USER MOD reduce.3.24.130724 H: found=0, std=0, add=1137, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 924 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 61 GLN : amide:sc= -0.0933 X(o=-0.093,f=-0.43) USER MOD Set 1.2: A 66 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 167:sc= 0.0609 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= -0.134 K(o=-0.13,f=-0.9) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -6:sc= 0.148 USER MOD Single : A 15 ASN :FLIP amide:sc= -0.12 F(o=-1.4,f=-0.12) USER MOD Single : A 16 SER OG : rot -129:sc= 0.0337 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -1.24 K(o=-1.2,f=-2.5) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -170:sc= -0.0271 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 155:sc= 0.0475 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -146:sc= 0.023 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.269 F(o=-0.92,f=-0.27) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.341 K(o=-0.34,f=-5.6!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 103:sc= 0.36 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 94 SER OG : rot 180:sc= 0.00207 USER MOD Single : A 96 ASN : amide:sc= -0.101 K(o=-0.1,f=-1.2!) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 58:sc= 0.0453 USER MOD Single : A 114 SER OG : rot -30:sc= 0.0144 USER MOD Single : A 115 ASN : amide:sc= -0.124 K(o=-0.12,f=-1.1) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 124 GLN : amide:sc= -0.042 K(o=-0.042,f=-1.5!) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc=-0.00767 X(o=-0.0077,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -15.748 15.223 16.885 1.00 0.00 N ATOM 2 CA SER A 1 -15.332 15.528 15.498 1.00 0.00 C ATOM 3 C SER A 1 -13.878 15.136 15.251 1.00 0.00 C ATOM 4 O SER A 1 -12.976 15.614 15.945 1.00 0.00 O ATOM 5 CB SER A 1 -15.531 17.008 15.160 1.00 0.00 C ATOM 6 OG SER A 1 -16.926 17.278 15.137 1.00 0.00 O ATOM 0 H1 SER A 1 -16.741 15.502 17.019 1.00 0.00 H new ATOM 0 H2 SER A 1 -15.648 14.203 17.061 1.00 0.00 H new ATOM 0 H3 SER A 1 -15.148 15.750 17.551 1.00 0.00 H new ATOM 0 HA SER A 1 -15.971 14.934 14.844 1.00 0.00 H new ATOM 0 HB2 SER A 1 -15.035 17.636 15.900 1.00 0.00 H new ATOM 0 HB3 SER A 1 -15.084 17.240 14.194 1.00 0.00 H new ATOM 0 HG SER A 1 -17.073 18.223 14.924 1.00 0.00 H new ATOM 11 N LYS A 2 -13.641 14.265 14.257 1.00 0.00 N ATOM 12 CA LYS A 2 -12.303 13.945 13.706 1.00 0.00 C ATOM 13 C LYS A 2 -11.844 15.003 12.679 1.00 0.00 C ATOM 14 O LYS A 2 -12.534 16.008 12.477 1.00 0.00 O ATOM 15 CB LYS A 2 -12.339 12.527 13.084 1.00 0.00 C ATOM 16 CG LYS A 2 -11.168 11.651 13.571 1.00 0.00 C ATOM 17 CD LYS A 2 -11.444 10.964 14.925 1.00 0.00 C ATOM 18 CE LYS A 2 -10.418 11.339 16.005 1.00 0.00 C ATOM 19 NZ LYS A 2 -10.408 10.341 17.108 1.00 0.00 N ATOM 0 H LYS A 2 -14.391 13.747 13.798 1.00 0.00 H new ATOM 0 HA LYS A 2 -11.572 13.962 14.514 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -13.283 12.044 13.338 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -12.304 12.607 11.998 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -10.956 10.889 12.821 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -10.274 12.268 13.660 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -12.442 11.237 15.268 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -11.439 9.883 14.786 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -9.425 11.403 15.560 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -10.652 12.325 16.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -9.706 10.620 17.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -11.350 10.299 17.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -10.161 9.405 16.727 1.00 0.00 H new ATOM 29 N SER A 3 -10.699 14.786 12.021 1.00 0.00 N ATOM 30 CA SER A 3 -10.167 15.687 10.989 1.00 0.00 C ATOM 31 C SER A 3 -10.938 15.559 9.653 1.00 0.00 C ATOM 32 O SER A 3 -11.644 16.489 9.261 1.00 0.00 O ATOM 33 CB SER A 3 -8.656 15.458 10.827 1.00 0.00 C ATOM 34 OG SER A 3 -8.021 16.682 10.493 1.00 0.00 O ATOM 0 H SER A 3 -10.109 13.972 12.191 1.00 0.00 H new ATOM 0 HA SER A 3 -10.317 16.717 11.314 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.237 15.060 11.751 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.472 14.717 10.049 1.00 0.00 H new ATOM 0 HG SER A 3 -7.051 16.587 10.598 1.00 0.00 H new ATOM 39 N ILE A 4 -10.853 14.399 8.979 1.00 0.00 N ATOM 40 CA ILE A 4 -11.395 14.167 7.617 1.00 0.00 C ATOM 41 C ILE A 4 -11.888 12.720 7.401 1.00 0.00 C ATOM 42 O ILE A 4 -13.004 12.534 6.918 1.00 0.00 O ATOM 43 CB ILE A 4 -10.371 14.515 6.493 1.00 0.00 C ATOM 44 CG1 ILE A 4 -8.982 15.061 6.903 1.00 0.00 C ATOM 45 CG2 ILE A 4 -11.041 15.436 5.466 1.00 0.00 C ATOM 46 CD1 ILE A 4 -8.808 16.556 7.154 1.00 0.00 C ATOM 0 H ILE A 4 -10.397 13.575 9.369 1.00 0.00 H new ATOM 0 HA ILE A 4 -12.247 14.844 7.548 1.00 0.00 H new ATOM 0 HB ILE A 4 -10.110 13.544 6.073 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.681 14.540 7.812 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -8.276 14.776 6.123 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -10.329 15.682 4.678 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -11.903 14.930 5.031 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -11.369 16.352 5.958 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -7.774 16.760 7.431 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -9.057 17.108 6.248 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -9.469 16.869 7.963 1.00 0.00 H new ATOM 57 N VAL A 5 -11.091 11.709 7.799 1.00 0.00 N ATOM 58 CA VAL A 5 -11.399 10.258 7.756 1.00 0.00 C ATOM 59 C VAL A 5 -11.687 9.726 6.336 1.00 0.00 C ATOM 60 O VAL A 5 -12.818 9.773 5.843 1.00 0.00 O ATOM 61 CB VAL A 5 -12.480 9.885 8.804 1.00 0.00 C ATOM 62 CG1 VAL A 5 -12.966 8.434 8.709 1.00 0.00 C ATOM 63 CG2 VAL A 5 -11.916 10.111 10.217 1.00 0.00 C ATOM 0 H VAL A 5 -10.162 11.888 8.181 1.00 0.00 H new ATOM 0 HA VAL A 5 -10.490 9.730 8.046 1.00 0.00 H new ATOM 0 HB VAL A 5 -13.337 10.526 8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -13.720 8.252 9.475 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -13.399 8.259 7.724 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -12.125 7.758 8.861 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -12.673 9.850 10.957 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -11.036 9.485 10.362 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.639 11.159 10.335 1.00 0.00 H new ATOM 73 N LEU A 6 -10.648 9.200 5.678 1.00 0.00 N ATOM 74 CA LEU A 6 -10.733 8.428 4.427 1.00 0.00 C ATOM 75 C LEU A 6 -11.534 7.119 4.577 1.00 0.00 C ATOM 76 O LEU A 6 -11.815 6.646 5.683 1.00 0.00 O ATOM 77 CB LEU A 6 -9.311 8.142 3.886 1.00 0.00 C ATOM 78 CG LEU A 6 -9.121 8.769 2.493 1.00 0.00 C ATOM 79 CD1 LEU A 6 -8.916 10.283 2.583 1.00 0.00 C ATOM 80 CD2 LEU A 6 -7.902 8.166 1.804 1.00 0.00 C ATOM 0 H LEU A 6 -9.689 9.302 6.011 1.00 0.00 H new ATOM 0 HA LEU A 6 -11.281 9.039 3.710 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.567 8.543 4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -9.147 7.066 3.831 1.00 0.00 H new ATOM 0 HG LEU A 6 -10.026 8.561 1.922 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -8.785 10.693 1.581 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -9.787 10.741 3.051 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -8.029 10.495 3.180 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -7.779 8.618 0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -7.013 8.357 2.405 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -8.041 7.091 1.694 1.00 0.00 H new ATOM 91 N GLU A 7 -11.883 6.512 3.443 1.00 0.00 N ATOM 92 CA GLU A 7 -12.659 5.270 3.385 1.00 0.00 C ATOM 93 C GLU A 7 -11.771 4.028 3.593 1.00 0.00 C ATOM 94 O GLU A 7 -10.631 4.001 3.109 1.00 0.00 O ATOM 95 CB GLU A 7 -13.396 5.172 2.036 1.00 0.00 C ATOM 96 CG GLU A 7 -14.476 6.258 1.877 1.00 0.00 C ATOM 97 CD GLU A 7 -13.938 7.525 1.179 1.00 0.00 C ATOM 98 OE1 GLU A 7 -13.805 7.518 -0.070 1.00 0.00 O ATOM 99 OE2 GLU A 7 -13.649 8.533 1.865 1.00 0.00 O ATOM 0 H GLU A 7 -11.631 6.874 2.523 1.00 0.00 H new ATOM 0 HA GLU A 7 -13.386 5.296 4.197 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -12.674 5.259 1.224 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.858 4.189 1.948 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.310 5.856 1.302 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -14.866 6.525 2.859 1.00 0.00 H new ATOM 104 N PRO A 8 -12.268 2.974 4.273 1.00 0.00 N ATOM 105 CA PRO A 8 -11.548 1.716 4.411 1.00 0.00 C ATOM 106 C PRO A 8 -11.493 0.961 3.078 1.00 0.00 C ATOM 107 O PRO A 8 -12.430 0.989 2.274 1.00 0.00 O ATOM 108 CB PRO A 8 -12.294 0.923 5.484 1.00 0.00 C ATOM 109 CG PRO A 8 -13.733 1.431 5.383 1.00 0.00 C ATOM 110 CD PRO A 8 -13.591 2.870 4.873 1.00 0.00 C ATOM 0 HA PRO A 8 -10.509 1.878 4.699 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -12.235 -0.150 5.301 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -11.876 1.101 6.475 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -14.323 0.822 4.698 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -14.235 1.399 6.350 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -14.366 3.100 4.142 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -13.702 3.583 5.690 1.00 0.00 H new ATOM 115 N ILE A 9 -10.385 0.259 2.860 1.00 0.00 N ATOM 116 CA ILE A 9 -10.134 -0.556 1.665 1.00 0.00 C ATOM 117 C ILE A 9 -11.002 -1.814 1.750 1.00 0.00 C ATOM 118 O ILE A 9 -10.853 -2.606 2.682 1.00 0.00 O ATOM 119 CB ILE A 9 -8.633 -0.912 1.544 1.00 0.00 C ATOM 120 CG1 ILE A 9 -7.676 0.269 1.859 1.00 0.00 C ATOM 121 CG2 ILE A 9 -8.310 -1.551 0.183 1.00 0.00 C ATOM 122 CD1 ILE A 9 -7.791 1.461 0.917 1.00 0.00 C ATOM 0 H ILE A 9 -9.612 0.238 3.526 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.397 0.006 0.769 1.00 0.00 H new ATOM 0 HB ILE A 9 -8.448 -1.653 2.322 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -7.867 0.610 2.877 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -6.650 -0.098 1.833 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -7.247 -1.787 0.135 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.891 -2.466 0.064 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.563 -0.854 -0.616 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.083 2.233 1.219 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.568 1.143 -0.101 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.804 1.861 0.959 1.00 0.00 H new ATOM 133 N TYR A 10 -11.911 -2.002 0.795 1.00 0.00 N ATOM 134 CA TYR A 10 -12.860 -3.125 0.776 1.00 0.00 C ATOM 135 C TYR A 10 -12.321 -4.280 -0.092 1.00 0.00 C ATOM 136 O TYR A 10 -12.954 -4.684 -1.067 1.00 0.00 O ATOM 137 CB TYR A 10 -14.244 -2.597 0.353 1.00 0.00 C ATOM 138 CG TYR A 10 -15.405 -3.354 0.990 1.00 0.00 C ATOM 139 CD1 TYR A 10 -15.821 -4.608 0.495 1.00 0.00 C ATOM 140 CD2 TYR A 10 -16.066 -2.797 2.105 1.00 0.00 C ATOM 141 CE1 TYR A 10 -16.892 -5.292 1.102 1.00 0.00 C ATOM 142 CE2 TYR A 10 -17.145 -3.472 2.708 1.00 0.00 C ATOM 143 CZ TYR A 10 -17.563 -4.726 2.208 1.00 0.00 C ATOM 144 OH TYR A 10 -18.607 -5.393 2.777 1.00 0.00 O ATOM 0 H TYR A 10 -12.014 -1.372 -0.001 1.00 0.00 H new ATOM 0 HA TYR A 10 -12.976 -3.556 1.770 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -14.319 -1.543 0.619 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -14.332 -2.659 -0.732 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -15.316 -5.045 -0.353 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -15.742 -1.845 2.499 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -17.201 -6.254 0.720 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -17.653 -3.031 3.553 1.00 0.00 H new ATOM 0 HH TYR A 10 -18.959 -4.870 3.527 1.00 0.00 H new ATOM 153 N TRP A 11 -11.099 -4.754 0.208 1.00 0.00 N ATOM 154 CA TRP A 11 -10.246 -5.656 -0.604 1.00 0.00 C ATOM 155 C TRP A 11 -9.809 -5.045 -1.949 1.00 0.00 C ATOM 156 O TRP A 11 -8.630 -4.749 -2.144 1.00 0.00 O ATOM 157 CB TRP A 11 -10.958 -7.012 -0.779 1.00 0.00 C ATOM 158 CG TRP A 11 -10.272 -8.147 -1.477 1.00 0.00 C ATOM 159 CD1 TRP A 11 -8.949 -8.273 -1.739 1.00 0.00 C ATOM 160 CD2 TRP A 11 -10.896 -9.359 -2.005 1.00 0.00 C ATOM 161 NE1 TRP A 11 -8.717 -9.483 -2.365 1.00 0.00 N ATOM 162 CE2 TRP A 11 -9.886 -10.197 -2.559 1.00 0.00 C ATOM 163 CE3 TRP A 11 -12.232 -9.830 -2.079 1.00 0.00 C ATOM 164 CZ2 TRP A 11 -10.179 -11.438 -3.145 1.00 0.00 C ATOM 165 CZ3 TRP A 11 -12.539 -11.066 -2.670 1.00 0.00 C ATOM 166 CH2 TRP A 11 -11.513 -11.878 -3.198 1.00 0.00 C ATOM 0 H TRP A 11 -10.644 -4.502 1.086 1.00 0.00 H new ATOM 0 HA TRP A 11 -9.314 -5.811 -0.061 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -11.230 -7.364 0.216 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -11.888 -6.820 -1.314 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -8.193 -7.541 -1.496 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -7.794 -9.811 -2.650 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -13.029 -9.225 -1.672 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -9.387 -12.049 -3.551 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -13.566 -11.397 -2.721 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -11.752 -12.834 -3.641 1.00 0.00 H new ATOM 176 N ASN A 12 -10.774 -4.844 -2.846 1.00 0.00 N ATOM 177 CA ASN A 12 -10.705 -4.265 -4.196 1.00 0.00 C ATOM 178 C ASN A 12 -12.124 -4.286 -4.820 1.00 0.00 C ATOM 179 O ASN A 12 -13.055 -4.850 -4.238 1.00 0.00 O ATOM 180 CB ASN A 12 -9.689 -5.047 -5.067 1.00 0.00 C ATOM 181 CG ASN A 12 -8.311 -4.394 -5.149 1.00 0.00 C ATOM 182 OD1 ASN A 12 -8.163 -3.180 -5.174 1.00 0.00 O ATOM 183 ND2 ASN A 12 -7.265 -5.179 -5.246 1.00 0.00 N ATOM 0 H ASN A 12 -11.733 -5.112 -2.623 1.00 0.00 H new ATOM 0 HA ASN A 12 -10.358 -3.233 -4.143 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -9.579 -6.054 -4.664 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -10.092 -5.149 -6.075 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -6.333 -4.777 -5.342 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -7.384 -6.192 -5.226 1.00 0.00 H new ATOM 189 N SER A 13 -12.272 -3.693 -6.011 1.00 0.00 N ATOM 190 CA SER A 13 -13.522 -3.556 -6.783 1.00 0.00 C ATOM 191 C SER A 13 -14.409 -2.430 -6.226 1.00 0.00 C ATOM 192 O SER A 13 -14.676 -2.381 -5.023 1.00 0.00 O ATOM 193 CB SER A 13 -14.295 -4.885 -6.866 1.00 0.00 C ATOM 194 OG SER A 13 -15.070 -4.930 -8.058 1.00 0.00 O ATOM 0 H SER A 13 -11.479 -3.270 -6.493 1.00 0.00 H new ATOM 0 HA SER A 13 -13.239 -3.282 -7.799 1.00 0.00 H new ATOM 0 HB2 SER A 13 -13.597 -5.722 -6.846 1.00 0.00 H new ATOM 0 HB3 SER A 13 -14.945 -4.991 -5.997 1.00 0.00 H new ATOM 0 HG SER A 13 -15.556 -5.780 -8.101 1.00 0.00 H new ATOM 199 N SER A 14 -14.823 -1.500 -7.098 1.00 0.00 N ATOM 200 CA SER A 14 -15.611 -0.280 -6.805 1.00 0.00 C ATOM 201 C SER A 14 -15.184 0.563 -5.576 1.00 0.00 C ATOM 202 O SER A 14 -15.985 1.304 -4.997 1.00 0.00 O ATOM 203 CB SER A 14 -17.117 -0.589 -6.812 1.00 0.00 C ATOM 204 OG SER A 14 -17.534 -1.437 -5.750 1.00 0.00 O ATOM 0 H SER A 14 -14.606 -1.579 -8.092 1.00 0.00 H new ATOM 0 HA SER A 14 -15.370 0.391 -7.629 1.00 0.00 H new ATOM 0 HB2 SER A 14 -17.671 0.348 -6.755 1.00 0.00 H new ATOM 0 HB3 SER A 14 -17.378 -1.056 -7.761 1.00 0.00 H new ATOM 0 HG SER A 14 -16.749 -1.755 -5.258 1.00 0.00 H new ATOM 209 N ASN A 15 -13.908 0.481 -5.193 1.00 0.00 N ATOM 210 CA ASN A 15 -13.329 1.074 -3.980 1.00 0.00 C ATOM 211 C ASN A 15 -12.523 2.361 -4.294 1.00 0.00 C ATOM 212 O ASN A 15 -12.080 2.565 -5.424 1.00 0.00 O ATOM 213 CB ASN A 15 -12.465 -0.026 -3.324 1.00 0.00 C ATOM 214 CG ASN A 15 -11.915 0.411 -1.988 1.00 0.00 C ATOM 215 OD1 ASN A 15 -10.626 0.315 -1.790 1.00 0.00 O flip ATOM 216 ND2 ASN A 15 -12.624 0.888 -1.122 1.00 0.00 N flip ATOM 0 H ASN A 15 -13.215 -0.024 -5.745 1.00 0.00 H new ATOM 0 HA ASN A 15 -14.109 1.400 -3.292 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -13.064 -0.927 -3.193 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -11.641 -0.285 -3.989 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -13.630 0.965 -1.272 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -12.212 1.211 -0.246 1.00 0.00 H new ATOM 222 N SER A 16 -12.257 3.221 -3.307 1.00 0.00 N ATOM 223 CA SER A 16 -11.485 4.474 -3.499 1.00 0.00 C ATOM 224 C SER A 16 -10.001 4.245 -3.848 1.00 0.00 C ATOM 225 O SER A 16 -9.420 5.020 -4.611 1.00 0.00 O ATOM 226 CB SER A 16 -11.612 5.373 -2.264 1.00 0.00 C ATOM 227 OG SER A 16 -12.967 5.800 -2.189 1.00 0.00 O ATOM 0 H SER A 16 -12.567 3.077 -2.346 1.00 0.00 H new ATOM 0 HA SER A 16 -11.924 4.970 -4.364 1.00 0.00 H new ATOM 0 HB2 SER A 16 -11.330 4.829 -1.362 1.00 0.00 H new ATOM 0 HB3 SER A 16 -10.943 6.230 -2.342 1.00 0.00 H new ATOM 0 HG SER A 16 -12.998 6.775 -2.090 1.00 0.00 H new ATOM 232 N LYS A 17 -9.397 3.156 -3.347 1.00 0.00 N ATOM 233 CA LYS A 17 -8.038 2.686 -3.705 1.00 0.00 C ATOM 234 C LYS A 17 -7.992 1.830 -4.975 1.00 0.00 C ATOM 235 O LYS A 17 -6.901 1.540 -5.464 1.00 0.00 O ATOM 236 CB LYS A 17 -7.483 1.921 -2.493 1.00 0.00 C ATOM 237 CG LYS A 17 -6.154 1.136 -2.574 1.00 0.00 C ATOM 238 CD LYS A 17 -6.296 -0.338 -2.986 1.00 0.00 C ATOM 239 CE LYS A 17 -5.119 -1.156 -2.426 1.00 0.00 C ATOM 240 NZ LYS A 17 -4.533 -2.039 -3.464 1.00 0.00 N ATOM 0 H LYS A 17 -9.851 2.555 -2.659 1.00 0.00 H new ATOM 0 HA LYS A 17 -7.421 3.553 -3.941 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -7.375 2.644 -1.684 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -8.252 1.212 -2.187 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.497 1.635 -3.286 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.663 1.181 -1.602 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -7.238 -0.739 -2.613 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -6.322 -0.420 -4.073 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -4.353 -0.481 -2.045 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -5.460 -1.758 -1.