USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 903 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 76 SER OG : rot 83:sc= -0.324 USER MOD Set 1.2: A 78 TYR OH : rot -140:sc= -2.18 USER MOD Set 2.1: A 28 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 41 GLN : amide:sc= -0.397 X(o=-0.4,f=0) USER MOD Set 3.1: A 4 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 8 THR OG1 : rot 85:sc= 0.594 USER MOD Single : A 3 GLN : amide:sc= -0.406 K(o=-0.41,f=-3.6!) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.537 X(o=-0.54,f=-0.15) USER MOD Single : A 13 THR OG1 : rot -64:sc= 0.769 USER MOD Single : A 17 THR OG1 : rot -51:sc= 0.533 USER MOD Single : A 18 GLN : amide:sc= -0.304 X(o=-0.3,f=-0.36) USER MOD Single : A 27 ASN : amide:sc= -0.366 K(o=-0.37,f=-2.2!) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 125:sc= -3.29! USER MOD Single : A 38 THR OG1 : rot 77:sc= -0.462! USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.661 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.401 K(o=-0.4,f=-3.6!) USER MOD Single : A 51 ASN : amide:sc= -0.194 X(o=-0.19,f=0) USER MOD Single : A 58 SER OG : rot 92:sc= -0.265! USER MOD Single : A 66 HIS : no HE2:sc= -3.22! C(o=-3.2!,f=-7.2!) USER MOD Single : A 67 TYR OH : rot 30:sc= -0.226 USER MOD Single : A 69 THR OG1 : rot 127:sc= 0.349 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= -0.392 USER MOD Single : A 88 THR OG1 : rot -62:sc= -0.956 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= -1.18 USER MOD Single : A 92 SER OG : rot 70:sc= 0.813 USER MOD Single : A 93 LYS NZ :NH3+ -106:sc= -0.305 (180deg=-1.18!) USER MOD Single : A 94 SER OG : rot 180:sc= -0.546 USER MOD Single : A 100 TYR OH : rot 180:sc= -0.525 USER MOD Single : A 101 ASN :FLIP amide:sc= -0.038 F(o=-1,f=-0.038) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 14 N TRP A 2 11.311 7.665 -1.138 1.00 0.00 N ATOM 15 CA TRP A 2 10.507 6.433 -1.380 1.00 0.00 C ATOM 16 C TRP A 2 10.290 6.260 -2.884 1.00 0.00 C ATOM 17 O TRP A 2 10.015 5.178 -3.362 1.00 0.00 O ATOM 18 CB TRP A 2 9.150 6.562 -0.683 1.00 0.00 C ATOM 19 CG TRP A 2 8.785 5.259 -0.045 1.00 0.00 C ATOM 20 CD1 TRP A 2 9.082 4.036 -0.542 1.00 0.00 C ATOM 21 CD2 TRP A 2 8.061 5.030 1.198 1.00 0.00 C ATOM 22 NE1 TRP A 2 8.589 3.071 0.321 1.00 0.00 N ATOM 23 CE2 TRP A 2 7.951 3.635 1.409 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.497 5.893 2.155 1.00 0.00 C ATOM 25 CZ2 TRP A 2 7.302 3.114 2.531 1.00 0.00 C ATOM 26 CZ3 TRP A 2 6.844 5.372 3.284 1.00 0.00 C ATOM 27 CH2 TRP A 2 6.748 3.985 3.471 1.00 0.00 C ATOM 0 HA TRP A 2 11.038 5.568 -0.983 1.00 0.00 H new ATOM 0 HB2 TRP A 2 9.191 7.348 0.071 1.00 0.00 H new ATOM 0 HB3 TRP A 2 8.386 6.851 -1.404 1.00 0.00 H new ATOM 0 HD1 TRP A 2 9.616 3.844 -1.461 1.00 0.00 H new ATOM 0 HE1 TRP A 2 8.685 2.067 0.171 1.00 0.00 H new ATOM 0 HE3 TRP A 2 7.567 6.962 2.021 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 7.229 2.045 2.670 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 6.413 6.043 4.012 1.00 0.00 H new ATOM 0 HH2 TRP A 2 6.246 3.591 4.342 1.00 0.00 H new ATOM 38 N GLN A 3 10.411 7.321 -3.633 1.00 0.00 N ATOM 39 CA GLN A 3 10.211 7.223 -5.107 1.00 0.00 C ATOM 40 C GLN A 3 11.278 6.310 -5.714 1.00 0.00 C ATOM 41 O GLN A 3 10.976 5.387 -6.445 1.00 0.00 O ATOM 42 CB GLN A 3 10.315 8.616 -5.728 1.00 0.00 C ATOM 43 CG GLN A 3 9.989 8.534 -7.220 1.00 0.00 C ATOM 44 CD GLN A 3 11.144 9.130 -8.028 1.00 0.00 C ATOM 45 OE1 GLN A 3 12.068 9.684 -7.468 1.00 0.00 O ATOM 46 NE2 GLN A 3 11.126 9.042 -9.329 1.00 0.00 N ATOM 0 H GLN A 3 10.640 8.253 -3.288 1.00 0.00 H new ATOM 0 HA GLN A 3 9.225 6.806 -5.311 1.00 0.00 H new ATOM 0 HB2 GLN A 3 9.627 9.300 -5.231 1.00 0.00 H new ATOM 0 HB3 GLN A 3 11.319 9.015 -5.586 1.00 0.00 H new ATOM 0 HG2 GLN A 3 9.825 7.496 -7.511 1.00 0.00 H new ATOM 0 HG3 GLN A 3 9.066 9.074 -7.432 1.00 0.00 H new ATOM 0 HE21 GLN A 3 10.349 8.576 -9.798 1.00 0.00 H new ATOM 0 HE22 GLN A 3 11.889 9.439 -9.878 1.00 0.00 H new ATOM 55 N THR A 4 12.526 6.557 -5.419 1.00 0.00 N ATOM 56 CA THR A 4 13.607 5.698 -5.979 1.00 0.00 C ATOM 57 C THR A 4 13.313 4.235 -5.643 1.00 0.00 C ATOM 58 O THR A 4 13.494 3.354 -6.461 1.00 0.00 O ATOM 59 CB THR A 4 14.956 6.107 -5.374 1.00 0.00 C ATOM 60 OG1 THR A 4 15.855 5.008 -5.440 1.00 0.00 O ATOM 61 CG2 THR A 4 14.763 6.523 -3.914 1.00 0.00 C ATOM 0 H THR A 4 12.843 7.316 -4.815 1.00 0.00 H new ATOM 0 HA THR A 4 13.649 5.822 -7.061 1.00 0.00 H new ATOM 0 HB THR A 4 15.364 6.947 -5.936 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.718 5.268 -5.055 1.00 0.00 H new ATOM 0 HG21 THR A 4 15.724 6.813 -3.488 1.00 0.00 H new ATOM 0 HG22 THR A 4 14.075 7.367 -3.864 1.00 0.00 H new ATOM 0 HG23 THR A 4 14.353 5.686 -3.348 1.00 0.00 H new ATOM 69 N TYR A 5 12.847 3.965 -4.452 1.00 0.00 N ATOM 70 CA TYR A 5 12.532 2.556 -4.086 1.00 0.00 C ATOM 71 C TYR A 5 11.435 2.049 -5.019 1.00 0.00 C ATOM 72 O TYR A 5 11.393 0.890 -5.383 1.00 0.00 O ATOM 73 CB TYR A 5 12.031 2.495 -2.639 1.00 0.00 C ATOM 74 CG TYR A 5 13.133 2.885 -1.680 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.475 2.840 -2.081 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.807 3.289 -0.379 1.00 0.00 C ATOM 77 CE1 TYR A 5 15.487 3.198 -1.181 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.818 3.647 0.519 1.00 0.00 C ATOM 79 CZ TYR A 5 15.158 3.602 0.119 1.00 0.00 C ATOM 80 OH TYR A 5 16.155 3.955 1.004 1.00 0.00 O ATOM 0 H TYR A 5 12.672 4.656 -3.722 1.00 0.00 H new ATOM 0 HA TYR A 5 13.426 1.940 -4.180 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.179 3.163 -2.514 1.00 0.00 H new ATOM 0 HB3 TYR A 5 11.682 1.488 -2.411 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.729 2.529 -3.084 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.773 3.324 -0.069 1.00 0.00 H new ATOM 0 HE1 TYR A 5 16.521 3.162 -1.490 1.00 0.00 H new ATOM 0 HE2 TYR A 5 13.564 3.958 1.522 1.00 0.00 H new ATOM 0 HH TYR A 5 15.756 4.211 1.862 1.00 0.00 H new ATOM 90 N VAL A 6 10.549 2.919 -5.411 1.00 0.00 N ATOM 91 CA VAL A 6 9.450 2.513 -6.327 1.00 0.00 C ATOM 92 C VAL A 6 10.057 2.035 -7.655 1.00 0.00 C ATOM 93 O VAL A 6 9.821 0.927 -8.094 1.00 0.00 O ATOM 94 CB VAL A 6 8.511 3.725 -6.535 1.00 0.00 C ATOM 95 CG1 VAL A 6 8.089 3.875 -8.004 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.258 3.533 -5.680 1.00 0.00 C ATOM 0 H VAL A 6 10.539 3.901 -5.134 1.00 0.00 H new ATOM 0 HA VAL A 6 8.869 1.692 -5.905 1.00 0.00 H new ATOM 0 HB VAL A 6 9.052 4.625 -6.243 1.00 0.00 H new ATOM 0 HG11 VAL A 6 7.430 4.737 -8.107 1.00 0.00 H new ATOM 0 HG12 VAL A 6 8.974 4.018 -8.624 1.00 0.00 H new ATOM 0 HG13 VAL A 6 7.563 2.976 -8.325 1.00 0.00 H new ATOM 0 HG21 VAL A 6 6.589 4.382 -5.819 1.00 0.00 H new ATOM 0 HG22 VAL A 6 6.749 2.617 -5.981 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.541 3.463 -4.630 1.00 0.00 H new ATOM 106 N ASP A 7 10.829 2.863 -8.300 1.00 0.00 N ATOM 107 CA ASP A 7 11.441 2.457 -9.597 1.00 0.00 C ATOM 108 C ASP A 7 12.818 1.831 -9.362 1.00 0.00 C ATOM 109 O ASP A 7 13.788 2.213 -9.986 1.00 0.00 O ATOM 110 CB ASP A 7 11.590 3.693 -10.486 1.00 0.00 C ATOM 111 CG ASP A 7 10.205 4.255 -10.818 1.00 0.00 C ATOM 112 OD1 ASP A 7 9.420 3.532 -11.407 1.00 0.00 O ATOM 113 OD2 ASP A 7 9.953 5.398 -10.474 1.00 0.00 O ATOM 0 H ASP A 7 11.064 3.805 -7.986 1.00 0.00 H new ATOM 0 HA ASP A 7 10.799 1.722 -10.082 1.00 0.00 H new ATOM 0 HB2 ASP A 7 12.188 4.449 -9.978 1.00 0.00 H new ATOM 0 HB3 ASP A 7 12.118 3.432 -11.403 1.00 0.00 H new ATOM 118 N THR A 8 12.927 0.879 -8.474 1.00 0.00 N ATOM 119 CA THR A 8 14.263 0.265 -8.233 1.00 0.00 C ATOM 120 C THR A 8 14.116 -1.149 -7.652 1.00 0.00 C ATOM 121 O THR A 8 13.888 -2.102 -8.371 1.00 0.00 O ATOM 122 CB THR A 8 15.054 1.145 -7.262 1.00 0.00 C ATOM 123 OG1 THR A 8 15.290 2.414 -7.858 1.00 0.00 O ATOM 124 CG2 THR A 8 16.388 0.475 -6.934 1.00 0.00 C ATOM 0 H THR A 8 12.161 0.505 -7.913 1.00 0.00 H new ATOM 0 HA THR A 8 14.794 0.191 -9.182 1.00 0.00 H new ATOM 0 HB THR A 8 14.482 1.277 -6.343 1.00 0.00 H new ATOM 0 HG1 THR A 8 14.515 2.995 -7.709 1.00 0.00 H new ATOM 0 HG21 THR A 8 16.950 1.103 -6.243 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.204 -0.496 -6.475 1.00 0.00 H new ATOM 0 HG23 THR A 8 16.962 0.340 -7.850 1.00 0.00 H new ATOM 132 N ASN A 9 14.277 -1.299 -6.363 1.00 0.00 N ATOM 133 CA ASN A 9 14.182 -2.657 -5.748 1.00 0.00 C ATOM 134 C ASN A 9 12.824 -2.861 -5.071 1.00 0.00 C ATOM 135 O ASN A 9 12.120 -3.802 -5.358 1.00 0.00 O ATOM 136 CB ASN A 9 15.289 -2.814 -4.703 1.00 0.00 C ATOM 137 CG ASN A 9 15.904 -4.210 -4.819 1.00 0.00 C ATOM 138 OD1 ASN A 9 16.088 -4.891 -3.829 1.00 0.00 O ATOM 139 ND2 ASN A 9 16.230 -4.669 -5.996 1.00 0.00 N ATOM 0 H ASN A 9 14.470 -0.540 -5.709 1.00 0.00 H new ATOM 0 HA ASN A 9 14.293 -3.401 -6.537 1.00 0.00 H new ATOM 0 HB2 ASN A 9 16.055 -2.054 -4.852 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.883 -2.665 -3.702 1.00 0.00 H new ATOM 0 HD21 ASN A 9 16.639 -5.599 -6.085 1.00 0.00 H new ATOM 0 HD22 ASN A 9 16.076 -4.098 -6.827 1.00 0.00 H new ATOM 146 N LEU A 10 12.467 -2.007 -4.152 1.00 0.00 N ATOM 147 CA LEU A 10 11.170 -2.172 -3.430 1.00 0.00 C ATOM 148 C LEU A 10 10.070 -2.668 -4.375 1.00 0.00 C ATOM 149 O LEU A 10 9.157 -3.355 -3.961 1.00 0.00 O ATOM 150 CB LEU A 10 10.750 -0.833 -2.820 1.00 0.00 C ATOM 151 CG LEU A 10 11.123 -0.804 -1.334 1.00 0.00 C ATOM 152 CD1 LEU A 10 10.560 0.464 -0.688 1.00 0.00 C ATOM 153 CD2 LEU A 10 10.531 -2.029 -0.633 1.00 0.00 C ATOM 0 H LEU A 10 13.019 -1.198 -3.868 1.00 0.00 H new ATOM 0 HA LEU A 10 11.309 -2.914 -2.644 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.241 -0.013 -3.344 1.00 0.00 H new ATOM 0 HB3 LEU A 10 9.676 -0.689 -2.938 1.00 0.00 H new ATOM 0 HG LEU A 10 12.209 -0.814 -1.237 1.00 0.00 H new ATOM 0 HD11 LEU A 10 10.826 0.483 0.369 1.00 0.00 H new ATOM 0 HD12 LEU A 10 10.977 1.341 -1.183 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.475 0.473 -0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 10 10.797 -2.007 0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 10 9.446 -2.017 -0.734 1.00 0.00 H new ATOM 0 HD23 LEU A 10 10.928 -2.936 -1.089 1.00 0.00 H new ATOM 165 N VAL A 11 10.133 -2.329 -5.635 1.00 0.00 N ATOM 166 CA VAL A 11 9.070 -2.798 -6.571 1.00 0.00 C ATOM 167 C VAL A 11 9.576 -3.988 -7.385 1.00 0.00 C ATOM 168 O VAL A 11 8.929 -5.015 -7.443 1.00 0.00 O ATOM 169 CB VAL A 11 8.661 -1.655 -7.506 1.00 0.00 C ATOM 170 CG1 VAL A 11 7.794 -2.191 -8.653 1.00 0.00 C ATOM 171 CG2 VAL A 11 7.852 -0.627 -6.713 1.00 0.00 C ATOM 0 H VAL A 11 10.865 -1.755 -6.053 1.00 0.00 H new ATOM 0 HA VAL A 11 8.201 -3.113 -5.994 1.00 0.00 H new ATOM 0 HB VAL A 11 9.559 -1.196 -7.920 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.510 -1.369 -9.310 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.358 -2.931 -9.221 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.896 -2.655 -8.244 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.557 0.190 -7.371 1.00 0.00 H new ATOM 0 HG22 VAL A 11 6.961 -1.103 -6.303 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.461 -0.235 -5.898 1.00 0.00 H new ATOM 181 N GLY A 12 10.715 -3.863 -8.021 1.00 0.00 N ATOM 182 CA GLY A 12 11.246 -5.002 -8.833 1.00 0.00 C ATOM 183 C GLY A 12 10.989 -6.302 -8.075 1.00 0.00 C ATOM 184 O GLY A 12 10.569 -7.296 -8.633 1.00 0.00 O ATOM 0 H GLY A 12 11.298 -3.026 -8.013 1.00 0.00 H new ATOM 0 HA2 GLY A 12 10.760 -5.030 -9.808 1.00 0.00 H new ATOM 0 HA3 GLY A 12 12.313 -4.873 -9.012 1.00 0.00 H new ATOM 188 N THR A 13 11.215 -6.279 -6.794 1.00 0.00 N ATOM 189 CA THR A 13 10.966 -7.477 -5.952 1.00 0.00 C ATOM 190 C THR A 13 11.729 -7.339 -4.641 1.00 0.00 C ATOM 191 O THR A 13 12.313 -8.277 -4.139 1.00 0.00 O ATOM 192 CB THR A 13 11.398 -8.750 -6.674 1.00 0.00 C ATOM 193 OG1 THR A 13 11.689 -9.769 -5.726 1.00 0.00 O ATOM 194 CG2 THR A 13 12.635 -8.474 -7.533 1.00 0.00 C ATOM 0 H THR A 13 11.568 -5.467 -6.287 1.00 0.00 H new ATOM 0 HA THR A 13 9.897 -7.548 -5.751 1.00 0.00 H new ATOM 0 HB THR A 13 10.585 -9.082 -7.319 1.00 0.00 H new ATOM 0 HG1 THR A 13 12.457 -9.498 -5.180 1.00 0.00 H new ATOM 0 HG21 THR A 13 12.935 -9.389 -8.044 1.00 0.00 H new ATOM 0 HG22 THR A 13 12.402 -7.706 -8.271 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.450 -8.130 -6.897 1.00 0.00 H new ATOM 202 N GLY A 14 11.691 -6.182 -4.051 1.00 0.00 N ATOM 203 CA GLY A 14 12.371 -6.006 -2.744 1.00 0.00 C ATOM 204 C GLY A 14 11.393 -6.447 -1.654 1.00 0.00 C ATOM 205 O GLY A 14 11.570 -6.156 -0.488 1.00 0.00 O ATOM 0 H GLY A 14 11.221 -5.354 -4.415 1.00 0.00 H new ATOM 0 HA2 GLY A 14 13.284 -6.600 -2.704 1.00 0.00 H new ATOM 0 HA3 GLY A 14 12.662 -4.965 -2.600 1.00 0.00 H new ATOM 209 N ALA A 15 10.350 -7.145 -2.044 1.00 0.00 N ATOM 210 CA ALA A 15 9.327 -7.612 -1.069 1.00 0.00 C ATOM 211 C ALA A 15 8.026 -7.819 -1.839 1.00 0.00 C ATOM 212 O ALA A 15 7.196 -8.635 -1.490 1.00 0.00 O ATOM 213 CB ALA A 15 9.116 -6.557 0.021 1.00 0.00 C ATOM 0 H ALA A 15 10.168 -7.411 -3.012 1.00 0.00 H new ATOM 0 HA ALA A 15 9.650 -8.537 -0.591 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.365 -6.910 0.728 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.056 -6.383 0.545 1.00 0.00 H new ATOM 0 HB3 ALA A 15 8.777 -5.627 -0.434 1.00 0.00 H new ATOM 219 N VAL A 16 7.862 -7.082 -2.905 1.00 0.00 N ATOM 220 CA VAL A 16 6.641 -7.217 -3.740 1.00 0.00 C ATOM 221 C VAL A 16 7.058 -7.137 -5.208 1.00 0.00 C ATOM 222 O VAL A 16 8.072 -6.555 -5.537 1.00 0.00 O ATOM 223 CB VAL A 16 5.672 -6.078 -3.420 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.005 -6.337 -2.069 1.00 0.00 C ATOM 225 CG2 VAL A 16 6.437 -4.754 -3.367 1.00 0.00 C ATOM 