H new ATOM 0 HG SER A 53 -3.709 -11.283 -1.215 1.00 1.09 H new ATOM 802 N ASN A 54 -5.451 -15.345 -0.868 1.00 0.59 N ATOM 803 CA ASN A 54 -5.985 -16.419 0.060 1.00 0.64 C ATOM 804 C ASN A 54 -6.547 -15.787 1.390 1.00 0.63 C ATOM 805 O ASN A 54 -6.139 -14.686 1.721 1.00 0.66 O ATOM 806 CB ASN A 54 -4.944 -17.581 0.366 1.00 0.80 C ATOM 807 CG ASN A 54 -3.448 -17.237 0.319 1.00 0.85 C ATOM 808 OD1 ASN A 54 -2.829 -17.247 -0.745 1.00 1.27 O ATOM 809 ND2 ASN A 54 -2.874 -16.947 1.480 1.00 1.12 N ATOM 0 H ASN A 54 -4.444 -15.204 -0.793 1.00 0.59 H new ATOM 0 HA ASN A 54 -6.806 -16.896 -0.476 1.00 0.64 H new ATOM 0 HB2 ASN A 54 -5.165 -17.975 1.358 1.00 0.80 H new ATOM 0 HB3 ASN A 54 -5.124 -18.387 -0.345 1.00 0.80 H new ATOM 0 HD21 ASN A 54 -1.880 -16.720 1.515 1.00 1.12 H new ATOM 0 HD22 ASN A 54 -3.427 -16.951 2.337 1.00 1.12 H new ATOM 816 N PRO A 55 -7.474 -16.470 2.190 1.00 0.71 N ATOM 817 CA PRO A 55 -8.132 -15.907 3.458 1.00 0.75 C ATOM 818 C PRO A 55 -7.283 -15.077 4.480 1.00 0.74 C ATOM 819 O PRO A 55 -7.738 -14.013 4.933 1.00 0.80 O ATOM 820 CB PRO A 55 -8.642 -17.183 4.136 1.00 0.89 C ATOM 821 CG PRO A 55 -9.083 -18.035 2.984 1.00 0.95 C ATOM 822 CD PRO A 55 -8.011 -17.843 1.917 1.00 0.83 C ATOM 0 HA PRO A 55 -8.854 -15.149 3.153 1.00 0.75 H new ATOM 0 HB2 PRO A 55 -7.859 -17.669 4.719 1.00 0.89 H new ATOM 0 HB3 PRO A 55 -9.465 -16.974 4.819 1.00 0.89 H new ATOM 0 HG2 PRO A 55 -9.166 -19.082 3.276 1.00 0.95 H new ATOM 0 HG3 PRO A 55 -10.063 -17.728 2.619 1.00 0.95 H new ATOM 0 HD2 PRO A 55 -7.231 -18.600 1.994 1.00 0.83 H new ATOM 0 HD3 PRO A 55 -8.429 -17.917 0.913 1.00 0.83 H new ATOM 830 N GLU A 56 -6.018 -15.497 4.747 1.00 0.71 N ATOM 831 CA GLU A 56 -5.114 -14.803 5.720 1.00 0.73 C ATOM 832 C GLU A 56 -4.491 -13.511 5.116 1.00 0.65 C ATOM 833 O GLU A 56 -4.632 -12.394 5.670 1.00 0.67 O ATOM 834 CB GLU A 56 -4.011 -15.779 6.231 1.00 0.80 C ATOM 835 CG GLU A 56 -3.287 -16.589 5.142 1.00 0.97 C ATOM 836 CD GLU A 56 -2.260 -17.543 5.724 1.00 1.48 C ATOM 837 OE1 GLU A 56 -1.112 -17.110 5.957 1.00 1.63 O ATOM 838 OE2 GLU A 56 -2.605 -18.722 5.947 1.00 2.04 O ATOM 0 H GLU A 56 -5.595 -16.313 4.305 1.00 0.71 H new ATOM 0 HA GLU A 56 -5.719 -14.492 6.571 1.00 0.73 H new ATOM 0 HB2 GLU A 56 -3.269 -15.203 6.785 1.00 0.80 H new ATOM 0 HB3 GLU A 56 -4.465 -16.476 6.936 1.00 0.80 H new ATOM 0 HG2 GLU A 56 -4.019 -17.154 4.565 1.00 0.97 H new ATOM 0 HG3 GLU A 56 -2.794 -15.906 4.450 1.00 0.97 H new ATOM 845 N ASP A 57 -3.914 -13.643 3.901 1.00 0.62 N ATOM 846 CA ASP A 57 -3.335 -12.486 3.184 1.00 0.58 C ATOM 847 C ASP A 57 -4.428 -11.578 2.483 1.00 0.52 C ATOM 848 O ASP A 57 -4.135 -10.474 2.021 1.00 0.53 O ATOM 849 CB ASP A 57 -2.151 -12.912 2.260 1.00 0.60 C ATOM 850 CG ASP A 57 -2.457 -13.843 1.085 1.00 1.08 C ATOM 851 OD1 ASP A 57 -3.638 -14.198 0.897 1.00 1.62 O ATOM 852 OD2 ASP A 57 -1.514 -14.213 0.368 1.00 1.62 O ATOM 0 H ASP A 57 -3.837 -14.529 3.401 1.00 0.62 H new ATOM 0 HA ASP A 57 -2.895 -11.829 3.934 1.00 0.58 H new ATOM 0 HB2 ASP A 57 -1.698 -12.006 1.859 1.00 0.60 H new ATOM 0 HB3 ASP A 57 -1.399 -13.396 2.883 1.00 0.60 H new ATOM 857 N GLN A 58 -5.715 -12.076 2.503 1.00 0.52 N ATOM 858 CA GLN A 58 -6.929 -11.361 2.054 1.00 0.51 C ATOM 859 C GLN A 58 -7.270 -10.299 3.129 1.00 0.50 C ATOM 860 O GLN A 58 -7.635 -9.196 2.799 1.00 0.49 O ATOM 861 CB GLN A 58 -8.100 -12.346 1.855 1.00 0.60 C ATOM 862 CG GLN A 58 -9.327 -11.763 1.142 1.00 0.84 C ATOM 863 CD GLN A 58 -10.542 -12.669 1.235 1.00 0.91 C ATOM 864 OE1 GLN A 58 -11.673 -12.196 1.298 1.00 1.16 O ATOM 865 NE2 GLN A 58 -10.316 -13.978 1.234 1.00 1.77 N ATOM 0 H GLN A 58 -5.922 -13.014 2.845 1.00 0.52 H new ATOM 0 HA GLN A 58 -6.754 -10.878 1.093 1.00 0.51 H new ATOM 0 HB2 GLN A 58 -7.741 -13.203 1.285 1.00 0.60 H new ATOM 0 HB3 GLN A 58 -8.410 -12.720 2.831 1.00 0.60 H new ATOM 0 HG2 GLN A 58 -9.568 -10.793 1.576 1.00 0.84 H new ATOM 0 HG3 GLN A 58 -9.086 -11.592 0.093 1.00 0.84 H new ATOM 0 HE21 GLN A 58 -9.360 -14.331 1.180 1.00 1.77 H new ATOM 0 HE22 GLN A 58 -11.098 -14.631 1.287 1.00 1.77 H new ATOM 874 N VAL A 59 -7.049 -10.662 4.445 1.00 0.52 N ATOM 875 CA VAL A 59 -7.165 -9.710 5.626 1.00 0.54 C ATOM 876 C VAL A 59 -6.113 -8.539 5.459 1.00 0.52 C ATOM 877 O VAL A 59 -6.460 -7.380 5.656 1.00 0.55 O ATOM 878 CB VAL A 59 -6.967 -10.413 7.066 1.00 0.55 C ATOM 879 CG1 VAL A 59 -7.285 -9.478 8.257 1.00 0.80 C ATOM 880 CG2 VAL A 59 -7.854 -11.635 7.267 1.00 0.81 C ATOM 0 H VAL A 59 -6.789 -11.610 4.717 1.00 0.52 H new ATOM 0 HA VAL A 59 -8.186 -9.330 5.614 1.00 0.54 H new ATOM 0 HB VAL A 59 -5.912 -10.688 7.055 1.00 0.55 H new ATOM 0 HG11 VAL A 59 -7.131 -10.015 9.193 1.00 0.80 H new ATOM 0 HG12 VAL A 59 -6.626 -8.610 8.224 1.00 0.80 H new ATOM 0 HG13 VAL A 59 -8.322 -9.149 8.194 1.00 0.80 H new ATOM 0 HG21 VAL A 59 -7.671 -12.059 8.254 1.00 0.81 H new ATOM 0 HG22 VAL A 59 -8.901 -11.342 7.186 1.00 0.81 H new ATOM 0 HG23 VAL A 59 -7.626 -12.380 6.504 1.00 0.81 H new ATOM 890 N LEU A 60 -4.843 -8.869 5.061 1.00 0.49 N ATOM 891 CA LEU A 60 -3.804 -7.812 4.797 1.00 0.48 C ATOM 892 C LEU A 60 -3.938 -7.121 3.388 1.00 0.49 C ATOM 893 O LEU A 60 -3.185 -6.217 3.076 1.00 0.65 O ATOM 894 CB LEU A 60 -2.380 -8.388 4.942 1.00 0.52 C ATOM 895 CG LEU A 60 -1.219 -7.341 5.054 1.00 0.71 C ATOM 896 CD1 LEU A 60 -1.017 -6.844 6.479 1.00 1.15 C ATOM 897 CD2 LEU A 60 0.127 -7.842 4.540 1.00 0.90 C ATOM 0 H LEU A 60 -4.519 -9.826 4.919 1.00 0.49 H new ATOM 0 HA LEU A 60 -3.982 -7.045 5.550 1.00 0.48 H new ATOM 0 HB2 LEU A 60 -2.356 -9.023 5.828 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -2.181 -9.030 4.084 1.00 0.52 H new ATOM 0 HG LEU A 60 -1.553 -6.526 4.412 1.00 0.71 H new ATOM 0 HD11 LEU A 60 -0.201 -6.121 6.500 1.00 1.15 H new ATOM 0 HD12 LEU A 60 -1.932 -6.369 6.832 1.00 1.15 H new ATOM 0 HD13 LEU A 60 -0.773 -7.686 7.127 1.00 1.15 H new ATOM 0 HD21 LEU A 60 0.875 -7.057 4.654 1.00 0.90 H new ATOM 0 HD22 LEU A 60 0.431 -8.719 5.112 1.00 0.90 H new ATOM 0 HD23 LEU A 60 0.038 -8.109 3.487 1.00 0.90 H new ATOM 909 N TYR A 61 -4.871 -7.601 2.565 1.00 0.44 N ATOM 910 CA TYR A 61 -5.181 -7.060 1.211 1.00 0.45 C ATOM 911 C TYR A 61 -6.675 -6.606 1.070 1.00 0.47 C ATOM 912 O TYR A 61 -7.132 -6.344 -0.042 1.00 0.52 O ATOM 913 CB TYR A 61 -4.903 -8.170 0.175 1.00 0.44 C ATOM 914 CG TYR A 61 -3.421 -8.438 -0.208 1.00 0.46 C ATOM 915 CD1 TYR A 61 -2.387 -7.934 0.585 1.00 0.70 C ATOM 916 CD2 TYR A 61 -3.042 -9.146 -1.366 1.00 0.76 C ATOM 917 CE1 TYR A 61 -1.054 -8.126 0.249 1.00 0.72 C ATOM 918 CE2 TYR A 61 -1.708 -9.334 -1.696 1.00 0.92 C ATOM 919 CZ TYR A 61 -0.768 -9.020 -0.912 1.00 0.72 C ATOM 920 OH TYR A 61 0.597 -9.010 -1.216 1.00 0.88 O ATOM 0 H TYR A 61 -5.456 -8.398 2.814 1.00 0.44 H new ATOM 0 HA TYR A 61 -4.555 -6.182 1.048 1.00 0.45 H new ATOM 0 HB2 TYR A 61 -5.325 -9.100 0.556 1.00 0.44 H new ATOM 0 HB3 TYR A 61 -5.447 -7.923 -0.737 1.00 0.44 H new ATOM 0 HD1 TYR A 61 -2.631 -7.382 1.481 1.00 0.70 H new ATOM 0 HD2 TYR A 61 -3.808 -9.551 -2.011 1.00 0.76 H new ATOM 0 HE1 TYR A 61 -0.259 -7.650 0.803 1.00 0.72 H new ATOM 0 HE2 TYR A 61 -1.464 -9.764 -2.656 1.00 0.92 H new ATOM 0 HH TYR A 61 0.767 -9.602 -1.979 1.00 0.88 H new ATOM 930 N GLN A 62 -7.406 -6.479 2.210 1.00 0.50 N ATOM 931 CA GLN A 62 -8.873 -6.164 2.208 1.00 0.57 C ATOM 932 C GLN A 62 -9.391 -5.187 3.301 1.00 0.70 C ATOM 933 O GLN A 62 -10.289 -4.389 3.021 1.00 1.33 O ATOM 934 CB GLN A 62 -9.604 -7.514 2.385 1.00 0.57 C ATOM 935 CG GLN A 62 -11.104 -7.488 2.684 1.00 0.75 C ATOM 936 CD GLN A 62 -11.491 -8.675 3.532 1.00 0.77 C ATOM 937 OE1 GLN A 62 -11.637 -8.554 4.745 1.00 1.26 O ATOM 938 NE2 GLN A 62 -11.572 -9.848 2.910 1.00 1.02 N ATOM 0 H GLN A 62 -7.010 -6.589 3.144 1.00 0.50 H new ATOM 0 HA GLN A 62 -9.069 -5.643 1.271 1.00 0.57 H new ATOM 0 HB2 GLN A 62 -9.456 -8.095 1.475 1.00 0.57 H new ATOM 0 HB3 GLN A 62 -9.112 -8.056 3.193 1.00 0.57 H new ATOM 0 HG2 GLN A 62 -11.362 -6.564 3.201 1.00 0.75 H new ATOM 0 HG3 GLN A 62 -11.668 -7.500 1.751 1.00 0.75 H new ATOM 0 HE21 GLN A 62 -11.443 -9.899 1.899 1.00 1.02 H new ATOM 0 HE22 GLN A 62 -11.763 -10.696 3.444 1.00 1.02 H new ATOM 947 N THR A 63 -8.867 -5.287 4.539 1.00 0.58 N ATOM 948 CA THR A 63 -9.325 -4.457 5.737 1.00 0.62 C ATOM 949 C THR A 63 -9.081 -2.904 5.615 1.00 0.76 C ATOM 950 O THR A 63 -7.971 -2.458 5.317 1.00 1.28 O ATOM 951 CB THR A 63 -8.714 -5.000 7.097 1.00 0.59 C ATOM 952 OG1 THR A 63 -7.283 -5.089 7.044 1.00 0.63 O ATOM 953 CG2 THR A 63 -9.286 -6.375 7.499 1.00 0.60 C ATOM 0 H THR A 63 -8.114 -5.936 4.766 1.00 0.58 H new ATOM 0 HA THR A 63 -10.407 -4.585 5.743 1.00 0.62 H new ATOM 0 HB THR A 63 -9.002 -4.270 7.853 1.00 0.59 H new ATOM 0 HG1 THR A 63 -7.023 -5.898 6.555 1.00 0.63 H new ATOM 0 HG21 THR A 63 -8.833 -6.698 8.436 1.00 0.60 H new ATOM 0 HG22 THR A 63 -10.366 -6.297 7.626 1.00 0.60 H new ATOM 0 HG23 THR A 63 -9.064 -7.103 6.719 1.00 0.60 H new ATOM 961 N GLU A 64 -10.170 -2.122 5.849 1.00 0.57 N ATOM 962 CA GLU A 64 -10.177 -0.621 5.767 1.00 0.60 C ATOM 963 C GLU A 64 -10.518 0.047 7.122 1.00 0.64 C ATOM 964 O GLU A 64 -11.308 -0.480 7.908 1.00 0.69 O ATOM 965 CB GLU A 64 -11.227 -0.130 4.736 1.00 0.67 C ATOM 966 CG GLU A 64 -12.478 -1.024 4.618 1.00 0.84 C ATOM 967 CD GLU A 64 -13.555 -0.423 3.737 1.00 1.07 C ATOM 968 OE1 GLU A 64 -13.273 -0.157 2.551 1.00 1.53 O ATOM 969 OE2 GLU A 64 -14.685 -0.228 4.232 1.00 1.50 O ATOM 0 H GLU A 64 -11.078 -2.511 6.102 1.00 0.57 H new ATOM 0 HA GLU A 64 -9.168 -0.338 5.468 1.00 0.60 H new ATOM 0 HB2 GLU A 64 -11.541 0.878 5.009 1.00 0.67 H new ATOM 0 HB3 GLU A 64 -10.752 -0.062 3.757 1.00 0.67 H new ATOM 0 HG2 GLU A 64 -12.187 -1.995 4.216 1.00 0.84 H new ATOM 0 HG3 GLU A 64 -12.887 -1.200 5.613 1.00 0.84 H new ATOM 1050 N ASP A 69 -9.426 13.921 4.450 1.00 0.76 N ATOM 1051 CA ASP A 69 -8.915 14.766 3.336 1.00 0.75 C ATOM 1052 C ASP A 69 -7.416 15.089 3.537 1.00 0.69 C ATOM 1053 O ASP A 69 -7.046 15.703 4.546 1.00 1.33 O ATOM 1054 CB ASP A 69 -9.703 16.098 3.267 1.00 1.17 C ATOM 1055 CG ASP A 69 -10.778 16.153 2.181 1.00 1.63 C ATOM 1056 OD1 ASP A 69 -11.226 15.074 1.743 1.00 2.06 O ATOM 1057 OD2 ASP A 69 -11.157 17.265 1.762 1.00 2.15 O ATOM 0 HA ASP A 69 -9.046 14.209 2.408 1.00 0.75 H new ATOM 0 HB2 ASP A 69 -10.174 16.275 4.234 1.00 1.17 H new ATOM 0 HB3 ASP A 69 -8.998 16.913 3.102 1.00 1.17 H new ATOM 1062 N SER A 70 -6.550 14.691 2.539 1.00 0.72 N ATOM 1063 CA SER A 70 -5.044 14.908 2.541 1.00 0.57 C ATOM 1064 C SER A 70 -4.320 14.241 3.739 1.00 0.53 C ATOM 1065 O SER A 70 -4.153 14.864 4.796 1.00 0.57 O ATOM 1066 CB SER A 70 -4.708 16.412 2.486 1.00 0.70 C ATOM 1067 OG SER A 70 -3.816 16.701 1.421 1.00 0.77 O ATOM 0 H SER A 70 -6.875 14.207 1.702 1.00 0.72 H new ATOM 0 HA SER A 70 -4.671 14.416 1.642 1.00 0.57 H new ATOM 0 HB2 SER A 70 -5.625 16.988 2.362 1.00 0.70 H new ATOM 0 HB3 SER A 70 -4.262 16.722 3.431 1.00 0.70 H new ATOM 0 HG SER A 70 -3.622 17.661 1.409 1.00 0.77 H new ATOM 1073 N PHE A 71 -3.898 12.975 3.569 1.00 0.49 N ATOM 1074 CA PHE A 71 -3.252 12.239 4.679 1.00 0.47 C ATOM 1075 C PHE A 71 -2.286 11.134 4.214 1.00 0.33 C ATOM 1076 O PHE A 71 -2.347 10.651 3.070 1.00 0.39 O ATOM 1077 CB PHE A 71 -4.323 11.662 5.664 1.00 0.66 C ATOM 1078 CG PHE A 71 -5.527 10.952 5.024 1.00 0.54 C ATOM 1079 CD1 PHE A 71 -6.625 11.666 4.540 1.00 0.75 C ATOM 1080 CD2 PHE A 71 -5.543 9.566 4.886 1.00 0.73 C ATOM 1081 CE1 PHE A 71 -7.696 11.017 3.946 1.00 0.81 C ATOM 1082 CE2 PHE A 71 -6.614 8.921 4.294 1.00 0.78 C ATOM 1083 CZ PHE A 71 -7.745 9.680 3.892 1.00 0.67 C ATOM 0 H PHE A 71 -3.987 12.449 2.700 1.00 0.49 H new ATOM 0 HA PHE A 71 -2.639 12.971 5.204 1.00 0.47 H new ATOM 0 HB2 PHE A 71 -3.828 10.959 6.334 1.00 0.66 H new ATOM 0 HB3 PHE A 71 -4.696 12.480 6.280 1.00 0.66 H new ATOM 0 HD1 PHE A 71 -6.640 12.742 4.630 1.00 0.75 H new ATOM 0 HD2 PHE A 71 -4.706 8.986 5.247 1.00 0.73 H new ATOM 0 HE1 PHE A 71 -8.502 11.597 3.521 1.00 0.81 H new ATOM 0 HE2 PHE A 71 -6.590 7.852 4.139 1.00 0.78 H new ATOM 0 HZ PHE A 71 -8.638 9.182 3.545 1.00 0.67 H new ATOM 1093 N GLY A 72 -1.375 10.752 5.130 1.00 0.31 N ATOM 1094 CA GLY A 72 -0.394 9.714 4.835 1.00 0.41 C ATOM 1095 C GLY A 72 0.513 9.306 5.993 1.00 0.33 C ATOM 1096 O GLY A 72 0.335 9.731 7.144 1.00 0.47 O ATOM 0 H GLY A 72 -1.306 11.147 6.068 1.00 0.31 H new ATOM 0 HA2 GLY A 72 -0.925 8.829 4.485 1.00 0.41 H new ATOM 0 HA3 GLY A 72 0.232 10.057 4.011 1.00 0.41 H new ATOM 1100 N TYR A 73 1.515 8.475 5.658 1.00 0.28 N ATOM 1101 CA TYR A 73 2.447 7.909 6.658 1.00 0.24 C ATOM 1102 C TYR A 73 3.906 8.436 6.569 1.00 0.21 C ATOM 1103 O TYR A 73 4.296 9.142 5.624 1.00 0.27 O ATOM 1104 CB TYR A 73 2.507 6.371 6.535 1.00 0.36 C ATOM 1105 CG TYR A 73 1.205 5.642 6.149 1.00 0.33 C ATOM 1106 CD1 TYR A 73 0.751 5.639 4.828 1.00 0.47 C ATOM 1107 CD2 TYR A 73 0.452 4.930 7.089 1.00 0.48 C ATOM 1108 CE1 TYR A 73 -0.400 4.965 4.466 1.00 0.63 C ATOM 1109 CE2 TYR A 73 -0.700 4.251 6.718 1.00 0.62 C ATOM 1110 CZ TYR A 73 -1.116 4.274 5.409 1.00 0.68 C ATOM 1111 OH TYR A 73 -2.258 3.601 5.043 1.00 0.89 O ATOM 0 H TYR A 73 1.703 8.178 4.701 1.00 0.28 H new ATOM 0 HA TYR A 73 2.037 8.232 7.615 1.00 0.24 H new ATOM 0 HB2 TYR A 73 3.266 6.121 5.794 1.00 0.36 H new ATOM 0 HB3 TYR A 73 2.849 5.969 7.489 1.00 0.36 H new ATOM 0 HD1 TYR A 73 1.310 6.174 4.075 1.00 0.47 H new ATOM 0 HD2 TYR A 73 0.773 4.908 8.120 1.00 0.48 H new ATOM 0 HE1 TYR A 73 -0.736 4.983 3.440 1.00 0.63 H new ATOM 0 HE2 TYR A 73 -1.268 3.706 7.457 1.00 0.62 H new ATOM 0 HH TYR A 73 -2.242 3.430 4.078 1.00 0.89 H new ATOM 1121 N ASP A 74 4.707 8.015 7.580 1.00 0.17 N ATOM 1122 CA ASP A 74 6.135 8.386 7.726 1.00 0.16 C ATOM 1123 