USER MOD reduce.3.24.130724 H: found=0, std=0, add=1096, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1096 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 68 ASN : amide:sc= -0.977 X(o=1.4,f=1.2) USER MOD Set 1.2: A 70 LYS NZ :NH3+ -127:sc= 2.33 (180deg=-0.31) USER MOD Set 2.1: A 40 THR OG1 : rot 50:sc= 0.448 USER MOD Set 2.2: A 79 THR OG1 : rot 180:sc= 0.0592 USER MOD Set 3.1: A 32 SER OG : rot 66:sc= 1.15 USER MOD Set 3.2: A 37 HIS : no HE2:sc= -1.62 X(o=-0.47,f=-0.9) USER MOD Single : A 1 MET CE :methyl 166:sc= -0.138 (180deg=-0.534) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0.1) USER MOD Single : A 12 SER OG : rot 180:sc=-0.000577 USER MOD Single : A 13 ASN : amide:sc= 0.34 X(o=0.34,f=-0.0026) USER MOD Single : A 15 TYR OH : rot -164:sc= 1.24 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0172 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ -159:sc= 1.23 (180deg=1.14) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.539 USER MOD Single : A 27 SER OG : rot 79:sc= 0.711 USER MOD Single : A 30 ASN : amide:sc= 0.71 K(o=0.71,f=-5.7!) USER MOD Single : A 34 MET CE :methyl -168:sc= -0.232 (180deg=-0.607) USER MOD Single : A 39 MET CE :methyl -129:sc= -3.12! (180deg=-4.59!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.0526 USER MOD Single : A 47 GLN : amide:sc= -0.0654 K(o=-0.065,f=-1.5!) USER MOD Single : A 48 ASN : amide:sc= 1.17 K(o=1.2,f=-0.16) USER MOD Single : A 52 GLN : amide:sc= -1.59! K(o=-1.6!,f=-0.045) USER MOD Single : A 59 SER OG : rot 180:sc= 0.0025 USER MOD Single : A 60 TYR OH : rot 180:sc= 0.0857 USER MOD Single : A 72 GLN : amide:sc= 0.238 K(o=0.24,f=-3.1!) USER MOD Single : A 78 GLN : amide:sc= -0.766 K(o=-0.77,f=-1.8!) USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 HIS : no HE2:sc= -5.46! C(o=-5.5!,f=-7.9!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -1.96! C(o=-2!,f=-4.1!) USER MOD Single : A 95 ASN : amide:sc= -1.15 K(o=-1.1,f=-0.033) USER MOD Single : A 96 SER OG : rot 69:sc= 1.23 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 ASN : amide:sc= 0.605 K(o=0.6,f=-3.2!) USER MOD Single : A 106 TYR OH : rot 37:sc= 1.31 USER MOD Single : A 107 ASN : amide:sc= 0.0286 K(o=0.029,f=-1.6) USER MOD Single : A 108 GLN : amide:sc= 2.21 K(o=2.2,f=-1.2) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= 0.175 X(o=0.18,f=-0.24) USER MOD Single : A 119 ASN : amide:sc= -0.0862 X(o=-0.086,f=-0.25) USER MOD Single : A 123 SER OG : rot 70:sc= -0.755 USER MOD Single : A 127 LYS NZ :NH3+ 158:sc= 1.16 (180deg=1.1) USER MOD Single : A 131 THR OG1 : rot -43:sc= 0.851 USER MOD Single : A 132 THR OG1 : rot -21:sc= -1.03! USER MOD Single : A 134 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= 0.788 K(o=0.79,f=-0.31) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -0.165 K(o=-0.16,f=-0.75) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.741 61.116 -16.432 1.00 0.00 N ATOM 2 CA MET A 1 15.092 61.186 -15.829 1.00 0.00 C ATOM 3 C MET A 1 15.085 60.578 -14.434 1.00 0.00 C ATOM 4 O MET A 1 14.435 61.095 -13.525 1.00 0.00 O ATOM 5 CB MET A 1 15.570 62.641 -15.759 1.00 0.00 C ATOM 6 CG MET A 1 16.963 62.796 -15.168 1.00 0.00 C ATOM 7 SD MET A 1 17.508 64.512 -15.099 1.00 0.00 S ATOM 8 CE MET A 1 16.331 65.196 -13.935 1.00 0.00 C ATOM 0 H1 MET A 1 13.763 61.535 -17.384 1.00 0.00 H new ATOM 0 H2 MET A 1 13.441 60.122 -16.498 1.00 0.00 H new ATOM 0 H3 MET A 1 13.068 61.641 -15.838 1.00 0.00 H new ATOM 0 HA MET A 1 15.777 60.617 -16.458 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.561 63.067 -16.762 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.864 63.218 -15.161 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.974 62.376 -14.162 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.671 62.219 -15.763 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.679 66.172 -13.597 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.361 65.304 -14.420 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.236 64.528 -13.079 1.00 0.00 H new ATOM 20 N VAL A 2 15.800 59.474 -14.269 1.00 0.00 N ATOM 21 CA VAL A 2 15.859 58.802 -12.981 1.00 0.00 C ATOM 22 C VAL A 2 17.122 59.167 -12.204 1.00 0.00 C ATOM 23 O VAL A 2 18.244 58.954 -12.659 1.00 0.00 O ATOM 24 CB VAL A 2 15.755 57.265 -13.125 1.00 0.00 C ATOM 25 CG1 VAL A 2 14.360 56.867 -13.582 1.00 0.00 C ATOM 26 CG2 VAL A 2 16.802 56.724 -14.089 1.00 0.00 C ATOM 0 H VAL A 2 16.344 59.027 -15.007 1.00 0.00 H new ATOM 0 HA VAL A 2 14.995 59.153 -12.416 1.00 0.00 H new ATOM 0 HB VAL A 2 15.944 56.826 -12.145 1.00 0.00 H new ATOM 0 HG11 VAL A 2 14.304 55.783 -13.678 1.00 0.00 H new ATOM 0 HG12 VAL A 2 13.627 57.204 -12.849 1.00 0.00 H new ATOM 0 HG13 VAL A 2 14.148 57.328 -14.547 1.00 0.00 H new ATOM 0 HG21 VAL A 2 16.700 55.642 -14.166 1.00 0.00 H new ATOM 0 HG22 VAL A 2 16.658 57.173 -15.072 1.00 0.00 H new ATOM 0 HG23 VAL A 2 17.798 56.969 -13.720 1.00 0.00 H new ATOM 36 N CYS A 3 16.904 59.748 -11.037 1.00 0.00 N ATOM 37 CA CYS A 3 17.958 60.014 -10.068 1.00 0.00 C ATOM 38 C CYS A 3 17.364 59.898 -8.669 1.00 0.00 C ATOM 39 O CYS A 3 16.214 60.292 -8.458 1.00 0.00 O ATOM 40 CB CYS A 3 18.576 61.411 -10.264 1.00 0.00 C ATOM 41 SG CYS A 3 19.976 61.471 -11.429 1.00 0.00 S ATOM 0 H CYS A 3 15.980 60.053 -10.730 1.00 0.00 H new ATOM 0 HA CYS A 3 18.757 59.286 -10.208 1.00 0.00 H new ATOM 0 HB2 CYS A 3 17.799 62.090 -10.616 1.00 0.00 H new ATOM 0 HB3 CYS A 3 18.911 61.784 -9.296 1.00 0.00 H new ATOM 46 N PRO A 4 18.112 59.327 -7.709 1.00 0.00 N ATOM 47 CA PRO A 4 17.642 59.180 -6.326 1.00 0.00 C ATOM 48 C PRO A 4 17.261 60.520 -5.702 1.00 0.00 C ATOM 49 O PRO A 4 17.844 61.554 -6.029 1.00 0.00 O ATOM 50 CB PRO A 4 18.841 58.564 -5.599 1.00 0.00 C ATOM 51 CG PRO A 4 19.649 57.918 -6.673 1.00 0.00 C ATOM 52 CD PRO A 4 19.463 58.770 -7.897 1.00 0.00 C ATOM 0 HA PRO A 4 16.740 58.571 -6.264 1.00 0.00 H new ATOM 0 HB2 PRO A 4 19.418 59.325 -5.074 1.00 0.00 H new ATOM 0 HB3 PRO A 4 18.520 57.836 -4.854 1.00 0.00 H new ATOM 0 HG2 PRO A 4 20.701 57.863 -6.391 1.00 0.00 H new ATOM 0 HG3 PRO A 4 19.314 56.897 -6.853 1.00 0.00 H new ATOM 0 HD2 PRO A 4 20.218 59.554 -7.962 1.00 0.00 H new ATOM 0 HD3 PRO A 4 19.534 58.183 -8.812 1.00 0.00 H new ATOM 60 N ILE A 5 16.291 60.488 -4.793 1.00 0.00 N ATOM 61 CA ILE A 5 15.768 61.702 -4.167 1.00 0.00 C ATOM 62 C ILE A 5 16.827 62.367 -3.281 1.00 0.00 C ATOM 63 O ILE A 5 16.694 63.527 -2.880 1.00 0.00 O ATOM 64 CB ILE A 5 14.498 61.388 -3.335 1.00 0.00 C ATOM 65 CG1 ILE A 5 13.827 62.676 -2.852 1.00 0.00 C ATOM 66 CG2 ILE A 5 14.832 60.486 -2.153 1.00 0.00 C ATOM 67 CD1 ILE A 5 13.330 63.565 -3.975 1.00 0.00 C ATOM 0 H ILE A 5 15.847 59.628 -4.470 1.00 0.00 H new ATOM 0 HA ILE A 5 15.502 62.397 -4.964 1.00 0.00 H new ATOM 0 HB ILE A 5 13.798 60.860 -3.982 1.00 0.00 H new ATOM 0 HG12 ILE A 5 12.987 62.417 -2.207 1.00 0.00 H new ATOM 0 HG13 ILE A 5 14.535 63.237 -2.243 1.00 0.00 H new ATOM 0 HG21 ILE A 5 13.925 60.280 -1.585 1.00 0.00 H new ATOM 0 HG22 ILE A 5 15.252 59.549 -2.518 1.00 0.00 H new ATOM 0 HG23 ILE A 5 15.558 60.983 -1.510 1.00 0.00 H new ATOM 0 HD11 ILE A 5 12.867 64.458 -3.555 1.00 0.00 H new ATOM 0 HD12 ILE A 5 14.169 63.855 -4.608 1.00 0.00 H new ATOM 0 HD13 ILE A 5 12.596 63.022 -4.571 1.00 0.00 H new ATOM 79 N ASP A 6 17.877 61.619 -2.982 1.00 0.00 N ATOM 80 CA ASP A 6 19.001 62.129 -2.209 1.00 0.00 C ATOM 81 C ASP A 6 19.801 63.129 -3.037 1.00 0.00 C ATOM 82 O ASP A 6 20.376 64.079 -2.507 1.00 0.00 O ATOM 83 CB ASP A 6 19.920 60.977 -1.791 1.00 0.00 C ATOM 84 CG ASP A 6 19.177 59.826 -1.150 1.00 0.00 C ATOM 85 OD1 ASP A 6 18.487 59.082 -1.880 1.00 0.00 O ATOM 86 OD2 ASP A 6 19.287 59.648 0.082 1.00 0.00 O ATOM 0 H ASP A 6 17.975 60.644 -3.267 1.00 0.00 H new ATOM 0 HA ASP A 6 18.610 62.624 -1.320 1.00 0.00 H new ATOM 0 HB2 ASP A 6 20.456 60.612 -2.667 1.00 0.00 H new ATOM 0 HB3 ASP A 6 20.668 61.352 -1.093 1.00 0.00 H new ATOM 91 N TRP A 7 19.803 62.916 -4.347 1.00 0.00 N ATOM 92 CA TRP A 7 20.633 63.693 -5.259 1.00 0.00 C ATOM 93 C TRP A 7 19.880 64.919 -5.776 1.00 0.00 C ATOM 94 O TRP A 7 18.653 64.996 -5.691 1.00 0.00 O ATOM 95 CB TRP A 7 21.094 62.818 -6.437 1.00 0.00 C ATOM 96 CG TRP A 7 21.936 61.636 -6.034 1.00 0.00 C ATOM 97 CD1 TRP A 7 21.571 60.606 -5.213 1.00 0.00 C ATOM 98 CD2 TRP A 7 23.279 61.352 -6.451 1.00 0.00 C ATOM 99 NE1 TRP A 7 22.604 59.710 -5.085 1.00 0.00 N ATOM 100 CE2 TRP A 7 23.664 60.144 -5.836 1.00 0.00 C ATOM 101 CE3 TRP A 7 24.196 62.003 -7.282 1.00 0.00 C ATOM 102 CZ2 TRP A 7 24.925 59.577 -6.025 1.00 0.00 C ATOM 103 CZ3 TRP A 7 25.445 61.440 -7.468 1.00 0.00 C ATOM 104 CH2 TRP A 7 25.799 60.238 -6.844 1.00 0.00 C ATOM 0 H TRP A 7 19.233 62.205 -4.805 1.00 0.00 H new ATOM 0 HA TRP A 7 21.509 64.038 -4.709 1.00 0.00 H new ATOM 0 HB2 TRP A 7 20.216 62.459 -6.974 1.00 0.00 H new ATOM 0 HB3 TRP A 7 21.663 63.435 -7.133 1.00 0.00 H new ATOM 0 HD1 TRP A 7 20.608 60.510 -4.734 1.00 0.00 H new ATOM 0 HE1 TRP A 7 22.585 58.860 -4.522 1.00 0.00 H new ATOM 0 HE3 TRP A 7 23.933 62.930 -7.770 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 25.201 58.651 -5.543 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 26.161 61.937 -8.106 1.00 0.00 H new ATOM 0 HH2 TRP A 7 26.782 59.824 -7.013 1.00 0.00 H new ATOM 115 N ARG A 8 20.625 65.885 -6.291 1.00 0.00 N ATOM 116 CA ARG A 8 20.044 67.091 -6.868 1.00 0.00 C ATOM 117 C ARG A 8 20.355 67.156 -8.354 1.00 0.00 C ATOM 118 O ARG A 8 21.481 66.891 -8.763 1.00 0.00 O ATOM 119 CB ARG A 8 20.586 68.337 -6.162 1.00 0.00 C ATOM 120 CG ARG A 8 20.257 68.378 -4.681 1.00 0.00 C ATOM 121 CD ARG A 8 18.760 68.273 -4.457 1.00 0.00 C ATOM 122 NE ARG A 8 18.417 68.147 -3.041 1.00 0.00 N ATOM 123 CZ ARG A 8 17.875 67.047 -2.510 1.00 0.00 C ATOM 124 NH1 ARG A 8 17.657 65.982 -3.271 1.00 0.00 N ATOM 125 NH2 ARG A 8 17.562 67.008 -1.220 1.00 0.00 N ATOM 0 H ARG A 8 21.644 65.857 -6.322 1.00 0.00 H new ATOM 0 HA ARG A 8 18.963 67.058 -6.731 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.668 68.376 -6.288 1.00 0.00 H new ATOM 0 HB3 ARG A 8 20.177 69.226 -6.643 1.00 0.00 H new ATOM 0 HG2 ARG A 8 20.764 67.560 -4.169 1.00 0.00 H new ATOM 0 HG3 ARG A 8 20.630 69.306 -4.247 1.00 0.00 H new ATOM 0 HD2 ARG A 8 18.271 69.155 -4.870 1.00 0.00 H new ATOM 0 HD3 ARG A 8 18.373 67.411 -5.000 1.00 0.00 H new ATOM 0 HE ARG A 8 18.601 68.940 -2.427 1.00 0.00 H new ATOM 0 HH11 ARG A 8 17.903 66.003 -4.261 1.00 0.00 H new ATOM 0 HH12 ARG A 8 17.243 65.142 -2.866 1.00 0.00 H new ATOM 0 HH21 ARG A 8 17.735 67.821 -0.628 1.00 0.00 H new ATOM 0 HH22 ARG A 8 17.149 66.165 -0.821 1.00 0.00 H new ATOM 139 N ALA A 9 19.363 67.509 -9.156 1.00 0.00 N ATOM 140 CA ALA A 9 19.525 67.527 -10.601 1.00 0.00 C ATOM 141 C ALA A 9 19.705 68.948 -11.128 1.00 0.00 C ATOM 142 O ALA A 9 19.002 69.869 -10.715 1.00 0.00 O ATOM 143 CB ALA A 9 18.332 66.865 -11.271 1.00 0.00 C ATOM 0 H ALA A 9 18.437 67.787 -8.831 1.00 0.00 H new ATOM 0 HA ALA A 9 20.428 66.966 -10.842 1.00 0.00 H new ATOM 0 HB1 ALA A 9 18.465 66.885 -12.353 1.00 0.00 H new ATOM 0 HB2 ALA A 9 18.253 65.831 -10.934 1.00 0.00 H new ATOM 0 HB3 ALA A 9 17.422 67.403 -11.008 1.00 0.00 H new ATOM 149 N PHE A 10 20.659 69.109 -12.033 1.00 0.00 N ATOM 150 CA PHE A 10 20.896 70.385 -12.696 1.00 0.00 C ATOM 151 C PHE A 10 21.161 70.150 -14.179 1.00 0.00 C ATOM 152 O PHE A 10 22.200 69.592 -14.551 1.00 0.00 O ATOM 153 CB PHE A 10 22.076 71.117 -12.052 1.00 0.00 C ATOM 154 CG PHE A 10 22.350 72.473 -12.643 1.00 0.00 C ATOM 155 CD1 PHE A 10 21.461 73.518 -12.460 1.00 0.00 C ATOM 156 CD2 PHE A 10 23.499 72.698 -13.385 1.00 0.00 C ATOM 157 CE1 PHE A 10 21.712 74.764 -13.005 1.00 0.00 C ATOM 158 CE2 PHE A 10 23.756 73.940 -13.932 1.00 0.00 C ATOM 159 CZ PHE A 10 22.861 74.975 -13.742 1.00 0.00 C ATOM 0 H PHE A 10 21.289 68.363 -12.328 1.00 0.00 H new ATOM 0 HA PHE A 10 20.010 71.010 -12.586 1.00 0.00 H new ATOM 0 HB2 PHE A 10 21.882 71.229 -10.985 1.00 0.00 H new ATOM 0 HB3 PHE A 10 22.970 70.501 -12.151 1.00 0.00 H new ATOM 0 HD1 PHE A 10 20.561 73.358 -11.885 1.00 0.00 H new ATOM 0 HD2 PHE A 10 24.202 71.892 -13.537 1.00 0.00 H new ATOM 0 HE1 PHE A 10 21.010 75.571 -12.855 1.00 0.00 H new ATOM 0 HE2 PHE A 10 24.655 74.102 -14.507 1.00 0.00 H new ATOM 0 HZ PHE A 10 23.059 75.947 -14.169 1.00 0.00 H new ATOM 169 N GLN A 11 20.201 70.565 -15.009 1.00 0.00 N ATOM 170 CA GLN A 11 20.244 70.356 -16.462 1.00 0.00 C ATOM 171 C GLN A 11 20.153 68.870 -16.810 1.00 0.00 C ATOM 172 O GLN A 11 19.101 68.380 -17.214 1.00 0.00 O ATOM 173 CB GLN A 11 21.505 70.960 -17.092 1.00 0.00 C ATOM 174 CG GLN A 11 21.619 72.466 -16.934 1.00 0.00 