USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 983 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 115 GLN : amide:sc= -11.1! C(o=-8.2!,f=-10!) USER MOD Set 1.2: A 117 TYR OH : rot -152:sc= 2.97 USER MOD Set 2.1: A 98 ASN : amide:sc= -0.731 X(o=-1.3,f=-1.2) USER MOD Set 2.2: A 100 LYS NZ :NH3+ -118:sc= -0.568 (180deg=-4.11!) USER MOD Set 3.1: A 37 LYS NZ :NH3+ 145:sc= -2.02 (180deg=-4.26!) USER MOD Set 3.2: A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.3: A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 118:sc= -12.5! USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.278 K(o=-0.28,f=-1.4) USER MOD Single : A 13 ASN : amide:sc= -1.09 K(o=-1.1,f=-5!) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.00038) USER MOD Single : A 18 MET CE :methyl -178:sc= -3.16! (180deg=-3.23!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -152:sc= -6.64! (180deg=-8.59!) USER MOD Single : A 24 ASN : amide:sc= -0.713 X(o=-0.71,f=-0.24) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 66:sc= -4.69! USER MOD Single : A 41 THR OG1 : rot -101:sc= -0.659 USER MOD Single : A 42 GLN : amide:sc=-0.00449 K(o=-0.0045,f=-8.6!) USER MOD Single : A 45 ASN : amide:sc=-0.00535 X(o=-0.0054,f=-0.0054) USER MOD Single : A 46 LYS NZ :NH3+ -146:sc= -0.0735 (180deg=-0.908) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= -0.0657 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 ASN : amide:sc= -0.551 K(o=-0.55,f=-2.2!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -58:sc= 0.516 USER MOD Single : A 76 THR OG1 : rot 177:sc= 1.12 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 56:sc= 1.04 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -171:sc= 0 (180deg=-0.0679) USER MOD Single : A 87 ASN : amide:sc= -0.0199 K(o=-0.02,f=-0.62) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc=-0.00182 X(o=-0.0018,f=-0.072) USER MOD Single : A 116 THR OG1 : rot -77:sc= -0.268 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 30:sc= -1.75 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 2.911 8.750 3.674 1.00 0.00 N ATOM 2 CA ALA A 1 3.533 9.689 4.588 1.00 0.00 C ATOM 3 C ALA A 1 4.963 9.894 4.107 1.00 0.00 C ATOM 4 O ALA A 1 5.179 10.959 3.578 1.00 0.00 O ATOM 5 CB ALA A 1 3.479 8.931 5.906 1.00 0.00 C ATOM 0 H1 ALA A 1 1.928 8.580 3.967 1.00 0.00 H new ATOM 0 H2 ALA A 1 2.923 9.143 2.711 1.00 0.00 H new ATOM 0 H3 ALA A 1 3.436 7.852 3.688 1.00 0.00 H new ATOM 0 HA ALA A 1 3.071 10.673 4.666 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.924 9.539 6.694 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.441 8.714 6.158 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.033 7.997 5.811 1.00 0.00 H new ATOM 13 N PHE A 2 5.910 8.918 4.279 1.00 0.00 N ATOM 14 CA PHE A 2 7.270 9.223 3.777 1.00 0.00 C ATOM 15 C PHE A 2 7.570 8.762 2.325 1.00 0.00 C ATOM 16 O PHE A 2 7.730 7.589 2.084 1.00 0.00 O ATOM 17 CB PHE A 2 8.481 8.741 4.618 1.00 0.00 C ATOM 18 CG PHE A 2 8.148 7.975 5.862 1.00 0.00 C ATOM 19 CD1 PHE A 2 7.326 6.868 5.948 1.00 0.00 C ATOM 20 CD2 PHE A 2 8.720 8.410 7.059 1.00 0.00 C ATOM 21 CE1 PHE A 2 7.085 6.227 7.149 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.516 7.814 8.278 1.00 0.00 C ATOM 23 CZ PHE A 2 7.677 6.691 8.331 1.00 0.00 C ATOM 0 H PHE A 2 5.773 8.007 4.716 1.00 0.00 H new ATOM 0 HA PHE A 2 7.195 10.308 3.849 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.112 8.115 3.987 1.00 0.00 H new ATOM 0 HB3 PHE A 2 9.074 9.611 4.898 1.00 0.00 H new ATOM 0 HD1 PHE A 2 6.858 6.492 5.050 1.00 0.00 H new ATOM 0 HD2 PHE A 2 9.367 9.274 7.023 1.00 0.00 H new ATOM 0 HE1 PHE A 2 6.437 5.364 7.176 1.00 0.00 H new ATOM 0 HE2 PHE A 2 8.988 8.198 9.170 1.00 0.00 H new ATOM 0 HZ PHE A 2 7.490 6.191 9.270 1.00 0.00 H new ATOM 33 N ASP A 3 7.634 9.748 1.445 1.00 0.00 N ATOM 34 CA ASP A 3 7.921 9.644 -0.005 1.00 0.00 C ATOM 35 C ASP A 3 8.709 10.822 -0.459 1.00 0.00 C ATOM 36 O ASP A 3 8.811 11.779 0.332 1.00 0.00 O ATOM 37 CB ASP A 3 6.663 9.521 -0.890 1.00 0.00 C ATOM 38 CG ASP A 3 5.772 10.695 -0.606 1.00 0.00 C ATOM 39 OD1 ASP A 3 5.625 11.150 0.523 1.00 0.00 O ATOM 40 OD2 ASP A 3 5.175 11.182 -1.653 1.00 0.00 O ATOM 0 H ASP A 3 7.478 10.715 1.729 1.00 0.00 H new ATOM 0 HA ASP A 3 8.487 8.720 -0.123 1.00 0.00 H new ATOM 0 HB2 ASP A 3 6.940 9.501 -1.944 1.00 0.00 H new ATOM 0 HB3 ASP A 3 6.140 8.588 -0.680 1.00 0.00 H new ATOM 45 N GLY A 4 9.270 10.818 -1.669 1.00 0.00 N ATOM 46 CA GLY A 4 9.998 12.020 -1.955 1.00 0.00 C ATOM 47 C GLY A 4 11.196 12.232 -1.017 1.00 0.00 C ATOM 48 O GLY A 4 11.603 11.371 -0.266 1.00 0.00 O ATOM 0 H GLY A 4 9.239 10.087 -2.380 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.351 11.988 -2.986 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.325 12.874 -1.875 1.00 0.00 H new ATOM 52 N THR A 5 11.698 13.425 -1.092 1.00 0.00 N ATOM 53 CA THR A 5 12.722 13.941 -0.296 1.00 0.00 C ATOM 54 C THR A 5 12.188 14.267 1.069 1.00 0.00 C ATOM 55 O THR A 5 11.003 14.081 1.252 1.00 0.00 O ATOM 56 CB THR A 5 13.582 15.105 -0.855 1.00 0.00 C ATOM 57 OG1 THR A 5 13.137 16.165 -0.054 1.00 0.00 O ATOM 58 CG2 THR A 5 13.310 15.203 -2.327 1.00 0.00 C ATOM 0 H THR A 5 11.361 14.104 -1.774 1.00 0.00 H new ATOM 0 HA THR A 5 13.449 13.129 -0.267 1.00 0.00 H new ATOM 0 HB THR A 5 14.668 15.031 -0.804 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.886 16.513 0.474 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.901 16.014 -2.753 1.00 0.00 H new ATOM 0 HG22 THR A 5 13.581 14.264 -2.810 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.251 15.402 -2.489 1.00 0.00 H new ATOM 66 N TRP A 6 13.142 14.673 1.835 1.00 0.00 N ATOM 67 CA TRP A 6 13.085 14.983 3.225 1.00 0.00 C ATOM 68 C TRP A 6 14.494 15.408 3.649 1.00 0.00 C ATOM 69 O TRP A 6 15.333 15.121 2.822 1.00 0.00 O ATOM 70 CB TRP A 6 13.011 13.510 3.753 1.00 0.00 C ATOM 71 CG TRP A 6 11.607 13.048 3.762 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.183 11.790 3.498 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.366 13.727 3.987 1.00 0.00 C ATOM 74 NE1 TRP A 6 9.836 11.585 3.524 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.305 12.796 3.825 1.00 0.00 C ATOM 76 CE3 TRP A 6 9.959 15.029 4.304 1.00 0.00 C ATOM 77 CZ2 TRP A 6 7.959 13.097 3.950 1.00 0.00 C ATOM 78 CZ3 TRP A 6 8.611 15.326 4.427 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.626 14.371 4.253 1.00 0.00 C ATOM 0 H TRP A 6 14.082 14.811 1.464 1.00 0.00 H new ATOM 0 HA TRP A 6 12.330 15.711 3.524 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.614 12.857 3.121 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.428 13.454 4.759 1.00 0.00 H new ATOM 0 HD1 TRP A 6 11.876 10.991 3.278 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.337 10.712 3.354 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.697 15.803 4.453 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.202 12.340 3.810 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.320 16.338 4.667 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.587 14.645 4.360 1.00 0.00 H new ATOM 90 N LYS A 7 14.752 15.934 4.813 1.00 0.00 N ATOM 91 CA LYS A 7 16.117 16.411 5.078 1.00 0.00 C ATOM 92 C LYS A 7 16.235 16.505 6.564 1.00 0.00 C ATOM 93 O LYS A 7 15.742 15.615 7.264 1.00 0.00 O ATOM 94 CB LYS A 7 16.230 17.751 4.319 1.00 0.00 C ATOM 95 CG LYS A 7 15.529 17.776 2.984 1.00 0.00 C ATOM 96 CD LYS A 7 15.751 18.873 1.963 1.00 0.00 C ATOM 97 CE LYS A 7 17.257 19.045 1.640 1.00 0.00 C ATOM 98 NZ LYS A 7 17.588 20.266 0.905 1.00 0.00 N ATOM 0 H LYS A 7 14.083 16.049 5.574 1.00 0.00 H new ATOM 0 HA LYS A 7 16.933 15.774 4.738 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.820 18.544 4.945 1.00 0.00 H new ATOM 0 HB3 LYS A 7 17.285 17.979 4.165 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.772 16.836 2.488 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.460 17.759 3.194 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.205 18.638 1.049 1.00 0.00 H new ATOM 0 HD3 LYS A 7 15.349 19.812 2.342 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.819 19.036 2.574 1.00 0.00 H new ATOM 0 HE3 LYS A 7 17.591 18.185 1.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.613 20.300 0.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.083 20.272 -0.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.304 21.096 1.464 1.00 0.00 H new ATOM 112 N VAL A 8 16.860 17.571 7.001 1.00 0.00 N ATOM 113 CA VAL A 8 16.956 17.828 8.404 1.00 0.00 C ATOM 114 C VAL A 8 17.103 19.352 8.569 1.00 0.00 C ATOM 115 O VAL A 8 18.101 19.833 9.046 1.00 0.00 O ATOM 116 CB VAL A 8 17.941 16.990 9.202 1.00 0.00 C ATOM 117 CG1 VAL A 8 18.119 17.551 10.611 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.564 15.483 9.310 1.00 0.00 C ATOM 0 H VAL A 8 17.305 18.267 6.403 1.00 0.00 H new ATOM 0 HA VAL A 8 16.039 17.478 8.877 1.00 0.00 H new ATOM 0 HB VAL A 8 18.873 17.049 8.640 1.00 0.00 H new ATOM 0 HG11 VAL A 8 18.829 16.933 11.162 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.496 18.572 10.551 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.159 17.549 11.127 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.320 14.960 9.895 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.595 15.385 9.799 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.513 15.048 8.312 1.00 0.00 H new ATOM 128 N ASP A 9 16.048 20.014 8.092 1.00 0.00 N ATOM 129 CA ASP A 9 15.931 21.452 8.041 1.00 0.00 C ATOM 130 C ASP A 9 16.442 22.126 9.323 1.00 0.00 C ATOM 131 O ASP A 9 17.004 23.203 9.308 1.00 0.00 O ATOM 132 CB ASP A 9 14.414 21.733 8.041 1.00 0.00 C ATOM 133 CG ASP A 9 13.931 23.042 7.527 1.00 0.00 C ATOM 134 OD1 ASP A 9 14.910 23.905 7.304 1.00 0.00 O ATOM 135 OD2 ASP A 9 12.774 23.319 7.329 1.00 0.00 O ATOM 0 H ASP A 9 15.228 19.536 7.720 1.00 0.00 H new ATOM 0 HA ASP A 9 16.493 21.822 7.183 1.00 0.00 H new ATOM 0 HB2 ASP A 9 13.933 20.950 7.455 1.00 0.00 H new ATOM 0 HB3 ASP A 9 14.058 21.629 9.066 1.00 0.00 H new ATOM 140 N ARG A 10 16.166 21.402 10.399 1.00 0.00 N ATOM 141 CA ARG A 10 16.547 21.949 11.640 1.00 0.00 C ATOM 142 C ARG A 10 17.125 20.947 12.593 1.00 0.00 C ATOM 143 O ARG A 10 17.085 19.747 12.311 1.00 0.00 O ATOM 144 CB ARG A 10 15.302 22.658 12.196 1.00 0.00 C ATOM 145 CG ARG A 10 13.980 22.321 11.540 1.00 0.00 C ATOM 146 CD ARG A 10 13.522 23.342 10.477 1.00 0.00 C ATOM 147 NE ARG A 10 12.862 24.492 11.024 1.00 0.00 N ATOM 148 CZ ARG A 10 11.582 24.847 10.901 1.00 0.00 C ATOM 149 NH1 ARG A 10 10.707 24.130 10.215 1.00 0.00 N ATOM 150 NH2 ARG A 10 11.124 25.959 11.473 1.00 0.00 N ATOM 0 H ARG A 10 15.707 20.491 10.418 1.00 0.00 H new ATOM 0 HA ARG A 10 17.368 22.653 11.502 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.224 22.426 13.258 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.458 23.734 12.115 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.059 21.339 11.074 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.213 22.248 12.311 1.00 0.00 H new ATOM 0 HD2 ARG A 10 14.390 23.671 9.905 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.848 22.847 9.778 1.00 0.00 H new ATOM 0 HE ARG A 10 13.446 25.118 11.578 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.002 23.269 9.755 1.00 0.00 H new ATOM 0 HH12 ARG A 10 9.737 24.438 10.146 1.00 0.00 H new ATOM 0 HH21 ARG A 10 11.754 26.551 12.013 1.00 0.00 H new ATOM 0 HH22 ARG A 10 10.143 26.218 11.371 1.00 0.00 H new ATOM 164 N ASN A 11 17.648 21.377 13.711 1.00 0.00 N ATOM 165 CA ASN A 11 18.187 20.389 14.633 1.00 0.00 C ATOM 166 C ASN A 11 18.065 20.851 16.077 1.00 0.00 C ATOM 167 O ASN A 11 18.776 21.791 16.453 1.00 0.00 O ATOM 168 CB ASN A 11 19.613 19.977 14.310 1.00 0.00 C ATOM 169 CG ASN A 11 20.199 20.651 13.104 1.00 0.00 C ATOM 170 OD1 ASN A 11 20.037 20.122 11.997 1.00 0.00 O ATOM 171 ND2 ASN A 11 20.866 21.773 13.236 1.00 0.00 N ATOM 0 H ASN A 11 17.716 22.352 14.004 1.00 0.00 H new ATOM 0 HA ASN A 11 17.575 19.496 14.504 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.244 20.192 15.173 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.640 18.898 14.156 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.265 22.229 12.415 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.986 22.189 14.159 1.00 0.00 H new ATOM 178 N GLU A 12 17.171 20.174 16.790 1.00 0.00 N ATOM 179 CA GLU A 12 16.892 20.482 18.185 1.00 0.00 C ATOM 180 C GLU A 12 18.019 20.023 19.085 1.00 0.00 C ATOM 181 O GLU A 12 18.889 20.788 19.474 1.00 0.00 O ATOM 182 CB GLU A 12 15.534 19.950 18.751 1.00 0.00 C ATOM 183 CG GLU A 12 14.967 20.690 19.991 1.00 0.00 C ATOM 184 CD GLU A 12 15.828 20.657 21.229 1.00 0.00 C ATOM 185 OE1 GLU A 12 16.723 21.448 21.448 1.00 0.00 O ATOM 186 OE2 GLU A 12 15.555 19.719 22.061 1.00 0.00 O ATOM 0 H GLU A 12 16.622 19.399 16.417 1.00 0.00 H new ATOM 0 HA GLU A 12 16.805 21.569 18.187 1.00 0.00 H new ATOM 0 HB2 GLU A 12 14.790 19.997 17.955 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.660 18.898 19.008 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.793 21.732 19.720 1.00 0.00 H new ATOM 0 HG3 GLU A 12 13.996 20.258 20.235 1.00 0.00 H new ATOM 193 N ASN A 13 18.027 18.763 19.449 1.00 0.00 N ATOM 194 CA ASN A 13 19.006 18.107 20.325 1.00 0.00 C ATOM 195 C ASN A 13 20.036 17.341 19.537 1.00 0.00 C ATOM 196 O ASN A 13 20.783 16.566 20.091 1.00 0.00 O ATOM 197 CB ASN A 13 18.185 17.217 21.307 1.00 0.00 C ATOM 198 CG ASN A 13 18.373 17.610 22.735 1.00 0.00 C ATOM 199 OD1 ASN A 13 18.547 16.745 23.588 1.00 0.00 O ATOM 200 ND2 ASN A 13 18.338 18.917 23.013 1.00 0.00 N ATOM 0 H ASN A 13 17.308 18.114 19.127 1.00 0.00 H new ATOM 0 HA ASN A 13 19.591 18.834 20.888 1.00 0.00 H new ATOM 0 HB2 ASN A 13 17.127 17.283 21.053 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.479 16.175 21.179 1.00 0.00 H new ATOM 0 HD21 ASN A 13 18.459 19.237 23.974 1.00 0.00 H new ATOM 0 HD22 ASN A 13 18.190 19.594 22.264 1.00 0.00 H new ATOM 207 N TYR A 14 20.052 17.580 18.210 1.00 0.00 N ATOM 208 CA TYR A 14 21.009 16.883 17.352 1.00 0.00 C ATOM 209 C TYR A 14 22.484 17.090 17.594 1.00 0.00 C ATOM 210 O TYR A 14 23.259 16.136 17.514 1.00 0.00 O ATOM 211 CB TYR A 14 20.563 17.023 15.890 1.00 0.00 C ATOM 212 CG TYR A 14 21.171 16.093 14.899 1.00 0.00 C ATOM 213 CD1 TYR A 14 21.826 14.931 15.303 1.00 0.00 C ATOM 214 CD2 TYR A 14 21.112 16.345 13.525 1.00 0.00 C ATOM 215 CE1 TYR A 14 22.417 14.021 14.423 1.00 0.00 C ATOM 216 CE2 TYR A 14 21.697 15.445 12.638 1.00 0.00 C ATOM 217 CZ TYR A 14 22.349 