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -3.742 -2.577 -3.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -5.259 -2.699 -3.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -4.186 -1.461 -4.256 1.00 0.00 H new ATOM 250 N PHE A 18 -9.145 1.383 -5.491 1.00 0.00 N ATOM 251 CA PHE A 18 -9.257 0.543 -6.697 1.00 0.00 C ATOM 252 C PHE A 18 -8.693 1.277 -7.918 1.00 0.00 C ATOM 253 O PHE A 18 -9.378 2.094 -8.537 1.00 0.00 O ATOM 254 CB PHE A 18 -10.714 0.117 -6.920 1.00 0.00 C ATOM 255 CG PHE A 18 -10.912 -0.829 -8.082 1.00 0.00 C ATOM 256 CD1 PHE A 18 -10.271 -2.086 -8.093 1.00 0.00 C ATOM 257 CD2 PHE A 18 -11.747 -0.465 -9.158 1.00 0.00 C ATOM 258 CE1 PHE A 18 -10.493 -2.982 -9.152 1.00 0.00 C ATOM 259 CE2 PHE A 18 -11.962 -1.363 -10.218 1.00 0.00 C ATOM 260 CZ PHE A 18 -11.346 -2.628 -10.213 1.00 0.00 C ATOM 0 H PHE A 18 -10.050 1.600 -5.073 1.00 0.00 H new ATOM 0 HA PHE A 18 -8.665 -0.360 -6.552 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -11.085 -0.358 -6.012 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -11.320 1.008 -7.084 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -9.608 -2.360 -7.285 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -12.222 0.505 -9.168 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -10.007 -3.946 -9.152 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -12.603 -1.081 -11.040 1.00 0.00 H new ATOM 0 HZ PHE A 18 -11.527 -3.323 -11.019 1.00 0.00 H new ATOM 269 N LEU A 19 -7.421 1.000 -8.198 1.00 0.00 N ATOM 270 CA LEU A 19 -6.519 1.721 -9.094 1.00 0.00 C ATOM 271 C LEU A 19 -7.197 2.302 -10.361 1.00 0.00 C ATOM 272 O LEU A 19 -7.304 1.599 -11.370 1.00 0.00 O ATOM 273 CB LEU A 19 -5.282 0.842 -9.364 1.00 0.00 C ATOM 274 CG LEU A 19 -5.568 -0.574 -9.900 1.00 0.00 C ATOM 275 CD1 LEU A 19 -4.563 -0.876 -10.999 1.00 0.00 C ATOM 276 CD2 LEU A 19 -5.365 -1.627 -8.810 1.00 0.00 C ATOM 0 H LEU A 19 -6.957 0.200 -7.769 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.186 2.630 -8.593 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.642 1.358 -10.080 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.715 0.751 -8.437 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.598 -0.607 -10.255 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.746 -1.875 -11.395 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.668 -0.144 -11.800 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.553 -0.826 -10.592 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -5.574 -2.617 -9.217 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.335 -1.590 -8.456 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.042 -1.426 -7.979 1.00 0.00 H new ATOM 287 N PRO A 20 -7.645 3.582 -10.353 1.00 0.00 N ATOM 288 CA PRO A 20 -8.468 4.158 -11.420 1.00 0.00 C ATOM 289 C PRO A 20 -7.646 4.579 -12.664 1.00 0.00 C ATOM 290 O PRO A 20 -8.204 5.100 -13.631 1.00 0.00 O ATOM 291 CB PRO A 20 -9.189 5.344 -10.765 1.00 0.00 C ATOM 292 CG PRO A 20 -8.248 5.808 -9.653 1.00 0.00 C ATOM 293 CD PRO A 20 -7.456 4.555 -9.283 1.00 0.00 C ATOM 0 HA PRO A 20 -9.169 3.424 -11.817 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -9.374 6.141 -11.485 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -10.158 5.046 -10.364 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -7.591 6.607 -9.995 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -8.802 6.195 -8.798 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -6.399 4.792 -9.163 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -7.802 4.150 -8.332 1.00 0.00 H new ATOM 298 N GLY A 21 -6.321 4.377 -12.637 1.00 0.00 N ATOM 299 CA GLY A 21 -5.337 4.749 -13.679 1.00 0.00 C ATOM 300 C GLY A 21 -3.971 5.190 -13.121 1.00 0.00 C ATOM 301 O GLY A 21 -3.008 5.313 -13.886 1.00 0.00 O ATOM 0 H GLY A 21 -5.874 3.922 -11.841 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -5.189 3.899 -14.345 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.750 5.558 -14.282 1.00 0.00 H new ATOM 304 N GLN A 22 -3.884 5.412 -11.801 1.00 0.00 N ATOM 305 CA GLN A 22 -2.682 5.793 -11.035 1.00 0.00 C ATOM 306 C GLN A 22 -2.521 5.011 -9.701 1.00 0.00 C ATOM 307 O GLN A 22 -1.443 5.045 -9.109 1.00 0.00 O ATOM 308 CB GLN A 22 -2.720 7.333 -10.841 1.00 0.00 C ATOM 309 CG GLN A 22 -1.974 7.882 -9.608 1.00 0.00 C ATOM 310 CD GLN A 22 -2.043 9.405 -9.490 1.00 0.00 C ATOM 311 OE1 GLN A 22 -1.048 10.111 -9.561 1.00 0.00 O ATOM 312 NE2 GLN A 22 -3.219 9.966 -9.295 1.00 0.00 N ATOM 0 H GLN A 22 -4.703 5.325 -11.199 1.00 0.00 H new ATOM 0 HA GLN A 22 -1.791 5.514 -11.597 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -2.301 7.801 -11.732 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -3.763 7.645 -10.778 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -2.396 7.435 -8.708 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -0.929 7.575 -9.657 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -4.056 9.387 -9.234 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -3.292 10.979 -9.205 1.00 0.00 H new ATOM 319 N GLY A 23 -3.558 4.316 -9.211 1.00 0.00 N ATOM 320 CA GLY A 23 -3.518 3.570 -7.945 1.00 0.00 C ATOM 321 C GLY A 23 -4.310 4.246 -6.831 1.00 0.00 C ATOM 322 O GLY A 23 -5.528 4.384 -6.932 1.00 0.00 O ATOM 0 H GLY A 23 -4.458 4.256 -9.688 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -3.913 2.567 -8.108 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.481 3.456 -7.629 1.00 0.00 H new ATOM 325 N LEU A 24 -3.631 4.694 -5.778 1.00 0.00 N ATOM 326 CA LEU A 24 -4.237 5.439 -4.671 1.00 0.00 C ATOM 327 C LEU A 24 -3.433 6.729 -4.433 1.00 0.00 C ATOM 328 O LEU A 24 -2.215 6.770 -4.616 1.00 0.00 O ATOM 329 CB LEU A 24 -4.349 4.497 -3.447 1.00 0.00 C ATOM 330 CG LEU A 24 -4.757 5.175 -2.128 1.00 0.00 C ATOM 331 CD1 LEU A 24 -6.194 5.700 -2.113 1.00 0.00 C ATOM 332 CD2 LEU A 24 -4.603 4.214 -0.952 1.00 0.00 C ATOM 0 H LEU A 24 -2.628 4.549 -5.665 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.253 5.766 -4.894 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.076 3.717 -3.675 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.388 4.004 -3.300 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.085 6.028 -2.037 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.402 6.163 -1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.320 6.438 -2.905 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.885 4.873 -2.275 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -4.897 4.716 -0.031 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.238 3.342 -1.109 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.563 3.896 -0.876 1.00 0.00 H new ATOM 343 N VAL A 25 -4.119 7.792 -4.014 1.00 0.00 N ATOM 344 CA VAL A 25 -3.533 9.092 -3.670 1.00 0.00 C ATOM 345 C VAL A 25 -3.917 9.399 -2.233 1.00 0.00 C ATOM 346 O VAL A 25 -5.104 9.412 -1.889 1.00 0.00 O ATOM 347 CB VAL A 25 -4.041 10.194 -4.617 1.00 0.00 C ATOM 348 CG1 VAL A 25 -3.594 11.594 -4.173 1.00 0.00 C ATOM 349 CG2 VAL A 25 -3.488 9.956 -6.025 1.00 0.00 C ATOM 0 H VAL A 25 -5.132 7.774 -3.900 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.449 9.057 -3.776 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.130 10.149 -4.600 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -3.977 12.337 -4.872 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.982 11.801 -3.176 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.505 11.640 -4.155 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.849 10.737 -6.694 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -2.399 9.977 -5.996 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.823 8.984 -6.388 1.00 0.00 H new ATOM 359 N LEU A 26 -2.909 9.664 -1.404 1.00 0.00 N ATOM 360 CA LEU A 26 -3.094 10.143 -0.040 1.00 0.00 C ATOM 361 C LEU A 26 -2.764 11.631 0.061 1.00 0.00 C ATOM 362 O LEU A 26 -1.854 12.147 -0.598 1.00 0.00 O ATOM 363 CB LEU A 26 -2.226 9.342 0.945 1.00 0.00 C ATOM 364 CG LEU A 26 -2.831 8.039 1.494 1.00 0.00 C ATOM 365 CD1 LEU A 26 -4.252 8.209 2.026 1.00 0.00 C ATOM 366 CD2 LEU A 26 -2.909 6.962 0.428 1.00 0.00 C ATOM 0 H LEU A 26 -1.930 9.550 -1.666 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.142 9.999 0.225 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.286 9.099 0.450 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.985 9.988 1.789 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.160 7.755 2.305 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.618 7.252 2.398 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.252 8.937 2.837 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.901 8.559 1.224 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.342 6.058 0.856 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.534 7.309 -0.395 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.908 6.744 0.057 1.00 0.00 H new ATOM 377 N TYR A 27 -3.505 12.289 0.947 1.00 0.00 N ATOM 378 CA TYR A 27 -3.442 13.719 1.223 1.00 0.00 C ATOM 379 C TYR A 27 -2.550 14.001 2.450 1.00 0.00 C ATOM 380 O TYR A 27 -2.644 13.275 3.444 1.00 0.00 O ATOM 381 CB TYR A 27 -4.874 14.230 1.443 1.00 0.00 C ATOM 382 CG TYR A 27 -5.708 14.298 0.177 1.00 0.00 C ATOM 383 CD1 TYR A 27 -5.512 15.364 -0.723 1.00 0.00 C ATOM 384 CD2 TYR A 27 -6.677 13.311 -0.099 1.00 0.00 C ATOM 385 CE1 TYR A 27 -6.293 15.455 -1.888 1.00 0.00 C ATOM 386 CE2 TYR A 27 -7.463 13.401 -1.263 1.00 0.00 C ATOM 387 CZ TYR A 27 -7.275 14.478 -2.163 1.00 0.00 C ATOM 388 OH TYR A 27 -8.031 14.587 -3.290 1.00 0.00 O ATOM 0 H TYR A 27 -4.201 11.814 1.521 1.00 0.00 H new ATOM 0 HA TYR A 27 -2.994 14.244 0.379 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -5.374 13.580 2.161 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -4.829 15.223 1.890 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -4.761 16.112 -0.518 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -6.816 12.486 0.583 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -6.142 16.275 -2.575 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -8.210 12.649 -1.470 1.00 0.00 H new ATOM 0 HH TYR A 27 -8.660 13.837 -3.336 1.00 0.00 H new ATOM 397 N PRO A 28 -1.714 15.058 2.426 1.00 0.00 N ATOM 398 CA PRO A 28 -0.869 15.501 3.544 1.00 0.00 C ATOM 399 C PRO A 28 -1.682 16.201 4.658 1.00 0.00 C ATOM 400 O PRO A 28 -1.478 17.383 4.953 1.00 0.00 O ATOM 401 CB PRO A 28 0.200 16.390 2.892 1.00 0.00 C ATOM 402 CG PRO A 28 -0.502 16.982 1.674 1.00 0.00 C ATOM 403 CD PRO A 28 -1.507 15.912 1.261 1.00 0.00 C ATOM 0 HA PRO A 28 -0.408 14.668 4.074 1.00 0.00 H new ATOM 0 HB2 PRO A 28 0.541 17.169 3.574 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.078 15.812 2.604 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -0.999 17.921 1.919 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.205 17.195 0.872 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -2.446 16.365 0.942 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.130 15.332 0.418 1.00 0.00 H new ATOM 408 N GLN A 29 -2.638 15.484 5.254 1.00 0.00 N ATOM 409 CA GLN A 29 -3.682 16.017 6.145 1.00 0.00 C ATOM 410 C GLN A 29 -3.627 15.346 7.539 1.00 0.00 C ATOM 411 O GLN A 29 -4.133 14.247 7.772 1.00 0.00 O ATOM 412 CB GLN A 29 -5.050 15.963 5.420 1.00 0.00 C ATOM 413 CG GLN A 29 -5.582 14.535 5.192 1.00 0.00 C ATOM 414 CD GLN A 29 -6.734 14.395 4.187 1.00 0.00 C ATOM 415 OE1 GLN A 29 -7.204 15.349 3.586 1.00 0.00 O ATOM 416 NE2 GLN A 29 -7.238 13.203 3.949 1.00 0.00 N ATOM 0 H GLN A 29 -2.712 14.475 5.126 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.506 17.070 6.364 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.781 16.523 6.003 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -4.959 16.464 4.456 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -4.755 13.911 4.854 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.913 14.135 6.151 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.867 12.386 4.435 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -7.999 13.096 3.279 1.00 0.00 H new ATOM 423 N ILE A 30 -2.937 15.998 8.478 1.00 0.00 N ATOM 424 CA ILE A 30 -2.712 15.490 9.837 1.00 0.00 C ATOM 425 C ILE A 30 -4.048 15.323 10.589 1.00 0.00 C ATOM 426 O ILE A 30 -4.813 16.277 10.748 1.00 0.00 O ATOM 427 CB ILE A 30 -1.668 16.370 10.560 1.00 0.00 C ATOM 428 CG1 ILE A 30 -0.270 16.218 9.906 1.00 0.00 C ATOM 429 CG2 ILE A 30 -1.573 16.051 12.057 1.00 0.00 C ATOM 430 CD1 ILE A 30 0.392 14.827 9.961 1.00 0.00 C ATOM 0 H ILE A 30 -2.511 16.910 8.314 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.285 14.488 9.800 1.00 0.00 H new ATOM 0 HB ILE A 30 -2.007 17.401 10.458 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.355 16.510 8.859 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.404 16.931 10.382 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.826 16.696 12.520 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -2.541 16.222 12.528 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.284 15.008 12.189 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.363 14.866 9.467 1.00 0.00 H new ATOM 0 HD12 ILE A 30 0.526 14.529 11.001 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.244 14.101 9.454 1.00 0.00 H new ATOM 441 N GLY A 31 -4.338 14.085 11.008 1.00 0.00 N ATOM 442 CA GLY A 31 -5.552 13.683 11.736 1.00 0.00 C ATOM 443 C GLY A 31 -6.492 12.744 10.965 1.00 0.00 C ATOM 444 O GLY A 31 -7.407 12.164 11.556 1.00 0.00 O ATOM 0 H GLY A 31 -3.707 13.301 10.843 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -5.256 13.194 12.664 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.106 14.580 12.012 1.00 0.00 H new ATOM 447 N ASP A 32 -6.284 12.580 9.658 1.00 0.00 N ATOM 448 CA ASP A 32 -6.917 11.545 8.825 1.00 0.00 C ATOM 449 C ASP A 32 -6.391 10.133 9.154 1.00 0.00 C ATOM 450 O ASP A 32 -5.296 9.972 9.695 1.00 0.00 O ATOM 451 CB ASP A 32 -6.697 11.949 7.363 1.00 0.00 C ATOM 452 CG ASP A 32 -7.226 10.954 6.336 1.00 0.00 C ATOM 453 OD1 ASP A 32 -8.278 10.336 6.619 1.00 0.00 O ATOM 454 OD2 ASP A 32 -6.611 10.844 5.257 1.00 0.00 O ATOM 0 H ASP A 32 -5.651 13.180 9.129 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.986 11.485 9.029 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.174 12.914 7.192 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.629 12.088 7.196 1.00 0.00 H new ATOM 458 N LYS A 33 -7.158 9.095 8.810 1.00 0.00 N ATOM 459 CA LYS A 33 -6.791 7.685 8.993 1.00 0.00 C ATOM 460 C LYS A 33 -7.355 6.808 7.868 1.00 0.00 C ATOM 461 O LYS A 33 -8.385 7.128 7.268 1.00 0.00 O ATOM 462 CB LYS A 33 -7.143 7.182 10.410 1.00 0.00 C ATOM 463 CG LYS A 33 -8.562 7.477 10.921 1.00 0.00 C ATOM 464 CD LYS A 33 -9.688 6.807 10.111 1.00 0.00 C ATOM 465 CE LYS A 33 -10.913 6.460 10.972 1.00 0.00 C ATOM 466 NZ LYS A 33 -10.675 5.219 11.760 1.00 0.00 N ATOM 0 H LYS A 33 -8.077 9.214 8.385 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.707 7.605 8.917 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.992 6.103 10.434 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.432 7.619 11.111 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.635 7.151 11.959 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -8.720 8.556 10.914 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.994 7.472 9.303 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.305 5.898 9.648 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -11.134 7.287 11.647 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.786 6.328 10.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -11.516 5.005 12.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -10.487 4.427 11.