C ATOM 175 CD GLN A 11 22.803 73.032 -17.688 1.00 0.00 C ATOM 176 OE1 GLN A 11 23.914 73.099 -17.166 1.00 0.00 O ATOM 177 NE2 GLN A 11 22.571 73.453 -18.922 1.00 0.00 N ATOM 0 H GLN A 11 19.366 71.058 -14.692 1.00 0.00 H new ATOM 0 HA GLN A 11 19.377 70.871 -16.877 1.00 0.00 H new ATOM 0 HB2 GLN A 11 22.381 70.492 -16.644 1.00 0.00 H new ATOM 0 HB3 GLN A 11 21.520 70.715 -18.154 1.00 0.00 H new ATOM 0 HG2 GLN A 11 20.704 72.937 -17.292 1.00 0.00 H new ATOM 0 HG3 GLN A 11 21.712 72.713 -15.876 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.634 73.379 -19.318 1.00 0.00 H new ATOM 0 HE22 GLN A 11 23.329 73.851 -19.476 1.00 0.00 H new ATOM 186 N SER A 12 21.259 68.164 -16.647 1.00 0.00 N ATOM 187 CA SER A 12 21.323 66.740 -16.935 1.00 0.00 C ATOM 188 C SER A 12 22.381 66.085 -16.059 1.00 0.00 C ATOM 189 O SER A 12 23.006 65.099 -16.443 1.00 0.00 O ATOM 190 CB SER A 12 21.639 66.513 -18.416 1.00 0.00 C ATOM 191 OG SER A 12 20.598 67.016 -19.239 1.00 0.00 O ATOM 0 H SER A 12 22.137 68.560 -16.312 1.00 0.00 H new ATOM 0 HA SER A 12 20.355 66.288 -16.717 1.00 0.00 H new ATOM 0 HB2 SER A 12 22.579 67.003 -18.671 1.00 0.00 H new ATOM 0 HB3 SER A 12 21.774 65.448 -18.604 1.00 0.00 H new ATOM 0 HG SER A 12 20.822 66.862 -20.181 1.00 0.00 H new ATOM 197 N ASN A 13 22.577 66.647 -14.875 1.00 0.00 N ATOM 198 CA ASN A 13 23.550 66.124 -13.933 1.00 0.00 C ATOM 199 C ASN A 13 22.889 65.935 -12.578 1.00 0.00 C ATOM 200 O ASN A 13 21.966 66.670 -12.233 1.00 0.00 O ATOM 201 CB ASN A 13 24.737 67.082 -13.779 1.00 0.00 C ATOM 202 CG ASN A 13 25.335 67.523 -15.103 1.00 0.00 C ATOM 203 OD1 ASN A 13 26.207 66.858 -15.661 1.00 0.00 O ATOM 204 ND2 ASN A 13 24.890 68.670 -15.599 1.00 0.00 N ATOM 0 H ASN A 13 22.071 67.469 -14.545 1.00 0.00 H new ATOM 0 HA ASN A 13 23.917 65.171 -14.313 1.00 0.00 H new ATOM 0 HB2 ASN A 13 24.413 67.963 -13.224 1.00 0.00 H new ATOM 0 HB3 ASN A 13 25.510 66.597 -13.184 1.00 0.00 H new ATOM 0 HD21 ASN A 13 25.272 69.030 -16.473 1.00 0.00 H new ATOM 0 HD22 ASN A 13 24.166 69.192 -15.106 1.00 0.00 H new ATOM 211 N CYS A 14 23.360 64.964 -11.815 1.00 0.00 N ATOM 212 CA CYS A 14 22.834 64.733 -10.477 1.00 0.00 C ATOM 213 C CYS A 14 23.973 64.762 -9.457 1.00 0.00 C ATOM 214 O CYS A 14 24.985 64.079 -9.615 1.00 0.00 O ATOM 215 CB CYS A 14 22.054 63.407 -10.419 1.00 0.00 C ATOM 216 SG CYS A 14 20.516 63.416 -11.393 1.00 0.00 S ATOM 0 H CYS A 14 24.103 64.324 -12.096 1.00 0.00 H new ATOM 0 HA CYS A 14 22.135 65.531 -10.227 1.00 0.00 H new ATOM 0 HB2 CYS A 14 22.696 62.603 -10.778 1.00 0.00 H new ATOM 0 HB3 CYS A 14 21.814 63.183 -9.380 1.00 0.00 H new ATOM 221 N TYR A 15 23.810 65.584 -8.425 1.00 0.00 N ATOM 222 CA TYR A 15 24.855 65.807 -7.430 1.00 0.00 C ATOM 223 C TYR A 15 24.386 65.336 -6.061 1.00 0.00 C ATOM 224 O TYR A 15 23.225 65.524 -5.706 1.00 0.00 O ATOM 225 CB TYR A 15 25.195 67.301 -7.328 1.00 0.00 C ATOM 226 CG TYR A 15 25.402 68.007 -8.655 1.00 0.00 C ATOM 227 CD1 TYR A 15 24.324 68.294 -9.481 1.00 0.00 C ATOM 228 CD2 TYR A 15 26.667 68.401 -9.069 1.00 0.00 C ATOM 229 CE1 TYR A 15 24.498 68.950 -10.682 1.00 0.00 C ATOM 230 CE2 TYR A 15 26.851 69.060 -10.273 1.00 0.00 C ATOM 231 CZ TYR A 15 25.763 69.330 -11.076 1.00 0.00 C ATOM 232 OH TYR A 15 25.932 69.994 -12.270 1.00 0.00 O ATOM 0 H TYR A 15 22.954 66.112 -8.255 1.00 0.00 H new ATOM 0 HA TYR A 15 25.736 65.246 -7.742 1.00 0.00 H new ATOM 0 HB2 TYR A 15 24.393 67.804 -6.788 1.00 0.00 H new ATOM 0 HB3 TYR A 15 26.100 67.412 -6.730 1.00 0.00 H new ATOM 0 HD1 TYR A 15 23.331 67.998 -9.178 1.00 0.00 H new ATOM 0 HD2 TYR A 15 27.521 68.190 -8.442 1.00 0.00 H new ATOM 0 HE1 TYR A 15 23.647 69.165 -11.311 1.00 0.00 H new ATOM 0 HE2 TYR A 15 27.841 69.361 -10.581 1.00 0.00 H new ATOM 0 HH TYR A 15 26.876 69.963 -12.531 1.00 0.00 H new ATOM 242 N PHE A 16 25.283 64.740 -5.294 1.00 0.00 N ATOM 243 CA PHE A 16 24.969 64.347 -3.928 1.00 0.00 C ATOM 244 C PHE A 16 26.028 64.872 -2.969 1.00 0.00 C ATOM 245 O PHE A 16 27.199 64.489 -3.051 1.00 0.00 O ATOM 246 CB PHE A 16 24.864 62.825 -3.816 1.00 0.00 C ATOM 247 CG PHE A 16 24.440 62.342 -2.457 1.00 0.00 C ATOM 248 CD1 PHE A 16 23.312 62.860 -1.844 1.00 0.00 C ATOM 249 CD2 PHE A 16 25.170 61.368 -1.797 1.00 0.00 C ATOM 250 CE1 PHE A 16 22.919 62.418 -0.596 1.00 0.00 C ATOM 251 CE2 PHE A 16 24.781 60.921 -0.548 1.00 0.00 C ATOM 252 CZ PHE A 16 23.654 61.446 0.053 1.00 0.00 C ATOM 0 H PHE A 16 26.233 64.517 -5.592 1.00 0.00 H new ATOM 0 HA PHE A 16 24.006 64.781 -3.659 1.00 0.00 H new ATOM 0 HB2 PHE A 16 24.151 62.464 -4.558 1.00 0.00 H new ATOM 0 HB3 PHE A 16 25.830 62.385 -4.062 1.00 0.00 H new ATOM 0 HD1 PHE A 16 22.732 63.619 -2.348 1.00 0.00 H new ATOM 0 HD2 PHE A 16 26.052 60.953 -2.263 1.00 0.00 H new ATOM 0 HE1 PHE A 16 22.038 62.832 -0.128 1.00 0.00 H new ATOM 0 HE2 PHE A 16 25.358 60.161 -0.042 1.00 0.00 H new ATOM 0 HZ PHE A 16 23.348 61.097 1.028 1.00 0.00 H new ATOM 262 N PRO A 17 25.635 65.784 -2.069 1.00 0.00 N ATOM 263 CA PRO A 17 26.515 66.308 -1.036 1.00 0.00 C ATOM 264 C PRO A 17 26.480 65.464 0.235 1.00 0.00 C ATOM 265 O PRO A 17 25.420 65.010 0.663 1.00 0.00 O ATOM 266 CB PRO A 17 25.938 67.695 -0.781 1.00 0.00 C ATOM 267 CG PRO A 17 24.473 67.572 -1.065 1.00 0.00 C ATOM 268 CD PRO A 17 24.296 66.400 -2.006 1.00 0.00 C ATOM 0 HA PRO A 17 27.562 66.311 -1.338 1.00 0.00 H new ATOM 0 HB2 PRO A 17 26.114 68.011 0.247 1.00 0.00 H new ATOM 0 HB3 PRO A 17 26.403 68.439 -1.428 1.00 0.00 H new ATOM 0 HG2 PRO A 17 23.914 67.412 -0.143 1.00 0.00 H new ATOM 0 HG3 PRO A 17 24.090 68.488 -1.515 1.00 0.00 H new ATOM 0 HD2 PRO A 17 23.551 65.697 -1.632 1.00 0.00 H new ATOM 0 HD3 PRO A 17 23.961 66.726 -2.990 1.00 0.00 H new ATOM 276 N LEU A 18 27.643 65.242 0.826 1.00 0.00 N ATOM 277 CA LEU A 18 27.725 64.490 2.066 1.00 0.00 C ATOM 278 C LEU A 18 28.392 65.330 3.143 1.00 0.00 C ATOM 279 O LEU A 18 29.265 66.151 2.850 1.00 0.00 O ATOM 280 CB LEU A 18 28.469 63.166 1.870 1.00 0.00 C ATOM 281 CG LEU A 18 27.832 62.210 0.855 1.00 0.00 C ATOM 282 CD1 LEU A 18 28.364 62.467 -0.546 1.00 0.00 C ATOM 283 CD2 LEU A 18 28.057 60.764 1.259 1.00 0.00 C ATOM 0 H LEU A 18 28.540 65.571 0.468 1.00 0.00 H new ATOM 0 HA LEU A 18 26.711 64.250 2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.489 63.383 1.552 