0 H VAL A 16 8.531 -6.386 -3.233 1.00 0.00 H new ATOM 0 HA VAL A 16 6.147 -8.167 -3.537 1.00 0.00 H new ATOM 0 HB VAL A 16 4.909 -6.024 -4.196 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.315 -5.524 -1.842 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.457 -7.278 -2.108 1.00 0.00 H new ATOM 0 HG13 VAL A 16 5.767 -6.393 -1.292 1.00 0.00 H new ATOM 0 HG21 VAL A 16 5.745 -3.943 -3.139 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.202 -4.807 -2.593 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.909 -4.568 -4.332 1.00 0.00 H new ATOM 235 N THR A 17 6.289 -7.698 -6.099 1.00 0.00 N ATOM 236 CA THR A 17 6.663 -7.625 -7.540 1.00 0.00 C ATOM 237 C THR A 17 6.100 -6.334 -8.132 1.00 0.00 C ATOM 238 O THR A 17 5.923 -6.207 -9.327 1.00 0.00 O ATOM 239 CB THR A 17 6.099 -8.836 -8.288 1.00 0.00 C ATOM 240 OG1 THR A 17 6.631 -8.864 -9.604 1.00 0.00 O ATOM 241 CG2 THR A 17 4.575 -8.739 -8.355 1.00 0.00 C ATOM 0 H THR A 17 5.425 -8.200 -5.895 1.00 0.00 H new ATOM 0 HA THR A 17 7.748 -7.631 -7.640 1.00 0.00 H new ATOM 0 HB THR A 17 6.377 -9.749 -7.761 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.511 -7.987 -10.024 1.00 0.00 H new ATOM 0 HG21 THR A 17 4.179 -9.603 -8.888 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.167 -8.718 -7.344 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.291 -7.827 -8.880 1.00 0.00 H new ATOM 249 N GLN A 18 5.822 -5.374 -7.295 1.00 0.00 N ATOM 250 CA GLN A 18 5.276 -4.080 -7.782 1.00 0.00 C ATOM 251 C GLN A 18 5.087 -3.144 -6.590 1.00 0.00 C ATOM 252 O GLN A 18 5.416 -3.479 -5.469 1.00 0.00 O ATOM 253 CB GLN A 18 3.925 -4.308 -8.460 1.00 0.00 C ATOM 254 CG GLN A 18 4.032 -3.959 -9.944 1.00 0.00 C ATOM 255 CD GLN A 18 3.586 -5.161 -10.777 1.00 0.00 C ATOM 256 OE1 GLN A 18 2.509 -5.687 -10.576 1.00 0.00 O ATOM 257 NE2 GLN A 18 4.372 -5.623 -11.710 1.00 0.00 N ATOM 0 H GLN A 18 5.952 -5.433 -6.285 1.00 0.00 H new ATOM 0 HA GLN A 18 5.968 -3.640 -8.500 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.618 -5.347 -8.341 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.160 -3.693 -7.986 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.411 -3.093 -10.172 1.00 0.00 H new ATOM 0 HG3 GLN A 18 5.058 -3.689 -10.193 1.00 0.00 H new ATOM 0 HE21 GLN A 18 5.276 -5.182 -11.880 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.082 -6.425 -12.270 1.00 0.00 H new ATOM 266 N ALA A 19 4.554 -1.978 -6.818 1.00 0.00 N ATOM 267 CA ALA A 19 4.339 -1.029 -5.687 1.00 0.00 C ATOM 268 C ALA A 19 3.816 0.291 -6.236 1.00 0.00 C ATOM 269 O ALA A 19 4.044 0.625 -7.378 1.00 0.00 O ATOM 270 CB ALA A 19 5.662 -0.791 -4.957 1.00 0.00 C ATOM 0 H ALA A 19 4.258 -1.640 -7.734 1.00 0.00 H new ATOM 0 HA ALA A 19 3.615 -1.450 -4.989 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.502 -0.098 -4.131 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.039 -1.737 -4.568 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.389 -0.368 -5.650 1.00 0.00 H new ATOM 276 N ALA A 20 3.109 1.043 -5.440 1.00 0.00 N ATOM 277 CA ALA A 20 2.576 2.336 -5.937 1.00 0.00 C ATOM 278 C ALA A 20 2.508 3.341 -4.787 1.00 0.00 C ATOM 279 O ALA A 20 2.081 3.026 -3.692 1.00 0.00 O ATOM 280 CB ALA A 20 1.173 2.120 -6.510 1.00 0.00 C ATOM 0 H ALA A 20 2.879 0.818 -4.472 1.00 0.00 H new ATOM 0 HA ALA A 20 3.233 2.724 -6.715 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.779 3.068 -6.876 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.222 1.406 -7.332 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.518 1.731 -5.731 1.00 0.00 H new ATOM 286 N ILE A 21 2.909 4.555 -5.031 1.00 0.00 N ATOM 287 CA ILE A 21 2.842 5.589 -3.964 1.00 0.00 C ATOM 288 C ILE A 21 1.692 6.530 -4.312 1.00 0.00 C ATOM 289 O ILE A 21 1.804 7.374 -5.180 1.00 0.00 O ATOM 290 CB ILE A 21 4.162 6.363 -3.891 1.00 0.00 C ATOM 291 CG1 ILE A 21 5.322 5.362 -3.723 1.00 0.00 C ATOM 292 CG2 ILE A 21 4.108 7.328 -2.699 1.00 0.00 C ATOM 293 CD1 ILE A 21 6.455 5.968 -2.880 1.00 0.00 C ATOM 0 H ILE A 21 3.281 4.877 -5.925 1.00 0.00 H new ATOM 0 HA ILE A 21 2.676 5.127 -2.991 1.00 0.00 H new ATOM 0 HB ILE A 21 4.319 6.936 -4.805 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.956 4.452 -3.247 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.705 5.077 -4.703 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.044 7.884 -2.638 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.280 8.024 -2.832 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.962 6.762 -1.779 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.261 5.241 -2.777 1.00 0.00 H new ATOM 0 HD12 ILE A 21 6.835 6.864 -3.371 1.00 0.00 H new ATOM 0 HD13 ILE A 21 6.074 6.230 -1.893 1.00 0.00 H new ATOM 305 N LEU A 22 0.573 6.367 -3.664 1.00 0.00 N ATOM 306 CA LEU A 22 -0.608 7.218 -3.977 1.00 0.00 C ATOM 307 C LEU A 22 -0.534 8.538 -3.197 1.00 0.00 C ATOM 308 O LEU A 22 -1.532 9.196 -2.977 1.00 0.00 O ATOM 309 CB LEU A 22 -1.886 6.454 -3.606 1.00 0.00 C ATOM 310 CG LEU A 22 -1.665 4.943 -3.797 1.00 0.00 C ATOM 311 CD1 LEU A 22 -2.997 4.202 -3.668 1.00 0.00 C ATOM 312 CD2 LEU A 22 -1.079 4.660 -5.187 1.00 0.00 C ATOM 0 H LEU A 22 0.425 5.677 -2.927 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.617 7.450 -5.042 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.158 6.663 -2.571 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.715 6.791 -4.228 1.00 0.00 H new ATOM 0 HG LEU A 22 -0.970 4.599 -3.031 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.833 3.133 -3.804 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.419 4.381 -2.679 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.689 4.563 -4.429 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.928 3.587 -5.307 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.768 5.017 -5.952 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.124 5.174 -5.291 1.00 0.00 H new ATOM 324 N GLY A 23 0.643 8.935 -2.790 1.00 0.00 N ATOM 325 CA GLY A 23 0.785 10.215 -2.039 1.00 0.00 C ATOM 326 C GLY A 23 -0.264 10.284 -0.933 1.00 0.00 C ATOM 327 O GLY A 23 -0.869 9.295 -0.576 1.00 0.00 O ATOM 0 H GLY A 23 1.513 8.426 -2.946 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.784 10.287 -1.610 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.668 11.060 -2.717 1.00 0.00 H new ATOM 331 N LEU A 24 -0.485 11.449 -0.389 1.00 0.00 N ATOM 332 CA LEU A 24 -1.498 11.585 0.692 1.00 0.00 C ATOM 333 C LEU A 24 -2.805 12.101 0.091 1.00 0.00 C ATOM 334 O LEU A 24 -3.758 11.364 -0.072 1.00 0.00 O ATOM 335 CB LEU A 24 -0.984 12.566 1.751 1.00 0.00 C ATOM 336 CG LEU A 24 0.418 12.141 2.196 1.00 0.00 C ATOM 337 CD1 LEU A 24 1.344 13.356 2.224 1.00 0.00 C ATOM 338 CD2 LEU A 24 0.352 11.531 3.597 1.00 0.00 C ATOM 0 H LEU A 24 -0.007 12.312 -0.647 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.674 10.617 1.160 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.958 13.577 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -1.660 12.583 2.606 1.00 0.00 H new ATOM 0 HG LEU A 24 0.804 11.404 1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 24 2.340 13.047 2.541 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.400 13.794 1.227 1.00 0.00 H new ATOM 0 HD13 LEU A 24 0.953 14.095 2.923 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.352 11.230 3.910 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.041 12.269 4.297 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.302 10.659 3.584 1.00 0.00 H new ATOM 350 N ASP A 25 -2.855 13.357 -0.249 1.00 0.00 N ATOM 351 CA ASP A 25 -4.095 13.918 -0.849 1.00 0.00 C ATOM 352 C ASP A 25 -3.714 14.785 -2.049 1.00 0.00 C ATOM 353 O ASP A 25 -4.453 15.655 -2.464 1.00 0.00 O ATOM 354 CB ASP A 25 -4.827 14.768 0.191 1.00 0.00 C ATOM 355 CG ASP A 25 -5.622 13.853 1.122 1.00 0.00 C ATOM 356 OD1 ASP A 25 -6.020 12.789 0.676 1.00 0.00 O ATOM 357 OD2 ASP A 25 -5.818 14.229 2.265 1.00 0.00 O ATOM 0 H ASP A 25 -2.089 14.021 -0.137 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.750 13.109 -1.172 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.112 15.357 0.765 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -5.496 15.472 -0.304 1.00 0.00 H new ATOM 362 N GLY A 26 -2.556 14.551 -2.604 1.00 0.00 N ATOM 363 CA GLY A 26 -2.113 15.360 -3.776 1.00 0.00 C ATOM 364 C GLY A 26 -2.031 14.471 -5.019 1.00 0.00 C ATOM 365 O GLY A 26 -0.964 14.208 -5.537 1.00 0.00 O ATOM 0 H GLY A 26 -1.898 13.835 -2.297 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -2.811 16.179 -3.949 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -1.140 15.808 -3.573 1.00 0.00 H new ATOM 369 N ASN A 27 -3.151 14.008 -5.501 1.00 0.00 N ATOM 370 CA ASN A 27 -3.141 13.138 -6.711 1.00 0.00 C ATOM 371 C ASN A 27 -2.100 12.030 -6.542 1.00 0.00 C ATOM 372 O ASN A 27 -1.818 11.593 -5.444 1.00 0.00 O ATOM 373 CB ASN A 27 -2.799 13.980 -7.942 1.00 0.00 C ATOM 374 CG ASN A 27 -3.741 13.606 -9.088 1.00 0.00 C ATOM 375 OD1 ASN A 27 -4.873 13.233 -8.859 1.00 0.00 O ATOM 376 ND2 ASN A 27 -3.319 13.691 -10.320 1.00 0.00 N ATOM 0 H ASN A 27 -4.074 14.195 -5.109 1.00 0.00 H new ATOM 0 HA ASN A 27 -4.126 12.688 -6.840 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -2.894 15.041 -7.709 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -1.764 13.810 -8.237 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -3.940 13.444 -11.090 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -2.368 14.004 -10.513 1.00 0.00 H new ATOM 383 N THR A 28 -1.529 11.568 -7.621 1.00 0.00 N ATOM 384 CA THR A 28 -0.511 10.485 -7.519 1.00 0.00 C ATOM 385 C THR A 28 0.891 11.095 -7.460 1.00 0.00 C ATOM 386 O THR A 28 1.202 12.034 -8.165 1.00 0.00 O ATOM 387 CB THR A 28 -0.616 9.572 -8.744 1.00 0.00 C ATOM 388 OG1 THR A 28 -1.884 8.930 -8.747 1.00 0.00 O ATOM 389 CG2 THR A 28 0.492 8.518 -8.693 1.00 0.00 C ATOM 0 H THR A 28 -1.724 11.894 -8.568 1.00 0.00 H new ATOM 0 HA THR A 28 -0.691 9.907 -6.613 1.00 0.00 H new ATOM 0 HB THR A 28 -0.507 10.166 -9.651 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.953 8.346 -9.531 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.417 7.868 -9.565 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.464 9.012 -8.691 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.386 7.922 -7.787 1.00 0.00 H new ATOM 397 N TRP A 29 1.742 10.557 -6.630 1.00 0.00 N ATOM 398 CA TRP A 29 3.128 11.089 -6.526 1.00 0.00 C ATOM 399 C TRP A 29 4.045 10.237 -7.403 1.00 0.00 C ATOM 400 O TRP A 29 4.590 10.696 -8.387 1.00 0.00 O ATOM 401 CB TRP A 29 3.598 11.008 -5.072 1.00 0.00 C ATOM 402 CG TRP A 29 3.019 12.141 -4.290 1.00 0.00 C ATOM 403 CD1 TRP A 29 1.807 12.698 -4.509 1.00 0.00 C ATOM 404 CD2 TRP A 29 3.604 12.862 -3.167 1.00 0.00 C ATOM 405 NE1 TRP A 29 1.609 13.715 -3.593 1.00 0.00 N ATOM 406 CE2 TRP A 29 2.690 13.855 -2.744 1.00 0.00 C ATOM 407 CE3 TRP A 29 4.827 12.751 -2.480 1.00 0.00 C ATOM 408 CZ2 TRP A 29 2.979 14.709 -1.678 1.00 0.00 C ATOM 409 CZ3 TRP A 29 5.121 13.607 -1.408 1.00 0.00 C ATOM 410 CH2 TRP A 29 4.199 14.584 -1.007 1.00 0.00 C ATOM 0 H TRP A 29 1.535 9.768 -6.017 1.00 0.00 H new ATOM 0 HA TRP A 29 3.154 12.128 -6.855 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.293 10.058 -4.634 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.687 11.043 -5.029 1.00 0.00 H new ATOM 0 HD1 TRP A 29 1.107 12.398 -5.275 1.00 0.00 H new ATOM 0 HE1 TRP A 29 0.768 14.291 -3.550 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.544 12.002 -2.780 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 2.265 15.461 -1.374 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 6.063 13.513 -0.889 1.00 0.00 H new ATOM 0 HH2 TRP A 29 4.431 15.239 -0.181 1.00 0.00 H new ATOM 421 N ALA A 30 4.205 8.991 -7.053 1.00 0.00 N ATOM 422 CA ALA A 30 5.071 8.086 -7.860 1.00 0.00 C ATOM 423 C ALA A 30 4.370 6.735 -7.997 1.00 0.00 C ATOM 424 O ALA A 30 3.486 6.411 -7.230 1.00 0.00 O ATOM 425 CB ALA A 30 6.415 7.897 -7.154 1.00 0.00 C ATOM 0 H ALA A 30 3.771 8.558 -6.238 1.00 0.00 H new ATOM 0 HA ALA A 30 5.245 8.518 -8.846 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.047 7.235 -7.746 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.906 8.863 -7.042 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.251 7.458 -6.170 1.00 0.00 H new ATOM 431 N THR A 31 4.744 5.944 -8.966 1.00 0.00 N ATOM 432 CA THR A 31 4.077 4.622 -9.129 1.00 0.00 C ATOM 433 C THR A 31 5.009 3.648 -9.852 1.00 0.00 C ATOM 434 O THR A 31 5.662 3.990 -10.817 1.00 0.00 O ATOM 435 CB THR A 31 2.791 4.793 -9.940 1.00 0.00 C ATOM 436 OG1 THR A 31 3.104 5.358 -11.205 1.00 0.00 O ATOM 437 CG2 THR A 31 1.825 5.714 -9.193 1.00 0.00 C ATOM 0 H THR A 31 5.475 6.154 -9.645 1.00 0.00 H new ATOM 0 HA THR A 31 3.838 4.222 -8.144 1.00 0.00 H new ATOM 0 HB THR A 31 2.321 3.820 -10.080 1.00 0.00 H new ATOM 0 HG1 THR A 31 2.282 5.467 -11.727 1.00 0.00 H new ATOM 0 HG21 THR A 31 0.911 5.832 -9.775 1.00 0.00 H new ATOM 0 HG22 THR A 31 1.584 5.279 -8.223 1.00 0.00 H new ATOM 0 HG23 THR A 31 2.291 6.689 -9.047 1.00 0.00 H new ATOM 445 N SER A 32 5.063 2.429 -9.389 1.00 0.00 N ATOM 446 CA SER A 32 5.936 1.409 -10.035 1.00 0.00 C ATOM 447 C SER A 32 5.059 0.391 -10.765 1.00 0.00 C ATOM 448 O SER A 32 4.288 -0.326 -10.151 1.00 0.00 O ATOM 449 CB SER A 32 6.757 0.687 -8.970 1.00 0.00 C ATOM 450 OG SER A 32 8.039 0.369 -9.497 1.00 0.00 O ATOM 0 H SER A 32 4.535 2.094 -8.584 1.00 0.00 H new ATOM 0 HA SER A 32 6.607 1.899 -10.741 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.861 1.317 -8.086 1.00 0.00 H new ATOM 0 HB3 SER A 32 6.245 -0.222 -8.655 1.00 0.00 H new ATOM 0 HG SER A 32 8.734 0.732 -8.909 1.00 0.00 H new ATOM 456 N ALA A 33 5.174 0.330 -12.068 1.00 0.00 N ATOM 457 CA ALA A 33 4.353 -0.631 -12.860 