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -9.856 5.357 12.385 1.00 0.00 H new ATOM 476 N LEU A 34 -6.668 5.708 7.596 1.00 0.00 N ATOM 477 CA LEU A 34 -7.001 4.739 6.554 1.00 0.00 C ATOM 478 C LEU A 34 -6.810 3.322 7.110 1.00 0.00 C ATOM 479 O LEU A 34 -5.792 2.993 7.729 1.00 0.00 O ATOM 480 CB LEU A 34 -6.204 4.961 5.241 1.00 0.00 C ATOM 481 CG LEU A 34 -4.990 5.919 5.148 1.00 0.00 C ATOM 482 CD1 LEU A 34 -5.355 7.405 5.229 1.00 0.00 C ATOM 483 CD2 LEU A 34 -3.824 5.643 6.099 1.00 0.00 C ATOM 0 H LEU A 34 -5.828 5.453 8.115 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.046 4.881 6.277 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.850 3.980 4.923 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.923 5.298 4.495 1.00 0.00 H new ATOM 0 HG LEU A 34 -4.635 5.685 4.144 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.449 8.007 5.156 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.027 7.660 4.409 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.849 7.607 6.179 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.039 6.381 5.936 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -4.173 5.706 7.130 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.429 4.645 5.910 1.00 0.00 H new ATOM 494 N ASP A 35 -7.809 2.479 6.852 1.00 0.00 N ATOM 495 CA ASP A 35 -7.941 1.096 7.318 1.00 0.00 C ATOM 496 C ASP A 35 -7.950 0.167 6.097 1.00 0.00 C ATOM 497 O ASP A 35 -8.946 0.109 5.371 1.00 0.00 O ATOM 498 CB ASP A 35 -9.216 0.929 8.181 1.00 0.00 C ATOM 499 CG ASP A 35 -8.878 0.292 9.533 1.00 0.00 C ATOM 500 OD1 ASP A 35 -8.340 -0.840 9.550 1.00 0.00 O ATOM 501 OD2 ASP A 35 -9.149 0.928 10.579 1.00 0.00 O ATOM 0 H ASP A 35 -8.601 2.761 6.274 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.096 0.833 7.954 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -9.684 1.901 8.339 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -9.940 0.309 7.652 1.00 0.00 H new ATOM 505 N ILE A 36 -6.839 -0.520 5.817 1.00 0.00 N ATOM 506 CA ILE A 36 -6.799 -1.521 4.752 1.00 0.00 C ATOM 507 C ILE A 36 -7.261 -2.864 5.304 1.00 0.00 C ATOM 508 O ILE A 36 -6.740 -3.342 6.310 1.00 0.00 O ATOM 509 CB ILE A 36 -5.429 -1.579 4.054 1.00 0.00 C ATOM 510 CG1 ILE A 36 -5.455 -2.485 2.804 1.00 0.00 C ATOM 511 CG2 ILE A 36 -4.324 -2.035 5.005 1.00 0.00 C ATOM 512 CD1 ILE A 36 -4.368 -2.077 1.813 1.00 0.00 C ATOM 0 H ILE A 36 -5.956 -0.400 6.314 1.00 0.00 H new ATOM 0 HA ILE A 36 -7.493 -1.231 3.963 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.208 -0.561 3.734 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.311 -3.524 3.100 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.432 -2.422 2.325 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.374 -2.062 4.472 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.252 -1.338 5.840 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.557 -3.031 5.382 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -4.407 -2.730 0.941 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.529 -1.045 1.501 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.391 -2.164 2.288 1.00 0.00 H new ATOM 523 N ILE A 37 -8.253 -3.463 4.645 1.00 0.00 N ATOM 524 CA ILE A 37 -8.860 -4.745 4.989 1.00 0.00 C ATOM 525 C ILE A 37 -8.888 -5.574 3.705 1.00 0.00 C ATOM 526 O ILE A 37 -9.318 -5.095 2.652 1.00 0.00 O ATOM 527 CB ILE A 37 -10.270 -4.502 5.583 1.00 0.00 C ATOM 528 CG1 ILE A 37 -10.137 -4.046 7.050 1.00 0.00 C ATOM 529 CG2 ILE A 37 -11.158 -5.759 5.523 1.00 0.00 C ATOM 530 CD1 ILE A 37 -11.307 -3.184 7.532 1.00 0.00 C ATOM 0 H ILE A 37 -8.675 -3.045 3.816 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.297 -5.286 5.749 1.00 0.00 H new ATOM 0 HB ILE A 37 -10.748 -3.730 4.980 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -10.057 -4.925 7.689 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -9.211 -3.483 7.164 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -12.135 -5.535 5.952 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -11.280 -6.069 4.485 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -10.689 -6.563 6.090 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -11.146 -2.900 8.572 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -11.375 -2.286 6.917 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -12.234 -3.751 7.450 1.00 0.00 H new ATOM 541 N CYS A 38 -8.445 -6.824 3.786 1.00 0.00 N ATOM 542 CA CYS A 38 -8.673 -7.802 2.730 1.00 0.00 C ATOM 543 C CYS A 38 -8.939 -9.195 3.345 1.00 0.00 C ATOM 544 O CYS A 38 -8.200 -9.617 4.246 1.00 0.00 O ATOM 545 CB CYS A 38 -7.519 -7.757 1.707 1.00 0.00 C ATOM 546 SG CYS A 38 -6.179 -8.957 1.875 1.00 0.00 S ATOM 0 H CYS A 38 -7.920 -7.186 4.582 1.00 0.00 H new ATOM 0 HA CYS A 38 -9.572 -7.555 2.166 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -7.951 -7.877 0.713 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -7.080 -6.760 1.745 1.00 0.00 H new ATOM 550 N PRO A 39 -9.994 -9.916 2.907 1.00 0.00 N ATOM 551 CA PRO A 39 -10.206 -11.312 3.257 1.00 0.00 C ATOM 552 C PRO A 39 -9.147 -12.180 2.563 1.00 0.00 C ATOM 553 O PRO A 39 -8.641 -11.845 1.486 1.00 0.00 O ATOM 554 CB PRO A 39 -11.634 -11.637 2.804 1.00 0.00 C ATOM 555 CG PRO A 39 -11.911 -10.672 1.652 1.00 0.00 C ATOM 556 CD PRO A 39 -10.954 -9.504 1.895 1.00 0.00 C ATOM 0 HA PRO A 39 -10.102 -11.509 4.324 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -11.719 -12.674 2.480 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.347 -11.498 3.616 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -11.726 -11.143 0.686 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -12.950 -10.341 1.652 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -10.442 -9.232 0.972 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -11.504 -8.623 2.227 1.00 0.00 H new ATOM 561 N LYS A 40 -8.821 -13.316 3.184 1.00 0.00 N ATOM 562 CA LYS A 40 -7.961 -14.345 2.579 1.00 0.00 C ATOM 563 C LYS A 40 -8.578 -14.948 1.307 1.00 0.00 C ATOM 564 O LYS A 40 -9.768 -14.782 1.017 1.00 0.00 O ATOM 565 CB LYS A 40 -7.602 -15.434 3.610 1.00 0.00 C ATOM 566 CG LYS A 40 -8.789 -16.320 4.028 1.00 0.00 C ATOM 567 CD LYS A 40 -8.289 -17.566 4.767 1.00 0.00 C ATOM 568 CE LYS A 40 -9.420 -18.568 5.033 1.00 0.00 C ATOM 569 NZ LYS A 40 -10.338 -18.121 6.116 1.00 0.00 N ATOM 0 H LYS A 40 -9.145 -13.552 4.122 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.037 -13.856 2.270 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.818 -16.068 3.195 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -7.189 -14.956 4.498 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.465 -15.755 4.670 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.359 -16.616 3.147 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -7.508 -18.048 4.178 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -7.837 -17.269 5.714 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.991 -18.718 4.117 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -8.990 -19.533 5.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.083 -18.833 6.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -9.802 -18.004 6.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.772 -17.214 5.851 1.00 0.00 H new ATOM 579 N VAL A 41 -7.764 -15.742 0.616 1.00 0.00 N ATOM 580 CA VAL A 41 -8.111 -16.528 -0.580 1.00 0.00 C ATOM 581 C VAL A 41 -8.052 -18.025 -0.248 1.00 0.00 C ATOM 582 O VAL A 41 -6.980 -18.595 -0.059 1.00 0.00 O ATOM 583 CB VAL A 41 -7.254 -16.115 -1.809 1.00 0.00 C ATOM 584 CG1 VAL A 41 -5.788 -15.822 -1.477 1.00 0.00 C ATOM 585 CG2 VAL A 41 -7.282 -17.155 -2.935 1.00 0.00 C ATOM 0 H VAL A 41 -6.788 -15.866 0.885 1.00 0.00 H new ATOM 0 HA VAL A 41 -9.137 -16.309 -0.876 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.729 -15.193 -2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.258 -15.541 -2.387 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -5.734 -15.004 -0.759 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.327 -16.712 -1.049 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -6.665 -16.810 -3.765 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.893 -18.103 -2.564 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.307 -17.293 -3.278 1.00 0.00 H new ATOM 595 N ASP A 42 -9.235 -18.643 -0.141 1.00 0.00 N ATOM 596 CA ASP A 42 -9.487 -20.089 0.001 1.00 0.00 C ATOM 597 C ASP A 42 -11.010 -20.337 -0.061 1.00 0.00 C ATOM 598 O ASP A 42 -11.542 -20.630 -1.131 1.00 0.00 O ATOM 599 CB ASP A 42 -8.895 -20.656 1.315 1.00 0.00 C ATOM 600 CG ASP A 42 -7.481 -21.257 1.181 1.00 0.00 C ATOM 601 OD1 ASP A 42 -7.192 -21.931 0.166 1.00 0.00 O ATOM 602 OD2 ASP A 42 -6.684 -21.134 2.145 1.00 0.00 O ATOM 0 H ASP A 42 -10.105 -18.111 -0.152 1.00 0.00 H new ATOM 0 HA ASP A 42 -8.990 -20.610 -0.817 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -8.867 -19.859 2.058 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -9.566 -21.425 1.698 1.00 0.00 H new ATOM 606 N SER A 43 -11.724 -20.142 1.056 1.00 0.00 N ATOM 607 CA SER A 43 -13.176 -20.371 1.184 1.00 0.00 C ATOM 608 C SER A 43 -14.003 -19.302 0.446 1.00 0.00 C ATOM 609 O SER A 43 -14.907 -19.643 -0.323 1.00 0.00 O ATOM 610 CB SER A 43 -13.533 -20.415 2.680 1.00 0.00 C ATOM 611 OG SER A 43 -14.936 -20.476 2.883 1.00 0.00 O ATOM 0 H SER A 43 -11.298 -19.811 1.922 1.00 0.00 H new ATOM 0 HA SER A 43 -13.425 -21.322 0.713 1.00 0.00 H new ATOM 0 HB2 SER A 43 -13.060 -21.282 3.142 1.00 0.00 H new ATOM 0 HB3 SER A 43 -13.132 -19.531 3.176 1.00 0.00 H new ATOM 0 HG SER A 43 -15.127 -20.504 3.844 1.00 0.00 H new ATOM 616 N LYS A 44 -13.662 -18.012 0.615 1.00 0.00 N ATOM 617 CA LYS A 44 -14.331 -16.876 -0.056 1.00 0.00 C ATOM 618 C LYS A 44 -14.171 -16.931 -1.578 1.00 0.00 C ATOM 619 O LYS A 44 -15.148 -16.789 -2.312 1.00 0.00 O ATOM 620 CB LYS A 44 -13.780 -15.546 0.516 1.00 0.00 C ATOM 621 CG LYS A 44 -14.213 -14.282 -0.253 1.00 0.00 C ATOM 622 CD LYS A 44 -15.731 -14.044 -0.227 1.00 0.00 C ATOM 623 CE LYS A 44 -16.141 -13.055 -1.328 1.00 0.00 C ATOM 624 NZ LYS A 44 -16.728 -13.747 -2.509 1.00 0.00 N ATOM 0 H LYS A 44 -12.902 -17.722 1.231 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.400 -16.940 0.144 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.103 -15.452 1.553 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.691 -15.594 0.524 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.709 -13.415 0.174 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.883 -14.364 -1.289 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -16.255 -14.989 -0.366 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -16.027 -13.655 0.747 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.865 -12.345 -0.927 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.270 -12.479 -1.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.991 -13.043 -3.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.029 -14.406 -2.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.574 -14.276 -2.216 1.00 0.00 H new ATOM 634 N THR A 45 -12.934 -17.097 -2.048 1.00 0.00 N ATOM 635 CA THR A 45 -12.584 -17.048 -3.483 1.00 0.00 C ATOM 636 C THR A 45 -12.949 -18.341 -4.214 1.00 0.00 C ATOM 637 O THR A 45 -13.343 -18.297 -5.377 1.00 0.00 O ATOM 638 CB THR A 45 -11.074 -16.799 -3.649 1.00 0.00 C ATOM 639 OG1 THR A 45 -10.659 -15.751 -2.800 1.00 0.00 O ATOM 640 CG2 THR A 45 -10.656 -16.424 -5.071 1.00 0.00 C ATOM 0 H THR A 45 -12.132 -17.272 -1.442 1.00 0.00 H new ATOM 0 HA THR A 45 -13.159 -16.232 -3.921 1.00 0.00 H new ATOM 0 HB THR A 45 -10.600 -17.747 -3.396 1.00 0.00 H new ATOM 0 HG1 THR A 45 -9.740 -15.494 -3.023 1.00 0.00 H new ATOM 0 HG21 THR A 45 -9.578 -16.265 -5.103 1.00 0.00 H new ATOM 0 HG22 THR A 45 -10.925 -17.230 -5.754 1.00 0.00 H new ATOM 0 HG23 THR A 45 -11.167 -15.509 -5.371 1.00 0.00 H new ATOM 648 N VAL A 46 -12.796 -19.494 -3.551 1.00 0.00 N ATOM 649 CA VAL A 46 -13.008 -20.870 -4.057 1.00 0.00 C ATOM 650 C VAL A 46 -12.143 -21.309 -5.265 1.00 0.00 C ATOM 651 O VAL A 46 -12.199 -22.471 -5.669 1.00 0.00 O ATOM 652 CB VAL A 46 -14.526 -21.158 -4.204 1.00 0.00 C ATOM 653 CG1 VAL A 46 -15.085 -21.195 -5.630 1.00 0.00 C ATOM 654 CG2 VAL A 46 -14.908 -22.465 -3.486 1.00 0.00 C ATOM 0 H VAL A 46 -12.499 -19.498 -2.575 1.00 0.00 H new ATOM 0 HA VAL A 46 -12.609 -21.533 -3.289 1.00 0.00 H new ATOM 0 HB VAL A 46 -14.988 -20.288 -3.737 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -16.154 -21.405 -5.596 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -14.919 -20.231 -6.111 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -14.580 -21.976 -6.199 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -15.977 -22.646 -3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -14.350 -23.295 -3.920 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -14.668 -22.381 -2.426 1.00 0.00 H new ATOM 664 N GLY A 47 -11.304 -20.416 -5.808 1.00 0.00 N ATOM 665 CA GLY A 47 -10.467 -20.619 -7.007 1.00 0.00 C ATOM 666 C GLY A 47 -8.938 -20.606 -6.769 1.00 0.00 C ATOM 667 O GLY A 47 -8.209 -21.103 -7.628 1.00 0.00 O ATOM 0 H GLY A 47 -11.182 -19.486 -5.406 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.738 -21.573 -7.459 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.710 -19.843 -7.732 1.00 0.00 H new ATOM 670 N GLN A 48 -8.439 -20.094 -5.624 1.00 0.00 N ATOM 671 CA GLN A 48 -7.004 -20.056 -5.240 1.00 0.00 C ATOM 672 C GLN A 48 -6.055 -19.541 -6.347 1.00 0.00 C ATOM 673 O GLN A 48 -5.210 -20.278 -6.867 1.00 0.00 O ATOM 674 CB GLN A 48 -6.592 -21.407 -4.623 1.00 0.00 C ATOM 675 CG GLN A 48 -7.126 -21.562 -3.190 1.00 0.00 C ATOM 676 CD GLN A 48 -7.419 -23.028 -2.869 1.00 0.00 C ATOM 677 OE1 GLN A 48 -6.529 -23.843 -2.665 1.00 0.00 O ATOM 678 NE2 GLN A 48 -8.673 -23.434 -2.878 1.00 0.00 N ATOM 0 H GLN A 48 -9.042 -19.680 -4.913 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.890 -19.293 -4.470 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -6.970 -22.221 -5.242 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.505 -21.489 -4.617 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.396 -21.170 -2.482 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.034 -20.972 -3.071 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -9.424 -22.765 -3.047 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -8.892 -24.417 -2.716 1.00 0.00 H new ATOM 685 N TYR A 49 -6.212 -18.264 -6.715 1.00 0.00 N ATOM 686 CA TYR A 49 -5.383 -17.596 -7.728 1.00 0.00 C ATOM 687 C TYR A 49 -3.930 -17.394 -7.239 1.00 0.00 C ATOM 688 O TYR A 49 -3.018 -18.100 -7.668 1.00 0.00 O ATOM 689 CB TYR A 49 -6.061 -16.277 -8.155 1.00 0.00 C ATOM 690 CG TYR A 49 -5.504 -15.706 -9.447 1.00 0.00 C ATOM 691 CD1 TYR A 49 -4.293 -14.985 -9.455 1.00 0.00 C ATOM 692 CD2 TYR A 49 -6.203 -15.917 -10.652 1.00 0.00 C ATOM 693 CE1 TYR A 49 -3.766 -14.498 -10.666 1.00 0.00 C ATOM 694 CE2 TYR A 49 -5.690 -15.415 -11.862 1.00 0.00 C ATOM 695 CZ TYR A 49 -4.465 -14.715 -11.877 1.00 0.00 C ATOM 696 OH TYR A 49 -3.970 -14.258 -13.059 1.00 0.00 O ATOM 0 H TYR A 49 -6.927 -17.657 -6.313 1.00 0.00 H new ATOM 0 HA TYR A 49 -5.306 -18.236 -8.607 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -7.131 -16.448 -8.273 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.942 -15.541 -7.360 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -3.768 -14.806 -8.529 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -7.134 -16.465 -10.647 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.830 -13.960 -10.671 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -6.235 -15.566 -12.782 1.00 0.00 H new ATOM 0 HH TYR A 49 -4.582 -14.499 -13.785 1.00 0.00 H new ATOM 705 N GLU A 50 -3.724 -16.445 -6.316 1.00 0.00 N ATOM 706 CA GLU A 50 -2.455 -16.040 -5.680 1.00 0.00 C ATOM 707 C GLU A 50 -2.739 -14.924 -4.641 1.00 0.00 C ATOM 708 O GLU A 50 -3.897 -14.564 -4.403 1.00 0.00 O ATOM 709 CB GLU A 50 -1.415 -15.553 -6.728 1.00 0.00 C ATOM 710 CG GLU A 50 -0.004 -16.123 -6.477 1.00 0.00 C ATOM 711 CD GLU A 50 0.281 -17.381 -7.330 1.00 0.00 C ATOM 712 OE1 GLU A 50 0.521 -17.241 -8.561 1.00 0.00 O ATOM 713 OE2 GLU A 50 0.315 -18.503 -6.781 1.00 0.00 O ATOM 0 H GLU A 50 -4.505 -15.892 -5.963 1.00 0.00 H new ATOM 0 HA GLU A 50 -2.026 -16.909 -5.181 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.747 -15.843 -7.725 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -1.371 -14.464 -6.711 1.00 0.00 H new ATOM 0 HG2 GLU A 50 0.740 -15.358 -6.702 1.00 0.00 H new ATOM 0 HG3 GLU A 50 0.103 -16.371 -5.421 1.00 0.00 H new ATOM 718 N TYR A 51 -1.690 -14.347 -4.055 1.00 0.00 N ATOM 719 CA TYR A 51 -1.728 -13.187 -3.149 1.00 0.00 C ATOM 720 C TYR A 51 -1.172 -11.905 -3.809 1.00 0.00 C ATOM 721 O TYR A 51 -0.618 -11.962 -4.913 1.00 0.00 O ATOM 722 CB TYR A 51 -0.943 -13.551 -1.875 1.00 0.00 C ATOM 723 CG TYR A 51 0.390 -14.262 -2.077 1.00 0.00 C ATOM 724 CD1 TYR A 51 1.472 -13.603 -2.698 1.00 0.00 C ATOM 725 CD2 TYR A 51 0.537 -15.604 -1.670 1.00 0.00 C ATOM 726 CE1 TYR A 51 2.694 -14.274 -2.892 1.00 0.00 C ATOM 727 CE2 TYR A 51 1.759 -16.278 -1.859 1.00 0.00 C ATOM 728 CZ TYR A 51 2.847 -15.612 -2.464 1.00 0.00 C ATOM 729 OH TYR A 51 4.038 -16.246 -2.643 1.00 0.00 O ATOM 0 H TYR A 51 -0.741 -14.689 -4.203 1.00 0.00 H new ATOM 0 HA TYR A 51 -2.765 -12.962 -2.900 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -0.759 -12.635 -1.314 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -1.576 -14.184 -1.253 1.00 0.00 H new ATOM 0 HD1 TYR A 51 1.362 -12.580 -3.026 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -0.294 -16.119 -1.210 1.00 0.00 H new ATOM 0 HE1 TYR A 51 3.518 -13.764 -3.370 1.00 0.00 H new ATOM 0 HE2 TYR A 51 1.864 -17.305 -1.541 1.00 0.00 H new ATOM 0 HH TYR A 51 3.978 -17.160 -2.293 1.00 0.00 H new ATOM 738 N TYR A 52 -1.253 -10.753 -3.128 1.00 0.00 N ATOM 739 CA TYR A 52 -0.540 -9.523 -3.517 1.00 0.00 C ATOM 740 C TYR A 52 0.073 -8.832 -2.289 1.00 0.00 C ATOM 741 O TYR A 52 -0.512 -8.817 -1.203 1.00 0.00 O ATOM 742 CB TYR A 52 -1.443 -8.567 -4.331 1.00 0.00 C ATOM 743 CG TYR A 52 -2.394 -7.674 -3.539 1.00 0.00 C ATOM 744 CD1 TYR A 52 -1.918 -6.488 -2.940 1.00 0.00 C ATOM 745 CD2 TYR A 52 -3.763 -8.004 -3.428 1.00 0.00 C ATOM 746 CE1 TYR A 52 -2.784 -5.669 -2.189 1.00 0.00 C ATOM 747 CE2 TYR A 52 -4.637 -7.163 -2.715 1.00 0.00 C ATOM 748 CZ TYR A 52 -4.150 -6.005 -2.074 1.00 0.00 C ATOM 749 OH TYR A 52 -4.990 -5.233 -1.332 1.00 0.00 O ATOM 0 H TYR A 52 -1.818 -10.646 -2.286 1.00 0.00 H new ATOM 0 HA TYR A 52 0.280 -9.809 -4.175 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -0.801 -7.927 -4.936 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -2.036 -9.166 -5.021 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -0.882 -6.206 -3.058 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.140 -8.904 -3.891 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.403 -4.784 -1.701 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -5.688 -7.406 -2.658 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.894 -5.610 -1.363 1.00 0.00 H new ATOM 758 N LYS A 53 1.244 -8.214 -2.461 1.00 0.00 N ATOM 759 CA LYS A 53 1.915 -7.434 -1.414 1.00 0.00 C ATOM 760 C LYS A 53 2.398 -6.102 -1.987 1.00 0.00 C ATOM 761 O LYS A 53 3.093 -6.076 -3.005 1.00 0.00 O ATOM 762 CB LYS A 53 3.092 -8.213 -0.801 1.00 0.00 C ATOM 763 CG LYS A 53 2.754 -9.568 -0.152 1.00 0.00 C ATOM 764 CD LYS A 53 3.138 -10.765 -1.031 1.00 0.00 C ATOM 765 CE LYS A 53 3.121 -12.053 -0.189 1.00 0.00 C ATOM 766 NZ LYS A 53 4.418 -12.783 -0.265 1.00 0.00 N ATOM 0 H LYS A 53 1.760 -8.240 -3.340 1.00 0.00 H new ATOM 0 HA LYS A 53 1.195 -7.242 -0.618 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.832 -8.384 -1.583 1.00 0.00 H new ATOM 0 HB3 LYS A 53 3.564 -7.582 -0.048 1.00 0.00 H new ATOM 0 HG2 LYS A 53 3.271 -9.646 0.804 1.00 0.00 H new ATOM 0 HG3 LYS A 53 1.685 -9.607 0.059 1.00 0.00 H new ATOM 0 HD2 LYS A 53 2.441 -10.855 -1.865 1.00 0.00 H new ATOM 0 HD3 LYS A 53 4.129 -10.612 -1.459 1.00 0.00 H new ATOM 0 HE2 LYS A 53 2.904 -11.805 0.850 1.00 0.00 H new ATOM 0 HE3 LYS A 53 2.318 -12.703 -0.