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.536 62.658 2.832 1.00 0.00 H new ATOM 0 HG LEU A 18 26.758 62.398 0.847 1.00 0.00 H new ATOM 0 HD11 LEU A 18 27.895 61.775 -1.246 1.00 0.00 H new ATOM 0 HD12 LEU A 18 28.135 63.491 -0.840 1.00 0.00 H new ATOM 0 HD13 LEU A 18 29.444 62.319 -0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.596 60.105 0.524 1.00 0.00 H new ATOM 0 HD22 LEU A 18 29.127 60.562 1.307 1.00 0.00 H new ATOM 0 HD23 LEU A 18 27.610 60.586 2.237 1.00 0.00 H new ATOM 295 N THR A 19 28.005 65.089 4.386 1.00 0.00 N ATOM 296 CA THR A 19 28.340 65.967 5.486 1.00 0.00 C ATOM 297 C THR A 19 29.498 65.426 6.311 1.00 0.00 C ATOM 298 O THR A 19 29.321 64.995 7.458 1.00 0.00 O ATOM 299 CB THR A 19 27.113 66.196 6.387 1.00 0.00 C ATOM 300 OG1 THR A 19 26.379 64.968 6.519 1.00 0.00 O ATOM 301 CG2 THR A 19 26.208 67.275 5.811 1.00 0.00 C ATOM 0 H THR A 19 27.450 64.277 4.656 1.00 0.00 H new ATOM 0 HA THR A 19 28.653 66.919 5.056 1.00 0.00 H new ATOM 0 HB THR A 19 27.460 66.527 7.366 1.00 0.00 H new ATOM 0 HG1 THR A 19 25.599 65.113 7.094 1.00 0.00 H new ATOM 0 HG21 THR A 19 25.349 67.417 6.466 1.00 0.00 H new ATOM 0 HG22 THR A 19 26.762 68.210 5.731 1.00 0.00 H new ATOM 0 HG23 THR A 19 25.864 66.972 4.822 1.00 0.00 H new ATOM 309 N ASP A 20 30.657 65.382 5.674 1.00 0.00 N ATOM 310 CA ASP A 20 31.938 65.182 6.363 1.00 0.00 C ATOM 311 C ASP A 20 32.195 63.700 6.664 1.00 0.00 C ATOM 312 O ASP A 20 31.381 62.843 6.305 1.00 0.00 O ATOM 313 CB ASP A 20 31.972 66.056 7.641 1.00 0.00 C ATOM 314 CG ASP A 20 33.227 65.899 8.477 1.00 0.00 C ATOM 315 OD1 ASP A 20 34.299 66.368 8.047 1.00 0.00 O ATOM 316 OD2 ASP A 20 33.141 65.283 9.560 1.00 0.00 O ATOM 0 H ASP A 20 30.745 65.483 4.663 1.00 0.00 H new ATOM 0 HA ASP A 20 32.749 65.497 5.707 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.871 67.102 7.353 1.00 0.00 H new ATOM 0 HB3 ASP A 20 31.107 65.810 8.257 1.00 0.00 H new ATOM 321 N ASN A 21 33.360 63.422 7.263 1.00 0.00 N ATOM 322 CA ASN A 21 33.755 62.095 7.734 1.00 0.00 C ATOM 323 C ASN A 21 34.418 61.265 6.639 1.00 0.00 C ATOM 324 O ASN A 21 34.573 60.055 6.788 1.00 0.00 O ATOM 325 CB ASN A 21 32.569 61.338 8.329 1.00 0.00 C ATOM 326 CG ASN A 21 32.739 61.047 9.805 1.00 0.00 C ATOM 327 OD1 ASN A 21 33.292 60.016 10.191 1.00 0.00 O ATOM 328 ND2 ASN A 21 32.253 61.948 10.646 1.00 0.00 N ATOM 0 H ASN A 21 34.070 64.134 7.436 1.00 0.00 H new ATOM 0 HA ASN A 21 34.494 62.255 8.519 1.00 0.00 H new ATOM 0 HB2 ASN A 21 31.660 61.921 8.181 1.00 0.00 H new ATOM 0 HB3 ASN A 21 32.436 60.399 7.791 1.00 0.00 H new ATOM 0 HD21 ASN A 21 32.330 61.800 11.652 1.00 0.00 H new ATOM 0 HD22 ASN A 21 31.802 62.789 10.287 1.00 0.00 H new ATOM 335 N LYS A 22 34.831 61.910 5.551 1.00 0.00 N ATOM 336 CA LYS A 22 35.540 61.210 4.482 1.00 0.00 C ATOM 337 C LYS A 22 36.690 62.046 3.939 1.00 0.00 C ATOM 338 O LYS A 22 36.630 63.271 3.930 1.00 0.00 O ATOM 339 CB LYS A 22 34.590 60.837 3.341 1.00 0.00 C ATOM 340 CG LYS A 22 33.686 59.655 3.655 1.00 0.00 C ATOM 341 CD LYS A 22 34.496 58.406 3.966 1.00 0.00 C ATOM 342 CE LYS A 22 33.606 57.197 4.186 1.00 0.00 C ATOM 343 NZ LYS A 22 34.398 55.980 4.509 1.00 0.00 N ATOM 0 H LYS A 22 34.689 62.907 5.386 1.00 0.00 H new ATOM 0 HA LYS A 22 35.948 60.296 4.914 1.00 0.00 H new ATOM 0 HB2 LYS A 22 33.971 61.701 3.099 1.00 0.00 H new ATOM 0 HB3 LYS A 22 35.178 60.607 2.452 1.00 0.00 H new ATOM 0 HG2 LYS A 22 33.048 59.898 4.505 1.00 0.00 H new ATOM 0 HG3 LYS A 22 33.028 59.463 2.807 1.00 0.00 H new ATOM 0 HD2 LYS A 22 35.185 58.206 3.145 1.00 0.00 H new ATOM 0 HD3 LYS A 22 35.102 58.578 4.856 1.00 0.00 H new ATOM 0 HE2 LYS A 22 32.908 57.402 4.997 1.00 0.00 H new ATOM 0 HE3 LYS A 22 33.010 57.016 3.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 33.831 55.132 4.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 35.262 55.965 3.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 34.656 55.991 5.517 1.00 0.00 H new ATOM 357 N THR A 23 37.740 61.374 3.502 1.00 0.00 N ATOM 358 CA THR A 23 38.862 62.045 2.871 1.00 0.00 C ATOM 359 C THR A 23 38.566 62.232 1.393 1.00 0.00 C ATOM 360 O THR A 23 37.571 61.704 0.893 1.00 0.00 O ATOM 361 CB THR A 23 40.160 61.229 3.029 1.00 0.00 C ATOM 362 OG1 THR A 23 39.967 59.900 2.525 1.00 0.00 O ATOM 363 CG2 THR A 23 40.590 61.160 4.486 1.00 0.00 C ATOM 0 H THR A 23 37.839 60.361 3.573 1.00 0.00 H new ATOM 0 HA THR A 23 39.002 63.011 3.356 1.00 0.00 H new ATOM 0 HB THR A 23 40.944 61.729 2.460 1.00 0.00 H new ATOM 0 HG1 THR A 23 40.796 59.388 2.627 1.00 0.00 H new ATOM 0 HG21 THR A 23 41.508 60.578 4.567 1.00 0.00 H new ATOM 0 HG22 THR A 23 40.765 62.168 4.862 1.00 0.00 H new ATOM 0 HG23 THR A 23 39.806 60.684 5.075 1.00 0.00 H new ATOM 371 N TRP A 24 39.413 62.969 0.689 1.00 0.00 N ATOM 372 CA TRP A 24 39.253 63.126 -0.750 1.00 0.00 C ATOM 373 C TRP A 24 39.383 61.766 -1.418 1.00 0.00 C ATOM 374 O TRP A 24 38.641 61.436 -2.345 1.00 0.00 O ATOM 375 CB TRP A 24 40.300 64.088 -1.303 1.00 0.00 C ATOM 376 CG TRP A 24 40.066 64.484 -2.730 1.00 0.00 C ATOM 377 CD1 TRP A 24 39.281 65.507 -3.169 1.00 0.00 C ATOM 378 CD2 TRP A 24 40.629 63.878 -3.902 1.00 0.00 C ATOM 379 NE1 TRP A 24 39.321 65.581 -4.536 1.00 0.00 N ATOM 380 CE2 TRP A 24 40.140 64.593 -5.013 1.00 0.00 C ATOM 381 CE3 TRP A 24 41.499 62.807 -4.122 1.00 0.00 C ATOM 382 CZ2 TRP A 24 40.490 64.269 -6.319 1.00 0.00 C ATOM 383 CZ3 TRP A 24 41.845 62.486 -5.421 1.00 0.00 C ATOM 384 CH2 TRP A 24 41.342 63.216 -6.505 1.00 0.00 C ATOM 0 H TRP A 24 40.212 63.464 1.086 1.00 0.00 H new ATOM 0 HA TRP A 24 38.267 63.541 -0.958 1.00 0.00 H new ATOM 0 HB2 TRP A 24 40.317 64.986 -0.685 1.00 0.00 H new ATOM 0 HB3 TRP A 24 41.284 63.626 -1.221 1.00 0.00 H new ATOM 0 HD1 TRP A 24 38.709 66.165 -2.531 1.00 0.00 H new ATOM 0 HE1 TRP A 24 38.821 66.263 -5.107 1.00 0.00 H new ATOM 0 HE3 TRP A 24 41.894 62.240 -3.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 40.103 64.829 -7.