1.00 0.00 C ATOM 458 C ALA A 33 2.969 -0.026 -13.101 1.00 0.00 C ATOM 459 O ALA A 33 2.595 0.955 -12.488 1.00 0.00 O ATOM 460 CB ALA A 33 4.216 -1.953 -12.099 1.00 0.00 C ATOM 0 H ALA A 33 5.807 0.910 -12.619 1.00 0.00 H new ATOM 0 HA ALA A 33 4.840 -0.825 -13.816 1.00 0.00 H new ATOM 0 HB1 ALA A 33 3.615 -2.649 -12.684 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.205 -2.380 -11.930 1.00 0.00 H new ATOM 0 HB3 ALA A 33 3.731 -1.772 -11.140 1.00 0.00 H new ATOM 466 N GLY A 34 2.206 -0.596 -13.992 1.00 0.00 N ATOM 467 CA GLY A 34 0.848 -0.046 -14.272 1.00 0.00 C ATOM 468 C GLY A 34 0.107 0.193 -12.955 1.00 0.00 C ATOM 469 O GLY A 34 0.282 1.207 -12.307 1.00 0.00 O ATOM 0 H GLY A 34 2.463 -1.418 -14.538 1.00 0.00 H new ATOM 0 HA2 GLY A 34 0.931 0.888 -14.828 1.00 0.00 H new ATOM 0 HA3 GLY A 34 0.285 -0.740 -14.896 1.00 0.00 H new ATOM 473 N PHE A 35 -0.718 -0.735 -12.553 1.00 0.00 N ATOM 474 CA PHE A 35 -1.471 -0.568 -11.276 1.00 0.00 C ATOM 475 C PHE A 35 -2.596 0.454 -11.464 1.00 0.00 C ATOM 476 O PHE A 35 -2.442 1.622 -11.166 1.00 0.00 O ATOM 477 CB PHE A 35 -0.519 -0.082 -10.180 1.00 0.00 C ATOM 478 CG PHE A 35 -1.128 -0.359 -8.826 1.00 0.00 C ATOM 479 CD1 PHE A 35 -1.710 -1.606 -8.565 1.00 0.00 C ATOM 480 CD2 PHE A 35 -1.110 0.626 -7.832 1.00 0.00 C ATOM 481 CE1 PHE A 35 -2.275 -1.867 -7.311 1.00 0.00 C ATOM 482 CE2 PHE A 35 -1.675 0.364 -6.577 1.00 0.00 C ATOM 483 CZ PHE A 35 -2.257 -0.882 -6.317 1.00 0.00 C ATOM 0 H PHE A 35 -0.904 -1.604 -13.054 1.00 0.00 H new ATOM 0 HA PHE A 35 -1.902 -1.527 -10.987 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.443 -0.587 -10.268 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.330 0.985 -10.294 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.723 -2.367 -9.332 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.661 1.588 -8.032 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.725 -2.828 -7.111 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -1.661 1.124 -5.810 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.692 -1.083 -5.349 1.00 0.00 H new ATOM 493 N ALA A 36 -3.729 0.021 -11.947 1.00 0.00 N ATOM 494 CA ALA A 36 -4.866 0.965 -12.147 1.00 0.00 C ATOM 495 C ALA A 36 -5.775 0.933 -10.915 1.00 0.00 C ATOM 496 O ALA A 36 -6.515 -0.006 -10.702 1.00 0.00 O ATOM 497 CB ALA A 36 -5.666 0.548 -13.383 1.00 0.00 C ATOM 0 H ALA A 36 -3.917 -0.946 -12.212 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.480 1.974 -12.290 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.497 1.238 -13.529 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.019 0.569 -14.260 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.053 -0.461 -13.242 1.00 0.00 H new ATOM 503 N VAL A 37 -5.722 1.950 -10.102 1.00 0.00 N ATOM 504 CA VAL A 37 -6.579 1.975 -8.884 1.00 0.00 C ATOM 505 C VAL A 37 -7.701 3.004 -9.064 1.00 0.00 C ATOM 506 O VAL A 37 -7.861 3.907 -8.269 1.00 0.00 O ATOM 507 CB VAL A 37 -5.726 2.354 -7.672 1.00 0.00 C ATOM 508 CG1 VAL A 37 -6.599 2.375 -6.416 1.00 0.00 C ATOM 509 CG2 VAL A 37 -4.602 1.326 -7.495 1.00 0.00 C ATOM 0 H VAL A 37 -5.122 2.765 -10.228 1.00 0.00 H new ATOM 0 HA VAL A 37 -7.017 0.989 -8.728 1.00 0.00 H new ATOM 0 HB VAL A 37 -5.294 3.342 -7.830 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.989 2.645 -5.554 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.397 3.107 -6.540 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.033 1.388 -6.258 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.994 1.596 -6.631 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -5.034 0.337 -7.340 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.977 1.312 -8.388 1.00 0.00 H new ATOM 519 N THR A 38 -8.482 2.869 -10.104 1.00 0.00 N ATOM 520 CA THR A 38 -9.597 3.835 -10.339 1.00 0.00 C ATOM 521 C THR A 38 -9.040 5.260 -10.433 1.00 0.00 C ATOM 522 O THR A 38 -7.976 5.544 -9.920 1.00 0.00 O ATOM 523 CB THR A 38 -10.604 3.755 -9.187 1.00 0.00 C ATOM 524 OG1 THR A 38 -10.086 2.926 -8.155 1.00 0.00 O ATOM 525 CG2 THR A 38 -11.918 3.170 -9.702 1.00 0.00 C ATOM 0 H THR A 38 -8.396 2.130 -10.802 1.00 0.00 H new ATOM 0 HA THR A 38 -10.096 3.581 -11.274 1.00 0.00 H new ATOM 0 HB THR A 38 -10.781 4.755 -8.790 1.00 0.00 H new ATOM 0 HG1 THR A 38 -9.408 3.420 -7.648 1.00 0.00 H new ATOM 0 HG21 THR A 38 -12.636 3.112 -8.884 1.00 0.00 H new ATOM 0 HG22 THR A 38 -12.317 3.809 -10.490 1.00 0.00 H new ATOM 0 HG23 THR A 38 -11.740 2.171 -10.100 1.00 0.00 H new ATOM 533 N PRO A 39 -9.783 6.116 -11.092 1.00 0.00 N ATOM 534 CA PRO A 39 -9.388 7.524 -11.275 1.00 0.00 C ATOM 535 C PRO A 39 -9.283 8.224 -9.918 1.00 0.00 C ATOM 536 O PRO A 39 -8.428 9.061 -9.704 1.00 0.00 O ATOM 537 CB PRO A 39 -10.513 8.142 -12.117 1.00 0.00 C ATOM 538 CG PRO A 39 -11.560 7.033 -12.395 1.00 0.00 C ATOM 539 CD PRO A 39 -11.072 5.747 -11.708 1.00 0.00 C ATOM 0 HA PRO A 39 -8.416 7.624 -11.757 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.972 8.977 -11.587 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.117 8.537 -13.053 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -12.537 7.325 -12.011 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -11.674 6.874 -13.467 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -11.785 5.404 -10.958 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -10.950 4.936 -12.426 1.00 0.00 H new ATOM 547 N ALA A 40 -10.148 7.888 -9.002 1.00 0.00 N ATOM 548 CA ALA A 40 -10.106 8.528 -7.656 1.00 0.00 C ATOM 549 C ALA A 40 -9.078 7.801 -6.776 1.00 0.00 C ATOM 550 O ALA A 40 -9.417 7.249 -5.748 1.00 0.00 O ATOM 551 CB ALA A 40 -11.488 8.425 -7.008 1.00 0.00 C ATOM 0 H ALA A 40 -10.886 7.195 -9.128 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.823 9.576 -7.757 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -11.464 8.891 -6.023 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.222 8.934 -7.633 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -11.765 7.376 -6.906 1.00 0.00 H new ATOM 557 N GLN A 41 -7.828 7.781 -7.164 1.00 0.00 N ATOM 558 CA GLN A 41 -6.808 7.076 -6.338 1.00 0.00 C ATOM 559 C GLN A 41 -6.629 7.793 -4.998 1.00 0.00 C ATOM 560 O GLN A 41 -6.614 7.178 -3.950 1.00 0.00 O ATOM 561 CB GLN A 41 -5.471 7.064 -7.084 1.00 0.00 C ATOM 562 CG GLN A 41 -5.198 5.659 -7.619 1.00 0.00 C ATOM 563 CD GLN A 41 -4.202 5.739 -8.779 1.00 0.00 C ATOM 564 OE1 GLN A 41 -4.593 5.783 -9.928 1.00 0.00 O ATOM 565 NE2 GLN A 41 -2.921 5.760 -8.525 1.00 0.00 N ATOM 0 H GLN A 41 -7.473 8.221 -8.013 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.142 6.055 -6.156 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -5.495 7.779 -7.906 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -4.667 7.373 -6.416 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -4.798 5.027 -6.826 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -6.127 5.199 -7.955 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -2.592 5.723 -7.560 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -2.250 5.813 -9.291 1.00 0.00 H new ATOM 574 N GLY A 42 -6.476 9.088 -5.023 1.00 0.00 N ATOM 575 CA GLY A 42 -6.276 9.842 -3.751 1.00 0.00 C ATOM 576 C GLY A 42 -7.601 9.999 -2.998 1.00 0.00 C ATOM 577 O GLY A 42 -7.624 10.095 -1.788 1.00 0.00 O ATOM 0 H GLY A 42 -6.481 9.658 -5.869 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -5.555 9.319 -3.123 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -5.857 10.825 -3.967 1.00 0.00 H new ATOM 581 N GLN A 43 -8.702 10.037 -3.695 1.00 0.00 N ATOM 582 CA GLN A 43 -10.010 10.201 -2.999 1.00 0.00 C ATOM 583 C GLN A 43 -10.484 8.849 -2.458 1.00 0.00 C ATOM 584 O GLN A 43 -10.630 8.662 -1.267 1.00 0.00 O ATOM 585 CB GLN A 43 -11.043 10.749 -3.985 1.00 0.00 C ATOM 586 CG GLN A 43 -10.469 11.979 -4.690 1.00 0.00 C ATOM 587 CD GLN A 43 -11.569 13.024 -4.880 1.00 0.00 C ATOM 588 OE1 GLN A 43 -12.309 12.974 -5.842 1.00 0.00 O ATOM 589 NE2 GLN A 43 -11.707 13.977 -4.000 1.00 0.00 N ATOM 0 H GLN A 43 -8.754 9.962 -4.711 1.00 0.00 H new ATOM 0 HA GLN A 43 -9.892 10.896 -2.168 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -11.304 9.985 -4.717 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.960 11.013 -3.459 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -9.653 12.399 -4.102 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -10.053 11.695 -5.657 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -11.086 14.019 -3.192 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -12.436 14.680 -4.120 1.00 0.00 H new ATOM 598 N THR A 44 -10.730 7.909 -3.325 1.00 0.00 N ATOM 599 CA THR A 44 -11.200 6.569 -2.869 1.00 0.00 C ATOM 600 C THR A 44 -10.349 6.094 -1.688 1.00 0.00 C ATOM 601 O THR A 44 -10.863 5.692 -0.662 1.00 0.00 O ATOM 602 CB THR A 44 -11.074 5.568 -4.022 1.00 0.00 C ATOM 603 OG1 THR A 44 -11.913 5.973 -5.093 1.00 0.00 O ATOM 604 CG2 THR A 44 -11.497 4.177 -3.543 1.00 0.00 C ATOM 0 H THR A 44 -10.626 8.010 -4.335 1.00 0.00 H new ATOM 0 HA THR A 44 -12.241 6.640 -2.555 1.00 0.00 H new ATOM 0 HB THR A 44 -10.039 5.535 -4.361 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.832 5.334 -5.832 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.407 3.466 -4.364 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.854 3.864 -2.720 1.00 0.00 H new ATOM 0 HG23 THR A 44 -12.532 4.209 -3.203 1.00 0.00 H new ATOM 612 N LEU A 45 -9.052 6.130 -1.824 1.00 0.00 N ATOM 613 CA LEU A 45 -8.172 5.672 -0.707 1.00 0.00 C ATOM 614 C LEU A 45 -8.315 6.619 0.485 1.00 0.00 C ATOM 615 O LEU A 45 -8.181 6.221 1.624 1.00 0.00 O ATOM 616 CB LEU A 45 -6.715 5.659 -1.175 1.00 0.00 C ATOM 617 CG LEU A 45 -6.151 4.242 -1.049 1.00 0.00 C ATOM 618 CD1 LEU A 45 -6.186 3.803 0.417 1.00 0.00 C ATOM 619 CD2 LEU A 45 -6.999 3.282 -1.886 1.00 0.00 C ATOM 0 H LEU A 45 -8.562 6.456 -2.658 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.467 4.667 -0.407 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -6.651 5.997 -2.209 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.123 6.352 -0.577 1.00 0.00 H new ATOM 0 HG LEU A 45 -5.121 4.229 -1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.784 2.794 0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.584 4.486 1.016 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -7.215 3.816 0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -6.599 2.272 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -8.028 3.298 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -6.975 3.592 -2.931 1.00 0.00 H new ATOM 631 N ALA A 46 -8.581 7.871 0.233 1.00 0.00 N ATOM 632 CA ALA A 46 -8.729 8.841 1.355 1.00 0.00 C ATOM 633 C ALA A 46 -10.031 8.557 2.105 1.00 0.00 C ATOM 634 O ALA A 46 -10.215 8.975 3.231 1.00 0.00 O ATOM 635 CB ALA A 46 -8.762 10.264 0.793 1.00 0.00 C ATOM 0 H ALA A 46 -8.702 8.264 -0.700 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.887 8.739 2.040 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -8.870 10.976 1.611 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -7.834 10.465 0.257 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.605 10.366 0.110 1.00 0.00 H new ATOM 641 N SER A 47 -10.936 7.848 1.489 1.00 0.00 N ATOM 642 CA SER A 47 -12.227 7.535 2.162 1.00 0.00 C ATOM 643 C SER A 47 -12.005 6.458 3.226 1.00 0.00 C ATOM 644 O SER A 47 -12.376 6.617 4.371 1.00 0.00 O ATOM 645 CB SER A 47 -13.228 7.025 1.125 1.00 0.00 C ATOM 646 OG SER A 47 -14.386 6.537 1.789 1.00 0.00 O ATOM 0 H SER A 47 -10.837 7.471 0.546 1.00 0.00 H new ATOM 0 HA SER A 47 -12.616 8.436 2.636 1.00 0.00 H new ATOM 0 HB2 SER A 47 -13.499 7.828 0.439 1.00 0.00 H new ATOM 0 HB3 SER A 47 -12.777 6.233 0.527 1.00 0.00 H new ATOM 0 HG SER A 47 -15.030 6.211 1.126 1.00 0.00 H new ATOM 652 N ALA A 48 -11.402 5.361 2.857 1.00 0.00 N ATOM 653 CA ALA A 48 -11.159 4.276 3.847 1.00 0.00 C ATOM 654 C ALA A 48 -10.320 4.819 5.006 1.00 0.00 C ATOM 655 O ALA A 48 -10.317 4.275 6.092 1.00 0.00 O ATOM 656 CB ALA A 48 -10.410 3.128 3.170 1.00 0.00 C ATOM 0 H ALA A 48 -11.067 5.170 1.913 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.113 3.913 4.229 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.232 2.333 3.894 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.008 2.740 2.345 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.456 3.491 2.788 1.00 0.00 H new ATOM 662 N PHE A 49 -9.609 5.890 4.784 1.00 0.00 N ATOM 663 CA PHE A 49 -8.770 6.468 5.871 1.00 0.00 C ATOM 664 C PHE A 49 -9.675 6.990 6.990 1.00 0.00 C ATOM 665 O PHE A 49 -9.356 6.889 8.158 1.00 0.00 O ATOM 666 CB PHE A 49 -7.932 7.620 5.311 1.00 0.00 C ATOM 667 CG PHE A 49 -6.656 7.076 4.708 1.00 0.00 C ATOM 668 CD1 PHE A 49 -6.601 5.749 4.262 1.00 0.00 C ATOM 669 CD2 PHE A 49 -5.529 7.898 4.598 1.00 0.00 C ATOM 670 CE1 PHE A 49 -5.419 5.247 3.704 1.00 0.00 C ATOM 671 CE2 PHE A 49 -4.347 7.396 4.042 1.00 0.00 C ATOM 672 CZ PHE A 49 -4.292 6.070 3.595 1.00 0.00 C ATOM 0 H PHE A 49 -9.573 6.390 3.896 1.00 0.00 H new ATOM 0 HA PHE A 49 -8.108 5.698 6.269 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -8.500 8.162 4.555 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -7.697 8.330 6.104 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -7.470 5.114 4.349 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.571 8.921 4.942 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -5.377 4.225 3.358 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.477 8.031 3.958 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.380 5.682 3.166 1.00 0.00 H new ATOM 682 N ASN A 50 -10.800 7.550 6.642 1.00 0.00 N ATOM 683 CA ASN A 50 -11.723 8.078 7.685 1.00 0.00 C ATOM 684 C ASN A 50 -12.671 6.967 8.141 1.00 0.00 C ATOM 685 O ASN A 50 -12.528 6.417 9.215 1.00 0.00 O ATOM 686 CB ASN A 50 -12.535 9.239 7.105 1.00 0.00 C ATOM 687 CG ASN A 50 -11.942 10.564 7.583 1.00 0.00 C ATOM 688 OD1 ASN A 50 -11.135 10.590 8.491 1.00 0.00 O ATOM 689 ND2 ASN A 50 -12.309 11.675 7.005 1.00 0.00 N ATOM 0 H ASN A 50 -11.120 7.665 5.680 1.00 0.00 H new ATOM 0 HA ASN A 50 -11.144 8.430 8.538 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -12.525 9.196 6.016 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -13.576 9.160 7.417 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.918 12.565 7.316 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.986 11.654 6.243 1.00 0.00 H new ATOM 696 N ASN A 51 -13.639 6.630 7.333 1.00 0.00 N ATOM 697 CA ASN A 51 -14.594 5.555 7.720 1.00 0.00 C ATOM 698 C ASN A 51 -13.889 4.196 7.655 1.00 0.00 C ATOM 699 O ASN A 51 -13.425 3.775 6.614 1.00 0.00 O ATOM 700 CB ASN A 51 -15.784 5.557 6.757 1.00 0.00 C ATOM 701 CG ASN A 51 -16.447 6.936 6.762 1.00 0.00 C ATOM 702 OD1 ASN A 51 -16.742 7.485 5.718 1.00 0.00 O ATOM 703 ND2 ASN A 51 -16.698 7.524 7.900 1.00 0.00 N ATOM 0 H ASN A 51 -13.809 7.054 6.421 1.00 0.00 H new ATOM 0 HA ASN A 51 -14.947 5.733 8.736 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -15.450 5.307 5.750 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -16.505 4.795 7.052 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -17.141 8.443 7.913 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -16.451 7.065 8.777 1.00 0.00 H new ATOM 710 N ALA A 52 -13.808 3.503 8.759 1.00 0.00 N ATOM 711 CA ALA A 52 -13.137 2.172 8.759 1.00 0.00 C ATOM 712 C ALA A 52 -14.204 1.074 8.808 1.00 0.00 C ATOM 713 O ALA A 52 -13.927 -0.065 9.131 1.00 0.00 O ATOM 714 CB ALA A 52 -12.226 2.057 9.985 1.00 0.00 C ATOM 0 H ALA A 52 -14.178 3.802 9.661 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.538 2.062 7.855 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -11.736 1.083 9.984 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -11.472 2.843 9.953 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -12.821 2.163 10.892 1.00 0.00 H new ATOM 720 N ASP A 53 -15.422 1.414 8.490 1.00 0.00 N ATOM 721 CA ASP A 53 -16.518 0.405 8.515 1.00 0.00 C ATOM 722 C ASP A 53 -16.433 -0.507 7.283 1.00 0.00 C ATOM 723 O ASP A 53 -16.478 -1.714 7.410 1.00 0.00 O ATOM 724 CB ASP A 53 -17.869 1.129 8.517 1.00 0.00 C ATOM 725 CG ASP A 53 -18.758 0.552 9.618 1.00 0.00 C ATOM 726 OD1 ASP A 53 -18.763 -0.658 9.777 1.00 0.00 O ATOM 727 OD2 ASP A 53 -19.421 1.331 10.285 1.00 0.00 O ATOM 0 H ASP A 53 -15.707 2.353 8.212 1.00 0.00 H new ATOM 0 HA ASP A 53 -16.419 -0.205 9.413 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -17.721 2.197 8.678 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -18.354 1.017 7.548 1.00 0.00 H new ATOM 732 N PRO A 54 -16.327 0.093 6.123 1.00 0.00 N ATOM 733 CA PRO A 54 -16.249 -0.661 4.858 1.00 0.00 C ATOM 734 C PRO A 54 -14.991 -1.537 4.819 1.00 0.00 C ATOM 735 O PRO A 54 -14.818 -2.345 3.927 1.00 0.00 O ATOM 736 CB PRO A 54 -16.192 0.414 3.764 1.00 0.00 C ATOM 737 CG PRO A 54 -16.265 1.797 4.458 1.00 0.00 C ATOM 738 CD PRO A 54 -16.279 1.560 5.975 1.00 0.00 C ATOM 0 HA PRO A 54 -17.096 -1.335 4.732 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -15.272 0.324 3.187 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -17.020 0.293 3.065 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -15.411 2.412 4.175 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -17.161 2.334 4.147 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -15.391 1.977 6.449 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -17.142 2.034 6.442 1.00 0.00 H new ATOM 746 N ILE A 55 -14.111 -1.388 5.773 1.00 0.00 N ATOM 747 CA ILE A 55 -12.870 -2.222 5.775 1.00 0.00 C ATOM 748 C ILE A 55 -12.988 -3.310 6.843 1.00 0.00 C ATOM 749 O ILE A 55 -12.650 -4.455 6.617 1.00 0.00 O ATOM 750 CB ILE A 55 -11.631 -1.359 6.074 1.00 0.00 C ATOM 751 CG1 ILE A 55 -12.042 0.078 6.419 1.00 0.00 C ATOM 752 CG2 ILE A 55 -10.718 -1.340 4.849 1.00 0.00 C ATOM 753 CD1 ILE A 55 -12.643 0.754 5.184 1.00 0.00 C ATOM 0 H ILE A 55 -14.195 -0.729 6.547 1.00 0.00 H new ATOM 0 HA ILE A 55 -12.757 -2.672 4.789 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.105 -1.789 6.927 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.768 0.073 7.232 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.176 0.640 6.768 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.840 -0.729 5.059 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.405 -2.357 4.613 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.257 -0.920 4.000 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -12.934 1.775 5.433 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.904 0.772 4.383 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -13.520 0.197 4.855 1.00 0.00 H new ATOM 765 N ARG A 56 -13.458 -2.960 8.009 1.00 0.00 N ATOM 766 CA ARG A 56 -13.592 -3.972 9.097 1.00 0.00 C ATOM 767 C ARG A 56 -14.571 -5.071 8.671 1.00 0.00 C ATOM 768 O ARG A 56 -14.549 -6.168 9.192 1.00 0.00 O ATOM 769 CB ARG A 56 -14.113 -3.285 10.361 1.00 0.00 C ATOM 770 CG ARG A 56 -15.432 -2.577 10.048 1.00 0.00 C ATOM 771 CD ARG A 56 -15.771 -1.596 11.171 1.00 0.00 C ATOM 772 NE ARG A 56 -15.393 -2.192 12.483 1.00 0.00 N ATOM 773 CZ ARG A 56 -15.319 -1.440 13.547 1.00 0.00 C ATOM 774 NH1 ARG A 56 -15.571 -0.160 13.469 1.00 0.00 N ATOM 775 NH2 ARG A 56 -14.993 -1.968 14.696 1.00 0.00 N ATOM 0 H ARG A 56 -13.755 -2.016 8.256 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.619 -4.421 9.295 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -14.261 -4.020 11.153 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -13.379 -2.566 10.726 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -15.354 -2.046 9.099 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -16.232 -3.309 9.938 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -15.240 -0.656 11.020 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -16.836 -1.366 11.158 1.00 0.00 H new ATOM 0 HE ARG A 56 -15.192 -3.190 12.550 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -15.827 0.256 12.573 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -15.512 0.423 14.304 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -14.797 -2.967 14.761 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -14.935 -1.382 15.529 1.00 0.00 H new ATOM 789 N ALA A 57 -15.436 -4.784 7.733 1.00 0.00 N ATOM 790 CA ALA A 57 -16.417 -5.816 7.288 1.00 0.00 C ATOM 791 C ALA A 57 -16.041 -6.326 5.893 1.00 0.00 C ATOM 792 O ALA A 57 -16.194 -5.636 4.907 1.00 0.00 O ATOM 793 CB ALA A 57 -17.820 -5.203 7.249 1.00 0.00 C ATOM 0 H ALA A 57 -15.505 -3.884 7.258 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.403 -6.651 7.989 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.537 -5.957 6.924 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.091 -4.850 8.244 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.832 -4.366 6.551 1.00 0.00 H new ATOM 799 N SER A 58 -15.555 -7.538 5.809 1.00 0.00 N ATOM 800 CA SER A 58 -15.166 -8.116 4.487 1.00 0.00 C ATOM 801 C SER A 58 -13.883 -7.447 3.983 1.00 0.00 C ATOM 802 O SER A 58 -12.804 -7.995 4.094 1.00 0.00 O ATOM 803 CB SER A 58 -16.290 -7.907 3.467 1.00 0.00 C ATOM 804 OG SER A 58 -17.474 -7.497 4.138 1.00 0.00 O ATOM 0 H SER A 58 -15.410 -8.157 6.606 1.00 0.00 H new ATOM 0 HA SER A 58 -14.992 -9.185 4.610 1.00 0.00 H new ATOM 0 HB2 SER A 58 -15.995 -7.154 2.736 1.00 0.00 H new ATOM 0 HB3 SER A 58 -16.473 -8.831 2.918 1.00 0.00 H new ATOM 0 HG SER A 58 -17.513 -6.518 4.164 1.00 0.00 H new ATOM 810 N GLY A 59 -13.986 -6.271 3.427 1.00 0.00 N ATOM 811 CA GLY A 59 -12.767 -5.580 2.919 1.00 0.00 C ATOM 812 C GLY A 59 -13.175 -4.495 1.921 1.00 0.00 C ATOM 813 O GLY A 59 -14.139 -3.784 2.123 1.00 0.00 O ATOM 0 H GLY A 59 -14.860 -5.760 3.303 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.215 -5.138 3.748 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.102 -6.298 2.440 1.00 0.00 H new ATOM 817 N PHE A 60 -12.447 -4.361 0.847 1.00 0.00 N ATOM 818 CA PHE A 60 -12.790 -3.320 -0.162 1.00 0.00 C ATOM 819 C PHE A 60 -12.239 -3.730 -1.529 1.00 0.00 C ATOM 820 O PHE A 60 -11.506 -4.691 -1.653 1.00 0.00 O ATOM 821 CB PHE A 60 -12.165 -1.986 0.250 1.00 0.00 C ATOM 822 CG PHE A 60 -10.703 -2.197 0.556 1.00 0.00 C ATOM 823 CD1 PHE A 60 -9.777 -2.300 -0.490 1.00 0.00 C ATOM 824 CD2 PHE A 60 -10.272 -2.296 1.885 1.00 0.00 C ATOM 825 CE1 PHE A 60 -8.421 -2.500 -0.208 1.00 0.00 C ATOM 826 CE2 PHE A 60 -8.916 -2.497 2.167 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.990 -2.599 1.121 1.00 0.00 C ATOM 0 H PHE A 60 -11.629 -4.928 0.624 1.00 0.00 H new ATOM 0 HA PHE A 60 -13.874 -3.217 -0.220 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -12.280 -1.255 -0.550 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -12.678 -1.585 1.124 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.110 -2.225 -1.515 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -10.986 -2.217 2.692 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -7.707 -2.578 -1.015 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -8.583 -2.574 3.192 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.944 -2.754 1.339 1.00 0.00 H new ATOM 837 N ASP A 61 -12.580 -3.002 -2.555 1.00 0.00 N ATOM 838 CA ASP A 61 -12.072 -3.340 -3.913 1.00 0.00 C ATOM 839 C ASP A 61 -10.835 -2.491 -4.210 1.00 0.00 C ATOM 840 O ASP A 61 -10.608 -1.473 -3.586 1.00 0.00 O ATOM 841 CB ASP A 61 -13.156 -3.052 -4.953 1.00 0.00 C ATOM 842 CG ASP A 61 -13.778 -1.680 -4.676 1.00 0.00 C ATOM 843 OD1 ASP A 61 -13.108 -0.689 -4.910 1.00 0.00 O ATOM 844 OD2 ASP A 61 -14.915 -1.647 -4.235 1.00 0.00 O ATOM 0 H ASP A 61 -13.190 -2.186 -2.511 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.809 -4.397 -3.954 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.728 -3.073 -5.955 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -13.924 -3.825 -4.917 1.00 0.00 H new ATOM 849 N LEU A 62 -10.028 -2.898 -5.149 1.00 0.00 N ATOM 850 CA LEU A 62 -8.807 -2.105 -5.467 1.00 0.00 C ATOM 851 C LEU A 62 -8.308 -2.456 -6.871 1.00 0.00 C ATOM 852 O LEU A 62 -7.626 -3.441 -7.067 1.00 0.00 O ATOM 853 CB LEU A 62 -7.716 -2.422 -4.443 1.00 0.00 C ATOM 854 CG LEU A 62 -7.521 -1.222 -3.518 1.00 0.00 C ATOM 855 CD1 LEU A 62 -6.341 -1.487 -2.581 1.00 0.00 C ATOM 856 CD2 LEU A 62 -7.237 0.025 -4.359 1.00 0.00 C ATOM 0 H LEU A 62 -10.159 -3.741 -5.708 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.048 -1.043 -5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.993 -3.302 -3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.782 -2.658 -4.952 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.424 -1.065 -2.927 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.201 -0.631 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.543 -2.377 -1.984 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.437 -1.643 -3.170 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.097 0.883 -3.702 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.333 -0.132 -4.948 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.078 0.213 -5.027 1.00 0.00 H new ATOM 868 N ALA A 63 -8.641 -1.649 -7.842 1.00 0.00 N ATOM 869 CA ALA A 63 -8.189 -1.915 -9.241 1.00 0.00 C ATOM 870 C ALA A 63 -9.002 -3.065 -9.846 1.00 0.00 C ATOM 871 O ALA A 63 -9.908 -2.848 -10.626 1.00 0.00 O ATOM 872 CB ALA A 63 -6.700 -2.271 -9.246 1.00 0.00 C ATOM 0 H ALA A 63 -9.211 -0.811 -7.727 1.00 0.00 H new ATOM 0 HA ALA A 63 -8.345 -1.018 -9.841 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -6.375 -2.464 -10.269 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.126 -1.441 -8.834 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.537 -3.162 -8.639 1.00 0.00 H new ATOM 878 N GLY A 64 -8.689 -4.287 -9.501 1.00 0.00 N ATOM 879 CA GLY A 64 -9.449 -5.438 -10.066 1.00 0.00 C ATOM 880 C GLY A 64 -9.274 -6.659 -9.164 1.00 0.00 C ATOM 881 O GLY A 64 -9.428 -7.787 -9.592 1.00 0.00 O ATOM 0 H GLY A 64 -7.941 -4.536 -8.854 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -10.506 -5.183 -10.150 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -9.094 -5.662 -11.072 1.00 0.00 H new ATOM 885 N VAL A 65 -8.955 -6.446 -7.918 1.00 0.00 N ATOM 886 CA VAL A 65 -8.773 -7.592 -6.985 1.00 0.00 C ATOM 887 C VAL A 65 -9.432 -7.260 -5.646 1.00 0.00 C ATOM 888 O VAL A 65 -9.625 -6.109 -5.309 1.00 0.00 O ATOM 889 CB VAL A 65 -7.278 -7.842 -6.776 1.00 0.00 C ATOM 890 CG1 VAL A 65 -7.082 -9.013 -5.811 1.00 0.00 C ATOM 891 CG2 VAL A 65 -6.627 -8.176 -8.119 1.00 0.00 C ATOM 0 H VAL A 65 -8.812 -5.525 -7.505 1.00 0.00 H new ATOM 0 HA VAL A 65 -9.233 -8.487 -7.404 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.817 -6.948 -6.357 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.016 -9.189 -5.664 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.546 -8.777 -4.853 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.543 -9.909 -6.227 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.562 -8.355 -7.973 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -7.091 -9.070 -8.536 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -6.764 -7.342 -8.807 1.00 0.00 H new ATOM 901 N HIS A 66 -9.777 -8.256 -4.876 1.00 0.00 N ATOM 902 CA HIS A 66 -10.421 -7.982 -3.558 1.00 0.00 C ATOM 903 C HIS A 66 -9.379 -8.106 -2.446 1.00 0.00 C ATOM 904 O HIS A 66 -8.406 -8.822 -2.570 1.00 0.00 O ATOM 905 CB HIS A 66 -11.561 -8.978 -3.310 1.00 0.00 C ATOM 906 CG HIS A 66 -11.265 -10.285 -3.995 1.00 0.00 C ATOM 907 ND1 HIS A 66 -10.053 -10.941 -3.848 1.00 0.00 N ATOM 908 CD2 HIS A 66 -12.015 -11.070 -4.835 1.00 0.00 C ATOM 909 CE1 HIS A 66 -10.110 -12.069 -4.580 1.00 0.00 C ATOM 910 