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 4.538 -13.367 0.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 4.424 -13.393 -1.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.198 -12.099 -0.328 1.00 0.00 H new ATOM 776 N VAL A 54 2.019 -5.011 -1.327 1.00 0.00 N ATOM 777 CA VAL A 54 2.381 -3.634 -1.687 1.00 0.00 C ATOM 778 C VAL A 54 3.660 -3.255 -0.930 1.00 0.00 C ATOM 779 O VAL A 54 3.772 -3.503 0.276 1.00 0.00 O ATOM 780 CB VAL A 54 1.257 -2.626 -1.350 1.00 0.00 C ATOM 781 CG1 VAL A 54 1.468 -1.346 -2.153 1.00 0.00 C ATOM 782 CG2 VAL A 54 -0.157 -3.117 -1.672 1.00 0.00 C ATOM 0 H VAL A 54 1.430 -5.058 -0.496 1.00 0.00 H new ATOM 0 HA VAL A 54 2.538 -3.590 -2.765 1.00 0.00 H new ATOM 0 HB VAL A 54 1.323 -2.475 -0.272 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.677 -0.634 -1.917 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.435 -0.912 -1.898 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.443 -1.576 -3.218 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.880 -2.346 -1.403 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.234 -3.331 -2.738 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -0.365 -4.024 -1.104 1.00 0.00 H new ATOM 792 N TYR A 55 4.612 -2.630 -1.623 1.00 0.00 N ATOM 793 CA TYR A 55 5.934 -2.252 -1.101 1.00 0.00 C ATOM 794 C TYR A 55 6.291 -0.816 -1.497 1.00 0.00 C ATOM 795 O TYR A 55 6.139 -0.409 -2.654 1.00 0.00 O ATOM 796 CB TYR A 55 7.006 -3.187 -1.676 1.00 0.00 C ATOM 797 CG TYR A 55 7.135 -4.586 -1.102 1.00 0.00 C ATOM 798 CD1 TYR A 55 6.340 -5.640 -1.596 1.00 0.00 C ATOM 799 CD2 TYR A 55 8.165 -4.860 -0.181 1.00 0.00 C ATOM 800 CE1 TYR A 55 6.580 -6.960 -1.172 1.00 0.00 C ATOM 801 CE2 TYR A 55 8.409 -6.178 0.244 1.00 0.00 C ATOM 802 CZ TYR A 55 7.604 -7.236 -0.241 1.00 0.00 C ATOM 803 OH TYR A 55 7.810 -8.519 0.166 1.00 0.00 O ATOM 0 H TYR A 55 4.483 -2.362 -2.599 1.00 0.00 H new ATOM 0 HA TYR A 55 5.898 -2.330 -0.014 1.00 0.00 H new ATOM 0 HB2 TYR A 55 6.821 -3.284 -2.746 1.00 0.00 H new ATOM 0 HB3 TYR A 55 7.971 -2.693 -1.563 1.00 0.00 H new ATOM 0 HD1 TYR A 55 5.547 -5.434 -2.300 1.00 0.00 H new ATOM 0 HD2 TYR A 55 8.771 -4.052 0.201 1.00 0.00 H new ATOM 0 HE1 TYR A 55 5.977 -7.767 -1.561 1.00 0.00 H new ATOM 0 HE2 TYR A 55 9.210 -6.383 0.939 1.00 0.00 H new ATOM 0 HH TYR A 55 8.551 -8.544 0.807 1.00 0.00 H new ATOM 812 N MET A 56 6.813 -0.052 -0.535 1.00 0.00 N ATOM 813 CA MET A 56 7.431 1.249 -0.801 1.00 0.00 C ATOM 814 C MET A 56 8.624 1.087 -1.760 1.00 0.00 C ATOM 815 O MET A 56 9.336 0.089 -1.657 1.00 0.00 O ATOM 816 CB MET A 56 7.817 1.914 0.532 1.00 0.00 C ATOM 817 CG MET A 56 9.043 1.290 1.217 1.00 0.00 C ATOM 818 SD MET A 56 9.186 1.683 2.982 1.00 0.00 S ATOM 819 CE MET A 56 10.863 1.064 3.285 1.00 0.00 C ATOM 0 H MET A 56 6.819 -0.318 0.450 1.00 0.00 H new ATOM 0 HA MET A 56 6.721 1.909 -1.300 1.00 0.00 H new ATOM 0 HB2 MET A 56 8.014 2.971 0.354 1.00 0.00 H new ATOM 0 HB3 MET A 56 6.967 1.858 1.212 1.00 0.00 H new ATOM 0 HG2 MET A 56 9.000 0.207 1.099 1.00 0.00 H new ATOM 0 HG3 MET A 56 9.944 1.630 0.706 1.00 0.00 H new ATOM 0 HE1 MET A 56 11.126 1.223 4.331 1.00 0.00 H new ATOM 0 HE2 MET A 56 10.904 -0.001 3.058 1.00 0.00 H new ATOM 0 HE3 MET A 56 11.568 1.598 2.648 1.00 0.00 H new ATOM 827 N VAL A 57 8.857 2.042 -2.662 1.00 0.00 N ATOM 828 CA VAL A 57 10.004 2.103 -3.604 1.00 0.00 C ATOM 829 C VAL A 57 10.274 3.549 -4.004 1.00 0.00 C ATOM 830 O VAL A 57 9.349 4.350 -4.006 1.00 0.00 O ATOM 831 CB VAL A 57 9.744 1.351 -4.932 1.00 0.00 C ATOM 832 CG1 VAL A 57 10.149 -0.117 -4.859 1.00 0.00 C ATOM 833 CG2 VAL A 57 8.312 1.435 -5.459 1.00 0.00 C ATOM 0 H VAL A 57 8.228 2.838 -2.770 1.00 0.00 H new ATOM 0 HA VAL A 57 10.837 1.642 -3.073 1.00 0.00 H new ATOM 0 HB VAL A 57 10.379 1.884 -5.640 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.946 -0.598 -5.816 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.213 -0.190 -4.634 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.578 -0.613 -4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.234 0.877 -6.392 1.00 0.00 H new ATOM 0 HG22 VAL A 57 7.628 1.010 -4.724 1.00 0.00 H new ATOM 0 HG23 VAL A 57 8.051 2.478 -5.638 1.00 0.00 H new ATOM 843 N ASP A 58 11.494 3.905 -4.409 1.00 0.00 N ATOM 844 CA ASP A 58 11.789 5.244 -4.957 1.00 0.00 C ATOM 845 C ASP A 58 11.092 5.497 -6.316 1.00 0.00 C ATOM 846 O ASP A 58 10.726 4.543 -7.011 1.00 0.00 O ATOM 847 CB ASP A 58 13.305 5.396 -5.139 1.00 0.00 C ATOM 848 CG ASP A 58 14.057 5.248 -3.807 1.00 0.00 C ATOM 849 OD1 ASP A 58 14.248 6.267 -3.104 1.00 0.00 O ATOM 850 OD2 ASP A 58 14.453 4.108 -3.464 1.00 0.00 O ATOM 0 H ASP A 58 12.303 3.285 -4.370 1.00 0.00 H new ATOM 0 HA ASP A 58 11.405 5.976 -4.247 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.663 4.646 -5.844 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.523 6.372 -5.573 1.00 0.00 H new ATOM 854 N LYS A 59 11.005 6.764 -6.763 1.00 0.00 N ATOM 855 CA LYS A 59 10.572 7.136 -8.133 1.00 0.00 C ATOM 856 C LYS A 59 11.315 6.336 -9.214 1.00 0.00 C ATOM 857 O LYS A 59 10.683 5.829 -10.132 1.00 0.00 O ATOM 858 CB LYS A 59 10.753 8.654 -8.341 1.00 0.00 C ATOM 859 CG LYS A 59 10.255 9.147 -9.722 1.00 0.00 C ATOM 860 CD LYS A 59 11.160 10.243 -10.309 1.00 0.00 C ATOM 861 CE LYS A 59 10.818 10.505 -11.788 1.00 0.00 C ATOM 862 NZ LYS A 59 11.969 10.236 -12.693 1.00 0.00 N ATOM 0 H LYS A 59 11.235 7.570 -6.181 1.00 0.00 H new ATOM 0 HA LYS A 59 9.516 6.885 -8.233 1.00 0.00 H new ATOM 0 HB2 LYS A 59 10.216 9.188 -7.557 1.00 0.00 H new ATOM 0 HB3 LYS A 59 11.808 8.905 -8.232 1.00 0.00 H new ATOM 0 HG2 LYS A 59 10.213 8.305 -10.413 1.00 0.00 H new ATOM 0 HG3 LYS A 59 9.239 9.531 -9.624 1.00 0.00 H new ATOM 0 HD2 LYS A 59 11.042 11.163 -9.736 1.00 0.00 H new ATOM 0 HD3 LYS A 59 12.204 9.944 -10.221 1.00 0.00 H new ATOM 0 HE2 LYS A 59 9.976 9.878 -12.080 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.500 11.541 -11.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 11.947 10.904 -13.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 12.859 10.353 -12.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.906 9.263 -13.055 1.00 0.00 H new ATOM 872 N ASP A 60 12.635 6.169 -9.085 1.00 0.00 N ATOM 873 CA ASP A 60 13.485 5.376 -9.995 1.00 0.00 C ATOM 874 C ASP A 60 13.022 3.913 -10.155 1.00 0.00 C ATOM 875 O ASP A 60 12.986 3.385 -11.267 1.00 0.00 O ATOM 876 CB ASP A 60 14.928 5.445 -9.464 1.00 0.00 C ATOM 877 CG ASP A 60 15.862 4.460 -10.187 1.00 0.00 C ATOM 878 OD1 ASP A 60 16.239 4.718 -11.353 1.00 0.00 O ATOM 879 OD2 ASP A 60 16.222 3.424 -9.578 1.00 0.00 O ATOM 0 H ASP A 60 13.163 6.593 -8.322 1.00 0.00 H new ATOM 0 HA ASP A 60 13.413 5.803 -10.995 1.00 0.00 H new ATOM 0 HB2 ASP A 60 15.309 6.459 -9.584 1.00 0.00 H new ATOM 0 HB3 ASP A 60 14.931 5.228 -8.396 1.00 0.00 H new ATOM 883 N GLN A 61 12.627 3.262 -9.060 1.00 0.00 N ATOM 884 CA GLN A 61 12.114 1.888 -9.083 1.00 0.00 C ATOM 885 C GLN A 61 10.641 1.831 -9.546 1.00 0.00 C ATOM 886 O GLN A 61 10.276 0.946 -10.325 1.00 0.00 O ATOM 887 CB GLN A 61 12.294 1.274 -7.685 1.00 0.00 C ATOM 888 CG GLN A 61 13.744 0.870 -7.366 1.00 0.00 C ATOM 889 CD GLN A 61 14.299 -0.265 -8.234 1.00 0.00 C ATOM 890 OE1 GLN A 61 13.595 -0.999 -8.910 1.00 0.00 O ATOM 891 NE2 GLN A 61 15.597 -0.473 -8.247 1.00 0.00 N ATOM 0 H GLN A 61 12.653 3.673 -8.127 1.00 0.00 H new ATOM 0 HA GLN A 61 12.680 1.306 -9.810 1.00 0.00 H new ATOM 0 HB2 GLN A 61 11.953 1.990 -6.937 1.00 0.00 H new ATOM 0 HB3 GLN A 61 11.655 0.395 -7.599 1.00 0.00 H new ATOM 0 HG2 GLN A 61 14.384 1.744 -7.482 1.00 0.00 H new ATOM 0 HG3 GLN A 61 13.801 0.570 -6.320 1.00 0.00 H new ATOM 0 HE21 GLN A 61 16.214 0.121 -7.694 1.00 0.00 H new ATOM 0 HE22 GLN A 61 15.987 -1.229 -8.810 1.00 0.00 H new ATOM 898 N ALA A 62 9.818 2.815 -9.158 1.00 0.00 N ATOM 899 CA ALA A 62 8.468 3.024 -9.688 1.00 0.00 C ATOM 900 C ALA A 62 8.463 3.326 -11.207 1.00 0.00 C ATOM 901 O ALA A 62 7.471 3.058 -11.886 1.00 0.00 O ATOM 902 CB ALA A 62 7.776 4.131 -8.877 1.00 0.00 C ATOM 0 H ALA A 62 10.080 3.502 -8.451 1.00 0.00 H new ATOM 0 HA ALA A 62 7.906 2.096 -9.578 1.00 0.00 H new ATOM 0 HB1 ALA A 62 6.771 4.292 -9.266 1.00 0.00 H new ATOM 0 HB2 ALA A 62 7.717 3.832 -7.830 1.00 0.00 H new ATOM 0 HB3 ALA A 62 8.349 5.055 -8.959 1.00 0.00 H new ATOM 908 N ASP A 63 9.567 3.842 -11.773 1.00 0.00 N ATOM 909 CA ASP A 63 9.781 4.040 -13.222 1.00 0.00 C ATOM 910 C ASP A 63 9.916 2.716 -14.003 1.00 0.00 C ATOM 911 O ASP A 63 9.532 2.643 -15.175 1.00 0.00 O ATOM 912 CB ASP A 63 11.035 4.929 -13.448 1.00 0.00 C ATOM 913 CG ASP A 63 10.782 6.158 -14.336 1.00 0.00 C ATOM 914 OD1 ASP A 63 10.103 6.042 -15.384 1.00 0.00 O ATOM 915 OD2 ASP A 63 11.291 7.258 -13.999 1.00 0.00 O ATOM 0 H ASP A 63 10.366 4.145 -11.216 1.00 0.00 H new ATOM 0 HA ASP A 63 8.893 4.537 -13.611 1.00 0.00 H new ATOM 0 HB2 ASP A 63 11.409 5.264 -12.480 1.00 0.00 H new ATOM 0 HB3 ASP A 63 11.820 4.323 -13.900 1.00 0.00 H new ATOM 919 N ARG A 64 10.433 1.661 -13.350 1.00 0.00 N ATOM 920 CA ARG A 64 10.551 0.308 -13.927 1.00 0.00 C ATOM 921 C ARG A 64 9.266 -0.507 -13.744 1.00 0.00 C ATOM 922 O ARG A 64 8.501 -0.602 -14.700 1.00 0.00 O ATOM 923 CB ARG A 64 11.783 -0.450 -13.387 1.00 0.00 C ATOM 924 CG ARG A 64 13.090 0.025 -14.044 1.00 0.00 C ATOM 925 CD ARG A 64 14.185 -1.023 -13.830 1.00 0.00 C ATOM 926 NE ARG A 64 15.442 -0.616 -14.486 1.00 0.00 N ATOM 927 CZ ARG A 64 16.387 -1.410 -14.957 1.00 0.00 C ATOM 928 NH1 ARG A 64 16.314 -2.711 -14.890 1.00 0.00 N ATOM 929 NH2 ARG A 64 17.446 -0.906 -15.514 1.00 0.00 N ATOM 0 H ARG A 64 10.785 1.723 -12.395 1.00 0.00 H new ATOM 0 HA ARG A 64 10.701 0.440 -14.999 1.00 0.00 H new ATOM 0 HB2 ARG A 64 11.849 -0.311 -12.308 1.00 0.00 H new ATOM 0 HB3 ARG A 64 11.657 -1.518 -13.564 1.00 0.00 H new ATOM 0 HG2 ARG A 64 12.934 0.189 -15.110 1.00 0.00 H new ATOM 0 HG3 ARG A 64 13.398 0.979 -13.616 1.00 0.00 H new ATOM 0 HD2 ARG A 64 14.356 -1.162 -12.763 1.00 0.00 H new ATOM 0 HD3 ARG A 64 13.857 -1.983 -14.228 1.00 0.00 H new ATOM 0 HE ARG A 64 15.598 0.387 -14.587 1.00 0.00 H new ATOM 0 HH11 ARG A 64 15.502 -3.155 -14.460 1.00 0.00 H new ATOM 0 HH12 ARG A 64 17.069 -3.284 -15.267 1.00 0.00 H new ATOM 0 HH21 ARG A 64 17.550 0.106 -15.589 1.00 0.00 H new ATOM 0 HH22 ARG A 64 18.174 -1.522 -15.877 1.00 0.00 H new ATOM 940 N CYS A 65 9.083 -1.087 -12.545 1.00 0.00 N ATOM 941 CA CYS A 65 8.098 -2.109 -12.109 1.00 0.00 C ATOM 942 C CYS A 65 8.661 -3.088 -11.076 1.00 0.00 C ATOM 943 O CYS A 65 7.930 -3.550 -10.199 1.00 0.00 O ATOM 944 CB CYS A 65 7.504 -2.932 -13.272 1.00 0.00 C ATOM 945 SG CYS A 65 5.871 -2.451 -13.897 1.00 0.00 S ATOM 0 H CYS A 65 9.687 -0.826 -11.766 1.00 0.00 H new ATOM 0 HA CYS A 65 7.306 -1.515 -11.653 1.00 0.00 H new ATOM 0 HB2 CYS A 65 8.207 -2.892 -14.104 1.00 0.00 H new ATOM 0 HB3 CYS A 65 7.448 -3.972 -12.952 1.00 0.00 H new ATOM 949 N THR A 66 9.941 -3.442 -11.186 1.00 0.00 N ATOM 950 CA THR A 66 10.644 -4.254 -10.182 1.00 0.00 C ATOM 951 C THR A 66 10.676 -3.523 -8.833 1.00 0.00 C ATOM 952 O THR A 66 10.724 -2.289 -8.780 1.00 0.00 O ATOM 953 CB THR A 66 12.057 -4.639 -10.668 1.00 0.00 C ATOM 954 OG1 THR A 66 12.792 -3.513 -11.098 1.00 0.00 O ATOM 955 CG2 THR A 66 11.982 -5.555 -11.891 1.00 0.00 C ATOM 0 H THR A 66 10.526 -3.174 -11.977 1.00 0.00 H new ATOM 0 HA THR A 66 10.096 -5.185 -10.040 1.00 0.00 H new ATOM 0 HB THR A 66 12.536 -5.123 -9.817 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.681 -3.797 -11.396 1.00 0.00 H new ATOM 0 HG21 THR A 66 12.990 -5.813 -12.215 1.00 0.00 H new ATOM 0 HG22 THR A 66 11.441 -6.465 -11.632 1.00 0.00 H new ATOM 0 HG23 THR A 66 11.461 -5.041 -12.699 1.00 0.00 H new ATOM 963 N ILE A 67 10.608 -4.276 -7.729 1.00 0.00 N ATOM 964 CA ILE A 67 10.661 -3.744 -6.350 1.00 0.00 C ATOM 965 C ILE A 67 12.092 -3.978 -5.807 1.00 0.00 C ATOM 966 O ILE A 67 12.750 -4.958 -6.166 1.00 0.00 O ATOM 967 CB ILE A 67 9.512 -4.333 -5.464 1.00 0.00 C ATOM 968 CG1 ILE A 67 8.162 -4.341 -6.225 1.00 0.00 C ATOM 969 CG2 ILE A 67 9.420 -3.617 -4.108 1.00 0.00 C ATOM 970 CD1 ILE A 67 6.896 -4.377 -5.362 1.00 0.00 C ATOM 0 H ILE A 67 10.513 -5.291 -7.763 1.00 0.00 H new ATOM 0 HA ILE A 67 10.474 -2.670 -6.331 1.00 0.00 H new ATOM 0 HB ILE A 67 9.757 -5.373 -5.248 1.00 0.00 H new ATOM 0 HG12 ILE A 67 8.120 -3.454 -6.857 1.00 0.00 H new ATOM 0 HG13 ILE A 67 8.148 -5.206 -6.888 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.612 -4.053 -3.521 1.00 0.00 H new ATOM 0 HG22 ILE A 67 10.362 -3.732 -3.571 1.00 0.00 H new ATOM 0 HG23 ILE A 67 9.221 -2.557 -4.269 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.017 -4.380 -6.006 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.899 -5.278 -4.749 1.00 0.00 H new ATOM 0 HD13 ILE A 67 6.871 -3.499 -4.717 1.00 0.00 H new ATOM 981 N LYS A 68 12.625 -3.095 -4.955 1.00 0.00 N ATOM 982 CA LYS A 68 13.920 -3.335 -4.283 1.00 0.00 C ATOM 983 C LYS A 68 13.723 -4.342 -3.142 1.00 0.00 C ATOM 984 O LYS A 68 12.871 -4.129 -2.278 1.00 0.00 O ATOM 985 CB LYS A 68 14.508 -2.016 -3.741 1.00 0.00 C ATOM 986 CG LYS A 68 16.043 -1.975 -3.743 1.00 0.00 C ATOM 987 CD LYS A 68 16.595 -1.293 -5.002 1.00 0.00 C ATOM 988 CE LYS A 68 18.075 -0.936 -4.806 1.00 0.00 C ATOM 989 NZ LYS A 68 18.983 -1.760 -5.645 1.00 0.00 N ATOM 0 H LYS A 68 12.185 -2.208 -4.711 1.00 0.00 H new ATOM 0 HA LYS A 68 14.625 -3.744 -5.007 1.00 0.00 H new ATOM 0 HB2 LYS A 68 14.131 -1.187 -4.341 1.00 0.00 H new ATOM 0 HB3 LYS A 68 14.151 -1.861 -2.723 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.393 -1.443 -2.859 1.00 0.00 H new ATOM 0 HG3 LYS A 68 16.433 -2.991 -3.679 1.00 0.00 H new ATOM 0 HD2 LYS A 68 16.484 -1.954 -5.861 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.021 -0.392 -5.217 1.00 0.00 H new ATOM 0 HE2 LYS A 68 18.224 0.117 -5.044 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.339 -1.066 -3.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 19.968 -1.476 -5.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 18.864 -2.764 -5.