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 42.514 61.658 -5.603 1.00 0.00 H new ATOM 0 HH2 TRP A 24 41.633 62.942 -7.508 1.00 0.00 H new ATOM 395 N ALA A 25 40.326 60.975 -0.918 1.00 0.00 N ATOM 396 CA ALA A 25 40.507 59.607 -1.373 1.00 0.00 C ATOM 397 C ALA A 25 39.218 58.818 -1.194 1.00 0.00 C ATOM 398 O ALA A 25 38.657 58.306 -2.160 1.00 0.00 O ATOM 399 CB ALA A 25 41.642 58.944 -0.609 1.00 0.00 C ATOM 0 H ALA A 25 40.981 61.264 -0.191 1.00 0.00 H new ATOM 0 HA ALA A 25 40.762 59.622 -2.433 1.00 0.00 H new ATOM 0 HB1 ALA A 25 41.767 57.920 -0.960 1.00 0.00 H new ATOM 0 HB2 ALA A 25 42.565 59.499 -0.775 1.00 0.00 H new ATOM 0 HB3 ALA A 25 41.409 58.937 0.456 1.00 0.00 H new ATOM 405 N GLU A 26 38.740 58.758 0.046 1.00 0.00 N ATOM 406 CA GLU A 26 37.506 58.048 0.371 1.00 0.00 C ATOM 407 C GLU A 26 36.329 58.570 -0.444 1.00 0.00 C ATOM 408 O GLU A 26 35.471 57.800 -0.864 1.00 0.00 O ATOM 409 CB GLU A 26 37.200 58.177 1.859 1.00 0.00 C ATOM 410 CG GLU A 26 37.997 57.221 2.727 1.00 0.00 C ATOM 411 CD GLU A 26 37.591 55.779 2.504 1.00 0.00 C ATOM 412 OE1 GLU A 26 36.409 55.449 2.733 1.00 0.00 O ATOM 413 OE2 GLU A 26 38.451 54.970 2.101 1.00 0.00 O ATOM 0 H GLU A 26 39.193 59.196 0.848 1.00 0.00 H new ATOM 0 HA GLU A 26 37.653 56.998 0.120 1.00 0.00 H new ATOM 0 HB2 GLU A 26 37.405 59.200 2.176 1.00 0.00 H new ATOM 0 HB3 GLU A 26 36.137 58.000 2.020 1.00 0.00 H new ATOM 0 HG2 GLU A 26 39.059 57.336 2.512 1.00 0.00 H new ATOM 0 HG3 GLU A 26 37.855 57.480 3.776 1.00 0.00 H new ATOM 420 N SER A 27 36.299 59.878 -0.661 1.00 0.00 N ATOM 421 CA SER A 27 35.252 60.499 -1.456 1.00 0.00 C ATOM 422 C SER A 27 35.142 59.857 -2.839 1.00 0.00 C ATOM 423 O SER A 27 34.054 59.458 -3.252 1.00 0.00 O ATOM 424 CB SER A 27 35.506 62.001 -1.586 1.00 0.00 C ATOM 425 OG SER A 27 35.429 62.639 -0.324 1.00 0.00 O ATOM 0 H SER A 27 36.992 60.531 -0.295 1.00 0.00 H new ATOM 0 HA SER A 27 34.305 60.342 -0.941 1.00 0.00 H new ATOM 0 HB2 SER A 27 36.490 62.171 -2.024 1.00 0.00 H new ATOM 0 HB3 SER A 27 34.775 62.440 -2.265 1.00 0.00 H new ATOM 0 HG SER A 27 36.263 62.491 0.169 1.00 0.00 H new ATOM 431 N GLU A 28 36.264 59.738 -3.541 1.00 0.00 N ATOM 432 CA GLU A 28 36.259 59.163 -4.880 1.00 0.00 C ATOM 433 C GLU A 28 36.247 57.635 -4.814 1.00 0.00 C ATOM 434 O GLU A 28 35.867 56.970 -5.770 1.00 0.00 O ATOM 435 CB GLU A 28 37.452 59.672 -5.698 1.00 0.00 C ATOM 436 CG GLU A 28 37.386 59.316 -7.179 1.00 0.00 C ATOM 437 CD GLU A 28 36.102 59.780 -7.848 1.00 0.00 C ATOM 438 OE1 GLU A 28 36.047 60.940 -8.309 1.00 0.00 O ATOM 439 OE2 GLU A 28 35.150 58.976 -7.934 1.00 0.00 O ATOM 0 H GLU A 28 37.183 60.030 -3.207 1.00 0.00 H new ATOM 0 HA GLU A 28 35.348 59.484 -5.385 1.00 0.00 H new ATOM 0 HB2 GLU A 28 37.512 60.756 -5.598 1.00 0.00 H new ATOM 0 HB3 GLU A 28 38.370 59.262 -5.277 1.00 0.00 H new ATOM 0 HG2 GLU A 28 38.238 59.763 -7.692 1.00 0.00 H new ATOM 0 HG3 GLU A 28 37.477 58.236 -7.291 1.00 0.00 H new ATOM 446 N ARG A 29 36.682 57.082 -3.684 1.00 0.00 N ATOM 447 CA ARG A 29 36.573 55.643 -3.451 1.00 0.00 C ATOM 448 C ARG A 29 35.107 55.238 -3.358 1.00 0.00 C ATOM 449 O ARG A 29 34.695 54.211 -3.901 1.00 0.00 O ATOM 450 CB ARG A 29 37.290 55.229 -2.162 1.00 0.00 C ATOM 451 CG ARG A 29 38.806 55.307 -2.228 1.00 0.00 C ATOM 452 CD ARG A 29 39.426 54.922 -0.897 1.00 0.00 C ATOM 453 NE ARG A 29 40.876 55.076 -0.898 1.00 0.00 N ATOM 454 CZ ARG A 29 41.624 55.054 0.203 1.00 0.00 C ATOM 455 NH1 ARG A 29 41.063 54.925 1.399 1.00 0.00 N ATOM 456 NH2 ARG A 29 42.939 55.182 0.109 1.00 0.00 N ATOM 0 H ARG A 29 37.111 57.604 -2.920 1.00 0.00 H new ATOM 0 HA ARG A 29 37.047 55.136 -4.291 1.00 0.00 H new ATOM 0 HB2 ARG A 29 36.942 55.865 -1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 29 37.002 54.207 -1.914 1.00 0.00 H new ATOM 0 HG2 ARG A 29 39.175 54.644 -3.011 1.00 0.00 H new ATOM 0 HG3 ARG A 29 39.111 56.318 -2.497 1.00 0.00 H new ATOM 0 HD2 ARG A 29 38.998 55.539 -0.107 1.00 0.00 H new ATOM 0 HD3 ARG A 29 39.173 53.887 -0.666 1.00 0.00 H new ATOM 0 HE ARG A 29 41.344 55.208 -1.794 1.00 0.00 H new ATOM 0 HH11 ARG A 29 40.050 54.842 1.481 1.00 0.00 H new ATOM 0 HH12 ARG A 29 41.645 54.909 2.236 1.00 0.00 H new ATOM 0 HH21 ARG A 29 43.376 55.297 -0.805 1.00 0.00 H new ATOM 0 HH22 ARG A 29 43.514 55.166 0.951 1.00 0.00 H new ATOM 470 N ASN A 30 34.329 56.047 -2.646 1.00 0.00 N ATOM 471 CA ASN A 30 32.897 55.815 -2.499 1.00 0.00 C ATOM 472 C ASN A 30 32.168 56.181 -3.789 1.00 0.00 C ATOM 473 O ASN A 30 31.121 55.620 -4.117 1.00 0.00 O ATOM 474 CB ASN A 30 32.358 56.628 -1.320 1.00 0.00 C ATOM 475 CG ASN A 30 30.880 56.414 -1.073 1.00 0.00 C ATOM 476 OD1 ASN A 30 30.039 57.157 -1.585 1.00 0.00 O ATOM 477 ND2 ASN A 30 30.552 55.405 -0.278 1.00 0.00 N ATOM 0 H ASN A 30 34.670 56.875 -2.158 1.00 0.00 H new ATOM 0 HA ASN A 30 32.724 54.757 -2.299 1.00 0.00 H new ATOM 0 HB2 ASN A 30 32.912 56.362 -0.420 1.00 0.00 H new ATOM 0 HB3 ASN A 30 32.539 57.687 -1.504 1.00 0.00 H new ATOM 0 HD21 ASN A 30 29.571 55.219 -0.069 1.00 0.00 H new ATOM 0 HD22 ASN A 30 31.280 54.815 0.124 1.00 0.00 H new ATOM 484 N CYS A 31 32.743 57.117 -4.526 1.00 0.00 N ATOM 485 CA CYS A 31 32.261 57.451 -5.854 1.00 0.00 C ATOM 486 C CYS A 31 32.875 56.478 -6.858 1.00 0.00 C ATOM 487 O CYS A 31 33.613 55.576 -6.463 1.00 0.00 O ATOM 488 CB CYS A 31 32.594 58.903 -6.216 1.00 0.00 C ATOM 489 SG CYS A 31 31.773 60.138 -5.161 1.00 0.00 S ATOM 0 H CYS A 31 33.550 57.662 -4.223 1.00 0.00 H new ATOM 0 HA CYS A 31 31.175 57.360 -5.878 1.00 0.00 H new ATOM 0 HB2 CYS A 31 33.673 59.044 -6.151 1.00 0.00 H new ATOM 0 HB3 CYS A 31 32.312 59.082 -7.253 1.00 0.00 H new ATOM 494 N SER A 32 32.519 56.616 -8.134 1.00 0.00 N ATOM 495 CA SER A 32 32.944 55.679 -9.181 1.00 0.00 C ATOM 496 C SER A 32 32.223 54.335 -9.043 1.00 0.00 C ATOM 497 O SER A 32 31.708 53.798 -10.023 1.00 0.00 O ATOM 498 CB SER A 32 34.467 55.497 -9.180 1.00 0.00 C ATOM 499 OG SER A 32 35.124 56.730 -9.433 1.00 0.00 O ATOM 0 H SER A 32 31.930 57.376 -8.474 1.00 0.00 H new ATOM 0 HA SER A 32 32.665 56.108 -10.144 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.789 55.099 -8.218 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.751 54.767 -9.938 1.00 0.00 H new ATOM 0 HG SER A 32 34.954 57.349 -8.693 1.00 0.00 H new ATOM 505 N GLY A 33 32.154 53.813 -7.822 1.00 0.00 N ATOM 506 CA GLY A 33 31.407 52.594 -7.566 1.00 0.00 C ATOM 507 C GLY A 33 29.912 52.798 -7.735 1.00 0.00 C ATOM 508 O GLY A 33 29.156 51.840 -7.878 1.00 0.00 O ATOM 0 H GLY A 33 32.605 54.215 -7.000 1.00 0.00 H new ATOM 0 HA2 GLY A 33 31.745 51.812 -8.245 1.00 0.00 H new ATOM 0 HA3 GLY A 33 31.614 52.248 -6.553 1.00 0.00 H new ATOM 512 N MET A 34 