NE2 HIS A 66 -11.285 -12.196 -5.202 1.00 0.00 N ATOM 0 H HIS A 66 -9.642 -9.242 -5.100 1.00 0.00 H new ATOM 0 HA HIS A 66 -10.830 -6.972 -3.564 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -11.686 -9.140 -2.239 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -12.500 -8.568 -3.682 1.00 0.00 H new ATOM 0 HD1 HIS A 66 -9.262 -10.626 -3.287 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -13.020 -10.847 -5.162 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -9.304 -12.784 -4.655 1.00 0.00 H new ATOM 918 N TYR A 67 -9.573 -7.408 -1.361 1.00 0.00 N ATOM 919 CA TYR A 67 -8.592 -7.481 -0.242 1.00 0.00 C ATOM 920 C TYR A 67 -9.340 -7.558 1.089 1.00 0.00 C ATOM 921 O TYR A 67 -10.425 -7.030 1.234 1.00 0.00 O ATOM 922 CB TYR A 67 -7.712 -6.230 -0.259 1.00 0.00 C ATOM 923 CG TYR A 67 -6.975 -6.154 -1.573 1.00 0.00 C ATOM 924 CD1 TYR A 67 -5.755 -6.822 -1.730 1.00 0.00 C ATOM 925 CD2 TYR A 67 -7.513 -5.419 -2.637 1.00 0.00 C ATOM 926 CE1 TYR A 67 -5.074 -6.756 -2.951 1.00 0.00 C ATOM 927 CE2 TYR A 67 -6.831 -5.352 -3.858 1.00 0.00 C ATOM 928 CZ TYR A 67 -5.611 -6.022 -4.014 1.00 0.00 C ATOM 929 OH TYR A 67 -4.937 -5.959 -5.218 1.00 0.00 O ATOM 0 H TYR A 67 -10.369 -6.790 -1.201 1.00 0.00 H new ATOM 0 HA TYR A 67 -7.970 -8.368 -0.360 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -8.325 -5.339 -0.121 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -7.002 -6.260 0.568 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -5.339 -7.388 -0.909 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -8.454 -4.904 -2.516 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -4.133 -7.272 -3.073 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -7.245 -4.785 -4.678 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.423 -6.783 -5.348 1.00 0.00 H new ATOM 939 N VAL A 68 -8.769 -8.209 2.063 1.00 0.00 N ATOM 940 CA VAL A 68 -9.446 -8.316 3.385 1.00 0.00 C ATOM 941 C VAL A 68 -8.958 -7.187 4.294 1.00 0.00 C ATOM 942 O VAL A 68 -8.496 -6.162 3.831 1.00 0.00 O ATOM 943 CB VAL A 68 -9.117 -9.665 4.030 1.00 0.00 C ATOM 944 CG1 VAL A 68 -10.292 -10.115 4.900 1.00 0.00 C ATOM 945 CG2 VAL A 68 -8.868 -10.710 2.939 1.00 0.00 C ATOM 0 H VAL A 68 -7.862 -8.672 2.001 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.524 -8.239 3.246 1.00 0.00 H new ATOM 0 HB VAL A 68 -8.223 -9.561 4.646 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.058 -11.075 5.359 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.472 -9.375 5.679 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.184 -10.216 4.282 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.634 -11.669 3.401 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.761 -10.812 2.322 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.031 -10.393 2.316 1.00 0.00 H new ATOM 955 N THR A 69 -9.054 -7.363 5.583 1.00 0.00 N ATOM 956 CA THR A 69 -8.592 -6.297 6.515 1.00 0.00 C ATOM 957 C THR A 69 -8.385 -6.892 7.909 1.00 0.00 C ATOM 958 O THR A 69 -9.185 -6.698 8.802 1.00 0.00 O ATOM 959 CB THR A 69 -9.645 -5.190 6.586 1.00 0.00 C ATOM 960 OG1 THR A 69 -10.598 -5.377 5.549 1.00 0.00 O ATOM 961 CG2 THR A 69 -8.969 -3.829 6.422 1.00 0.00 C ATOM 0 H THR A 69 -9.432 -8.198 6.031 1.00 0.00 H new ATOM 0 HA THR A 69 -7.651 -5.882 6.153 1.00 0.00 H new ATOM 0 HB THR A 69 -10.148 -5.228 7.552 1.00 0.00 H new ATOM 0 HG1 THR A 69 -11.500 -5.390 5.932 1.00 0.00 H new ATOM 0 HG21 THR A 69 -9.720 -3.041 6.473 1.00 0.00 H new ATOM 0 HG22 THR A 69 -8.239 -3.687 7.219 1.00 0.00 H new ATOM 0 HG23 THR A 69 -8.464 -3.787 5.457 1.00 0.00 H new ATOM 969 N LEU A 70 -7.316 -7.615 8.103 1.00 0.00 N ATOM 970 CA LEU A 70 -7.059 -8.218 9.441 1.00 0.00 C ATOM 971 C LEU A 70 -6.117 -7.311 10.236 1.00 0.00 C ATOM 972 O LEU A 70 -5.592 -7.693 11.262 1.00 0.00 O ATOM 973 CB LEU A 70 -6.415 -9.596 9.267 1.00 0.00 C ATOM 974 CG LEU A 70 -7.113 -10.605 10.180 1.00 0.00 C ATOM 975 CD1 LEU A 70 -6.646 -12.020 9.829 1.00 0.00 C ATOM 976 CD2 LEU A 70 -6.758 -10.305 11.639 1.00 0.00 C ATOM 0 H LEU A 70 -6.610 -7.814 7.394 1.00 0.00 H new ATOM 0 HA LEU A 70 -8.002 -8.324 9.978 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.492 -9.916 8.228 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.353 -9.546 9.508 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.192 -10.530 10.043 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.143 -12.739 10.480 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.894 -12.238 8.790 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.567 -12.092 9.967 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.255 -11.024 12.290 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.679 -10.380 11.774 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.087 -9.297 11.894 1.00 0.00 H new ATOM 988 N ARG A 71 -5.899 -6.111 9.769 1.00 0.00 N ATOM 989 CA ARG A 71 -4.989 -5.183 10.498 1.00 0.00 C ATOM 990 C ARG A 71 -5.323 -3.736 10.128 1.00 0.00 C ATOM 991 O ARG A 71 -4.520 -3.034 9.545 1.00 0.00 O ATOM 992 CB ARG A 71 -3.539 -5.482 10.113 1.00 0.00 C ATOM 993 CG ARG A 71 -2.938 -6.473 11.109 1.00 0.00 C ATOM 994 CD ARG A 71 -1.445 -6.644 10.821 1.00 0.00 C ATOM 995 NE ARG A 71 -0.657 -5.858 11.812 1.00 0.00 N ATOM 996 CZ ARG A 71 0.624 -6.071 11.948 1.00 0.00 C ATOM 997 NH1 ARG A 71 1.222 -6.968 11.212 1.00 0.00 N ATOM 998 NH2 ARG A 71 1.309 -5.386 12.823 1.00 0.00 N ATOM 0 H ARG A 71 -6.311 -5.734 8.916 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.119 -5.322 11.571 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.497 -5.894 9.105 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.957 -4.561 10.105 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -3.084 -6.114 12.128 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.446 -7.434 11.033 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -1.171 -7.698 10.875 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.217 -6.307 9.810 1.00 0.00 H new ATOM 0 HE ARG A 71 -1.119 -5.152 12.385 1.00 0.00 H new ATOM 0 HH11 ARG A 71 0.688 -7.505 10.528 1.00 0.00 H new ATOM 0 HH12 ARG A 71 2.223 -7.132 11.321 1.00 0.00 H new ATOM 0 HH21 ARG A 71 0.843 -4.685 13.400 1.00 0.00 H new ATOM 0 HH22 ARG A 71 2.310 -5.552 12.930 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.498 -3.282 10.464 1.00 0.00 N ATOM 1013 CA ALA A 72 -6.876 -1.879 10.134 1.00 0.00 C ATOM 1014 C ALA A 72 -6.851 -1.041 11.413 1.00 0.00 C ATOM 1015 O ALA A 72 -7.838 -0.933 12.113 1.00 0.00 O ATOM 1016 CB ALA A 72 -8.285 -1.857 9.537 1.00 0.00 C ATOM 0 H ALA A 72 -7.213 -3.821 10.953 1.00 0.00 H new ATOM 0 HA ALA A 72 -6.171 -1.468 9.411 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.562 -0.831 9.295 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -8.305 -2.461 8.630 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.993 -2.263 10.260 1.00 0.00 H new ATOM 1022 N ASP A 73 -5.732 -0.448 11.729 1.00 0.00 N ATOM 1023 CA ASP A 73 -5.658 0.373 12.969 1.00 0.00 C ATOM 1024 C ASP A 73 -5.519 1.858 12.602 1.00 0.00 C ATOM 1025 O ASP A 73 -6.462 2.476 12.152 1.00 0.00 O ATOM 1026 CB ASP A 73 -4.466 -0.082 13.817 1.00 0.00 C ATOM 1027 CG ASP A 73 -3.321 -0.519 12.902 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -2.891 0.288 12.094 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -2.893 -1.655 13.025 1.00 0.00 O ATOM 0 H ASP A 73 -4.871 -0.496 11.185 1.00 0.00 H new ATOM 0 HA ASP A 73 -6.572 0.241 13.548 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -4.137 0.730 14.465 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -4.762 -0.907 14.465 1.00 0.00 H new ATOM 1034 N ASP A 74 -4.366 2.446 12.801 1.00 0.00 N ATOM 1035 CA ASP A 74 -4.210 3.890 12.470 1.00 0.00 C ATOM 1036 C ASP A 74 -3.091 4.091 11.444 1.00 0.00 C ATOM 1037 O ASP A 74 -3.151 4.982 10.619 1.00 0.00 O ATOM 1038 CB ASP A 74 -3.870 4.666 13.744 1.00 0.00 C ATOM 1039 CG ASP A 74 -5.153 5.222 14.365 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -5.791 6.039 13.724 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -5.474 4.820 15.472 1.00 0.00 O ATOM 0 H ASP A 74 -3.534 1.991 13.175 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.145 4.255 12.046 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.363 4.013 14.455 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -3.183 5.480 13.513 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.056 3.294 11.497 1.00 0.00 N ATOM 1047 CA ARG A 75 -0.935 3.482 10.530 1.00 0.00 C ATOM 1048 C ARG A 75 -0.491 2.138 9.940 1.00 0.00 C ATOM 1049 O ARG A 75 0.664 1.951 9.615 1.00 0.00 O ATOM 1050 CB ARG A 75 0.243 4.125 11.263 1.00 0.00 C ATOM 1051 CG ARG A 75 0.491 3.375 12.573 1.00 0.00 C ATOM 1052 CD ARG A 75 1.665 4.011 13.316 1.00 0.00 C ATOM 1053 NE ARG A 75 1.406 3.969 14.791 1.00 0.00 N ATOM 1054 CZ ARG A 75 0.288 4.420 15.298 1.00 0.00 C ATOM 1055 NH1 ARG A 75 -0.554 5.091 14.558 1.00 0.00 N ATOM 1056 NH2 ARG A 75 0.032 4.237 16.564 1.00 0.00 N ATOM 0 H ARG A 75 -1.939 2.529 12.161 1.00 0.00 H new ATOM 0 HA ARG A 75 -1.274 4.121 9.715 1.00 0.00 H new ATOM 0 HB2 ARG A 75 1.136 4.095 10.638 1.00 0.00 H new ATOM 0 HB3 ARG A 75 0.031 5.175 11.466 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -0.404 3.404 13.195 1.00 0.00 H new ATOM 0 HG3 ARG A 75 0.703 2.326 12.368 1.00 0.00 H new ATOM 0 HD2 ARG A 75 2.587 3.479 13.083 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.800 5.042 12.989 1.00 0.00 H new ATOM 0 HE ARG A 75 2.116 3.581 15.412 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -0.342 5.267 13.576 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -1.423 5.439 14.962 1.00 0.00 H new ATOM 0 HH21 ARG A 75 0.702 3.744 17.154 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -0.839 4.587 16.964 1.00 0.00 H new ATOM 1070 N SER A 76 -1.390 1.206 9.789 1.00 0.00 N ATOM 1071 CA SER A 76 -0.998 -0.111 9.207 1.00 0.00 C ATOM 1072 C SER A 76 -2.193 -0.719 8.470 1.00 0.00 C ATOM 1073 O SER A 76 -3.205 -1.035 9.062 1.00 0.00 O ATOM 1074 CB SER A 76 -0.553 -1.053 10.328 1.00 0.00 C ATOM 1075 OG SER A 76 0.129 -0.305 11.326 1.00 0.00 O ATOM 0 H SER A 76 -2.374 1.297 10.041 1.00 0.00 H new ATOM 0 HA SER A 76 -0.175 0.032 8.507 1.00 0.00 H new ATOM 0 HB2 SER A 76 -1.418 -1.556 10.761 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.100 -1.829 9.929 1.00 0.00 H new ATOM 0 HG SER A 76 -0.524 0.112 11.926 1.00 0.00 H new ATOM 1081 N ILE A 77 -2.080 -0.890 7.180 1.00 0.00 N ATOM 1082 CA ILE A 77 -3.207 -1.479 6.399 1.00 0.00 C ATOM 1083 C ILE A 77 -2.648 -2.351 5.270 1.00 0.00 C ATOM 1084 O ILE A 77 -3.038 -2.224 4.127 1.00 0.00 O ATOM 1085 CB ILE A 77 -4.063 -0.359 5.791 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -4.577 0.566 6.898 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -5.257 -0.969 5.054 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -3.766 1.863 6.892 1.00 0.00 C ATOM 0 H ILE A 77 -1.255 -0.647 6.632 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.821 -2.085 7.065 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.452 0.215 5.094 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.634 0.784 6.744 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.491 0.075 7.867 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.864 -0.173 4.623 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.898 -1.623 4.259 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.860 -1.546 5.754 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -4.130 2.523 7.679 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.714 1.635 7.067 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.875 2.356 5.926 1.00 0.00 H new ATOM 1100 N TYR A 78 -1.745 -3.241 5.579 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.182 -4.122 4.514 1.00 0.00 C ATOM 1102 C TYR A 78 -2.029 -5.396 4.435 1.00 0.00 C ATOM 1103 O TYR A 78 -1.788 -6.358 5.137 1.00 0.00 O ATOM 1104 CB TYR A 78 0.284 -4.494 4.817 1.00 0.00 C ATOM 1105 CG TYR A 78 0.854 -3.622 5.920 1.00 0.00 C ATOM 1106 CD1 TYR A 78 0.617 -3.953 7.262 1.00 0.00 C ATOM 1107 CD2 TYR A 78 1.632 -2.493 5.605 1.00 0.00 C ATOM 1108 CE1 TYR A 78 1.150 -3.160 8.285 1.00 0.00 C ATOM 1109 CE2 TYR A 78 2.163 -1.704 6.633 1.00 0.00 C ATOM 1110 CZ TYR A 78 1.922 -2.036 7.970 1.00 0.00 C ATOM 1111 OH TYR A 78 2.449 -1.257 8.980 1.00 0.00 O ATOM 0 H TYR A 78 -1.374 -3.397 6.516 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.204 -3.588 3.564 1.00 0.00 H new ATOM 0 HB2 TYR A 78 0.343 -5.542 5.111 1.00 0.00 H new ATOM 0 HB3 TYR A 78 0.885 -4.382 3.914 1.00 0.00 H new ATOM 0 HD1 TYR A 78 0.022 -4.821 7.507 1.00 0.00 H new ATOM 0 HD2 TYR A 78 1.819 -2.235 4.573 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.965 -3.416 9.318 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.760 -0.837 6.393 1.00 0.00 H new ATOM 0 HH TYR A 78 2.380 -0.311 8.733 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.032 -5.400 3.599 1.00 0.00 N ATOM 1122 CA GLY A 79 -3.914 -6.597 3.486 1.00 0.00 C ATOM 1123 C GLY A 79 -3.199 -7.721 2.732 1.00 0.00 C ATOM 1124 O GLY A 79 -2.141 -7.535 2.166 1.00 0.00 O ATOM 0 H GLY A 79 -3.279 -4.622 2.987 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.198 -6.942 4.480 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.834 -6.330 2.966 1.00 0.00 H new ATOM 1128 N LYS A 80 -3.782 -8.890 2.724 1.00 0.00 N ATOM 1129 CA LYS A 80 -3.160 -10.042 2.012 1.00 0.00 C ATOM 1130 C LYS A 80 -4.263 -10.992 1.536 1.00 0.00 C ATOM 1131 O LYS A 80 -5.287 -11.132 2.174 1.00 0.00 O ATOM 1132 CB LYS A 80 -2.221 -10.781 2.967 1.00 0.00 C ATOM 1133 CG LYS A 80 -1.661 -12.024 2.277 1.00 0.00 C ATOM 1134 CD LYS A 80 -1.975 -13.260 3.121 1.00 0.00 C ATOM 1135 CE LYS A 80 -0.697 -14.074 3.326 1.00 0.00 C ATOM 1136 NZ LYS A 80 -0.532 -14.387 4.773 1.00 0.00 N ATOM 0 H LYS A 80 -4.669 -9.097 3.184 1.00 0.00 H new ATOM 0 HA LYS A 80 -2.592 -9.684 1.154 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -1.406 -10.124 3.272 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.757 -11.066 3.872 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.096 -12.129 1.283 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.584 -11.925 2.144 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.387 -12.961 4.085 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -2.732 -13.869 2.626 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.744 -14.996 2.747 1.00 0.00 H new ATOM 0 HE3 LYS A 80 0.165 -13.514 2.