14.287 13.065 1.00 0.00 C ATOM 218 OH TYR A 14 22.935 13.387 12.210 1.00 0.00 O ATOM 0 H TYR A 14 19.431 18.230 17.728 1.00 0.00 H new ATOM 0 HA TYR A 14 20.961 15.837 17.656 1.00 0.00 H new ATOM 0 HB2 TYR A 14 19.481 16.895 15.854 1.00 0.00 H new ATOM 0 HB3 TYR A 14 20.774 18.043 15.569 1.00 0.00 H new ATOM 0 HD1 TYR A 14 21.880 14.721 16.361 1.00 0.00 H new ATOM 0 HD2 TYR A 14 20.617 17.230 13.155 1.00 0.00 H new ATOM 0 HE1 TYR A 14 22.913 13.135 14.791 1.00 0.00 H new ATOM 0 HE2 TYR A 14 21.644 15.651 11.579 1.00 0.00 H new ATOM 0 HH TYR A 14 22.816 13.689 11.285 1.00 0.00 H new ATOM 228 N GLU A 15 22.979 18.285 17.894 1.00 0.00 N ATOM 229 CA GLU A 15 24.405 18.474 18.124 1.00 0.00 C ATOM 230 C GLU A 15 24.965 17.687 19.319 1.00 0.00 C ATOM 231 O GLU A 15 25.954 16.957 19.217 1.00 0.00 O ATOM 232 CB GLU A 15 24.844 19.940 18.261 1.00 0.00 C ATOM 233 CG GLU A 15 23.811 20.939 17.697 1.00 0.00 C ATOM 234 CD GLU A 15 24.445 22.198 17.212 1.00 0.00 C ATOM 235 OE1 GLU A 15 24.869 22.338 16.087 1.00 0.00 O ATOM 236 OE2 GLU A 15 24.471 23.094 18.162 1.00 0.00 O ATOM 0 H GLU A 15 22.418 19.132 17.983 1.00 0.00 H new ATOM 0 HA GLU A 15 24.831 18.070 17.206 1.00 0.00 H new ATOM 0 HB2 GLU A 15 25.019 20.163 19.313 1.00 0.00 H new ATOM 0 HB3 GLU A 15 25.793 20.078 17.744 1.00 0.00 H new ATOM 0 HG2 GLU A 15 23.266 20.470 16.877 1.00 0.00 H new ATOM 0 HG3 GLU A 15 23.080 21.178 18.470 1.00 0.00 H new ATOM 243 N LYS A 16 24.333 17.824 20.489 1.00 0.00 N ATOM 244 CA LYS A 16 24.798 17.115 21.666 1.00 0.00 C ATOM 245 C LYS A 16 24.458 15.645 21.605 1.00 0.00 C ATOM 246 O LYS A 16 25.074 14.812 22.230 1.00 0.00 O ATOM 247 CB LYS A 16 24.261 17.795 22.936 1.00 0.00 C ATOM 248 CG LYS A 16 25.239 17.716 24.111 1.00 0.00 C ATOM 249 CD LYS A 16 24.856 18.787 25.107 1.00 0.00 C ATOM 250 CE LYS A 16 25.891 19.304 26.086 1.00 0.00 C ATOM 251 NZ LYS A 16 26.051 18.461 27.293 1.00 0.00 N ATOM 0 H LYS A 16 23.512 18.411 20.637 1.00 0.00 H new ATOM 0 HA LYS A 16 25.886 17.167 21.697 1.00 0.00 H new ATOM 0 HB2 LYS A 16 24.045 18.841 22.719 1.00 0.00 H new ATOM 0 HB3 LYS A 16 23.319 17.328 23.222 1.00 0.00 H new ATOM 0 HG2 LYS A 16 25.198 16.731 24.576 1.00 0.00 H new ATOM 0 HG3 LYS A 16 26.262 17.864 23.766 1.00 0.00 H new ATOM 0 HD2 LYS A 16 24.487 19.642 24.541 1.00 0.00 H new ATOM 0 HD3 LYS A 16 24.018 18.405 25.690 1.00 0.00 H new ATOM 0 HE2 LYS A 16 26.852 19.379 25.577 1.00 0.00 H new ATOM 0 HE3 LYS A 16 25.614 20.312 26.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 26.433 19.037 28.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 25.127 18.074 27.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 26.706 17.680 27.087 1.00 0.00 H new ATOM 265 N PHE A 17 23.434 15.226 20.826 1.00 0.00 N ATOM 266 CA PHE A 17 22.948 13.863 20.633 1.00 0.00 C ATOM 267 C PHE A 17 24.012 12.889 20.081 1.00 0.00 C ATOM 268 O PHE A 17 24.095 11.683 20.400 1.00 0.00 O ATOM 269 CB PHE A 17 21.746 13.926 19.674 1.00 0.00 C ATOM 270 CG PHE A 17 21.401 12.583 19.105 1.00 0.00 C ATOM 271 CD1 PHE A 17 20.640 11.703 19.888 1.00 0.00 C ATOM 272 CD2 PHE A 17 21.838 12.259 17.840 1.00 0.00 C ATOM 273 CE1 PHE A 17 20.336 10.466 19.318 1.00 0.00 C ATOM 274 CE2 PHE A 17 21.540 11.021 17.267 1.00 0.00 C ATOM 275 CZ PHE A 17 20.780 10.131 18.028 1.00 0.00 C ATOM 0 H PHE A 17 22.892 15.894 20.278 1.00 0.00 H new ATOM 0 HA PHE A 17 22.671 13.467 21.610 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.882 14.326 20.204 1.00 0.00 H new ATOM 0 HB3 PHE A 17 21.969 14.616 18.860 1.00 0.00 H new ATOM 0 HD1 PHE A 17 20.307 11.969 20.880 1.00 0.00 H new ATOM 0 HD2 PHE A 17 22.422 12.975 17.281 1.00 0.00 H new ATOM 0 HE1 PHE A 17 19.749 9.754 19.879 1.00 0.00 H new ATOM 0 HE2 PHE A 17 21.883 10.763 16.276 1.00 0.00 H new ATOM 0 HZ PHE A 17 20.528 9.165 17.616 1.00 0.00 H new ATOM 285 N MET A 18 24.842 13.468 19.223 1.00 0.00 N ATOM 286 CA MET A 18 25.932 12.825 18.549 1.00 0.00 C ATOM 287 C MET A 18 27.086 12.702 19.547 1.00 0.00 C ATOM 288 O MET A 18 27.613 11.626 19.797 1.00 0.00 O ATOM 289 CB MET A 18 26.423 13.733 17.397 1.00 0.00 C ATOM 290 CG MET A 18 25.614 13.402 16.166 1.00 0.00 C ATOM 291 SD MET A 18 25.988 14.407 14.719 1.00 0.00 S ATOM 292 CE MET A 18 27.442 15.245 15.369 1.00 0.00 C ATOM 0 H MET A 18 24.757 14.453 18.974 1.00 0.00 H new ATOM 0 HA MET A 18 25.616 11.855 18.166 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.302 14.783 17.662 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.485 13.571 17.210 1.00 0.00 H new ATOM 0 HG2 MET A 18 25.776 12.354 15.914 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.556 13.513 16.404 1.00 0.00 H new ATOM 0 HE1 MET A 18 27.815 15.953 14.629 1.00 0.00 H new ATOM 0 HE2 MET A 18 27.176 15.780 16.281 1.00 0.00 H new ATOM 0 HE3 MET A 18 28.216 14.511 15.591 1.00 0.00 H new ATOM 302 N GLU A 19 27.412 13.866 20.071 1.00 0.00 N ATOM 303 CA GLU A 19 28.479 14.065 21.023 1.00 0.00 C ATOM 304 C GLU A 19 28.508 13.061 22.185 1.00 0.00 C ATOM 305 O GLU A 19 29.541 12.513 22.569 1.00 0.00 O ATOM 306 CB GLU A 19 28.235 15.378 21.808 1.00 0.00 C ATOM 307 CG GLU A 19 29.408 15.787 22.717 1.00 0.00 C ATOM 308 CD GLU A 19 29.259 17.186 23.272 1.00 0.00 C ATOM 309 OE1 GLU A 19 28.723 18.094 22.509 1.00 0.00 O ATOM 310 OE2 GLU A 19 29.631 17.430 24.397 1.00 0.00 O ATOM 0 H GLU A 19 26.922 14.729 19.835 1.00 0.00 H new ATOM 0 HA GLU A 19 29.376 14.008 20.406 1.00 0.00 H new ATOM 0 HB2 GLU A 19 28.039 16.183 21.099 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.338 15.265 22.417 1.00 0.00 H new ATOM 0 HG2 GLU A 19 29.486 15.080 23.543 1.00 0.00 H new ATOM 0 HG3 GLU A 19 30.339 15.722 22.153 1.00 0.00 H new ATOM 317 N LYS A 20 27.311 12.899 22.746 1.00 0.00 N ATOM 318 CA LYS A 20 27.234 12.045 23.948 1.00 0.00 C ATOM 319 C LYS A 20 27.535 10.588 23.752 1.00 0.00 C ATOM 320 O LYS A 20 27.937 9.887 24.692 1.00 0.00 O ATOM 321 CB LYS A 20 25.883 12.368 24.601 1.00 0.00 C ATOM 322 CG LYS A 20 25.681 13.841 24.876 1.00 0.00 C ATOM 323 CD LYS A 20 26.181 14.123 26.254 1.00 0.00 C ATOM 324 CE LYS A 20 27.576 14.697 26.331 1.00 0.00 C ATOM 325 NZ LYS A 20 28.377 13.955 27.320 1.00 0.00 N ATOM 0 H LYS A 20 26.435 13.310 22.424 1.00 0.00 H new ATOM 0 HA LYS A 20 28.053 12.283 24.626 1.00 0.00 H new ATOM 0 HB2 LYS A 20 25.082 12.015 23.952 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.801 11.817 25.538 1.00 0.00 H new ATOM 0 HG2 LYS A 20 26.219 14.443 24.144 1.00 0.00 H new ATOM 0 HG3 LYS A 20 24.627 14.104 24.791 1.00 0.00 H new ATOM 0 HD2 LYS A 20 25.493 14.817 26.737 1.00 0.00 H new ATOM 0 HD3 LYS A 20 26.155 13.197 26.828 1.00 0.00 H new ATOM 0 HE2 LYS A 20 28.053 14.645 25.352 1.00 0.00 H new ATOM 0 HE3 LYS A 20 27.529 15.751 26.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 29.334 14.359 27.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 27.927 14.027 28.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 28.435 12.955 27.040 1.00 0.00 H new ATOM 339 N MET A 21 27.361 10.080 22.521 1.00 0.00 N ATOM 340 CA MET A 21 27.641 8.692 22.241 1.00 0.00 C ATOM 341 C MET A 21 29.163 8.473 22.069 1.00 0.00 C ATOM 342 O MET A 21 29.557 7.343 21.838 1.00 0.00 O ATOM 343 CB MET A 21 26.934 8.095 21.015 1.00 0.00 C ATOM 344 CG MET A 21 25.799 8.989 20.505 1.00 0.00 C ATOM 345 SD MET A 21 24.443 8.092 19.721 1.00 0.00 S ATOM 346 CE MET A 21 24.427 9.126 18.242 1.00 0.00 C ATOM 0 H MET A 21 27.030 10.618 21.720 1.00 0.00 H new ATOM 0 HA MET A 21 27.241 8.168 23.109 1.00 0.00 H new ATOM 0 HB2 MET A 21 27.661 7.944 20.217 1.00 0.00 H new ATOM 0 HB3 MET A 21 26.534 7.114 21.271 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.403 9.566 21.341 1.00 0.00 H new ATOM 0 HG3 MET A 21 26.208 9.703 19.790 1.00 0.00 H new ATOM 0 HE1 MET A 21 23.423 9.138 17.817 1.00 0.00 H new ATOM 0 HE2 MET A 21 24.722 10.142 18.505 1.00 0.00 H new ATOM 0 HE3 MET A 21 25.126 8.724 17.509 1.00 0.00 H new ATOM 356 N GLY A 22 29.927 9.570 22.192 1.00 0.00 N ATOM 357 CA GLY A 22 31.400 9.550 22.060 1.00 0.00 C ATOM 358 C GLY A 22 31.835 10.247 20.769 1.00 0.00 C ATOM 359 O GLY A 22 32.905 10.006 20.208 1.00 0.00 O ATOM 0 H GLY A 22 29.546 10.496 22.385 1.00 0.00 H new ATOM 0 HA2 GLY A 22 31.854 10.046 22.918 1.00 0.00 H new ATOM 0 HA3 GLY A 22 31.757 8.520 22.061 1.00 0.00 H new ATOM 363 N ILE A 23 30.970 11.140 20.293 1.00 0.00 N ATOM 364 CA ILE A 23 31.291 11.862 19.061 1.00 0.00 C ATOM 365 C ILE A 23 32.189 13.022 19.435 1.00 0.00 C ATOM 366 O ILE A 23 31.650 14.011 19.950 1.00 0.00 O ATOM 367 CB ILE A 23 30.061 12.344 18.337 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.332 11.226 17.633 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.443 13.413 17.297 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.488 9.882 18.314 1.00 0.00 C ATOM 0 H ILE A 23 30.075 11.376 20.720 1.00 0.00 H new ATOM 0 HA ILE A 23 31.795 11.187 18.369 1.00 0.00 H new ATOM 0 HB ILE A 23 29.397 12.763 19.093 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.272 11.474 17.574 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.699 11.151 16.609 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.546 13.754 16.780 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.915 14.257 17.799 1.00 0.00 H new ATOM 0 HG23 ILE A 23 31.138 12.986 16.574 1.00 0.00 H new ATOM 0 HD11 ILE A 23 28.938 9.125 17.755 1.00 0.00 H new ATOM 0 HD12 ILE A 23 30.544 9.612 18.349 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.094 9.940 19.329 1.00 0.00 H new ATOM 382 N ASN A 24 33.496 12.934 19.204 1.00 0.00 N ATOM 383 CA ASN A 24 34.390 14.017 19.551 1.00 0.00 C ATOM 384 C ASN A 24 33.928 15.371 19.126 1.00 0.00 C ATOM 385 O ASN A 24 33.104 15.493 18.218 1.00 0.00 O ATOM 386 CB ASN A 24 35.845 13.725 19.162 1.00 0.00 C ATOM 387 CG ASN A 24 36.261 12.259 19.215 1.00 0.00 C ATOM 388 OD1 ASN A 24 36.996 11.757 18.374 1.00 0.00 O ATOM 389 ND2 ASN A 24 35.759 11.581 20.254 1.00 0.00 N ATOM 0 H ASN A 24 33.951 12.125 18.780 1.00 0.00 H new ATOM 0 HA ASN A 24 34.361 14.061 20.640 1.00 0.00 H new ATOM 0 HB2 ASN A 24 36.013 14.095 18.151 1.00 0.00 H new ATOM 0 HB3 ASN A 24 36.500 14.294 19.822 1.00 0.00 H new ATOM 0 HD21 ASN A 24 35.984 10.594 20.376 1.00 0.00 H new ATOM 0 HD22 ASN A 24 35.151 12.052 20.924 1.00 0.00 H new ATOM 396 N VAL A 25 34.421 16.439 19.740 1.00 0.00 N ATOM 397 CA VAL A 25 34.006 17.788 19.361 1.00 0.00 C ATOM 398 C VAL A 25 34.361 18.318 17.987 1.00 0.00 C ATOM 399 O VAL A 25 33.729 19.256 17.514 1.00 0.00 O ATOM 400 CB VAL A 25 34.097 18.838 20.470 1.00 0.00 C ATOM 401 CG1 VAL A 25 33.722 18.247 21.821 1.00 0.00 C ATOM 402 CG2 VAL A 25 35.497 19.377 20.627 1.00 0.00 C ATOM 0 H VAL A 25 35.104 16.401 20.497 1.00 0.00 H new ATOM 0 HA VAL A 25 32.945 17.580 19.219 1.00 0.00 H new ATOM 0 HB VAL A 25 33.409 19.631 20.175 1.00 0.00 H new ATOM 0 HG11 VAL A 25 33.796 19.017 22.588 1.00 0.00 H new ATOM 0 HG12 VAL A 25 32.700 17.871 21.782 1.00 0.00 H new ATOM 0 HG13 VAL A 25 34.401 17.429 22.061 1.00 0.00 H new ATOM 0 HG21 VAL A 25 35.514 20.119 21.425 1.00 0.00 H new ATOM 0 HG22 VAL A 25 36.175 18.561 20.876 1.00 0.00 H new ATOM 0 HG23 VAL A 25 35.815 19.841 19.693 1.00 0.00 H new ATOM 412 N VAL A 26 35.352 17.767 17.285 1.00 0.00 N ATOM 413 CA VAL A 26 35.760 18.201 15.952 1.00 0.00 C ATOM 414 C VAL A 26 34.634 18.080 14.944 1.00 0.00 C ATOM 415 O VAL A 26 34.600 18.716 13.891 1.00 0.00 O ATOM 416 CB VAL A 26 37.043 17.558 15.491 1.00 0.00 C ATOM 417 CG1 VAL A 26 37.235 17.632 13.983 1.00 0.00 C ATOM 418 CG2 VAL A 26 38.150 18.336 16.164 1.00 0.00 C ATOM 0 H VAL A 26 35.906 16.987 17.638 1.00 0.00 H new ATOM 0 HA VAL A 26 35.986 19.265 16.028 1.00 0.00 H new ATOM 0 HB VAL A 26 37.035 16.499 15.747 1.00 0.00 H new ATOM 0 HG11 VAL A 26 38.176 17.153 13.712 1.00 0.00 H new ATOM 0 HG12 VAL A 26 36.411 17.121 13.486 1.00 0.00 H new ATOM 0 HG13 VAL A 26 37.256 18.676 13.670 1.00 0.00 H new ATOM 0 HG21 VAL A 26 39.115 17.921 15.873 1.00 0.00 H new ATOM 0 HG22 VAL A 26 38.097 19.381 15.859 1.00 0.00 H new ATOM 0 HG23 VAL A 26 38.037 18.267 17.246 1.00 0.00 H new ATOM 428 N LYS A 27 33.696 17.214 15.351 1.00 0.00 N ATOM 429 CA LYS A 27 32.504 16.907 14.636 1.00 0.00 C ATOM 430 C LYS A 27 31.485 18.048 14.910 1.00 0.00 C ATOM 431 O LYS A 27 30.585 18.305 14.112 1.00 0.00 O ATOM 432 CB LYS A 27 31.883 15.560 14.945 1.00 0.00 C ATOM 433 CG LYS A 27 32.562 14.338 14.298 1.00 0.00 C ATOM 434 CD LYS A 27 33.945 13.989 14.840 1.00 0.00 C ATOM 435 CE LYS A 27 34.827 13.112 13.936 1.00 0.00 C ATOM 436 NZ LYS A 27 36.253 13.519 13.874 1.00 0.00 N ATOM 0 H LYS A 27 33.775 16.700 16.228 1.00 0.00 H new ATOM 0 HA LYS A 27 32.776 16.834 13.583 1.00 0.00 H new ATOM 0 HB2 LYS A 27 31.884 15.421 16.026 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.840 15.582 14.628 1.00 0.00 H new ATOM 0 HG2 LYS A 27 31.912 13.473 14.427 1.00 0.00 H new ATOM 0 HG3 LYS A 27 32.646 14.517 13.226 1.00 0.00 H new ATOM 0 HD2 LYS A 27 34.478 14.918 15.042 1.00 0.00 H new ATOM 0 HD3 LYS A 27 33.820 13.479 15.795 1.00 0.00 H new ATOM 0 HE2 LYS A 27 34.773 12.082 14.288 1.00 0.00 H new ATOM 0 HE3 LYS A 27 34.416 13.126 12.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 36.771 12.874 13.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 36.321 14.490 13.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 36.667 13.478 14.827 1.00 0.00 H new ATOM 595 N LYS A 37 18.990 15.893 3.531 1.00 0.00 N ATOM 596 CA LYS A 37 18.254 15.034 2.666 1.00 0.00 C ATOM 597 C LYS A 37 18.351 13.569 2.953 1.00 0.00 C ATOM 598 O LYS A 37 18.897 12.830 2.157 1.00 0.00 O ATOM 599 CB LYS A 37 18.480 15.337 1.172 1.00 0.00 C ATOM 600 CG LYS A 37 17.137 15.526 0.469 1.00 0.00 C ATOM 601 CD LYS A 37 17.201 15.230 -0.992 1.00 0.00 C ATOM 602 CE LYS A 37 18.284 15.948 -1.766 1.00 0.00 C ATOM 603 NZ LYS A 37 19.680 15.677 -1.432 1.00 0.00 N ATOM 0 HA LYS A 37 17.222 15.288 2.907 1.00 0.00 H new ATOM 0 HB2 LYS A 37 19.087 16.236 1.062 1.00 0.00 H new ATOM 0 HB3 LYS A 37 19.032 14.521 0.706 1.00 0.00 H new ATOM 0 HG2 LYS A 37 16.395 14.877 0.934 1.00 0.00 H new ATOM 0 HG3 LYS A 37 16.798 16.552 0.612 1.00 0.00 H new ATOM 0 HD2 LYS A 37 17.341 14.157 -1.119 1.00 0.00 H new ATOM 0 HD3 LYS A 37 16.238 15.480 -1.436 1.00 0.00 H new ATOM 0 HE2 LYS A 37 18.145 15.716 -2.822 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.118 17.019 -1.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 20.257 15.710 -2.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 20.022 16.394 -0.