C ASP A 74 7.041 7.134 7.900 1.00 0.15 C ATOM 1124 O ASP A 74 6.751 6.254 8.719 1.00 0.24 O ATOM 1125 CB ASP A 74 6.319 9.304 8.957 1.00 0.21 C ATOM 1126 CG ASP A 74 6.089 10.787 8.673 1.00 0.26 C ATOM 1127 OD1 ASP A 74 5.203 11.103 7.851 1.00 0.51 O ATOM 1128 OD2 ASP A 74 6.799 11.625 9.269 1.00 0.40 O ATOM 0 H ASP A 74 4.375 7.402 8.324 1.00 0.17 H new ATOM 0 HA ASP A 74 6.430 8.906 6.814 1.00 0.16 H new ATOM 0 HB2 ASP A 74 5.631 8.985 9.740 1.00 0.21 H new ATOM 0 HB3 ASP A 74 7.329 9.173 9.346 1.00 0.21 H new ATOM 1133 N ILE A 75 8.150 7.080 7.128 1.00 0.10 N ATOM 1134 CA ILE A 75 9.122 5.957 7.184 1.00 0.09 C ATOM 1135 C ILE A 75 10.564 6.510 7.465 1.00 0.08 C ATOM 1136 O ILE A 75 11.189 7.048 6.553 1.00 0.12 O ATOM 1137 CB ILE A 75 9.144 5.087 5.837 1.00 0.11 C ATOM 1138 CG1 ILE A 75 7.736 4.659 5.381 1.00 0.13 C ATOM 1139 CG2 ILE A 75 9.977 3.778 5.955 1.00 0.14 C ATOM 1140 CD1 ILE A 75 7.141 5.480 4.262 1.00 0.15 C ATOM 0 H ILE A 75 8.398 7.804 6.454 1.00 0.10 H new ATOM 0 HA ILE A 75 8.800 5.302 7.993 1.00 0.09 H new ATOM 0 HB ILE A 75 9.602 5.761 5.113 1.00 0.11 H new ATOM 0 HG12 ILE A 75 7.776 3.617 5.063 1.00 0.13 H new ATOM 0 HG13 ILE A 75 7.065 4.704 6.239 1.00 0.13 H new ATOM 0 HG21 ILE A 75 9.947 3.241 5.007 1.00 0.14 H new ATOM 0 HG22 ILE A 75 11.010 4.025 6.200 1.00 0.14 H new ATOM 0 HG23 ILE A 75 9.558 3.150 6.741 1.00 0.14 H new ATOM 0 HD11 ILE A 75 6.150 5.097 4.017 1.00 0.15 H new ATOM 0 HD12 ILE A 75 7.060 6.520 4.577 1.00 0.15 H new ATOM 0 HD13 ILE A 75 7.782 5.416 3.383 1.00 0.15 H new ATOM 1152 N PRO A 76 11.116 6.392 8.714 1.00 0.09 N ATOM 1153 CA PRO A 76 12.495 6.844 9.016 1.00 0.10 C ATOM 1154 C PRO A 76 13.618 5.808 8.679 1.00 0.09 C ATOM 1155 O PRO A 76 13.622 4.690 9.204 1.00 0.11 O ATOM 1156 CB PRO A 76 12.420 7.140 10.513 1.00 0.14 C ATOM 1157 CG PRO A 76 11.459 6.106 11.049 1.00 0.15 C ATOM 1158 CD PRO A 76 10.443 5.870 9.933 1.00 0.12 C ATOM 0 HA PRO A 76 12.783 7.695 8.399 1.00 0.10 H new ATOM 0 HB2 PRO A 76 13.399 7.056 10.985 1.00 0.14 H new ATOM 0 HB3 PRO A 76 12.061 8.152 10.701 1.00 0.14 H new ATOM 0 HG2 PRO A 76 11.980 5.184 11.306 1.00 0.15 H new ATOM 0 HG3 PRO A 76 10.969 6.459 11.956 1.00 0.15 H new ATOM 0 HD2 PRO A 76 10.200 4.812 9.832 1.00 0.12 H new ATOM 0 HD3 PRO A 76 9.508 6.395 10.128 1.00 0.12 H new ATOM 1166 N ILE A 77 14.550 6.213 7.792 1.00 0.09 N ATOM 1167 CA ILE A 77 15.684 5.357 7.345 1.00 0.10 C ATOM 1168 C ILE A 77 17.045 6.127 7.457 1.00 0.13 C ATOM 1169 O ILE A 77 17.096 7.360 7.551 1.00 0.19 O ATOM 1170 CB ILE A 77 15.486 4.829 5.848 1.00 0.12 C ATOM 1171 CG1 ILE A 77 13.987 4.669 5.489 1.00 0.11 C ATOM 1172 CG2 ILE A 77 16.185 3.446 5.576 1.00 0.18 C ATOM 1173 CD1 ILE A 77 13.449 5.619 4.437 1.00 0.19 C ATOM 0 H ILE A 77 14.544 7.138 7.363 1.00 0.09 H new ATOM 0 HA ILE A 77 15.704 4.492 8.008 1.00 0.10 H new ATOM 0 HB ILE A 77 15.953 5.592 5.226 1.00 0.12 H new ATOM 0 HG12 ILE A 77 13.824 3.648 5.145 1.00 0.11 H new ATOM 0 HG13 ILE A 77 13.401 4.797 6.399 1.00 0.11 H new ATOM 0 HG21 ILE A 77 16.011 3.147 4.542 1.00 0.18 H new ATOM 0 HG22 ILE A 77 17.257 3.539 5.751 1.00 0.18 H new ATOM 0 HG23 ILE A 77 15.772 2.692 6.246 1.00 0.18 H new ATOM 0 HD11 ILE A 77 12.392 5.414 4.268 1.00 0.19 H new ATOM 0 HD12 ILE A 77 13.569 6.647 4.779 1.00 0.19 H new ATOM 0 HD13 ILE A 77 13.999 5.480 3.506 1.00 0.19 H new ATOM 1185 N LYS A 78 18.136 5.348 7.428 1.00 0.15 N ATOM 1186 CA LYS A 78 19.515 5.863 7.504 1.00 0.20 C ATOM 1187 C LYS A 78 20.527 4.920 6.781 1.00 0.21 C ATOM 1188 O LYS A 78 21.711 4.885 7.139 1.00 0.25 O ATOM 1189 CB LYS A 78 19.943 6.091 8.986 1.00 0.27 C ATOM 1190 CG LYS A 78 19.543 4.955 9.957 1.00 0.87 C ATOM 1191 CD LYS A 78 19.967 5.246 11.414 1.00 1.32 C ATOM 1192 CE LYS A 78 19.537 4.127 12.379 1.00 1.91 C ATOM 1193 NZ LYS A 78 20.148 2.819 12.016 1.00 2.53 N ATOM 0 H LYS A 78 18.088 4.332 7.350 1.00 0.15 H new ATOM 0 HA LYS A 78 19.530 6.822 6.986 1.00 0.20 H new ATOM 0 HB2 LYS A 78 21.025 6.217 9.022 1.00 0.27 H new ATOM 0 HB3 LYS A 78 19.502 7.023 9.338 1.00 0.27 H new ATOM 0 HG2 LYS A 78 18.463 4.811 9.918 1.00 0.87 H new ATOM 0 HG3 LYS A 78 20.001 4.022 9.628 1.00 0.87 H new ATOM 0 HD2 LYS A 78 21.049 5.366 11.459 1.00 1.32 H new ATOM 0 HD3 LYS A 78 19.528 6.190 11.737 1.00 1.32 H new ATOM 0 HE2 LYS A 78 19.825 4.393 13.396 1.00 1.91 H new ATOM 0 HE3 LYS A 78 18.451 4.036 12.369 1.00 1.91 H new ATOM 0 HZ1 LYS A 78 19.975 2.132 12.777 1.00 2.53 H new ATOM 0 HZ2 LYS A 78 19.724 2.471 11.132 1.00 2.53 H new ATOM 0 HZ3 LYS A 78 21.173 2.939 11.884 1.00 2.53 H new ATOM 1207 N GLU A 79 20.054 4.167 5.751 1.00 0.19 N ATOM 1208 CA GLU A 79 20.899 3.245 4.979 1.00 0.22 C ATOM 1209 C GLU A 79 20.679 3.432 3.465 1.00 0.20 C ATOM 1210 O GLU A 79 19.613 3.884 3.021 1.00 0.18 O ATOM 1211 CB GLU A 79 20.587 1.791 5.382 1.00 0.24 C ATOM 1212 CG GLU A 79 21.220 1.334 6.712 1.00 0.55 C ATOM 1213 CD GLU A 79 22.706 1.034 6.587 1.00 1.17 C ATOM 1214 OE1 GLU A 79 23.052 -0.107 6.214 1.00 1.03 O ATOM 1215 OE2 GLU A 79 23.522 1.940 6.863 1.00 2.12 O ATOM 0 H GLU A 79 19.082 4.189 5.443 1.00 0.19 H new ATOM 0 HA GLU A 79 21.943 3.466 5.201 1.00 0.22 H new ATOM 0 HB2 GLU A 79 19.506 1.673 5.452 1.00 0.24 H new ATOM 0 HB3 GLU A 79 20.929 1.128 4.587 1.00 0.24 H new ATOM 0 HG2 GLU A 79 21.073 2.109 7.464 1.00 0.55 H new ATOM 0 HG3 GLU A 79 20.703 0.443 7.067 1.00 0.55 H new ATOM 1222 N GLU A 80 21.691 3.057 2.667 1.00 0.26 N ATOM 1223 CA GLU A 80 21.623 3.213 1.205 1.00 0.25 C ATOM 1224 C GLU A 80 21.671 1.883 0.430 1.00 0.27 C ATOM 1225 O GLU A 80 22.403 0.947 0.776 1.00 0.32 O ATOM 1226 CB GLU A 80 22.764 4.121 0.721 1.00 0.27 C ATOM 1227 CG GLU A 80 22.645 5.609 1.113 1.00 0.28 C ATOM 1228 CD GLU A 80 23.773 6.054 2.024 1.00 0.36 C ATOM 1229 OE1 GLU A 80 23.665 5.844 3.251 1.00 0.42 O ATOM 1230 OE2 GLU A 80 24.766 6.612 1.511 1.00 0.40 O ATOM 0 H GLU A 80 22.561 2.646 3.006 1.00 0.26 H new ATOM 0 HA GLU A 80 20.651 3.662 0.998 1.00 0.25 H new ATOM 0 HB2 GLU A 80 23.704 3.734 1.115 1.00 0.27 H new ATOM 0 HB3 GLU A 80 22.822 4.054 -0.365 1.00 0.27 H new ATOM 0 HG2 GLU A 80 22.645 6.222 0.211 1.00 0.28 H new ATOM 0 HG3 GLU A 80 21.690 5.776 1.612 1.00 0.28 H new ATOM 1237 N GLY A 81 20.873 1.856 -0.640 1.00 0.22 N ATOM 1238 CA GLY A 81 20.775 0.695 -1.527 1.00 0.23 C ATOM 1239 C GLY A 81 19.524 0.745 -2.401 1.00 0.19 C ATOM 1240 O GLY A 81 19.181 1.816 -2.924 1.00 0.18 O ATOM 0 H GLY A 81 20.278 2.637 -0.915 1.00 0.22 H new ATOM 0 HA2 GLY A 81 21.659 0.649 -2.163 1.00 0.23 H new ATOM 0 HA3 GLY A 81 20.764 -0.217 -0.930 1.00 0.23 H new ATOM 1244 N GLU A 82 18.830 -0.407 -2.600 1.00 0.20 N ATOM 1245 CA GLU A 82 17.597 -0.394 -3.400 1.00 0.17 C ATOM 1246 C GLU A 82 16.366 -0.726 -2.536 1.00 0.18 C ATOM 1247 O GLU A 82 16.181 -1.852 -2.096 1.00 0.30 O ATOM 1248 CB GLU A 82 17.705 -1.370 -4.586 1.00 0.19 C ATOM 1249 CG GLU A 82 18.727 -0.981 -5.669 1.00 0.26 C ATOM 1250 CD GLU A 82 18.432 -1.634 -7.006 1.00 0.86 C ATOM 1251 OE1 GLU A 82 17.434 -1.246 -7.649 1.00 0.78 O ATOM 1252 OE2 GLU A 82 19.198 -2.534 -7.412 1.00 1.75 O ATOM 0 H GLU A 82 19.097 -1.319 -2.229 1.00 0.20 H new ATOM 0 HA GLU A 82 17.468 0.614 -3.794 1.00 0.17 H new ATOM 0 HB2 GLU A 82 17.966 -2.356 -4.201 1.00 0.19 H new ATOM 0 HB3 GLU A 82 16.724 -1.460 -5.052 1.00 0.19 H new ATOM 0 HG2 GLU A 82 18.729 0.102 -5.790 1.00 0.26 H new ATOM 0 HG3 GLU A 82 19.726 -1.267 -5.341 1.00 0.26 H new ATOM 1259 N TYR A 83 15.511 0.282 -2.307 1.00 0.08 N ATOM 1260 CA TYR A 83 14.291 0.102 -1.493 1.00 0.08 C ATOM 1261 C TYR A 83 13.055 0.036 -2.388 1.00 0.08 C ATOM 1262 O TYR A 83 12.862 0.874 -3.259 1.00 0.12 O ATOM 1263 CB TYR A 83 14.139 1.227 -0.458 1.00 0.10 C ATOM 1264 CG TYR A 83 15.195 1.195 0.653 1.00 0.11 C ATOM 1265 CD1 TYR A 83 16.489 1.665 0.423 1.00 0.16 C ATOM 1266 CD2 TYR A 83 14.908 0.689 1.922 1.00 0.17 C ATOM 1267 CE1 TYR A 83 17.448 1.637 1.409 1.00 0.18 C ATOM 1268 CE2 TYR A 83 15.870 0.658 2.910 1.00 0.19 C ATOM 1269 CZ TYR A 83 17.134 1.134 2.649 1.00 0.16 C ATOM 1270 OH TYR A 83 18.090 1.095 3.632 1.00 0.21 O ATOM 0 H TYR A 83 15.637 1.227 -2.670 1.00 0.08 H new ATOM 0 HA TYR A 83 14.387 -0.841 -0.955 1.00 0.08 H new ATOM 0 HB2 TYR A 83 14.193 2.188 -0.970 1.00 0.10 H new ATOM 0 HB3 TYR A 83 13.149 1.161 -0.007 1.00 0.10 H new ATOM 0 HD1 TYR A 83 16.743 2.059 -0.550 1.00 0.16 H new ATOM 0 HD2 TYR A 83 13.917 0.316 2.134 1.00 0.17 H new ATOM 0 HE1 TYR A 83 18.442 2.008 1.210 1.00 0.18 H new ATOM 0 HE2 TYR A 83 15.632 0.261 3.886 1.00 0.19 H new ATOM 0 HH TYR A 83 17.705 0.712 4.448 1.00 0.21 H new ATOM 1280 N VAL A 84 12.215 -0.973 -2.156 1.00 0.08 N ATOM 1281 CA VAL A 84 11.007 -1.188 -3.001 1.00 0.10 C ATOM 1282 C VAL A 84 9.717 -0.959 -2.174 1.00 0.10 C ATOM 1283 O VAL A 84 9.497 -1.592 -1.134 1.00 0.10 O ATOM 1284 CB VAL A 84 10.967 -2.629 -3.744 1.00 0.11 C ATOM 1285 CG1 VAL A 84 10.079 -2.628 -5.019 1.00 0.13 C ATOM 1286 CG2 VAL A 84 12.355 -3.157 -4.175 1.00 0.20 C ATOM 0 H VAL A 84 12.333 -1.653 -1.405 1.00 0.08 H new ATOM 0 HA VAL A 84 11.065 -0.448 -3.799 1.00 0.10 H new ATOM 0 HB VAL A 84 10.548 -3.283 -2.979 1.00 0.11 H new ATOM 0 HG11 VAL A 84 10.092 -3.619 -5.472 1.00 0.13 H new ATOM 0 HG12 VAL A 84 9.056 -2.365 -4.750 1.00 0.13 H new ATOM 0 HG13 VAL A 84 10.465 -1.899 -5.731 1.00 0.13 H new ATOM 0 HG21 VAL A 84 12.241 -4.124 -4.664 1.00 0.20 H new ATOM 0 HG22 VAL A 84 12.813 -2.452 -4.869 1.00 0.20 H new ATOM 0 HG23 VAL A 84 12.991 -3.267 -3.297 1.00 0.20 H new ATOM 1296 N LEU A 85 8.870 -0.045 -2.689 1.00 0.12 N ATOM 1297 CA LEU A 85 7.592 0.286 -2.059 1.00 0.15 C ATOM 1298 C LEU A 85 6.431 -0.264 -2.912 1.00 0.16 C ATOM 1299 O LEU A 85 6.130 0.234 -4.008 1.00 0.21 O ATOM 1300 CB LEU A 85 7.508 1.818 -1.838 1.00 0.25 C ATOM 1301 CG LEU A 85 6.440 2.359 -0.827 1.00 0.43 C ATOM 1302 CD1 LEU A 85 7.030 3.424 0.095 1.00 0.78 C ATOM 1303 CD2 LEU A 85 5.231 2.957 -1.537 1.00 0.61 C ATOM 0 H LEU A 85 9.057 0.476 -3.546 1.00 0.12 H new ATOM 0 HA LEU A 85 7.514 -0.186 -1.080 1.00 0.15 H new ATOM 0 HB2 LEU A 85 8.487 2.161 -1.504 1.00 0.25 H new ATOM 0 HB3 LEU A 85 7.319 2.285 -2.805 1.00 0.25 H new ATOM 0 HG LEU A 85 6.122 1.497 -0.240 1.00 0.43 H new ATOM 0 HD11 LEU A 85 6.261 3.776 0.783 1.00 0.78 H new ATOM 0 HD12 LEU A 85 7.856 2.996 0.663 1.00 0.78 H new ATOM 0 HD13 LEU A 85 7.394 4.260 -0.502 1.00 0.78 H new ATOM 0 HD21 LEU A 85 4.517 3.319 -0.797 1.00 0.61 H new ATOM 0 HD22 LEU A 85 5.553 3.786 -2.167 1.00 0.61 H new ATOM 0 HD23 LEU A 85 4.758 2.194 -2.155 1.00 0.61 H new ATOM 1315 N VAL A 86 5.832 -1.343 -2.385 1.00 0.17 N ATOM 1316 CA VAL A 86 4.698 -2.060 -3.024 1.00 0.21 C ATOM 1317 C VAL A 86 3.429 -1.854 -2.152 1.00 0.21 C ATOM 1318 O VAL A 86 3.445 -2.081 -0.935 1.00 0.27 O ATOM 1319 CB VAL A 86 4.933 -3.648 -3.244 1.00 0.25 C ATOM 1320 CG1 VAL A 86 4.125 -4.209 -4.447 1.00 0.44 C ATOM 1321 CG2 VAL A 86 6.412 -4.077 -3.438 1.00 0.32 C ATOM 0 H VAL A 86 6.118 -1.753 -1.496 1.00 0.17 H new ATOM 0 HA VAL A 86 4.592 -1.634 -4.022 1.00 0.21 H new ATOM 0 HB VAL A 86 4.578 -4.070 -2.304 1.00 0.25 H new ATOM 0 HG11 VAL A 86 4.319 -5.277 -4.549 1.00 0.44 H new ATOM 0 HG12 VAL A 86 3.060 -4.048 -4.277 1.00 0.44 H new ATOM 0 HG13 VAL A 86 4.428 -3.696 -5.360 1.00 0.44 H new ATOM 0 HG21 VAL A 86 6.462 -5.157 -3.577 1.00 0.32 H new ATOM 0 HG22 VAL A 86 6.823 -3.578 -4.316 1.00 0.32 H new ATOM 0 HG23 VAL A 86 6.990 -3.797 -2.558 1.00 0.32 H new ATOM 1331 N LEU A 87 2.343 -1.431 -2.802 1.00 0.20 N ATOM 1332 CA LEU A 87 1.068 -1.199 -2.100 1.00 0.22 C ATOM 1333 C LEU A 87 -0.118 -1.870 -2.801 1.00 0.22 C ATOM 1334 O LEU A 87 -0.228 -1.858 -4.041 1.00 0.26 O ATOM 1335 CB LEU A 87 0.743 0.326 -1.917 1.00 0.31 C ATOM 1336 CG LEU A 87 1.505 1.367 -2.799 1.00 0.50 C ATOM 1337 CD1 LEU A 87 1.021 1.383 -4.249 1.00 1.25 C ATOM 1338 CD2 LEU A 87 1.376 2.774 -2.213 1.00 0.88 C ATOM 0 H LEU A 87 2.315 -1.242 -3.804 1.00 0.20 H new ATOM 0 HA LEU A 87 1.207 -1.651 -1.118 1.00 0.22 H new ATOM 0 HB2 LEU A 87 -0.324 0.460 -2.095 1.00 0.31 H new ATOM 0 HB3 LEU A 87 0.927 0.580 -0.873 1.00 0.31 H new ATOM 0 HG LEU A 87 2.550 1.056 -2.798 1.00 0.50 H new ATOM 0 HD11 LEU A 87 1.586 2.125 -4.813 1.00 1.25 H new ATOM 0 HD12 LEU A 87 1.170 0.399 -4.693 1.00 1.25 H new ATOM 0 HD13 LEU A 87 -0.039 1.637 -4.276 1.00 1.25 H new ATOM 0 HD21 LEU A 87 1.914 3.482 -2.844 1.00 0.88 H new ATOM 0 HD22 LEU A 87 0.324 3.055 -2.169 1.00 0.88 H new ATOM 0 HD23 LEU A 87 1.798 2.790 -1.208 1.00 0.88 H new ATOM 1350 N LYS A 88 -1.016 -2.460 -1.980 1.00 0.23 N ATOM 1351 CA LYS A 88 -2.248 -3.089 -2.506 1.00 0.26 C ATOM 1352 C LYS A 88 -3.457 -2.183 -2.226 1.00 0.27 C ATOM 1353 O LYS A 88 -3.834 -1.960 -1.070 1.00 0.29 O ATOM 1354 CB LYS A 88 -2.496 -4.484 -1.882 1.00 0.31 C ATOM 1355 CG LYS A 88 -3.057 -5.568 -2.838 1.00 0.46 C ATOM 1356 CD LYS A 88 -1.935 -6.233 -3.679 1.00 1.53 C ATOM 1357 CE LYS A 88 -2.465 -7.149 -4.799 1.00 2.13 C ATOM 1358 NZ LYS A 88 -3.021 -8.415 -4.264 1.00 2.52 N ATOM 0 H LYS A 88 -0.914 -2.514 -0.967 1.00 0.23 H new ATOM 0 HA LYS A 88 -2.117 -3.219 -3.580 1.00 0.26 H new ATOM 0 HB2 LYS A 88 -1.556 -4.846 -1.466 1.00 0.31 H new ATOM 0 HB3 LYS A 88 -3.189 -4.369 -1.049 1.00 0.31 H new ATOM 0 HG2 LYS A 88 -3.576 -6.331 -2.258 1.00 0.46 H new ATOM 0 HG3 LYS A 88 -3.793 -5.119 -3.505 1.00 0.46 H new ATOM 0 HD2 LYS A 88 -1.314 -5.454 -4.121 1.00 1.53 H new ATOM 0 HD3 LYS A 88 -1.293 -6.815 -3.018 1.00 1.53 H new ATOM 0 HE2 LYS A 88 -3.236 -6.624 -5.362 1.00 2.13 H new ATOM 0 HE3 LYS A 88 -1.658 -7.373 -5.496 1.00 2.13 H new ATOM 0 HZ1 LYS A 88 -3.304 -9.031 -5.053 1.00 2.52 H new ATOM 0 HZ2 LYS A 88 -2.299 -8.897 -3.691 1.00 2.52 H new ATOM 0 HZ3 LYS A 88 -3.851 -8.207 -3.672 1.00 2.52 H new ATOM 1372 N PHE A 89 -4.066 -1.672 -3.304 1.00 0.27 N ATOM 1373 CA PHE A 89 -5.233 -0.778 -3.188 1.00 0.29 C ATOM 1374 C PHE A 89 -6.541 -1.512 -3.564 1.00 0.31 C ATOM 1375 O PHE A 89 -6.592 -2.283 -4.531 1.00 0.32 O ATOM 1376 CB PHE A 89 -5.076 0.460 -4.105 1.00 0.30 C ATOM 1377 CG PHE A 89 -4.300 1.650 -3.522 1.00 0.28 C ATOM 1378 CD1 PHE A 89 -4.673 2.262 -2.309 1.00 0.36 C ATOM 1379 CD2 PHE A 89 -3.168 2.141 -4.175 1.00 0.25 C ATOM 1380 CE1 PHE A 89 -3.933 3.312 -1.793 1.00 0.40 C ATOM 1381 CE2 PHE A 89 -2.441 3.195 -3.656 1.00 0.26 C ATOM 1382 CZ PHE A 89 -2.948 3.856 -2.458 1.00 0.31 C ATOM 0 H PHE A 89 -3.774 -1.859 -4.263 1.00 0.27 H new ATOM 0 HA PHE A 89 -5.286 -0.458 -2.148 1.00 0.29 H new ATOM 0 HB2 PHE A 89 -4.578 0.144 -5.022 1.00 0.30 H new ATOM 0 HB3 PHE A 89 -6.071 0.806 -4.385 1.00 0.30 H new ATOM 0 HD1 PHE A 89 -5.544 1.909 -1.777 1.00 0.36 H new ATOM 0 HD2 PHE A 89 -2.854 1.688 -5.104 1.00 0.25 H new ATOM 0 HE1 PHE A 89 -4.177 3.693 -0.812 1.00 0.40 H new ATOM 0 HE2 PHE A 89 -1.524 3.520 -4.124 1.00 0.26 H new ATOM 0 HZ PHE A 89 -2.513 4.786 -2.124 1.00 0.31 H new ATOM 1392 N ALA A 90 -7.600 -1.277 -2.756 1.00 0.33 N ATOM 1393 CA ALA A 90 -8.939 -1.911 -2.961 1.00 0.36 C ATOM 1394 C ALA A 90 -10.101 -0.895 -2.694 1.00 0.39 C ATOM 1395 O ALA A 90 -9.950 0.062 -1.905 1.00 0.37 O ATOM 1396 CB ALA A 90 -9.099 -3.175 -2.066 1.00 0.41 C ATOM 0 H ALA A 90 -7.561 -0.652 -1.951 1.00 0.33 H new ATOM 0 HA ALA A 90 -8.999 -2.219 -4.005 1.00 0.36 H new ATOM 0 HB1 ALA A 90 -10.081 -3.618 -2.234 1.00 0.41 H new ATOM 0 HB2 ALA A 90 -8.326 -3.900 -2.319 1.00 0.41 H new ATOM 0 HB3 ALA A 90 -9.002 -2.893 -1.018 1.00 0.41 H new ATOM 1402 N GLU A 91 -11.261 -1.098 -3.375 1.00 0.46 N ATOM 1403 CA GLU A 91 -12.447 -0.227 -3.211 1.00 0.53 C ATOM 1404 C GLU A 91 -13.760 -1.022 -3.344 1.00 0.63 C ATOM 1405 O GLU A 91 -14.007 -1.672 -4.367 1.00 1.23 O ATOM 1406 CB GLU A 91 -12.429 0.910 -4.255 1.00 0.78 C ATOM 1407 CG GLU A 91 -13.268 2.145 -3.882 1.00 1.80 C ATOM 1408 CD GLU A 91 -13.341 3.162 -5.006 1.00 2.04 C ATOM 1409 OE1 GLU A 91 -14.087 2.919 -5.979 1.00 1.94 O ATOM 1410 OE2 GLU A 91 -12.655 4.200 -4.912 1.00 2.61 O ATOM 0 H GLU A 91 -11.395 -1.858 -4.042 1.00 0.46 H new ATOM 0 HA GLU A 91 -12.402 0.196 -2.207 1.00 0.53 H new ATOM 0 HB2 GLU A 91 -11.397 1.224 -4.411 1.00 0.78 H new ATOM 0 HB3 GLU A 91 -12.790 0.517 -5.205 1.00 0.78 H new ATOM 0 HG2 GLU A 91 -14.277 1.828 -3.618 1.00 1.80 H new ATOM 0 HG3 GLU A 91 -12.840 2.617 -2.997 1.00 1.80 H new ATOM 1417 N VAL A 92 -14.607 -0.945 -2.297 1.00 0.60 N ATOM 1418 CA VAL A 92 -15.924 -1.652 -2.280 1.00 0.76 C ATOM 1419 C VAL A 92 -17.045 -0.767 -1.662 1.00 0.66 C ATOM 1420 O VAL A 92 -17.441 -0.964 -0.506 1.00 1.19 O ATOM 1421 CB VAL A 92 -15.949 -3.102 -1.575 1.00 1.42 C ATOM 1422 CG1 VAL A 92 -15.837 -4.229 -2.616 1.00 2.13 C ATOM 1423 CG2 VAL A 92 -14.878 -3.341 -0.462 1.00 2.00 C ATOM 0 H VAL A 92 -14.413 -0.406 -1.453 1.00 0.60 H new ATOM 0 HA VAL A 92 -16.111 -1.835 -3.338 1.00 0.76 H new ATOM 0 HB VAL A 92 -16.916 -3.119 -1.073 1.00 1.42 H new ATOM 0 HG11 VAL A 92 -15.857 -5.194 -2.111 1.00 2.13 H new ATOM 0 HG12 VAL A 92 -16.674 -4.166 -3.311 1.00 2.13 H new ATOM 0 HG13 VAL A 92 -14.901 -4.126 -3.165 1.00 2.13 H new ATOM 0 HG21 VAL A 92 -14.990 -4.348 -0.060 1.00 2.00 H new ATOM 0 HG22 VAL A 92 -13.880 -3.228 -0.887 1.00 2.00 H new ATOM 0 HG23 VAL A 92 -15.016 -2.613 0.338 1.00 2.00 H new ATOM 1433 N TYR A 93 -17.545 0.208 -2.451 1.00 0.76 N ATOM 1434 CA TYR A 93 -18.629 1.123 -2.011 1.00 0.80 C ATOM 1435 C TYR A 93 -19.169 1.997 -3.167 1.00 0.86 C ATOM 1436 O TYR A 93 -20.387 2.104 -3.337 1.00 1.46 O ATOM 1437 CB TYR A 93 -18.161 2.036 -0.853 1.00 1.23 C ATOM 1438 CG TYR A 93 -19.221 2.265 0.240 1.00 0.97 C ATOM 1439 CD1 TYR A 93 -19.372 1.373 1.310 1.00 1.14 C ATOM 1440 CD2 TYR A 93 -20.067 3.379 0.204 1.00 1.01 C ATOM 1441 CE1 TYR A 93 -20.324 1.586 2.293 1.00 1.47 C ATOM 1442 CE2 TYR A 93 -21.018 3.589 1.188 1.00 1.43 C ATOM 1443 CZ TYR A 93 -21.151 2.667 2.221 1.00 1.67 C ATOM 1444 OH TYR A 93 -22.085 2.906 3.203 1.00 2.27 O ATOM 0 H TYR A 93 -17.216 0.385 -3.400 1.00 0.76 H new ATOM 0 HA TYR A 93 -19.439 0.484 -1.661 1.00 0.80 H new ATOM 0 HB2 TYR A 93 -17.274 1.598 -0.396 1.00 1.23 H new ATOM 0 HB3 TYR A 93 -17.865 3.001 -1.264 1.00 1.23 H new ATOM 0 HD1 TYR A 93 -18.734 0.503 1.369 1.00 1.14 H new ATOM 0 HD2 TYR A 93 -19.976 4.088 -0.606 1.00 1.01 H new ATOM 0 HE1 TYR A 93 -20.411 0.894 3.118 1.00 1.47 H new ATOM 0 HE2 TYR A 93 -21.652 4.463 1.154 1.00 1.43 H new ATOM 0 HH TYR A 93 -22.585 3.721 2.987 1.00 2.27 H new ATOM 1454 N PHE A 94 -18.261 2.621 -3.959 1.00 0.78 N ATOM 1455 CA PHE A 94 -18.652 3.493 -5.086 1.00 0.82 C ATOM 1456 C PHE A 94 -18.183 2.919 -6.435 1.00 0.76 C ATOM 1457 O PHE A 94 -16.997 2.614 -6.617 1.00 0.79 O ATOM 1458 CB PHE A 94 -18.067 4.912 -4.912 1.00 1.01 C ATOM 1459 CG PHE A 94 -18.377 5.570 -3.567 1.00 1.11 C ATOM 1460 CD1 PHE A 94 -19.619 6.158 -3.331 1.00 1.31 C ATOM 1461 CD2 PHE A 94 -17.429 5.596 -2.540 1.00 1.13 C ATOM 1462 CE1 PHE A 94 -19.907 6.752 -2.109 1.00 1.46 C ATOM 1463 CE2 PHE A 94 -17.716 6.190 -1.321 1.00 1.23 C ATOM 1464 CZ PHE A 94 -18.954 6.767 -1.104 1.00 1.37 C ATOM 0 H PHE A 94 -17.252 2.534 -3.834 1.00 0.78 H new ATOM 0 HA PHE A 94 -19.741 3.544 -5.085 1.00 0.82 H new ATOM 0 HB2 PHE A 94 -16.985 4.862 -5.036 1.00 1.01 H new ATOM 0 HB3 PHE A 94 -18.450 5.549 -5.710 1.00 1.01 H new ATOM 0 HD1 PHE A 94 -20.368 6.151 -4.109 1.00 1.31 H new ATOM 0 HD2 PHE A 94 -16.460 5.147 -2.699 1.00 1.13 H new ATOM 0 HE1 PHE A 94 -20.874 7.202 -1.942 1.00 1.46 H new ATOM 0 HE2 PHE A 94 -16.971 6.202 -0.539 1.00 1.23 H new ATOM 0 HZ PHE A 94 -19.177 7.228 -0.153 1.00 1.37 H new ATOM 1474 N ALA A 95 -19.134 2.790 -7.394 1.00 0.73 N ATOM 1475 CA ALA A 95 -18.845 2.246 -8.742 1.00 0.73 C ATOM 1476 C ALA A 95 -18.777 3.369 -9.823 1.00 0.72 C ATOM 1477 O ALA A 95 -19.797 3.948 -10.246 1.00 0.84 O ATOM 1478 CB ALA A 95 -19.877 1.145 -9.113 1.00 0.82 C ATOM 0 H ALA A 95 -20.109 3.056 -7.257 1.00 0.73 H new ATOM 0 HA ALA A 95 -17.857 1.787 -8.715 1.00 0.73 H new ATOM 0 HB1 ALA A 95 -19.652 0.755 -10.106 1.00 0.82 H new ATOM 0 HB2 ALA A 95 -19.824 0.336 -8.385 1.00 0.82 H new ATOM 0 HB3 ALA A 95 -20.880 1.571 -9.109 1.00 0.82 H new ATOM 1484 N GLN A 96 -17.532 3.710 -10.211 1.00 0.65 N ATOM 1485 CA GLN A 96 -17.267 4.747 -11.233 1.00 0.66 C ATOM 1486 C GLN A 96 -15.847 4.613 -11.826 1.00 0.58 C ATOM 1487 O GLN A 96 -14.879 4.327 -11.109 1.00 0.53 O ATOM 1488 CB GLN A 96 -17.454 6.162 -10.631 1.00 0.72 C ATOM 1489 CG GLN A 96 -17.990 7.232 -11.608 1.00 1.40 C ATOM 1490 CD GLN A 96 -19.468 7.063 -11.927 1.00 1.85 C ATOM 1491 OE1 GLN A 96 -20.329 7.602 -11.233 1.00 2.38 O ATOM 1492 NE2 GLN A 96 -19.768 6.316 -12.984 1.00 2.45 N ATOM 0 H GLN A 96 -16.689 3.281 -9.831 1.00 0.65 H new ATOM 0 HA GLN A 96 -17.986 4.601 -12.039 1.00 0.66 H new ATOM 0 HB2 GLN A 96 -18.138 6.091 -9.785 1.00 0.72 H new ATOM 0 HB3 GLN A 96 -16.495 6.501 -10.238 1.00 0.72 H new ATOM 0 HG2 GLN A 96 -17.828 8.221 -11.179 1.00 1.40 H new ATOM 0 HG3 GLN A 96 -17.417 7.189 -12.534 1.00 1.40 H new ATOM 0 HE21 GLN A 96 -19.023 5.887 -13.533 1.00 2.45 H new ATOM 0 HE22 GLN A 96 -20.743 6.172 -13.246 1.00 2.45 H new ATOM 1501 N SER A 97 -15.732 4.857 -13.148 1.00 0.64 N ATOM 1502 CA SER A 97 -14.445 4.750 -13.869 1.00 0.62 C ATOM 1503 C SER A 97 -14.110 6.014 -14.680 1.00 0.81 C ATOM 1504 O SER A 97 -14.873 6.426 -15.562 1.00 1.66 O ATOM 1505 CB SER A 97 -14.471 3.545 -14.819 1.00 0.68 C ATOM 1506 OG SER A 97 -14.356 2.318 -14.120 1.00 0.73 O ATOM 0 H SER A 97 -16.517 5.130 -13.740 1.00 0.64 H new ATOM 0 HA SER A 97 -13.673 4.625 -13.110 1.00 0.62 H new ATOM 0 HB2 SER A 97 -15.400 3.552 -15.389 1.00 0.68 H new ATOM 0 HB3 SER A 97 -13.656 3.631 -15.537 1.00 0.68 H new ATOM 0 HG SER A 97 -14.378 1.575 -14.758 1.00 0.73 H new ATOM 1512 N GLN A 98 -12.923 6.619 -14.361 1.00 0.55 N ATOM 1513 CA GLN A 98 -12.369 7.872 -15.004 1.00 0.54 C ATOM 1514 C GLN A 98 -13.203 9.151 -14.675 1.00 0.56 C ATOM 1515 O GLN A 98 -13.674 9.869 -15.566 1.00 0.67 O ATOM 1516 CB GLN A 98 -12.221 7.704 -16.545 1.00 0.62 C ATOM 1517 CG GLN A 98 -10.771 7.625 -17.076 1.00 1.06 C ATOM 1518 CD GLN A 98 -10.061 8.971 -17.061 1.00 1.14 C ATOM 1519 OE1 GLN A 98 -10.120 9.727 -18.031 1.00 1.89 O ATOM 1520 NE2 GLN A 98 -9.386 9.274 -15.957 1.00 1.60 N ATOM 0 H GLN A 98 -12.308 6.248 -13.637 1.00 0.55 H new ATOM 0 HA GLN A 98 -11.380 8.016 -14.569 1.00 0.54 H new ATOM 0 HB2 GLN A 98 -12.748 6.798 -16.845 1.00 0.62 H new ATOM 0 HB3 GLN A 98 -12.722 8.540 -17.033 1.00 0.62 H new ATOM 0 HG2 GLN A 98 -10.206 6.915 -16.472 1.00 1.06 H new ATOM 0 HG3 GLN A 98 -10.783 7.238 -18.095 1.00 1.06 H new ATOM 0 HE21 GLN A 98 -9.364 8.618 -15.177 1.00 1.60 H new ATOM 0 HE22 GLN A 98 -8.890 10.163 -15.890 1.00 1.60 H new ATOM 1529 N GLN A 99 -13.360 9.392 -13.373 1.00 0.53 N ATOM 1530 CA GLN A 99 -14.133 10.521 -12.817 1.00 0.58 C ATOM 1531 C GLN A 99 -13.654 10.813 -11.381 1.00 0.57 C ATOM 1532 O GLN A 99 -13.556 11.976 -10.978 1.00 0.62 O ATOM 1533 CB GLN A 99 -15.646 10.206 -12.822 1.00 0.61 C ATOM 1534 CG GLN A 99 -16.565 11.439 -12.825 1.00 1.18 C ATOM 1535 CD GLN A 99 -18.035 11.066 -12.759 1.00 1.71 C ATOM 1536 OE1 GLN A 99 -18.685 10.875 -13.788 1.00 2.56 O ATOM 1537 NE2 GLN A 99 -18.568 10.961 -11.547 1.00 2.02 N ATOM 0 H GLN A 99 -12.947 8.799 -12.653 1.00 0.53 H new ATOM 0 HA GLN A 99 -13.969 11.400 -13.440 1.00 0.58 H new ATOM 0 HB2 GLN A 99 -15.873 9.600 -13.699 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -15.879 9.600 -11.947 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -16.316 12.076 -11.976 1.00 1.18 H new ATOM 0 HG3 GLN A 99 -16.381 12.023 -13.727 1.00 1.18 H new ATOM 0 HE21 GLN A 99 -17.993 11.128 -10.721 1.00 2.02 H new ATOM 0 HE22 GLN A 99 -19.552 10.714 -11.442 1.00 2.02 H new ATOM 1546 N LYS A 100 -13.362 9.727 -10.614 1.00 0.53 N ATOM 1547 CA LYS A 100 -12.829 9.822 -9.251 1.00 0.55 C ATOM 1548 C LYS A 100 -11.352 9.391 -9.286 1.00 0.48 C ATOM 1549 O LYS A 100 -11.001 8.244 -8.992 1.00 0.49 O ATOM 1550 CB LYS A 100 -13.644 8.944 -8.277 1.00 0.64 C ATOM 1551 CG LYS A 100 -15.004 9.547 -7.863 1.00 1.11 C ATOM 1552 CD LYS A 100 -15.815 8.608 -6.941 1.00 1.52 C ATOM 1553 CE LYS A 100 -17.130 9.246 -6.462 1.00 2.14 C ATOM 1554 NZ LYS A 100 -17.915 8.312 -5.610 1.00 2.76 N ATOM 0 H LYS A 100 -13.494 8.768 -10.935 1.00 0.53 H new ATOM 0 HA LYS A 100 -12.906 10.848 -8.890 1.00 0.55 H new ATOM 0 HB2 LYS A 100 -13.817 7.972 -8.740 1.00 0.64 H new ATOM 0 HB3 LYS A 100 -13.050 8.769 -7.380 1.00 0.64 H new ATOM 0 HG2 LYS A 100 -14.836 10.495 -7.353 1.00 1.11 H new ATOM 0 HG3 LYS A 100 -15.588 9.765 -8.757 1.00 1.11 H new ATOM 0 HD2 LYS A 100 -16.036 7.683 -7.474 1.00 1.52 H new ATOM 0 HD3 LYS A 100 -15.208 8.340 -6.076 1.00 1.52 H new ATOM 0 HE2 LYS A 100 -16.911 10.154 -5.901 1.00 2.14 H new ATOM 0 HE3 LYS A 100 -17.727 9.541 -7.325 1.00 2.14 H new ATOM 0 HZ1 LYS A 100 -18.573 8.855 -5.015 1.00 2.76 H new ATOM 0 HZ2 LYS A 100 -18.453 7.659 -6.215 1.00 2.76 H new ATOM 0 HZ3 LYS A 100 -17.268 7.768 -5.004 1.00 2.76 H new ATOM 1568 N VAL A 101 -10.498 10.363 -9.650 1.00 0.45 N ATOM 1569 CA VAL A 101 -9.037 10.149 -9.823 1.00 0.40 C ATOM 1570 C VAL A 101 -8.228 10.798 -8.675 1.00 0.41 C ATOM 1571 O VAL A 101 -8.404 11.977 -8.344 1.00 0.47 O ATOM 1572 CB VAL A 101 -8.454 10.613 -11.246 1.00 0.38 C ATOM 1573 CG1 VAL A 101 -8.395 9.435 -12.237 1.00 0.69 C ATOM 1574 CG2 VAL A 101 -9.199 11.794 -11.941 1.00 0.68 C ATOM 0 H VAL A 101 -10.794 11.322 -9.834 1.00 0.45 H new ATOM 0 HA VAL A 101 -8.914 9.067 -9.788 1.00 0.40 H new ATOM 0 HB VAL A 101 -7.459 10.980 -10.994 1.00 0.38 H new ATOM 0 HG11 VAL A 101 -7.996 9.781 -13.190 1.00 0.69 H new ATOM 0 HG12 VAL A 101 -7.749 8.654 -11.836 1.00 0.69 H new ATOM 0 HG13 VAL A 101 -9.398 9.035 -12.387 1.00 0.69 H new ATOM 0 HG21 VAL A 101 -8.717 12.019 -12.892 1.00 0.68 H new ATOM 0 HG22 VAL A 101 -10.238 11.515 -12.117 1.00 0.68 H new ATOM 0 HG23 VAL A 101 -9.164 12.674 -11.299 1.00 0.68 H new ATOM 1584 N PHE A 102 -7.322 9.992 -8.105 1.00 0.39 N ATOM 1585 CA PHE A 102 -6.507 10.396 -6.943 1.00 0.40 C ATOM 1586 C PHE A 102 -5.017 10.661 -7.242 1.00 0.38 C ATOM 1587 O PHE A 102 -4.512 10.374 -8.331 1.00 0.41 O ATOM 1588 CB PHE A 102 -6.595 9.269 -5.908 1.00 0.42 C ATOM 1589 CG PHE A 102 -8.017 8.954 -5.433 1.00 0.49 C ATOM 1590 CD1 PHE A 102 -8.813 9.939 -4.852 1.00 0.60 C ATOM 1591 CD2 PHE A 102 -8.574 7.679 -5.606 1.00 0.60 C ATOM 1592 CE1 PHE A 102 -10.111 9.666 -4.464 1.00 0.67 C ATOM 1593 CE2 PHE A 102 -9.870 7.406 -5.207 1.00 0.70 C ATOM 1594 CZ PHE A 102 -10.638 8.399 -4.638 1.00 0.69 C ATOM 0 H PHE A 102 -7.131 9.045 -8.432 1.00 0.39 H new ATOM 0 HA PHE A 102 -6.911 11.347 -6.596 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -6.159 8.366 -6.335 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -5.988 9.538 -5.044 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -8.410 10.930 -4.703 1.00 0.60 H new ATOM 0 HD2 PHE A 102 -7.982 6.897 -6.058 1.00 0.60 H new ATOM 0 HE1 PHE A 102 -10.716 10.445 -4.023 1.00 0.67 H new ATOM 0 HE2 PHE A 102 -10.280 6.416 -5.341 1.00 0.70 H new ATOM 0 HZ PHE A 102 -11.651 8.188 -4.328 1.00 0.69 H new ATOM 1604 N ASP A 103 -4.316 11.221 -6.229 1.00 0.36 N ATOM 1605 CA ASP A 103 -2.866 11.517 -6.340 1.00 0.34 C ATOM 1606 C ASP A 103 -2.067 10.751 -5.270 1.00 0.32 C ATOM 1607 O ASP A 103 -2.460 10.701 -4.104 1.00 0.34 O ATOM 1608 CB ASP A 103 -2.542 13.023 -6.205 1.00 0.37 C ATOM 1609 CG ASP A 103 -3.128 13.928 -7.292 1.00 0.85 C ATOM 