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 18.753 -1.617 -6.649 1.00 0.00 H new ATOM 999 N LYS A 69 14.540 -5.399 -3.085 1.00 0.00 N ATOM 1000 CA LYS A 69 14.617 -6.351 -1.950 1.00 0.00 C ATOM 1001 C LYS A 69 15.054 -5.711 -0.620 1.00 0.00 C ATOM 1002 O LYS A 69 14.787 -6.263 0.445 1.00 0.00 O ATOM 1003 CB LYS A 69 15.536 -7.528 -2.334 1.00 0.00 C ATOM 1004 CG LYS A 69 17.010 -7.109 -2.433 1.00 0.00 C ATOM 1005 CD LYS A 69 17.867 -8.212 -3.062 1.00 0.00 C ATOM 1006 CE LYS A 69 19.316 -7.718 -3.146 1.00 0.00 C ATOM 1007 NZ LYS A 69 20.259 -8.832 -3.417 1.00 0.00 N ATOM 0 H LYS A 69 15.185 -5.630 -3.840 1.00 0.00 H new ATOM 0 HA LYS A 69 13.605 -6.711 -1.766 1.00 0.00 H new ATOM 0 HB2 LYS A 69 15.435 -8.321 -1.593 1.00 0.00 H new ATOM 0 HB3 LYS A 69 15.213 -7.941 -3.290 1.00 0.00 H new ATOM 0 HG2 LYS A 69 17.091 -6.200 -3.028 1.00 0.00 H new ATOM 0 HG3 LYS A 69 17.390 -6.874 -1.439 1.00 0.00 H new ATOM 0 HD2 LYS A 69 17.812 -9.122 -2.464 1.00 0.00 H new ATOM 0 HD3 LYS A 69 17.494 -8.461 -4.056 1.00 0.00 H new ATOM 0 HE2 LYS A 69 19.401 -6.969 -3.934 1.00 0.00 H new ATOM 0 HE3 LYS A 69 19.589 -7.229 -2.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 21.229 -8.461 -3.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 20.196 -9.534 -2.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 20.013 -9.282 -4.322 1.00 0.00 H new ATOM 1017 N GLU A 70 15.718 -4.548 -0.676 1.00 0.00 N ATOM 1018 CA GLU A 70 16.107 -3.750 0.502 1.00 0.00 C ATOM 1019 C GLU A 70 14.928 -3.019 1.176 1.00 0.00 C ATOM 1020 O GLU A 70 15.060 -2.551 2.311 1.00 0.00 O ATOM 1021 CB GLU A 70 17.197 -2.727 0.132 1.00 0.00 C ATOM 1022 CG GLU A 70 18.489 -3.382 -0.380 1.00 0.00 C ATOM 1023 CD GLU A 70 19.716 -2.499 -0.067 1.00 0.00 C ATOM 1024 OE1 GLU A 70 19.941 -1.483 -0.765 1.00 0.00 O ATOM 1025 OE2 GLU A 70 20.465 -2.820 0.893 1.00 0.00 O ATOM 0 H GLU A 70 16.007 -4.125 -1.558 1.00 0.00 H new ATOM 0 HA GLU A 70 16.492 -4.468 1.226 1.00 0.00 H new ATOM 0 HB2 GLU A 70 16.810 -2.054 -0.633 1.00 0.00 H new ATOM 0 HB3 GLU A 70 17.427 -2.118 1.006 1.00 0.00 H new ATOM 0 HG2 GLU A 70 18.613 -4.361 0.083 1.00 0.00 H new ATOM 0 HG3 GLU A 70 18.418 -3.544 -1.455 1.00 0.00 H new ATOM 1030 N ASN A 71 13.772 -2.924 0.508 1.00 0.00 N ATOM 1031 CA ASN A 71 12.533 -2.439 1.119 1.00 0.00 C ATOM 1032 C ASN A 71 11.940 -3.462 2.105 1.00 0.00 C ATOM 1033 O ASN A 71 12.434 -4.584 2.252 1.00 0.00 O ATOM 1034 CB ASN A 71 11.530 -2.079 0.009 1.00 0.00 C ATOM 1035 CG ASN A 71 12.054 -1.000 -0.925 1.00 0.00 C ATOM 1036 OD1 ASN A 71 11.850 -1.165 -2.205 1.00 0.00 O flip ATOM 1037 ND2 ASN A 71 12.652 -0.014 -0.521 1.00 0.00 N flip ATOM 0 H ASN A 71 13.671 -3.182 -0.474 1.00 0.00 H new ATOM 0 HA ASN A 71 12.757 -1.546 1.703 1.00 0.00 H new ATOM 0 HB2 ASN A 71 11.297 -2.973 -0.569 1.00 0.00 H new ATOM 0 HB3 ASN A 71 10.598 -1.741 0.462 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.810 0.113 0.479 1.00 0.00 H new ATOM 0 HD22 ASN A 71 12.993 0.683 -1.183 1.00 0.00 H new ATOM 1043 N THR A 72 10.836 -3.082 2.740 1.00 0.00 N ATOM 1044 CA THR A 72 10.149 -3.869 3.769 1.00 0.00 C ATOM 1045 C THR A 72 8.698 -4.117 3.329 1.00 0.00 C ATOM 1046 O THR A 72 8.080 -3.186 2.795 1.00 0.00 O ATOM 1047 CB THR A 72 10.218 -3.121 5.114 1.00 0.00 C ATOM 1048 OG1 THR A 72 11.562 -3.103 5.556 1.00 0.00 O ATOM 1049 CG2 THR A 72 9.367 -3.708 6.240 1.00 0.00 C ATOM 0 H THR A 72 10.377 -2.191 2.550 1.00 0.00 H new ATOM 0 HA THR A 72 10.634 -4.837 3.898 1.00 0.00 H new ATOM 0 HB THR A 72 9.815 -2.129 4.910 1.00 0.00 H new ATOM 0 HG1 THR A 72 11.619 -2.628 6.411 1.00 0.00 H new ATOM 0 HG21 THR A 72 9.489 -3.106 7.140 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.318 -3.707 5.942 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.686 -4.731 6.442 1.00 0.00 H new ATOM 1057 N PRO A 73 8.143 -5.334 3.529 1.00 0.00 N ATOM 1058 CA PRO A 73 6.739 -5.644 3.234 1.00 0.00 C ATOM 1059 C PRO A 73 5.793 -4.852 4.156 1.00 0.00 C ATOM 1060 O PRO A 73 5.437 -5.304 5.248 1.00 0.00 O ATOM 1061 CB PRO A 73 6.587 -7.161 3.380 1.00 0.00 C ATOM 1062 CG PRO A 73 7.826 -7.635 4.141 1.00 0.00 C ATOM 1063 CD PRO A 73 8.853 -6.505 4.029 1.00 0.00 C ATOM 0 HA PRO A 73 6.464 -5.344 2.223 1.00 0.00 H new ATOM 0 HB2 PRO A 73 5.676 -7.412 3.923 1.00 0.00 H new ATOM 0 HB3 PRO A 73 6.520 -7.643 2.404 1.00 0.00 H new ATOM 0 HG2 PRO A 73 7.587 -7.842 5.184 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.216 -8.559 3.714 1.00 0.00 H new ATOM 0 HD2 PRO A 73 9.305 -6.297 4.999 1.00 0.00 H new ATOM 0 HD3 PRO A 73 9.662 -6.784 3.353 1.00 0.00 H new ATOM 1068 N LEU A 74 5.413 -3.637 3.746 1.00 0.00 N ATOM 1069 CA LEU A 74 4.482 -2.786 4.494 1.00 0.00 C ATOM 1070 C LEU A 74 3.074 -3.405 4.503 1.00 0.00 C ATOM 1071 O LEU A 74 2.421 -3.423 5.547 1.00 0.00 O ATOM 1072 CB LEU A 74 4.515 -1.348 3.920 1.00 0.00 C ATOM 1073 CG LEU A 74 3.992 -0.219 4.841 1.00 0.00 C ATOM 1074 CD1 LEU A 74 2.470 -0.148 4.971 1.00 0.00 C ATOM 1075 CD2 LEU A 74 4.600 -0.255 6.248 1.00 0.00 C ATOM 0 H LEU A 74 5.745 -3.214 2.880 1.00 0.00 H new ATOM 0 HA LEU A 74 4.791 -2.721 5.537 1.00 0.00 H new ATOM 0 HB2 LEU A 74 5.544 -1.115 3.646 1.00 0.00 H new ATOM 0 HB3 LEU A 74 3.930 -1.335 3.000 1.00 0.00 H new ATOM 0 HG LEU A 74 4.324 0.680 4.322 1.00 0.00 H new ATOM 0 HD11 LEU A 74 2.199 0.673 5.635 1.00 0.00 H new ATOM 0 HD12 LEU A 74 2.028 0.020 3.989 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.096 -1.086 5.382 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.191 0.562 6.842 1.00 0.00 H new ATOM 0 HD22 LEU A 74 4.359 -1.205 6.724 1.00 0.00 H new ATOM 0 HD23 LEU A 74 5.683 -0.148 6.179 1.00 0.00 H new ATOM 1086 N LEU A 75 2.636 -3.989 3.376 1.00 0.00 N ATOM 1087 CA LEU A 75 1.289 -4.551 3.229 1.00 0.00 C ATOM 1088 C LEU A 75 1.284 -5.909 2.524 1.00 0.00 C ATOM 1089 O LEU A 75 1.677 -6.003 1.363 1.00 0.00 O ATOM 1090 CB LEU A 75 0.444 -3.538 2.447 1.00 0.00 C ATOM 1091 CG LEU A 75 -1.078 -3.738 2.501 1.00 0.00 C ATOM 1092 CD1 LEU A 75 -1.654 -4.926 1.722 1.00 0.00 C ATOM 1093 CD2 LEU A 75 -1.611 -3.835 3.930 1.00 0.00 C ATOM 0 H LEU A 75 3.211 -4.084 2.539 1.00 0.00 H new ATOM 0 HA LEU A 75 0.874 -4.729 4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.672 -2.540 2.822 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.756 -3.565 1.403 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.419 -2.832 2.000 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.737 -4.951 1.845 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.411 -4.820 0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.224 -5.853 2.102 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.692 -3.976 3.907 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.146 -4.681 4.435 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.376 -2.917 4.469 1.00 0.00 H new ATOM 1104 N ASN A 76 0.745 -6.935 3.192 1.00 0.00 N ATOM 1105 CA ASN A 76 0.765 -8.334 2.743 1.00 0.00 C ATOM 1106 C ASN A 76 -0.658 -8.932 2.659 1.00 0.00 C ATOM 1107 O ASN A 76 -1.050 -9.751 3.495 1.00 0.00 O ATOM 1108 CB ASN A 76 1.706 -9.152 3.656 1.00 0.00 C ATOM 1109 CG ASN A 76 3.190 -8.886 3.436 1.00 0.00 C ATOM 1110 OD1 ASN A 76 3.601 -7.953 2.767 1.00 0.00 O ATOM 1111 ND2 ASN A 76 4.050 -9.729 3.959 1.00 0.00 N ATOM 0 H ASN A 76 0.269 -6.813 4.086 1.00 0.00 H new ATOM 0 HA ASN A 76 1.157 -8.377 1.727 1.00 0.00 H new ATOM 0 HB2 ASN A 76 1.461 -8.935 4.696 1.00 0.00 H new ATOM 0 HB3 ASN A 76 1.513 -10.213 3.498 1.00 0.00 H new ATOM 0 HD21 ASN A 76 5.050 -9.600 3.804 1.00 0.00 H new ATOM 0 HD22 ASN A 76 3.718 -10.513 4.520 1.00 0.00 H new ATOM 1117 N CYS A 77 -1.459 -8.487 1.685 1.00 0.00 N ATOM 1118 CA CYS A 77 -2.826 -8.975 1.468 1.00 0.00 C ATOM 1119 C CYS A 77 -2.846 -10.412 0.914 1.00 0.00 C ATOM 1120 O CYS A 77 -2.527 -10.660 -0.255 1.00 0.00 O ATOM 1121 CB CYS A 77 -3.606 -8.052 0.530 1.00 0.00 C ATOM 1122 SG CYS A 77 -5.225 -8.762 0.106 1.00 0.00 S ATOM 0 H CYS A 77 -1.174 -7.770 1.018 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.310 -8.978 2.445 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.745 -7.080 1.004 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -3.030 -7.883 -0.380 1.00 0.00 H new ATOM 1126 N ALA A 78 -3.280 -11.347 1.766 1.00 0.00 N ATOM 1127 CA ALA A 78 -3.049 -12.789 1.648 1.00 0.00 C ATOM 1128 C ALA A 78 -1.543 -13.167 1.598 1.00 0.00 C ATOM 1129 O ALA A 78 -0.702 -12.350 1.220 1.00 0.00 O ATOM 1130 CB ALA A 78 -3.894 -13.366 0.495 1.00 0.00 C ATOM 0 H ALA A 78 -3.826 -11.107 2.593 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.394 -13.269 2.564 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.716 -14.438 0.415 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.951 -13.188 0.694 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.614 -12.881 -0.440 1.00 0.00 H new ATOM 1136 N LYS A 79 -1.231 -14.404 2.032 1.00 0.00 N ATOM 1137 CA LYS A 79 0.099 -15.023 2.336 1.00 0.00 C ATOM 1138 C LYS A 79 0.089 -15.903 3.599 1.00 0.00 C ATOM 1139 O LYS A 79 0.619 -17.013 3.513 1.00 0.00 O ATOM 1140 CB LYS A 79 1.266 -14.004 2.338 1.00 0.00 C ATOM 1141 CG LYS A 79 2.605 -14.424 2.994 1.00 0.00 C ATOM 1142 CD LYS A 79 2.744 -13.932 4.456 1.00 0.00 C ATOM 1143 CE LYS A 79 2.858 -15.071 5.481 1.00 0.00 C ATOM 1144 NZ LYS A 79 4.149 -15.019 6.223 1.00 0.00 N ATOM 0 H LYS A 79 -1.978 -15.077 2.200 1.00 0.00 H new ATOM 0 HA LYS A 79 0.289 -15.697 1.501 1.00 0.00 H new ATOM 0 HB2 LYS A 79 1.473 -13.733 1.303 1.00 0.00 H new ATOM 0 HB3 LYS A 79 0.918 -13.101 2.840 1.00 0.00 H new ATOM 0 HG2 LYS A 79 2.688 -15.511 2.973 1.00 0.00 H new ATOM 0 HG3 LYS A 79 3.432 -14.029 2.404 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.625 -13.295 4.534 1.00 0.00 H new ATOM 0 HD3 LYS A 79 1.881 -13.315 4.706 1.00 0.00 H new ATOM 0 HE2 LYS A 79 2.030 -15.009 6.187 1.00 0.00 H new ATOM 0 HE3 LYS A 79 2.770 -16.030 4.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 4.189 -15.803 6.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.939 -15.103 5.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 4.221 -14.114 6.731 1.00 0.00 H new ATOM 1154 N PRO A 80 -0.470 -15.467 4.754 1.00 0.00 N ATOM 1155 CA PRO A 80 -0.541 -16.304 5.948 1.00 0.00 C ATOM 1156 C PRO A 80 -1.692 -17.331 5.809 1.00 0.00 C ATOM 1157 O PRO A 80 -1.585 -18.273 5.023 1.00 0.00 O ATOM 1158 CB PRO A 80 -0.651 -15.307 7.110 1.00 0.00 C ATOM 1159 CG PRO A 80 -1.351 -14.078 6.524 1.00 0.00 C ATOM 1160 CD PRO A 80 -1.071 -14.159 5.017 1.00 0.00 C ATOM 0 HA PRO A 80 0.328 -16.939 6.119 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -1.223 -15.728 7.937 1.00 0.00 H new ATOM 0 HB3 PRO A 80 0.333 -15.050 7.502 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -2.421 -14.095 6.730 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -0.958 -13.156 6.952 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -1.993 -14.039 4.448 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -0.399 -13.358 4.708 1.00 0.00 H new ATOM 1165 N ASP A 81 -2.799 -17.166 6.542 1.00 0.00 N ATOM 1166 CA ASP A 81 -3.984 -18.048 6.491 1.00 0.00 C ATOM 1167 C ASP A 81 -5.257 -17.356 7.051 1.00 0.00 C ATOM 1168 O ASP A 81 -6.157 -17.992 7.606 1.00 0.00 O ATOM 1169 CB ASP A 81 -3.669 -19.375 7.218 1.00 0.00 C ATOM 1170 CG ASP A 81 -4.323 -20.591 6.527 1.00 0.00 C ATOM 1171 OD1 ASP A 81 -5.430 -20.480 5.951 1.00 0.00 O ATOM 1172 OD2 ASP A 81 -3.706 -21.686 6.546 1.00 0.00 O ATOM 0 H ASP A 81 -2.904 -16.398 7.205 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.208 -18.269 5.448 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -2.589 -19.519 7.256 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -4.019 -19.314 8.249 1.00 0.00 H new ATOM 1176 N GLN A 82 -5.306 -16.018 6.975 1.00 0.00 N ATOM 1177 CA GLN A 82 -6.336 -15.166 7.590 1.00 0.00 C ATOM 1178 C GLN A 82 -6.499 -13.821 6.864 1.00 0.00 C ATOM 1179 O GLN A 82 -5.644 -13.419 6.070 1.00 0.00 O ATOM 1180 CB GLN A 82 -5.995 -14.929 9.083 1.00 0.00 C ATOM 1181 CG GLN A 82 -7.136 -15.419 9.992 1.00 0.00 C ATOM 1182 CD GLN A 82 -7.044 -14.916 11.438 1.00 0.00 C ATOM 1183 OE1 GLN A 82 -6.026 -14.426 11.913 1.00 0.00 O ATOM 1184 NE2 GLN A 82 -8.112 -15.006 12.204 1.00 0.00 N ATOM 0 H GLN A 82 -4.605 -15.480 6.466 1.00 0.00 H new ATOM 0 HA GLN A 82 -7.288 -15.691 7.505 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -5.073 -15.452 9.337 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -5.818 -13.867 9.256 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -8.088 -15.099 9.567 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -7.140 -16.509 9.997 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -8.973 -15.410 11.834 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -8.078 -14.672 13.167 1.00 0.00 H new ATOM 1191 N ASP A 83 -7.595 -13.114 7.154 1.00 0.00 N ATOM 1192 CA ASP A 83 -7.776 -11.710 6.778 1.00 0.00 C ATOM 1193 C ASP A 83 -6.594 -10.845 7.260 1.00 0.00 C ATOM 1194 O ASP A 83 -6.066 -11.045 8.360 1.00 0.00 O ATOM 1195 CB ASP A 83 -9.118 -11.185 7.323 1.00 0.00 C ATOM 1196 CG ASP A 83 -9.294 -11.440 8.833 1.00 0.00 C ATOM 1197 OD1 ASP A 83 -9.635 -12.585 9.207 1.00 0.00 O ATOM 1198 OD2 ASP A 83 -9.111 -10.496 9.638 1.00 0.00 O ATOM 0 H ASP A 83 -8.389 -13.505 7.661 1.00 0.00 H new ATOM 0 HA ASP A 83 -7.798 -11.643 5.690 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.189 -10.115 7.130 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -9.935 -11.661 6.782 1.00 0.00 H new ATOM 1202 N ILE A 84 -6.197 -9.866 6.438 1.00 0.00 N ATOM 1203 CA ILE A 84 -5.209 -8.838 6.793 1.00 0.00 C ATOM 1204 C ILE A 84 -5.947 -7.527 7.061 1.00 0.00 C ATOM 1205 O ILE A 84 -6.866 -7.157 6.323 1.00 0.00 O ATOM 1206 CB ILE A 84 -4.078 -8.726 5.729 1.00 0.00 C ATOM 1207 CG1 ILE A 84 -2.691 -8.789 6.408 1.00 0.00 C ATOM 1208 CG2 ILE A 84 -4.132 -7.456 4.848 1.00 0.00 C ATOM 1209 CD1 ILE A 84 -2.353 -10.176 6.979 1.00 0.00 C ATOM 0 H ILE A 84 -6.560 -9.764 5.490 1.00 0.00 H new ATOM 0 HA ILE A 84 -4.686 -9.119 7.707 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.241 -9.575 5.066 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -1.927 -8.506 5.684 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -2.655 -8.054 7.212 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.304 -7.470 4.139 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.076 -7.431 4.303 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.054 -6.571 5.480 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.366 -10.149 7.441 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.096 -10.453 7.727 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.357 -10.911 6.175 1.00 0.00 H new ATOM 1220 N LYS A 85 -5.546 -6.844 8.138 1.00 0.00 N ATOM 1221 CA LYS A 85 -6.142 -5.600 8.643 1.00 0.00 C ATOM 1222 C LYS A 85 -5.034 -4.686 9.172 1.00 0.00 C ATOM 1223 O LYS A 85 -4.284 -5.085 10.067 1.00 0.00 O ATOM 1224 CB LYS A 85 -7.198 -5.889 9.736 1.00 0.00 C ATOM 1225 CG LYS A 85 -8.275 -6.889 9.284 1.00 0.00 C ATOM 1226 CD LYS A 85 -9.418 -7.091 10.291 1.00 0.00 C ATOM 1227 CE LYS A 85 -10.264 -5.827 10.524 1.00 0.00 C ATOM 1228 NZ LYS A 85 -10.126 -5.302 11.909 1.00 0.00 N ATOM 0 H LYS A 85 -4.761 -7.157 8.709 1.00 0.00 H new ATOM 0 HA LYS A 85 -6.658 -5.096 7.826 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -6.698 -6.279 10.622 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.677 -4.954 10.026 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -8.696 -6.547 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.802 -7.852 9.093 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -10.067 -7.892 9.936 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -8.999 -7.418 11.243 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.964 -5.056 9.814 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -11.312 -6.052 10.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -10.714 -4.451 12.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -10.437 -6.026 12.