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 19.757 14.734 -1.001 1.00 0.00 H new ATOM 617 N LEU A 38 17.719 13.219 4.088 1.00 0.00 N ATOM 618 CA LEU A 38 17.628 11.837 4.440 1.00 0.00 C ATOM 619 C LEU A 38 16.993 11.217 3.199 1.00 0.00 C ATOM 620 O LEU A 38 17.449 10.125 2.882 1.00 0.00 O ATOM 621 CB LEU A 38 16.480 11.633 5.452 1.00 0.00 C ATOM 622 CG LEU A 38 16.335 10.296 6.139 1.00 0.00 C ATOM 623 CD1 LEU A 38 16.326 9.142 5.159 1.00 0.00 C ATOM 624 CD2 LEU A 38 17.542 10.097 7.056 1.00 0.00 C ATOM 0 H LEU A 38 17.284 13.869 4.743 1.00 0.00 H new ATOM 0 HA LEU A 38 18.588 11.462 4.794 1.00 0.00 H new ATOM 0 HB2 LEU A 38 16.587 12.391 6.228 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.544 11.839 4.933 1.00 0.00 H new ATOM 0 HG LEU A 38 15.389 10.304 6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.220 8.203 5.703 1.00 0.00 H new ATOM 0 HD12 LEU A 38 15.491 9.258 4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 38 17.261 9.133 4.599 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.459 9.136 7.564 1.00 0.00 H new ATOM 0 HD22 LEU A 38 18.456 10.116 6.463 1.00 0.00 H new ATOM 0 HD23 LEU A 38 17.573 10.897 7.796 1.00 0.00 H new ATOM 636 N THR A 39 16.077 11.978 2.681 1.00 0.00 N ATOM 637 CA THR A 39 15.216 11.703 1.512 1.00 0.00 C ATOM 638 C THR A 39 14.551 10.378 1.694 1.00 0.00 C ATOM 639 O THR A 39 15.212 9.434 2.093 1.00 0.00 O ATOM 640 CB THR A 39 16.006 11.677 0.162 1.00 0.00 C ATOM 641 OG1 THR A 39 17.081 12.548 0.342 1.00 0.00 O ATOM 642 CG2 THR A 39 15.174 12.104 -1.051 1.00 0.00 C ATOM 0 H THR A 39 15.875 12.894 3.082 1.00 0.00 H new ATOM 0 HA THR A 39 14.490 12.514 1.455 1.00 0.00 H new ATOM 0 HB THR A 39 16.314 10.655 -0.060 1.00 0.00 H new ATOM 0 HG1 THR A 39 17.687 12.184 1.021 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.791 12.060 -1.949 1.00 0.00 H new ATOM 0 HG22 THR A 39 14.322 11.433 -1.163 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.816 13.123 -0.906 1.00 0.00 H new ATOM 650 N ILE A 40 13.271 10.161 1.411 1.00 0.00 N ATOM 651 CA ILE A 40 12.680 8.827 1.577 1.00 0.00 C ATOM 652 C ILE A 40 11.728 8.392 0.496 1.00 0.00 C ATOM 653 O ILE A 40 10.669 8.938 0.246 1.00 0.00 O ATOM 654 CB ILE A 40 12.040 8.671 2.969 1.00 0.00 C ATOM 655 CG1 ILE A 40 12.977 9.075 4.115 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.514 7.227 3.159 1.00 0.00 C ATOM 657 CD1 ILE A 40 12.260 9.292 5.462 1.00 0.00 C ATOM 0 H ILE A 40 12.627 10.875 1.071 1.00 0.00 H new ATOM 0 HA ILE A 40 13.527 8.148 1.482 1.00 0.00 H new ATOM 0 HB ILE A 40 11.201 9.365 3.011 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.737 8.303 4.239 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.497 9.993 3.840 1.00 0.00 H new ATOM 0 HG21 ILE A 40 11.064 7.131 4.147 1.00 0.00 H new ATOM 0 HG22 ILE A 40 10.766 7.009 2.397 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.341 6.523 3.067 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.989 9.575 6.221 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.520 10.085 5.357 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.763 8.370 5.762 1.00 0.00 H new ATOM 669 N THR A 41 12.101 7.326 -0.203 1.00 0.00 N ATOM 670 CA THR A 41 11.348 6.724 -1.274 1.00 0.00 C ATOM 671 C THR A 41 10.715 5.474 -0.692 1.00 0.00 C ATOM 672 O THR A 41 10.700 5.319 0.531 1.00 0.00 O ATOM 673 CB THR A 41 12.228 6.300 -2.442 1.00 0.00 C ATOM 674 OG1 THR A 41 13.556 6.337 -2.002 1.00 0.00 O ATOM 675 CG2 THR A 41 12.083 7.272 -3.593 1.00 0.00 C ATOM 0 H THR A 41 12.980 6.842 -0.022 1.00 0.00 H new ATOM 0 HA THR A 41 10.626 7.447 -1.654 1.00 0.00 H new ATOM 0 HB THR A 41 11.939 5.305 -2.779 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.985 7.157 -2.325 1.00 0.00 H new ATOM 0 HG21 THR A 41 12.719 6.954 -4.420 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.044 7.294 -3.922 1.00 0.00 H new ATOM 0 HG23 THR A 41 12.382 8.268 -3.268 1.00 0.00 H new ATOM 683 N GLN A 42 10.196 4.584 -1.486 1.00 0.00 N ATOM 684 CA GLN A 42 9.579 3.379 -0.957 1.00 0.00 C ATOM 685 C GLN A 42 9.680 2.267 -1.932 1.00 0.00 C ATOM 686 O GLN A 42 9.110 2.325 -3.010 1.00 0.00 O ATOM 687 CB GLN A 42 8.085 3.802 -0.848 1.00 0.00 C ATOM 688 CG GLN A 42 7.199 2.957 0.039 1.00 0.00 C ATOM 689 CD GLN A 42 6.284 2.006 -0.743 1.00 0.00 C ATOM 690 OE1 GLN A 42 6.574 0.830 -1.050 1.00 0.00 O ATOM 691 NE2 GLN A 42 5.131 2.603 -1.051 1.00 0.00 N ATOM 0 H GLN A 42 10.182 4.659 -2.503 1.00 0.00 H new ATOM 0 HA GLN A 42 10.035 3.037 -0.028 1.00 0.00 H new ATOM 0 HB2 GLN A 42 8.049 4.829 -0.485 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.659 3.804 -1.851 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.824 2.374 0.715 1.00 0.00 H new ATOM 0 HG3 GLN A 42 6.586 3.612 0.658 1.00 0.00 H new ATOM 0 HE21 GLN A 42 4.964 3.568 -0.766 1.00 0.00 H new ATOM 0 HE22 GLN A 42 4.416 2.094 -1.571 1.00 0.00 H new ATOM 700 N GLU A 43 10.394 1.205 -1.637 1.00 0.00 N ATOM 701 CA GLU A 43 10.555 0.068 -2.528 1.00 0.00 C ATOM 702 C GLU A 43 9.836 -1.084 -1.867 1.00 0.00 C ATOM 703 O GLU A 43 10.382 -2.162 -1.694 1.00 0.00 O ATOM 704 CB GLU A 43 12.058 -0.154 -2.725 1.00 0.00 C ATOM 705 CG GLU A 43 12.513 -0.054 -4.172 1.00 0.00 C ATOM 706 CD GLU A 43 12.026 -1.338 -4.759 1.00 0.00 C ATOM 707 OE1 GLU A 43 12.712 -2.343 -4.636 1.00 0.00 O ATOM 708 OE2 GLU A 43 10.882 -1.259 -5.366 1.00 0.00 O ATOM 0 H GLU A 43 10.892 1.101 -0.753 1.00 0.00 H new ATOM 0 HA GLU A 43 10.130 0.203 -3.523 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.604 0.579 -2.132 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.323 -1.138 -2.339 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.079 0.811 -4.674 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.596 0.042 -4.250 1.00 0.00 H new ATOM 715 N GLY A 44 8.579 -0.808 -1.503 1.00 0.00 N ATOM 716 CA GLY A 44 7.764 -1.824 -0.852 1.00 0.00 C ATOM 717 C GLY A 44 8.229 -1.820 0.605 1.00 0.00 C ATOM 718 O GLY A 44 7.656 -1.207 1.508 1.00 0.00 O ATOM 0 H GLY A 44 8.117 0.090 -1.646 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.702 -1.590 -0.929 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.909 -2.802 -1.311 1.00 0.00 H new ATOM 722 N ASN A 45 9.331 -2.548 0.845 1.00 0.00 N ATOM 723 CA ASN A 45 9.912 -2.660 2.153 1.00 0.00 C ATOM 724 C ASN A 45 11.102 -1.660 2.165 1.00 0.00 C ATOM 725 O ASN A 45 10.949 -0.552 2.641 1.00 0.00 O ATOM 726 CB ASN A 45 10.337 -4.084 2.562 1.00 0.00 C ATOM 727 CG ASN A 45 9.653 -5.146 1.719 1.00 0.00 C ATOM 728 OD1 ASN A 45 10.134 -5.641 0.656 1.00 0.00 O ATOM 729 ND2 ASN A 45 8.482 -5.539 2.173 1.00 0.00 N ATOM 0 H ASN A 45 9.830 -3.069 0.124 1.00 0.00 H new ATOM 0 HA ASN A 45 9.161 -2.421 2.906 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.418 -4.182 2.462 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.098 -4.246 3.613 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.952 -6.249 1.668 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.105 -5.134 3.030 1.00 0.00 H new ATOM 736 N LYS A 46 12.217 -2.105 1.648 1.00 0.00 N ATOM 737 CA LYS A 46 13.426 -1.312 1.569 1.00 0.00 C ATOM 738 C LYS A 46 13.097 0.051 0.979 1.00 0.00 C ATOM 739 O LYS A 46 12.070 0.317 0.352 1.00 0.00 O ATOM 740 CB LYS A 46 14.419 -1.878 0.533 1.00 0.00 C ATOM 741 CG LYS A 46 15.044 -0.884 -0.441 1.00 0.00 C ATOM 742 CD LYS A 46 15.864 -1.659 -1.497 1.00 0.00 C ATOM 743 CE LYS A 46 15.001 -2.376 -2.543 1.00 0.00 C ATOM 744 NZ LYS A 46 14.704 -3.797 -2.266 1.00 0.00 N ATOM 0 H LYS A 46 12.317 -3.044 1.262 1.00 0.00 H new ATOM 0 HA LYS A 46 13.836 -1.293 2.579 1.00 0.00 H new ATOM 0 HB2 LYS A 46 15.225 -2.376 1.073 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.904 -2.643 -0.048 1.00 0.00 H new ATOM 0 HG2 LYS A 46 14.267 -0.294 -0.927 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.686 -0.185 0.095 1.00 0.00 H new ATOM 0 HD2 LYS A 46 16.534 -0.965 -2.005 1.00 0.00 H new ATOM 0 HD3 LYS A 46 16.490 -2.393 -0.991 1.00 0.00 H new ATOM 0 HE2 LYS A 46 14.057 -1.839 -2.638 1.00 0.00 H new ATOM 0 HE3 LYS A 46 15.504 -2.311 -3.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 14.658 -4.323 -3.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 15.454 -4.198 -1.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 13.791 -3.871 -1.774 1.00 0.00 H new ATOM 758 N PHE A 47 14.091 0.925 1.180 1.00 0.00 N ATOM 759 CA PHE A 47 13.948 2.229 0.575 1.00 0.00 C ATOM 760 C PHE A 47 15.306 2.891 0.278 1.00 0.00 C ATOM 761 O PHE A 47 16.249 2.841 1.026 1.00 0.00 O ATOM 762 CB PHE A 47 13.088 3.189 1.418 1.00 0.00 C ATOM 763 CG PHE A 47 12.756 2.748 2.831 1.00 0.00 C ATOM 764 CD1 PHE A 47 13.733 2.615 3.814 1.00 0.00 C ATOM 765 CD2 PHE A 47 11.440 2.459 3.209 1.00 0.00 C ATOM 766 CE1 PHE A 47 13.440 2.218 5.124 1.00 0.00 C ATOM 767 CE2 PHE A 47 11.143 2.063 4.504 1.00 0.00 C ATOM 768 CZ PHE A 47 12.132 1.939 5.477 1.00 0.00 C ATOM 0 H PHE A 47 14.941 0.761 1.719 1.00 0.00 H new ATOM 0 HA PHE A 47 13.433 2.045 -0.368 1.00 0.00 H new ATOM 0 HB2 PHE A 47 13.604 4.147 1.474 1.00 0.00 H new ATOM 0 HB3 PHE A 47 12.152 3.361 0.887 1.00 0.00 H new ATOM 0 HD1 PHE A 47 14.760 2.827 3.555 1.00 0.00 H new ATOM 0 HD2 PHE A 47 10.646 2.546 2.483 1.00 0.00 H new ATOM 0 HE1 PHE A 47 14.230 2.130 5.855 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.118 1.845 4.765 1.00 0.00 H new ATOM 0 HZ PHE A 47 11.884 1.633 6.482 1.00 0.00 H new ATOM 778 N THR A 48 15.285 3.510 -0.895 1.00 0.00 N ATOM 779 CA THR A 48 16.403 4.220 -1.449 1.00 0.00 C ATOM 780 C THR A 48 16.307 5.509 -0.730 1.00 0.00 C ATOM 781 O THR A 48 15.980 6.563 -1.310 1.00 0.00 O ATOM 782 CB THR A 48 16.374 4.411 -2.983 1.00 0.00 C ATOM 783 OG1 THR A 48 16.415 3.186 -3.656 1.00 0.00 O ATOM 784 CG2 THR A 48 17.573 5.256 -3.452 1.00 0.00 C ATOM 0 H THR A 48 14.460 3.525 -1.495 1.00 0.00 H new ATOM 0 HA THR A 48 17.339 3.677 -1.319 1.00 0.00 H new ATOM 0 HB THR A 48 15.439 4.921 -3.216 1.00 0.00 H new ATOM 0 HG1 THR A 48 16.393 3.343 -4.623 1.00 0.00 H new ATOM 0 HG21 THR A 48 17.532 5.377 -4.534 1.00 0.00 H new ATOM 0 HG22 THR A 48 17.536 6.236 -2.976 1.00 0.00 H new ATOM 0 HG23 THR A 48 18.501 4.754 -3.178 1.00 0.00 H new ATOM 792 N VAL A 49 16.581 5.485 0.537 1.00 0.00 N ATOM 793 CA VAL A 49 16.508 6.746 1.326 1.00 0.00 C ATOM 794 C VAL A 49 17.844 7.372 0.980 1.00 0.00 C ATOM 795 O VAL A 49 18.801 6.619 0.824 1.00 0.00 O ATOM 796 CB VAL A 49 16.277 6.580 2.792 1.00 0.00 C ATOM 797 CG1 VAL A 49 14.913 5.931 3.062 1.00 0.00 C ATOM 798 CG2 VAL A 49 17.313 5.624 3.396 1.00 0.00 C ATOM 0 H VAL A 49 16.851 4.654 1.063 1.00 0.00 H new ATOM 0 HA VAL A 49 15.640 7.356 1.076 1.00 0.00 H new ATOM 0 HB VAL A 49 16.340 7.576 3.231 1.00 0.00 H new ATOM 0 HG11 VAL A 49 14.769 5.821 4.137 1.00 0.00 H new ATOM 0 HG12 VAL A 49 14.123 6.561 2.652 1.00 0.00 H new ATOM 0 HG13 VAL A 49 14.877 4.950 2.589 1.00 0.00 H new ATOM 0 HG21 VAL A 49 17.129 5.516 4.465 1.00 0.00 H new ATOM 0 HG22 VAL A 49 17.234 4.650 2.914 1.00 0.00 H new ATOM 0 HG23 VAL A 49 18.314 6.026 3.240 1.00 0.00 H new ATOM 808 N LYS A 50 17.929 8.660 0.860 1.00 0.00 N ATOM 809 CA LYS A 50 19.227 9.245 0.512 1.00 0.00 C ATOM 810 C LYS A 50 19.890 9.459 1.824 1.00 0.00 C ATOM 811 O LYS A 50 19.900 8.494 2.591 1.00 0.00 O ATOM 812 CB LYS A 50 18.983 10.555 -0.178 1.00 0.00 C ATOM 813 CG LYS A 50 20.112 11.011 -1.065 1.00 0.00 C ATOM 814 CD LYS A 50 19.551 11.868 -2.173 1.00 0.00 C ATOM 815 CE LYS A 50 20.436 11.747 -3.362 1.00 0.00 C ATOM 816 NZ LYS A 50 20.842 13.078 -3.839 1.00 0.00 N ATOM 0 H LYS A 50 17.162 9.320 0.987 1.00 0.00 H new ATOM 0 HA LYS A 50 19.831 8.625 -0.151 1.00 0.00 H new ATOM 0 HB2 LYS A 50 18.077 10.473 -0.778 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.798 11.320 0.576 1.00 0.00 H new ATOM 0 HG2 LYS A 50 20.842 11.576 -0.485 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.634 10.150 -1.483 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.538 11.550 -2.421 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.489 12.908 -1.852 1.00 0.00 H new ATOM 0 HE2 LYS A 50 21.319 11.160 -3.108 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.916 11.212 -4.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.460 12.976 -4.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.997 13.625 -4.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 21.357 13.575 -3.084 1.00 0.00 H new ATOM 830 N GLU A 51 20.363 10.663 1.980 1.00 0.00 N ATOM 831 CA GLU A 51 21.030 11.194 3.152 1.00 0.00 C ATOM 832 C GLU A 51 22.361 11.676 2.596 1.00 0.00 C ATOM 833 O GLU A 51 23.426 11.220 2.958 1.00 0.00 O ATOM 834 CB GLU A 51 21.349 10.163 4.185 1.00 0.00 C ATOM 835 CG GLU A 51 21.997 10.744 5.440 1.00 0.00 C ATOM 836 CD GLU A 51 21.798 9.858 6.598 1.00 0.00 C ATOM 837 OE1 GLU A 51 20.751 9.951 7.166 1.00 0.00 O ATOM 838 OE2 GLU A 51 22.773 8.969 6.997 1.00 0.00 O ATOM 0 H GLU A 51 20.290 11.359 1.237 1.00 0.00 H new ATOM 0 HA GLU A 51 20.398 11.938 3.637 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.432 9.644 4.465 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.017 9.419 3.751 1.00 0.00 H new ATOM 0 HG2 GLU A 51 23.064 10.889 5.268 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.572 11.725 5.652 1.00 0.00 H new ATOM 845 N SER A 52 22.227 12.611 1.690 1.00 0.00 N ATOM 846 CA SER A 52 23.374 13.215 1.012 1.00 0.00 C ATOM 847 C SER A 52 23.572 14.509 1.819 1.00 0.00 C ATOM 848 O SER A 52 23.566 15.564 1.212 1.00 0.00 O ATOM 849 CB SER A 52 23.124 13.507 -0.417 1.00 0.00 C ATOM 850 OG SER A 52 23.278 12.310 -1.173 1.00 0.00 O ATOM 0 H SER A 52 21.325 12.983 1.393 1.00 0.00 H new ATOM 0 HA SER A 52 24.242 12.556 0.988 1.00 0.00 H new ATOM 0 HB2 SER A 52 22.119 13.908 -0.548 1.00 0.00 H new ATOM 0 HB3 SER A 52 23.819 14.268 -0.772 1.00 0.00 H new ATOM 0 HG SER A 52 23.112 12.498 -2.120 1.00 0.00 H new ATOM 856 N SER A 53 23.706 14.312 3.109 1.00 0.00 N ATOM 857 CA SER A 53 23.851 15.350 4.104 1.00 0.00 C ATOM 858 C SER A 53 25.121 16.136 3.940 1.00 0.00 C ATOM 859 O SER A 53 25.304 16.708 2.865 1.00 0.00 O ATOM 860 CB SER A 53 23.752 14.776 5.530 1.00 0.00 C ATOM 861 OG SER A 53 22.557 14.008 5.675 1.00 0.00 O ATOM 0 H SER A 53 23.718 13.376 3.514 1.00 0.00 H new ATOM 0 HA SER A 53 23.023 16.041 3.948 1.00 0.00 H new ATOM 0 HB2 SER A 53 24.621 14.152 5.739 1.00 0.00 H new ATOM 0 HB3 SER A 53 23.761 15.588 6.257 1.00 0.00 H new ATOM 0 HG SER A 53 22.508 13.648 6.585 1.00 0.00 H new ATOM 867 N ASN A 54 25.990 16.210 4.911 1.00 0.00 N ATOM 