1610 OD1 ASP A 103 -3.816 13.412 -8.196 1.00 1.30 O ATOM 1611 OD2 ASP A 103 -2.891 15.154 -7.231 1.00 1.33 O ATOM 0 H ASP A 103 -4.726 11.476 -5.331 1.00 0.36 H new ATOM 0 HA ASP A 103 -2.576 11.194 -7.340 1.00 0.34 H new ATOM 0 HB2 ASP A 103 -2.904 13.368 -5.237 1.00 0.37 H new ATOM 0 HB3 ASP A 103 -1.459 13.144 -6.202 1.00 0.37 H new ATOM 1616 N VAL A 104 -0.925 10.173 -5.683 1.00 0.29 N ATOM 1617 CA VAL A 104 -0.057 9.371 -4.784 1.00 0.28 C ATOM 1618 C VAL A 104 1.451 9.850 -4.933 1.00 0.26 C ATOM 1619 O VAL A 104 2.008 9.878 -6.051 1.00 0.25 O ATOM 1620 CB VAL A 104 -0.360 7.788 -5.035 1.00 0.33 C ATOM 1621 CG1 VAL A 104 0.813 6.821 -4.798 1.00 0.31 C ATOM 1622 CG2 VAL A 104 -1.514 7.294 -4.138 1.00 0.48 C ATOM 0 H VAL A 104 -0.575 10.244 -6.638 1.00 0.29 H new ATOM 0 HA VAL A 104 -0.278 9.531 -3.729 1.00 0.28 H new ATOM 0 HB VAL A 104 -0.599 7.762 -6.098 1.00 0.33 H new ATOM 0 HG11 VAL A 104 0.488 5.800 -4.997 1.00 0.31 H new ATOM 0 HG12 VAL A 104 1.636 7.077 -5.465 1.00 0.31 H new ATOM 0 HG13 VAL A 104 1.147 6.901 -3.763 1.00 0.31 H new ATOM 0 HG21 VAL A 104 -1.694 6.236 -4.327 1.00 0.48 H new ATOM 0 HG22 VAL A 104 -1.247 7.436 -3.091 1.00 0.48 H new ATOM 0 HG23 VAL A 104 -2.417 7.861 -4.362 1.00 0.48 H new ATOM 1632 N ARG A 105 2.087 10.162 -3.763 1.00 0.26 N ATOM 1633 CA ARG A 105 3.482 10.695 -3.704 1.00 0.26 C ATOM 1634 C ARG A 105 4.451 9.946 -2.743 1.00 0.23 C ATOM 1635 O ARG A 105 4.028 9.376 -1.728 1.00 0.26 O ATOM 1636 CB ARG A 105 3.452 12.157 -3.209 1.00 0.33 C ATOM 1637 CG ARG A 105 2.426 13.070 -3.896 1.00 0.53 C ATOM 1638 CD ARG A 105 2.557 14.534 -3.444 1.00 0.51 C ATOM 1639 NE ARG A 105 1.386 15.309 -3.821 1.00 0.92 N ATOM 1640 CZ ARG A 105 1.398 16.623 -4.053 1.00 1.25 C ATOM 1641 NH1 ARG A 105 2.512 17.328 -3.887 1.00 1.15 N ATOM 1642 NH2 ARG A 105 0.289 17.239 -4.437 1.00 1.69 N ATOM 0 H ARG A 105 1.652 10.052 -2.847 1.00 0.26 H new ATOM 0 HA ARG A 105 3.856 10.571 -4.720 1.00 0.26 H new ATOM 0 HB2 ARG A 105 3.250 12.155 -2.138 1.00 0.33 H new ATOM 0 HB3 ARG A 105 4.444 12.588 -3.345 1.00 0.33 H new ATOM 0 HG2 ARG A 105 2.557 13.012 -4.977 1.00 0.53 H new ATOM 0 HG3 ARG A 105 1.420 12.712 -3.677 1.00 0.53 H new ATOM 0 HD2 ARG A 105 2.689 14.573 -2.363 1.00 0.51 H new ATOM 0 HD3 ARG A 105 3.448 14.976 -3.890 1.00 0.51 H new ATOM 0 HE ARG A 105 0.498 14.816 -3.914 1.00 0.92 H new ATOM 0 HH11 ARG A 105 3.367 16.865 -3.580 1.00 1.15 H new ATOM 0 HH12 ARG A 105 2.512 18.332 -4.067 1.00 1.15 H new ATOM 0 HH21 ARG A 105 -0.574 16.709 -4.555 1.00 1.69 H new ATOM 0 HH22 ARG A 105 0.299 18.243 -4.614 1.00 1.69 H new ATOM 1656 N VAL A 106 5.781 10.015 -3.072 1.00 0.23 N ATOM 1657 CA VAL A 106 6.874 9.413 -2.225 1.00 0.23 C ATOM 1658 C VAL A 106 8.037 10.424 -1.926 1.00 0.22 C ATOM 1659 O VAL A 106 8.783 10.820 -2.826 1.00 0.23 O ATOM 1660 CB VAL A 106 7.493 8.017 -2.722 1.00 0.29 C ATOM 1661 CG1 VAL A 106 6.656 6.818 -2.239 1.00 0.57 C ATOM 1662 CG2 VAL A 106 7.705 7.887 -4.251 1.00 0.60 C ATOM 0 H VAL A 106 6.124 10.479 -3.913 1.00 0.23 H new ATOM 0 HA VAL A 106 6.333 9.179 -1.308 1.00 0.23 H new ATOM 0 HB VAL A 106 8.483 8.009 -2.267 1.00 0.29 H new ATOM 0 HG11 VAL A 106 7.107 5.892 -2.596 1.00 0.57 H new ATOM 0 HG12 VAL A 106 6.626 6.811 -1.149 1.00 0.57 H new ATOM 0 HG13 VAL A 106 5.642 6.901 -2.630 1.00 0.57 H new ATOM 0 HG21 VAL A 106 8.127 6.908 -4.478 1.00 0.60 H new ATOM 0 HG22 VAL A 106 6.748 7.997 -4.762 1.00 0.60 H new ATOM 0 HG23 VAL A 106 8.389 8.664 -4.591 1.00 0.60 H new ATOM 1672 N ASN A 107 8.159 10.824 -0.613 1.00 0.23 N ATOM 1673 CA ASN A 107 9.176 11.807 -0.048 1.00 0.23 C ATOM 1674 C ASN A 107 9.044 13.257 -0.611 1.00 0.24 C ATOM 1675 O ASN A 107 10.023 14.014 -0.646 1.00 0.25 O ATOM 1676 CB ASN A 107 10.630 11.306 -0.240 1.00 0.23 C ATOM 1677 CG ASN A 107 11.482 11.374 1.024 1.00 0.27 C ATOM 1678 OD1 ASN A 107 12.312 10.504 1.276 1.00 1.05 O ATOM 1679 ND2 ASN A 107 11.297 12.431 1.806 1.00 1.12 N ATOM 0 H ASN A 107 7.536 10.464 0.110 1.00 0.23 H new ATOM 0 HA ASN A 107 8.945 11.857 1.016 1.00 0.23 H new ATOM 0 HB2 ASN A 107 10.604 10.275 -0.594 1.00 0.23 H new ATOM 0 HB3 ASN A 107 11.108 11.899 -1.020 1.00 0.23 H new ATOM 0 HD21 ASN A 107 11.855 12.543 2.652 1.00 1.12 H new ATOM 0 HD22 ASN A 107 10.597 13.131 1.560 1.00 1.12 H new ATOM 1686 N GLY A 108 7.823 13.627 -1.031 1.00 0.25 N ATOM 1687 CA GLY A 108 7.590 14.930 -1.633 1.00 0.29 C ATOM 1688 C GLY A 108 7.394 14.883 -3.168 1.00 0.29 C ATOM 1689 O GLY A 108 6.848 15.817 -3.759 1.00 0.32 O ATOM 0 H GLY A 108 6.993 13.039 -0.961 1.00 0.25 H new ATOM 0 HA2 GLY A 108 6.707 15.378 -1.177 1.00 0.29 H new ATOM 0 HA3 GLY A 108 8.433 15.582 -1.403 1.00 0.29 H new ATOM 1693 N HIS A 109 7.856 13.764 -3.797 1.00 0.27 N ATOM 1694 CA HIS A 109 7.793 13.506 -5.243 1.00 0.28 C ATOM 1695 C HIS A 109 6.444 12.919 -5.732 1.00 0.30 C ATOM 1696 O HIS A 109 5.724 12.298 -4.966 1.00 0.57 O ATOM 1697 CB HIS A 109 8.868 12.462 -5.525 1.00 0.29 C ATOM 1698 CG HIS A 109 10.283 12.948 -5.401 1.00 0.31 C ATOM 1699 ND1 HIS A 109 10.997 13.468 -6.456 1.00 0.43 N ATOM 1700 CD2 HIS A 109 11.120 12.968 -4.332 1.00 0.27 C ATOM 1701 CE1 HIS A 109 12.212 13.784 -6.048 1.00 0.46 C ATOM 1702 NE2 HIS A 109 12.313 13.493 -4.762 1.00 0.36 N ATOM 0 H HIS A 109 8.294 13.000 -3.283 1.00 0.27 H new ATOM 0 HA HIS A 109 7.924 14.456 -5.760 1.00 0.28 H new ATOM 0 HB2 HIS A 109 8.727 11.626 -4.840 1.00 0.29 H new ATOM 0 HB3 HIS A 109 8.721 12.076 -6.534 1.00 0.29 H new ATOM 0 HD1 HIS A 109 10.643 13.590 -7.405 1.00 0.43 H new ATOM 0 HD2 HIS A 109 10.890 12.634 -3.331 1.00 0.27 H new ATOM 0 HE1 HIS A 109 12.993 14.209 -6.662 1.00 0.46 H new ATOM 1711 N THR A 110 6.126 13.097 -7.031 1.00 0.31 N ATOM 1712 CA THR A 110 4.876 12.528 -7.612 1.00 0.32 C ATOM 1713 C THR A 110 5.184 11.322 -8.513 1.00 0.35 C ATOM 1714 O THR A 110 6.051 11.381 -9.395 1.00 0.47 O ATOM 1715 CB THR A 110 3.986 13.524 -8.435 1.00 0.43 C ATOM 1716 OG1 THR A 110 4.694 14.723 -8.802 1.00 0.55 O ATOM 1717 CG2 THR A 110 2.696 13.900 -7.688 1.00 0.47 C ATOM 0 H THR A 110 6.700 13.619 -7.693 1.00 0.31 H new ATOM 0 HA THR A 110 4.300 12.245 -6.731 1.00 0.32 H new ATOM 0 HB THR A 110 3.721 12.990 -9.347 1.00 0.43 H new ATOM 0 HG1 THR A 110 4.099 15.310 -9.314 1.00 0.55 H new ATOM 0 HG21 THR A 110 2.112 14.591 -8.296 1.00 0.47 H new ATOM 0 HG22 THR A 110 2.111 13.001 -7.497 1.00 0.47 H new ATOM 0 HG23 THR A 110 2.950 14.376 -6.741 1.00 0.47 H new ATOM 1725 N VAL A 111 4.439 10.237 -8.283 1.00 0.29 N ATOM 1726 CA VAL A 111 4.632 8.974 -9.041 1.00 0.35 C ATOM 1727 C VAL A 111 3.349 8.505 -9.781 1.00 0.35 C ATOM 1728 O VAL A 111 3.375 8.344 -11.004 1.00 0.39 O ATOM 1729 CB VAL A 111 5.265 7.773 -8.188 1.00 0.38 C ATOM 1730 CG1 VAL A 111 6.805 7.880 -8.136 1.00 1.06 C ATOM 1731 CG2 VAL A 111 4.715 7.617 -6.736 1.00 1.00 C ATOM 0 H VAL A 111 3.697 10.196 -7.584 1.00 0.29 H new ATOM 0 HA VAL A 111 5.376 9.240 -9.792 1.00 0.35 H new ATOM 0 HB VAL A 111 4.954 6.878 -8.726 1.00 0.38 H new ATOM 0 HG11 VAL A 111 7.208 7.053 -7.551 1.00 1.06 H new ATOM 0 HG12 VAL A 111 7.207 7.838 -9.148 1.00 1.06 H new ATOM 0 HG13 VAL A 111 7.089 8.825 -7.672 1.00 1.06 H new ATOM 0 HG21 VAL A 111 5.209 6.777 -6.248 1.00 1.00 H new ATOM 0 HG22 VAL A 111 4.910 8.530 -6.173 1.00 1.00 H new ATOM 0 HG23 VAL A 111 3.641 7.435 -6.771 1.00 1.00 H new ATOM 1741 N VAL A 112 2.234 8.288 -9.038 1.00 0.33 N ATOM 1742 CA VAL A 112 0.962 7.843 -9.669 1.00 0.35 C ATOM 1743 C VAL A 112 -0.128 8.904 -9.390 1.00 0.34 C ATOM 1744 O VAL A 112 -0.853 8.833 -8.394 1.00 0.32 O ATOM 1745 CB VAL A 112 0.426 6.361 -9.267 1.00 0.37 C ATOM 1746 CG1 VAL A 112 -0.004 5.570 -10.524 1.00 0.44 C ATOM 1747 CG2 VAL A 112 1.431 5.470 -8.489 1.00 0.40 C ATOM 0 H VAL A 112 2.187 8.410 -8.026 1.00 0.33 H new ATOM 0 HA VAL A 112 1.186 7.751 -10.732 1.00 0.35 H new ATOM 0 HB VAL A 112 -0.410 6.570 -8.599 1.00 0.37 H new ATOM 0 HG11 VAL A 112 -0.358 4.582 -10.229 1.00 0.44 H new ATOM 0 HG12 VAL A 112 -0.805 6.105 -11.035 1.00 0.44 H new ATOM 0 HG13 VAL A 112 0.848 5.464 -11.196 1.00 0.44 H new ATOM 0 HG21 VAL A 112 0.971 4.506 -8.273 1.00 0.40 H new ATOM 0 HG22 VAL A 112 2.325 5.318 -9.093 1.00 0.40 H new ATOM 0 HG23 VAL A 112 1.704 5.960 -7.554 1.00 0.40 H new ATOM 1757 N LYS A 113 -0.221 9.879 -10.320 1.00 0.36 N ATOM 1758 CA LYS A 113 -1.185 10.983 -10.230 1.00 0.38 C ATOM 1759 C LYS A 113 -2.303 10.859 -11.281 1.00 0.43 C ATOM 1760 O LYS A 113 -2.339 11.548 -12.304 1.00 0.70 O ATOM 1761 CB LYS A 113 -0.440 12.310 -10.367 1.00 0.42 C ATOM 1762 CG LYS A 113 -1.312 13.586 -10.160 1.00 1.12 C ATOM 1763 CD LYS A 113 -0.935 14.747 -11.111 1.00 1.27 C ATOM 1764 CE LYS A 113 0.508 15.217 -10.914 1.00 1.50 C ATOM 1765 NZ LYS A 113 0.944 16.130 -12.007 1.00 2.30 N ATOM 0 H LYS A 113 0.371 9.918 -11.150 1.00 0.36 H new ATOM 0 HA LYS A 113 -1.673 10.941 -9.256 1.00 0.38 H new ATOM 0 HB2 LYS A 113 0.376 12.326 -9.645 1.00 0.42 H new ATOM 0 HB3 LYS A 113 0.011 12.354 -11.358 1.00 0.42 H new ATOM 0 HG2 LYS A 113 -2.361 13.329 -10.310 1.00 1.12 H new ATOM 0 HG3 LYS A 113 -1.211 13.923 -9.128 1.00 1.12 H new ATOM 0 HD2 LYS A 113 -1.072 14.426 -12.144 1.00 1.27 H new ATOM 0 HD3 LYS A 113 -1.613 15.584 -10.945 1.00 1.27 H new ATOM 0 HE2 LYS A 113 0.596 15.729 -9.956 1.00 1.50 H new ATOM 0 HE3 LYS A 113 1.170 14.352 -10.876 1.00 1.50 H new ATOM 0 HZ1 LYS A 113 1.926 16.428 -11.840 1.00 2.30 H new ATOM 0 HZ2 LYS A 113 0.883 15.634 -12.919 1.00 2.30 H new ATOM 0 HZ3 LYS A 113 0.327 16.967 -12.027 1.00 2.30 H new ATOM 1779 N ASP A 114 -3.204 9.961 -10.918 1.00 0.37 N ATOM 1780 CA ASP A 114 -4.441 9.535 -11.645 1.00 0.42 C ATOM 1781 C ASP A 114 -4.754 8.078 -11.235 1.00 0.38 C ATOM 1782 O ASP A 114 -4.706 7.150 -12.053 1.00 0.40 O ATOM 1783 CB ASP A 114 -4.471 9.739 -13.238 1.00 0.50 C ATOM 1784 CG ASP A 114 -3.364 9.058 -14.095 1.00 1.70 C ATOM 1785 OD1 ASP A 114 -2.430 8.477 -13.503 1.00 2.09 O ATOM 1786 OD2 ASP A 114 -3.453 9.115 -15.339 1.00 2.48 O ATOM 0 H ASP A 114 -3.103 9.456 -10.038 1.00 0.37 H new ATOM 0 HA ASP A 114 -5.226 10.224 -11.333 1.00 0.42 H new ATOM 0 HB2 ASP A 114 -5.436 9.383 -13.600 1.00 0.50 H new ATOM 0 HB3 ASP A 114 -4.431 10.810 -13.436 1.00 0.50 H new ATOM 1791 N LEU A 115 -5.094 7.884 -9.945 1.00 0.36 N ATOM 1792 CA LEU A 115 -5.350 6.550 -9.428 1.00 0.36 C ATOM 1793 C LEU A 115 -6.841 6.248 -9.202 1.00 0.38 C ATOM 1794 O LEU A 115 -7.454 6.682 -8.227 1.00 0.42 O ATOM 1795 CB LEU A 115 -4.475 6.279 -8.179 1.00 0.38 C ATOM 1796 CG LEU A 115 -4.060 4.794 -7.895 1.00 0.35 C ATOM 1797 CD1 LEU A 115 -3.467 4.046 -9.104 1.00 1.13 C ATOM 1798 CD2 LEU A 115 -3.063 4.737 -6.753 1.00 1.06 C ATOM 0 H LEU A 115 -5.194 8.633 -9.259 1.00 0.36 H new ATOM 0 HA LEU A 115 -5.054 5.842 -10.202 1.00 0.36 H new ATOM 0 HB2 LEU A 115 -3.564 6.871 -8.271 1.00 0.38 H new ATOM 0 HB3 LEU A 115 -5.010 6.652 -7.306 1.00 0.38 H new ATOM 0 HG LEU A 115 -4.990 4.287 -7.640 1.00 0.35 H new ATOM 0 HD11 LEU A 115 -3.210 3.028 -8.812 1.00 1.13 H new ATOM 0 HD12 LEU A 115 -4.200 4.018 -9.910 1.00 1.13 H new ATOM 0 HD13 LEU A 115 -2.570 4.562 -9.447 1.00 1.13 H new ATOM 0 HD21 LEU A 115 -2.783 3.700 -6.566 1.00 1.06 H new ATOM 0 HD22 LEU A 115 -2.175 5.311 -7.017 1.00 1.06 H new ATOM 0 HD23 LEU A 115 -3.514 5.159 -5.855 1.00 1.06 H new ATOM 1810 N ASP A 116 -7.398 5.531 -10.204 1.00 0.39 N ATOM 1811 CA ASP A 116 -8.790 5.055 -10.221 1.00 0.43 C ATOM 1812 C ASP A 116 -8.769 3.501 -10.141 1.00 0.42 C ATOM 1813 O ASP A 116 -8.438 2.818 -11.120 1.00 0.43 O ATOM 1814 CB ASP A 116 -9.505 5.545 -11.505 1.00 0.46 C ATOM 1815 CG ASP A 116 -11.007 5.787 -11.333 1.00 1.55 C ATOM 1816 OD1 ASP A 116 -11.730 4.822 -11.008 1.00 2.35 O ATOM 1817 OD2 ASP A 116 -11.450 6.939 -11.525 1.00 1.83 O ATOM 0 H ASP A 116 -6.877 5.264 -11.039 1.00 0.39 H new ATOM 0 HA ASP A 116 -9.343 5.453 -9.370 1.00 0.43 H new ATOM 0 HB2 ASP A 116 -9.035 6.470 -11.839 1.00 0.46 H new ATOM 0 HB3 ASP A 116 -9.355 4.809 -12.295 1.00 0.46 H new ATOM 1822 N ILE A 117 -9.153 2.965 -8.957 1.00 0.42 N ATOM 1823 CA ILE A 117 -9.155 1.493 -8.644 1.00 0.42 C ATOM 1824 C ILE A 117 -10.243 0.655 -9.431 1.00 0.44 C ATOM 1825 O ILE A 117 -9.971 -0.493 -9.810 1.00 0.44 O ATOM 1826 CB ILE A 117 -9.242 1.267 -7.064 1.00 0.43 C ATOM 1827 CG1 ILE A 117 -8.496 2.405 -6.285 1.00 0.55 C ATOM 1828 CG2 ILE A 117 -8.636 -0.104 -6.618 1.00 0.49 C ATOM 1829 CD1 ILE A 117 -9.379 3.402 -5.535 1.00 0.68 C ATOM 0 H ILE A 117 -9.475 3.538 -8.177 1.00 0.42 H new ATOM 0 HA ILE A 117 -8.206 1.099 -9.007 1.00 0.42 H new ATOM 0 HB ILE A 117 -10.305 1.278 -6.825 1.00 0.43 H new ATOM 0 HG12 ILE A 117 -7.818 1.942 -5.568 1.00 0.55 H new ATOM 0 HG13 ILE A 117 -7.881 2.959 -6.994 1.00 0.55 H new ATOM 0 HG21 ILE A 117 -8.722 -0.205 -5.536 1.00 0.49 H new ATOM 0 HG22 ILE A 117 -9.178 -0.916 -7.102 1.00 0.49 H new ATOM 0 HG23 ILE A 117 -7.585 -0.148 -6.905 1.00 0.49 H new ATOM 0 HD11 ILE A 117 -8.751 4.140 -5.036 1.00 0.68 H new ATOM 0 HD12 ILE A 117 -10.040 3.905 -6.241 1.00 0.68 H new ATOM 0 HD13 ILE A 117 -9.976 2.872 -4.793 1.00 0.68 H new ATOM 1841 N PHE A 118 -11.429 1.257 -9.721 1.00 0.48 N ATOM 1842 CA PHE A 118 -12.525 0.589 -10.492 1.00 0.51 C ATOM 1843 C PHE A 118 -12.208 0.509 -12.027 1.00 0.53 C ATOM 1844 O PHE A 118 -12.558 -0.474 -12.679 1.00 0.56 O ATOM 1845 CB PHE A 118 -13.846 1.349 -10.259 1.00 0.56 C ATOM 1846 CG PHE A 118 -15.114 0.565 -10.605 1.00 0.62 C ATOM 1847 CD1 PHE A 118 -15.585 -0.456 -9.776 1.00 0.65 C ATOM 1848 CD2 PHE A 118 -15.832 0.852 -11.766 1.00 0.68 C ATOM 1849 CE1 PHE A 118 -16.731 -1.165 -10.097 1.00 0.72 C ATOM 1850 CE2 PHE A 118 -16.980 0.144 -12.088 1.00 0.75 C ATOM 1851 CZ PHE A 118 -17.433 -0.870 -11.222 