29.484 54.056 -7.703 1.00 0.00 N ATOM 513 CA MET A 34 28.087 54.404 -7.950 1.00 0.00 C ATOM 514 C MET A 34 27.900 54.852 -9.397 1.00 0.00 C ATOM 515 O MET A 34 26.813 55.265 -9.793 1.00 0.00 O ATOM 516 CB MET A 34 27.629 55.529 -7.014 1.00 0.00 C ATOM 517 CG MET A 34 27.611 55.152 -5.544 1.00 0.00 C ATOM 518 SD MET A 34 27.018 56.495 -4.494 1.00 0.00 S ATOM 519 CE MET A 34 28.277 57.736 -4.780 1.00 0.00 C ATOM 0 H MET A 34 30.087 54.855 -7.508 1.00 0.00 H new ATOM 0 HA MET A 34 27.484 53.516 -7.760 1.00 0.00 H new ATOM 0 HB2 MET A 34 28.287 56.388 -7.148 1.00 0.00 H new ATOM 0 HB3 MET A 34 26.628 55.845 -7.308 1.00 0.00 H new ATOM 0 HG2 MET A 34 26.975 54.278 -5.404 1.00 0.00 H new ATOM 0 HG3 MET A 34 28.616 54.868 -5.233 1.00 0.00 H new ATOM 0 HE1 MET A 34 28.172 58.536 -4.048 1.00 0.00 H new ATOM 0 HE2 MET A 34 29.263 57.283 -4.683 1.00 0.00 H new ATOM 0 HE3 MET A 34 28.163 58.145 -5.784 1.00 0.00 H new ATOM 529 N GLY A 35 28.972 54.776 -10.176 1.00 0.00 N ATOM 530 CA GLY A 35 28.934 55.258 -11.547 1.00 0.00 C ATOM 531 C GLY A 35 29.168 56.754 -11.627 1.00 0.00 C ATOM 532 O GLY A 35 29.198 57.336 -12.711 1.00 0.00 O ATOM 0 H GLY A 35 29.869 54.389 -9.884 1.00 0.00 H new ATOM 0 HA2 GLY A 35 29.692 54.740 -12.135 1.00 0.00 H new ATOM 0 HA3 GLY A 35 27.967 55.018 -11.990 1.00 0.00 H new ATOM 536 N ALA A 36 29.346 57.371 -10.468 1.00 0.00 N ATOM 537 CA ALA A 36 29.543 58.810 -10.377 1.00 0.00 C ATOM 538 C ALA A 36 31.019 59.146 -10.204 1.00 0.00 C ATOM 539 O ALA A 36 31.865 58.257 -10.219 1.00 0.00 O ATOM 540 CB ALA A 36 28.736 59.370 -9.214 1.00 0.00 C ATOM 0 H ALA A 36 29.358 56.891 -9.568 1.00 0.00 H new ATOM 0 HA ALA A 36 29.198 59.266 -11.305 1.00 0.00 H new ATOM 0 HB1 ALA A 36 28.888 60.448 -9.151 1.00 0.00 H new ATOM 0 HB2 ALA A 36 27.678 59.161 -9.371 1.00 0.00 H new ATOM 0 HB3 ALA A 36 29.064 58.903 -8.285 1.00 0.00 H new ATOM 546 N HIS A 37 31.321 60.420 -10.039 1.00 0.00 N ATOM 547 CA HIS A 37 32.687 60.870 -9.804 1.00 0.00 C ATOM 548 C HIS A 37 32.636 62.123 -8.943 1.00 0.00 C ATOM 549 O HIS A 37 31.568 62.709 -8.790 1.00 0.00 O ATOM 550 CB HIS A 37 33.384 61.156 -11.138 1.00 0.00 C ATOM 551 CG HIS A 37 34.747 60.547 -11.251 1.00 0.00 C ATOM 552 ND1 HIS A 37 34.998 59.212 -11.020 1.00 0.00 N ATOM 553 CD2 HIS A 37 35.936 61.096 -11.587 1.00 0.00 C ATOM 554 CE1 HIS A 37 36.280 58.968 -11.213 1.00 0.00 C ATOM 555 NE2 HIS A 37 36.872 60.094 -11.559 1.00 0.00 N ATOM 0 H HIS A 37 30.632 61.172 -10.063 1.00 0.00 H new ATOM 0 HA HIS A 37 33.256 60.096 -9.290 1.00 0.00 H new ATOM 0 HB2 HIS A 37 32.761 60.782 -11.950 1.00 0.00 H new ATOM 0 HB3 HIS A 37 33.466 62.235 -11.270 1.00 0.00 H new ATOM 0 HD1 HIS A 37 34.301 58.520 -10.743 1.00 0.00 H new ATOM 0 HD2 HIS A 37 36.116 62.132 -11.832 1.00 0.00 H new ATOM 0 HE1 HIS A 37 36.763 58.008 -11.106 1.00 0.00 H new ATOM 564 N LEU A 38 33.759 62.525 -8.362 1.00 0.00 N ATOM 565 CA LEU A 38 33.779 63.724 -7.528 1.00 0.00 C ATOM 566 C LEU A 38 33.368 64.961 -8.320 1.00 0.00 C ATOM 567 O LEU A 38 33.665 65.082 -9.510 1.00 0.00 O ATOM 568 CB LEU A 38 35.152 63.925 -6.888 1.00 0.00 C ATOM 569 CG LEU A 38 35.499 62.913 -5.796 1.00 0.00 C ATOM 570 CD1 LEU A 38 36.803 63.285 -5.116 1.00 0.00 C ATOM 571 CD2 LEU A 38 34.373 62.826 -4.777 1.00 0.00 C ATOM 0 H LEU A 38 34.656 62.048 -8.449 1.00 0.00 H new ATOM 0 HA LEU A 38 33.049 63.580 -6.732 1.00 0.00 H new ATOM 0 HB2 LEU A 38 35.913 63.874 -7.667 1.00 0.00 H new ATOM 0 HB3 LEU A 38 35.197 64.928 -6.463 1.00 0.00 H new ATOM 0 HG LEU A 38 35.623 61.935 -6.261 1.00 0.00 H new ATOM 0 HD11 LEU A 38 37.032 62.552 -4.342 1.00 0.00 H new ATOM 0 HD12 LEU A 38 37.607 63.298 -5.852 1.00 0.00 H new ATOM 0 HD13 LEU A 38 36.709 64.272 -4.664 1.00 0.00 H new ATOM 0 HD21 LEU A 38 34.635 62.101 -4.006 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.220 63.803 -4.319 1.00 0.00 H new ATOM 0 HD23 LEU A 38 33.456 62.511 -5.274 1.00 0.00 H new ATOM 583 N MET A 39 32.672 65.863 -7.636 1.00 0.00 N ATOM 584 CA MET A 39 32.116 67.065 -8.249 1.00 0.00 C ATOM 585 C MET A 39 33.214 67.904 -8.903 1.00 0.00 C ATOM 586 O MET A 39 34.164 68.333 -8.240 1.00 0.00 O ATOM 587 CB MET A 39 31.374 67.878 -7.182 1.00 0.00 C ATOM 588 CG MET A 39 30.414 68.928 -7.724 1.00 0.00 C ATOM 589 SD MET A 39 31.240 70.374 -8.397 1.00 0.00 S ATOM 590 CE MET A 39 29.824 71.357 -8.877 1.00 0.00 C ATOM 0 H MET A 39 32.477 65.781 -6.638 1.00 0.00 H new ATOM 0 HA MET A 39 31.416 66.774 -9.032 1.00 0.00 H new ATOM 0 HB2 MET A 39 30.816 67.191 -6.546 1.00 0.00 H new ATOM 0 HB3 MET A 39 32.109 68.373 -6.548 1.00 0.00 H new ATOM 0 HG2 MET A 39 29.796 68.478 -8.501 1.00 0.00 H new ATOM 0 HG3 MET A 39 29.742 69.242 -6.925 1.00 0.00 H new ATOM 0 HE1 MET A 39 29.939 71.681 -9.911 1.00 0.00 H new ATOM 0 HE2 MET A 39 28.917 70.759 -8.783 1.00 0.00 H new ATOM 0 HE3 MET A 39 29.751 72.231 -8.230 1.00 0.00 H new ATOM 600 N THR A 40 33.087 68.108 -10.205 1.00 0.00 N ATOM 601 CA THR A 40 34.042 68.902 -10.950 1.00 0.00 C ATOM 602 C THR A 40 33.370 70.142 -11.537 1.00 0.00 C ATOM 603 O THR A 40 32.652 70.063 -12.536 1.00 0.00 O ATOM 604 CB THR A 40 34.711 68.070 -12.067 1.00 0.00 C ATOM 605 OG1 THR A 40 33.724 67.500 -12.940 1.00 0.00 O ATOM 606 CG2 THR A 40 35.554 66.958 -11.465 1.00 0.00 C ATOM 0 H THR A 40 32.325 67.730 -10.768 1.00 0.00 H new ATOM 0 HA THR A 40 34.820 69.223 -10.258 1.00 0.00 H new ATOM 0 HB THR A 40 35.351 68.737 -12.645 1.00 0.00 H new ATOM 0 HG1 THR A 40 33.097 68.197 -13.224 1.00 0.00 H new ATOM 0 HG21 THR A 40 36.019 66.381 -12.264 1.00 0.00 H new ATOM 0 HG22 THR A 40 36.329 67.391 -10.832 1.00 0.00 H new ATOM 0 HG23 THR A 40 34.920 66.304 -10.866 1.00 0.00 H new ATOM 614 N ILE A 41 33.590 71.281 -10.887 1.00 0.00 N ATOM 615 CA ILE A 41 32.963 72.535 -11.287 1.00 0.00 C ATOM 616 C ILE A 41 33.439 72.974 -12.666 1.00 0.00 C ATOM 617 O ILE A 41 34.590 73.374 -12.849 1.00 0.00 O ATOM 618 CB ILE A 41 33.235 73.655 -10.258 1.00 0.00 C ATOM 619 CG1 ILE A 41 32.730 73.216 -8.880 1.00 0.00 C ATOM 620 CG2 ILE A 41 32.567 74.956 -10.689 1.00 0.00 C ATOM 621 CD1 ILE A 41 32.838 74.270 -7.803 1.00 0.00 C ATOM 0 H ILE A 41 34.203 71.360 -10.075 1.00 0.00 H new ATOM 0 HA ILE A 41 31.889 72.356 -11.328 1.00 0.00 H new ATOM 0 HB ILE A 41 34.309 73.835 -10.202 1.00 0.00 H new ATOM 0 HG12 ILE A 41 31.687 