868 CA ASN A 54 27.224 16.999 4.702 1.00 0.00 C ATOM 869 C ASN A 54 28.410 16.135 5.096 1.00 0.00 C ATOM 870 O ASN A 54 29.247 16.485 5.925 1.00 0.00 O ATOM 871 CB ASN A 54 27.230 18.296 5.525 1.00 0.00 C ATOM 872 CG ASN A 54 28.057 19.380 4.898 1.00 0.00 C ATOM 873 OD1 ASN A 54 29.190 19.618 5.343 1.00 0.00 O ATOM 874 ND2 ASN A 54 27.579 20.075 3.874 1.00 0.00 N ATOM 0 H ASN A 54 25.897 15.764 5.824 1.00 0.00 H new ATOM 0 HA ASN A 54 27.280 17.288 3.652 1.00 0.00 H new ATOM 0 HB2 ASN A 54 26.206 18.650 5.644 1.00 0.00 H new ATOM 0 HB3 ASN A 54 27.613 18.085 6.524 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.144 20.810 3.448 1.00 0.00 H new ATOM 0 HD22 ASN A 54 26.647 19.875 3.513 1.00 0.00 H new ATOM 881 N PHE A 55 28.453 14.977 4.458 1.00 0.00 N ATOM 882 CA PHE A 55 29.524 14.021 4.707 1.00 0.00 C ATOM 883 C PHE A 55 29.965 13.259 3.539 1.00 0.00 C ATOM 884 O PHE A 55 31.055 13.542 3.065 1.00 0.00 O ATOM 885 CB PHE A 55 29.020 12.896 5.620 1.00 0.00 C ATOM 886 CG PHE A 55 29.325 13.126 7.058 1.00 0.00 C ATOM 887 CD1 PHE A 55 30.600 13.560 7.421 1.00 0.00 C ATOM 888 CD2 PHE A 55 28.330 12.898 7.996 1.00 0.00 C ATOM 889 CE1 PHE A 55 30.902 13.777 8.757 1.00 0.00 C ATOM 890 CE2 PHE A 55 28.624 13.111 9.328 1.00 0.00 C ATOM 891 CZ PHE A 55 29.887 13.539 9.668 1.00 0.00 C ATOM 0 H PHE A 55 27.765 14.676 3.768 1.00 0.00 H new ATOM 0 HA PHE A 55 30.324 14.649 5.100 1.00 0.00 H new ATOM 0 HB2 PHE A 55 27.942 12.792 5.496 1.00 0.00 H new ATOM 0 HB3 PHE A 55 29.469 11.954 5.306 1.00 0.00 H new ATOM 0 HD1 PHE A 55 31.351 13.727 6.663 1.00 0.00 H new ATOM 0 HD2 PHE A 55 27.349 12.562 7.692 1.00 0.00 H new ATOM 0 HE1 PHE A 55 31.879 14.114 9.071 1.00 0.00 H new ATOM 0 HE2 PHE A 55 27.876 12.945 10.089 1.00 0.00 H new ATOM 0 HZ PHE A 55 30.100 13.700 10.714 1.00 0.00 H new ATOM 901 N ARG A 56 29.190 12.315 3.049 1.00 0.00 N ATOM 902 CA ARG A 56 29.577 11.530 1.901 1.00 0.00 C ATOM 903 C ARG A 56 28.776 11.861 0.674 1.00 0.00 C ATOM 904 O ARG A 56 29.189 11.571 -0.443 1.00 0.00 O ATOM 905 CB ARG A 56 29.204 10.063 2.172 1.00 0.00 C ATOM 906 CG ARG A 56 29.476 9.637 3.595 1.00 0.00 C ATOM 907 CD ARG A 56 29.186 8.152 3.849 1.00 0.00 C ATOM 908 NE ARG A 56 30.181 7.269 3.261 1.00 0.00 N ATOM 909 CZ ARG A 56 30.601 6.092 3.752 1.00 0.00 C ATOM 910 NH1 ARG A 56 30.138 5.574 4.880 1.00 0.00 N ATOM 911 NH2 ARG A 56 31.526 5.453 3.038 1.00 0.00 N ATOM 0 H ARG A 56 28.278 12.072 3.435 1.00 0.00 H new ATOM 0 HA ARG A 56 30.638 11.723 1.744 1.00 0.00 H new ATOM 0 HB2 ARG A 56 28.147 9.916 1.951 1.00 0.00 H new ATOM 0 HB3 ARG A 56 29.764 9.420 1.493 1.00 0.00 H new ATOM 0 HG2 ARG A 56 30.519 9.843 3.836 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.868 10.240 4.270 1.00 0.00 H new ATOM 0 HD2 ARG A 56 29.141 7.975 4.924 1.00 0.00 H new ATOM 0 HD3 ARG A 56 28.205 7.905 3.444 1.00 0.00 H new ATOM 0 HE ARG A 56 30.604 7.576 2.385 1.00 0.00 H new ATOM 0 HH11 ARG A 56 29.430 6.074 5.418 1.00 0.00 H new ATOM 0 HH12 ARG A 56 30.490 4.676 5.211 1.00 0.00 H new ATOM 0 HH21 ARG A 56 31.874 5.863 2.171 1.00 0.00 H new ATOM 0 HH22 ARG A 56 31.886 4.554 3.358 1.00 0.00 H new ATOM 925 N ASN A 57 27.653 12.465 0.954 1.00 0.00 N ATOM 926 CA ASN A 57 26.745 12.865 -0.090 1.00 0.00 C ATOM 927 C ASN A 57 26.427 11.578 -0.821 1.00 0.00 C ATOM 928 O ASN A 57 26.897 11.278 -1.913 1.00 0.00 O ATOM 929 CB ASN A 57 27.353 13.983 -0.962 1.00 0.00 C ATOM 930 CG ASN A 57 26.800 13.992 -2.367 1.00 0.00 C ATOM 931 OD1 ASN A 57 25.635 14.335 -2.640 1.00 0.00 O ATOM 932 ND2 ASN A 57 27.641 13.605 -3.306 1.00 0.00 N ATOM 0 H ASN A 57 27.343 12.692 1.899 1.00 0.00 H new ATOM 0 HA ASN A 57 25.825 13.321 0.275 1.00 0.00 H new ATOM 0 HB2 ASN A 57 27.161 14.948 -0.494 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.435 13.859 -1.003 1.00 0.00 H new ATOM 0 HD21 ASN A 57 27.342 13.582 -4.281 1.00 0.00 H new ATOM 0 HD22 ASN A 57 28.591 13.329 -3.058 1.00 0.00 H new ATOM 939 N ILE A 58 25.591 10.775 -0.188 1.00 0.00 N ATOM 940 CA ILE A 58 25.231 9.539 -0.802 1.00 0.00 C ATOM 941 C ILE A 58 23.851 9.134 -0.317 1.00 0.00 C ATOM 942 O ILE A 58 23.232 9.752 0.552 1.00 0.00 O ATOM 943 CB ILE A 58 26.184 8.469 -0.329 1.00 0.00 C ATOM 944 CG1 ILE A 58 26.448 7.377 -1.355 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.664 7.853 0.959 1.00 0.00 C ATOM 946 CD1 ILE A 58 27.917 7.293 -1.687 1.00 0.00 C ATOM 0 H ILE A 58 25.167 10.959 0.721 1.00 0.00 H new ATOM 0 HA ILE A 58 25.257 9.650 -1.886 1.00 0.00 H new ATOM 0 HB ILE A 58 27.141 8.964 -0.161 1.00 0.00 H new ATOM 0 HG12 ILE A 58 26.103 6.418 -0.968 1.00 0.00 H new ATOM 0 HG13 ILE A 58 25.877 7.579 -2.261 1.00 0.00 H new ATOM 0 HG21 ILE A 58 26.355 7.081 1.298 1.00 0.00 H new ATOM 0 HG22 ILE A 58 25.580 8.625 1.724 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.684 7.410 0.781 1.00 0.00 H new ATOM 0 HD11 ILE A 58 28.079 6.505 -2.422 1.00 0.00 H new ATOM 0 HD12 ILE A 58 28.253 8.246 -2.096 1.00 0.00 H new ATOM 0 HD13 ILE A 58 28.482 7.067 -0.783 1.00 0.00 H new ATOM 958 N ASP A 59 23.411 8.063 -0.927 1.00 0.00 N ATOM 959 CA ASP A 59 22.116 7.535 -0.590 1.00 0.00 C ATOM 960 C ASP A 59 22.322 6.141 -0.040 1.00 0.00 C ATOM 961 O ASP A 59 23.364 5.528 -0.292 1.00 0.00 O ATOM 962 CB ASP A 59 21.257 7.305 -1.836 1.00 0.00 C ATOM 963 CG ASP A 59 21.992 6.787 -3.024 1.00 0.00 C ATOM 964 OD1 ASP A 59 22.939 7.539 -3.518 1.00 0.00 O ATOM 965 OD2 ASP A 59 21.708 5.703 -3.504 1.00 0.00 O ATOM 0 H ASP A 59 23.920 7.548 -1.646 1.00 0.00 H new ATOM 0 HA ASP A 59 21.641 8.239 0.094 1.00 0.00 H new ATOM 0 HB2 ASP A 59 20.462 6.603 -1.586 1.00 0.00 H new ATOM 0 HB3 ASP A 59 20.778 8.246 -2.107 1.00 0.00 H new ATOM 970 N VAL A 60 21.326 5.687 0.692 1.00 0.00 N ATOM 971 CA VAL A 60 21.355 4.382 1.300 1.00 0.00 C ATOM 972 C VAL A 60 20.201 3.565 0.813 1.00 0.00 C ATOM 973 O VAL A 60 19.083 4.056 0.549 1.00 0.00 O ATOM 974 CB VAL A 60 21.364 4.580 2.826 1.00 0.00 C ATOM 975 CG1 VAL A 60 21.681 3.265 3.501 1.00 0.00 C ATOM 976 CG2 VAL A 60 22.385 5.596 3.264 1.00 0.00 C ATOM 0 H VAL A 60 20.475 6.216 0.880 1.00 0.00 H new ATOM 0 HA VAL A 60 22.250 3.826 1.022 1.00 0.00 H new ATOM 0 HB VAL A 60 20.376 4.942 3.111 1.00 0.00 H new ATOM 0 HG11 VAL A 60 21.688 3.403 4.582 1.00 0.00 H new ATOM 0 HG12 VAL A 60 20.924 2.527 3.234 1.00 0.00 H new ATOM 0 HG13 VAL A 60 22.660 2.915 3.174 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.353 5.700 4.349 1.00 0.00 H new ATOM 0 HG22 VAL A 60 23.379 5.267 2.961 1.00 0.00 H new ATOM 0 HG23 VAL A 60 22.164 6.557 2.800 1.00 0.00 H new ATOM 986 N VAL A 61 20.352 2.248 0.650 1.00 0.00 N ATOM 987 CA VAL A 61 19.230 1.415 0.174 1.00 0.00 C ATOM 988 C VAL A 61 19.297 0.110 0.875 1.00 0.00 C ATOM 989 O VAL A 61 20.240 -0.630 0.628 1.00 0.00 O ATOM 990 CB VAL A 61 19.249 1.283 -1.332 1.00 0.00 C ATOM 991 CG1 VAL A 61 20.676 1.591 -1.819 1.00 0.00 C ATOM 992 CG2 VAL A 61 18.774 -0.086 -1.811 1.00 0.00 C ATOM 0 H VAL A 61 21.217 1.739 0.834 1.00 0.00 H new ATOM 0 HA VAL A 61 18.275 1.886 0.409 1.00 0.00 H new ATOM 0 HB VAL A 61 18.544 1.996 -1.760 1.00 0.00 H new ATOM 0 HG11 VAL A 61 20.717 1.503 -2.905 1.00 0.00 H new ATOM 0 HG12 VAL A 61 20.949 2.605 -1.527 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.374 0.884 -1.371 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.809 -0.123 -2.900 1.00 0.00 H new ATOM 0 HG22 VAL A 61 19.422 -0.860 -1.401 1.00 0.00 H new ATOM 0 HG23 VAL A 61 17.751 -0.254 -1.475 1.00 0.00 H new ATOM 1002 N PHE A 62 18.325 -0.138 1.716 1.00 0.00 N ATOM 1003 CA PHE A 62 18.306 -1.373 2.442 1.00 0.00 C ATOM 1004 C PHE A 62 16.920 -1.784 2.917 1.00 0.00 C ATOM 1005 O PHE A 62 16.198 -0.893 3.422 1.00 0.00 O ATOM 1006 CB PHE A 62 19.151 -1.195 3.735 1.00 0.00 C ATOM 1007 CG PHE A 62 18.679 -0.087 4.649 1.00 0.00 C ATOM 1008 CD1 PHE A 62 18.946 1.227 4.365 1.00 0.00 C ATOM 1009 CD2 PHE A 62 17.957 -0.382 5.812 1.00 0.00 C ATOM 1010 CE1 PHE A 62 18.545 2.292 5.155 1.00 0.00 C ATOM 1011 CE2 PHE A 62 17.526 0.645 6.649 1.00 0.00 C ATOM 1012 CZ PHE A 62 17.821 1.976 6.315 1.00 0.00 C ATOM 0 H PHE A 62 17.547 0.493 1.910 1.00 0.00 H new ATOM 0 HA PHE A 62 18.686 -2.132 1.758 1.00 0.00 H new ATOM 0 HB2 PHE A 62 19.144 -2.133 4.290 1.00 0.00 H new ATOM 0 HB3 PHE A 62 20.186 -0.999 3.453 1.00 0.00 H new ATOM 0 HD1 PHE A 62 19.505 1.446 3.467 1.00 0.00 H new ATOM 0 HD2 PHE A 62 17.734 -1.409 6.061 1.00 0.00 H new ATOM 0 HE1 PHE A 62 18.778 3.313 4.892 1.00 0.00 H new ATOM 0 HE2 PHE A 62 16.970 0.419 7.547 1.00 0.00 H new ATOM 0 HZ PHE A 62 17.485 2.772 6.963 1.00 0.00 H new ATOM 1022 N GLU A 63 16.621 -3.042 2.751 1.00 0.00 N ATOM 1023 CA GLU A 63 15.341 -3.648 3.156 1.00 0.00 C ATOM 1024 C GLU A 63 15.280 -3.344 4.652 1.00 0.00 C ATOM 1025 O GLU A 63 15.766 -4.185 5.413 1.00 0.00 O ATOM 1026 CB GLU A 63 15.217 -5.149 2.874 1.00 0.00 C ATOM 1027 CG GLU A 63 14.892 -5.383 1.369 1.00 0.00 C ATOM 1028 CD GLU A 63 16.081 -5.621 0.472 1.00 0.00 C ATOM 1029 OE1 GLU A 63 17.227 -5.293 0.764 1.00 0.00 O ATOM 1030 OE2 GLU A 63 15.765 -6.210 -0.642 1.00 0.00 O ATOM 0 H GLU A 63 17.263 -3.708 2.321 1.00 0.00 H new ATOM 0 HA GLU A 63 14.512 -3.239 2.579 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.146 -5.655 3.137 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.432 -5.581 3.495 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.223 -6.240 1.290 1.00 0.00 H new ATOM 0 HG3 GLU A 63 14.346 -4.517 0.995 1.00 0.00 H new ATOM 1037 N LEU A 64 14.715 -2.191 5.003 1.00 0.00 N ATOM 1038 CA LEU A 64 14.562 -1.695 6.349 1.00 0.00 C ATOM 1039 C LEU A 64 14.768 -2.724 7.444 1.00 0.00 C ATOM 1040 O LEU A 64 13.874 -3.539 7.741 1.00 0.00 O ATOM 1041 CB LEU A 64 13.177 -0.995 6.492 1.00 0.00 C ATOM 1042 CG LEU A 64 11.927 -1.850 6.298 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.691 -0.989 6.605 1.00 0.00 C ATOM 1044 CD2 LEU A 64 11.876 -2.280 4.819 1.00 0.00 C ATOM 0 H LEU A 64 14.333 -1.549 4.308 1.00 0.00 H new ATOM 0 HA LEU A 64 15.370 -0.979 6.498 1.00 0.00 H new ATOM 0 HB2 LEU A 64 13.128 -0.549 7.485 1.00 0.00 H new ATOM 0 HB3 LEU A 64 13.139 -0.177 5.773 1.00 0.00 H new ATOM 0 HG LEU A 64 11.946 -2.721 6.953 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.789 -1.586 6.471 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.741 -0.634 7.634 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.665 -0.135 5.928 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.992 -2.894 4.649 1.00 0.00 H new ATOM 0 HD22 LEU A 64 11.831 -1.395 4.184 1.00 0.00 H new ATOM 0 HD23 LEU A 64 12.769 -2.856 4.576 1.00 0.00 H new ATOM 1056 N GLY A 65 15.936 -2.760 8.089 1.00 0.00 N ATOM 1057 CA GLY A 65 16.204 -3.735 9.148 1.00 0.00 C ATOM 1058 C GLY A 65 17.419 -4.616 8.940 1.00 0.00 C ATOM 1059 O GLY A 65 17.293 -5.833 9.040 1.00 0.00 O ATOM 0 H GLY A 65 16.711 -2.125 7.896 1.00 0.00 H new ATOM 0 HA2 GLY A 65 16.325 -3.198 10.089 1.00 0.00 H new ATOM 0 HA3 GLY A 65 15.329 -4.375 9.257 1.00 0.00 H new ATOM 1063 N VAL A 66 18.562 -3.975 8.663 1.00 0.00 N ATOM 1064 CA VAL A 66 19.810 -4.723 8.451 1.00 0.00 C ATOM 1065 C VAL A 66 20.841 -4.066 9.385 1.00 0.00 C ATOM 1066 O VAL A 66 20.683 -2.878 9.660 1.00 0.00 O ATOM 1067 CB VAL A 66 20.245 -4.795 7.018 1.00 0.00 C ATOM 1068 CG1 VAL A 66 19.326 -5.791 6.297 1.00 0.00 C ATOM 1069 CG2 VAL A 66 20.137 -3.468 6.292 1.00 0.00 C ATOM 0 H VAL A 66 18.650 -2.962 8.581 1.00 0.00 H new ATOM 0 HA VAL A 66 19.678 -5.777 8.694 1.00 0.00 H new ATOM 0 HB VAL A 66 21.293 -5.094 7.010 1.00 0.00 H new ATOM 0 HG11 VAL A 66 19.619 -5.864 5.250 1.00 0.00 H new ATOM 0 HG12 VAL A 66 19.411 -6.771 6.767 1.00 0.00 H new ATOM 0 HG13 VAL A 66 18.294 -5.446 6.361 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.467 -3.590 5.260 1.00 0.00 H new ATOM 0 HG22 VAL A 66 19.101 -3.130 6.304 1.00 0.00 H new ATOM 0 HG23 VAL A 66 20.765 -2.729 6.789 1.00 0.00 H new ATOM 1079 N ASP A 67 21.833 -4.781 9.849 1.00 0.00 N ATOM 1080 CA ASP A 67 22.833 -4.203 10.738 1.00 0.00 C ATOM 1081 C ASP A 67 23.539 -3.054 10.150 1.00 0.00 C ATOM 1082 O ASP A 67 23.278 -2.732 8.965 1.00 0.00 O ATOM 1083 CB ASP A 67 23.697 -5.303 11.399 1.00 0.00 C ATOM 1084 CG ASP A 67 24.556 -6.075 10.443 1.00 0.00 C ATOM 1085 OD1 ASP A 67 24.951 -5.589 9.399 1.00 0.00 O ATOM 1086 OD2 ASP A 67 24.803 -7.282 10.888 1.00 0.00 O ATOM 0 H ASP A 67 21.978 -5.767 9.631 1.00 0.00 H new ATOM 0 HA ASP A 67 22.324 -3.731 11.579 1.00 0.00 H new ATOM 0 HB2 ASP A 67 24.336 -4.842 12.152 1.00 0.00 H new ATOM 0 HB3 ASP A 67 23.040 -5.999 11.921 1.00 0.00 H new ATOM 1091 N PHE A 68 24.434 -2.385 10.888 1.00 0.00 N ATOM 1092 CA PHE A 68 25.111 -1.249 10.276 1.00 0.00 C ATOM 1093 C PHE A 68 26.529 -1.056 10.720 1.00 0.00 C ATOM 1094 O PHE A 68 27.422 -1.124 9.855 1.00 0.00 O ATOM 1095 CB PHE A 68 24.358 0.125 10.411 1.00 0.00 C ATOM 1096 CG PHE A 68 23.304 0.263 9.374 1.00 0.00 C ATOM 1097 CD1 PHE A 68 22.008 -0.199 9.620 1.00 0.00 C ATOM 1098 CD2 PHE A 68 23.565 0.848 8.142 1.00 0.00 C ATOM 1099 CE1 PHE A 68 21.007 -0.077 8.662 1.00 0.00 C ATOM 1100 CE2 PHE A 68 22.570 0.969 7.183 1.00 0.00 C ATOM 1101 CZ PHE A 68 21.280 0.504 7.446 1.00 0.00 C ATOM 0 H PHE A 68 24.692 -2.597 11.852 1.00 0.00 H new ATOM 0 HA PHE A 68 25.107 -1.541 9.226 1.00 0.00 H new ATOM 0 HB2 PHE A 68 23.910 0.201 11.402 1.00 0.00 H new ATOM 0 HB3 PHE A 68 25.071 0.944 10.320 1.00 0.00 H new ATOM 0 HD1 PHE A 68 21.780 -0.659 10.570 1.00 0.00 H new ATOM 0 HD2 PHE A 68 24.558 1.214 7.927 1.00 0.00 H new ATOM 0 HE1 PHE A 68 20.012 -0.440 8.874 1.00 0.00 H new ATOM 0 HE2 PHE A 68 22.794 1.424 6.230 1.00 0.00 H new ATOM 0 HZ PHE A 68 20.504 0.600 6.701 1.00 0.00 H new ATOM 1111 N ALA A 69 26.754 -0.808 11.994 1.00 0.00 N ATOM 1112 CA ALA A 69 28.131 -0.570 12.432 1.00 0.00 C ATOM 1113 C ALA A 69 28.654 0.612 11.599 1.00 0.00 C ATOM 1114 O ALA A 69 29.695 0.610 10.956 1.00 0.00 O ATOM 1115 CB ALA A 69 29.000 -1.779 12.246 1.00 0.00 C ATOM 0 H ALA A 69 26.042 -0.765 12.723 1.00 0.00 H new ATOM 0 HA ALA A 69 28.154 -0.349 13.499 1.00 0.00 H new ATOM 0 HB1 ALA A 69 30.012 -1.555 12.584 1.00 0.00 H new ATOM 0 HB2 ALA A 69 28.598 -2.609 12.827 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.022 -2.052 11.191 1.00 0.00 H new ATOM 1121 N TYR A 70 27.817 1.655 11.651 1.00 0.00 N ATOM 1122 CA TYR A 70 28.050 2.894 10.945 1.00 0.00 C ATOM 1123 C TYR A 70 28.807 3.788 11.881 1.00 0.00 C ATOM 1124 O TYR A 70 29.891 4.144 11.506 1.00 0.00 O ATOM 1125 CB TYR A 70 26.655 3.527 10.660 1.00 0.00 C ATOM 1126 