1.00 0.77 C ATOM 0 H PHE A 118 -11.655 2.209 -9.432 1.00 0.48 H new ATOM 0 HA PHE A 118 -12.614 -0.436 -10.132 1.00 0.51 H new ATOM 0 HB2 PHE A 118 -13.896 1.647 -9.212 1.00 0.56 H new ATOM 0 HB3 PHE A 118 -13.830 2.264 -10.851 1.00 0.56 H new ATOM 0 HD1 PHE A 118 -15.047 -0.696 -8.871 1.00 0.65 H new ATOM 0 HD2 PHE A 118 -15.489 1.637 -12.424 1.00 0.68 H new ATOM 0 HE1 PHE A 118 -17.069 -1.959 -9.447 1.00 0.72 H new ATOM 0 HE2 PHE A 118 -17.522 0.368 -12.995 1.00 0.75 H new ATOM 0 HZ PHE A 118 -18.338 -1.413 -11.452 1.00 0.77 H new ATOM 1861 N ASP A 119 -11.539 1.571 -12.579 1.00 0.52 N ATOM 1862 CA ASP A 119 -11.081 1.636 -14.006 1.00 0.54 C ATOM 1863 C ASP A 119 -9.820 0.739 -14.296 1.00 0.53 C ATOM 1864 O ASP A 119 -9.633 0.293 -15.431 1.00 0.57 O ATOM 1865 CB ASP A 119 -10.762 3.100 -14.389 1.00 0.55 C ATOM 1866 CG ASP A 119 -11.164 3.480 -15.820 1.00 0.57 C ATOM 1867 OD1 ASP A 119 -11.256 2.573 -16.669 1.00 0.72 O ATOM 1868 OD2 ASP A 119 -11.396 4.681 -16.077 1.00 0.91 O ATOM 0 H ASP A 119 -11.302 2.407 -12.045 1.00 0.52 H new ATOM 0 HA ASP A 119 -11.899 1.247 -14.612 1.00 0.54 H new ATOM 0 HB2 ASP A 119 -11.272 3.765 -13.692 1.00 0.55 H new ATOM 0 HB3 ASP A 119 -9.692 3.270 -14.267 1.00 0.55 H new ATOM 1873 N ARG A 120 -8.965 0.494 -13.254 1.00 0.49 N ATOM 1874 CA ARG A 120 -7.742 -0.350 -13.370 1.00 0.48 C ATOM 1875 C ARG A 120 -8.050 -1.873 -13.390 1.00 0.50 C ATOM 1876 O ARG A 120 -7.661 -2.556 -14.341 1.00 0.54 O ATOM 1877 CB ARG A 120 -6.763 -0.038 -12.226 1.00 0.46 C ATOM 1878 CG ARG A 120 -6.012 1.317 -12.341 1.00 0.45 C ATOM 1879 CD ARG A 120 -4.946 1.344 -13.461 1.00 0.52 C ATOM 1880 NE ARG A 120 -5.540 1.466 -14.791 1.00 1.23 N ATOM 1881 CZ ARG A 120 -4.846 1.370 -15.923 1.00 1.49 C ATOM 1882 NH1 ARG A 120 -3.536 1.159 -15.890 1.00 1.03 N ATOM 1883 NH2 ARG A 120 -5.462 1.489 -17.090 1.00 2.43 N ATOM 0 H ARG A 120 -9.108 0.876 -12.319 1.00 0.49 H new ATOM 0 HA ARG A 120 -7.289 -0.100 -14.329 1.00 0.48 H new ATOM 0 HB2 ARG A 120 -7.314 -0.050 -11.286 1.00 0.46 H new ATOM 0 HB3 ARG A 120 -6.026 -0.839 -12.173 1.00 0.46 H new ATOM 0 HG2 ARG A 120 -6.737 2.110 -12.523 1.00 0.45 H new ATOM 0 HG3 ARG A 120 -5.531 1.538 -11.388 1.00 0.45 H new ATOM 0 HD2 ARG A 120 -4.266 2.179 -13.292 1.00 0.52 H new ATOM 0 HD3 ARG A 120 -4.350 0.433 -13.414 1.00 0.52 H new ATOM 0 HE ARG A 120 -6.544 1.634 -14.855 1.00 1.23 H new ATOM 0 HH11 ARG A 120 -3.056 1.070 -14.994 1.00 1.03 H new ATOM 0 HH12 ARG A 120 -3.009 1.086 -16.760 1.00 1.03 H new ATOM 0 HH21 ARG A 120 -6.468 1.654 -17.121 1.00 2.43 H new ATOM 0 HH22 ARG A 120 -4.930 1.415 -17.957 1.00 2.43 H new ATOM 1897 N VAL A 121 -8.742 -2.406 -12.345 1.00 0.48 N ATOM 1898 CA VAL A 121 -9.127 -3.862 -12.327 1.00 0.51 C ATOM 1899 C VAL A 121 -10.550 -4.149 -12.935 1.00 0.56 C ATOM 1900 O VAL A 121 -10.715 -5.140 -13.652 1.00 0.62 O ATOM 1901 CB VAL A 121 -8.977 -4.617 -10.918 1.00 0.53 C ATOM 1902 CG1 VAL A 121 -7.553 -5.181 -10.747 1.00 0.92 C ATOM 1903 CG2 VAL A 121 -9.336 -3.777 -9.656 1.00 0.93 C ATOM 0 H VAL A 121 -9.040 -1.877 -11.526 1.00 0.48 H new ATOM 0 HA VAL A 121 -8.369 -4.291 -12.982 1.00 0.51 H new ATOM 0 HB VAL A 121 -9.720 -5.413 -10.972 1.00 0.53 H new ATOM 0 HG11 VAL A 121 -7.476 -5.688 -9.785 1.00 0.92 H new ATOM 0 HG12 VAL A 121 -7.344 -5.889 -11.549 1.00 0.92 H new ATOM 0 HG13 VAL A 121 -6.831 -4.365 -10.786 1.00 0.92 H new ATOM 0 HG21 VAL A 121 -9.199 -4.386 -8.762 1.00 0.93 H new ATOM 0 HG22 VAL A 121 -8.686 -2.904 -9.603 1.00 0.93 H new ATOM 0 HG23 VAL A 121 -10.375 -3.453 -9.718 1.00 0.93 H new ATOM 1913 N GLY A 122 -11.560 -3.285 -12.643 1.00 0.57 N ATOM 1914 CA GLY A 122 -12.924 -3.476 -13.176 1.00 0.63 C ATOM 1915 C GLY A 122 -13.939 -3.988 -12.147 1.00 0.66 C ATOM 1916 O GLY A 122 -14.904 -3.298 -11.813 1.00 0.85 O ATOM 0 H GLY A 122 -11.451 -2.463 -12.049 1.00 0.57 H new ATOM 0 HA2 GLY A 122 -13.280 -2.528 -13.579 1.00 0.63 H new ATOM 0 HA3 GLY A 122 -12.881 -4.180 -14.007 1.00 0.63 H new ATOM 1920 N HIS A 123 -13.692 -5.216 -11.656 1.00 0.72 N ATOM 1921 CA HIS A 123 -14.537 -5.898 -10.650 1.00 0.87 C ATOM 1922 C HIS A 123 -13.892 -5.857 -9.238 1.00 0.73 C ATOM 1923 O HIS A 123 -12.760 -5.379 -9.071 1.00 1.34 O ATOM 1924 CB HIS A 123 -14.773 -7.363 -11.070 1.00 1.38 C ATOM 1925 CG HIS A 123 -15.515 -7.527 -12.367 1.00 1.76 C ATOM 1926 ND1 HIS A 123 -14.887 -7.831 -13.558 1.00 2.62 N ATOM 1927 CD2 HIS A 123 -16.835 -7.431 -12.657 1.00 2.27 C ATOM 1928 CE1 HIS A 123 -15.786 -7.916 -14.521 1.00 3.18 C ATOM 1929 NE2 HIS A 123 -16.976 -7.678 -14.000 1.00 3.01 N ATOM 0 H HIS A 123 -12.889 -5.773 -11.949 1.00 0.72 H new ATOM 0 HA HIS A 123 -15.489 -5.369 -10.601 1.00 0.87 H new ATOM 0 HB2 HIS A 123 -13.809 -7.864 -11.152 1.00 1.38 H new ATOM 0 HB3 HIS A 123 -15.329 -7.869 -10.281 1.00 1.38 H new ATOM 0 HD2 HIS A 123 -17.629 -7.203 -11.961 1.00 2.27 H new ATOM 0 HE1 HIS A 123 -15.583 -8.142 -15.558 1.00 3.18 H new ATOM 0 HE2 HIS A 123 -17.858 -7.678 -14.513 1.00 3.01 H new ATOM 1938 N SER A 124 -14.636 -6.347 -8.207 1.00 0.86 N ATOM 1939 CA SER A 124 -14.158 -6.386 -6.784 1.00 0.70 C ATOM 1940 C SER A 124 -13.081 -7.486 -6.554 1.00 0.99 C ATOM 1941 O SER A 124 -13.398 -8.631 -6.230 1.00 2.08 O ATOM 1942 CB SER A 124 -15.353 -6.633 -5.837 1.00 0.73 C ATOM 1943 OG SER A 124 -16.226 -5.515 -5.797 1.00 1.20 O ATOM 0 H SER A 124 -15.576 -6.724 -8.331 1.00 0.86 H new ATOM 0 HA SER A 124 -13.699 -5.421 -6.570 1.00 0.70 H new ATOM 0 HB2 SER A 124 -15.904 -7.514 -6.167 1.00 0.73 H new ATOM 0 HB3 SER A 124 -14.985 -6.844 -4.833 1.00 0.73 H new ATOM 0 HG SER A 124 -16.972 -5.704 -5.190 1.00 1.20 H new ATOM 1949 N THR A 125 -11.803 -7.094 -6.744 1.00 0.56 N ATOM 1950 CA THR A 125 -10.628 -8.003 -6.649 1.00 0.51 C ATOM 1951 C THR A 125 -9.444 -7.245 -5.953 1.00 0.48 C ATOM 1952 O THR A 125 -9.668 -6.423 -5.052 1.00 0.51 O ATOM 1953 CB THR A 125 -10.173 -8.566 -8.087 1.00 0.55 C ATOM 1954 OG1 THR A 125 -9.940 -7.493 -9.022 1.00 0.62 O ATOM 1955 CG2 THR A 125 -11.169 -9.560 -8.753 1.00 0.62 C ATOM 0 H THR A 125 -11.550 -6.132 -6.970 1.00 0.56 H new ATOM 0 HA THR A 125 -10.916 -8.868 -6.052 1.00 0.51 H new ATOM 0 HB THR A 125 -9.257 -9.114 -7.867 1.00 0.55 H new ATOM 0 HG1 THR A 125 -9.664 -7.866 -9.885 1.00 0.62 H new ATOM 0 HG21 THR A 125 -10.773 -9.882 -9.716 1.00 0.62 H new ATOM 0 HG22 THR A 125 -11.303 -10.428 -8.108 1.00 0.62 H new ATOM 0 HG23 THR A 125 -12.130 -9.067 -8.902 1.00 0.62 H new ATOM 1963 N ALA A 126 -8.175 -7.539 -6.354 1.00 0.46 N ATOM 1964 CA ALA A 126 -6.974 -6.875 -5.788 1.00 0.43 C ATOM 1965 C ALA A 126 -6.205 -5.986 -6.825 1.00 0.38 C ATOM 1966 O ALA A 126 -5.977 -6.394 -7.975 1.00 0.41 O ATOM 1967 CB ALA A 126 -6.024 -7.949 -5.210 1.00 0.46 C ATOM 0 H ALA A 126 -7.962 -8.234 -7.069 1.00 0.46 H new ATOM 0 HA ALA A 126 -7.321 -6.202 -5.004 1.00 0.43 H new ATOM 0 HB1 ALA A 126 -5.140 -7.466 -4.793 1.00 0.46 H new ATOM 0 HB2 ALA A 126 -6.538 -8.505 -4.426 1.00 0.46 H new ATOM 0 HB3 ALA A 126 -5.723 -8.634 -6.003 1.00 0.46 H new ATOM 1973 N HIS A 127 -5.815 -4.751 -6.396 1.00 0.34 N ATOM 1974 CA HIS A 127 -5.024 -3.813 -7.242 1.00 0.32 C ATOM 1975 C HIS A 127 -3.583 -3.670 -6.665 1.00 0.31 C ATOM 1976 O HIS A 127 -3.385 -3.704 -5.446 1.00 0.35 O ATOM 1977 CB HIS A 127 -5.713 -2.427 -7.338 1.00 0.32 C ATOM 1978 CG HIS A 127 -5.094 -1.479 -8.348 1.00 0.33 C ATOM 1979 ND1 HIS A 127 -4.579 -1.894 -9.562 1.00 0.35 N ATOM 1980 CD2 HIS A 127 -4.862 -0.141 -8.290 1.00 0.36 C ATOM 1981 CE1 HIS A 127 -4.056 -0.860 -10.196 1.00 0.38 C ATOM 1982 NE2 HIS A 127 -4.218 0.212 -9.448 1.00 0.38 N ATOM 0 H HIS A 127 -6.036 -4.384 -5.470 1.00 0.34 H new ATOM 0 HA HIS A 127 -4.966 -4.223 -8.250 1.00 0.32 H new ATOM 0 HB2 HIS A 127 -6.762 -2.575 -7.595 1.00 0.32 H new ATOM 0 HB3 HIS A 127 -5.689 -1.956 -6.355 1.00 0.32 H new ATOM 0 HD2 HIS A 127 -5.134 0.521 -7.482 1.00 0.36 H new ATOM 0 HE1 HIS A 127 -3.577 -0.889 -11.163 1.00 0.38 H new ATOM 0 HE2 HIS A 127 -3.913 1.154 -9.691 1.00 0.38 H new ATOM 1991 N ASP A 128 -2.583 -3.500 -7.549 1.00 0.32 N ATOM 1992 CA ASP A 128 -1.175 -3.401 -7.116 1.00 0.33 C ATOM 1993 C ASP A 128 -0.323 -2.437 -7.973 1.00 0.30 C ATOM 1994 O ASP A 128 -0.483 -2.333 -9.196 1.00 0.42 O ATOM 1995 CB ASP A 128 -0.534 -4.806 -7.155 1.00 0.45 C ATOM 1996 CG ASP A 128 0.382 -5.127 -5.969 1.00 1.70 C ATOM 1997 OD1 ASP A 128 0.796 -4.187 -5.262 1.00 2.50 O ATOM 1998 OD2 ASP A 128 0.687 -6.321 -5.762 1.00 2.10 O ATOM 0 H ASP A 128 -2.720 -3.429 -8.557 1.00 0.32 H new ATOM 0 HA ASP A 128 -1.189 -2.992 -6.106 1.00 0.33 H new ATOM 0 HB2 ASP A 128 -1.328 -5.551 -7.195 1.00 0.45 H new ATOM 0 HB3 ASP A 128 0.040 -4.903 -8.076 1.00 0.45 H new ATOM 2003 N GLU A 129 0.600 -1.749 -7.279 1.00 0.25 N ATOM 2004 CA GLU A 129 1.570 -0.842 -7.911 1.00 0.30 C ATOM 2005 C GLU A 129 2.974 -1.030 -7.286 1.00 0.27 C ATOM 2006 O GLU A 129 3.151 -0.948 -6.055 1.00 0.25 O ATOM 2007 CB GLU A 129 1.113 0.632 -7.811 1.00 0.43 C ATOM 2008 CG GLU A 129 0.382 1.175 -9.058 1.00 0.91 C ATOM 2009 CD GLU A 129 1.316 1.423 -10.234 1.00 0.76 C ATOM 2010 OE1 GLU A 129 1.946 2.501 -10.277 1.00 1.56 O ATOM 2011 OE2 GLU A 129 1.416 0.538 -11.109 1.00 1.12 O ATOM 0 H GLU A 129 0.693 -1.807 -6.265 1.00 0.25 H new ATOM 0 HA GLU A 129 1.627 -1.095 -8.970 1.00 0.30 H new ATOM 0 HB2 GLU A 129 0.454 0.735 -6.949 1.00 0.43 H new ATOM 0 HB3 GLU A 129 1.987 1.255 -7.620 1.00 0.43 H new ATOM 0 HG2 GLU A 129 -0.390 0.466 -9.357 1.00 0.91 H new ATOM 0 HG3 GLU A 129 -0.123 2.106 -8.800 1.00 0.91 H new ATOM 2018 N ILE A 130 3.962 -1.293 -8.173 1.00 0.28 N ATOM 2019 CA ILE A 130 5.385 -1.533 -7.798 1.00 0.28 C ATOM 2020 C ILE A 130 6.277 -0.328 -8.217 1.00 0.29 C ATOM 2021 O ILE A 130 6.344 0.026 -9.401 1.00 0.39 O ATOM 2022 CB ILE A 130 5.968 -2.864 -8.458 1.00 0.31 C ATOM 2023 CG1 ILE A 130 4.847 -3.836 -8.941 1.00 0.37 C ATOM 2024 CG2 ILE A 130 6.926 -3.633 -7.494 1.00 0.37 C ATOM 2025 CD1 ILE A 130 4.568 -3.809 -10.445 1.00 0.45 C ATOM 0 H ILE A 130 3.798 -1.346 -9.178 1.00 0.28 H new ATOM 0 HA ILE A 130 5.404 -1.650 -6.714 1.00 0.28 H new ATOM 0 HB ILE A 130 6.534 -2.525 -9.326 1.00 0.31 H new ATOM 0 HG12 ILE A 130 5.121 -4.852 -8.656 1.00 0.37 H new ATOM 0 HG13 ILE A 130 3.925 -3.594 -8.412 1.00 0.37 H new ATOM 0 HG21 ILE A 130 7.296 -4.531 -7.989 1.00 0.37 H new ATOM 0 HG22 ILE A 130 7.767 -2.992 -7.229 1.00 0.37 H new ATOM 0 HG23 ILE A 130 6.385 -3.914 -6.591 1.00 0.37 H new ATOM 0 HD11 ILE A 130 3.774 -4.518 -10.681 1.00 0.45 H new ATOM 0 HD12 ILE A 130 4.258 -2.806 -10.740 1.00 0.45 H new ATOM 0 HD13 ILE A 130 5.472 -4.083 -10.988 1.00 0.45 H new ATOM 2037 N ILE A 131 6.963 0.278 -7.226 1.00 0.21 N ATOM 2038 CA ILE A 131 7.835 1.443 -7.481 1.00 0.26 C ATOM 2039 C ILE A 131 9.238 1.297 -6.790 1.00 0.18 C ATOM 2040 O ILE A 131 9.338 1.532 -5.578 1.00 0.18 O ATOM 2041 CB ILE A 131 7.172 2.801 -7.003 1.00 0.34 C ATOM 2042 CG1 ILE A 131 5.637 2.648 -6.712 1.00 0.30 C ATOM 2043 CG2 ILE A 131 7.393 3.925 -8.072 1.00 0.62 C ATOM 2044 CD1 ILE A 131 5.148 3.263 -5.403 1.00 0.84 C ATOM 0 H ILE A 131 6.931 -0.017 -6.250 1.00 0.21 H new ATOM 0 HA ILE A 131 7.971 1.472 -8.562 1.00 0.26 H new ATOM 0 HB ILE A 131 7.661 3.078 -6.069 1.00 0.34 H new ATOM 0 HG12 ILE A 131 5.083 3.101 -7.534 1.00 0.30 H new ATOM 0 HG13 ILE A 131 5.391 1.586 -6.708 1.00 0.30 H new ATOM 0 HG21 ILE A 131 6.931 4.850 -7.728 1.00 0.62 H new ATOM 0 HG22 ILE A 131 8.462 4.084 -8.217 1.00 0.62 H new ATOM 0 HG23 ILE A 131 6.940 3.623 -9.016 1.00 0.62 H new ATOM 0 HD11 ILE A 131 4.075 3.100 -5.303 1.00 0.84 H new ATOM 0 HD12 ILE A 131 5.666 2.796 -4.566 1.00 0.84 H new ATOM 0 HD13 ILE A 131 5.354 4.333 -5.405 1.00 0.84 H new ATOM 2056 N PRO A 132 10.350 0.875 -7.529 1.00 0.13 N ATOM 2057 CA PRO A 132 11.741 0.796 -6.950 1.00 0.09 C ATOM 2058 C PRO A 132 12.434 2.172 -6.761 1.00 0.08 C ATOM 2059 O PRO A 132 12.262 3.087 -7.570 1.00 0.16 O ATOM 2060 CB PRO A 132 12.534 -0.030 -7.988 1.00 0.13 C ATOM 2061 CG PRO A 132 11.482 -0.708 -8.812 1.00 0.16 C ATOM 2062 CD PRO A 132 10.351 0.303 -8.902 1.00 0.16 C ATOM 0 HA PRO A 132 11.701 0.363 -5.950 1.00 0.09 H new ATOM 0 HB2 PRO A 132 13.169 0.609 -8.602 1.00 0.13 H new ATOM 0 HB3 PRO A 132 13.187 -0.756 -7.503 1.00 0.13 H new ATOM 0 HG2 PRO A 132 11.860 -0.968 -9.801 1.00 0.16 H new ATOM 0 HG3 PRO A 132 11.149 -1.634 -8.344 1.00 0.16 H new ATOM 0 HD2 PRO A 132 10.539 1.062 -9.662 1.00 0.16 H new ATOM 0 HD3 PRO A 132 9.400 -0.168 -9.150 1.00 0.16 H new ATOM 2070 N ILE A 133 13.213 2.275 -5.672 1.00 0.07 N ATOM 2071 CA ILE A 133 13.935 3.507 -5.284 1.00 0.08 C ATOM 2072 C ILE A 133 15.469 3.217 -5.130 1.00 0.08 C ATOM 2073 O ILE A 133 15.880 2.111 -4.758 1.00 0.10 O ATOM 2074 CB ILE A 133 13.331 4.111 -3.927 1.00 0.15 C ATOM 2075 CG1 ILE A 133 11.771 3.915 -3.857 1.00 0.23 C ATOM 2076 CG2 ILE A 133 13.676 5.628 -3.748 1.00 0.30 C ATOM 2077 CD1 ILE A 133 11.186 3.584 -2.472 1.00 0.38 C ATOM 0 H ILE A 133 13.364 1.500 -5.027 1.00 0.07 H new ATOM 0 HA ILE A 133 13.804 4.248 -6.073 1.00 0.08 H new ATOM 0 HB ILE A 133 13.798 3.557 -3.113 1.00 0.15 H new ATOM 0 HG12 ILE A 133 11.295 4.826 -4.220 1.00 0.23 H new ATOM 0 HG13 ILE A 133 11.496 3.115 -4.545 1.00 0.23 H new ATOM 0 HG21 ILE A 133 13.245 5.991 -2.815 1.00 0.30 H new ATOM 0 HG22 ILE A 133 14.758 5.754 -3.722 1.00 0.30 H new ATOM 0 HG23 ILE A 133 13.265 6.196 -4.583 1.00 0.30 H new ATOM 0 HD11 ILE A 133 10.105 3.472 -2.551 1.00 0.38 H new ATOM 0 HD12 ILE A 133 11.621 2.654 -2.106 1.00 0.38 H new ATOM 0 HD13 ILE A 133 11.418 4.391 -1.777 1.00 0.38 H new ATOM 2089 N SER A 134 16.295 4.244 -5.417 1.00 0.10 N ATOM 2090 CA SER A 134 17.757 4.127 -5.300 1.00 0.12 C ATOM 2091 C SER A 134 18.384 5.321 -4.541 1.00 0.13 C ATOM 2092 O SER A 134 18.401 6.454 -5.032 1.00 0.15 O ATOM 2093 CB SER A 134 18.424 3.945 -6.699 1.00 0.15 C ATOM 2094 OG SER A 134 17.979 4.904 -7.663 1.00 1.31 O ATOM 0 H SER A 134 15.973 5.160 -5.730 1.00 0.10 H new ATOM 0 HA SER A 134 17.953 3.233 -4.709 1.00 0.12 H new ATOM 0 HB2 SER A 134 19.506 4.022 -6.592 1.00 0.15 H new ATOM 0 HB3 SER A 134 18.211 2.942 -7.068 1.00 0.15 H new ATOM 0 HG SER A 134 18.431 4.743 -8.518 1.00 1.31 H new ATOM 2100 N ILE A 135 18.900 5.032 -3.326 1.00 0.13 N ATOM 2101 CA ILE A 135 19.573 6.035 -2.463 1.00 0.15 C ATOM 2102 C ILE A 135 21.094 5.673 -2.374 1.00 0.18 C ATOM 2103 O ILE A 135 21.457 4.563 -1.963 1.00 0.18 O ATOM 2104 CB ILE A 135 18.881 6.132 -1.017 1.00 0.16 C ATOM 2105 CG1 ILE A 135 17.340 6.300 -1.138 1.00 0.13 C ATOM 2106 CG2 ILE A 135 19.449 7.291 -0.116 1.00 0.25 C ATOM 2107 CD1 ILE A 135 16.514 5.385 -0.224 1.00 0.15 C ATOM 0 H ILE A 135 18.863 4.100 -2.914 1.00 0.13 H new ATOM 0 HA ILE A 135 19.471 7.027 -2.903 1.00 0.15 H new ATOM 0 HB ILE A 135 19.121 5.188 -0.528 1.00 0.16 H new ATOM 0 HG12 ILE A 135 17.084 7.336 -0.917 1.00 0.13 H new ATOM 0 HG13 ILE A 135 17.049 6.114 -2.172 1.00 0.13 H new ATOM 0 HG21 ILE A 135 18.932 7.292 0.844 1.00 0.25 H new ATOM 0 HG22 ILE A 135 20.516 7.136 0.046 1.00 0.25 H new ATOM 0 HG23 ILE A 135 19.293 8.248 -0.613 1.00 0.25 H new ATOM 0 HD11 ILE A 135 15.452 5.576 -0.381 1.00 0.15 H new ATOM 0 HD12 ILE A 135 16.733 4.343 -0.458 1.00 0.15 H new ATOM 0 HD13 ILE A 135 16.769 5.585 0.817 1.00 0.15 H new ATOM 2119 N LYS A 136 21.952 6.642 -2.774 1.00 0.20 N ATOM 2120 CA LYS A 136 23.423 6.472 -2.772 1.00 0.23 C ATOM 2121 C LYS A 136 24.122 7.771 -2.359 1.00 0.28 C ATOM 2122 O LYS A 136 23.797 8.856 -2.868 1.00 0.29 O ATOM 2123 CB LYS A 136 23.916 6.031 -4.163 1.00 0.22 C ATOM 2124 CG LYS A 136 23.530 4.583 -4.521 1.00 0.25 C ATOM 2125 CD LYS A 136 23.704 4.268 -6.024 1.00 0.94 C ATOM 2126 CE LYS A 136 23.383 2.803 -6.359 1.00 1.23 C ATOM 2127 NZ LYS A 136 23.475 2.544 -7.824 1.00 2.05 N ATOM 0 H LYS A 136 21.646 7.557 -3.105 1.00 0.20 H new ATOM 0 HA LYS A 136 23.671 5.698 -2.046 1.00 0.23 H new ATOM 0 HB2 LYS A 136 23.506 6.705 -4.915 1.00 0.22 H new ATOM 0 HB3 LYS A 136 25.001 6.130 -4.204 1.00 0.22 H new ATOM 0 HG2 LYS A 136 24.141 3.895 -3.938 1.00 0.25 H new ATOM 0 HG3 LYS A 136 22.493 4.408 -4.236 1.00 0.25 H new ATOM 0 HD2 LYS A 136 23.054 4.921 -6.606 1.00 0.94 H new ATOM 0 HD3 LYS A 136 24.729 4.489 -6.322 1.00 0.94 H new ATOM 0 HE2 LYS A 136 24.074 2.148 -5.829 1.00 1.23 H new ATOM 0 HE3 LYS A 136 22.380 2.560 -6.008 1.00 1.23 H new ATOM 0 HZ1 LYS A 136 23.252 1.546 -8.015 1.00 2.05 H new ATOM 0 HZ2 LYS A 136 22.798 3.152 -8.327 1.00 2.05 H new ATOM 0 HZ3 LYS A 136 24.439 2.753 -8.154 1.00 2.05 H new ATOM 2141 N LYS A 137 25.070 7.656 -1.374 1.00 0.33 N ATOM 2142 CA LYS A 137 25.871 8.810 -0.798 1.00 0.40 C ATOM 2143 C LYS A 137 25.039 9.815 0.070 1.00 0.39 C ATOM 2144 O LYS A 137 25.531 10.883 0.450 1.00 0.42 O ATOM 2145 CB LYS A 137 26.584 9.595 -1.915 1.00 0.44 C ATOM 2146 CG LYS A 137 27.771 8.856 -2.577 1.00 0.99 C ATOM 2147 CD LYS A 137 28.149 9.440 -3.963 1.00 1.59 C ATOM 2148 CE LYS A 137 28.386 10.959 -3.934 1.00 2.70 C ATOM 2149 NZ LYS A 137 28.930 11.452 -5.230 1.00 3.55 N ATOM 0 H LYS A 137 25.307 6.759 -0.950 1.00 0.33 H new ATOM 0 HA LYS A 137 26.592 8.337 -0.131 1.00 0.40 H new ATOM 0 HB2 LYS A 137 25.855 9.844 -2.686 1.00 0.44 H new ATOM 0 HB3 LYS A 137 26.946 10.537 -1.503 1.00 0.44 H new ATOM 0 HG2 LYS A 137 28.638 8.908 -1.918 1.00 0.99 H new ATOM 0 HG3 LYS A 137 27.519 7.802 -2.689 1.00 0.99 H new ATOM 0 HD2 LYS A 137 29.050 8.945 -4.326 1.00 1.59 H new ATOM 0 HD3 LYS A 137 27.354 9.216 -4.674 1.00 1.59 H new ATOM 0 HE2 LYS A 137 27.449 11.470 -3.714 1.00 2.70 H new ATOM 0 HE3 LYS A 137 29.080 11.205 -3.130 1.00 2.70 H new ATOM 0 HZ1 LYS A 137 29.078 12.480 -5.176 1.00 3.55 H new ATOM 0 HZ2 LYS A 137 29.836 10.982 -5.427 1.00 3.55 H new ATOM 0 HZ3 LYS A 137 28.256 11.239 -5.993 1.00 3.55 H new ATOM 2163 N GLY A 138 23.786 9.428 0.374 1.00 0.35 N ATOM 2164 CA GLY A 138 22.842 10.251 1.135 1.00 0.36 C ATOM 2165 C GLY A 138 21.806 11.004 0.266 1.00 0.33 C ATOM 2166 O GLY A 138 21.201 11.969 0.741 1.00 0.37 O ATOM 0 H GLY A 138 23.402 8.526 0.093 1.00 0.35 H new ATOM 0 HA2 GLY A 138 22.311 9.614 1.842 1.00 0.36 H new ATOM 0 HA3 GLY A 138 23.403 10.978 1.721 1.00 0.36 H new ATOM 2170 N LYS A 139 21.601 10.565 -1.012 1.00 0.29 N ATOM 2171 CA LYS A 139 20.628 11.213 -1.914 1.00 0.29 C ATOM 2172 C LYS A 139 19.643 10.212 -2.548 1.00 0.26 C ATOM 2173 O LYS A 139 19.993 9.066 -2.831 1.00 0.25 O ATOM 2174 CB LYS A 139 21.344 11.984 -3.028 1.00 0.33 C ATOM 2175 CG LYS A 139 22.305 13.085 -2.537 1.00 0.65 C ATOM 2176 CD LYS A 139 22.954 13.865 -3.700 1.00 0.67 C ATOM 2177 CE LYS A 139 23.887 14.978 -3.203 1.00 1.00 C ATOM 2178 NZ LYS A 139 24.427 15.787 -4.330 1.00 1.56 N ATOM 0 H LYS A 139 22.095 9.775 -1.426 1.00 0.29 H new ATOM 0 HA LYS A 139 20.055 11.902 -1.293 1.00 0.29 H new ATOM 0 HB2 LYS A 139 21.906 11.276 -3.637 1.00 0.33 H new ATOM 0 HB3 LYS A 139 20.594 12.438 -3.676 1.00 0.33 H new ATOM 0 HG2 LYS A 139 21.760 13.779 -1.897 1.00 0.65 H new ATOM 0 HG3 LYS A 139 23.087 12.634 -1.925 1.00 0.65 H new ATOM 0 HD2 LYS A 139 23.517 13.175 -4.328 1.00 0.67 H new ATOM 0 HD3 LYS A 139 22.173 14.300 -4.324 1.00 0.67 H new ATOM 0 HE2 LYS A 139 23.345 15.627 -2.516 1.00 1.00 H new ATOM 0 HE3 LYS A 139 24.712 14.538 -2.642 1.00 1.00 H new ATOM 0 HZ1 LYS A 139 25.053 16.529 -3.956 1.00 1.56 H new ATOM 0 HZ2 LYS A 139 24.965 15.171 -4.973 1.00 1.56 H new ATOM 0 HZ3 LYS A 139 23.641 16.227 -4.850 1.00 1.56 H new ATOM 2192 N LEU A 140 18.428 10.703 -2.858 1.00 0.25 N ATOM 2193 CA LEU A 140 17.339 9.870 -3.407 1.00 0.24 C ATOM 2194 C LEU A 140 17.129 10.041 -4.931 1.00 0.26 C ATOM 2195 O LEU A 140 17.276 11.131 -5.489 1.00 0.34 O ATOM 2196 CB LEU A 140 16.036 10.233 -2.659 1.00 0.24 C ATOM 2197 CG LEU A 140 14.948 9.129 -2.501 1.00 0.22 C ATOM 2198 CD1 LEU A 140 14.406 9.078 -1.077 1.00 0.22 C ATOM 2199 CD2 LEU A 140 13.790 9.349 -3.460 1.00 0.25 C ATOM 0 H LEU A 140 18.174 11.683 -2.736 1.00 0.25 H new ATOM 0 HA LEU A 140 17.616 8.826 -3.259 1.00 0.24 H new ATOM 0 HB2 LEU A 140 16.309 10.577 -1.661 1.00 0.24 H new ATOM 0 HB3 LEU A 140 15.580 11.079 -3.174 1.00 0.24 H new ATOM 0 HG LEU A 140 15.433 8.181 -2.734 1.00 0.22 H new ATOM 0 HD11 LEU A 140 13.649 8.297 -1.003 1.00 0.22 H new ATOM 0 HD12 LEU A 140 15.220 8.861 -0.385 1.00 0.22 H new ATOM 0 HD13 LEU A 140 13.960 10.040 -0.823 1.00 0.22 H new ATOM 0 HD21 LEU A 140 13.049 8.561 -3.323 1.00 0.25 H new ATOM 0 HD22 LEU A 140 13.331 10.317 -3.260 1.00 0.25 H new ATOM 0 HD23 LEU A 140 14.158 9.327 -4.486 1.00 0.25 H new ATOM 2211 N SER A 141 16.766 8.924 -5.577 1.00 0.21 N ATOM 2212 CA SER A 141 16.498 8.879 -7.018 1.00 0.22 C ATOM 2213 C SER A 141 15.202 8.098 -7.307 1.00 0.19 C ATOM 2214 O SER A 141 15.131 6.882 -7.067 1.00 0.16 O ATOM 2215 CB SER A 141 17.667 8.208 -7.749 1.00 0.25 C ATOM 2216 OG SER A 141 18.726 9.120 -7.990 1.00 0.64 O ATOM 0 H SER A 141 16.650 8.024 -5.111 1.00 0.21 H new ATOM 0 HA SER A 141 16.382 9.902 -7.375 1.00 0.22 H new ATOM 0 HB2 SER A 141 18.035 7.371 -7.156 1.00 0.25 H new ATOM 0 HB3 SER A 141 17.317 7.798 -8.696 1.00 0.25 H new ATOM 0 HG SER A 141 19.455 8.659 -8.456 1.00 0.64 H new ATOM 2222 N VAL A 142 14.177 8.807 -7.824 1.00 0.21 N ATOM 2223 CA VAL A 142 12.883 8.182 -8.160 1.00 0.22 C ATOM 2224 C VAL A 142 12.632 8.234 -9.731 1.00 0.25 C ATOM 2225 O VAL A 142 12.215 9.259 -10.281 1.00 0.26 O ATOM 2226 CB VAL A 142 11.688 8.746 -7.191 1.00 0.27 C ATOM 2227 CG1 VAL A 142 10.932 10.032 -7.635 1.00 0.46 C ATOM 2228 CG2 VAL A 142 10.660 7.644 -6.882 1.00 0.41 C ATOM 0 H VAL A 142 14.221 9.808 -8.017 1.00 0.21 H new ATOM 0 HA VAL A 142 12.897 7.115 -7.936 1.00 0.22 H new ATOM 0 HB VAL A 142 12.245 9.053 -6.305 1.00 0.27 H new ATOM 0 HG11 VAL A 142 10.172 10.281 -6.894 1.00 0.46 H new ATOM 0 HG12 VAL A 142 11.638 10.858 -7.722 1.00 0.46 H new ATOM 0 HG13 VAL A 142 10.455 9.859 -8.600 1.00 0.46 H new ATOM 0 HG21 VAL A 142 9.878 8.046 -6.237 1.00 0.41 H new ATOM 0 HG22 VAL A 142 10.216 7.289 -7.812 1.00 0.41 H new ATOM 0 HG23 VAL A 142 11.156 6.815 -6.377 1.00 0.41 H new ATOM 2238 N GLN A 143 12.978 7.108 -10.434 1.00 0.31 N ATOM 2239 CA GLN A 143 12.826 6.926 -11.931 1.00 0.39 C ATOM 2240 C GLN A 143 13.782 7.829 -12.770 1.00 0.41 C ATOM 2241 O GLN A 143 14.868 7.396 -13.164 1.00 0.46 O ATOM 2242 CB GLN A 143 11.347 7.129 -12.391 1.00 0.44 C ATOM 2243 CG GLN A 143 10.474 5.853 -12.460 1.00 0.65 C ATOM 2244 CD GLN A 143 10.086 5.316 -11.093 1.00 0.87 C ATOM 2245 OE1 GLN A 143 9.063 5.705 -10.533 1.00 1.56 O ATOM 2246 NE2 GLN A 143 10.904 4.421 -10.552 1.00 1.12 N ATOM 0 H GLN A 143 13.376 6.287 -9.978 1.00 0.31 H new ATOM 0 HA GLN A 143 13.117 5.894 -12.125 1.00 0.39 H new ATOM 0 HB2 GLN A 143 10.870 7.835 -11.711 1.00 0.44 H new ATOM 0 HB3 GLN A 143 11.355 7.593 -13.377 1.00 0.44 H new ATOM 0 HG2 GLN A 143 9.569 6.070 -13.028 1.00 0.65 H new ATOM 0 HG3 GLN A 143 11.015 5.080 -13.006 1.00 0.65 H new ATOM 0 HE21 GLN A 143 11.742 4.127 -11.054 1.00 1.12 H new ATOM 0 HE22 GLN A 143 10.694 4.027 -9.635 1.00 1.12 H new ATOM 2255 N GLY A 144 13.342 9.078 -13.025 1.00 0.40 N ATOM 2256 CA GLY A 144 14.139 10.060 -13.764 1.00 0.45 C ATOM 2257 C GLY A 144 14.240 11.427 -13.054 1.00 0.42 C ATOM 2258 O GLY A 144 14.425 12.453 -13.713 1.00 0.49 O ATOM 0 H GLY A 144 12.431 9.426 -12.725 1.00 0.40 H new ATOM 0 HA2 GLY A 144 15.143 9.663 -13.915 1.00 0.45 H new ATOM 0 HA3 GLY A 144 13.701 10.203 -14.752 1.00 0.45 H new ATOM 2262 N GLU A 145 14.118 11.426 -11.703 1.00 0.33 N ATOM 2263 CA GLU A 145 14.200 12.643 -10.879 1.00 0.32 C ATOM 2264 C GLU A 145 15.203 12.446 -9.726 1.00 0.27 C ATOM 2265 O GLU A 145 15.107 11.480 -8.961 1.00 0.36 O ATOM 2266 CB GLU A 145 12.802 13.002 -10.316 1.00 0.37 C ATOM 2267 CG GLU A 145 12.600 14.490 -9.960 1.00 0.80 C ATOM 2268 CD GLU A 145 12.407 15.372 -11.184 1.00 1.16 C ATOM 2269 OE1 GLU A 145 11.254 15.503 -11.645 1.00 1.53 O ATOM 2270 OE2 GLU A 145 13.410 15.929 -11.679 1.00 1.82 O ATOM 0 H GLU A 145 13.960 10.577 -11.160 1.00 0.33 H new ATOM 0 HA GLU A 145 14.549 13.464 -11.506 1.00 0.32 H new ATOM 0 HB2 GLU A 145 12.048 12.715 -11.049 1.00 0.37 H new ATOM 0 HB3 GLU A 145 12.623 12.404 -9.423 1.00 0.37 H new ATOM 0 HG2 GLU A 145 11.732 14.587 -9.308 1.00 0.80 H new ATOM 0 HG3 GLU A 145 13.463 14.844 -9.396 1.00 0.80 H new ATOM 2277 N VAL A 146 16.153 13.385 -9.597 1.00 0.30 N ATOM 2278 CA VAL A 146 17.196 13.313 -8.551 1.00 0.27 C ATOM 2279 C VAL A 146 17.042 14.477 -7.486 1.00 0.28 C ATOM 2280 O VAL A 146 16.898 15.657 -7.830 1.00 0.32 O ATOM 2281 CB VAL A 146 18.669 13.161 -9.233 1.00 0.31 C ATOM 2282 CG1 VAL A 146 19.263 14.444 -9.902 1.00 1.02 C ATOM 2283 CG2 VAL A 146 19.719 12.544 -8.272 1.00 0.72 C ATOM 0 H VAL A 146 16.224 14.204 -10.201 1.00 0.30 H new ATOM 0 HA VAL A 146 17.064 12.409 -7.956 1.00 0.27 H new ATOM 0 HB VAL A 146 18.464 12.470 -10.051 1.00 0.31 H new ATOM 0 HG11 VAL A 146 20.244 14.216 -10.319 1.00 1.02 H new ATOM 0 HG12 VAL A 146 18.599 14.780 -10.699 1.00 1.02 H new ATOM 0 HG13 VAL A 146 19.361 15.232 -9.155 1.00 1.02 H new ATOM 0 HG21 VAL A 146 20.679 12.468 -8.782 1.00 0.72 H new ATOM 0 HG22 VAL A 146 19.825 13.179 -7.393 1.00 0.72 H new ATOM 0 HG23 VAL A 146 19.392 11.551 -7.965 1.00 0.72 H new ATOM 2293 N SER A 147 17.073 14.079 -6.203 1.00 0.27 N ATOM 2294 CA SER A 147 16.959 14.998 -5.058 1.00 0.29 C ATOM 2295 C SER A 147 17.767 14.448 -3.867 1.00 0.29 C ATOM 2296 O SER A 147 18.399 13.389 -3.963 1.00 0.30 O ATOM 2297 CB SER A 147 15.485 15.179 -4.650 1.00 0.31 C ATOM 2298 OG SER A 147 14.839 16.159 -5.447 1.00 0.56 O ATOM 0 H SER A 147 17.179 13.102 -5.929 1.00 0.27 H new ATOM 0 HA SER A 147 17.358 15.969 -5.351 1.00 0.29 H new ATOM 0 HB2 SER A 147 14.961 14.228 -4.746 1.00 0.31 H new ATOM 0 HB3 SER A 147 15.430 15.469 -3.601 1.00 0.31 H new ATOM 0 HG SER A 147 15.295 16.230 -6.312 1.00 0.56 H new ATOM 2304 N THR A 148 17.793 15.182 -2.748 1.00 0.30 N ATOM 2305 CA THR A 148 18.523 14.714 -1.550 1.00 0.31 C ATOM 2306 C THR A 148 17.577 14.141 -0.425 1.00 0.27 C ATOM 2307 O THR A 148 16.522 14.709 -0.122 1.00 0.32 O ATOM 2308 CB THR A 148 19.615 15.775 -1.033 1.00 0.44 C ATOM 2309 OG1 THR A 148 20.404 15.228 0.038 1.00 1.25 O ATOM 2310 CG2 THR A 148 19.062 17.152 -0.578 1.00 0.99 C ATOM 0 H THR A 148 17.330 16.084 -2.641 1.00 0.30 H new ATOM 0 HA THR A 148 19.107 13.850 -1.867 1.00 0.31 H new ATOM 0 HB THR A 148 20.218 15.965 -1.921 1.00 0.44 H new ATOM 0 HG1 THR A 148 21.061 15.893 0.333 1.00 1.25 H new ATOM 0 HG21 THR A 148 19.887 17.785 -0.251 1.00 0.99 H new ATOM 0 HG22 THR A 148 18.546 17.630 -1.411 1.00 0.99 H new ATOM 0 HG23 THR A 148 18.364 17.009 0.247 1.00 0.99 H new ATOM 2318 N PHE A 149 18.014 13.004 0.177 1.00 0.26 N ATOM 2319 CA PHE A 149 17.288 12.304 1.281 1.00 0.24 C ATOM 2320 C PHE A 149 17.616 12.922 2.659 1.00 0.24 C ATOM 2321 O PHE A 149 18.787 12.989 3.058 1.00 0.29 O ATOM 2322 CB PHE A 149 17.670 10.790 1.293 1.00 0.23 C ATOM 2323 CG PHE A 149 17.050 9.966 2.440 1.00 0.22 C ATOM 2324 CD1 PHE A 149 15.671 9.754 2.512 1.00 0.22 C ATOM 2325 CD2 PHE A 149 17.848 9.434 3.461 1.00 0.24 C ATOM 2326 CE1 PHE A 149 15.112 9.044 3.561 1.00 0.24 C ATOM 2327 CE2 PHE A 149 17.286 8.719 4.505 1.00 0.26 C ATOM 2328 CZ PHE A 149 15.920 8.528 4.555 1.00 0.25 C ATOM 0 H PHE A 149 18.884 12.541 -0.088 1.00 0.26 H new ATOM 0 HA PHE A 149 16.220 12.419 1.098 1.00 0.24 H new ATOM 0 HB2 PHE A 149 17.367 10.348 0.344 1.00 