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.337 -14.941 4.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -0.469 -13.501 5.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.350 -14.938 5.104 1.00 0.00 H new ATOM 1150 N LYS A 81 -4.070 -11.646 0.422 1.00 0.00 N ATOM 1151 CA LYS A 81 -5.118 -12.582 -0.080 1.00 0.00 C ATOM 1152 C LYS A 81 -4.509 -13.971 -0.295 1.00 0.00 C ATOM 1153 O LYS A 81 -3.386 -14.233 0.087 1.00 0.00 O ATOM 1154 CB LYS A 81 -5.679 -12.060 -1.405 1.00 0.00 C ATOM 1155 CG LYS A 81 -7.175 -11.780 -1.249 1.00 0.00 C ATOM 1156 CD LYS A 81 -7.968 -12.692 -2.188 1.00 0.00 C ATOM 1157 CE LYS A 81 -9.290 -13.085 -1.524 1.00 0.00 C ATOM 1158 NZ LYS A 81 -9.436 -14.568 -1.551 1.00 0.00 N ATOM 0 H LYS A 81 -3.236 -11.573 -0.160 1.00 0.00 H new ATOM 0 HA LYS A 81 -5.921 -12.649 0.654 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.156 -11.150 -1.700 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -5.515 -12.792 -2.195 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.481 -11.949 -0.217 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.386 -10.735 -1.477 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.161 -12.181 -3.131 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -7.387 -13.584 -2.422 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -9.314 -12.725 -0.496 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.125 -12.617 -2.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -10.334 -14.837 -1.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -9.431 -14.899 -2.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -8.645 -15.004 -1.035 1.00 0.00 H new ATOM 1172 N GLY A 82 -5.245 -14.862 -0.905 1.00 0.00 N ATOM 1173 CA GLY A 82 -4.712 -16.236 -1.144 1.00 0.00 C ATOM 1174 C GLY A 82 -3.853 -16.243 -2.412 1.00 0.00 C ATOM 1175 O GLY A 82 -3.394 -17.277 -2.856 1.00 0.00 O ATOM 0 H GLY A 82 -6.192 -14.698 -1.248 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.118 -16.560 -0.289 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -5.535 -16.943 -1.247 1.00 0.00 H new ATOM 1179 N SER A 83 -3.633 -15.097 -2.996 1.00 0.00 N ATOM 1180 CA SER A 83 -2.804 -15.035 -4.232 1.00 0.00 C ATOM 1181 C SER A 83 -2.191 -13.640 -4.347 1.00 0.00 C ATOM 1182 O SER A 83 -0.997 -13.461 -4.214 1.00 0.00 O ATOM 1183 CB SER A 83 -3.684 -15.311 -5.450 1.00 0.00 C ATOM 1184 OG SER A 83 -4.861 -15.991 -5.034 1.00 0.00 O ATOM 0 H SER A 83 -3.992 -14.200 -2.670 1.00 0.00 H new ATOM 0 HA SER A 83 -2.012 -15.783 -4.186 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.946 -14.375 -5.943 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.140 -15.913 -6.177 1.00 0.00 H new ATOM 0 HG SER A 83 -5.429 -16.168 -5.813 1.00 0.00 H new ATOM 1190 N ALA A 84 -3.004 -12.648 -4.580 1.00 0.00 N ATOM 1191 CA ALA A 84 -2.476 -11.261 -4.687 1.00 0.00 C ATOM 1192 C ALA A 84 -2.530 -10.610 -3.303 1.00 0.00 C ATOM 1193 O ALA A 84 -3.197 -11.094 -2.410 1.00 0.00 O ATOM 1194 CB ALA A 84 -3.334 -10.460 -5.666 1.00 0.00 C ATOM 0 H ALA A 84 -4.013 -12.739 -4.701 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.448 -11.280 -5.050 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.946 -9.444 -5.743 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.306 -10.935 -6.647 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.363 -10.429 -5.307 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.839 -9.522 -3.110 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.865 -8.862 -1.773 1.00 0.00 C ATOM 1202 C GLY A 85 -1.503 -7.385 -1.915 1.00 0.00 C ATOM 1203 O GLY A 85 -0.758 -6.997 -2.792 1.00 0.00 O ATOM 0 H GLY A 85 -1.261 -9.063 -3.814 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.855 -8.962 -1.328 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.162 -9.355 -1.101 1.00 0.00 H new ATOM 1207 N VAL A 86 -2.023 -6.557 -1.051 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.710 -5.104 -1.127 1.00 0.00 C ATOM 1209 C VAL A 86 -1.095 -4.645 0.198 1.00 0.00 C ATOM 1210 O VAL A 86 -1.423 -5.147 1.256 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.996 -4.322 -1.400 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.868 -4.313 -0.144 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -2.645 -2.884 -1.788 1.00 0.00 C ATOM 0 H VAL A 86 -2.652 -6.826 -0.295 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.000 -4.923 -1.934 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.542 -4.797 -2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.784 -3.755 -0.341 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.119 -5.337 0.132 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.324 -3.840 0.673 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.561 -2.326 -1.983 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.098 -2.410 -0.973 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.026 -2.890 -2.685 1.00 0.00 H new ATOM 1223 N ILE A 87 -0.205 -3.692 0.145 1.00 0.00 N ATOM 1224 CA ILE A 87 0.439 -3.187 1.389 1.00 0.00 C ATOM 1225 C ILE A 87 0.144 -1.693 1.516 1.00 0.00 C ATOM 1226 O ILE A 87 0.839 -0.867 0.960 1.00 0.00 O ATOM 1227 CB ILE A 87 1.954 -3.415 1.304 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.244 -4.914 1.409 1.00 0.00 C ATOM 1229 CG2 ILE A 87 2.666 -2.682 2.444 1.00 0.00 C ATOM 1230 CD1 ILE A 87 3.460 -5.260 0.548 1.00 0.00 C ATOM 0 H ILE A 87 0.105 -3.239 -0.714 1.00 0.00 H new ATOM 0 HA ILE A 87 0.049 -3.715 2.259 1.00 0.00 H new ATOM 0 HB ILE A 87 2.319 -3.029 0.352 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.431 -5.187 2.448 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.377 -5.487 1.080 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.740 -2.852 2.371 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.463 -1.614 2.373 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.303 -3.057 3.401 1.00 0.00 H new ATOM 0 HD11 ILE A 87 3.667 -6.328 0.623 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.255 -5.002 -0.491 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.326 -4.697 0.898 1.00 0.00 H new ATOM 1242 N THR A 88 -0.887 -1.333 2.227 1.00 0.00 N ATOM 1243 CA THR A 88 -1.215 0.112 2.356 1.00 0.00 C ATOM 1244 C THR A 88 -1.015 0.585 3.794 1.00 0.00 C ATOM 1245 O THR A 88 -1.449 -0.045 4.736 1.00 0.00 O ATOM 1246 CB THR A 88 -2.669 0.346 1.940 1.00 0.00 C ATOM 1247 OG1 THR A 88 -3.534 -0.260 2.889 1.00 0.00 O ATOM 1248 CG2 THR A 88 -2.912 -0.264 0.559 1.00 0.00 C ATOM 0 H THR A 88 -1.512 -1.971 2.720 1.00 0.00 H new ATOM 0 HA THR A 88 -0.548 0.679 1.706 1.00 0.00 H new ATOM 0 HB THR A 88 -2.868 1.417 1.899 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.374 -1.227 2.907 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.948 -0.096 0.264 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.248 0.204 -0.168 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.714 -1.335 0.594 1.00 0.00 H new ATOM 1256 N VAL A 89 -0.366 1.704 3.962 1.00 0.00 N ATOM 1257 CA VAL A 89 -0.145 2.249 5.333 1.00 0.00 C ATOM 1258 C VAL A 89 -0.047 3.776 5.243 1.00 0.00 C ATOM 1259 O VAL A 89 0.329 4.325 4.227 1.00 0.00 O ATOM 1260 CB VAL A 89 1.138 1.648 5.937 1.00 0.00 C ATOM 1261 CG1 VAL A 89 2.147 1.362 4.827 1.00 0.00 C ATOM 1262 CG2 VAL A 89 1.760 2.620 6.947 1.00 0.00 C ATOM 0 H VAL A 89 0.023 2.267 3.206 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.977 1.981 5.984 1.00 0.00 H new ATOM 0 HB VAL A 89 0.879 0.720 6.447 1.00 0.00 H new ATOM 0 HG11 VAL A 89 3.053 0.937 5.259 1.00 0.00 H new ATOM 0 HG12 VAL A 89 1.717 0.655 4.118 1.00 0.00 H new ATOM 0 HG13 VAL A 89 2.392 2.290 4.310 1.00 0.00 H new ATOM 0 HG21 VAL A 89 2.666 2.180 7.365 1.00 0.00 H new ATOM 0 HG22 VAL A 89 2.008 3.556 6.446 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.048 2.816 7.749 1.00 0.00 H new ATOM 1272 N LYS A 90 -0.396 4.464 6.296 1.00 0.00 N ATOM 1273 CA LYS A 90 -0.336 5.952 6.269 1.00 0.00 C ATOM 1274 C LYS A 90 0.962 6.433 6.922 1.00 0.00 C ATOM 1275 O LYS A 90 1.197 6.213 8.094 1.00 0.00 O ATOM 1276 CB LYS A 90 -1.532 6.516 7.042 1.00 0.00 C ATOM 1277 CG LYS A 90 -2.372 7.398 6.117 1.00 0.00 C ATOM 1278 CD LYS A 90 -1.912 8.852 6.244 1.00 0.00 C ATOM 1279 CE LYS A 90 -2.550 9.486 7.484 1.00 0.00 C ATOM 1280 NZ LYS A 90 -1.482 9.997 8.390 1.00 0.00 N ATOM 0 H LYS A 90 -0.720 4.059 7.174 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.365 6.297 5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.140 5.702 7.435 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.184 7.096 7.897 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.270 7.062 5.085 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.427 7.315 6.377 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.825 8.895 6.319 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.192 9.412 5.352 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.211 10.301 7.189 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -3.163 8.751 8.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.917 10.427 9.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.868 9.210 8.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.915 10.711 7.890 1.00 0.00 H new ATOM 1294 N THR A 91 1.804 7.098 6.177 1.00 0.00 N ATOM 1295 CA THR A 91 3.077 7.605 6.762 1.00 0.00 C ATOM 1296 C THR A 91 2.883 9.066 7.171 1.00 0.00 C ATOM 1297 O THR A 91 2.846 9.395 8.340 1.00 0.00 O ATOM 1298 CB THR A 91 4.193 7.505 5.716 1.00 0.00 C ATOM 1299 OG1 THR A 91 3.638 7.683 4.422 1.00 0.00 O ATOM 1300 CG2 THR A 91 4.862 6.132 5.800 1.00 0.00 C ATOM 0 H THR A 91 1.665 7.311 5.189 1.00 0.00 H new ATOM 0 HA THR A 91 3.350 7.011 7.634 1.00 0.00 H new ATOM 0 HB THR A 91 4.938 8.277 5.907 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.349 7.621 3.750 1.00 0.00 H new ATOM 0 HG21 THR A 91 5.654 6.067 5.054 1.00 0.00 H new ATOM 0 HG22 THR A 91 5.287 5.995 6.794 1.00 0.00 H new ATOM 0 HG23 THR A 91 4.122 5.354 5.612 1.00 0.00 H new ATOM 1308 N SER A 92 2.743 9.937 6.207 1.00 0.00 N ATOM 1309 CA SER A 92 2.533 11.386 6.500 1.00 0.00 C ATOM 1310 C SER A 92 2.954 12.197 5.276 1.00 0.00 C ATOM 1311 O SER A 92 2.502 13.304 5.062 1.00 0.00 O ATOM 1312 CB SER A 92 3.372 11.815 7.705 1.00 0.00 C ATOM 1313 OG SER A 92 2.615 11.630 8.894 1.00 0.00 O ATOM 0 H SER A 92 2.766 9.703 5.215 1.00 0.00 H new ATOM 0 HA SER A 92 1.481 11.559 6.729 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.290 11.230 7.750 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.665 12.860 7.605 1.00 0.00 H new ATOM 0 HG SER A 92 2.510 10.672 9.069 1.00 0.00 H new ATOM 1319 N LYS A 93 3.817 11.646 4.467 1.00 0.00 N ATOM 1320 CA LYS A 93 4.272 12.370 3.249 1.00 0.00 C ATOM 1321 C LYS A 93 3.720 11.667 2.009 1.00 0.00 C ATOM 1322 O LYS A 93 3.772 12.188 0.911 1.00 0.00 O ATOM 1323 CB LYS A 93 5.801 12.363 3.194 1.00 0.00 C ATOM 1324 CG LYS A 93 6.329 13.780 3.426 1.00 0.00 C ATOM 1325 CD LYS A 93 7.036 14.273 2.163 1.00 0.00 C ATOM 1326 CE LYS A 93 8.319 15.013 2.551 1.00 0.00 C ATOM 1327 NZ LYS A 93 9.216 14.090 3.305 1.00 0.00 N ATOM 0 H LYS A 93 4.228 10.722 4.599 1.00 0.00 H new ATOM 0 HA LYS A 93 3.912 13.399 3.280 1.00 0.00 H new ATOM 0 HB2 LYS A 93 6.199 11.687 3.951 1.00 0.00 H new ATOM 0 HB3 LYS A 93 6.139 11.992 2.226 1.00 0.00 H new ATOM 0 HG2 LYS A 93 5.507 14.449 3.680 1.00 0.00 H new ATOM 0 HG3 LYS A 93 7.020 13.789 4.269 1.00 0.00 H new ATOM 0 HD2 LYS A 93 7.272 13.430 1.513 1.00 0.00 H new ATOM 0 HD3 LYS A 93 6.378 14.935 1.600 1.00 0.00 H new ATOM 0 HE2 LYS A 93 8.825 15.380 1.658 1.00 0.00 H new ATOM 0 HE3 LYS A 93 8.079 15.884 3.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 9.207 14.344 4.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 8.882 13.112 3.