CG TYR A 70 26.670 4.798 9.842 1.00 0.00 C ATOM 1127 CD1 TYR A 70 27.844 5.339 9.338 1.00 0.00 C ATOM 1128 CD2 TYR A 70 25.463 5.478 9.569 1.00 0.00 C ATOM 1129 CE1 TYR A 70 27.822 6.516 8.587 1.00 0.00 C ATOM 1130 CE2 TYR A 70 25.456 6.663 8.810 1.00 0.00 C ATOM 1131 CZ TYR A 70 26.634 7.206 8.304 1.00 0.00 C ATOM 1132 OH TYR A 70 26.614 8.361 7.569 1.00 0.00 O ATOM 0 H TYR A 70 26.953 1.650 12.194 1.00 0.00 H new ATOM 0 HA TYR A 70 28.601 2.749 10.016 1.00 0.00 H new ATOM 0 HB2 TYR A 70 26.040 2.790 10.143 1.00 0.00 H new ATOM 0 HB3 TYR A 70 26.169 3.735 11.613 1.00 0.00 H new ATOM 0 HD1 TYR A 70 28.785 4.844 9.529 1.00 0.00 H new ATOM 0 HD2 TYR A 70 24.532 5.083 9.948 1.00 0.00 H new ATOM 0 HE1 TYR A 70 28.754 6.910 8.210 1.00 0.00 H new ATOM 0 HE2 TYR A 70 24.518 7.161 8.616 1.00 0.00 H new ATOM 0 HH TYR A 70 25.691 8.680 7.486 1.00 0.00 H new ATOM 1142 N SER A 71 28.182 4.073 13.024 1.00 0.00 N ATOM 1143 CA SER A 71 28.684 4.879 14.090 1.00 0.00 C ATOM 1144 C SER A 71 28.035 6.262 14.045 1.00 0.00 C ATOM 1145 O SER A 71 28.714 7.241 14.302 1.00 0.00 O ATOM 1146 CB SER A 71 30.169 5.153 14.073 1.00 0.00 C ATOM 1147 OG SER A 71 30.601 6.056 13.065 1.00 0.00 O ATOM 0 H SER A 71 27.249 3.712 13.223 1.00 0.00 H new ATOM 0 HA SER A 71 28.451 4.291 14.978 1.00 0.00 H new ATOM 0 HB2 SER A 71 30.461 5.550 15.045 1.00 0.00 H new ATOM 0 HB3 SER A 71 30.696 4.208 13.943 1.00 0.00 H new ATOM 0 HG SER A 71 30.349 5.708 12.184 1.00 0.00 H new ATOM 1153 N LEU A 72 26.780 6.217 13.722 1.00 0.00 N ATOM 1154 CA LEU A 72 25.896 7.343 13.586 1.00 0.00 C ATOM 1155 C LEU A 72 26.697 8.506 12.991 1.00 0.00 C ATOM 1156 O LEU A 72 27.160 9.478 13.619 1.00 0.00 O ATOM 1157 CB LEU A 72 25.246 7.747 14.905 1.00 0.00 C ATOM 1158 CG LEU A 72 24.311 8.964 14.807 1.00 0.00 C ATOM 1159 CD1 LEU A 72 25.008 10.254 15.206 1.00 0.00 C ATOM 1160 CD2 LEU A 72 23.657 9.044 13.438 1.00 0.00 C ATOM 0 H LEU A 72 26.309 5.332 13.532 1.00 0.00 H new ATOM 0 HA LEU A 72 25.074 7.065 12.926 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.680 6.900 15.291 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.030 7.964 15.631 1.00 0.00 H new ATOM 0 HG LEU A 72 23.509 8.825 15.532 1.00 0.00 H new ATOM 0 HD11 LEU A 72 24.309 11.086 15.121 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.356 10.176 16.236 1.00 0.00 H new ATOM 0 HD13 LEU A 72 25.859 10.426 14.547 1.00 0.00 H new ATOM 0 HD21 LEU A 72 23.002 9.914 13.398 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.427 9.134 12.672 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.073 8.141 13.261 1.00 0.00 H new ATOM 1172 N ALA A 73 26.883 8.387 11.678 1.00 0.00 N ATOM 1173 CA ALA A 73 27.607 9.316 10.825 1.00 0.00 C ATOM 1174 C ALA A 73 28.908 9.810 11.449 1.00 0.00 C ATOM 1175 O ALA A 73 29.152 11.019 11.517 1.00 0.00 O ATOM 1176 CB ALA A 73 26.664 10.437 10.384 1.00 0.00 C ATOM 0 H ALA A 73 26.510 7.594 11.156 1.00 0.00 H new ATOM 0 HA ALA A 73 27.937 8.788 9.931 1.00 0.00 H new ATOM 0 HB1 ALA A 73 27.203 11.136 9.744 1.00 0.00 H new ATOM 0 HB2 ALA A 73 25.826 10.011 9.831 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.290 10.964 11.262 1.00 0.00 H new ATOM 1182 N ASP A 74 29.743 8.876 11.905 1.00 0.00 N ATOM 1183 CA ASP A 74 31.025 9.063 12.532 1.00 0.00 C ATOM 1184 C ASP A 74 30.984 9.230 14.045 1.00 0.00 C ATOM 1185 O ASP A 74 30.179 9.984 14.584 1.00 0.00 O ATOM 1186 CB ASP A 74 31.984 10.082 11.989 1.00 0.00 C ATOM 1187 CG ASP A 74 32.662 9.588 10.698 1.00 0.00 C ATOM 1188 OD1 ASP A 74 32.067 8.742 9.907 1.00 0.00 O ATOM 1189 OD2 ASP A 74 33.841 9.985 10.341 1.00 0.00 O ATOM 0 H ASP A 74 29.506 7.887 11.832 1.00 0.00 H new ATOM 0 HA ASP A 74 31.435 8.095 12.244 1.00 0.00 H new ATOM 0 HB2 ASP A 74 31.453 11.013 11.789 1.00 0.00 H new ATOM 0 HB3 ASP A 74 32.744 10.303 12.738 1.00 0.00 H new ATOM 1194 N GLY A 75 31.868 8.519 14.738 1.00 0.00 N ATOM 1195 CA GLY A 75 31.918 8.604 16.192 1.00 0.00 C ATOM 1196 C GLY A 75 32.062 7.254 16.955 1.00 0.00 C ATOM 1197 O GLY A 75 33.144 6.961 17.429 1.00 0.00 O ATOM 0 H GLY A 75 32.551 7.886 14.322 1.00 0.00 H new ATOM 0 HA2 GLY A 75 32.755 9.245 16.469 1.00 0.00 H new ATOM 0 HA3 GLY A 75 31.010 9.098 16.538 1.00 0.00 H new ATOM 1201 N THR A 76 31.024 6.475 17.067 1.00 0.00 N ATOM 1202 CA THR A 76 31.088 5.217 17.757 1.00 0.00 C ATOM 1203 C THR A 76 30.892 3.991 16.897 1.00 0.00 C ATOM 1204 O THR A 76 31.887 3.476 16.372 1.00 0.00 O ATOM 1205 CB THR A 76 29.962 5.212 18.828 1.00 0.00 C ATOM 1206 OG1 THR A 76 30.342 6.215 19.705 1.00 0.00 O ATOM 1207 CG2 THR A 76 29.905 3.893 19.593 1.00 0.00 C ATOM 0 H THR A 76 30.106 6.695 16.681 1.00 0.00 H new ATOM 0 HA THR A 76 32.098 5.149 18.162 1.00 0.00 H new ATOM 0 HB THR A 76 28.981 5.352 18.374 1.00 0.00 H new ATOM 0 HG1 THR A 76 29.655 6.323 20.396 1.00 0.00 H new ATOM 0 HG21 THR A 76 29.104 3.935 20.331 1.00 0.00 H new ATOM 0 HG22 THR A 76 29.715 3.076 18.897 1.00 0.00 H new ATOM 0 HG23 THR A 76 30.856 3.724 20.099 1.00 0.00 H new ATOM 1215 N GLU A 77 29.674 3.484 16.717 1.00 0.00 N ATOM 1216 CA GLU A 77 29.516 2.295 15.891 1.00 0.00 C ATOM 1217 C GLU A 77 28.112 2.081 15.319 1.00 0.00 C ATOM 1218 O GLU A 77 27.970 1.853 14.136 1.00 0.00 O ATOM 1219 CB GLU A 77 29.694 1.032 16.776 1.00 0.00 C ATOM 1220 CG GLU A 77 30.814 0.100 16.306 1.00 0.00 C ATOM 1221 CD GLU A 77 30.451 -0.512 14.982 1.00 0.00 C ATOM 1222 OE1 GLU A 77 30.355 0.109 13.963 1.00 0.00 O ATOM 1223 OE2 GLU A 77 30.253 -1.797 15.053 1.00 0.00 O ATOM 0 H GLU A 77 28.814 3.862 17.115 1.00 0.00 H new ATOM 0 HA GLU A 77 30.243 2.438 15.091 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.899 1.344 17.800 1.00 0.00 H new ATOM 0 HB3 GLU A 77 28.756 0.477 16.794 1.00 0.00 H new ATOM 0 HG2 GLU A 77 31.747 0.656 16.215 1.00 0.00 H new ATOM 0 HG3 GLU A 77 30.980 -0.684 17.045 1.00 0.00 H new ATOM 1230 N LEU A 78 27.083 2.137 16.142 1.00 0.00 N ATOM 1231 CA LEU A 78 25.673 1.948 15.805 1.00 0.00 C ATOM 1232 C LEU A 78 25.496 0.669 14.955 1.00 0.00 C ATOM 1233 O LEU A 78 25.633 0.613 13.731 1.00 0.00 O ATOM 1234 CB LEU A 78 25.129 3.107 14.932 1.00 0.00 C ATOM 1235 CG LEU A 78 23.980 3.974 15.465 1.00 0.00 C ATOM 1236 CD1 LEU A 78 23.159 4.538 14.312 1.00 0.00 C ATOM 1237 CD2 LEU A 78 23.022 3.093 16.233 1.00 0.00 C ATOM 0 H LEU A 78 27.212 2.329 17.135 1.00 0.00 H new ATOM 0 HA LEU A 78 25.137 1.895 16.753 1.00 0.00 H new ATOM 0 HB2 LEU A 78 25.965 3.771 14.711 1.00 0.00 H new ATOM 0 HB3 LEU A 78 24.803 2.678 13.984 1.00 0.00 H new ATOM 0 HG LEU A 78 24.413 4.768 16.073 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.349 5.150 14.708 1.00 0.00 H new ATOM 0 HD12 LEU A 78 23.798 5.150 13.675 1.00 0.00 H new ATOM 0 HD13 LEU A 78 22.742 3.718 13.727 1.00 0.00 H new ATOM 0 HD21 LEU A 78 22.200 3.697 16.617 1.00 0.00 H new ATOM 0 HD22 LEU A 78 22.627 2.322 15.572 1.00 0.00 H new ATOM 0 HD23 LEU A 78 23.547 2.623 17.065 1.00 0.00 H new ATOM 1249 N THR A 79 25.184 -0.357 15.661 1.00 0.00 N ATOM 1250 CA THR A 79 24.953 -1.729 15.186 1.00 0.00 C ATOM 1251 C THR A 79 23.522 -2.066 15.571 1.00 0.00 C ATOM 1252 O THR A 79 23.186 -2.683 16.604 1.00 0.00 O ATOM 1253 CB THR A 79 25.867 -2.787 15.869 1.00 0.00 C ATOM 1254 OG1 THR A 79 27.172 -2.593 15.364 1.00 0.00 O ATOM 1255 CG2 THR A 79 25.465 -4.244 15.729 1.00 0.00 C ATOM 0 H THR A 79 25.067 -0.283 16.672 1.00 0.00 H new ATOM 0 HA THR A 79 25.161 -1.762 14.116 1.00 0.00 H new ATOM 0 HB THR A 79 25.781 -2.615 16.942 1.00 0.00 H new ATOM 0 HG1 THR A 79 27.781 -3.243 15.773 1.00 0.00 H new ATOM 0 HG21 THR A 79 26.187 -4.872 16.251 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.475 -4.392 16.162 1.00 0.00 H new ATOM 0 HG23 THR A 79 25.444 -4.516 14.674 1.00 0.00 H new ATOM 1263 N GLY A 80 22.619 -1.649 14.714 1.00 0.00 N ATOM 1264 CA GLY A 80 21.205 -1.877 14.911 1.00 0.00 C ATOM 1265 C GLY A 80 20.564 -2.023 13.540 1.00 0.00 C ATOM 1266 O GLY A 80 21.259 -1.897 12.533 1.00 0.00 O ATOM 0 H GLY A 80 22.844 -1.141 13.859 1.00 0.00 H new ATOM 0 HA2 GLY A 80 21.042 -2.775 15.507 1.00 0.00 H new ATOM 0 HA3 GLY A 80 20.756 -1.047 15.456 1.00 0.00 H new ATOM 1270 N THR A 81 19.283 -2.275 13.593 1.00 0.00 N ATOM 1271 CA THR A 81 18.534 -2.436 12.343 1.00 0.00 C ATOM 1272 C THR A 81 17.374 -1.456 12.235 1.00 0.00 C ATOM 1273 O THR A 81 16.250 -1.610 12.688 1.00 0.00 O ATOM 1274 CB THR A 81 17.912 -3.846 12.279 1.00 0.00 C ATOM 1275 OG1 THR A 81 16.754 -4.026 13.060 1.00 0.00 O ATOM 1276 CG2 THR A 81 18.940 -4.913 12.694 1.00 0.00 C ATOM 0 H THR A 81 18.738 -2.373 14.449 1.00 0.00 H new ATOM 0 HA THR A 81 19.247 -2.261 11.537 1.00 0.00 H new ATOM 0 HB THR A 81 17.612 -3.958 11.237 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.080 -3.362 12.804 1.00 0.00 H new ATOM 0 HG21 THR A 81 18.481 -5.900 12.642 1.00 0.00 H new ATOM 0 HG22 THR A 81 19.796 -4.875 12.020 1.00 0.00 H new ATOM 0 HG23 THR A 81 19.272 -4.721 13.714 1.00 0.00 H new ATOM 1284 N TRP A 82 17.782 -0.387 11.574 1.00 0.00 N ATOM 1285 CA TRP A 82 16.864 0.687 11.354 1.00 0.00 C ATOM 1286 C TRP A 82 15.701 0.022 10.566 1.00 0.00 C ATOM 1287 O TRP A 82 15.917 -0.740 9.610 1.00 0.00 O ATOM 1288 CB TRP A 82 17.272 1.829 10.410 1.00 0.00 C ATOM 1289 CG TRP A 82 18.588 2.467 10.542 1.00 0.00 C ATOM 1290 CD1 TRP A 82 19.818 1.958 10.709 1.00 0.00 C ATOM 1291 CD2 TRP A 82 18.796 3.883 10.522 1.00 0.00 C ATOM 1292 NE1 TRP A 82 20.743 2.971 10.797 1.00 0.00 N ATOM 1293 CE2 TRP A 82 20.180 4.204 10.693 1.00 0.00 C ATOM 1294 CE3 TRP A 82 17.966 4.989 10.381 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 20.641 5.509 10.723 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 18.391 6.284 10.415 1.00 0.00 C ATOM 1297 CH2 TRP A 82 19.745 6.546 10.587 1.00 0.00 C ATOM 0 H TRP A 82 18.719 -0.251 11.194 1.00 0.00 H new ATOM 0 HA TRP A 82 16.702 1.130 12.337 1.00 0.00 H new ATOM 0 HB2 TRP A 82 17.200 1.447 9.392 1.00 0.00 H new ATOM 0 HB3 TRP A 82 16.522 2.614 10.510 1.00 0.00 H new ATOM 0 HD1 TRP A 82 20.048 0.904 10.766 1.00 0.00 H new ATOM 0 HE1 TRP A 82 21.743 2.815 10.926 1.00 0.00 H new ATOM 0 HE3 TRP A 82 16.911 4.810 10.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 21.694 5.712 10.852 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 17.685 7.095 10.310 1.00 0.00 H new ATOM 0 HH2 TRP A 82 20.096 7.567 10.614 1.00 0.00 H new ATOM 1308 N THR A 83 14.505 0.353 10.992 1.00 0.00 N ATOM 1309 CA THR A 83 13.229 -0.084 10.443 1.00 0.00 C ATOM 1310 C THR A 83 12.325 1.142 10.600 1.00 0.00 C ATOM 1311 O THR A 83 12.750 2.199 10.989 1.00 0.00 O ATOM 1312 CB THR A 83 12.600 -1.302 11.111 1.00 0.00 C ATOM 1313 OG1 THR A 83 13.235 -1.537 12.338 1.00 0.00 O ATOM 1314 CG2 THR A 83 12.762 -2.540 10.224 1.00 0.00 C ATOM 0 H THR A 83 14.382 0.979 11.788 1.00 0.00 H new ATOM 0 HA THR A 83 13.371 -0.422 9.416 1.00 0.00 H new ATOM 0 HB THR A 83 11.539 -1.108 11.266 1.00 0.00 H new ATOM 0 HG1 THR A 83 12.832 -2.318 12.771 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.308 -3.401 10.715 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.272 -2.368 9.266 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.822 -2.733 10.059 1.00 0.00 H new ATOM 1322 N MET A 84 11.078 0.936 10.279 1.00 0.00 N ATOM 1323 CA MET A 84 10.066 1.998 10.376 1.00 0.00 C ATOM 1324 C MET A 84 8.784 1.237 10.598 1.00 0.00 C ATOM 1325 O MET A 84 8.881 0.119 11.108 1.00 0.00 O ATOM 1326 CB MET A 84 10.139 2.735 9.022 1.00 0.00 C ATOM 1327 CG MET A 84 9.418 2.066 7.840 1.00 0.00 C ATOM 1328 SD MET A 84 8.572 3.208 6.692 1.00 0.00 S ATOM 1329 CE MET A 84 7.561 1.990 5.812 1.00 0.00 C ATOM 0 H MET A 84 10.718 0.042 9.944 1.00 0.00 H new ATOM 0 HA MET A 84 10.180 2.741 11.165 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.724 3.734 9.154 1.00 0.00 H new ATOM 0 HB3 MET A 84 11.189 2.858 8.756 1.00 0.00 H new ATOM 0 HG2 MET A 84 10.145 1.483 7.275 1.00 0.00 H new ATOM 0 HG3 MET A 84 8.684 1.364 8.234 1.00 0.00 H new ATOM 0 HE1 MET A 84 7.083 2.465 4.955 1.00 0.00 H new ATOM 0 HE2 MET A 84 8.194 1.172 5.468 1.00 0.00 H new ATOM 0 HE3 MET A 84 6.796 1.599 6.483 1.00 0.00 H new ATOM 1339 N GLU A 85 7.616 1.744 10.249 1.00 0.00 N ATOM 1340 CA GLU A 85 6.403 0.967 10.469 1.00 0.00 C ATOM 1341 C GLU A 85 5.308 1.552 9.664 1.00 0.00 C ATOM 1342 O GLU A 85 5.576 2.300 8.706 1.00 0.00 O ATOM 1343 CB GLU A 85 6.108 0.980 11.986 1.00 0.00 C ATOM 1344 CG GLU A 85 5.576 -0.376 12.444 1.00 0.00 C ATOM 1345 CD GLU A 85 5.091 -0.455 13.872 1.00 0.00 C ATOM 1346 OE1 GLU A 85 5.704 0.408 14.650 1.00 0.00 O ATOM 1347 OE2 GLU A 85 4.227 -1.242 14.218 1.00 0.00 O ATOM 0 H GLU A 85 7.478 2.661 9.825 1.00 0.00 H new ATOM 0 HA GLU A 85 6.512 -0.070 10.152 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.017 1.224 12.536 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.379 1.758 12.213 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.754 -0.661 11.787 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.364 -1.117 12.309 1.00 0.00 H new ATOM 1354 N GLY A 86 4.098 1.222 10.040 1.00 0.00 N ATOM 1355 CA GLY A 86 2.895 1.681 9.403 1.00 0.00 C ATOM 1356 C GLY A 86 2.978 3.168 9.453 1.00 0.00 C ATOM 1357 O GLY A 86 2.350 3.789 8.612 1.00 0.00 O ATOM 0 H GLY A 86 3.920 0.602 10.830 1.00 0.00 H new ATOM 0 HA2 GLY A 86 2.831 1.323 8.375 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.009 1.317 9.923 1.00 0.00 H new ATOM 1361 N ASN A 87 3.715 3.735 10.385 1.00 0.00 N ATOM 1362 CA ASN A 87 3.787 5.175 10.408 1.00 0.00 C ATOM 1363 C ASN A 87 5.045 5.720 11.082 1.00 0.00 C ATOM 1364 O ASN A 87 5.009 6.760 11.702 1.00 0.00 O ATOM 1365 CB ASN A 87 2.479 5.908 10.687 1.00 0.00 C ATOM 1366 CG ASN A 87 2.051 5.585 12.099 1.00 0.00 C ATOM 1367 OD1 ASN A 87 1.777 4.418 12.423 1.00 0.00 O ATOM 1368 ND2 ASN A 87 1.993 6.593 12.946 1.00 0.00 N ATOM 0 H ASN A 87 4.249 3.246 11.104 1.00 0.00 H new ATOM 0 HA ASN A 87 3.931 5.452 9.364 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.612 6.983 10.566 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.711 5.600 9.977 1.00 0.00 H new ATOM 0 HD21 ASN A 87 1.714 6.431 13.914 1.00 0.00 H new ATOM 0 HD22 ASN A 87 2.227 7.535 12.634 1.00 0.00 H new ATOM 1375 N LYS A 88 6.182 5.068 10.999 1.00 0.00 N ATOM 1376 CA LYS A 88 7.301 5.641 11.657 1.00 0.00 C ATOM 1377 C LYS A 88 8.580 4.793 11.569 1.00 0.00 C ATOM 1378 O LYS A 88 8.487 3.659 11.950 1.00 0.00 O ATOM 1379 CB LYS A 88 7.200 5.769 13.164 1.00 0.00 C ATOM 1380 CG LYS A 88 6.674 4.643 13.984 1.00 0.00 C ATOM 1381 CD LYS A 88 6.820 5.063 15.442 1.00 0.00 C ATOM 1382 CE LYS A 88 8.029 4.468 16.128 1.00 0.00 C ATOM 1383 NZ LYS A 88 7.652 3.394 17.030 1.00 0.00 N ATOM 0 H LYS A 88 6.341 4.189 10.507 1.00 0.00 H new ATOM 0 HA LYS A 88 7.326 6.599 11.137 1.00 0.00 H new ATOM 0 HB2 LYS A 88 8.199 5.998 13.535 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.576 6.638 13.372 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.631 4.441 13.741 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.230 3.727 13.787 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.883 6.150 15.493 1.00 0.00 H new ATOM 0 HD3 LYS A 88 5.923 4.769 15.987 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.724 4.089 15.379 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.553 5.245 16.