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.131 -5.061 12.091 1.00 0.00 H new ATOM 1238 N PHE A 86 -4.918 -3.481 8.616 1.00 0.00 N ATOM 1239 CA PHE A 86 -3.869 -2.507 8.950 1.00 0.00 C ATOM 1240 C PHE A 86 -4.493 -1.110 9.081 1.00 0.00 C ATOM 1241 O PHE A 86 -4.939 -0.520 8.092 1.00 0.00 O ATOM 1242 CB PHE A 86 -2.734 -2.556 7.900 1.00 0.00 C ATOM 1243 CG PHE A 86 -1.321 -2.573 8.448 1.00 0.00 C ATOM 1244 CD1 PHE A 86 -0.904 -3.592 9.331 1.00 0.00 C ATOM 1245 CD2 PHE A 86 -0.385 -1.615 8.000 1.00 0.00 C ATOM 1246 CE1 PHE A 86 0.433 -3.649 9.762 1.00 0.00 C ATOM 1247 CE2 PHE A 86 0.951 -1.678 8.428 1.00 0.00 C ATOM 1248 CZ PHE A 86 1.364 -2.693 9.312 1.00 0.00 C ATOM 0 H PHE A 86 -5.564 -3.143 7.903 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.417 -2.759 9.910 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -2.874 -3.444 7.284 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.837 -1.693 7.242 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -1.613 -4.329 9.676 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -0.698 -0.831 7.326 1.00 0.00 H new ATOM 0 HE1 PHE A 86 0.747 -4.428 10.440 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.664 -0.946 8.078 1.00 0.00 H new ATOM 0 HZ PHE A 86 2.391 -2.738 9.644 1.00 0.00 H new ATOM 1257 N THR A 87 -4.536 -0.571 10.302 1.00 0.00 N ATOM 1258 CA THR A 87 -4.971 0.813 10.555 1.00 0.00 C ATOM 1259 C THR A 87 -3.746 1.695 10.755 1.00 0.00 C ATOM 1260 O THR A 87 -2.894 1.428 11.609 1.00 0.00 O ATOM 1261 CB THR A 87 -5.981 0.912 11.717 1.00 0.00 C ATOM 1262 OG1 THR A 87 -6.651 2.158 11.669 1.00 0.00 O ATOM 1263 CG2 THR A 87 -5.428 0.674 13.134 1.00 0.00 C ATOM 0 H THR A 87 -4.271 -1.079 11.146 1.00 0.00 H new ATOM 0 HA THR A 87 -5.516 1.176 9.683 1.00 0.00 H new ATOM 0 HB THR A 87 -6.662 0.078 11.549 1.00 0.00 H new ATOM 0 HG1 THR A 87 -7.552 2.031 11.306 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.235 0.771 13.860 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.003 -0.328 13.195 1.00 0.00 H new ATOM 0 HG23 THR A 87 -4.654 1.410 13.351 1.00 0.00 H new ATOM 1271 N ILE A 88 -3.652 2.746 9.943 1.00 0.00 N ATOM 1272 CA ILE A 88 -2.649 3.811 10.049 1.00 0.00 C ATOM 1273 C ILE A 88 -3.387 5.151 10.141 1.00 0.00 C ATOM 1274 O ILE A 88 -4.459 5.342 9.556 1.00 0.00 O ATOM 1275 CB ILE A 88 -1.608 3.711 8.891 1.00 0.00 C ATOM 1276 CG1 ILE A 88 -0.508 2.704 9.308 1.00 0.00 C ATOM 1277 CG2 ILE A 88 -0.979 5.067 8.503 1.00 0.00 C ATOM 1278 CD1 ILE A 88 0.578 2.429 8.259 1.00 0.00 C ATOM 0 H ILE A 88 -4.295 2.887 9.164 1.00 0.00 H new ATOM 0 HA ILE A 88 -2.051 3.710 10.955 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.136 3.369 8.001 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.027 3.075 10.213 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -0.986 1.759 9.565 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -0.266 4.919 7.692 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -1.762 5.751 8.177 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.464 5.490 9.366 1.00 0.00 H new ATOM 0 HD11 ILE A 88 1.295 1.711 8.657 1.00 0.00 H new ATOM 0 HD12 ILE A 88 0.119 2.022 7.358 1.00 0.00 H new ATOM 0 HD13 ILE A 88 1.093 3.359 8.016 1.00 0.00 H new ATOM 1289 N LYS A 89 -2.798 6.081 10.893 1.00 0.00 N ATOM 1290 CA LYS A 89 -3.302 7.434 11.150 1.00 0.00 C ATOM 1291 C LYS A 89 -2.197 8.460 10.909 1.00 0.00 C ATOM 1292 O LYS A 89 -1.052 8.269 11.327 1.00 0.00 O ATOM 1293 CB LYS A 89 -3.891 7.473 12.575 1.00 0.00 C ATOM 1294 CG LYS A 89 -4.470 8.843 12.970 1.00 0.00 C ATOM 1295 CD LYS A 89 -5.652 8.723 13.950 1.00 0.00 C ATOM 1296 CE LYS A 89 -5.702 9.903 14.930 1.00 0.00 C ATOM 1297 NZ LYS A 89 -5.071 9.551 16.232 1.00 0.00 N ATOM 0 H LYS A 89 -1.911 5.904 11.364 1.00 0.00 H new ATOM 0 HA LYS A 89 -4.103 7.697 10.459 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.676 6.721 12.655 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -3.113 7.199 13.287 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -3.685 9.448 13.424 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -4.798 9.368 12.073 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -6.586 8.676 13.389 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -5.568 7.790 14.508 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -5.190 10.762 14.495 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -6.738 10.199 15.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -5.120 10.368 16.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -5.576 8.747 16.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -4.076 9.292 16.077 1.00 0.00 H new ATOM 1307 N PHE A 90 -2.553 9.551 10.241 1.00 0.00 N ATOM 1308 CA PHE A 90 -1.706 10.718 9.977 1.00 0.00 C ATOM 1309 C PHE A 90 -1.471 11.554 11.247 1.00 0.00 C ATOM 1310 O PHE A 90 -1.725 12.754 11.253 1.00 0.00 O ATOM 1311 CB PHE A 90 -2.326 11.539 8.831 1.00 0.00 C ATOM 1312 CG PHE A 90 -2.045 11.003 7.451 1.00 0.00 C ATOM 1313 CD1 PHE A 90 -0.732 11.084 6.940 1.00 0.00 C ATOM 1314 CD2 PHE A 90 -3.099 10.569 6.625 1.00 0.00 C ATOM 1315 CE1 PHE A 90 -0.473 10.714 5.613 1.00 0.00 C ATOM 1316 CE2 PHE A 90 -2.847 10.270 5.281 1.00 0.00 C ATOM 1317 CZ PHE A 90 -1.528 10.291 4.787 1.00 0.00 C ATOM 0 H PHE A 90 -3.488 9.655 9.847 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.717 10.383 9.665 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -3.405 11.583 8.976 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.954 12.562 8.892 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.073 11.431 7.571 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -4.097 10.467 7.026 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.535 10.754 5.227 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -3.666 10.023 4.621 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.327 9.982 3.772 1.00 0.00 H new ATOM 1326 N GLN A 91 -1.049 10.934 12.352 1.00 0.00 N ATOM 1327 CA GLN A 91 -0.589 11.614 13.574 1.00 0.00 C ATOM 1328 C GLN A 91 0.161 10.629 14.508 1.00 0.00 C ATOM 1329 O GLN A 91 0.718 9.633 14.047 1.00 0.00 O ATOM 1330 CB GLN A 91 -1.765 12.319 14.303 1.00 0.00 C ATOM 1331 CG GLN A 91 -1.256 13.588 15.032 1.00 0.00 C ATOM 1332 CD GLN A 91 -2.073 14.016 16.253 1.00 0.00 C ATOM 1333 OE1 GLN A 91 -3.050 13.399 16.656 1.00 0.00 O ATOM 1334 NE2 GLN A 91 -1.669 15.077 16.923 1.00 0.00 N ATOM 0 H GLN A 91 -1.015 9.917 12.427 1.00 0.00 H new ATOM 0 HA GLN A 91 0.119 12.390 13.282 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -2.539 12.589 13.584 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -2.220 11.636 15.020 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -0.226 13.417 15.347 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -1.239 14.413 14.320 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -0.857 15.604 16.602 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -2.169 15.371 17.762 1.00 0.00 H new ATOM 1341 N GLU A 92 0.163 10.892 15.823 1.00 0.00 N ATOM 1342 CA GLU A 92 0.748 10.054 16.879 1.00 0.00 C ATOM 1343 C GLU A 92 2.252 9.814 16.676 1.00 0.00 C ATOM 1344 O GLU A 92 2.759 8.692 16.775 1.00 0.00 O ATOM 1345 CB GLU A 92 -0.122 8.799 17.084 1.00 0.00 C ATOM 1346 CG GLU A 92 -0.055 8.241 18.517 1.00 0.00 C ATOM 1347 CD GLU A 92 0.783 6.953 18.651 1.00 0.00 C ATOM 1348 OE1 GLU A 92 0.446 5.933 18.004 1.00 0.00 O ATOM 1349 OE2 GLU A 92 1.731 6.927 19.474 1.00 0.00 O ATOM 0 H GLU A 92 -0.265 11.739 16.197 1.00 0.00 H new ATOM 0 HA GLU A 92 0.727 10.585 17.831 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.157 9.040 16.843 1.00 0.00 H new ATOM 0 HB3 GLU A 92 0.197 8.026 16.385 1.00 0.00 H new ATOM 0 HG2 GLU A 92 0.363 9.004 19.174 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -1.068 8.041 18.866 1.00 0.00 H new ATOM 1354 N PHE A 93 2.963 10.906 16.360 1.00 0.00 N ATOM 1355 CA PHE A 93 4.416 10.942 16.245 1.00 0.00 C ATOM 1356 C PHE A 93 5.074 10.314 17.491 1.00 0.00 C ATOM 1357 O PHE A 93 4.711 10.635 18.630 1.00 0.00 O ATOM 1358 CB PHE A 93 4.892 12.389 15.969 1.00 0.00 C ATOM 1359 CG PHE A 93 4.591 13.422 17.045 1.00 0.00 C ATOM 1360 CD1 PHE A 93 5.487 13.615 18.121 1.00 0.00 C ATOM 1361 CD2 PHE A 93 3.424 14.214 16.971 1.00 0.00 C ATOM 1362 CE1 PHE A 93 5.205 14.563 19.121 1.00 0.00 C ATOM 1363 CE2 PHE A 93 3.147 15.166 17.970 1.00 0.00 C ATOM 1364 CZ PHE A 93 4.034 15.339 19.051 1.00 0.00 C ATOM 0 H PHE A 93 2.526 11.809 16.174 1.00 0.00 H new ATOM 0 HA PHE A 93 4.731 10.338 15.394 1.00 0.00 H new ATOM 0 HB2 PHE A 93 5.970 12.368 15.809 1.00 0.00 H new ATOM 0 HB3 PHE A 93 4.437 12.725 15.037 1.00 0.00 H new ATOM 0 HD1 PHE A 93 6.394 13.031 18.176 1.00 0.00 H new ATOM 0 HD2 PHE A 93 2.741 14.089 16.144 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.890 14.696 19.945 1.00 0.00 H new ATOM 0 HE2 PHE A 93 2.251 15.766 17.908 1.00 0.00 H new ATOM 0 HZ PHE A 93 3.816 16.064 19.822 1.00 0.00 H new ATOM 1373 N SER A 94 6.027 9.405 17.272 1.00 0.00 N ATOM 1374 CA SER A 94 6.719 8.640 18.322 1.00 0.00 C ATOM 1375 C SER A 94 8.238 8.853 18.223 1.00 0.00 C ATOM 1376 O SER A 94 8.801 8.662 17.136 1.00 0.00 O ATOM 1377 CB SER A 94 6.376 7.146 18.224 1.00 0.00 C ATOM 1378 OG SER A 94 7.075 6.431 19.237 1.00 0.00 O ATOM 0 H SER A 94 6.351 9.171 16.333 1.00 0.00 H new ATOM 0 HA SER A 94 6.379 9.002 19.292 1.00 0.00 H new ATOM 0 HB2 SER A 94 5.302 7.000 18.337 1.00 0.00 H new ATOM 0 HB3 SER A 94 6.648 6.763 17.240 1.00 0.00 H new ATOM 0 HG SER A 94 6.855 5.478 19.176 1.00 0.00 H new ATOM 1383 N PRO A 95 8.931 9.222 19.323 1.00 0.00 N ATOM 1384 CA PRO A 95 10.375 9.459 19.309 1.00 0.00 C ATOM 1385 C PRO A 95 11.181 8.168 19.072 1.00 0.00 C ATOM 1386 O PRO A 95 12.327 8.240 18.621 1.00 0.00 O ATOM 1387 CB PRO A 95 10.695 10.113 20.659 1.00 0.00 C ATOM 1388 CG PRO A 95 9.600 9.603 21.596 1.00 0.00 C ATOM 1389 CD PRO A 95 8.398 9.388 20.670 1.00 0.00 C ATOM 0 HA PRO A 95 10.662 10.106 18.480 1.00 0.00 H new ATOM 0 HB2 PRO A 95 11.686 9.829 21.014 1.00 0.00 H new ATOM 0 HB3 PRO A 95 10.682 11.201 20.587 1.00 0.00 H new ATOM 0 HG2 PRO A 95 9.895 8.677 22.090 1.00 0.00 H new ATOM 0 HG3 PRO A 95 9.376 10.326 22.381 1.00 0.00 H new ATOM 0 HD2 PRO A 95 7.829 8.509 20.972 1.00 0.00 H new ATOM 0 HD3 PRO A 95 7.718 10.239 20.715 1.00 0.00 H new ATOM 1394 N ASN A 96 10.593 6.995 19.341 1.00 0.00 N ATOM 1395 CA ASN A 96 11.221 5.687 19.126 1.00 0.00 C ATOM 1396 C ASN A 96 10.871 5.107 17.735 1.00 0.00 C ATOM 1397 O ASN A 96 11.763 4.697 16.989 1.00 0.00 O ATOM 1398 CB ASN A 96 10.773 4.747 20.273 1.00 0.00 C ATOM 1399 CG ASN A 96 11.876 3.842 20.813 1.00 0.00 C ATOM 1400 OD1 ASN A 96 12.996 3.782 20.325 1.00 0.00 O ATOM 1401 ND2 ASN A 96 11.597 3.119 21.874 1.00 0.00 N ATOM 0 H ASN A 96 9.649 6.929 19.722 1.00 0.00 H new ATOM 0 HA ASN A 96 12.306 5.790 19.140 1.00 0.00 H new ATOM 0 HB2 ASN A 96 10.383 5.352 21.091 1.00 0.00 H new ATOM 0 HB3 ASN A 96 9.951 4.125 19.917 1.00 0.00 H new ATOM 0 HD21 ASN A 96 12.311 2.516 22.282 1.00 0.00 H new ATOM 0 HD22 ASN A 96 10.666 3.161 22.289 1.00 0.00 H new ATOM 1407 N LEU A 97 9.580 5.118 17.368 1.00 0.00 N ATOM 1408 CA LEU A 97 9.047 4.576 16.107 1.00 0.00 C ATOM 1409 C LEU A 97 8.748 5.698 15.100 1.00 0.00 C ATOM 1410 O LEU A 97 7.621 6.186 14.979 1.00 0.00 O ATOM 1411 CB LEU A 97 7.825 3.657 16.371 1.00 0.00 C ATOM 1412 CG LEU A 97 8.130 2.149 16.482 1.00 0.00 C ATOM 1413 CD1 LEU A 97 8.618 1.555 15.154 1.00 0.00 C ATOM 1414 CD2 LEU A 97 9.141 1.808 17.579 1.00 0.00 C ATOM 0 H LEU A 97 8.853 5.518 17.961 1.00 0.00 H new ATOM 0 HA LEU A 97 9.813 3.951 15.648 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.344 3.980 17.294 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.103 3.804 15.567 1.00 0.00 H new ATOM 0 HG LEU A 97 7.175 1.699 16.752 1.00 0.00 H new ATOM 0 HD11 LEU A 97 8.819 0.492 15.283 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.851 1.689 14.392 1.00 0.00 H new ATOM 0 HD13 LEU A 97 9.531 2.062 14.842 1.00 0.00 H new ATOM 0 HD21 LEU A 97 9.307 0.731 17.599 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.084 2.316 17.376 1.00 0.00 H new ATOM 0 HD23 LEU A 97 8.754 2.133 18.545 1.00 0.00 H new ATOM 1425 N TRP A 98 9.762 6.074 14.314 1.00 0.00 N ATOM 1426 CA TRP A 98 9.620 7.009 13.190 1.00 0.00 C ATOM 1427 C TRP A 98 8.747 6.489 12.019 1.00 0.00 C ATOM 1428 O TRP A 98 8.539 7.212 11.046 1.00 0.00 O ATOM 1429 CB TRP A 98 11.012 7.469 12.717 1.00 0.00 C ATOM 1430 CG TRP A 98 11.960 6.422 12.201 1.00 0.00 C ATOM 1431 CD1 TRP A 98 11.689 5.485 11.257 1.00 0.00 C ATOM 1432 CD2 TRP A 98 13.369 6.228 12.540 1.00 0.00 C ATOM 1433 NE1 TRP A 98 12.809 4.718 11.022 1.00 0.00 N ATOM 1434 CE2 TRP A 98 13.885 5.143 11.774 1.00 0.00 C ATOM 1435 CE3 TRP A 98 14.278 6.882 13.407 1.00 0.00 C ATOM 1436 CZ2 TRP A 98 15.219 4.722 11.857 1.00 0.00 C ATOM 1437 CZ3 TRP A 98 15.619 6.474 13.499 1.00 0.00 C ATOM 1438 CH2 TRP A 98 16.093 5.392 12.724 1.00 0.00 C ATOM 0 H TRP A 98 10.716 5.735 14.441 1.00 0.00 H new ATOM 0 HA TRP A 98 9.063 7.866 13.568 1.00 0.00 H new ATOM 0 HB2 TRP A 98 10.870 8.209 11.930 1.00 0.00 H new ATOM 0 HB3 TRP A 98 11.497 7.978 13.550 1.00 0.00 H new ATOM 0 HD1 TRP A 98 10.737 5.359 10.763 1.00 0.00 H new ATOM 0 HE1 TRP A 98 12.839 3.933 10.372 1.00 0.00 H new ATOM 0 HE3 TRP A 98 13.934 7.710 14.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 15.569 3.892 11.261 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 16.292 6.991 14.167 1.00 0.00 H new ATOM 0 HH2 TRP A 98 17.125 5.082 12.799 1.00 0.00 H new ATOM 1448 N GLY A 99 8.234 5.254 12.084 1.00 0.00 N ATOM 1449 CA GLY A 99 7.381 4.657 11.041 1.00 0.00 C ATOM 1450 C GLY A 99 5.994 5.312 10.932 1.00 0.00 C ATOM 1451 O GLY A 99 5.513 5.563 9.826 1.00 0.00 O ATOM 0 H GLY A 99 8.401 4.630 12.873 1.00 0.00 H new ATOM 0 HA2 GLY A 99 7.888 4.736 10.079 1.00 0.00 H new ATOM 0 HA3 GLY A 99 7.257 3.594 11.249 1.00 0.00 H new ATOM 1454 N LEU A 100 5.369 5.634 12.077 1.00 0.00 N ATOM 1455 CA LEU A 100 4.116 6.407 12.164 1.00 0.00 C ATOM 1456 C LEU A 100 4.356 7.931 12.184 1.00 0.00 C ATOM 1457 O LEU A 100 3.424 8.694 11.920 1.00 0.00 O ATOM 1458 CB LEU A 100 3.311 5.980 13.410 1.00 0.00 C ATOM 1459 CG LEU A 100 2.729 4.555 13.307 1.00 0.00 C ATOM 1460 CD1 LEU A 100 2.283 4.088 14.690 1.00 0.00 C ATOM 1461 CD2 LEU A 100 1.513 4.482 12.376 1.00 0.00 C ATOM 0 H LEU A 100 5.729 5.358 12.991 1.00 0.00 H new ATOM 0 HA LEU A 100 3.544 6.186 11.263 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.956 6.038 14.287 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.496 6.687 13.566 1.00 0.00 H new ATOM 0 HG LEU A 100 3.517 3.921 12.900 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.871 3.081 14.619 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.138 4.084 15.366 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.520 4.765 15.074 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.143 3.457 12.340 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.728 5.138 12.751 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.802 4.799 11.374 1.00 0.00 H new ATOM 1472 N GLU A 101 5.585 8.394 12.453 1.00 0.00 N ATOM 1473 CA GLU A 101 5.946 9.806 12.246 1.00 0.00 C ATOM 1474 C GLU A 101 5.803 10.201 10.770 1.00 0.00 C ATOM 1475 O GLU A 101 6.240 9.485 9.864 1.00 0.00 O ATOM 1476 CB GLU A 101 7.383 10.147 12.688 1.00 0.00 C ATOM 1477 CG GLU A 101 7.562 10.171 14.207 1.00 0.00 C ATOM 1478 CD GLU A 101 8.798 10.979 14.659 1.00 0.00 C ATOM 1479 OE1 GLU A 101 9.884 10.868 14.026 1.00 0.00 O ATOM 1480 OE2 GLU A 101 8.689 11.750 15.637 1.00 0.00 O ATOM 0 H GLU A 101 6.344 7.815 12.813 1.00 0.00 H new ATOM 0 HA GLU A 101 5.252 10.368 12.871 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.070 9.417 12.260 1.00 0.00 H new ATOM 0 HB3 GLU A 101 7.659 11.120 12.282 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.669 10.597 14.665 1.00 0.00 H new ATOM 0 HG3 GLU A 101 7.651 9.148 14.573 1.00 0.00 H new ATOM 1485 N PHE A 102 5.251 11.391 10.536 1.00 0.00 N ATOM 1486 CA PHE A 102 5.278 12.070 9.242 1.00 0.00 C ATOM 1487 C PHE A 102 6.622 12.822 9.061 1.00 0.00 C ATOM 1488 O PHE A 102 7.369 13.032 10.023 1.00 0.00 O ATOM 1489 CB PHE A 102 4.037 12.984 9.136 1.00 0.00 C ATOM 1490 CG PHE A 102 4.159 14.358 9.779 1.00 0.00 C ATOM 1491 CD1 PHE A 102 4.202 14.511 11.182 1.00 0.00 C ATOM 1492 CD2 PHE A 102 4.239 15.505 8.961 1.00 0.00 C ATOM 1493 CE1 PHE A 102 4.359 15.787 11.749 1.00 0.00 C ATOM 1494 CE2 PHE A 102 4.399 16.778 9.527 1.00 0.00 C ATOM 1495 CZ PHE A 102 4.458 16.925 10.926 1.00 0.00 C ATOM 0 H PHE A 102 4.762 11.921 11.257 1.00 0.00 H new ATOM 0 HA PHE A 102 5.225 11.353 8.422 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.800 13.119 8.081 1.00 0.00 H new ATOM 0 HB3 PHE A 102 3.191 12.467 9.589 1.00 0.00 H new ATOM 0 HD1 PHE A 102 4.114 13.645 11.821 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.176 15.401 7.888 1.00 0.00 H new ATOM 0 HE1 PHE A 102 4.404 15.895 12.823 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.477 17.646 8.889 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.578 17.904 11.365 1.00 0.00 H new ATOM 1504 N GLN A 103 6.926 13.238 7.832 1.00 0.00 N ATOM 1505 CA GLN A 103 8.055 14.118 7.470 1.00 0.00 C ATOM 1506 C GLN A 103 7.516 15.401 6.805 1.00 0.00 C ATOM 1507 O GLN A 103 6.307 15.533 6.610 1.00 0.00 O ATOM 1508 CB GLN A 103 9.052 13.361 6.565 1.00 0.00 C ATOM 1509 CG GLN A 103 9.744 12.162 7.238 1.00 0.00 C ATOM 1510 CD GLN A 103 9.081 10.827 6.885 1.00 0.00 C ATOM 1511 OE1 GLN A 103 9.176 10.335 5.770 1.00 0.00 O ATOM 1512 NE2 GLN A 103 8.392 10.181 7.800 1.00 0.00 N ATOM 0 H GLN A 103 6.373 12.963 7.020 1.00 0.00 H new ATOM 0 HA GLN A 103 8.600 14.413 8.367 1.00 0.00 H new ATOM 0 HB2 GLN A 103 8.523 13.009 5.679 1.00 0.00 H new ATOM 0 HB3 GLN A 103 9.816 14.060 6.223 1.00 0.00 H new ATOM 0 HG2 GLN A 103 10.791 12.135 6.936 1.00 0.00 H new ATOM 0 HG3 GLN A 103 9.727 12.297 8.319 1.00 0.00 H new ATOM 0 HE21 GLN A 103 8.298 10.571 8.738 1.00 0.00 H new ATOM 0 HE22 GLN A 103 7.951 9.290 7.572 1.00 0.00 H new ATOM 1519 N LYS A 104 8.381 16.360 6.450 1.00 0.00 N ATOM 1520 CA LYS A 104 7.975 17.677 5.917 1.00 0.00 C ATOM 1521 C LYS A 104 8.599 17.932 4.545 1.00 0.00 C ATOM 1522 O LYS A 104 9.777 17.637 4.336 1.00 0.00 O ATOM 1523 CB LYS A 104 8.299 18.761 6.965 1.00 0.00 C ATOM 1524 CG LYS A 104 7.221 19.858 6.999 1.00 0.00 C ATOM 1525 CD LYS A 104 7.221 20.656 8.317 1.00 0.00 C ATOM 1526 CE LYS A 104 7.353 22.167 8.088 1.00 0.00 C ATOM 1527 NZ LYS A 104 6.860 22.942 9.259 1.00 0.00 N ATOM 0 H LYS A 104 9.392 16.247 6.523 1.00 0.00 H new ATOM 0 HA LYS A 104 6.899 17.703 5.745 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.382 18.302 7.950 1.00 0.00 H new ATOM 0 HB3 LYS A 104 9.267 19.208 6.739 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.379 20.542 6.166 1.00 0.00 H new ATOM 0 HG3 LYS A 104 6.241 19.402 6.856 1.00 0.00 H new ATOM 0 HD2 LYS A 104 6.298 20.453 8.861 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.043 20.314 8.945 1.00 0.00 H new ATOM 0 HE2 LYS A 104 8.397 22.417 7.898 1.00 0.00 H new ATOM 0 HE3 LYS A 104 6.790 22.452 7.