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 10.185 14.170 2.937 1.00 0.00 H new ATOM 1341 N SER A 94 3.195 10.482 2.171 1.00 0.00 N ATOM 1342 CA SER A 94 2.645 9.745 0.999 1.00 0.00 C ATOM 1343 C SER A 94 1.928 8.481 1.472 1.00 0.00 C ATOM 1344 O SER A 94 2.037 8.077 2.617 1.00 0.00 O ATOM 1345 CB SER A 94 3.790 9.353 0.064 1.00 0.00 C ATOM 1346 OG SER A 94 5.031 9.651 0.690 1.00 0.00 O ATOM 0 H SER A 94 3.124 9.994 3.064 1.00 0.00 H new ATOM 0 HA SER A 94 1.939 10.386 0.471 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.735 8.290 -0.172 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.706 9.894 -0.879 1.00 0.00 H new ATOM 0 HG SER A 94 5.767 9.399 0.094 1.00 0.00 H new ATOM 1352 N ILE A 95 1.201 7.847 0.594 1.00 0.00 N ATOM 1353 CA ILE A 95 0.484 6.603 0.975 1.00 0.00 C ATOM 1354 C ILE A 95 1.210 5.403 0.363 1.00 0.00 C ATOM 1355 O ILE A 95 1.599 5.420 -0.789 1.00 0.00 O ATOM 1356 CB ILE A 95 -0.959 6.667 0.466 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -1.767 7.594 1.378 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -1.578 5.267 0.485 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -3.038 8.051 0.659 1.00 0.00 C ATOM 0 H ILE A 95 1.074 8.140 -0.375 1.00 0.00 H new ATOM 0 HA ILE A 95 0.468 6.499 2.060 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.970 7.048 -0.555 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.027 7.075 2.301 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.165 8.459 1.657 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.605 5.318 0.122 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.998 4.604 -0.158 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -1.572 4.880 1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.609 8.710 1.313 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -2.768 8.587 -0.251 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.643 7.182 0.402 1.00 0.00 H new ATOM 1371 N LEU A 96 1.413 4.371 1.131 1.00 0.00 N ATOM 1372 CA LEU A 96 2.133 3.175 0.609 1.00 0.00 C ATOM 1373 C LEU A 96 1.145 2.199 -0.027 1.00 0.00 C ATOM 1374 O LEU A 96 0.016 2.082 0.403 1.00 0.00 O ATOM 1375 CB LEU A 96 2.824 2.468 1.775 1.00 0.00 C ATOM 1376 CG LEU A 96 4.342 2.578 1.655 1.00 0.00 C ATOM 1377 CD1 LEU A 96 4.980 1.562 2.600 1.00 0.00 C ATOM 1378 CD2 LEU A 96 4.783 2.279 0.219 1.00 0.00 C ATOM 0 H LEU A 96 1.110 4.303 2.103 1.00 0.00 H new ATOM 0 HA LEU A 96 2.860 3.495 -0.138 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.497 2.907 2.717 1.00 0.00 H new ATOM 0 HB3 LEU A 96 2.532 1.418 1.794 1.00 0.00 H new ATOM 0 HG LEU A 96 4.655 3.589 1.915 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.065 1.628 2.526 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.672 1.774 3.624 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.658 0.557 2.325 1.00 0.00 H new ATOM 0 HD21 LEU A 96 5.868 2.361 0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.476 1.269 -0.053 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.319 2.994 -0.460 1.00 0.00 H new ATOM 1390 N VAL A 97 1.570 1.480 -1.034 1.00 0.00 N ATOM 1391 CA VAL A 97 0.664 0.489 -1.678 1.00 0.00 C ATOM 1392 C VAL A 97 1.491 -0.656 -2.269 1.00 0.00 C ATOM 1393 O VAL A 97 1.434 -0.923 -3.450 1.00 0.00 O ATOM 1394 CB VAL A 97 -0.137 1.159 -2.791 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -0.916 0.098 -3.571 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -1.120 2.153 -2.173 1.00 0.00 C ATOM 0 H VAL A 97 2.505 1.538 -1.436 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.022 0.097 -0.927 1.00 0.00 H new ATOM 0 HB VAL A 97 0.542 1.681 -3.466 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.488 0.577 -4.366 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.219 -0.618 -4.007 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.597 -0.422 -2.897 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.695 2.635 -2.963 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.797 1.625 -1.502 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.569 2.909 -1.613 1.00 0.00 H new ATOM 1406 N GLY A 98 2.256 -1.338 -1.463 1.00 0.00 N ATOM 1407 CA GLY A 98 3.073 -2.466 -1.998 1.00 0.00 C ATOM 1408 C GLY A 98 2.154 -3.461 -2.712 1.00 0.00 C ATOM 1409 O GLY A 98 1.341 -4.120 -2.097 1.00 0.00 O ATOM 0 H GLY A 98 2.352 -1.166 -0.462 1.00 0.00 H new ATOM 0 HA2 GLY A 98 3.827 -2.089 -2.689 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.605 -2.962 -1.186 1.00 0.00 H new ATOM 1413 N VAL A 99 2.274 -3.579 -4.005 1.00 0.00 N ATOM 1414 CA VAL A 99 1.402 -4.533 -4.746 1.00 0.00 C ATOM 1415 C VAL A 99 2.255 -5.695 -5.262 1.00 0.00 C ATOM 1416 O VAL A 99 3.250 -5.499 -5.937 1.00 0.00 O ATOM 1417 CB VAL A 99 0.709 -3.823 -5.927 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.808 -3.905 -5.745 1.00 0.00 C ATOM 1419 CG2 VAL A 99 1.112 -2.342 -5.990 1.00 0.00 C ATOM 0 H VAL A 99 2.936 -3.058 -4.580 1.00 0.00 H new ATOM 0 HA VAL A 99 0.632 -4.912 -4.074 1.00 0.00 H new ATOM 0 HB VAL A 99 1.015 -4.316 -6.850 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.302 -3.404 -6.578 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.115 -4.950 -5.717 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.089 -3.419 -4.811 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.610 -1.864 -6.831 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.821 -1.846 -5.064 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.191 -2.264 -6.120 1.00 0.00 H new ATOM 1429 N TYR A 100 1.882 -6.907 -4.941 1.00 0.00 N ATOM 1430 CA TYR A 100 2.678 -8.080 -5.407 1.00 0.00 C ATOM 1431 C TYR A 100 1.744 -9.206 -5.855 1.00 0.00 C ATOM 1432 O TYR A 100 0.535 -9.073 -5.836 1.00 0.00 O ATOM 1433 CB TYR A 100 3.564 -8.585 -4.267 1.00 0.00 C ATOM 1434 CG TYR A 100 2.733 -8.781 -3.021 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.224 -7.671 -2.336 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.474 -10.074 -2.549 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.457 -7.854 -1.178 1.00 0.00 C ATOM 1438 CE2 TYR A 100 1.707 -10.256 -1.392 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.197 -9.148 -0.706 1.00 0.00 C ATOM 1440 OH TYR A 100 0.441 -9.330 0.433 1.00 0.00 O ATOM 0 H TYR A 100 1.063 -7.134 -4.378 1.00 0.00 H new ATOM 0 HA TYR A 100 3.299 -7.772 -6.248 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.037 -9.525 -4.551 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.364 -7.871 -4.073 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.423 -6.674 -2.700 1.00 0.00 H new ATOM 0 HD2 TYR A 100 2.866 -10.930 -3.077 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.066 -6.998 -0.649 1.00 0.00 H new ATOM 0 HE2 TYR A 100 1.509 -11.253 -1.028 1.00 0.00 H new ATOM 0 HH TYR A 100 0.356 -10.288 0.620 1.00 0.00 H new ATOM 1450 N ASN A 101 2.301 -10.316 -6.259 1.00 0.00 N ATOM 1451 CA ASN A 101 1.460 -11.459 -6.715 1.00 0.00 C ATOM 1452 C ASN A 101 1.444 -12.549 -5.639 1.00 0.00 C ATOM 1453 O ASN A 101 1.497 -12.271 -4.458 1.00 0.00 O ATOM 1454 CB ASN A 101 2.038 -12.028 -8.013 1.00 0.00 C ATOM 1455 CG ASN A 101 0.898 -12.383 -8.968 1.00 0.00 C ATOM 1456 OD1 ASN A 101 -0.187 -12.931 -8.495 1.00 0.00 O flip ATOM 1457 ND2 ASN A 101 0.996 -12.160 -10.159 1.00 0.00 N flip ATOM 0 H ASN A 101 3.307 -10.480 -6.293 1.00 0.00 H new ATOM 0 HA ASN A 101 0.441 -11.113 -6.890 1.00 0.00 H new ATOM 0 HB2 ASN A 101 2.702 -11.299 -8.478 1.00 0.00 H new ATOM 0 HB3 ASN A 101 2.636 -12.914 -7.799 1.00 0.00 H new ATOM 0 HD21 ASN A 101 1.844 -11.731 -10.530 1.00 0.00 H new ATOM 0 HD22 ASN A 101 0.230 -12.401 -10.788 1.00 0.00 H new ATOM 1464 N GLU A 102 1.360 -13.789 -6.038 1.00 0.00 N ATOM 1465 CA GLU A 102 1.328 -14.897 -5.047 1.00 0.00 C ATOM 1466 C GLU A 102 2.698 -15.581 -4.983 1.00 0.00 C ATOM 1467 O GLU A 102 3.092 -16.110 -3.963 1.00 0.00 O ATOM 1468 CB GLU A 102 0.273 -15.914 -5.480 1.00 0.00 C ATOM 1469 CG GLU A 102 0.295 -17.107 -4.530 1.00 0.00 C ATOM 1470 CD GLU A 102 -1.018 -17.880 -4.656 1.00 0.00 C ATOM 1471 OE1 GLU A 102 -1.679 -17.722 -5.669 1.00 0.00 O ATOM 1472 OE2 GLU A 102 -1.340 -18.617 -3.738 1.00 0.00 O ATOM 0 H GLU A 102 1.312 -14.082 -7.014 1.00 0.00 H new ATOM 0 HA GLU A 102 1.084 -14.499 -4.062 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -0.714 -15.452 -5.478 1.00 0.00 H new ATOM 0 HB3 GLU A 102 0.468 -16.244 -6.500 1.00 0.00 H new ATOM 0 HG2 GLU A 102 1.137 -17.758 -4.765 1.00 0.00 H new ATOM 0 HG3 GLU A 102 0.432 -16.766 -3.504 1.00 0.00 H new ATOM 1479 N LYS A 103 3.419 -15.583 -6.069 1.00 0.00 N ATOM 1480 CA LYS A 103 4.757 -16.240 -6.079 1.00 0.00 C ATOM 1481 C LYS A 103 5.672 -15.591 -5.038 1.00 0.00 C ATOM 1482 O LYS A 103 6.694 -16.138 -4.674 1.00 0.00 O ATOM 1483 CB LYS A 103 5.385 -16.094 -7.465 1.00 0.00 C ATOM 1484 CG LYS A 103 5.654 -17.480 -8.053 1.00 0.00 C ATOM 1485 CD LYS A 103 5.081 -17.554 -9.469 1.00 0.00 C ATOM 1486 CE LYS A 103 3.787 -18.367 -9.451 1.00 0.00 C ATOM 1487 NZ LYS A 103 3.848 -19.424 -10.500 1.00 0.00 N ATOM 0 H LYS A 103 3.139 -15.157 -6.953 1.00 0.00 H new ATOM 0 HA LYS A 103 4.635 -17.296 -5.837 1.00 0.00 H new ATOM 0 HB2 LYS A 103 4.719 -15.533 -8.120 1.00 0.00 H new ATOM 0 HB3 LYS A 103 6.315 -15.530 -7.397 1.00 0.00 H new ATOM 0 HG2 LYS A 103 6.726 -17.677 -8.072 1.00 0.00 H new ATOM 0 HG3 LYS A 103 5.201 -18.247 -7.425 1.00 0.00 H new ATOM 0 HD2 LYS A 103 4.888 -16.550 -9.848 1.00 0.00 H new ATOM 0 HD3 LYS A 103 5.804 -18.015 -10.142 1.00 0.00 H new ATOM 0 HE2 LYS A 103 3.644 -18.821 -8.470 1.00 0.00 H new ATOM 0 HE3 LYS A 103 2.932 -17.714 -9.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 2.967 -19.977 -10.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 3.965 -18.980 -11.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 4.654 -20.053 -10.312 1.00 0.00 H new ATOM 1501 N ILE A 104 5.322 -14.431 -4.557 1.00 0.00 N ATOM 1502 CA ILE A 104 6.185 -13.763 -3.543 1.00 0.00 C ATOM 1503 C ILE A 104 5.820 -14.275 -2.149 1.00 0.00 C ATOM 1504 O ILE A 104 4.667 -14.495 -1.839 1.00 0.00 O ATOM 1505 CB ILE A 104 5.976 -12.247 -3.618 1.00 0.00 C ATOM 1506 CG1 ILE A 104 6.733 -11.700 -4.830 1.00 0.00 C ATOM 1507 CG2 ILE A 104 6.509 -11.584 -2.344 1.00 0.00 C ATOM 1508 CD1 ILE A 104 6.580 -10.182 -4.884 1.00 0.00 C ATOM 0 H ILE A 104 4.480 -13.919 -4.820 1.00 0.00 H new ATOM 0 HA ILE A 104 7.232 -13.989 -3.743 1.00 0.00 H new ATOM 0 HB ILE A 104 4.912 -12.031 -3.714 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.788 -11.968 -4.764 1.00 0.00 H new ATOM 0 HG13 ILE A 104 6.347 -12.148 -5.746 1.00 0.00 H new ATOM 0 HG21 ILE A 104 6.357 -10.506 -2.404 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.976 -11.978 -1.479 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.573 -11.795 -2.242 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.119 -9.792 -5.747 1.00 0.00 H new ATOM 0 HD12 ILE A 104 5.524 -9.926 -4.970 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.987 -9.743 -3.973 1.00 0.00 H new ATOM 1520 N GLN A 105 6.799 -14.469 -1.308 1.00 0.00 N ATOM 1521 CA GLN A 105 6.521 -14.974 0.065 1.00 0.00 C ATOM 1522 C GLN A 105 5.550 -14.022 0.778 1.00 0.00 C ATOM 1523 O GLN A 105 5.914 -12.913 1.115 1.00 0.00 O ATOM 1524 CB GLN A 105 7.833 -15.045 0.851 1.00 0.00 C ATOM 1525 CG GLN A 105 8.214 -16.511 1.070 1.00 0.00 C ATOM 1526 CD GLN A 105 9.001 -16.645 2.375 1.00 0.00 C ATOM 1527 OE1 GLN A 105 8.621 -17.395 3.252 1.00 0.00 O ATOM 1528 NE2 GLN A 105 10.090 -15.947 2.540 1.00 0.00 N ATOM 0 H GLN A 105 7.783 -14.298 -1.514 1.00 0.00 H new ATOM 0 HA GLN A 105 6.074 -15.966 0.004 1.00 0.00 H new ATOM 0 HB2 GLN A 105 8.624 -14.529 0.307 1.00 0.00 H new ATOM 0 HB3 GLN A 105 7.723 -14.539 1.810 1.00 0.00 H new ATOM 0 HG2 GLN A 105 7.317 -17.129 1.109 1.00 0.00 H new ATOM 0 HG3 GLN A 105 8.813 -16.871 0.233 1.00 0.00 H new ATOM 0 HE21 GLN A 105 10.409 -15.317 1.803 1.00 0.00 H new ATOM 0 HE22 GLN A 105 10.623 -16.031 3.406 1.00 0.00 H new ATOM 1537 N PRO A 106 4.337 -14.480 0.987 1.00 0.00 N ATOM 1538 CA PRO A 106 3.301 -13.675 1.658 1.00 0.00 C ATOM 1539 C PRO A 106 3.692 -13.416 3.117 1.00 0.00 C ATOM 1540 O PRO A 106 4.299 -14.246 3.762 1.00 0.00 O ATOM 1541 CB PRO A 106 2.030 -14.533 1.589 1.00 0.00 C ATOM 1542 CG PRO A 106 2.409 -15.881 0.925 1.00 0.00 C ATOM 1543 CD PRO A 106 3.902 -15.825 0.572 1.00 0.00 C ATOM 0 HA PRO A 106 3.166 -12.701 1.188 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.625 -14.699 2.587 1.00 0.00 H new ATOM 0 HB3 PRO A 106 1.257 -14.026 1.012 1.00 0.00 H new ATOM 0 HG2 PRO A 106 2.207 -16.711 1.602 1.00 0.00 H new ATOM 0 HG3 PRO A 106 1.810 -16.048 0.029 1.00 0.00 H new ATOM 0 HD2 PRO A 106 4.461 -16.601 1.095 1.00 0.00 H new ATOM 0 HD3 PRO A 106 4.062 -15.981 -0.495 1.00 0.00 H new ATOM 1551 N GLY A 107 3.344 -12.271 3.639 1.00 0.00 N ATOM 1552 CA GLY A 107 3.693 -11.960 5.055 1.00 0.00 C ATOM 1553 C GLY A 107 5.067 -11.291 5.113 1.00 0.00 C ATOM 1554 O GLY A 107 5.269 -10.323 5.818 1.00 0.00 O ATOM 0 H GLY A 107 2.833 -11.538 3.147 1.00 0.00 H new ATOM 0 HA2 GLY A 107 2.939 -11.303 5.489 1.00 0.00 H new ATOM 0 HA3 GLY A 107 3.698 -12.875 5.648 1.00 0.00 H new ATOM 1558 N THR A 108 6.017 -11.801 4.376 1.00 0.00 N ATOM 1559 CA THR A 108 7.378 -11.195 4.390 1.00 0.00 C ATOM 1560 C THR A 108 7.362 -9.885 3.597 1.00 0.00 C ATOM 1561 O THR A 108 8.101 -8.965 3.884 1.00 0.00 O ATOM 1562 CB THR A 108 8.375 -12.173 3.756 1.00 0.00 C ATOM 1563 OG1 THR A 108 8.668 -13.212 4.680 1.00 0.00 O ATOM 1564 CG2 THR A 108 9.668 -11.439 3.388 1.00 0.00 C ATOM 0 H THR A 108 5.909 -12.611 3.765 1.00 0.00 H new ATOM 0 HA THR A 108 7.677 -10.989 5.418 1.00 0.00 H new ATOM 0 HB THR A 108 7.936 -12.596 2.853 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.304 -13.839 4.276 1.00 0.00 H new ATOM 0 HG21 THR A 108 10.370 -12.141 2.939 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.445 -10.644 2.677 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.111 -11.009 4.286 1.00 0.00 H new ATOM 1572 N ALA A 109 6.527 -9.797 2.598 1.00 0.00 N ATOM 1573 CA ALA A 109 6.466 -8.550 1.784 1.00 0.00 C ATOM 1574 C ALA A 109 6.005 -7.381 2.657 1.00 0.00 C ATOM 1575 O ALA A 109 6.557 -6.300 2.607 1.00 0.00 O ATOM 1576 CB ALA A 109 5.477 -8.743 0.631 1.00 0.00 C ATOM 0 H ALA A 109 5.884 -10.535 2.310 1.00 0.00 H new ATOM 0 HA ALA A 109 7.457 -8.333 1.386 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.431 -7.832 0.035 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.807 -9.571 0.004 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.488 -8.964 1.033 1.00 0.00 H new ATOM 1582 N ALA A 110 4.991 -7.585 3.453 1.00 0.00 N ATOM 1583 CA ALA A 110 4.491 -6.481 4.320 1.00 0.00 C ATOM 1584 C ALA A 110 5.487 -6.218 5.453 1.00 0.00 C ATOM 1585 O ALA A 110 5.642 -5.101 5.906 1.00 0.00 O ATOM 1586 CB ALA A 110 3.135 -6.874 4.910 1.00 0.00 C ATOM 0 H ALA A 110 4.488 -8.468 3.540 1.00 0.00 H new ATOM 0 HA ALA A 110 4.382 -5.575 3.724 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.767 -6.068 5.545 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.425 -7.053 4.103 1.00 0.00 H new ATOM 0 HB3 ALA A 110 3.246 -7.781 5.504 1.00 0.00 H new ATOM 1592 N ASN A 111 6.161 -7.234 5.915 1.00 0.00 N ATOM 1593 CA ASN A 111 7.143 -7.037 7.021 1.00 0.00 C ATOM 1594 C ASN A 111 8.327 -6.204 6.519 1.00 0.00 C ATOM 1595 O ASN A 111 8.920 -5.443 7.259 1.00 0.00 O ATOM 1596 CB ASN A 111 7.645 -8.399 7.505 1.00 0.00 C ATOM 1597 CG ASN A 111 8.234 -8.258 8.909 1.00 0.00 C ATOM 1598 OD1 ASN A 111 9.412 -8.003 9.064 1.00 0.00 O ATOM 1599 ND2 ASN A 111 7.459 -8.416 9.947 1.00 0.00 N ATOM 0 H ASN A 111 6.075 -8.192 5.576 1.00 0.00 H new ATOM 0 HA ASN A 111 6.658 -6.513 7.845 1.00 0.00 H new ATOM 0 HB2 ASN A 111 6.826 -9.118 7.514 1.00 0.00 H new ATOM 0 HB3 ASN A 111 8.400 -8.784 6.820 1.00 0.00 H new ATOM 0 HD21 ASN A 111 7.842 -8.325 10.888 1.00 0.00 H new ATOM 0 HD22 ASN A 111 6.470 -8.630 9.817 1.00 0.00 H new ATOM 1606 N VAL A 112 8.679 -6.342 5.269 1.00 0.00 N ATOM 1607 CA VAL A 112 9.825 -5.559 4.727 1.00 0.00 C ATOM 1608 C VAL A 112 9.361 -4.134 4.403 1.00 0.00 C ATOM 1609 O VAL A 112 10.137 -3.198 4.431 1.00 0.00 O ATOM 1610 CB VAL A 112 10.361 -6.262 3.472 1.00 0.00 C ATOM 1611 CG1 VAL A 112 10.803 -5.244 2.410 1.00 0.00 C ATOM 1612 CG2 VAL A 112 11.559 -7.131 3.860 1.00 0.00 C ATOM 0 H VAL A 112 8.222 -6.963 4.601 1.00 0.00 H new ATOM 0 HA VAL A 112 10.626 -5.499 5.464 1.00 0.00 H new ATOM 0 HB VAL A 112 9.563 -6.874 3.052 1.00 0.00 H new ATOM 0 HG11 VAL A 112 11.178 -5.772 1.533 1.00 0.00 H new ATOM 0 HG12 VAL A 112 9.953 -4.624 2.124 1.00 0.00 H new ATOM 0 HG13 VAL A 112 11.592 -4.612 2.818 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.946 -7.634 2.974 1.00 0.00 H new ATOM 0 HG22 VAL A 112 12.339 -6.504 4.291 1.00 0.00 H new ATOM 0 HG23 VAL A 112 11.247 -7.875 4.592 1.00 0.00 H new ATOM 1622 N VAL A 113 8.107 -3.962 4.090 1.00 0.00 N ATOM 1623 CA VAL A 113 7.603 -2.599 3.761 1.00 0.00 C ATOM 1624 C VAL A 113 7.279 -1.844 5.051 1.00 0.00 C ATOM 1625 O VAL A 113 7.160 -0.635 5.060 1.00 0.00 O ATOM 1626 CB VAL A 113 6.336 -2.718 2.912 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.948 -1.338 2.379 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.594 -3.666 1.739 1.00 0.00 C ATOM 0 H VAL A 113 7.410 -4.705 4.048 1.00 0.00 H new ATOM 0 HA VAL A 113 8.368 -2.055 3.206 1.00 0.00 H new ATOM 0 HB VAL A 113 5.524 -3.112 3.524 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.045 -1.422 1.774 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.763 -0.664 3.215 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.759 -0.943 1.767 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.691 -3.751 1.134 1.00 0.00 H new ATOM 0 HG22 VAL A 113 7.406 -3.274 1.126 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.869 -4.650 2.120 1.00 0.00 H new ATOM 1638 N GLU A 114 7.130 -2.545 6.141 1.00 0.00 N ATOM 1639 CA GLU A 114 6.807 -1.865 7.426 1.00 0.00 C ATOM 1640 C GLU A 114 8.072 -1.233 8.009 1.00 0.00 C ATOM 1641 O GLU A 114 8.034 -0.165 8.587 1.00 0.00 O ATOM 1642 CB GLU A 114 6.247 -2.888 8.415 1.00 0.00 C ATOM 1643 CG GLU A 114 4.865 -2.434 8.889 1.00 0.00 C ATOM 1644 CD GLU A 114 3.988 -3.660 9.149 1.00 0.00 C ATOM 1645 OE1 GLU A 114 3.590 -4.293 8.185 1.00 0.00 O ATOM 1646 OE2 GLU A 114 3.729 -3.944 10.306 1.00 0.00 O ATOM 0 H GLU A 114 7.218 -3.560 6.197 1.00 0.00 H new ATOM 0 HA GLU A 114 6.066 -1.086 7.246 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.177 -3.867 7.942 1.00 0.00 H new ATOM 0 HB3 GLU A 114 6.919 -2.993 9.267 1.00 0.00 H new ATOM 0 HG2 GLU A 114 4.957 -1.840 9.798 1.00 0.00 H new ATOM 0 HG3 GLU A 114 4.402 -1.795 8.137 1.00 0.00 H new ATOM 1653 N LYS A 115 9.194 -1.884 7.868 1.00 0.00 N ATOM 1654 CA LYS A 115 10.459 -1.319 8.420 1.00 0.00 C ATOM 1655 C LYS A 115 10.900 -0.116 7.583 1.00 0.00 C ATOM 1656 O LYS A 115 11.256 0.920 8.110 1.00 0.00 O ATOM 1657 CB LYS A 115 11.551 -2.391 8.393 1.00 0.00 C ATOM 1658 CG LYS A 115 10.981 -3.722 8.896 1.00 0.00 C ATOM 1659 CD LYS A 115 10.302 -3.516 10.254 1.00 0.00 C ATOM 1660 CE LYS A 115 11.009 -4.361 11.315 1.00 0.00 C ATOM 1661 NZ LYS A 115 10.006 -4.878 12.290 1.00 0.00 N ATOM 0 H LYS A 115 9.290 -2.782 7.395 1.00 0.00 H new ATOM 0 HA LYS A 115 10.290 -0.997 9.447 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.934 -2.508 7.379 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.390 -2.085 9.017 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.263 -4.116 8.176 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.779 -4.459 8.986 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.335 -2.463 10.532 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.251 -3.797 10.192 1.00 0.00 H new ATOM 0 HE2 LYS A 115 11.534 -5.191 10.843 1.00 0.00 H new ATOM 0 HE3 LYS A 115 11.759 -3.762 11.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.487 -5.452 13.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.524 -4.079 12.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.307 -5.464 11.791 1.00 0.00 H new ATOM 1675 N LEU A 116 10.882 -0.236 6.283 1.00 0.00 N ATOM 1676 CA LEU A 116 11.302 0.913 5.433 1.00 0.00 C ATOM 1677 C LEU A 116 10.490 2.148 5.822 1.00 0.00 C ATOM 1678 O LEU A 116 10.976 3.262 5.786 1.00 0.00 O ATOM 1679 CB LEU A 116 11.059 0.586 3.959 1.00 0.00 C ATOM 1680 CG LEU A 116 11.885 1.535 3.088 1.00 0.00 C ATOM 1681 CD1 LEU A 116 12.486 0.762 1.914 1.00 0.00 C ATOM 1682 CD2 LEU A 116 10.987 2.652 2.555 1.00 0.00 C ATOM 0 H LEU A 116 10.597 -1.074 5.776 1.00 0.00 H new ATOM 0 HA LEU A 116 12.364 1.106 5.585 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.336 -0.448 3.754 1.00 0.00 H new ATOM 0 HB3 LEU A 116 10.000 0.686 3.722 1.00 0.00 H new ATOM 0 HG LEU A 116 12.687 1.967 3.686 1.00 0.00 H new ATOM 0 HD11 LEU A 116 13.074 1.440 1.295 1.00 0.00 H new ATOM 0 HD12 LEU A 116 13.128 -0.033 2.293 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.685 0.327 1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.576 3.328 1.935 1.00 0.00 H new ATOM 0 HD22 LEU A 116 10.183 2.220 1.959 1.00 0.00 H new ATOM 0 HD23 LEU A 116 10.560 3.206 3.391 1.00 0.00 H new ATOM 1694 N ALA A 117 9.254 1.964 6.199 1.00 0.00 N ATOM 1695 CA ALA A 117 8.425 3.134 6.591 1.00 0.00 C ATOM 1696 C ALA A 117 9.054 3.798 7.815 1.00 0.00 C ATOM 1697 O ALA A 117 9.065 5.002 7.939 1.00 0.00 O ATOM 1698 CB ALA A 117 7.004 2.678 6.925 1.00 0.00 C ATOM 0 H ALA A 117 8.786 1.059 6.252 1.00 0.00 H new ATOM 0 HA ALA A 117 8.381 3.845 5.766 1.00 0.00 H new ATOM 0 HB1 ALA A 117 6.403 3.541 7.211 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.560 2.200 6.051 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.035 1.967 7.751 1.00 0.00 H new ATOM 1704 N ASP A 118 9.583 3.020 8.718 1.00 0.00 N ATOM 1705 CA ASP A 118 10.219 3.607 9.933 1.00 0.00 C ATOM 1706 C ASP A 118 11.376 4.520 9.517 1.00 0.00 C ATOM 1707 O ASP A 118 11.794 5.385 10.260 1.00 0.00 O ATOM 1708 CB ASP A 118 10.756 2.482 10.821 1.00 0.00 C ATOM 1709 CG ASP A 118 10.214 2.650 12.243 1.00 0.00 C ATOM 1710 OD1 ASP A 118 9.054 2.336 12.455 1.00 0.00 O ATOM 1711 OD2 ASP A 118 10.969 3.088 13.096 1.00 0.00 O ATOM 0 H ASP A 118 9.603 2.001 8.668 1.00 0.00 H new ATOM 0 HA ASP A 118 9.478 4.187 10.484 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.458 1.514 10.419 1.00 0.00 H new ATOM 0 HB3 ASP A 118 11.846 2.501 10.831 1.00 0.00 H new ATOM 1716 N TYR A 119 11.904 4.325 8.339 1.00 0.00 N ATOM 1717 CA TYR A 119 13.042 5.175 7.881 1.00 0.00 C ATOM 1718 C TYR A 119 12.532 6.582 7.519 1.00 0.00 C ATOM 1719 O TYR A 119 13.172 7.573 7.812 1.00 0.00 O ATOM 1720 CB TYR A 119 13.731 4.488 6.676 1.00 0.00 C ATOM 1721 CG TYR A 119 13.628 5.322 5.412 1.00 0.00 C ATOM 1722 CD1 TYR A 119 14.285 6.555 5.331 1.00 0.00 C ATOM 1723 CD2 TYR A 119 12.881 4.856 4.324 1.00 0.00 C ATOM 1724 CE1 TYR A 119 14.195 7.323 4.163 1.00 0.00 C ATOM 1725 CE2 TYR A 119 12.790 5.624 3.157 1.00 0.00 C ATOM 1726 CZ TYR A 119 13.446 6.857 3.076 1.00 0.00 C ATOM 1727 OH TYR A 119 13.355 7.614 1.927 1.00 0.00 O ATOM 0 H TYR A 119 11.597 3.615 7.674 1.00 0.00 H new ATOM 0 HA TYR A 119 13.776 5.287 8.679 1.00 0.00 H new ATOM 0 HB2 TYR A 119 14.781 4.313 6.910 1.00 0.00 H new ATOM 0 HB3 TYR A 119 13.275 3.513 6.505 1.00 0.00 H new ATOM 0 HD1 TYR A 119 14.862 6.915 6.170 1.00 0.00 H new ATOM 0 HD2 TYR A 119 12.375 3.904 4.385 1.00 0.00 H new ATOM 0 HE1 TYR A 119 14.703 8.274 4.101 1.00 0.00 H new ATOM 0 HE2 TYR A 119 12.213 5.264 2.318 1.00 0.00 H new ATOM 0 HH TYR A 119 12.799 7.146 1.270 1.00 0.00 H new ATOM 1737 N LEU A 120 11.398 6.676 6.877 1.00 0.00 N ATOM 1738 CA LEU A 120 10.869 8.020 6.490 1.00 0.00 C ATOM 1739 C LEU A 120 10.164 8.685 7.680 1.00 0.00 C ATOM 1740 O LEU A 120 10.223 9.885 7.854 1.00 0.00 O ATOM 1741 CB LEU A 120 9.870 7.857 5.343 1.00 0.00 C ATOM 1742 CG LEU A 120 10.538 8.254 4.027 1.00 0.00 C ATOM 1743 CD1 LEU A 120 9.591 7.954 2.864 1.00 0.00 C ATOM 1744 CD2 LEU A 120 10.858 9.750 4.048 1.00 0.00 C ATOM 0 H LEU A 120 10.816 5.884 6.604 1.00 0.00 H new ATOM 0 HA LEU A 120 11.703 8.649 6.177 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.525 6.824 5.291 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.992 8.478 5.520 1.00 0.00 H new ATOM 0 HG LEU A 120 11.460 7.686 3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.067 8.237 1.925 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.361 6.889 2.848 1.00 0.00 H new ATOM 0 HD13 LEU A 120 8.669 8.522 2.989 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.334 10.033 3.109 1.00 0.00 H new ATOM 0 HD22 LEU A 120 9.936 10.318 4.173 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.532 9.966 4.877 1.00 0.00 H new ATOM 1756 N ILE A 121 9.486 7.919 8.490 1.00 0.00 N ATOM 1757 CA ILE A 121 8.767 8.508 9.658 1.00 0.00 C ATOM 1758 C ILE A 121 9.779 9.122 10.627 1.00 0.00 C ATOM 1759 O ILE A 121 9.449 9.977 11.426 1.00 0.00 O ATOM 1760 CB ILE A 121 7.963 7.411 10.367 1.00 0.00 C ATOM 1761 CG1 ILE A 121 6.703 7.101 9.552 1.00 0.00 C ATOM 1762 CG2 ILE A 121 7.552 7.886 11.764 1.00 0.00 C ATOM 1763 CD1 ILE A 121 6.804 5.695 8.954 1.00 0.00 C ATOM 0 H ILE A 121 9.398 6.907 8.394 1.00 0.00 H new ATOM 0 HA ILE A 121 8.087 9.287 9.314 1.00 0.00 H new ATOM 0 HB ILE A 121 8.579 6.516 10.456 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.821 7.173 10.188 1.00 0.00 H new ATOM 0 HG13 ILE A 121 6.583 7.837 8.757 1.00 0.00 H new ATOM 0 HG21 ILE A 121 6.981 7.102 12.262 1.00 0.00 H new ATOM 0 HG22 ILE A 121 8.444 8.112 12.348 1.00 0.00 H new ATOM 0 HG23 ILE A 121 6.938 8.782 11.677 1.00 0.00 H new ATOM 0 HD11 ILE A 121 5.905 5.480 8.376 1.00 0.00 H new ATOM 0 HD12 ILE A 121 7.677 5.638 8.303 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.902 4.964 9.757 1.00 0.00 H new ATOM 1775 N GLY A 122 11.008 8.697 10.564 1.00 0.00 N ATOM 1776 CA GLY A 122 12.037 9.263 11.481 1.00 0.00 C ATOM 1777 C GLY A 122 12.818 10.356 10.754 1.00 0.00 C ATOM 1778 O GLY A 122 13.933 10.679 11.114 1.00 0.00 O ATOM 0 H GLY A 122 11.346 7.983 9.919 1.00 0.00 H new ATOM 0 HA2 GLY A 122 11.561 9.672 12.372 1.00 0.00 H new ATOM 0 HA3 GLY A 122 12.715 8.477 11.815 1.00 0.00 H new ATOM 1782 N GLN A 123 12.245 10.929 9.730 1.00 0.00 N ATOM 1783 CA GLN A 123 12.959 11.999 8.978 1.00 0.00 C ATOM 1784 C GLN A 123 11.959 12.798 8.137 1.00 0.00 C ATOM 1785 O GLN A 123 11.496 13.847 8.536 1.00 0.00 O ATOM 1786 CB GLN A 123 14.004 11.362 8.059 1.00 0.00 C ATOM 1787 CG GLN A 123 15.188 10.866 8.893 1.00 0.00 C ATOM 1788 CD GLN A 123 16.396 10.632 7.984 1.00 0.00 C ATOM 1789 OE1 GLN A 123 16.442 9.662 7.254 1.00 0.00 O ATOM 1790 NE2 GLN A 123 17.383 11.486 7.998 1.00 0.00 N ATOM 0 H GLN A 123 11.313 10.702 9.382 1.00 0.00 H new ATOM 0 HA GLN A 123 13.450 12.669 9.683 1.00 0.00 H new ATOM 0 HB2 GLN A 123 13.561 10.532 7.508 1.00 0.00 H new ATOM 0 HB3 GLN A 123 14.345 12.088 7.321 1.00 0.00 H new ATOM 0 HG2 GLN A 123 15.436 11.598 9.662 1.00 0.00 H new ATOM 0 HG3 GLN A 123 14.922 9.942 9.406 1.00 0.00 H new ATOM 0 HE21 GLN A 123 17.344 12.300 8.611 1.00 0.00 H new ATOM 0 HE22 GLN A 123 18.193 11.339 7.396 1.00 0.00 H new ATOM 1799 N GLY A 124 11.631 12.314 6.969 1.00 0.00 N ATOM 1800 CA GLY A 124 10.671 13.053 6.096 1.00 0.00 C ATOM 1801 C GLY A 124 9.255 12.498 6.280 1.00 0.00 C ATOM 1802 O GLY A 124 8.624 12.065 5.337 1.00 0.00 O ATOM 0 H GLY A 124 11.985 11.440 6.581 1.00 0.00 H new ATOM 0 HA2 GLY A 124 10.688 14.115 6.341 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.973 12.962 5.053 1.00 0.00 H new ATOM 1806 N PHE A 125 8.751 12.516 7.487 1.00 0.00 N ATOM 1807 CA PHE A 125 7.373 11.998 7.739 1.00 0.00 C ATOM 1808 C PHE A 125 7.130 10.734 6.911 1.00 0.00 C ATOM 1809 O PHE A 125 6.329 10.797 5.992 1.00 0.00 O ATOM 1810 CB PHE A 125 6.343 13.065 7.356 1.00 0.00 C ATOM 1811 CG PHE A 125 6.918 14.437 7.627 1.00 0.00 C ATOM 1812 CD1 PHE A 125 7.677 15.084 6.644 1.00 0.00 C ATOM 1813 CD2 PHE A 125 6.699 15.057 8.863 1.00 0.00 C ATOM 1814 CE1 PHE A 125 8.215 16.351 6.897 1.00 0.00 C ATOM 1815 CE2 PHE A 125 7.236 16.323 9.116 1.00 0.00 C ATOM 1816 CZ PHE A 125 7.995 16.971 8.133 1.00 0.00 C ATOM 1817 OXT PHE A 125 7.751 9.727 7.207 1.00 0.00 O ATOM 0 H PHE A 125 9.236 12.869 8.312 1.00 0.00 H new ATOM 0 HA PHE A 125 7.272 11.758 8.797 1.00 0.00 H new ATOM 0 HB2 PHE A 125 6.079 12.970 6.303 1.00 0.00 H new ATOM 0 HB3 PHE A 125 5.426 12.923 7.928 1.00 0.00 H new ATOM 0 HD1 PHE A 125 7.847 14.605 5.691 1.00 0.00 H new ATOM 0 HD2 PHE A 125 6.115 14.557 9.622 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.800 16.851 6.139 1.00 0.00 H new ATOM 0 HE2 PHE A 125 7.066 16.801 10.069 1.00 0.00 H new ATOM 0 HZ PHE A 125 8.410 17.949 8.328 1.00 0.00 H new