0.23 H new ATOM 0 HB3 PHE A 149 18.755 10.706 1.352 1.00 0.23 H new ATOM 0 HD1 PHE A 149 15.031 10.150 1.737 1.00 0.22 H new ATOM 0 HD2 PHE A 149 18.917 9.584 3.433 1.00 0.24 H new ATOM 0 HE1 PHE A 149 14.043 8.894 3.602 1.00 0.24 H new ATOM 0 HE2 PHE A 149 17.917 8.311 5.281 1.00 0.26 H new ATOM 0 HZ PHE A 149 15.482 7.974 5.373 1.00 0.25 H new ATOM 2338 N THR A 150 16.571 13.359 3.382 1.00 0.25 N ATOM 2339 CA THR A 150 16.780 13.961 4.719 1.00 0.30 C ATOM 2340 C THR A 150 15.896 13.310 5.804 1.00 0.40 C ATOM 2341 O THR A 150 14.764 13.741 6.049 1.00 1.15 O ATOM 2342 CB THR A 150 16.558 15.526 4.748 1.00 0.66 C ATOM 2343 OG1 THR A 150 15.564 15.944 3.791 1.00 1.42 O ATOM 2344 CG2 THR A 150 17.863 16.316 4.496 1.00 1.18 C ATOM 0 H THR A 150 15.598 13.312 3.079 1.00 0.25 H new ATOM 0 HA THR A 150 17.828 13.763 4.942 1.00 0.30 H new ATOM 0 HB THR A 150 16.207 15.751 5.755 1.00 0.66 H new ATOM 0 HG1 THR A 150 15.452 16.916 3.839 1.00 1.42 H new ATOM 0 HG21 THR A 150 17.653 17.385 4.527 1.00 1.18 H new ATOM 0 HG22 THR A 150 18.593 16.067 5.266 1.00 1.18 H new ATOM 0 HG23 THR A 150 18.264 16.053 3.517 1.00 1.18 H new ATOM 2352 N GLY A 151 16.457 12.257 6.454 1.00 0.32 N ATOM 2353 CA GLY A 151 15.803 11.539 7.574 1.00 0.18 C ATOM 2354 C GLY A 151 14.680 10.532 7.257 1.00 0.20 C ATOM 2355 O GLY A 151 14.840 9.338 7.516 1.00 0.42 O ATOM 0 H GLY A 151 17.376 11.884 6.214 1.00 0.32 H new ATOM 0 HA2 GLY A 151 16.580 11.005 8.122 1.00 0.18 H new ATOM 0 HA3 GLY A 151 15.393 12.288 8.251 1.00 0.18 H new ATOM 2359 N LYS A 152 13.549 11.014 6.710 1.00 0.16 N ATOM 2360 CA LYS A 152 12.384 10.152 6.443 1.00 0.13 C ATOM 2361 C LYS A 152 11.815 10.270 5.007 1.00 0.13 C ATOM 2362 O LYS A 152 12.004 11.265 4.301 1.00 0.16 O ATOM 2363 CB LYS A 152 11.304 10.466 7.555 1.00 0.22 C ATOM 2364 CG LYS A 152 9.796 10.297 7.182 1.00 0.41 C ATOM 2365 CD LYS A 152 9.024 11.644 7.044 1.00 0.56 C ATOM 2366 CE LYS A 152 9.517 12.531 5.889 1.00 0.69 C ATOM 2367 NZ LYS A 152 8.685 13.757 5.747 1.00 1.10 N ATOM 0 H LYS A 152 13.418 11.990 6.446 1.00 0.16 H new ATOM 0 HA LYS A 152 12.699 9.110 6.495 1.00 0.13 H new ATOM 0 HB2 LYS A 152 11.510 9.824 8.411 1.00 0.22 H new ATOM 0 HB3 LYS A 152 11.453 11.494 7.884 1.00 0.22 H new ATOM 0 HG2 LYS A 152 9.724 9.750 6.242 1.00 0.41 H new ATOM 0 HG3 LYS A 152 9.310 9.687 7.944 1.00 0.41 H new ATOM 0 HD2 LYS A 152 7.965 11.431 6.899 1.00 0.56 H new ATOM 0 HD3 LYS A 152 9.112 12.199 7.978 1.00 0.56 H new ATOM 0 HE2 LYS A 152 10.555 12.813 6.064 1.00 0.69 H new ATOM 0 HE3 LYS A 152 9.493 11.964 4.958 1.00 0.69 H new ATOM 0 HZ1 LYS A 152 9.046 14.332 4.959 1.00 1.10 H new ATOM 0 HZ2 LYS A 152 7.699 13.487 5.556 1.00 1.10 H new ATOM 0 HZ3 LYS A 152 8.728 14.310 6.627 1.00 1.10 H new ATOM 2381 N LEU A 153 11.096 9.193 4.628 1.00 0.12 N ATOM 2382 CA LEU A 153 10.380 9.055 3.330 1.00 0.13 C ATOM 2383 C LEU A 153 8.857 9.182 3.571 1.00 0.13 C ATOM 2384 O LEU A 153 8.345 8.633 4.553 1.00 0.18 O ATOM 2385 CB LEU A 153 10.709 7.679 2.703 1.00 0.15 C ATOM 2386 CG LEU A 153 11.142 7.632 1.206 1.00 0.34 C ATOM 2387 CD1 LEU A 153 12.031 6.423 0.923 1.00 0.43 C ATOM 2388 CD2 LEU A 153 9.943 7.585 0.264 1.00 0.67 C ATOM 0 H LEU A 153 10.991 8.373 5.225 1.00 0.12 H new ATOM 0 HA LEU A 153 10.700 9.841 2.645 1.00 0.13 H new ATOM 0 HB2 LEU A 153 11.506 7.227 3.294 1.00 0.15 H new ATOM 0 HB3 LEU A 153 9.830 7.044 2.815 1.00 0.15 H new ATOM 0 HG LEU A 153 11.700 8.550 1.024 1.00 0.34 H new ATOM 0 HD11 LEU A 153 12.316 6.419 -0.129 1.00 0.43 H new ATOM 0 HD12 LEU A 153 12.927 6.478 1.541 1.00 0.43 H new ATOM 0 HD13 LEU A 153 11.486 5.508 1.155 1.00 0.43 H new ATOM 0 HD21 LEU A 153 10.292 7.553 -0.768 1.00 0.67 H new ATOM 0 HD22 LEU A 153 9.350 6.695 0.474 1.00 0.67 H new ATOM 0 HD23 LEU A 153 9.329 8.473 0.412 1.00 0.67 H new ATOM 2400 N SER A 154 8.115 9.890 2.692 1.00 0.14 N ATOM 2401 CA SER A 154 6.672 10.076 2.944 1.00 0.16 C ATOM 2402 C SER A 154 5.729 9.545 1.842 1.00 0.19 C ATOM 2403 O SER A 154 6.012 9.611 0.657 1.00 0.36 O ATOM 2404 CB SER A 154 6.394 11.578 3.163 1.00 0.21 C ATOM 2405 OG SER A 154 5.212 11.812 3.924 1.00 0.24 O ATOM 0 H SER A 154 8.471 10.324 1.840 1.00 0.14 H new ATOM 0 HA SER A 154 6.450 9.477 3.827 1.00 0.16 H new ATOM 0 HB2 SER A 154 7.245 12.031 3.672 1.00 0.21 H new ATOM 0 HB3 SER A 154 6.302 12.071 2.195 1.00 0.21 H new ATOM 0 HG SER A 154 4.962 10.993 4.400 1.00 0.24 H new ATOM 2411 N VAL A 155 4.579 9.013 2.285 1.00 0.16 N ATOM 2412 CA VAL A 155 3.515 8.534 1.356 1.00 0.19 C ATOM 2413 C VAL A 155 2.268 9.415 1.592 1.00 0.25 C ATOM 2414 O VAL A 155 1.499 9.176 2.530 1.00 0.30 O ATOM 2415 CB VAL A 155 3.075 6.990 1.450 1.00 0.28 C ATOM 2416 CG1 VAL A 155 3.204 6.286 0.081 1.00 0.39 C ATOM 2417 CG2 VAL A 155 3.828 6.139 2.499 1.00 0.74 C ATOM 0 H VAL A 155 4.352 8.899 3.273 1.00 0.16 H new ATOM 0 HA VAL A 155 3.953 8.616 0.361 1.00 0.19 H new ATOM 0 HB VAL A 155 2.037 7.046 1.778 1.00 0.28 H new ATOM 0 HG11 VAL A 155 2.899 5.244 0.178 1.00 0.39 H new ATOM 0 HG12 VAL A 155 2.564 6.785 -0.647 1.00 0.39 H new ATOM 0 HG13 VAL A 155 4.240 6.331 -0.255 1.00 0.39 H new ATOM 0 HG21 VAL A 155 3.451 5.116 2.476 1.00 0.74 H new ATOM 0 HG22 VAL A 155 4.894 6.139 2.270 1.00 0.74 H new ATOM 0 HG23 VAL A 155 3.670 6.561 3.491 1.00 0.74 H new ATOM 2427 N GLU A 156 2.088 10.430 0.728 1.00 0.28 N ATOM 2428 CA GLU A 156 0.974 11.374 0.863 1.00 0.36 C ATOM 2429 C GLU A 156 0.038 11.343 -0.338 1.00 0.34 C ATOM 2430 O GLU A 156 0.460 11.526 -1.489 1.00 0.38 O ATOM 2431 CB GLU A 156 1.508 12.807 1.059 1.00 0.53 C ATOM 2432 CG GLU A 156 2.016 13.116 2.473 1.00 0.73 C ATOM 2433 CD GLU A 156 2.669 14.482 2.568 1.00 1.26 C ATOM 2434 OE1 GLU A 156 1.942 15.474 2.788 1.00 1.67 O ATOM 2435 OE2 GLU A 156 3.907 14.560 2.422 1.00 1.66 O ATOM 0 H GLU A 156 2.700 10.614 -0.067 1.00 0.28 H new ATOM 0 HA GLU A 156 0.403 11.066 1.739 1.00 0.36 H new ATOM 0 HB2 GLU A 156 2.319 12.977 0.351 1.00 0.53 H new ATOM 0 HB3 GLU A 156 0.715 13.512 0.811 1.00 0.53 H new ATOM 0 HG2 GLU A 156 1.183 13.065 3.174 1.00 0.73 H new ATOM 0 HG3 GLU A 156 2.733 12.352 2.773 1.00 0.73 H new ATOM 2442 N PHE A 157 -1.252 11.115 -0.050 1.00 0.35 N ATOM 2443 CA PHE A 157 -2.280 11.082 -1.094 1.00 0.40 C ATOM 2444 C PHE A 157 -3.299 12.212 -0.914 1.00 0.41 C ATOM 2445 O PHE A 157 -3.815 12.475 0.196 1.00 0.43 O ATOM 2446 CB PHE A 157 -2.989 9.704 -1.229 1.00 0.51 C ATOM 2447 CG PHE A 157 -2.902 8.782 -0.017 1.00 0.60 C ATOM 2448 CD1 PHE A 157 -1.790 7.972 0.196 1.00 0.99 C ATOM 2449 CD2 PHE A 157 -3.935 8.748 0.922 1.00 1.03 C ATOM 2450 CE1 PHE A 157 -1.714 7.156 1.311 1.00 1.55 C ATOM 2451 CE2 PHE A 157 -3.856 7.931 2.035 1.00 1.60 C ATOM 2452 CZ PHE A 157 -2.742 7.060 2.171 1.00 1.80 C ATOM 0 H PHE A 157 -1.604 10.952 0.893 1.00 0.35 H new ATOM 0 HA PHE A 157 -1.750 11.241 -2.033 1.00 0.40 H new ATOM 0 HB2 PHE A 157 -4.042 9.880 -1.451 1.00 0.51 H new ATOM 0 HB3 PHE A 157 -2.565 9.183 -2.087 1.00 0.51 H new ATOM 0 HD1 PHE A 157 -0.978 7.981 -0.516 1.00 0.99 H new ATOM 0 HD2 PHE A 157 -4.807 9.368 0.777 1.00 1.03 H new ATOM 0 HE1 PHE A 157 -0.814 6.587 1.493 1.00 1.55 H new ATOM 0 HE2 PHE A 157 -4.629 7.955 2.789 1.00 1.60 H new ATOM 0 HZ PHE A 157 -2.721 6.324 2.962 1.00 1.80 H new ATOM 2462 N VAL A 158 -3.563 12.871 -2.056 1.00 0.43 N ATOM 2463 CA VAL A 158 -4.479 14.050 -2.145 1.00 0.46 C ATOM 2464 C VAL A 158 -5.829 13.644 -2.831 1.00 0.48 C ATOM 2465 O VAL A 158 -5.868 12.839 -3.776 1.00 0.47 O ATOM 2466 CB VAL A 158 -3.828 15.335 -2.897 1.00 0.50 C ATOM 2467 CG1 VAL A 158 -4.414 16.686 -2.401 1.00 0.58 C ATOM 2468 CG2 VAL A 158 -2.287 15.456 -2.764 1.00 0.58 C ATOM 0 H VAL A 158 -3.152 12.610 -2.952 1.00 0.43 H new ATOM 0 HA VAL A 158 -4.665 14.363 -1.118 1.00 0.46 H new ATOM 0 HB VAL A 158 -4.087 15.147 -3.939 1.00 0.50 H new ATOM 0 HG11 VAL A 158 -3.941 17.507 -2.939 1.00 0.58 H new ATOM 0 HG12 VAL A 158 -5.489 16.705 -2.582 1.00 0.58 H new ATOM 0 HG13 VAL A 158 -4.224 16.795 -1.333 1.00 0.58 H new ATOM 0 HG21 VAL A 158 -1.944 16.343 -3.298 1.00 0.58 H new ATOM 0 HG22 VAL A 158 -2.018 15.540 -1.711 1.00 0.58 H new ATOM 0 HG23 VAL A 158 -1.814 14.571 -3.190 1.00 0.58 H new ATOM 2478 N LYS A 159 -6.922 14.265 -2.328 1.00 0.52 N ATOM 2479 CA LYS A 159 -8.316 14.030 -2.789 1.00 0.56 C ATOM 2480 C LYS A 159 -8.743 14.884 -4.019 1.00 0.66 C ATOM 2481 O LYS A 159 -8.263 16.008 -4.225 1.00 0.81 O ATOM 2482 CB LYS A 159 -9.305 14.271 -1.601 1.00 0.72 C ATOM 2483 CG LYS A 159 -9.675 15.758 -1.309 1.00 1.06 C ATOM 2484 CD LYS A 159 -8.520 16.566 -0.673 1.00 1.48 C ATOM 2485 CE LYS A 159 -8.833 18.072 -0.599 1.00 1.63 C ATOM 2486 NZ LYS A 159 -8.902 18.687 -1.954 1.00 2.18 N ATOM 0 H LYS A 159 -6.862 14.955 -1.579 1.00 0.52 H new ATOM 0 HA LYS A 159 -8.353 12.994 -3.125 1.00 0.56 H new ATOM 0 HB2 LYS A 159 -10.225 13.722 -1.803 1.00 0.72 H new ATOM 0 HB3 LYS A 159 -8.869 13.842 -0.699 1.00 0.72 H new ATOM 0 HG2 LYS A 159 -9.975 16.239 -2.240 1.00 1.06 H new ATOM 0 HG3 LYS A 159 -10.537 15.786 -0.643 1.00 1.06 H new ATOM 0 HD2 LYS A 159 -8.324 16.188 0.330 1.00 1.48 H new ATOM 0 HD3 LYS A 159 -7.610 16.414 -1.254 1.00 1.48 H new ATOM 0 HE2 LYS A 159 -9.781 18.222 -0.083 1.00 1.63 H new ATOM 0 HE3 LYS A 159 -8.066 18.575 -0.010 1.00 1.63 H new ATOM 0 HZ1 LYS A 159 -8.911 19.723 -1.865 1.00 2.18 H new ATOM 0 HZ2 LYS A 159 -8.074 18.394 -2.511 1.00 2.18 H new ATOM 0 HZ3 LYS A 159 -9.770 18.374 -2.434 1.00 2.18 H new ATOM 2500 N GLY A 160 -9.666 14.314 -4.816 1.00 0.74 N ATOM 2501 CA GLY A 160 -10.200 14.984 -6.013 1.00 0.93 C ATOM 2502 C GLY A 160 -11.610 15.577 -5.821 1.00 0.96 C ATOM 2503 O GLY A 160 -11.829 16.754 -6.120 1.00 1.02 O ATOM 0 H GLY A 160 -10.058 13.387 -4.650 1.00 0.74 H new ATOM 0 HA2 GLY A 160 -9.518 15.782 -6.305 1.00 0.93 H new ATOM 0 HA3 GLY A 160 -10.226 14.270 -6.836 1.00 0.93 H new ATOM 2507 N TYR A 161 -12.559 14.751 -5.327 1.00 0.96 N ATOM 2508 CA TYR A 161 -13.948 15.197 -5.082 1.00 1.02 C ATOM 2509 C TYR A 161 -14.425 14.831 -3.653 1.00 1.05 C ATOM 2510 O TYR A 161 -14.347 15.661 -2.744 1.00 1.11 O ATOM 2511 CB TYR A 161 -14.904 14.611 -6.146 1.00 1.14 C ATOM 2512 CG TYR A 161 -14.882 15.346 -7.494 1.00 1.34 C ATOM 2513 CD1 TYR A 161 -15.712 16.447 -7.738 1.00 1.81 C ATOM 2514 CD2 TYR A 161 -14.028 14.937 -8.526 1.00 1.63 C ATOM 2515 CE1 TYR A 161 -15.689 17.106 -8.957 1.00 2.26 C ATOM 2516 CE2 TYR A 161 -14.007 15.599 -9.743 1.00 2.07 C ATOM 2517 CZ TYR A 161 -14.845 16.692 -9.943 1.00 2.29 C ATOM 2518 OH TYR A 161 -14.813 17.335 -11.159 1.00 2.86 O ATOM 0 H TYR A 161 -12.388 13.774 -5.091 1.00 0.96 H new ATOM 0 HA TYR A 161 -13.963 16.284 -5.162 1.00 1.02 H new ATOM 0 HB2 TYR A 161 -14.645 13.565 -6.312 1.00 1.14 H new ATOM 0 HB3 TYR A 161 -15.920 14.629 -5.753 1.00 1.14 H new ATOM 0 HD1 TYR A 161 -16.382 16.789 -6.963 1.00 1.81 H new ATOM 0 HD2 TYR A 161 -13.375 14.091 -8.371 1.00 1.63 H new ATOM 0 HE1 TYR A 161 -16.342 17.950 -9.126 1.00 2.26 H new ATOM 0 HE2 TYR A 161 -13.345 15.269 -10.530 1.00 2.07 H new ATOM 0 HH TYR A 161 -14.151 16.904 -11.739 1.00 2.86 H new ATOM 2528 N TYR A 162 -14.920 13.586 -3.470 1.00 1.09 N ATOM 2529 CA TYR A 162 -15.405 13.097 -2.162 1.00 1.17 C ATOM 2530 C TYR A 162 -14.989 11.632 -1.955 1.00 1.10 C ATOM 2531 O TYR A 162 -15.322 10.766 -2.774 1.00 1.71 O ATOM 2532 CB TYR A 162 -16.939 13.227 -2.074 1.00 1.54 C ATOM 2533 CG TYR A 162 -17.448 13.822 -0.752 1.00 1.88 C ATOM 2534 CD1 TYR A 162 -17.639 13.022 0.381 1.00 2.00 C ATOM 2535 CD2 TYR A 162 -17.743 15.185 -0.639 1.00 2.57 C ATOM 2536 CE1 TYR A 162 -18.103 13.561 1.571 1.00 2.64 C ATOM 2537 CE2 TYR A 162 -18.206 15.724 0.552 1.00 3.18 C ATOM 2538 CZ TYR A 162 -18.366 14.902 1.657 1.00 3.16 C ATOM 2539 OH TYR A 162 -18.843 15.443 2.829 1.00 3.91 O ATOM 0 H TYR A 162 -14.994 12.898 -4.219 1.00 1.09 H new ATOM 0 HA TYR A 162 -14.957 13.706 -1.377 1.00 1.17 H new ATOM 0 HB2 TYR A 162 -17.287 13.851 -2.897 1.00 1.54 H new ATOM 0 HB3 TYR A 162 -17.384 12.241 -2.211 1.00 1.54 H new ATOM 0 HD1 TYR A 162 -17.421 11.966 0.327 1.00 2.00 H new ATOM 0 HD2 TYR A 162 -17.608 15.829 -1.495 1.00 2.57 H new ATOM 0 HE1 TYR A 162 -18.257 12.924 2.429 1.00 2.64 H new ATOM 0 HE2 TYR A 162 -18.440 16.776 0.618 1.00 3.18 H new ATOM 0 HH TYR A 162 -18.974 16.408 2.715 1.00 3.91 H new ATOM 2549 N ASP A 163 -14.242 11.368 -0.835 1.00 1.04 N ATOM 2550 CA ASP A 163 -13.689 10.011 -0.462 1.00 0.99 C ATOM 2551 C ASP A 163 -12.342 9.759 -1.145 1.00 1.06 C ATOM 2552 O ASP A 163 -12.258 9.657 -2.368 1.00 1.74 O ATOM 2553 CB ASP A 163 -14.652 8.831 -0.753 1.00 1.11 C ATOM 2554 CG ASP A 163 -15.593 8.535 0.408 1.00 1.19 C ATOM 2555 OD1 ASP A 163 -16.630 9.221 0.522 1.00 1.34 O ATOM 2556 OD2 ASP A 163 -15.292 7.615 1.197 1.00 1.27 O ATOM 0 H ASP A 163 -14.002 12.092 -0.158 1.00 1.04 H new ATOM 0 HA ASP A 163 -13.558 10.046 0.619 1.00 0.99 H new ATOM 0 HB2 ASP A 163 -15.240 9.059 -1.642 1.00 1.11 H new ATOM 0 HB3 ASP A 163 -14.068 7.939 -0.978 1.00 1.11 H new ATOM 2561 N ASN A 164 -11.292 9.654 -0.309 1.00 0.83 N ATOM 2562 CA ASN A 164 -9.892 9.380 -0.741 1.00 0.83 C ATOM 2563 C ASN A 164 -9.677 7.837 -0.964 1.00 1.01 C ATOM 2564 O ASN A 164 -10.672 7.095 -0.965 1.00 1.68 O ATOM 2565 CB ASN A 164 -8.973 9.924 0.378 1.00 1.02 C ATOM 2566 CG ASN A 164 -8.027 11.040 -0.068 1.00 0.88 C ATOM 2567 OD1 ASN A 164 -7.659 11.141 -1.239 1.00 1.57 O ATOM 2568 ND2 ASN A 164 -7.624 11.879 0.883 1.00 0.82 N ATOM 0 H ASN A 164 -11.385 9.757 0.702 1.00 0.83 H new ATOM 0 HA ASN A 164 -9.665 9.865 -1.690 1.00 0.83 H new ATOM 0 HB2 ASN A 164 -9.594 10.295 1.193 1.00 1.02 H new ATOM 0 HB3 ASN A 164 -8.381 9.101 0.778 1.00 1.02 H new ATOM 0 HD21 ASN A 164 -6.986 12.641 