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 6.964 23.959 9.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 5.857 22.721 9.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.414 22.688 10.102 1.00 0.00 H new ATOM 1537 N ASN A 105 7.798 18.441 3.603 1.00 0.00 N ATOM 1538 CA ASN A 105 8.099 18.470 2.164 1.00 0.00 C ATOM 1539 C ASN A 105 8.593 17.109 1.611 1.00 0.00 C ATOM 1540 O ASN A 105 9.512 17.056 0.786 1.00 0.00 O ATOM 1541 CB ASN A 105 9.035 19.657 1.846 1.00 0.00 C ATOM 1542 CG ASN A 105 8.312 20.994 1.895 1.00 0.00 C ATOM 1543 OD1 ASN A 105 7.485 21.300 1.051 1.00 0.00 O ATOM 1544 ND2 ASN A 105 8.611 21.836 2.859 1.00 0.00 N ATOM 0 H ASN A 105 6.894 18.858 3.826 1.00 0.00 H new ATOM 0 HA ASN A 105 7.166 18.638 1.625 1.00 0.00 H new ATOM 0 HB2 ASN A 105 9.860 19.667 2.558 1.00 0.00 H new ATOM 0 HB3 ASN A 105 9.470 19.518 0.856 1.00 0.00 H new ATOM 0 HD21 ASN A 105 8.152 22.746 2.902 1.00 0.00 H new ATOM 0 HD22 ASN A 105 9.302 21.580 3.564 1.00 0.00 H new ATOM 1550 N LYS A 106 8.000 16.002 2.081 1.00 0.00 N ATOM 1551 CA LYS A 106 8.390 14.629 1.720 1.00 0.00 C ATOM 1552 C LYS A 106 7.288 13.945 0.912 1.00 0.00 C ATOM 1553 O LYS A 106 6.093 14.115 1.165 1.00 0.00 O ATOM 1554 CB LYS A 106 8.788 13.834 2.985 1.00 0.00 C ATOM 1555 CG LYS A 106 10.287 13.477 3.018 1.00 0.00 C ATOM 1556 CD LYS A 106 11.183 14.718 3.182 1.00 0.00 C ATOM 1557 CE LYS A 106 12.604 14.446 2.674 1.00 0.00 C ATOM 1558 NZ LYS A 106 13.245 15.696 2.178 1.00 0.00 N ATOM 0 H LYS A 106 7.219 16.036 2.737 1.00 0.00 H new ATOM 0 HA LYS A 106 9.268 14.664 1.076 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.539 14.419 3.870 1.00 0.00 H new ATOM 0 HB3 LYS A 106 8.200 12.918 3.033 1.00 0.00 H new ATOM 0 HG2 LYS A 106 10.475 12.786 3.839 1.00 0.00 H new ATOM 0 HG3 LYS A 106 10.554 12.958 2.097 1.00 0.00 H new ATOM 0 HD2 LYS A 106 10.752 15.556 2.634 1.00 0.00 H new ATOM 0 HD3 LYS A 106 11.219 15.008 4.232 1.00 0.00 H new ATOM 0 HE2 LYS A 106 13.205 14.019 3.477 1.00 0.00 H new ATOM 0 HE3 LYS A 106 12.572 13.708 1.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 14.205 15.483 1.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 12.682 16.088 1.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 13.296 16.390 2.951 1.00 0.00 H new ATOM 1568 N ASP A 107 7.732 13.141 -0.050 1.00 0.00 N ATOM 1569 CA ASP A 107 6.929 12.402 -1.023 1.00 0.00 C ATOM 1570 C ASP A 107 7.370 10.936 -1.009 1.00 0.00 C ATOM 1571 O ASP A 107 8.413 10.576 -1.569 1.00 0.00 O ATOM 1572 CB ASP A 107 7.086 13.001 -2.434 1.00 0.00 C ATOM 1573 CG ASP A 107 6.134 14.180 -2.677 1.00 0.00 C ATOM 1574 OD1 ASP A 107 6.445 15.315 -2.244 1.00 0.00 O ATOM 1575 OD2 ASP A 107 5.083 13.970 -3.325 1.00 0.00 O ATOM 0 H ASP A 107 8.730 12.977 -0.180 1.00 0.00 H new ATOM 0 HA ASP A 107 5.875 12.473 -0.753 1.00 0.00 H new ATOM 0 HB2 ASP A 107 8.115 13.333 -2.572 1.00 0.00 H new ATOM 0 HB3 ASP A 107 6.898 12.227 -3.178 1.00 0.00 H new ATOM 1579 N TYR A 108 6.585 10.089 -0.345 1.00 0.00 N ATOM 1580 CA TYR A 108 6.718 8.637 -0.458 1.00 0.00 C ATOM 1581 C TYR A 108 6.201 8.157 -1.814 1.00 0.00 C ATOM 1582 O TYR A 108 5.161 8.616 -2.296 1.00 0.00 O ATOM 1583 CB TYR A 108 5.949 7.940 0.676 1.00 0.00 C ATOM 1584 CG TYR A 108 6.833 7.403 1.774 1.00 0.00 C ATOM 1585 CD1 TYR A 108 7.644 6.277 1.530 1.00 0.00 C ATOM 1586 CD2 TYR A 108 6.823 8.013 3.043 1.00 0.00 C ATOM 1587 CE1 TYR A 108 8.455 5.763 2.555 1.00 0.00 C ATOM 1588 CE2 TYR A 108 7.629 7.498 4.073 1.00 0.00 C ATOM 1589 CZ TYR A 108 8.450 6.371 3.831 1.00 0.00 C ATOM 1590 OH TYR A 108 9.231 5.857 4.821 1.00 0.00 O ATOM 0 H TYR A 108 5.841 10.389 0.285 1.00 0.00 H new ATOM 0 HA TYR A 108 7.774 8.381 -0.376 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.239 8.645 1.107 1.00 0.00 H new ATOM 0 HB3 TYR A 108 5.368 7.119 0.256 1.00 0.00 H new ATOM 0 HD1 TYR A 108 7.642 5.810 0.556 1.00 0.00 H new ATOM 0 HD2 TYR A 108 6.198 8.875 3.225 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.082 4.904 2.368 1.00 0.00 H new ATOM 0 HE2 TYR A 108 7.622 7.962 5.048 1.00 0.00 H new ATOM 0 HH TYR A 108 9.116 6.388 5.637 1.00 0.00 H new ATOM 1599 N TYR A 109 6.895 7.167 -2.368 1.00 0.00 N ATOM 1600 CA TYR A 109 6.496 6.395 -3.537 1.00 0.00 C ATOM 1601 C TYR A 109 6.353 4.930 -3.103 1.00 0.00 C ATOM 1602 O TYR A 109 7.062 4.442 -2.217 1.00 0.00 O ATOM 1603 CB TYR A 109 7.539 6.573 -4.657 1.00 0.00 C ATOM 1604 CG TYR A 109 7.431 7.826 -5.501 1.00 0.00 C ATOM 1605 CD1 TYR A 109 7.840 9.067 -4.975 1.00 0.00 C ATOM 1606 CD2 TYR A 109 7.021 7.728 -6.846 1.00 0.00 C ATOM 1607 CE1 TYR A 109 7.823 10.216 -5.784 1.00 0.00 C ATOM 1608 CE2 TYR A 109 7.003 8.876 -7.659 1.00 0.00 C ATOM 1609 CZ TYR A 109 7.397 10.124 -7.130 1.00 0.00 C ATOM 1610 OH TYR A 109 7.398 11.223 -7.934 1.00 0.00 O ATOM 0 H TYR A 109 7.796 6.868 -1.994 1.00 0.00 H new ATOM 0 HA TYR A 109 5.542 6.739 -3.936 1.00 0.00 H new ATOM 0 HB2 TYR A 109 8.530 6.554 -4.204 1.00 0.00 H new ATOM 0 HB3 TYR A 109 7.475 5.711 -5.320 1.00 0.00 H new ATOM 0 HD1 TYR A 109 8.167 9.136 -3.948 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.721 6.773 -7.252 1.00 0.00 H new ATOM 0 HE1 TYR A 109 8.135 11.167 -5.379 1.00 0.00 H new ATOM 0 HE2 TYR A 109 6.687 8.802 -8.689 1.00 0.00 H new ATOM 0 HH TYR A 109 7.076 10.976 -8.826 1.00 0.00 H new ATOM 1619 N ILE A 110 5.407 4.232 -3.718 1.00 0.00 N ATOM 1620 CA ILE A 110 5.026 2.841 -3.435 1.00 0.00 C ATOM 1621 C ILE A 110 4.600 2.195 -4.764 1.00 0.00 C ATOM 1622 O ILE A 110 4.053 2.891 -5.614 1.00 0.00 O ATOM 1623 CB ILE A 110 3.842 2.825 -2.425 1.00 0.00 C ATOM 1624 CG1 ILE A 110 4.082 3.681 -1.155 1.00 0.00 C ATOM 1625 CG2 ILE A 110 3.476 1.389 -2.036 1.00 0.00 C ATOM 1626 CD1 ILE A 110 3.235 3.365 0.086 1.00 0.00 C ATOM 0 H ILE A 110 4.850 4.637 -4.470 1.00 0.00 H new ATOM 0 HA ILE A 110 5.859 2.289 -2.999 1.00 0.00 H new ATOM 0 HB ILE A 110 3.006 3.288 -2.949 1.00 0.00 H new ATOM 0 HG12 ILE A 110 5.132 3.585 -0.878 1.00 0.00 H new ATOM 0 HG13 ILE A 110 3.916 4.726 -1.418 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.646 1.404 -1.329 1.00 0.00 H new ATOM 0 HG22 ILE A 110 3.184 0.834 -2.927 1.00 0.00 H new ATOM 0 HG23 ILE A 110 4.337 0.906 -1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 110 3.510 4.041 0.896 1.00 0.00 H new ATOM 0 HD12 ILE A 110 2.179 3.494 -0.152 1.00 0.00 H new ATOM 0 HD13 ILE A 110 3.414 2.335 0.396 1.00 0.00 H new ATOM 1637 N ILE A 111 4.777 0.885 -4.941 1.00 0.00 N ATOM 1638 CA ILE A 111 4.346 0.128 -6.124 1.00 0.00 C ATOM 1639 C ILE A 111 3.745 -1.220 -5.688 1.00 0.00 C ATOM 1640 O ILE A 111 3.934 -1.674 -4.552 1.00 0.00 O ATOM 1641 CB ILE A 111 5.540 -0.001 -7.095 1.00 0.00 C ATOM 1642 CG1 ILE A 111 5.095 0.046 -8.566 1.00 0.00 C ATOM 1643 CG2 ILE A 111 6.426 -1.213 -6.759 1.00 0.00 C ATOM 1644 CD1 ILE A 111 6.267 -0.185 -9.515 1.00 0.00 C ATOM 0 H ILE A 111 5.239 0.300 -4.244 1.00 0.00 H new ATOM 0 HA ILE A 111 3.554 0.648 -6.663 1.00 0.00 H new ATOM 0 HB ILE A 111 6.173 0.875 -6.953 1.00 0.00 H new ATOM 0 HG12 ILE A 111 4.331 -0.711 -8.740 1.00 0.00 H new ATOM 0 HG13 ILE A 111 4.639 1.013 -8.778 1.00 0.00 H new ATOM 0 HG21 ILE A 111 7.254 -1.266 -7.466 1.00 0.00 H new ATOM 0 HG22 ILE A 111 6.819 -1.107 -5.748 1.00 0.00 H new ATOM 0 HG23 ILE A 111 5.834 -2.126 -6.824 1.00 0.00 H new ATOM 0 HD11 ILE A 111 5.914 -0.145 -10.546 1.00 0.00 H new ATOM 0 HD12 ILE A 111 7.020 0.588 -9.359 1.00 0.00 H new ATOM 0 HD13 ILE A 111 6.706 -1.163 -9.320 1.00 0.00 H new ATOM 1655 N SER A 112 3.039 -1.880 -6.600 1.00 0.00 N ATOM 1656 CA SER A 112 2.571 -3.257 -6.433 1.00 0.00 C ATOM 1657 C SER A 112 2.569 -4.007 -7.761 1.00 0.00 C ATOM 1658 O SER A 112 2.737 -3.424 -8.837 1.00 0.00 O ATOM 1659 CB SER A 112 1.168 -3.259 -5.829 1.00 0.00 C ATOM 1660 OG SER A 112 0.980 -4.447 -5.080 1.00 0.00 O ATOM 0 H SER A 112 2.770 -1.468 -7.493 1.00 0.00 H new ATOM 0 HA SER A 112 3.258 -3.769 -5.759 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.035 -2.387 -5.188 1.00 0.00 H new ATOM 0 HB3 SER A 112 0.420 -3.192 -6.619 1.00 0.00 H new ATOM 0 HG SER A 112 0.081 -4.449 -4.690 1.00 0.00 H new ATOM 1665 N THR A 113 2.373 -5.317 -7.670 1.00 0.00 N ATOM 1666 CA THR A 113 2.597 -6.285 -8.748 1.00 0.00 C ATOM 1667 C THR A 113 1.398 -7.229 -8.918 1.00 0.00 C ATOM 1668 O THR A 113 1.553 -8.444 -8.995 1.00 0.00 O ATOM 1669 CB THR A 113 3.939 -7.034 -8.578 1.00 0.00 C ATOM 1670 OG1 THR A 113 3.988 -7.866 -7.441 1.00 0.00 O ATOM 1671 CG2 THR A 113 5.105 -6.064 -8.418 1.00 0.00 C ATOM 0 H THR A 113 2.041 -5.756 -6.811 1.00 0.00 H new ATOM 0 HA THR A 113 2.681 -5.728 -9.681 1.00 0.00 H new ATOM 0 HB THR A 113 4.017 -7.634 -9.485 1.00 0.00 H new ATOM 0 HG1 THR A 113 3.261 -8.521 -7.484 1.00 0.00 H new ATOM 0 HG21 THR A 113 6.032 -6.625 -8.301 1.00 0.00 H new ATOM 0 HG22 THR A 113 5.174 -5.429 -9.302 1.00 0.00 H new ATOM 0 HG23 THR A 113 4.943 -5.443 -7.537 1.00 0.00 H new ATOM 1679 N SER A 114 0.177 -6.676 -8.989 1.00 0.00 N ATOM 1680 CA SER A 114 -1.099 -7.426 -9.116 1.00 0.00 C ATOM 1681 C SER A 114 -1.175 -8.401 -10.317 1.00 0.00 C ATOM 1682 O SER A 114 -1.986 -9.332 -10.312 1.00 0.00 O ATOM 1683 CB SER A 114 -2.259 -6.423 -9.138 1.00 0.00 C ATOM 1684 OG SER A 114 -3.508 -7.067 -8.932 1.00 0.00 O ATOM 0 H SER A 114 0.038 -5.666 -8.959 1.00 0.00 H new ATOM 0 HA SER A 114 -1.165 -8.080 -8.246 1.00 0.00 H new ATOM 0 HB2 SER A 114 -2.105 -5.670 -8.365 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.271 -5.900 -10.094 1.00 0.00 H new ATOM 0 HG SER A 114 -3.468 -7.980 -9.286 1.00 0.00 H new ATOM 1689 N ASN A 115 -0.288 -8.268 -11.318 1.00 0.00 N ATOM 1690 CA ASN A 115 -0.091 -9.275 -12.381 1.00 0.00 C ATOM 1691 C ASN A 115 0.351 -10.640 -11.823 1.00 0.00 C ATOM 1692 O ASN A 115 0.007 -11.672 -12.398 1.00 0.00 O ATOM 1693 CB ASN A 115 0.940 -8.766 -13.432 1.00 0.00 C ATOM 1694 CG ASN A 115 0.336 -8.360 -14.777 1.00 0.00 C ATOM 1695 OD1 ASN A 115 -0.854 -8.146 -14.933 1.00 0.00 O ATOM 1696 ND2 ASN A 115 1.149 -8.238 -15.801 1.00 0.00 N ATOM 0 H ASN A 115 0.318 -7.453 -11.415 1.00 0.00 H new ATOM 0 HA ASN A 115 -1.058 -9.419 -12.864 1.00 0.00 H new ATOM 0 HB2 ASN A 115 1.471 -7.910 -13.015 1.00 0.00 H new ATOM 0 HB3 ASN A 115 1.680 -9.548 -13.603 1.00 0.00 H new ATOM 0 HD21 ASN A 115 0.783 -7.967 -16.714 1.00 0.00 H new ATOM 0 HD22 ASN A 115 2.147 -8.414 -15.684 1.00 0.00 H new ATOM 1702 N GLY A 116 1.117 -10.633 -10.723 1.00 0.00 N ATOM 1703 CA GLY A 116 1.709 -11.796 -10.052 1.00 0.00 C ATOM 1704 C GLY A 116 2.278 -12.840 -11.016 1.00 0.00 C ATOM 1705 O GLY A 116 1.999 -14.033 -10.860 1.00 0.00 O ATOM 0 H GLY A 116 1.354 -9.761 -10.250 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.504 -11.456 -9.389 1.00 0.00 H new ATOM 0 HA3 GLY A 116 0.952 -12.267 -9.426 1.00 0.00 H new ATOM 1708 N SER A 117 3.004 -12.377 -12.046 1.00 0.00 N ATOM 1709 CA SER A 117 3.572 -13.207 -13.122 1.00 0.00 C ATOM 1710 C SER A 117 4.413 -14.357 -12.546 1.00 0.00 C ATOM 1711 O SER A 117 4.932 -14.234 -11.441 1.00 0.00 O ATOM 1712 CB SER A 117 4.430 -12.325 -14.040 1.00 0.00 C ATOM 1713 OG SER A 117 4.963 -13.099 -15.103 1.00 0.00 O ATOM 0 H SER A 117 3.219 -11.386 -12.157 1.00 0.00 H new ATOM 0 HA SER A 117 2.757 -13.648 -13.696 1.00 0.00 H new ATOM 0 HB2 SER A 117 3.828 -11.510 -14.440 1.00 0.00 H new ATOM 0 HB3 SER A 117 5.240 -11.872 -13.468 1.00 0.00 H new ATOM 0 HG SER A 117 5.507 -12.527 -15.683 1.00 0.00 H new ATOM 1718 N LEU A 118 4.615 -15.460 -13.277 1.00 0.00 N ATOM 1719 CA LEU A 118 5.443 -16.581 -12.800 1.00 0.00 C ATOM 1720 C LEU A 118 6.888 -16.144 -12.483 1.00 0.00 C ATOM 1721 O LEU A 118 7.470 -16.566 -11.482 1.00 0.00 O ATOM 1722 CB LEU A 118 5.388 -17.700 -13.853 1.00 0.00 C ATOM 1723 CG LEU A 118 5.716 -19.132 -13.382 1.00 0.00 C ATOM 1724 CD1 LEU A 118 7.133 -19.331 -12.852 1.00 0.00 C ATOM 1725 CD2 LEU A 118 4.729 -19.638 -12.328 1.00 0.00 C ATOM 0 H LEU A 118 4.216 -15.603 -14.205 1.00 0.00 H new ATOM 0 HA LEU A 118 5.045 -16.953 -11.856 1.00 0.00 H new ATOM 0 HB2 LEU A 118 4.387 -17.708 -14.285 1.00 0.00 H new ATOM 0 HB3 LEU A 118 6.079 -17.442 -14.655 1.00 0.00 H new ATOM 0 HG LEU A 118 5.627 -19.717 -14.297 1.00 0.00 H new ATOM 0 HD11 LEU A 118 7.265 -20.369 -12.546 1.00 0.00 H new ATOM 0 HD12 LEU A 118 7.852 -19.089 -13.635 1.00 0.00 H new ATOM 0 HD13 LEU A 118 7.296 -18.677 -11.995 1.00 0.00 H new ATOM 0 HD21 LEU A 118 5.003 -20.650 -12.029 1.00 0.00 H new ATOM 0 HD22 LEU A 118 4.758 -18.982 -11.458 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.722 -19.643 -12.745 1.00 0.00 H new ATOM 1736 N GLU A 119 7.458 -15.230 -13.272 1.00 0.00 N ATOM 1737 CA GLU A 119 8.780 -14.647 -12.968 1.00 0.00 C ATOM 1738 C GLU A 119 8.792 -13.766 -11.701 1.00 0.00 C ATOM 1739 O GLU A 119 9.821 -13.672 -11.036 1.00 0.00 O ATOM 1740 CB GLU A 119 9.315 -13.845 -14.166 1.00 0.00 C ATOM 1741 CG GLU A 119 9.515 -14.707 -15.426 1.00 0.00 C ATOM 1742 CD GLU A 119 10.863 -14.410 -16.117 1.00 0.00 C ATOM 1743 OE1 GLU A 119 10.955 -13.448 -16.917 1.00 0.00 O ATOM 1744 OE2 GLU A 119 11.844 -15.160 -15.874 1.00 0.00 O ATOM 0 H GLU A 119 7.030 -14.874 -14.127 1.00 0.00 H new ATOM 0 HA GLU A 119 9.436 -15.495 -12.769 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.622 -13.035 -14.393 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.265 -13.385 -13.893 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.470 -15.762 -15.155 1.00 0.00 H new ATOM 0 HG3 GLU A 119 8.700 -14.522 -16.126 1.00 0.00 H new ATOM 1749 N GLY A 120 7.647 -13.180 -11.328 1.00 0.00 N ATOM 1750 CA GLY A 120 7.437 -12.315 -10.157 1.00 0.00 C ATOM 1751 C GLY A 120 6.499 -12.922 -9.099 1.00 0.00 C ATOM 1752 O GLY A 120 5.838 -12.173 -8.375 1.00 0.00 O ATOM 0 H GLY A 120 6.790 -13.304 -11.867 1.00 0.00 H new ATOM 0 HA2 GLY A 120 8.401 -12.103 -9.696 1.00 0.00 H new ATOM 0 HA3 GLY A 120 7.026 -11.362 -10.490 1.00 0.00 H new ATOM 1755 N LEU A 121 6.390 -14.258 -9.032 1.00 0.00 N ATOM 1756 CA LEU A 121 5.451 -14.961 -8.136 1.00 0.00 C ATOM 1757 C LEU A 121 5.789 -14.713 -6.646 1.00 0.00 C ATOM 1758 O LEU A 121 4.908 -14.638 -5.789 1.00 0.00 O ATOM 1759 CB LEU A 121 5.366 -16.460 -8.539 1.00 0.00 C ATOM 1760 CG LEU A 121 6.019 -17.506 -7.602 1.00 0.00 C ATOM 1761 CD1 LEU A 121 5.028 -18.002 -6.546 1.00 0.00 C ATOM 1762 CD2 LEU A 121 6.505 -18.726 -8.389 1.00 0.00 C ATOM 0 H LEU A 121 6.955 -14.888 -9.602 1.00 0.00 H new ATOM 0 HA LEU A 121 4.449 -14.550 -8.257 1.00 0.00 H new ATOM 0 HB2 LEU A 121 4.312 -16.718 -8.643 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.819 -16.566 -9.525 1.00 0.00 H new ATOM 0 HG LEU A 121 6.861 -17.007 -7.121 1.00 0.00 H new ATOM 0 HD11 LEU A 121 5.517 -18.735 -5.904 1.00 0.00 H new ATOM 0 HD12 LEU A 121 4.688 -17.160 -5.942 1.00 0.00 H new ATOM 0 HD13 LEU A 121 4.173 -18.464 -7.039 1.00 0.00 H new ATOM 0 HD21 LEU A 121 6.959 -19.443 -7.705 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.660 -19.192 -8.896 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.243 -18.412 -9.128 1.00 0.00 H new ATOM 1773 N ASP A 122 7.088 -14.540 -6.377 1.00 0.00 N ATOM 1774 CA ASP A 122 7.721 -14.253 -5.082 1.00 0.00 C ATOM 1775 C ASP A 122 8.904 -13.263 -5.223 1.00 0.00 C ATOM 1776 O ASP A 122 9.122 -12.429 -4.341 1.00 0.00 O ATOM 1777 CB ASP A 122 8.184 -15.585 -4.468 1.00 0.00 C ATOM 1778 CG ASP A 122 8.732 -15.379 -3.047 1.00 0.00 C ATOM 1779 OD1 ASP A 122 7.976 -14.910 -2.162 1.00 0.00 O ATOM 1780 OD2 ASP A 122 9.922 -15.695 -2.804 1.00 0.00 O ATOM 0 H ASP A 122 7.783 -14.602 -7.121 1.00 0.00 H new ATOM 0 HA ASP A 122 6.996 -13.770 -4.427 1.00 0.00 H new ATOM 0 HB2 ASP A 122 7.350 -16.286 -4.441 1.00 0.00 H new ATOM 0 HB3 ASP A 122 8.955 -16.031 -5.097 1.00 0.00 H new ATOM 1784 N ASN A 123 9.617 -13.277 -6.361 1.00 0.00 N ATOM 1785 CA ASN A 123 10.538 -12.211 -6.755 1.00 0.00 C ATOM 1786 C ASN A 123 9.819 -10.860 -6.879 1.00 0.00 C ATOM 1787 O ASN A 123 8.627 -10.765 -7.188 1.00 0.00 O ATOM 1788 CB ASN A 123 11.198 -12.541 -8.105 1.00 0.00 C ATOM 1789 CG ASN A 123 12.364 -13.514 -8.047 1.00 0.00 C ATOM 1790 OD1 ASN A 123 12.541 -14.292 -7.119 1.00 0.00 O ATOM 1791 ND2 ASN A 123 13.212 -13.478 -9.048 1.00 0.00 N ATOM 0 H ASN A 123 9.566 -14.039 -7.037 1.00 0.00 H new ATOM 0 HA ASN A 123 11.296 -12.139 -5.975 1.00 0.00 H new ATOM 0 HB2 ASN A 123 10.438 -12.952 -8.769 1.00 0.00 H new ATOM 0 HB3 ASN A 123 11.546 -11.611 -8.555 1.00 0.00 H new ATOM 0 HD21 ASN A 123 14.021 -14.099 -9.054 1.00 0.00 H new ATOM 0 HD22 ASN A 123 13.062 -12.829 -9.820 1.00 0.00 H new ATOM 1797 N GLN A 124 10.617 -9.814 -6.709 1.00 0.00 N ATOM 1798 CA GLN A 124 10.233 -8.418 -6.831 1.00 0.00 C ATOM 1799 C GLN A 124 10.116 -7.953 -8.299 1.00 0.00 C ATOM 1800 