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 8.504 3.007 17.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.008 3.763 17.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.174 2.642 16.494 1.00 0.00 H new ATOM 1397 N LEU A 89 9.650 5.439 11.098 1.00 0.00 N ATOM 1398 CA LEU A 89 10.997 4.936 10.954 1.00 0.00 C ATOM 1399 C LEU A 89 11.354 4.515 12.393 1.00 0.00 C ATOM 1400 O LEU A 89 10.539 4.624 13.322 1.00 0.00 O ATOM 1401 CB LEU A 89 11.908 6.114 10.489 1.00 0.00 C ATOM 1402 CG LEU A 89 12.546 6.065 9.120 1.00 0.00 C ATOM 1403 CD1 LEU A 89 12.177 7.307 8.294 1.00 0.00 C ATOM 1404 CD2 LEU A 89 14.086 6.001 9.215 1.00 0.00 C ATOM 0 H LEU A 89 9.578 6.407 10.785 1.00 0.00 H new ATOM 0 HA LEU A 89 11.111 4.125 10.235 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.314 7.026 10.540 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.710 6.215 11.220 1.00 0.00 H new ATOM 0 HG LEU A 89 12.169 5.164 8.636 1.00 0.00 H new ATOM 0 HD11 LEU A 89 12.650 7.246 7.314 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.095 7.355 8.173 1.00 0.00 H new ATOM 0 HD13 LEU A 89 12.525 8.203 8.809 1.00 0.00 H new ATOM 0 HD21 LEU A 89 14.511 5.967 8.212 1.00 0.00 H new ATOM 0 HD22 LEU A 89 14.455 6.884 9.736 1.00 0.00 H new ATOM 0 HD23 LEU A 89 14.380 5.107 9.764 1.00 0.00 H new ATOM 1416 N VAL A 90 12.570 4.019 12.650 1.00 0.00 N ATOM 1417 CA VAL A 90 12.948 3.618 13.963 1.00 0.00 C ATOM 1418 C VAL A 90 14.468 3.700 14.178 1.00 0.00 C ATOM 1419 O VAL A 90 14.824 3.138 15.235 1.00 0.00 O ATOM 1420 CB VAL A 90 12.553 2.148 14.280 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.441 1.858 15.769 1.00 0.00 C ATOM 1422 CG2 VAL A 90 11.205 1.785 13.720 1.00 0.00 C ATOM 0 H VAL A 90 13.296 3.895 11.945 1.00 0.00 H new ATOM 0 HA VAL A 90 12.417 4.309 14.618 1.00 0.00 H new ATOM 0 HB VAL A 90 13.358 1.570 13.827 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.162 0.815 15.917 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.400 2.049 16.250 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.680 2.502 16.209 1.00 0.00 H new ATOM 0 HG21 VAL A 90 10.975 0.749 13.968 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.445 2.438 14.149 1.00 0.00 H new ATOM 0 HG23 VAL A 90 11.217 1.905 12.637 1.00 0.00 H new ATOM 1432 N GLY A 91 15.247 4.327 13.312 1.00 0.00 N ATOM 1433 CA GLY A 91 16.663 4.454 13.354 1.00 0.00 C ATOM 1434 C GLY A 91 17.352 3.166 13.824 1.00 0.00 C ATOM 1435 O GLY A 91 18.104 2.487 13.146 1.00 0.00 O ATOM 0 H GLY A 91 14.852 4.795 12.496 1.00 0.00 H new ATOM 0 HA2 GLY A 91 17.031 4.719 12.363 1.00 0.00 H new ATOM 0 HA3 GLY A 91 16.932 5.272 14.023 1.00 0.00 H new ATOM 1439 N LYS A 92 17.063 2.846 15.042 1.00 0.00 N ATOM 1440 CA LYS A 92 17.528 1.657 15.721 1.00 0.00 C ATOM 1441 C LYS A 92 18.956 1.780 16.122 1.00 0.00 C ATOM 1442 O LYS A 92 19.533 2.824 15.850 1.00 0.00 O ATOM 1443 CB LYS A 92 17.198 0.388 14.973 1.00 0.00 C ATOM 1444 CG LYS A 92 15.694 0.162 15.197 1.00 0.00 C ATOM 1445 CD LYS A 92 15.446 -0.132 16.674 1.00 0.00 C ATOM 1446 CE LYS A 92 14.483 -1.290 16.857 1.00 0.00 C ATOM 1447 NZ LYS A 92 14.709 -1.853 18.185 1.00 0.00 N ATOM 0 H LYS A 92 16.467 3.429 15.630 1.00 0.00 H new ATOM 0 HA LYS A 92 16.967 1.571 16.652 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.427 0.487 13.912 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.782 -0.452 15.348 1.00 0.00 H new ATOM 0 HG2 LYS A 92 15.132 1.044 14.890 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.344 -0.669 14.585 1.00 0.00 H new ATOM 0 HD2 LYS A 92 16.392 -0.363 17.164 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.044 0.757 17.160 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.452 -0.949 16.757 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.645 -2.046 16.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.060 -2.651 18.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.692 -2.186 18.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.536 -1.123 18.905 1.00 0.00 H new ATOM 1461 N PHE A 93 19.473 0.749 16.794 1.00 0.00 N ATOM 1462 CA PHE A 93 20.819 0.823 17.327 1.00 0.00 C ATOM 1463 C PHE A 93 21.122 -0.264 18.373 1.00 0.00 C ATOM 1464 O PHE A 93 20.454 -1.291 18.387 1.00 0.00 O ATOM 1465 CB PHE A 93 20.722 2.074 18.257 1.00 0.00 C ATOM 1466 CG PHE A 93 19.332 2.216 18.841 1.00 0.00 C ATOM 1467 CD1 PHE A 93 18.788 1.087 19.467 1.00 0.00 C ATOM 1468 CD2 PHE A 93 18.594 3.371 18.792 1.00 0.00 C ATOM 1469 CE1 PHE A 93 17.516 1.074 20.060 1.00 0.00 C ATOM 1470 CE2 PHE A 93 17.356 3.358 19.391 1.00 0.00 C ATOM 1471 CZ PHE A 93 16.807 2.245 20.015 1.00 0.00 C ATOM 0 H PHE A 93 18.985 -0.128 16.976 1.00 0.00 H new ATOM 0 HA PHE A 93 21.536 0.784 16.507 1.00 0.00 H new ATOM 0 HB2 PHE A 93 21.451 1.989 19.063 1.00 0.00 H new ATOM 0 HB3 PHE A 93 20.975 2.971 17.692 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.377 0.182 19.495 1.00 0.00 H new ATOM 0 HD2 PHE A 93 18.971 4.257 18.302 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.117 0.186 20.528 1.00 0.00 H new ATOM 0 HE2 PHE A 93 16.775 4.269 19.375 1.00 0.00 H new ATOM 0 HZ PHE A 93 15.826 2.303 20.463 1.00 0.00 H new ATOM 1481 N LYS A 94 22.094 0.213 19.102 1.00 0.00 N ATOM 1482 CA LYS A 94 22.770 -0.263 20.300 1.00 0.00 C ATOM 1483 C LYS A 94 24.219 -0.229 19.887 1.00 0.00 C ATOM 1484 O LYS A 94 24.680 -1.228 19.394 1.00 0.00 O ATOM 1485 CB LYS A 94 22.403 -1.631 20.752 1.00 0.00 C ATOM 1486 CG LYS A 94 21.610 -1.223 21.989 1.00 0.00 C ATOM 1487 CD LYS A 94 20.915 -2.255 22.815 1.00 0.00 C ATOM 1488 CE LYS A 94 19.809 -2.939 22.049 1.00 0.00 C ATOM 1489 NZ LYS A 94 20.255 -4.266 21.613 1.00 0.00 N ATOM 0 H LYS A 94 22.507 1.103 18.823 1.00 0.00 H new ATOM 0 HA LYS A 94 22.500 0.354 21.157 1.00 0.00 H new ATOM 0 HB2 LYS A 94 21.806 -2.177 20.022 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.269 -2.252 20.984 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.294 -0.689 22.649 1.00 0.00 H new ATOM 0 HG3 LYS A 94 20.855 -0.507 21.666 1.00 0.00 H new ATOM 0 HD2 LYS A 94 21.638 -2.999 23.150 1.00 0.00 H new ATOM 0 HD3 LYS A 94 20.502 -1.787 23.708 1.00 0.00 H new ATOM 0 HE2 LYS A 94 18.922 -3.031 22.676 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.527 -2.338 21.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 19.490 -4.733 21.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 21.089 -4.168 20.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 20.503 -4.839 22.444 1.00 0.00 H new ATOM 1503 N ARG A 95 24.753 0.945 20.091 1.00 0.00 N ATOM 1504 CA ARG A 95 26.113 1.189 19.742 1.00 0.00 C ATOM 1505 C ARG A 95 26.975 0.087 20.401 1.00 0.00 C ATOM 1506 O ARG A 95 26.519 -0.845 20.986 1.00 0.00 O ATOM 1507 CB ARG A 95 26.732 2.429 20.336 1.00 0.00 C ATOM 1508 CG ARG A 95 25.963 3.700 20.408 1.00 0.00 C ATOM 1509 CD ARG A 95 24.959 3.993 19.304 1.00 0.00 C ATOM 1510 NE ARG A 95 25.593 4.277 18.041 1.00 0.00 N ATOM 1511 CZ ARG A 95 26.421 5.330 17.811 1.00 0.00 C ATOM 1512 NH1 ARG A 95 26.724 6.209 18.762 1.00 0.00 N ATOM 1513 NH2 ARG A 95 26.999 5.566 16.616 1.00 0.00 N ATOM 0 H ARG A 95 24.262 1.742 20.497 1.00 0.00 H new ATOM 0 HA ARG A 95 26.099 1.252 18.654 1.00 0.00 H new ATOM 0 HB2 ARG A 95 27.037 2.180 21.352 1.00 0.00 H new ATOM 0 HB3 ARG A 95 27.642 2.636 19.772 1.00 0.00 H new ATOM 0 HG2 ARG A 95 25.428 3.713 21.357 1.00 0.00 H new ATOM 0 HG3 ARG A 95 26.679 4.522 20.435 1.00 0.00 H new ATOM 0 HD2 ARG A 95 24.292 3.139 19.188 1.00 0.00 H new ATOM 0 HD3 ARG A 95 24.341 4.842 19.596 1.00 0.00 H new ATOM 0 HE ARG A 95 25.407 3.642 17.264 1.00 0.00 H new ATOM 0 HH11 ARG A 95 26.331 6.104 19.698 1.00 0.00 H new ATOM 0 HH12 ARG A 95 27.349 6.988 18.556 1.00 0.00 H new ATOM 0 HH21 ARG A 95 26.822 4.939 15.831 1.00 0.00 H new ATOM 0 HH22 ARG A 95 27.613 6.372 16.497 1.00 0.00 H new ATOM 1527 N VAL A 96 28.231 0.283 20.317 1.00 0.00 N ATOM 1528 CA VAL A 96 29.251 -0.596 20.873 1.00 0.00 C ATOM 1529 C VAL A 96 29.843 0.149 22.091 1.00 0.00 C ATOM 1530 O VAL A 96 30.083 -0.534 23.064 1.00 0.00 O ATOM 1531 CB VAL A 96 30.253 -0.837 19.787 1.00 0.00 C ATOM 1532 CG1 VAL A 96 31.670 -0.746 20.396 1.00 0.00 C ATOM 1533 CG2 VAL A 96 30.006 -2.113 19.003 1.00 0.00 C ATOM 0 H VAL A 96 28.625 1.094 19.840 1.00 0.00 H new ATOM 0 HA VAL A 96 28.882 -1.565 21.208 1.00 0.00 H new ATOM 0 HB VAL A 96 30.146 -0.059 19.031 1.00 0.00 H new ATOM 0 HG11 VAL A 96 32.413 -0.919 19.617 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.819 0.245 20.825 1.00 0.00 H new ATOM 0 HG13 VAL A 96 31.780 -1.499 21.176 1.00 0.00 H new ATOM 0 HG21 VAL A 96 30.771 -2.221 18.234 1.00 0.00 H new ATOM 0 HG22 VAL A 96 30.046 -2.968 19.678 1.00 0.00 H new ATOM 0 HG23 VAL A 96 29.023 -2.067 18.534 1.00 0.00 H new ATOM 1543 N ASP A 97 30.002 1.446 21.921 1.00 0.00 N ATOM 1544 CA ASP A 97 30.516 2.224 23.090 1.00 0.00 C ATOM 1545 C ASP A 97 29.849 1.744 24.378 1.00 0.00 C ATOM 1546 O ASP A 97 30.490 1.599 25.434 1.00 0.00 O ATOM 1547 CB ASP A 97 30.325 3.721 22.888 1.00 0.00 C ATOM 1548 CG ASP A 97 30.466 4.629 24.115 1.00 0.00 C ATOM 1549 OD1 ASP A 97 29.606 4.832 24.962 1.00 0.00 O ATOM 1550 OD2 ASP A 97 31.618 5.202 24.206 1.00 0.00 O ATOM 0 H ASP A 97 29.809 1.973 21.069 1.00 0.00 H new ATOM 0 HA ASP A 97 31.588 2.048 23.175 1.00 0.00 H new ATOM 0 HB2 ASP A 97 31.045 4.053 22.140 1.00 0.00 H new ATOM 0 HB3 ASP A 97 29.332 3.879 22.466 1.00 0.00 H new ATOM 1555 N ASN A 98 28.574 1.499 24.199 1.00 0.00 N ATOM 1556 CA ASN A 98 27.659 1.046 25.230 1.00 0.00 C ATOM 1557 C ASN A 98 26.232 0.715 24.930 1.00 0.00 C ATOM 1558 O ASN A 98 25.403 0.564 25.845 1.00 0.00 O ATOM 1559 CB ASN A 98 27.736 2.162 26.339 1.00 0.00 C ATOM 1560 CG ASN A 98 26.991 1.942 27.626 1.00 0.00 C ATOM 1561 OD1 ASN A 98 27.444 1.122 28.500 1.00 0.00 O ATOM 1562 ND2 ASN A 98 25.886 2.594 27.842 1.00 0.00 N ATOM 0 H ASN A 98 28.121 1.614 23.292 1.00 0.00 H new ATOM 0 HA ASN A 98 28.003 0.045 25.489 1.00 0.00 H new ATOM 0 HB2 ASN A 98 28.787 2.314 26.585 1.00 0.00 H new ATOM 0 HB3 ASN A 98 27.374 3.092 25.900 1.00 0.00 H new ATOM 0 HD21 ASN A 98 25.373 2.454 28.713 1.00 0.00 H new ATOM 0 HD22 ASN A 98 25.533 3.245 27.141 1.00 0.00 H new ATOM 1569 N GLY A 99 25.849 0.598 23.674 1.00 0.00 N ATOM 1570 CA GLY A 99 24.507 0.313 23.286 1.00 0.00 C ATOM 1571 C GLY A 99 23.478 1.441 23.570 1.00 0.00 C ATOM 1572 O GLY A 99 22.599 1.283 24.416 1.00 0.00 O ATOM 0 H GLY A 99 26.488 0.703 22.886 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.494 0.093 22.218 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.182 -0.591 23.802 1.00 0.00 H new ATOM 1576 N LYS A 100 23.628 2.567 22.830 1.00 0.00 N ATOM 1577 CA LYS A 100 22.757 3.713 22.945 1.00 0.00 C ATOM 1578 C LYS A 100 21.369 3.387 22.331 1.00 0.00 C ATOM 1579 O LYS A 100 21.267 2.277 21.866 1.00 0.00 O ATOM 1580 CB LYS A 100 23.251 4.846 22.055 1.00 0.00 C ATOM 1581 CG LYS A 100 24.455 5.593 22.514 1.00 0.00 C ATOM 1582 CD LYS A 100 25.213 4.858 23.607 1.00 0.00 C ATOM 1583 CE LYS A 100 26.312 5.717 24.223 1.00 0.00 C ATOM 1584 NZ LYS A 100 26.666 5.396 25.590 1.00 0.00 N ATOM 0 H LYS A 100 24.368 2.684 22.138 1.00 0.00 H new ATOM 0 HA LYS A 100 22.724 3.972 24.003 1.00 0.00 H new ATOM 0 HB2 LYS A 100 23.464 4.433 21.069 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.436 5.560 21.932 1.00 0.00 H new ATOM 0 HG2 LYS A 100 25.119 5.762 21.666 1.00 0.00 H new ATOM 0 HG3 LYS A 100 24.152 6.573 22.882 1.00 0.00 H new ATOM 0 HD2 LYS A 100 24.516 4.549 24.386 1.00 0.00 H new ATOM 0 HD3 LYS A 100 25.652 3.950 23.194 1.00 0.00 H new ATOM 0 HE2 LYS A 100 27.206 5.629 23.605 1.00 0.00 H new ATOM 0 HE3 LYS A 100 25.998 6.760 24.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 26.468 6.214 26.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 26.106 4.580 25.