0.654 1.00 0.82 H new ATOM 0 HD22 ASN A 164 -7.953 11.760 1.841 1.00 0.82 H new ATOM 2575 N PRO A 165 -8.420 7.291 -1.217 1.00 0.87 N ATOM 2576 CA PRO A 165 -8.198 5.800 -1.342 1.00 1.06 C ATOM 2577 C PRO A 165 -8.559 5.047 -0.034 1.00 0.93 C ATOM 2578 O PRO A 165 -7.801 5.051 0.942 1.00 1.76 O ATOM 2579 CB PRO A 165 -6.694 5.691 -1.650 1.00 1.45 C ATOM 2580 CG PRO A 165 -6.364 7.004 -2.296 1.00 2.06 C ATOM 2581 CD PRO A 165 -7.165 8.027 -1.516 1.00 1.41 C ATOM 0 HA PRO A 165 -8.828 5.347 -2.107 1.00 1.06 H new ATOM 0 HB2 PRO A 165 -6.110 5.534 -0.743 1.00 1.45 H new ATOM 0 HB3 PRO A 165 -6.482 4.854 -2.315 1.00 1.45 H new ATOM 0 HG2 PRO A 165 -5.296 7.214 -2.244 1.00 2.06 H new ATOM 0 HG3 PRO A 165 -6.638 7.007 -3.351 1.00 2.06 H new ATOM 0 HD2 PRO A 165 -6.650 8.338 -0.607 1.00 1.41 H new ATOM 0 HD3 PRO A 165 -7.352 8.928 -2.101 1.00 1.41 H new ATOM 2589 N LYS A 166 -9.775 4.432 -0.062 1.00 0.54 N ATOM 2590 CA LYS A 166 -10.424 3.744 1.092 1.00 0.47 C ATOM 2591 C LYS A 166 -9.631 2.544 1.718 1.00 0.42 C ATOM 2592 O LYS A 166 -9.470 2.503 2.941 1.00 0.47 O ATOM 2593 CB LYS A 166 -11.843 3.305 0.671 1.00 0.82 C ATOM 2594 CG LYS A 166 -12.848 3.167 1.840 1.00 1.30 C ATOM 2595 CD LYS A 166 -14.251 2.725 1.368 1.00 1.83 C ATOM 2596 CE LYS A 166 -15.278 2.747 2.511 1.00 2.33 C ATOM 2597 NZ LYS A 166 -16.595 2.210 2.080 1.00 3.00 N ATOM 0 H LYS A 166 -10.345 4.400 -0.908 1.00 0.54 H new ATOM 0 HA LYS A 166 -10.451 4.477 1.898 1.00 0.47 H new ATOM 0 HB2 LYS A 166 -12.235 4.027 -0.045 1.00 0.82 H new ATOM 0 HB3 LYS A 166 -11.775 2.348 0.153 1.00 0.82 H new ATOM 0 HG2 LYS A 166 -12.466 2.443 2.559 1.00 1.30 H new ATOM 0 HG3 LYS A 166 -12.928 4.121 2.360 1.00 1.30 H new ATOM 0 HD2 LYS A 166 -14.587 3.382 0.566 1.00 1.83 H new ATOM 0 HD3 LYS A 166 -14.193 1.719 0.952 1.00 1.83 H new ATOM 0 HE2 LYS A 166 -14.902 2.159 3.349 1.00 2.33 H new ATOM 0 HE3 LYS A 166 -15.402 3.769 2.869 1.00 2.33 H new ATOM 0 HZ1 LYS A 166 -17.195 2.051 2.914 1.00 3.00 H new ATOM 0 HZ2 LYS A 166 -17.058 2.893 1.446 1.00 3.00 H new ATOM 0 HZ3 LYS A 166 -16.455 1.310 1.577 1.00 3.00 H new ATOM 2611 N VAL A 167 -9.143 1.580 0.888 1.00 0.39 N ATOM 2612 CA VAL A 167 -8.328 0.438 1.413 1.00 0.38 C ATOM 2613 C VAL A 167 -6.840 0.636 0.971 1.00 0.34 C ATOM 2614 O VAL A 167 -6.547 0.800 -0.226 1.00 0.33 O ATOM 2615 CB VAL A 167 -8.877 -1.013 0.957 1.00 0.45 C ATOM 2616 CG1 VAL A 167 -8.132 -2.201 1.632 1.00 0.80 C ATOM 2617 CG2 VAL A 167 -10.387 -1.232 1.239 1.00 0.58 C ATOM 0 H VAL A 167 -9.292 1.565 -0.121 1.00 0.39 H new ATOM 0 HA VAL A 167 -8.408 0.448 2.500 1.00 0.38 H new ATOM 0 HB VAL A 167 -8.692 -1.004 -0.117 1.00 0.45 H new ATOM 0 HG11 VAL A 167 -8.553 -3.142 1.279 1.00 0.80 H new ATOM 0 HG12 VAL A 167 -7.073 -2.159 1.376 1.00 0.80 H new ATOM 0 HG13 VAL A 167 -8.247 -2.135 2.714 1.00 0.80 H new ATOM 0 HG21 VAL A 167 -10.679 -2.228 0.905 1.00 0.58 H new ATOM 0 HG22 VAL A 167 -10.575 -1.138 2.309 1.00 0.58 H new ATOM 0 HG23 VAL A 167 -10.970 -0.484 0.702 1.00 0.58 H new ATOM 2627 N CYS A 168 -5.932 0.482 1.962 1.00 0.35 N ATOM 2628 CA CYS A 168 -4.487 0.666 1.756 1.00 0.35 C ATOM 2629 C CYS A 168 -3.655 -0.436 2.453 1.00 0.36 C ATOM 2630 O CYS A 168 -3.745 -0.628 3.668 1.00 0.48 O ATOM 2631 CB CYS A 168 -4.098 2.031 2.306 1.00 0.37 C ATOM 2632 SG CYS A 168 -2.664 2.788 1.507 1.00 0.87 S ATOM 0 H CYS A 168 -6.183 0.229 2.918 1.00 0.35 H new ATOM 0 HA CYS A 168 -4.275 0.600 0.689 1.00 0.35 H new ATOM 0 HB2 CYS A 168 -4.950 2.704 2.206 1.00 0.37 H new ATOM 0 HB3 CYS A 168 -3.893 1.933 3.372 1.00 0.37 H new ATOM 0 HG CYS A 168 -2.894 2.917 0.234 1.00 0.87 H new ATOM 2638 N ALA A 169 -2.810 -1.127 1.652 1.00 0.29 N ATOM 2639 CA ALA A 169 -1.957 -2.270 2.099 1.00 0.29 C ATOM 2640 C ALA A 169 -0.409 -2.077 1.930 1.00 0.25 C ATOM 2641 O ALA A 169 0.274 -2.864 1.232 1.00 0.26 O ATOM 2642 CB ALA A 169 -2.458 -3.633 1.590 1.00 0.34 C ATOM 0 H ALA A 169 -2.695 -0.909 0.662 1.00 0.29 H new ATOM 0 HA ALA A 169 -2.089 -2.273 3.181 1.00 0.29 H new ATOM 0 HB1 ALA A 169 -1.796 -4.421 1.949 1.00 0.34 H new ATOM 0 HB2 ALA A 169 -3.468 -3.811 1.960 1.00 0.34 H new ATOM 0 HB3 ALA A 169 -2.466 -3.634 0.500 1.00 0.34 H new ATOM 2648 N LEU A 170 0.104 -0.896 2.392 1.00 0.22 N ATOM 2649 CA LEU A 170 1.563 -0.491 2.384 1.00 0.21 C ATOM 2650 C LEU A 170 2.593 -1.592 2.785 1.00 0.19 C ATOM 2651 O LEU A 170 2.396 -2.334 3.752 1.00 0.34 O ATOM 2652 CB LEU A 170 1.754 0.667 3.383 1.00 0.31 C ATOM 2653 CG LEU A 170 2.171 2.075 2.841 1.00 0.38 C ATOM 2654 CD1 LEU A 170 3.447 2.037 1.978 1.00 0.50 C ATOM 2655 CD2 LEU A 170 1.038 2.742 2.051 1.00 0.70 C ATOM 0 H LEU A 170 -0.495 -0.174 2.793 1.00 0.22 H new ATOM 0 HA LEU A 170 1.768 -0.238 1.344 1.00 0.21 H new ATOM 0 HB2 LEU A 170 0.818 0.788 3.929 1.00 0.31 H new ATOM 0 HB3 LEU A 170 2.508 0.356 4.107 1.00 0.31 H new ATOM 0 HG LEU A 170 2.386 2.671 3.728 1.00 0.38 H new ATOM 0 HD11 LEU A 170 3.683 3.044 1.633 1.00 0.50 H new ATOM 0 HD12 LEU A 170 4.277 1.653 2.572 1.00 0.50 H new ATOM 0 HD13 LEU A 170 3.285 1.387 1.118 1.00 0.50 H new ATOM 0 HD21 LEU A 170 1.369 3.717 1.693 1.00 0.70 H new ATOM 0 HD22 LEU A 170 0.769 2.115 1.201 1.00 0.70 H new ATOM 0 HD23 LEU A 170 0.169 2.869 2.697 1.00 0.70 H new ATOM 2667 N PHE A 171 3.677 -1.673 2.007 1.00 0.16 N ATOM 2668 CA PHE A 171 4.736 -2.660 2.230 1.00 0.14 C ATOM 2669 C PHE A 171 6.098 -2.141 1.703 1.00 0.14 C ATOM 2670 O PHE A 171 6.313 -2.101 0.487 1.00 0.19 O ATOM 2671 CB PHE A 171 4.319 -3.987 1.514 1.00 0.17 C ATOM 2672 CG PHE A 171 5.375 -5.096 1.399 1.00 0.16 C ATOM 2673 CD1 PHE A 171 6.366 -5.233 2.375 1.00 0.15 C ATOM 2674 CD2 PHE A 171 5.380 -5.999 0.333 1.00 0.20 C ATOM 2675 CE1 PHE A 171 7.317 -6.231 2.287 1.00 0.15 C ATOM 2676 CE2 PHE A 171 6.328 -6.989 0.251 1.00 0.21 C ATOM 2677 CZ PHE A 171 7.287 -7.110 1.157 1.00 0.17 C ATOM 0 H PHE A 171 3.844 -1.059 1.209 1.00 0.16 H new ATOM 0 HA PHE A 171 4.861 -2.840 3.298 1.00 0.14 H new ATOM 0 HB2 PHE A 171 3.458 -4.397 2.042 1.00 0.17 H new ATOM 0 HB3 PHE A 171 3.986 -3.735 0.507 1.00 0.17 H new ATOM 0 HD1 PHE A 171 6.389 -4.549 3.210 1.00 0.15 H new ATOM 0 HD2 PHE A 171 4.628 -5.917 -0.437 1.00 0.20 H new ATOM 0 HE1 PHE A 171 8.068 -6.346 3.055 1.00 0.15 H new ATOM 0 HE2 PHE A 171 6.291 -7.686 -0.573 1.00 0.21 H new ATOM 0 HZ PHE A 171 8.045 -7.871 1.043 1.00 0.17 H new ATOM 2687 N ILE A 172 7.021 -1.750 2.615 1.00 0.10 N ATOM 2688 CA ILE A 172 8.371 -1.336 2.179 1.00 0.10 C ATOM 2689 C ILE A 172 9.475 -2.321 2.731 1.00 0.08 C ATOM 2690 O ILE A 172 9.629 -2.536 3.973 1.00 0.08 O ATOM 2691 CB ILE A 172 8.746 0.225 2.378 1.00 0.13 C ATOM 2692 CG1 ILE A 172 9.966 0.576 1.387 1.00 0.14 C ATOM 2693 CG2 ILE A 172 8.992 0.636 3.875 1.00 0.22 C ATOM 2694 CD1 ILE A 172 10.502 2.030 1.332 1.00 0.31 C ATOM 0 H ILE A 172 6.862 -1.713 3.622 1.00 0.10 H new ATOM 0 HA ILE A 172 8.346 -1.422 1.093 1.00 0.10 H new ATOM 0 HB ILE A 172 7.886 0.837 2.108 1.00 0.13 H new ATOM 0 HG12 ILE A 172 10.801 -0.072 1.653 1.00 0.14 H new ATOM 0 HG13 ILE A 172 9.658 0.301 0.378 1.00 0.14 H new ATOM 0 HG21 ILE A 172 9.238 1.697 3.925 1.00 0.22 H new ATOM 0 HG22 ILE A 172 8.091 0.445 4.458 1.00 0.22 H new ATOM 0 HG23 ILE A 172 9.818 0.052 4.282 1.00 0.22 H new ATOM 0 HD11 ILE A 172 11.321 2.089 0.615 1.00 0.31 H new ATOM 0 HD12 ILE A 172 9.701 2.702 1.024 1.00 0.31 H new ATOM 0 HD13 ILE A 172 10.862 2.323 2.318 1.00 0.31 H new ATOM 2706 N MET A 173 10.233 -2.887 1.783 1.00 0.09 N ATOM 2707 CA MET A 173 11.320 -3.826 2.092 1.00 0.11 C ATOM 2708 C MET A 173 12.688 -3.315 1.575 1.00 0.13 C ATOM 2709 O MET A 173 12.758 -2.367 0.776 1.00 0.21 O ATOM 2710 CB MET A 173 10.982 -5.249 1.578 1.00 0.15 C ATOM 2711 CG MET A 173 10.383 -5.302 0.156 1.00 0.17 C ATOM 2712 SD MET A 173 11.624 -5.166 -1.149 1.00 0.44 S ATOM 2713 CE MET A 173 12.628 -6.620 -0.851 1.00 0.26 C ATOM 0 H MET A 173 10.112 -2.709 0.786 1.00 0.09 H new ATOM 0 HA MET A 173 11.413 -3.889 3.176 1.00 0.11 H new ATOM 0 HB2 MET A 173 11.890 -5.851 1.596 1.00 0.15 H new ATOM 0 HB3 MET A 173 10.279 -5.712 2.270 1.00 0.15 H new ATOM 0 HG2 MET A 173 9.839 -6.238 0.034 1.00 0.17 H new ATOM 0 HG3 MET A 173 9.659 -4.495 0.044 1.00 0.17 H new ATOM 0 HE1 MET A 173 13.094 -6.938 -1.784 1.00 0.26 H new ATOM 0 HE2 MET A 173 13.402 -6.384 -0.120 1.00 0.26 H new ATOM 0 HE3 MET A 173 12.000 -7.424 -0.468 1.00 0.26 H new ATOM 2723 N LYS A 174 13.781 -3.965 2.020 1.00 0.12 N ATOM 2724 CA LYS A 174 15.119 -3.500 1.713 1.00 0.19 C ATOM 2725 C LYS A 174 16.050 -4.449 0.897 1.00 0.16 C ATOM 2726 O LYS A 174 16.037 -5.676 1.003 1.00 0.17 O ATOM 2727 CB LYS A 174 15.745 -3.169 3.091 1.00 0.38 C ATOM 2728 CG LYS A 174 17.230 -2.806 3.089 1.00 0.54 C ATOM 2729 CD LYS A 174 17.778 -2.582 4.513 1.00 0.57 C ATOM 2730 CE LYS A 174 19.267 -2.266 4.494 1.00 0.49 C ATOM 2731 NZ LYS A 174 19.750 -1.776 5.814 1.00 1.26 N ATOM 0 H LYS A 174 13.749 -4.810 2.591 1.00 0.12 H new ATOM 0 HA LYS A 174 15.027 -2.655 1.030 1.00 0.19 H new ATOM 0 HB2 LYS A 174 15.190 -2.339 3.529 1.00 0.38 H new ATOM 0 HB3 LYS A 174 15.603 -4.028 3.747 1.00 0.38 H new ATOM 0 HG2 LYS A 174 17.796 -3.602 2.605 1.00 0.54 H new ATOM 0 HG3 LYS A 174 17.381 -1.903 2.498 1.00 0.54 H new ATOM 0 HD2 LYS A 174 17.237 -1.763 4.988 1.00 0.57 H new ATOM 0 HD3 LYS A 174 17.602 -3.473 5.116 1.00 0.57 H new ATOM 0 HE2 LYS A 174 19.824 -3.160 4.213 1.00 0.49 H new ATOM 0 HE3 LYS A 174 19.468 -1.513 3.732 1.00 0.49 H new ATOM 0 HZ1 LYS A 174 20.768 -1.573 5.757 1.00 1.26 H new ATOM 0 HZ2 LYS A 174 19.237 -0.908 6.071 1.00 1.26 H new ATOM 0 HZ3 LYS A 174 19.582 -2.504 6.537 1.00 1.26 H new ATOM 2745 N GLY A 175 16.847 -3.746 0.087 1.00 0.14 N ATOM 2746 CA GLY A 175 17.961 -4.260 -0.722 1.00 0.15 C ATOM 2747 C GLY A 175 17.803 -4.415 -2.248 1.00 0.13 C ATOM 2748 O GLY A 175 18.696 -3.896 -2.937 1.00 0.17 O ATOM 0 H GLY A 175 16.726 -2.740 -0.030 1.00 0.14 H new ATOM 0 HA2 GLY A 175 18.815 -3.605 -0.550 1.00 0.15 H new ATOM 0 HA3 GLY A 175 18.226 -5.239 -0.323 1.00 0.15 H new ATOM 2752 N THR A 176 16.637 -4.900 -2.801 1.00 0.11 N ATOM 2753 CA THR A 176 16.463 -5.087 -4.297 1.00 0.10 C ATOM 2754 C THR A 176 15.047 -5.567 -4.701 1.00 0.10 C ATOM 2755 O THR A 176 14.290 -6.117 -3.893 1.00 0.13 O ATOM 2756 CB THR A 176 17.462 -6.122 -4.975 1.00 0.12 C ATOM 2757 OG1 THR A 176 18.011 -7.068 -4.034 1.00 0.15 O ATOM 2758 CG2 THR A 176 18.614 -5.447 -5.756 1.00 0.15 C ATOM 0 H THR A 176 15.819 -5.164 -2.251 1.00 0.11 H new ATOM 0 HA THR A 176 16.669 -4.079 -4.656 1.00 0.10 H new ATOM 0 HB THR A 176 16.841 -6.661 -5.691 1.00 0.12 H new ATOM 0 HG1 THR A 176 18.616 -7.681 -4.502 1.00 0.15 H new ATOM 0 HG21 THR A 176 19.256 -6.213 -6.192 1.00 0.15 H new ATOM 0 HG22 THR A 176 18.200 -4.826 -6.550 1.00 0.15 H new ATOM 0 HG23 THR A 176 19.199 -4.826 -5.077 1.00 0.15 H new ATOM 2766 N ALA A 177 14.720 -5.358 -6.018 1.00 0.10 N ATOM 2767 CA ALA A 177 13.436 -5.789 -6.665 1.00 0.11 C ATOM 2768 C ALA A 177 13.401 -7.316 -7.079 1.00 0.15 C ATOM 2769 O ALA A 177 12.338 -7.856 -7.425 1.00 0.17 O ATOM 2770 CB ALA A 177 13.158 -4.882 -7.889 1.00 0.15 C ATOM 0 H ALA A 177 15.348 -4.881 -6.665 1.00 0.10 H new ATOM 0 HA ALA A 177 12.650 -5.678 -5.918 1.00 0.11 H new ATOM 0 HB1 ALA A 177 12.227 -5.189 -8.365 1.00 0.15 H new ATOM 0 HB2 ALA A 177 13.075 -3.845 -7.562 1.00 0.15 H new ATOM 0 HB3 ALA A 177 13.977 -4.973 -8.603 1.00 0.15 H new ATOM 2776 N ASP A 178 14.574 -8.012 -7.009 1.00 0.19 N ATOM 2777 CA ASP A 178 14.698 -9.467 -7.332 1.00 0.24 C ATOM 2778 C ASP A 178 14.405 -10.425 -6.119 1.00 0.26 C ATOM 2779 O ASP A 178 14.496 -11.648 -6.262 1.00 0.31 O ATOM 2780 CB ASP A 178 16.107 -9.758 -7.878 1.00 0.31 C ATOM 2781 CG ASP A 178 16.176 -9.743 -9.401 1.00 0.42 C ATOM 2782 OD1 ASP A 178 15.933 -10.802 -10.018 1.00 0.55 O ATOM 2783 OD2 ASP A 178 16.471 -8.671 -9.973 1.00 0.51 O ATOM 0 H ASP A 178 15.456 -7.583 -6.729 1.00 0.19 H new ATOM 0 HA ASP A 178 13.933 -9.674 -8.080 1.00 0.24 H new ATOM 0 HB2 ASP A 178 16.803 -9.018 -7.482 1.00 0.31 H new ATOM 0 HB3 ASP A 178 16.436 -10.732 -7.515 1.00 0.31 H new ATOM 2788 N ASP A 179 14.045 -9.850 -4.944 1.00 0.24 N ATOM 2789 CA ASP A 179 13.725 -10.620 -3.712 1.00 0.31 C ATOM 2790 C ASP A 179 12.202 -10.638 -3.368 1.00 0.32 C ATOM 2791 O ASP A 179 11.785 -11.384 -2.481 1.00 0.44 O ATOM 2792 CB ASP A 179 14.509 -10.052 -2.521 1.00 0.37 C ATOM 2793 CG ASP A 179 15.793 -10.821 -2.228 1.00 0.48 C ATOM 2794 OD1 ASP A 179 16.824 -10.522 -2.868 1.00 0.52 O ATOM 2795 OD2 ASP A 179 15.762 -11.720 -1.361 1.00 0.60 O ATOM 0 H ASP A 179 13.968 -8.840 -4.822 1.00 0.24 H new ATOM 0 HA ASP A 179 14.019 -11.651 -3.910 1.00 0.31 H new ATOM 0 HB2 ASP A 179 14.755 -9.009 -2.720 1.00 0.37 H new ATOM 0 HB3 ASP A 179 13.874 -10.067 -1.635 1.00 0.37 H new ATOM 2800 N VAL A 180 11.395 -9.793 -4.064 1.00 0.24 N ATOM 2801 CA VAL A 180 9.902 -9.708 -3.881 1.00 0.29 C ATOM 2802 C VAL A 180 9.120 -10.677 -4.852 1.00 0.50 C ATOM 2803 O VAL A 180 8.839 -10.295 -5.993 1.00 0.95 O ATOM 2804 CB VAL A 180 9.271 -8.231 -4.040 1.00 0.27 C ATOM 2805 CG1 VAL A 180 9.064 -7.563 -2.673 1.00 0.48 C ATOM 2806 CG2 VAL A 180 10.064 -7.240 -4.944 1.00 0.50 C ATOM 0 H VAL A 180 11.751 -9.148 -4.769 1.00 0.24 H new ATOM 0 HA VAL A 180 9.772 -10.013 -2.843 1.00 0.29 H new ATOM 0 HB VAL A 180 8.325 -8.424 -4.545 1.00 0.27 H new ATOM 0 HG11 VAL A 180 8.638 -6.570 -2.814 1.00 0.48 H new ATOM 0 HG12 VAL A 180 8.385 -8.167 -2.072 1.00 0.48 H new ATOM 0 HG13 VAL A 180 10.022 -7.477 -2.161 1.00 0.48 H new ATOM 0 HG21 VAL A 180 9.545 -6.282 -4.976 1.00 0.50 H new ATOM 0 HG22 VAL A 180 11.065 -7.098 -4.537 1.00 0.50 H new ATOM 0 HG23 VAL A 180 10.137 -7.646 -5.953 1.00 0.50 H new