O GLN A 124 10.866 -7.082 -8.743 1.00 0.00 O ATOM 1801 CB GLN A 124 11.245 -7.579 -6.043 1.00 0.00 C ATOM 1802 CG GLN A 124 11.204 -7.772 -4.515 1.00 0.00 C ATOM 1803 CD GLN A 124 12.098 -8.900 -3.990 1.00 0.00 C ATOM 1804 OE1 GLN A 124 13.011 -9.384 -4.644 1.00 0.00 O ATOM 1805 NE2 GLN A 124 11.870 -9.380 -2.786 1.00 0.00 N ATOM 0 H GLN A 124 11.602 -9.925 -6.469 1.00 0.00 H new ATOM 0 HA GLN A 124 9.234 -8.286 -6.416 1.00 0.00 H new ATOM 0 HB2 GLN A 124 12.247 -7.820 -6.397 1.00 0.00 H new ATOM 0 HB3 GLN A 124 11.072 -6.526 -6.266 1.00 0.00 H new ATOM 0 HG2 GLN A 124 11.500 -6.839 -4.036 1.00 0.00 H new ATOM 0 HG3 GLN A 124 10.175 -7.972 -4.215 1.00 0.00 H new ATOM 0 HE21 GLN A 124 11.115 -8.995 -2.218 1.00 0.00 H new ATOM 0 HE22 GLN A 124 12.448 -10.137 -2.421 1.00 0.00 H new ATOM 1812 N GLU A 125 9.185 -8.518 -9.075 1.00 0.00 N ATOM 1813 CA GLU A 125 8.982 -8.177 -10.494 1.00 0.00 C ATOM 1814 C GLU A 125 7.537 -7.754 -10.787 1.00 0.00 C ATOM 1815 O GLU A 125 6.588 -8.501 -10.534 1.00 0.00 O ATOM 1816 CB GLU A 125 9.418 -9.330 -11.417 1.00 0.00 C ATOM 1817 CG GLU A 125 10.914 -9.656 -11.300 1.00 0.00 C ATOM 1818 CD GLU A 125 11.373 -10.744 -12.292 1.00 0.00 C ATOM 1819 OE1 GLU A 125 10.958 -10.710 -13.480 1.00 0.00 O ATOM 1820 OE2 GLU A 125 12.197 -11.603 -11.901 1.00 0.00 O ATOM 0 H GLU A 125 8.542 -9.233 -8.735 1.00 0.00 H new ATOM 0 HA GLU A 125 9.618 -7.317 -10.705 1.00 0.00 H new ATOM 0 HB2 GLU A 125 8.837 -10.221 -11.177 1.00 0.00 H new ATOM 0 HB3 GLU A 125 9.188 -9.069 -12.450 1.00 0.00 H new ATOM 0 HG2 GLU A 125 11.493 -8.748 -11.472 1.00 0.00 H new ATOM 0 HG3 GLU A 125 11.130 -9.984 -10.283 1.00 0.00 H new ATOM 1825 N GLY A 126 7.374 -6.543 -11.330 1.00 0.00 N ATOM 1826 CA GLY A 126 6.071 -5.979 -11.680 1.00 0.00 C ATOM 1827 C GLY A 126 5.687 -6.180 -13.145 1.00 0.00 C ATOM 1828 O GLY A 126 6.445 -6.721 -13.953 1.00 0.00 O ATOM 0 H GLY A 126 8.155 -5.921 -11.540 1.00 0.00 H new ATOM 0 HA2 GLY A 126 5.307 -6.433 -11.048 1.00 0.00 H new ATOM 0 HA3 GLY A 126 6.076 -4.912 -11.458 1.00 0.00 H new ATOM 1831 N GLY A 127 4.481 -5.718 -13.467 1.00 0.00 N ATOM 1832 CA GLY A 127 3.876 -5.823 -14.799 1.00 0.00 C ATOM 1833 C GLY A 127 2.599 -4.986 -14.954 1.00 0.00 C ATOM 1834 O GLY A 127 2.369 -4.414 -16.017 1.00 0.00 O ATOM 0 H GLY A 127 3.878 -5.247 -12.792 1.00 0.00 H new ATOM 0 HA2 GLY A 127 4.603 -5.506 -15.547 1.00 0.00 H new ATOM 0 HA3 GLY A 127 3.644 -6.868 -15.004 1.00 0.00 H new ATOM 1837 N VAL A 128 1.804 -4.819 -13.885 1.00 0.00 N ATOM 1838 CA VAL A 128 0.673 -3.865 -13.865 1.00 0.00 C ATOM 1839 C VAL A 128 1.150 -2.413 -13.849 1.00 0.00 C ATOM 1840 O VAL A 128 0.587 -1.581 -14.557 1.00 0.00 O ATOM 1841 CB VAL A 128 -0.330 -4.159 -12.723 1.00 0.00 C ATOM 1842 CG1 VAL A 128 -0.989 -5.517 -12.966 1.00 0.00 C ATOM 1843 CG2 VAL A 128 0.281 -4.110 -11.318 1.00 0.00 C ATOM 0 H VAL A 128 1.922 -5.336 -13.013 1.00 0.00 H new ATOM 0 HA VAL A 128 0.129 -4.012 -14.798 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.069 -3.358 -12.747 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.696 -5.727 -12.163 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -1.517 -5.500 -13.919 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.224 -6.294 -12.989 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.490 -4.327 -10.578 1.00 0.00 H new ATOM 0 HG22 VAL A 128 1.077 -4.851 -11.241 1.00 0.00 H new ATOM 0 HG23 VAL A 128 0.691 -3.117 -11.134 1.00 0.00 H new ATOM 1853 N CYS A 129 2.239 -2.093 -13.140 1.00 0.00 N ATOM 1854 CA CYS A 129 2.777 -0.725 -13.095 1.00 0.00 C ATOM 1855 C CYS A 129 3.038 -0.116 -14.497 1.00 0.00 C ATOM 1856 O CYS A 129 2.938 1.097 -14.682 1.00 0.00 O ATOM 1857 CB CYS A 129 4.032 -0.676 -12.210 1.00 0.00 C ATOM 1858 SG CYS A 129 5.577 -0.581 -13.154 1.00 0.00 S ATOM 0 H CYS A 129 2.769 -2.766 -12.586 1.00 0.00 H new ATOM 0 HA CYS A 129 2.007 -0.096 -12.649 1.00 0.00 H new ATOM 0 HB2 CYS A 129 3.966 0.187 -11.547 1.00 0.00 H new ATOM 0 HB3 CYS A 129 4.056 -1.563 -11.577 1.00 0.00 H new ATOM 1862 N GLN A 130 3.312 -0.979 -15.483 1.00 0.00 N ATOM 1863 CA GLN A 130 3.583 -0.646 -16.880 1.00 0.00 C ATOM 1864 C GLN A 130 2.423 0.118 -17.559 1.00 0.00 C ATOM 1865 O GLN A 130 2.679 0.985 -18.399 1.00 0.00 O ATOM 1866 CB GLN A 130 3.879 -1.975 -17.597 1.00 0.00 C ATOM 1867 CG GLN A 130 4.517 -1.770 -18.978 1.00 0.00 C ATOM 1868 CD GLN A 130 4.785 -3.081 -19.727 1.00 0.00 C ATOM 1869 OE1 GLN A 130 4.725 -4.181 -19.193 1.00 0.00 O ATOM 1870 NE2 GLN A 130 5.092 -3.026 -21.006 1.00 0.00 N ATOM 0 H GLN A 130 3.352 -1.984 -15.314 1.00 0.00 H new ATOM 0 HA GLN A 130 4.431 0.036 -16.938 1.00 0.00 H new ATOM 0 HB2 GLN A 130 4.545 -2.577 -16.979 1.00 0.00 H new ATOM 0 HB3 GLN A 130 2.952 -2.538 -17.709 1.00 0.00 H new ATOM 0 HG2 GLN A 130 3.862 -1.142 -19.583 1.00 0.00 H new ATOM 0 HG3 GLN A 130 5.456 -1.230 -18.859 1.00 0.00 H new ATOM 0 HE21 GLN A 130 5.150 -2.124 -21.478 1.00 0.00 H new ATOM 0 HE22 GLN A 130 5.272 -3.886 -21.525 1.00 0.00 H new ATOM 1877 N THR A 131 1.165 -0.166 -17.173 1.00 0.00 N ATOM 1878 CA THR A 131 -0.056 0.411 -17.795 1.00 0.00 C ATOM 1879 C THR A 131 -1.179 0.708 -16.790 1.00 0.00 C ATOM 1880 O THR A 131 -1.681 1.833 -16.762 1.00 0.00 O ATOM 1881 CB THR A 131 -0.596 -0.523 -18.898 1.00 0.00 C ATOM 1882 OG1 THR A 131 0.349 -0.661 -19.946 1.00 0.00 O ATOM 1883 CG2 THR A 131 -1.912 -0.024 -19.507 1.00 0.00 C ATOM 0 H THR A 131 0.958 -0.811 -16.410 1.00 0.00 H new ATOM 0 HA THR A 131 0.254 1.365 -18.222 1.00 0.00 H new ATOM 0 HB THR A 131 -0.778 -1.482 -18.413 1.00 0.00 H new ATOM 0 HG1 THR A 131 -0.011 -1.258 -20.635 1.00 0.00 H new ATOM 0 HG21 THR A 131 -2.244 -0.721 -20.277 1.00 0.00 H new ATOM 0 HG22 THR A 131 -2.671 0.044 -18.728 1.00 0.00 H new ATOM 0 HG23 THR A 131 -1.758 0.960 -19.950 1.00 0.00 H new ATOM 1891 N ARG A 132 -1.561 -0.251 -15.927 1.00 0.00 N ATOM 1892 CA ARG A 132 -2.446 -0.012 -14.767 1.00 0.00 C ATOM 1893 C ARG A 132 -1.869 1.032 -13.809 1.00 0.00 C ATOM 1894 O ARG A 132 -2.632 1.670 -13.086 1.00 0.00 O ATOM 1895 CB ARG A 132 -2.624 -1.320 -13.983 1.00 0.00 C ATOM 1896 CG ARG A 132 -3.452 -2.460 -14.601 1.00 0.00 C ATOM 1897 CD ARG A 132 -4.964 -2.212 -14.485 1.00 0.00 C ATOM 1898 NE ARG A 132 -5.485 -1.397 -15.596 1.00 0.00 N ATOM 1899 CZ ARG A 132 -5.908 -1.852 -16.762 1.00 0.00 C ATOM 1900 NH1 ARG A 132 -5.888 -3.121 -17.061 1.00 0.00 N ATOM 1901 NH2 ARG A 132 -6.366 -1.031 -17.658 1.00 0.00 N ATOM 0 H ARG A 132 -1.263 -1.223 -16.014 1.00 0.00 H new ATOM 0 HA ARG A 132 -3.396 0.354 -15.156 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -1.630 -1.714 -13.772 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -3.077 -1.068 -13.024 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -3.184 -2.572 -15.652 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -3.201 -3.398 -14.106 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -5.486 -3.169 -14.464 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -5.176 -1.712 -13.540 1.00 0.00 H new ATOM 0 HE ARG A 132 -5.523 -0.388 -15.452 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -5.538 -3.799 -16.384 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -6.223 -3.436 -17.972 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -6.400 -0.030 -17.463 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -6.691 -1.387 -18.557 1.00 0.00 H new ATOM 1912 N ALA A 133 -0.543 1.197 -13.812 1.00 0.00 N ATOM 1913 CA ALA A 133 0.180 2.121 -12.942 1.00 0.00 C ATOM 1914 C ALA A 133 -0.192 1.924 -11.462 1.00 0.00 C ATOM 1915 O ALA A 133 -0.535 2.878 -10.772 1.00 0.00 O ATOM 1916 CB ALA A 133 0.035 3.547 -13.494 1.00 0.00 C ATOM 0 H ALA A 133 0.071 0.676 -14.438 1.00 0.00 H new ATOM 0 HA ALA A 133 1.248 1.905 -12.951 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.572 4.243 -12.850 1.00 0.00 H new ATOM 0 HB2 ALA A 133 0.449 3.591 -14.501 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -1.020 3.820 -13.523 1.00 0.00 H new ATOM 1922 N MET A 134 -0.166 0.677 -10.968 1.00 0.00 N ATOM 1923 CA MET A 134 -0.429 0.370 -9.560 1.00 0.00 C ATOM 1924 C MET A 134 0.688 0.879 -8.634 1.00 0.00 C ATOM 1925 O MET A 134 1.633 0.159 -8.293 1.00 0.00 O ATOM 1926 CB MET A 134 -0.673 -1.134 -9.383 1.00 0.00 C ATOM 1927 CG MET A 134 -1.288 -1.409 -8.008 1.00 0.00 C ATOM 1928 SD MET A 134 -1.951 -3.080 -7.846 1.00 0.00 S ATOM 1929 CE MET A 134 -2.769 -2.902 -6.240 1.00 0.00 C ATOM 0 H MET A 134 0.038 -0.145 -11.536 1.00 0.00 H new ATOM 0 HA MET A 134 -1.333 0.903 -9.265 1.00 0.00 H new ATOM 0 HB2 MET A 134 -1.338 -1.497 -10.167 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.266 -1.677 -9.485 1.00 0.00 H new ATOM 0 HG2 MET A 134 -0.531 -1.250 -7.240 1.00 0.00 H new ATOM 0 HG3 MET A 134 -2.086 -0.689 -7.823 1.00 0.00 H new ATOM 0 HE1 MET A 134 -3.243 -3.845 -5.967 1.00 0.00 H new ATOM 0 HE2 MET A 134 -2.031 -2.634 -5.484 1.00 0.00 H new ATOM 0 HE3 MET A 134 -3.526 -2.120 -6.302 1.00 0.00 H new ATOM 1937 N LYS A 135 0.559 2.138 -8.229 1.00 0.00 N ATOM 1938 CA LYS A 135 1.408 2.834 -7.259 1.00 0.00 C ATOM 1939 C LYS A 135 0.568 3.663 -6.294 1.00 0.00 C ATOM 1940 O LYS A 135 -0.631 3.854 -6.486 1.00 0.00 O ATOM 1941 CB LYS A 135 2.507 3.650 -7.983 1.00 0.00 C ATOM 1942 CG LYS A 135 2.132 4.455 -9.248 1.00 0.00 C ATOM 1943 CD LYS A 135 2.885 3.996 -10.522 1.00 0.00 C ATOM 1944 CE LYS A 135 3.784 5.095 -11.115 1.00 0.00 C ATOM 1945 NZ LYS A 135 3.008 6.093 -11.902 1.00 0.00 N ATOM 0 H LYS A 135 -0.183 2.738 -8.588 1.00 0.00 H new ATOM 0 HA LYS A 135 1.928 2.098 -6.645 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.927 4.350 -7.260 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.303 2.958 -8.257 1.00 0.00 H new ATOM 0 HG2 LYS A 135 1.059 4.368 -9.419 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.342 5.510 -9.072 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.495 3.124 -10.283 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.160 3.682 -11.273 1.00 0.00 H new ATOM 0 HE2 LYS A 135 4.314 5.603 -10.309 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.539 4.638 -11.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.654 6.814 -12.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 2.523 5.614 -12.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.304 6.549 -11.287 1.00 0.00 H new ATOM 1955 N ILE A 136 1.177 4.143 -5.220 1.00 0.00 N ATOM 1956 CA ILE A 136 0.538 5.107 -4.326 1.00 0.00 C ATOM 1957 C ILE A 136 1.561 6.121 -3.859 1.00 0.00 C ATOM 1958 O ILE A 136 2.690 5.768 -3.515 1.00 0.00 O ATOM 1959 CB ILE A 136 -0.311 4.437 -3.211 1.00 0.00 C ATOM 1960 CG1 ILE A 136 -0.667 5.354 -2.023 1.00 0.00 C ATOM 1961 CG2 ILE A 136 0.124 3.054 -2.698 1.00 0.00 C ATOM 1962 CD1 ILE A 136 0.380 5.469 -0.909 1.00 0.00 C ATOM 0 H ILE A 136 2.122 3.880 -4.942 1.00 0.00 H new ATOM 0 HA ILE A 136 -0.216 5.668 -4.878 1.00 0.00 H new ATOM 0 HB ILE A 136 -1.213 4.246 -3.793 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -0.864 6.354 -2.411 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -1.597 4.995 -1.582 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -0.566 2.720 -1.924 1.00 0.00 H new ATOM 0 HG22 ILE A 136 0.117 2.341 -3.523 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.130 3.120 -2.284 1.00 0.00 H new ATOM 0 HD11 ILE A 136 0.013 6.141 -0.133 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.564 4.484 -0.480 1.00 0.00 H new ATOM 0 HD13 ILE A 136 1.308 5.864 -1.322 1.00 0.00 H new ATOM 1973 N LEU A 137 1.152 7.389 -3.873 1.00 0.00 N ATOM 1974 CA LEU A 137 1.958 8.491 -3.366 1.00 0.00 C ATOM 1975 C LEU A 137 1.396 8.949 -2.016 1.00 0.00 C ATOM 1976 O LEU A 137 0.192 9.186 -1.877 1.00 0.00 O ATOM 1977 CB LEU A 137 2.035 9.658 -4.364 1.00 0.00 C ATOM 1978 CG LEU A 137 2.742 9.382 -5.712 1.00 0.00 C ATOM 1979 CD1 LEU A 137 3.417 10.663 -6.210 1.00 0.00 C ATOM 1980 CD2 LEU A 137 3.835 8.309 -5.700 1.00 0.00 C ATOM 0 H LEU A 137 0.245 7.679 -4.240 1.00 0.00 H new ATOM 0 HA LEU A 137 2.980 8.137 -3.229 1.00 0.00 H new ATOM 0 HB2 LEU A 137 1.019 9.990 -4.576 1.00 0.00 H new ATOM 0 HB3 LEU A 137 2.547 10.488 -3.876 1.00 0.00 H new ATOM 0 HG LEU A 137 1.937 9.019 -6.351 1.00 0.00 H new ATOM 0 HD11 LEU A 137 3.915 10.467 -7.160 1.00 0.00 H new ATOM 0 HD12 LEU A 137 2.665 11.440 -6.348 1.00 0.00 H new ATOM 0 HD13 LEU A 137 4.152 10.995 -5.477 1.00 0.00 H new ATOM 0 HD21 LEU A 137 4.255 8.206 -6.701 1.00 0.00 H new ATOM 0 HD22 LEU A 137 4.622 8.599 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 137 3.407 7.357 -5.387 1.00 0.00 H new ATOM 1991 N MET A 138 2.293 9.099 -1.043 1.00 0.00 N ATOM 1992 CA MET A 138 2.034 9.558 0.326 1.00 0.00 C ATOM 1993 C MET A 138 2.800 10.865 0.544 1.00 0.00 C ATOM 1994 O MET A 138 4.012 10.874 0.772 1.00 0.00 O ATOM 1995 CB MET A 138 2.450 8.487 1.355 1.00 0.00 C ATOM 1996 CG MET A 138 1.307 7.593 1.838 1.00 0.00 C ATOM 1997 SD MET A 138 1.040 7.627 3.634 1.00 0.00 S ATOM 1998 CE MET A 138 1.002 5.844 3.962 1.00 0.00 C ATOM 0 H MET A 138 3.280 8.892 -1.196 1.00 0.00 H new ATOM 0 HA MET A 138 0.967 9.731 0.465 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.224 7.859 0.914 1.00 0.00 H new ATOM 0 HB3 MET A 138 2.895 8.983 2.217 1.00 0.00 H new ATOM 0 HG2 MET A 138 0.387 7.898 1.340 1.00 0.00 H new ATOM 0 HG3 MET A 138 1.510 6.567 1.532 1.00 0.00 H new ATOM 0 HE1 MET A 138 0.845 5.673 5.027 1.00 0.00 H new ATOM 0 HE2 MET A 138 0.189 5.387 3.397 1.00 0.00 H new ATOM 0 HE3 MET A 138 1.949 5.398 3.659 1.00 0.00 H new ATOM 2006 N LYS A 139 2.087 11.983 0.422 1.00 0.00 N ATOM 2007 CA LYS A 139 2.602 13.330 0.697 1.00 0.00 C ATOM 2008 C LYS A 139 2.494 13.588 2.194 1.00 0.00 C ATOM 2009 O LYS A 139 1.493 13.222 2.814 1.00 0.00 O ATOM 2010 CB LYS A 139 1.777 14.349 -0.104 1.00 0.00 C ATOM 2011 CG LYS A 139 2.029 14.175 -1.611 1.00 0.00 C ATOM 2012 CD LYS A 139 0.829 14.595 -2.463 1.00 0.00 C ATOM 2013 CE LYS A 139 1.067 14.140 -3.909 1.00 0.00 C ATOM 2014 NZ LYS A 139 -0.031 14.576 -4.812 1.00 0.00 N ATOM 0 H LYS A 139 1.112 11.981 0.122 1.00 0.00 H new ATOM 0 HA LYS A 139 3.646 13.422 0.398 1.00 0.00 H new ATOM 0 HB2 LYS A 139 0.717 14.218 0.112 1.00 0.00 H new ATOM 0 HB3 LYS A 139 2.042 15.361 0.201 1.00 0.00 H new ATOM 0 HG2 LYS A 139 2.899 14.765 -1.900 1.00 0.00 H new ATOM 0 HG3 LYS A 139 2.268 13.132 -1.817 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -0.086 14.149 -2.073 1.00 0.00 H new ATOM 0 HD3 LYS A 139 0.698 15.676 -2.424 1.00 0.00 H new ATOM 0 HE2 LYS A 139 2.014 14.545 -4.266 1.00 0.00 H new ATOM 0 HE3 LYS A 139 1.153 13.054 -3.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 0.165 14.250 -5.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -0.931 14.170 -4.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -0.096 15.614 -4.803 1.00 0.00 H new ATOM 2024 N VAL A 140 3.499 14.250 2.754 1.00 0.00 N ATOM 2025 CA VAL A 140 3.568 14.634 4.171 1.00 0.00 C ATOM 2026 C VAL A 140 4.234 16.015 4.316 1.00 0.00 C ATOM 2027 O VAL A 140 5.340 16.245 3.815 1.00 0.00 O ATOM 2028 CB VAL A 140 4.279 13.548 5.015 1.00 0.00 C ATOM 2029 CG1 VAL A 140 3.392 12.318 5.241 1.00 0.00 C ATOM 2030 CG2 VAL A 140 5.607 13.045 4.439 1.00 0.00 C ATOM 0 H VAL A 140 4.318 14.547 2.223 1.00 0.00 H new ATOM 0 HA VAL A 140 2.553 14.713 4.561 1.00 0.00 H new ATOM 0 HB VAL A 140 4.486 14.067 5.951 1.00 0.00 H new ATOM 0 HG11 VAL A 140 3.933 11.584 5.838 1.00 0.00 H new ATOM 0 HG12 VAL A 140 2.485 12.615 5.767 1.00 0.00 H new ATOM 0 HG13 VAL A 140 3.126 11.879 4.279 1.00 0.00 H new ATOM 0 HG21 VAL A 140 6.027 12.288 5.101 1.00 0.00 H new ATOM 0 HG22 VAL A 140 5.435 12.611 3.454 1.00 0.00 H new ATOM 0 HG23 VAL A 140 6.305 13.878 4.352 1.00 0.00 H new ATOM 2040 N GLY A 141 3.519 16.946 4.964 1.00 0.00 N ATOM 2041 CA GLY A 141 3.897 18.354 5.156 1.00 0.00 C ATOM 2042 C GLY A 141 3.771 19.225 3.892 1.00 0.00 C ATOM 2043 O GLY A 141 4.625 19.138 3.005 1.00 0.00 O ATOM 0 H GLY A 141 2.618 16.727 5.389 1.00 0.00 H new ATOM 0 HA2 GLY A 141 3.273 18.781 5.941 1.00 0.00 H new ATOM 0 HA3 GLY A 141 4.927 18.396 5.510 1.00 0.00 H new ATOM 2046 N GLN A 142 2.732 20.072 3.808 1.00 0.00 N ATOM 2047 CA GLN A 142 2.564 21.088 2.746 1.00 0.00 C ATOM 2048 C GLN A 142 3.448 22.332 2.967 1.00 0.00 C ATOM 2049 O GLN A 142 4.032 22.832 1.979 1.00 0.00 O ATOM 2050 CB GLN A 142 1.087 21.514 2.615 1.00 0.00 C ATOM 2051 CG GLN A 142 0.196 20.362 2.115 1.00 0.00 C ATOM 2052 CD GLN A 142 -1.059 20.830 1.357 1.00 0.00 C ATOM 2053 OE1 GLN A 142 -1.012 21.674 0.472 1.00 0.00 O ATOM 2054 NE2 GLN A 142 -2.230 20.296 1.632 1.00 0.00 N ATOM 0 H GLN A 142 1.970 20.073 4.486 1.00 0.00 H new ATOM 0 HA GLN A 142 2.887 20.615 1.819 1.00 0.00 H new ATOM 0 HB2 GLN A 142 0.723 21.861 3.582 1.00 0.00 H new ATOM 0 HB3 GLN A 142 1.012 22.355 1.926 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.784 19.718 1.462 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -0.111 19.756 2.968 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -2.309 19.589 2.363 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -3.058 20.589 1.114 1.00 0.00 H new TER 2061 GLN A 142