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 27.678 5.163 25.641 1.00 0.00 H new ATOM 1598 N GLU A 101 20.470 4.365 22.312 1.00 0.00 N ATOM 1599 CA GLU A 101 19.206 4.053 21.631 1.00 0.00 C ATOM 1600 C GLU A 101 18.565 5.230 20.859 1.00 0.00 C ATOM 1601 O GLU A 101 17.457 5.555 21.177 1.00 0.00 O ATOM 1602 CB GLU A 101 18.224 3.203 22.429 1.00 0.00 C ATOM 1603 CG GLU A 101 18.679 1.727 22.591 1.00 0.00 C ATOM 1604 CD GLU A 101 19.515 1.424 23.810 1.00 0.00 C ATOM 1605 OE1 GLU A 101 19.825 2.518 24.479 1.00 0.00 O ATOM 1606 OE2 GLU A 101 19.898 0.334 24.205 1.00 0.00 O ATOM 0 H GLU A 101 20.566 5.297 22.716 1.00 0.00 H new ATOM 0 HA GLU A 101 19.528 3.378 20.838 1.00 0.00 H new ATOM 0 HB2 GLU A 101 18.091 3.645 23.416 1.00 0.00 H new ATOM 0 HB3 GLU A 101 17.252 3.224 21.936 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.792 1.095 22.617 1.00 0.00 H new ATOM 0 HG3 GLU A 101 19.247 1.443 21.705 1.00 0.00 H new ATOM 1613 N LEU A 102 19.365 5.673 19.917 1.00 0.00 N ATOM 1614 CA LEU A 102 19.122 6.764 18.976 1.00 0.00 C ATOM 1615 C LEU A 102 17.638 6.540 18.631 1.00 0.00 C ATOM 1616 O LEU A 102 16.870 7.210 19.273 1.00 0.00 O ATOM 1617 CB LEU A 102 19.956 6.598 17.696 1.00 0.00 C ATOM 1618 CG LEU A 102 21.453 6.838 18.031 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.193 5.541 18.341 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.001 7.356 16.719 1.00 0.00 C ATOM 0 H LEU A 102 20.281 5.250 19.769 1.00 0.00 H new ATOM 0 HA LEU A 102 19.372 7.745 19.381 1.00 0.00 H new ATOM 0 HB2 LEU A 102 19.818 5.598 17.284 1.00 0.00 H new ATOM 0 HB3 LEU A 102 19.623 7.304 16.936 1.00 0.00 H new ATOM 0 HG LEU A 102 21.568 7.490 18.897 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.236 5.763 18.569 1.00 0.00 H new ATOM 0 HD12 LEU A 102 21.730 5.054 19.199 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.143 4.878 17.477 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.065 7.566 16.827 1.00 0.00 H new ATOM 0 HD22 LEU A 102 21.856 6.605 15.942 1.00 0.00 H new ATOM 0 HD23 LEU A 102 21.477 8.271 16.442 1.00 0.00 H new ATOM 1632 N ILE A 103 17.405 5.658 17.698 1.00 0.00 N ATOM 1633 CA ILE A 103 16.053 5.219 17.293 1.00 0.00 C ATOM 1634 C ILE A 103 15.687 6.036 16.070 1.00 0.00 C ATOM 1635 O ILE A 103 14.572 5.870 15.602 1.00 0.00 O ATOM 1636 CB ILE A 103 15.047 5.339 18.414 1.00 0.00 C ATOM 1637 CG1 ILE A 103 14.591 3.993 18.958 1.00 0.00 C ATOM 1638 CG2 ILE A 103 13.854 6.225 18.069 1.00 0.00 C ATOM 1639 CD1 ILE A 103 14.776 2.758 18.130 1.00 0.00 C ATOM 0 H ILE A 103 18.151 5.201 17.173 1.00 0.00 H new ATOM 0 HA ILE A 103 16.044 4.156 17.050 1.00 0.00 H new ATOM 0 HB ILE A 103 15.592 5.841 19.214 1.00 0.00 H new ATOM 0 HG12 ILE A 103 15.108 3.832 19.904 1.00 0.00 H new ATOM 0 HG13 ILE A 103 13.528 4.077 19.186 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.173 6.266 18.919 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.203 7.231 17.835 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.332 5.813 17.206 1.00 0.00 H new ATOM 0 HD11 ILE A 103 14.395 1.894 18.675 1.00 0.00 H new ATOM 0 HD12 ILE A 103 14.232 2.864 17.191 1.00 0.00 H new ATOM 0 HD13 ILE A 103 15.836 2.616 17.921 1.00 0.00 H new ATOM 1651 N ALA A 104 16.649 6.831 15.660 1.00 0.00 N ATOM 1652 CA ALA A 104 16.595 7.740 14.528 1.00 0.00 C ATOM 1653 C ALA A 104 15.406 7.397 13.668 1.00 0.00 C ATOM 1654 O ALA A 104 15.570 6.826 12.610 1.00 0.00 O ATOM 1655 CB ALA A 104 17.900 7.689 13.739 1.00 0.00 C ATOM 0 H ALA A 104 17.550 6.865 16.137 1.00 0.00 H new ATOM 0 HA ALA A 104 16.476 8.763 14.884 1.00 0.00 H new ATOM 0 HB1 ALA A 104 17.842 8.376 12.895 1.00 0.00 H new ATOM 0 HB2 ALA A 104 18.728 7.979 14.386 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.064 6.676 13.372 1.00 0.00 H new ATOM 1661 N VAL A 105 14.257 7.751 14.199 1.00 0.00 N ATOM 1662 CA VAL A 105 12.976 7.483 13.592 1.00 0.00 C ATOM 1663 C VAL A 105 12.831 8.400 12.365 1.00 0.00 C ATOM 1664 O VAL A 105 13.641 8.160 11.487 1.00 0.00 O ATOM 1665 CB VAL A 105 11.827 7.667 14.558 1.00 0.00 C ATOM 1666 CG1 VAL A 105 10.428 7.335 13.997 1.00 0.00 C ATOM 1667 CG2 VAL A 105 11.968 6.870 15.849 1.00 0.00 C ATOM 0 H VAL A 105 14.188 8.246 15.088 1.00 0.00 H new ATOM 0 HA VAL A 105 12.937 6.437 13.289 1.00 0.00 H new ATOM 0 HB VAL A 105 11.894 8.738 14.751 1.00 0.00 H new ATOM 0 HG11 VAL A 105 9.677 7.501 14.770 1.00 0.00 H new ATOM 0 HG12 VAL A 105 10.217 7.978 13.142 1.00 0.00 H new ATOM 0 HG13 VAL A 105 10.400 6.292 13.682 1.00 0.00 H new ATOM 0 HG21 VAL A 105 11.105 7.056 16.488 1.00 0.00 H new ATOM 0 HG22 VAL A 105 12.024 5.807 15.616 1.00 0.00 H new ATOM 0 HG23 VAL A 105 12.876 7.176 16.368 1.00 0.00 H new ATOM 1677 N ARG A 106 11.889 9.297 12.363 1.00 0.00 N ATOM 1678 CA ARG A 106 11.525 10.199 11.269 1.00 0.00 C ATOM 1679 C ARG A 106 9.991 10.199 11.433 1.00 0.00 C ATOM 1680 O ARG A 106 9.464 11.257 11.244 1.00 0.00 O ATOM 1681 CB ARG A 106 11.875 9.769 9.913 1.00 0.00 C ATOM 1682 CG ARG A 106 12.523 10.932 9.177 1.00 0.00 C ATOM 1683 CD ARG A 106 13.918 10.735 8.666 1.00 0.00 C ATOM 1684 NE ARG A 106 14.624 9.622 9.228 1.00 0.00 N ATOM 1685 CZ ARG A 106 15.343 9.720 10.355 1.00 0.00 C ATOM 1686 NH1 ARG A 106 15.460 10.797 11.084 1.00 0.00 N ATOM 1687 NH2 ARG A 106 15.967 8.599 10.735 1.00 0.00 N ATOM 0 H ARG A 106 11.299 9.441 13.183 1.00 0.00 H new ATOM 0 HA ARG A 106 12.054 11.149 11.344 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.558 8.920 9.952 1.00 0.00 H new ATOM 0 HB3 ARG A 106 10.983 9.437 9.381 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.888 11.190 8.330 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.528 11.793 9.846 1.00 0.00 H new ATOM 0 HD2 ARG A 106 13.877 10.609 7.584 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.490 11.642 8.860 1.00 0.00 H new ATOM 0 HE ARG A 106 14.578 8.721 8.752 1.00 0.00 H new ATOM 0 HH11 ARG A 106 14.981 11.654 10.808 1.00 0.00 H new ATOM 0 HH12 ARG A 106 16.030 10.781 11.930 1.00 0.00 H new ATOM 0 HH21 ARG A 106 15.876 7.750 10.177 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.534 8.593 11.583 1.00 0.00 H new ATOM 1701 N GLU A 107 9.544 9.032 11.813 1.00 0.00 N ATOM 1702 CA GLU A 107 8.179 8.728 12.155 1.00 0.00 C ATOM 1703 C GLU A 107 7.275 9.215 11.017 1.00 0.00 C ATOM 1704 O GLU A 107 6.645 8.413 10.353 1.00 0.00 O ATOM 1705 CB GLU A 107 7.875 9.668 13.369 1.00 0.00 C ATOM 1706 CG GLU A 107 7.796 8.911 14.702 1.00 0.00 C ATOM 1707 CD GLU A 107 6.505 8.913 15.545 1.00 0.00 C ATOM 1708 OE1 GLU A 107 5.566 8.219 15.248 1.00 0.00 O ATOM 1709 OE2 GLU A 107 6.561 9.729 16.583 1.00 0.00 O ATOM 0 H GLU A 107 10.157 8.221 11.897 1.00 0.00 H new ATOM 0 HA GLU A 107 8.025 7.666 12.347 1.00 0.00 H new ATOM 0 HB2 GLU A 107 8.651 10.431 13.435 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.932 10.186 13.194 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.037 7.869 14.491 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.592 9.300 15.337 1.00 0.00 H new ATOM 1716 N ILE A 108 7.298 10.533 10.919 1.00 0.00 N ATOM 1717 CA ILE A 108 6.566 11.353 9.957 1.00 0.00 C ATOM 1718 C ILE A 108 5.137 11.506 10.417 1.00 0.00 C ATOM 1719 O ILE A 108 4.537 10.570 10.904 1.00 0.00 O ATOM 1720 CB ILE A 108 6.694 10.776 8.568 1.00 0.00 C ATOM 1721 CG1 ILE A 108 6.461 11.959 7.637 1.00 0.00 C ATOM 1722 CG2 ILE A 108 5.693 9.703 8.195 1.00 0.00 C ATOM 1723 CD1 ILE A 108 6.816 11.618 6.214 1.00 0.00 C ATOM 0 H ILE A 108 7.865 11.100 11.549 1.00 0.00 H new ATOM 0 HA ILE A 108 6.995 12.354 9.906 1.00 0.00 H new ATOM 0 HB ILE A 108 7.667 10.289 8.500 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.416 12.265 7.689 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.058 12.808 7.969 1.00 0.00 H new ATOM 0 HG21 ILE A 108 5.884 9.366 7.176 1.00 0.00 H new ATOM 0 HG22 ILE A 108 5.790 8.861 8.880 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.683 10.109 8.260 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.638 12.484 5.577 1.00 0.00 H new ATOM 0 HD12 ILE A 108 7.868 11.337 6.159 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.200 10.785 5.875 1.00 0.00 H new ATOM 1735 N SER A 109 4.639 12.716 10.295 1.00 0.00 N ATOM 1736 CA SER A 109 3.279 12.962 10.786 1.00 0.00 C ATOM 1737 C SER A 109 2.872 14.293 10.285 1.00 0.00 C ATOM 1738 O SER A 109 3.141 15.353 10.803 1.00 0.00 O ATOM 1739 CB SER A 109 3.278 12.884 12.307 1.00 0.00 C ATOM 1740 OG SER A 109 2.331 13.731 12.896 1.00 0.00 O ATOM 0 H SER A 109 5.117 13.517 9.883 1.00 0.00 H new ATOM 0 HA SER A 109 2.567 12.218 10.430 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.079 11.857 12.613 1.00 0.00 H new ATOM 0 HB3 SER A 109 4.270 13.141 12.680 1.00 0.00 H new ATOM 0 HG SER A 109 2.372 13.640 13.871 1.00 0.00 H new ATOM 1746 N GLY A 110 2.143 14.212 9.167 1.00 0.00 N ATOM 1747 CA GLY A 110 1.653 15.412 8.522 1.00 0.00 C ATOM 1748 C GLY A 110 2.919 16.035 7.932 1.00 0.00 C ATOM 1749 O GLY A 110 3.780 15.270 7.483 1.00 0.00 O ATOM 0 H GLY A 110 1.888 13.339 8.704 1.00 0.00 H new ATOM 0 HA2 GLY A 110 0.920 15.183 7.749 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.168 16.082 9.233 1.00 0.00 H new ATOM 1753 N ASN A 111 3.051 17.340 7.928 1.00 0.00 N ATOM 1754 CA ASN A 111 4.285 17.843 7.354 1.00 0.00 C ATOM 1755 C ASN A 111 5.413 17.705 8.403 1.00 0.00 C ATOM 1756 O ASN A 111 5.876 18.698 8.926 1.00 0.00 O ATOM 1757 CB ASN A 111 4.258 19.189 6.635 1.00 0.00 C ATOM 1758 CG ASN A 111 3.496 20.298 7.370 1.00 0.00 C ATOM 1759 OD1 ASN A 111 3.405 20.338 8.596 1.00 0.00 O ATOM 1760 ND2 ASN A 111 2.953 21.202 6.588 1.00 0.00 N ATOM 0 H ASN A 111 2.385 18.027 8.282 1.00 0.00 H new ATOM 0 HA ASN A 111 4.483 17.206 6.492 1.00 0.00 H new ATOM 0 HB2 ASN A 111 5.284 19.519 6.473 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.809 19.050 5.651 1.00 0.00 H new ATOM 0 HD21 ASN A 111 2.430 21.978 6.993 1.00 0.00 H new ATOM 0 HD22 ASN A 111 3.055 21.128 5.576 1.00 0.00 H new ATOM 1767 N GLU A 112 5.839 16.465 8.689 1.00 0.00 N ATOM 1768 CA GLU A 112 6.885 16.207 9.636 1.00 0.00 C ATOM 1769 C GLU A 112 7.887 15.199 9.015 1.00 0.00 C ATOM 1770 O GLU A 112 7.714 14.822 7.879 1.00 0.00 O ATOM 1771 CB GLU A 112 6.343 15.505 10.930 1.00 0.00 C ATOM 1772 CG GLU A 112 6.201 16.430 12.135 1.00 0.00 C ATOM 1773 CD GLU A 112 5.650 17.806 11.865 1.00 0.00 C ATOM 1774 OE1 GLU A 112 4.593 17.921 11.304 1.00 0.00 O ATOM 1775 OE2 GLU A 112 6.406 18.789 12.284 1.00 0.00 O ATOM 0 H GLU A 112 5.454 15.625 8.258 1.00 0.00 H new ATOM 0 HA GLU A 112 7.334 17.169 9.883 1.00 0.00 H new ATOM 0 HB2 GLU A 112 5.371 15.063 10.709 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.013 14.686 11.192 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.556 15.942 12.866 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.182 16.540 12.598 1.00 0.00 H new ATOM 1782 N LEU A 113 8.831 14.859 9.867 1.00 0.00 N ATOM 1783 CA LEU A 113 9.867 13.881 9.687 1.00 0.00 C ATOM 1784 C LEU A 113 10.628 13.762 11.034 1.00 0.00 C ATOM 1785 O LEU A 113 11.820 13.550 11.037 1.00 0.00 O ATOM 1786 CB LEU A 113 10.862 14.083 8.555 1.00 0.00 C ATOM 1787 CG LEU A 113 10.479 13.442 7.209 1.00 0.00 C ATOM 1788 CD1 LEU A 113 11.774 13.139 6.520 1.00 0.00 C ATOM 1789 CD2 LEU A 113 9.817 12.083 7.421 1.00 0.00 C ATOM 0 H LEU A 113 8.892 15.304 10.783 1.00 0.00 H new ATOM 0 HA LEU A 113 9.346 12.974 9.381 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.998 15.154 8.401 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.826 13.681 8.867 1.00 0.00 H new ATOM 0 HG LEU A 113 9.810 14.108 6.664 1.00 0.00 H new ATOM 0 HD11 LEU A 113 11.572 12.679 5.552 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.333 14.063 6.373 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.360 12.454 7.132 1.00 0.00 H new ATOM 0 HD21 LEU A 113 9.556 11.651 6.455 1.00 0.00 H new ATOM 0 HD22 LEU A 113 10.508 11.419 7.941 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.914 12.207 8.019 1.00 0.00 H new ATOM 1801 N ILE A 114 9.864 13.904 12.050 1.00 0.00 N ATOM 1802 CA ILE A 114 10.297 13.736 13.418 1.00 0.00 C ATOM 1803 C ILE A 114 11.350 12.648 13.470 1.00 0.00 C ATOM 1804 O ILE A 114 11.130 11.450 13.649 1.00 0.00 O ATOM 1805 CB ILE A 114 9.089 13.148 14.163 1.00 0.00 C ATOM 1806 CG1 ILE A 114 7.816 12.849 13.381 1.00 0.00 C ATOM 1807 CG2 ILE A 114 8.879 13.924 15.473 1.00 0.00 C ATOM 1808 CD1 ILE A 114 6.634 13.826 13.589 1.00 0.00 C ATOM 0 H ILE A 114 8.878 14.150 11.967 1.00 0.00 H new ATOM 0 HA ILE A 114 10.670 14.675 13.826 1.00 0.00 H new ATOM 0 HB ILE A 114 9.366 12.117 14.381 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.063 12.833 12.320 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.481 11.846 13.645 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.023 13.512 16.007 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.770 13.837 16.094 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.695 14.974 15.248 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.788 13.508 12.980 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.345 13.828 14.640 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.936 14.831 13.294 1.00 0.00 H new ATOM 1820 N GLN A 115 12.576 13.113 13.291 1.00 0.00 N ATOM 1821 CA GLN A 115 13.790 12.335 13.272 1.00 0.00 C ATOM 1822 C GLN A 115 13.932 11.554 14.565 1.00 0.00 C ATOM 1823 O GLN A 115 14.681 10.575 14.556 1.00 0.00 O ATOM 1824 CB GLN A 115 14.882 13.363 13.040 1.00 0.00 C ATOM 1825 CG GLN A 115 14.884 13.850 11.575 1.00 0.00 C ATOM 1826 CD GLN A 115 16.254 13.541 11.051 1.00 0.00 C ATOM 1827 OE1 GLN A 115 16.443 12.879 10.032 1.00 0.00 O ATOM 1828 NE2 GLN A 115 17.247 14.055 11.802 1.00 0.00 N ATOM 0 H GLN A 115 12.754 14.107 13.147 1.00 0.00 H new ATOM 0 HA GLN A 115 13.821 11.570 12.496 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.735 14.211 13.708 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.852 12.929 13.284 1.00 0.00 H new ATOM 0 HG2 GLN A 115 14.117 13.341 10.991 1.00 0.00 H new ATOM 0 HG3 GLN A 115 14.673 14.918 11.516 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.026 14.596 12.638 1.00 0.00 H new ATOM 0 HE22 GLN A 115 18.220 13.903 11.535 1.00 0.00 H new ATOM 1837 N THR A 116 13.192 12.000 15.559 1.00 0.00 N ATOM 1838 CA THR A 116 13.045 11.432 16.876 1.00 0.00 C ATOM 1839 C THR A 116 14.043 10.386 17.235 1.00 0.00 C ATOM 1840 O THR A 116 13.597 9.256 17.455 1.00 0.00 O ATOM 1841 CB THR A 116 11.633 10.793 16.974 1.00 0.00 C ATOM 1842 OG1 THR A 116 10.669 11.742 16.506 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.295 10.462 18.402 1.00 0.00 C ATOM 0 H THR A 116 12.630 12.844 15.452 1.00 0.00 H new ATOM 0 HA THR A 116 13.202 12.255 17.573 1.00 0.00 H new ATOM 0 HB THR A 116 11.621 9.881 16.377 1.00 0.00 H new ATOM 0 HG1 THR A 116 10.511 12.417 17.199 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.302 10.016 18.447 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.028 9.757 18.795 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.311 11.373 19.000 1.00 0.00 H new ATOM 1851 N TYR A 117 15.327 10.728 17.336 1.00 0.00 N ATOM 1852 CA TYR A 117 16.248 9.723 17.738 1.00 0.00 C ATOM 1853 C TYR A 117 16.604 9.858 19.232 1.00 0.00 C ATOM 1854 O TYR A 117 17.510 10.636 19.614 1.00 0.00 O ATOM 1855 CB TYR A 117 17.620 9.865 17.052 1.00 0.00 C ATOM 1856 CG TYR A 117 18.050 10.969 16.119 1.00 0.00 C ATOM 1857 CD1 TYR A 117 17.660 11.093 14.776 1.00 0.00 C ATOM 1858 CD2 TYR A 117 18.901 11.953 16.571 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.087 12.130 13.919 1.00 0.00 C ATOM 1860 CE2 TYR A 117 19.346 12.996 15.762 1.00 0.00 C ATOM 1861 CZ TYR A 117 18.942 13.084 14.439 1.00 0.00 C ATOM 1862 OH TYR A 117 19.375 14.099 13.639 1.00 0.00 O ATOM 0 H TYR A 117 15.718 11.652 17.151 1.00 0.00 H new ATOM 0 HA TYR A 117 15.749 8.788 17.484 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.351 9.866 17.861 1.00 0.00 H new ATOM 0 HB3 TYR A 117 17.763 8.940 16.494 1.00 0.00 H new ATOM 0 HD1 TYR A 117 16.991 10.347 14.373 1.00 0.00 H new ATOM 0 HD2 TYR A 117 19.238 11.914 17.596 1.00 0.00 H new ATOM 0 HE1 TYR A 117 17.757 12.177 12.892 1.00 0.00 H new ATOM 0 HE2 TYR A 117 20.012 13.743 16.169 1.00 0.00 H new ATOM 0 HH TYR A 117 20.252 14.407 13.948 1.00 0.00 H new ATOM 1872 N THR A 118 15.883 9.075 20.016 1.00 0.00 N ATOM 1873 CA THR A 118 15.905 9.042 21.459 1.00 0.00 C ATOM 1874 C THR A 