72.913 -8.970 1.00 0.00 H new ATOM 0 HG13 ILE A 41 33.291 72.336 -8.566 1.00 0.00 H new ATOM 0 HG21 ILE A 41 32.771 75.732 -9.951 1.00 0.00 H new ATOM 0 HG22 ILE A 41 32.961 75.264 -11.657 1.00 0.00 H new ATOM 0 HG23 ILE A 41 31.491 74.804 -10.767 1.00 0.00 H new ATOM 0 HD11 ILE A 41 32.457 73.870 -6.863 1.00 0.00 H new ATOM 0 HD12 ILE A 41 33.882 74.558 -7.679 1.00 0.00 H new ATOM 0 HD13 ILE A 41 32.253 75.144 -8.089 1.00 0.00 H new ATOM 633 N SER A 42 32.542 72.882 -13.634 1.00 0.00 N ATOM 634 CA SER A 42 32.855 73.248 -15.001 1.00 0.00 C ATOM 635 C SER A 42 32.417 74.684 -15.283 1.00 0.00 C ATOM 636 O SER A 42 33.106 75.435 -15.978 1.00 0.00 O ATOM 637 CB SER A 42 32.165 72.272 -15.952 1.00 0.00 C ATOM 638 OG SER A 42 32.374 70.933 -15.524 1.00 0.00 O ATOM 0 H SER A 42 31.586 72.555 -13.494 1.00 0.00 H new ATOM 0 HA SER A 42 33.933 73.193 -15.155 1.00 0.00 H new ATOM 0 HB2 SER A 42 31.097 72.486 -15.991 1.00 0.00 H new ATOM 0 HB3 SER A 42 32.553 72.403 -16.962 1.00 0.00 H new ATOM 0 HG SER A 42 31.925 70.318 -16.141 1.00 0.00 H new ATOM 644 N THR A 43 31.277 75.067 -14.723 1.00 0.00 N ATOM 645 CA THR A 43 30.742 76.405 -14.917 1.00 0.00 C ATOM 646 C THR A 43 30.476 77.074 -13.575 1.00 0.00 C ATOM 647 O THR A 43 30.246 76.400 -12.567 1.00 0.00 O ATOM 648 CB THR A 43 29.437 76.381 -15.744 1.00 0.00 C ATOM 649 OG1 THR A 43 28.463 75.548 -15.102 1.00 0.00 O ATOM 650 CG2 THR A 43 29.687 75.873 -17.155 1.00 0.00 C ATOM 0 H THR A 43 30.705 74.467 -14.129 1.00 0.00 H new ATOM 0 HA THR A 43 31.490 76.975 -15.468 1.00 0.00 H new ATOM 0 HB THR A 43 29.063 77.403 -15.806 1.00 0.00 H new ATOM 0 HG1 THR A 43 27.639 75.540 -15.632 1.00 0.00 H new ATOM 0 HG21 THR A 43 28.750 75.868 -17.711 1.00 0.00 H new ATOM 0 HG22 THR A 43 30.402 76.526 -17.655 1.00 0.00 H new ATOM 0 HG23 THR A 43 30.088 74.861 -17.111 1.00 0.00 H new ATOM 658 N GLU A 44 30.505 78.399 -13.561 1.00 0.00 N ATOM 659 CA GLU A 44 30.260 79.143 -12.345 1.00 0.00 C ATOM 660 C GLU A 44 28.802 78.989 -11.927 1.00 0.00 C ATOM 661 O GLU A 44 28.484 79.014 -10.742 1.00 0.00 O ATOM 662 CB GLU A 44 30.625 80.616 -12.538 1.00 0.00 C ATOM 663 CG GLU A 44 29.706 81.368 -13.484 1.00 0.00 C ATOM 664 CD GLU A 44 30.173 82.781 -13.743 1.00 0.00 C ATOM 665 OE1 GLU A 44 30.247 83.575 -12.781 1.00 0.00 O ATOM 666 OE2 GLU A 44 30.474 83.102 -14.911 1.00 0.00 O ATOM 0 H GLU A 44 30.696 78.976 -14.380 1.00 0.00 H new ATOM 0 HA GLU A 44 30.890 78.744 -11.550 1.00 0.00 H new ATOM 0 HB2 GLU A 44 30.612 81.112 -11.567 1.00 0.00 H new ATOM 0 HB3 GLU A 44 31.646 80.679 -12.915 1.00 0.00 H new ATOM 0 HG2 GLU A 44 29.645 80.830 -14.430 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.700 81.392 -13.065 1.00 0.00 H new ATOM 673 N ALA A 45 27.925 78.812 -12.912 1.00 0.00 N ATOM 674 CA ALA A 45 26.516 78.560 -12.644 1.00 0.00 C ATOM 675 C ALA A 45 26.354 77.269 -11.853 1.00 0.00 C ATOM 676 O ALA A 45 25.649 77.235 -10.847 1.00 0.00 O ATOM 677 CB ALA A 45 25.726 78.492 -13.943 1.00 0.00 C ATOM 0 H ALA A 45 28.168 78.839 -13.902 1.00 0.00 H new ATOM 0 HA ALA A 45 26.124 79.385 -12.050 1.00 0.00 H new ATOM 0 HB1 ALA A 45 24.676 78.303 -13.721 1.00 0.00 H new ATOM 0 HB2 ALA A 45 25.820 79.438 -14.476 1.00 0.00 H new ATOM 0 HB3 ALA A 45 26.116 77.686 -14.564 1.00 0.00 H new ATOM 683 N GLU A 46 27.036 76.221 -12.307 1.00 0.00 N ATOM 684 CA GLU A 46 27.032 74.932 -11.622 1.00 0.00 C ATOM 685 C GLU A 46 27.419 75.111 -10.154 1.00 0.00 C ATOM 686 O GLU A 46 26.748 74.600 -9.253 1.00 0.00 O ATOM 687 CB GLU A 46 28.002 73.977 -12.327 1.00 0.00 C ATOM 688 CG GLU A 46 28.065 72.584 -11.723 1.00 0.00 C ATOM 689 CD GLU A 46 28.936 71.640 -12.533 1.00 0.00 C ATOM 690 OE1 GLU A 46 30.045 72.049 -12.941 1.00 0.00 O ATOM 691 OE2 GLU A 46 28.515 70.478 -12.755 1.00 0.00 O ATOM 0 H GLU A 46 27.603 76.241 -13.154 1.00 0.00 H new ATOM 0 HA GLU A 46 26.029 74.506 -11.657 1.00 0.00 H new ATOM 0 HB2 GLU A 46 27.712 73.892 -13.374 1.00 0.00 H new ATOM 0 HB3 GLU A 46 29.001 74.413 -12.307 1.00 0.00 H new ATOM 0 HG2 GLU A 46 28.453 72.649 -10.706 1.00 0.00 H new ATOM 0 HG3 GLU A 46 27.057 72.175 -11.654 1.00 0.00 H new ATOM 698 N GLN A 47 28.491 75.863 -9.923 1.00 0.00 N ATOM 699 CA GLN A 47 28.928 76.181 -8.565 1.00 0.00 C ATOM 700 C GLN A 47 27.848 76.953 -7.804 1.00 0.00 C ATOM 701 O GLN A 47 27.441 76.556 -6.712 1.00 0.00 O ATOM 702 CB GLN A 47 30.209 77.014 -8.600 1.00 0.00 C ATOM 703 CG GLN A 47 30.665 77.477 -7.222 1.00 0.00 C ATOM 704 CD GLN A 47 31.675 78.605 -7.291 1.00 0.00 C ATOM 705 OE1 GLN A 47 31.659 79.405 -8.223 1.00 0.00 O ATOM 706 NE2 GLN A 47 32.547 78.688 -6.298 1.00 0.00 N ATOM 0 H GLN A 47 29.074 76.264 -10.658 1.00 0.00 H new ATOM 0 HA GLN A 47 29.117 75.239 -8.050 1.00 0.00 H new ATOM 0 HB2 GLN A 47 31.004 76.426 -9.060 1.00 0.00 H new ATOM 0 HB3 GLN A 47 30.050 77.886 -9.234 1.00 0.00 H new ATOM 0 HG2 GLN A 47 29.798 77.805 -6.648 1.00 0.00 H new ATOM 0 HG3 GLN A 47 31.103 76.635 -6.686 1.00 0.00 H new ATOM 0 HE21 GLN A 47 32.526 78.003 -5.543 1.00 0.00 H new ATOM 0 HE22 GLN A 47 33.239 79.437 -6.288 1.00 0.00 H new ATOM 715 N ASN A 48 27.387 78.050 -8.399 1.00 0.00 N ATOM 716 CA ASN A 48 26.436 78.956 -7.753 1.00 0.00 C ATOM 717 C ASN A 48 25.149 78.251 -7.341 1.00 0.00 C ATOM 718 O ASN A 48 24.523 78.625 -6.351 1.00 0.00 O ATOM 719 CB ASN A 48 26.107 80.140 -8.670 1.00 0.00 C ATOM 720 CG ASN A 48 27.099 81.288 -8.536 1.00 0.00 C ATOM 721 OD1 ASN A 48 26.906 82.195 -7.726 1.00 0.00 O ATOM 722 ND2 ASN A 48 28.164 81.261 -9.323 1.00 0.00 N ATOM 0 H ASN A 48 27.660 78.337 -9.339 1.00 0.00 H new ATOM 0 HA ASN A 48 26.919 79.321 -6.846 1.00 0.00 H new ATOM 0 HB2 ASN A 48 26.092 79.798 -9.705 1.00 0.00 H new ATOM 0 HB3 ASN A 48 25.105 80.503 -8.440 1.00 0.00 H new ATOM 0 HD21 ASN A 48 28.857 82.008 -9.269 1.00 0.00 H new ATOM 0 HD22 ASN A 48 28.291 80.493 -9.983 1.00 0.00 H new ATOM 729 N PHE A 49 24.756 77.233 -8.090 1.00 0.00 N ATOM 730 CA PHE A 49 23.532 76.508 -7.784 1.00 0.00 C ATOM 731 C PHE A 49 23.747 75.451 -6.703 1.00 0.00 C ATOM 732 O PHE A 49 22.896 75.280 -5.831 1.00 0.00 O ATOM 733 CB PHE A 49 22.942 75.872 -9.043 1.00 0.00 C ATOM 734 CG PHE A 49 22.129 76.829 -9.870 1.00 0.00 C ATOM 735 CD1 PHE A 49 20.790 77.048 -9.580 1.00 0.00 C ATOM 736 CD2 PHE A 49 22.697 77.509 -10.935 1.00 0.00 C ATOM 