118 16.951 8.160 22.028 1.00 0.00 C ATOM 1875 O THR A 118 16.645 7.259 22.814 1.00 0.00 O ATOM 1876 CB THR A 118 14.570 8.673 22.154 1.00 0.00 C ATOM 1877 OG1 THR A 118 13.510 9.319 21.423 1.00 0.00 O ATOM 1878 CG2 THR A 118 14.643 9.236 23.534 1.00 0.00 C ATOM 0 H THR A 118 15.223 8.401 19.629 1.00 0.00 H new ATOM 0 HA THR A 118 16.125 10.087 21.675 1.00 0.00 H new ATOM 0 HB THR A 118 14.394 7.598 22.185 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.648 9.104 21.837 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.723 9.004 24.071 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.491 8.799 24.061 1.00 0.00 H new ATOM 0 HG23 THR A 118 14.768 10.317 23.480 1.00 0.00 H new ATOM 1886 N TYR A 119 18.248 8.402 21.744 1.00 0.00 N ATOM 1887 CA TYR A 119 19.295 7.631 22.349 1.00 0.00 C ATOM 1888 C TYR A 119 19.368 8.072 23.819 1.00 0.00 C ATOM 1889 O TYR A 119 19.673 9.198 24.130 1.00 0.00 O ATOM 1890 CB TYR A 119 20.660 7.780 21.662 1.00 0.00 C ATOM 1891 CG TYR A 119 21.744 8.424 22.498 1.00 0.00 C ATOM 1892 CD1 TYR A 119 22.223 7.663 23.570 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.236 9.690 22.222 1.00 0.00 C ATOM 1894 CE1 TYR A 119 23.208 8.172 24.383 1.00 0.00 C ATOM 1895 CE2 TYR A 119 23.227 10.223 23.029 1.00 0.00 C ATOM 1896 CZ TYR A 119 23.692 9.447 24.095 1.00 0.00 C ATOM 1897 OH TYR A 119 24.679 9.904 24.953 1.00 0.00 O ATOM 0 H TYR A 119 18.569 9.126 21.101 1.00 0.00 H new ATOM 0 HA TYR A 119 19.058 6.572 22.249 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.002 6.792 21.354 1.00 0.00 H new ATOM 0 HB3 TYR A 119 20.528 8.369 20.754 1.00 0.00 H new ATOM 0 HD1 TYR A 119 21.820 6.679 23.758 1.00 0.00 H new ATOM 0 HD2 TYR A 119 21.850 10.255 21.386 1.00 0.00 H new ATOM 0 HE1 TYR A 119 23.594 7.603 25.216 1.00 0.00 H new ATOM 0 HE2 TYR A 119 23.628 11.208 22.841 1.00 0.00 H new ATOM 0 HH TYR A 119 25.193 9.143 25.295 1.00 0.00 H new ATOM 1907 N GLU A 120 19.067 7.109 24.712 1.00 0.00 N ATOM 1908 CA GLU A 120 19.095 7.322 26.162 1.00 0.00 C ATOM 1909 C GLU A 120 18.053 8.217 26.750 1.00 0.00 C ATOM 1910 O GLU A 120 18.002 8.646 27.882 1.00 0.00 O ATOM 1911 CB GLU A 120 20.549 7.704 26.498 1.00 0.00 C ATOM 1912 CG GLU A 120 20.685 8.955 27.394 1.00 0.00 C ATOM 1913 CD GLU A 120 20.646 8.667 28.872 1.00 0.00 C ATOM 1914 OE1 GLU A 120 20.546 7.406 29.082 1.00 0.00 O ATOM 1915 OE2 GLU A 120 20.700 9.479 29.779 1.00 0.00 O ATOM 0 H GLU A 120 18.798 6.163 24.442 1.00 0.00 H new ATOM 0 HA GLU A 120 18.796 6.399 26.659 1.00 0.00 H new ATOM 0 HB2 GLU A 120 21.028 6.861 26.995 1.00 0.00 H new ATOM 0 HB3 GLU A 120 21.092 7.876 25.568 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.624 9.456 27.158 1.00 0.00 H new ATOM 0 HG3 GLU A 120 19.882 9.651 27.150 1.00 0.00 H new ATOM 1922 N GLY A 121 17.078 8.550 25.901 1.00 0.00 N ATOM 1923 CA GLY A 121 15.997 9.413 26.321 1.00 0.00 C ATOM 1924 C GLY A 121 16.226 10.893 26.034 1.00 0.00 C ATOM 1925 O GLY A 121 15.849 11.753 26.796 1.00 0.00 O ATOM 0 H GLY A 121 17.024 8.235 24.933 1.00 0.00 H new ATOM 0 HA2 GLY A 121 15.081 9.096 25.823 1.00 0.00 H new ATOM 0 HA3 GLY A 121 15.839 9.283 27.392 1.00 0.00 H new ATOM 1929 N VAL A 122 16.884 11.100 24.863 1.00 0.00 N ATOM 1930 CA VAL A 122 17.206 12.416 24.413 1.00 0.00 C ATOM 1931 C VAL A 122 16.260 12.846 23.275 1.00 0.00 C ATOM 1932 O VAL A 122 15.434 13.707 23.541 1.00 0.00 O ATOM 1933 CB VAL A 122 18.680 12.420 23.930 1.00 0.00 C ATOM 1934 CG1 VAL A 122 19.049 13.568 23.023 1.00 0.00 C ATOM 1935 CG2 VAL A 122 19.580 12.432 25.165 1.00 0.00 C ATOM 0 H VAL A 122 17.187 10.353 24.238 1.00 0.00 H new ATOM 0 HA VAL A 122 17.083 13.128 25.229 1.00 0.00 H new ATOM 0 HB VAL A 122 18.817 11.524 23.324 1.00 0.00 H new ATOM 0 HG11 VAL A 122 20.098 13.484 22.739 1.00 0.00 H new ATOM 0 HG12 VAL A 122 18.427 13.539 22.128 1.00 0.00 H new ATOM 0 HG13 VAL A 122 18.889 14.511 23.546 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.625 12.435 24.854 1.00 0.00 H new ATOM 0 HG22 VAL A 122 19.375 13.325 25.756 1.00 0.00 H new ATOM 0 HG23 VAL A 122 19.383 11.545 25.767 1.00 0.00 H new ATOM 1945 N GLU A 123 16.445 12.262 22.128 1.00 0.00 N ATOM 1946 CA GLU A 123 15.744 12.500 20.908 1.00 0.00 C ATOM 1947 C GLU A 123 16.286 13.749 20.292 1.00 0.00 C ATOM 1948 O GLU A 123 16.468 14.780 20.970 1.00 0.00 O ATOM 1949 CB GLU A 123 14.266 12.938 21.184 1.00 0.00 C ATOM 1950 CG GLU A 123 13.394 12.749 19.900 1.00 0.00 C ATOM 1951 CD GLU A 123 11.917 13.025 19.942 1.00 0.00 C ATOM 1952 OE1 GLU A 123 11.256 13.078 20.980 1.00 0.00 O ATOM 1953 OE2 GLU A 123 11.336 13.211 18.808 1.00 0.00 O ATOM 0 H GLU A 123 17.157 11.541 22.017 1.00 0.00 H new ATOM 0 HA GLU A 123 15.830 11.590 20.314 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.852 12.349 22.003 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.242 13.982 21.498 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.820 13.385 19.124 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.521 11.717 19.572 1.00 0.00 H new ATOM 1960 N ALA A 124 16.521 13.628 18.979 1.00 0.00 N ATOM 1961 CA ALA A 124 17.017 14.813 18.288 1.00 0.00 C ATOM 1962 C ALA A 124 16.356 14.813 16.918 1.00 0.00 C ATOM 1963 O ALA A 124 16.495 13.890 16.171 1.00 0.00 O ATOM 1964 CB ALA A 124 18.508 14.824 18.200 1.00 0.00 C ATOM 0 H ALA A 124 16.388 12.789 18.414 1.00 0.00 H new ATOM 0 HA ALA A 124 16.765 15.721 18.836 1.00 0.00 H new ATOM 0 HB1 ALA A 124 18.835 15.723 17.678 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.932 14.813 19.204 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.847 13.944 17.653 1.00 0.00 H new ATOM 1970 N LYS A 125 15.634 15.909 16.734 1.00 0.00 N ATOM 1971 CA LYS A 125 14.871 16.039 15.497 1.00 0.00 C ATOM 1972 C LYS A 125 14.813 17.499 15.214 1.00 0.00 C ATOM 1973 O LYS A 125 15.791 18.188 15.603 1.00 0.00 O ATOM 1974 CB LYS A 125 13.448 15.457 15.746 1.00 0.00 C ATOM 1975 CG LYS A 125 13.372 14.642 17.032 1.00 0.00 C ATOM 1976 CD LYS A 125 13.147 15.571 18.259 1.00 0.00 C ATOM 1977 CE LYS A 125 12.014 16.589 18.145 1.00 0.00 C ATOM 1978 NZ LYS A 125 11.768 17.207 19.462 1.00 0.00 N ATOM 0 H LYS A 125 15.559 16.688 17.389 1.00 0.00 H new ATOM 0 HA LYS A 125 15.313 15.506 14.656 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.727 16.273 15.793 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.163 14.828 14.903 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.559 13.919 16.963 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.293 14.074 17.164 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.956 14.945 19.131 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.073 16.112 18.452 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.273 17.356 17.415 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.108 16.101 17.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 10.996 17.900 19.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 11.503 16.471 20.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 12.631 17.687 19.787 1.00 0.00 H new ATOM 1992 N ARG A 126 13.770 17.994 14.602 1.00 0.00 N ATOM 1993 CA ARG A 126 13.426 19.379 14.274 1.00 0.00 C ATOM 1994 C ARG A 126 12.616 19.201 13.006 1.00 0.00 C ATOM 1995 O ARG A 126 11.585 19.815 12.965 1.00 0.00 O ATOM 1996 CB ARG A 126 14.466 20.408 14.124 1.00 0.00 C ATOM 1997 CG ARG A 126 14.942 20.955 15.440 1.00 0.00 C ATOM 1998 CD ARG A 126 13.895 21.934 15.938 1.00 0.00 C ATOM 1999 NE ARG A 126 13.821 23.080 15.083 1.00 0.00 N ATOM 2000 CZ ARG A 126 12.702 23.664 14.687 1.00 0.00 C ATOM 2001 NH1 ARG A 126 11.497 23.240 15.034 1.00 0.00 N ATOM 2002 NH2 ARG A 126 12.780 24.733 13.901 1.00 0.00 N ATOM 0 H ARG A 126 13.038 17.364 14.274 1.00 0.00 H new ATOM 0 HA ARG A 126 12.932 19.820 15.140 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.313 19.985 13.584 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.077 21.225 13.516 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.085 20.149 16.160 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.905 21.452 15.322 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.923 21.443 15.980 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.138 22.248 16.953 1.00 0.00 H new ATOM 0 HE ARG A 126 14.701 23.478 14.753 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.398 22.423 15.637 1.00 0.00 H new ATOM 0 HH12 ARG A 126 10.668 23.730 14.699 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.692 25.089 13.614 1.00 0.00 H new ATOM 0 HH22 ARG A 126 11.928 25.197 13.585 1.00 0.00 H new ATOM 2016 N ILE A 127 13.128 18.379 12.080 1.00 0.00 N ATOM 2017 CA ILE A 127 12.508 17.976 10.859 1.00 0.00 C ATOM 2018 C ILE A 127 13.255 18.266 9.621 1.00 0.00 C ATOM 2019 O ILE A 127 14.158 19.104 9.547 1.00 0.00 O ATOM 2020 CB ILE A 127 11.043 18.473 10.695 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.148 17.532 11.513 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.468 18.585 9.298 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.614 17.151 12.906 1.00 0.00 C ATOM 0 H ILE A 127 14.052 17.962 12.195 1.00 0.00 H new ATOM 0 HA ILE A 127 12.509 16.893 10.980 1.00 0.00 H new ATOM 0 HB ILE A 127 11.068 19.508 11.037 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.166 17.997 11.603 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.015 16.614 10.941 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.441 18.944 9.355 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.065 19.285 8.714 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.484 17.606 8.818 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.884 16.484 13.364 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.578 16.646 12.842 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.716 18.050 13.514 1.00 0.00 H new ATOM 2035 N PHE A 128 12.772 17.498 8.614 1.00 0.00 N ATOM 2036 CA PHE A 128 13.112 17.450 7.267 1.00 0.00 C ATOM 2037 C PHE A 128 13.162 18.826 6.581 1.00 0.00 C ATOM 2038 O PHE A 128 12.475 19.721 7.043 1.00 0.00 O ATOM 2039 CB PHE A 128 12.037 16.711 6.441 1.00 0.00 C ATOM 2040 CG PHE A 128 10.657 17.388 6.313 1.00 0.00 C ATOM 2041 CD1 PHE A 128 10.455 18.573 5.653 1.00 0.00 C ATOM 2042 CD2 PHE A 128 9.505 16.819 6.867 1.00 0.00 C ATOM 2043 CE1 PHE A 128 9.231 19.215 5.510 1.00 0.00 C ATOM 2044 CE2 PHE A 128 8.278 17.412 6.747 1.00 0.00 C ATOM 2045 CZ PHE A 128 8.116 18.622 6.064 1.00 0.00 C ATOM 0 H PHE A 128 12.034 16.822 8.813 1.00 0.00 H new ATOM 0 HA PHE A 128 14.088 16.966 7.280 1.00 0.00 H new ATOM 0 HB2 PHE A 128 12.431 16.555 5.437 1.00 0.00 H new ATOM 0 HB3 PHE A 128 11.890 15.725 6.883 1.00 0.00 H new ATOM 0 HD1 PHE A 128 11.318 19.046 5.208 1.00 0.00 H new ATOM 0 HD2 PHE A 128 9.587 15.886 7.404 1.00 0.00 H new ATOM 0 HE1 PHE A 128 9.155 20.153 4.980 1.00 0.00 H new ATOM 0 HE2 PHE A 128 7.416 16.936 7.189 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.142 19.080 5.973 1.00 0.00 H new ATOM 2055 N LYS A 129 13.941 18.745 5.536 1.00 0.00 N ATOM 2056 CA LYS A 129 14.211 19.878 4.698 1.00 0.00 C ATOM 2057 C LYS A 129 13.464 19.681 3.392 1.00 0.00 C ATOM 2058 O LYS A 129 13.491 20.605 2.616 1.00 0.00 O ATOM 2059 CB LYS A 129 15.567 20.483 4.634 1.00 0.00 C ATOM 2060 CG LYS A 129 15.431 22.020 4.617 1.00 0.00 C ATOM 2061 CD LYS A 129 15.171 22.703 3.316 1.00 0.00 C ATOM 2062 CE LYS A 129 13.816 23.444 3.342 1.00 0.00 C ATOM 2063 NZ LYS A 129 13.881 24.906 3.172 1.00 0.00 N ATOM 0 H LYS A 129 14.407 17.887 5.242 1.00 0.00 H new ATOM 0 HA LYS A 129 13.820 20.741 5.237 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.161 20.167 5.492 1.00 0.00 H new ATOM 0 HB3 LYS A 129 16.090 20.141 3.741 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.623 22.288 5.298 1.00 0.00 H new ATOM 0 HG3 LYS A 129 16.349 22.437 5.032 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.973 23.411 3.106 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.173 21.970 2.509 1.00 0.00 H new ATOM 0 HE2 LYS A 129 13.184 23.033 2.555 1.00 0.00 H new ATOM 0 HE3 LYS A 129 13.324 23.229 4.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 12.920 25.302 3.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 14.452 25.319 3.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.316 25.130 2.254 1.00 0.00 H new ATOM 2077 N LYS A 130 12.802 18.569 3.372 1.00 0.00 N ATOM 2078 CA LYS A 130 12.010 17.993 2.330 1.00 0.00 C ATOM 2079 C LYS A 130 12.327 18.618 0.988 1.00 0.00 C ATOM 2080 O LYS A 130 12.792 19.734 0.758 1.00 0.00 O ATOM 2081 CB LYS A 130 10.520 17.963 2.592 1.00 0.00 C ATOM 2082 CG LYS A 130 9.572 18.077 1.367 1.00 0.00 C ATOM 2083 CD LYS A 130 8.681 19.314 1.344 1.00 0.00 C ATOM 2084 CE LYS A 130 7.191 18.948 1.248 1.00 0.00 C ATOM 2085 NZ LYS A 130 6.325 20.087 0.908 1.00 0.00 N ATOM 0 H LYS A 130 12.805 17.965 4.194 1.00 0.00 H new ATOM 0 HA LYS A 130 12.302 16.943 2.310 1.00 0.00 H new ATOM 0 HB2 LYS A 130 10.289 17.032 3.110 1.00 0.00 H new ATOM 0 HB3 LYS A 130 10.283 18.777 3.277 1.00 0.00 H new ATOM 0 HG2 LYS A 130 10.176 18.068 0.459 1.00 0.00 H new ATOM 0 HG3 LYS A 130 8.937 17.192 1.337 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.853 19.901 2.246 1.00 0.00 H new ATOM 0 HD3 LYS A 130 8.955 19.943 0.497 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.065 18.169 0.496 1.00 0.00 H new ATOM 0 HE3 LYS A 130 6.867 18.527 2.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.336 19.769 0.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.417 20.823 1.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.609 20.476 -0.014 1.00 0.00 H new ATOM 2099 N GLU A 131 11.989 17.741 0.022 1.00 0.00 N ATOM 2100 CA GLU A 131 12.240 18.090 -1.425 1.00 0.00 C ATOM 2101 C GLU A 131 11.338 17.409 -2.410 1.00 0.00 C ATOM 2102 O GLU A 131 10.526 16.549 -1.998 1.00 0.00 O ATOM 2103 CB GLU A 131 13.771 18.129 -1.476 1.00 0.00 C ATOM 2104 CG GLU A 131 14.711 18.994 -2.357 1.00 0.00 C ATOM 2105 CD GLU A 131 13.960 20.048 -3.198 1.00 0.00 C ATOM 2106 OE1 GLU A 131 13.218 20.969 -2.655 1.00 0.00 O ATOM 2107 OE2 GLU A 131 14.054 20.037 -4.498 1.00 0.00 O ATOM 2108 OXT GLU A 131 12.590 17.672 -3.238 1.00 0.00 O ATOM 0 H GLU A 131 11.563 16.828 0.184 1.00 0.00 H new ATOM 0 HA GLU A 131 11.904 19.050 -1.815 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.076 18.346 -0.452 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.066 17.101 -1.685 1.00 0.00 H new ATOM 0 HG2 GLU A 131 15.435 19.498 -1.717 1.00 0.00 H new ATOM 0 HG3 GLU A 131 15.275 18.342 -3.024 1.00 0.00 H new