737 CE1 PHE A 49 20.037 77.927 -10.337 1.00 0.00 C ATOM 738 CE2 PHE A 49 21.949 78.387 -11.695 1.00 0.00 C ATOM 739 CZ PHE A 49 20.617 78.595 -11.396 1.00 0.00 C ATOM 0 H PHE A 49 25.261 76.892 -8.908 1.00 0.00 H new ATOM 0 HA PHE A 49 22.820 77.236 -7.395 1.00 0.00 H new ATOM 0 HB2 PHE A 49 23.752 75.473 -9.654 1.00 0.00 H new ATOM 0 HB3 PHE A 49 22.315 75.028 -8.755 1.00 0.00 H new ATOM 0 HD1 PHE A 49 20.330 76.526 -8.754 1.00 0.00 H new ATOM 0 HD2 PHE A 49 23.738 77.351 -11.174 1.00 0.00 H new ATOM 0 HE1 PHE A 49 18.996 78.090 -10.100 1.00 0.00 H new ATOM 0 HE2 PHE A 49 22.405 78.910 -12.522 1.00 0.00 H new ATOM 0 HZ PHE A 49 20.030 79.280 -11.990 1.00 0.00 H new ATOM 749 N ILE A 50 24.882 74.754 -6.735 1.00 0.00 N ATOM 750 CA ILE A 50 25.115 73.668 -5.784 1.00 0.00 C ATOM 751 C ILE A 50 25.405 74.209 -4.379 1.00 0.00 C ATOM 752 O ILE A 50 25.020 73.599 -3.376 1.00 0.00 O ATOM 753 CB ILE A 50 26.259 72.722 -6.239 1.00 0.00 C ATOM 754 CG1 ILE A 50 26.310 71.478 -5.347 1.00 0.00 C ATOM 755 CG2 ILE A 50 27.604 73.433 -6.229 1.00 0.00 C ATOM 756 CD1 ILE A 50 25.051 70.638 -5.399 1.00 0.00 C ATOM 0 H ILE A 50 25.642 74.917 -7.396 1.00 0.00 H new ATOM 0 HA ILE A 50 24.195 73.084 -5.752 1.00 0.00 H new ATOM 0 HB ILE A 50 26.049 72.415 -7.264 1.00 0.00 H new ATOM 0 HG12 ILE A 50 27.159 70.863 -5.645 1.00 0.00 H new ATOM 0 HG13 ILE A 50 26.487 71.788 -4.317 1.00 0.00 H new ATOM 0 HG21 ILE A 50 28.383 72.743 -6.553 1.00 0.00 H new ATOM 0 HG22 ILE A 50 27.570 74.285 -6.907 1.00 0.00 H new ATOM 0 HG23 ILE A 50 27.824 73.781 -5.220 1.00 0.00 H new ATOM 0 HD11 ILE A 50 25.162 69.775 -4.742 1.00 0.00 H new ATOM 0 HD12 ILE A 50 24.201 71.236 -5.072 1.00 0.00 H new ATOM 0 HD13 ILE A 50 24.883 70.297 -6.421 1.00 0.00 H new ATOM 768 N ILE A 51 26.040 75.377 -4.304 1.00 0.00 N ATOM 769 CA ILE A 51 26.380 75.981 -3.016 1.00 0.00 C ATOM 770 C ILE A 51 25.127 76.456 -2.279 1.00 0.00 C ATOM 771 O ILE A 51 25.183 76.837 -1.112 1.00 0.00 O ATOM 772 CB ILE A 51 27.360 77.162 -3.173 1.00 0.00 C ATOM 773 CG1 ILE A 51 26.754 78.253 -4.063 1.00 0.00 C ATOM 774 CG2 ILE A 51 28.684 76.669 -3.743 1.00 0.00 C ATOM 775 CD1 ILE A 51 27.633 79.477 -4.222 1.00 0.00 C ATOM 0 H ILE A 51 26.329 75.923 -5.116 1.00 0.00 H new ATOM 0 HA ILE A 51 26.868 75.203 -2.429 1.00 0.00 H new ATOM 0 HB ILE A 51 27.546 77.597 -2.191 1.00 0.00 H new ATOM 0 HG12 ILE A 51 26.552 77.833 -5.048 1.00 0.00 H new ATOM 0 HG13 ILE A 51 25.795 78.559 -3.644 1.00 0.00 H new ATOM 0 HG21 ILE A 51 29.369 77.510 -3.850 1.00 0.00 H new ATOM 0 HG22 ILE A 51 29.118 75.931 -3.069 1.00 0.00 H new ATOM 0 HG23 ILE A 51 28.513 76.213 -4.718 1.00 0.00 H new ATOM 0 HD11 ILE A 51 27.134 80.202 -4.865 1.00 0.00 H new ATOM 0 HD12 ILE A 51 27.815 79.924 -3.245 1.00 0.00 H new ATOM 0 HD13 ILE A 51 28.583 79.187 -4.671 1.00 0.00 H new ATOM 787 N GLN A 52 23.999 76.424 -2.976 1.00 0.00 N ATOM 788 CA GLN A 52 22.718 76.768 -2.381 1.00 0.00 C ATOM 789 C GLN A 52 22.193 75.600 -1.551 1.00 0.00 C ATOM 790 O GLN A 52 21.447 75.790 -0.591 1.00 0.00 O ATOM 791 CB GLN A 52 21.710 77.125 -3.475 1.00 0.00 C ATOM 792 CG GLN A 52 22.117 78.332 -4.312 1.00 0.00 C ATOM 793 CD GLN A 52 21.204 78.569 -5.501 1.00 0.00 C ATOM 794 OE1 GLN A 52 20.999 79.705 -5.924 1.00 0.00 O ATOM 795 NE2 GLN A 52 20.664 77.501 -6.066 1.00 0.00 N ATOM 0 H GLN A 52 23.947 76.161 -3.960 1.00 0.00 H new ATOM 0 HA GLN A 52 22.855 77.631 -1.729 1.00 0.00 H new ATOM 0 HB2 GLN A 52 21.581 76.265 -4.132 1.00 0.00 H new ATOM 0 HB3 GLN A 52 20.742 77.323 -3.015 1.00 0.00 H new ATOM 0 HG2 GLN A 52 22.119 79.220 -3.680 1.00 0.00 H new ATOM 0 HG3 GLN A 52 23.138 78.192 -4.668 1.00 0.00 H new ATOM 0 HE21 GLN A 52 20.855 76.573 -5.689 1.00 0.00 H new ATOM 0 HE22 GLN A 52 20.056 77.606 -6.879 1.00 0.00 H new ATOM 804 N PHE A 53 22.596 74.391 -1.929 1.00 0.00 N ATOM 805 CA PHE A 53 22.161 73.182 -1.241 1.00 0.00 C ATOM 806 C PHE A 53 23.137 72.810 -0.131 1.00 0.00 C ATOM 807 O PHE A 53 22.763 72.169 0.850 1.00 0.00 O ATOM 808 CB PHE A 53 22.053 72.014 -2.225 1.00 0.00 C ATOM 809 CG PHE A 53 21.081 72.236 -3.348 1.00 0.00 C ATOM 810 CD1 PHE A 53 19.724 72.038 -3.155 1.00 0.00 C ATOM 811 CD2 PHE A 53 21.529 72.629 -4.598 1.00 0.00 C ATOM 812 CE1 PHE A 53 18.830 72.230 -4.191 1.00 0.00 C ATOM 813 CE2 PHE A 53 20.640 72.824 -5.637 1.00 0.00 C ATOM 814 CZ PHE A 53 19.288 72.623 -5.432 1.00 0.00 C ATOM 0 H PHE A 53 23.227 74.223 -2.713 1.00 0.00 H new ATOM 0 HA PHE A 53 21.182 73.382 -0.805 1.00 0.00 H new ATOM 0 HB2 PHE A 53 23.039 71.818 -2.647 1.00 0.00 H new ATOM 0 HB3 PHE A 53 21.758 71.119 -1.677 1.00 0.00 H new ATOM 0 HD1 PHE A 53 19.361 71.731 -2.185 1.00 0.00 H new ATOM 0 HD2 PHE A 53 22.585 72.785 -4.762 1.00 0.00 H new ATOM 0 HE1 PHE A 53 17.774 72.073 -4.030 1.00 0.00 H new ATOM 0 HE2 PHE A 53 21.000 73.133 -6.607 1.00 0.00 H new ATOM 0 HZ PHE A 53 18.590 72.773 -6.243 1.00 0.00 H new ATOM 824 N LEU A 54 24.391 73.201 -0.310 1.00 0.00 N ATOM 825 CA LEU A 54 25.446 72.868 0.640 1.00 0.00 C ATOM 826 C LEU A 54 25.264 73.603 1.964 1.00 0.00 C ATOM 827 O LEU A 54 24.984 74.803 1.983 1.00 0.00 O ATOM 828 CB LEU A 54 26.812 73.222 0.050 1.00 0.00 C ATOM 829 CG LEU A 54 27.135 72.581 -1.299 1.00 0.00 C ATOM 830 CD1 LEU A 54 28.497 73.042 -1.787 1.00 0.00 C ATOM 831 CD2 LEU A 54 27.090 71.065 -1.191 1.00 0.00 C ATOM 0 H LEU A 54 24.705 73.752 -1.109 1.00 0.00 H new ATOM 0 HA LEU A 54 25.389 71.797 0.832 1.00 0.00 H new ATOM 0 HB2 LEU A 54 26.871 74.305 -0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 54 27.583 72.931 0.764 1.00 0.00 H new ATOM 0 HG LEU A 54 26.384 72.895 -2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 54 28.715 72.578 -2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 54 28.495 74.126 -1.899 1.00 0.00 H new ATOM 0 HD13 LEU A 54 29.260 72.753 -1.064 1.00 0.00 H new ATOM 0 HD21 LEU A 54 27.322 70.624 -2.160 1.00 0.00 H new ATOM 0 HD22 LEU A 54 27.822 70.731 -0.456 1.00 0.00 H new ATOM 0 HD23 LEU A 54 26.094 70.752 -0.879 1.00 0.00 H new ATOM 843 N ASP A 55 25.412 72.873 3.068 1.00 0.00 N ATOM 844 CA ASP A 55 25.447 73.493 4.390 1.00 0.00 C ATOM 845 C ASP A 55 26.634 74.440 4.461 1.00 0.00 C ATOM 846 O ASP A 55 27.764 74.053 4.161 1.00 0.00 O ATOM 847 CB ASP A 55 25.556 72.444 5.498 1.00 0.00 C ATOM 848 CG ASP A 55 25.531 73.068 6.883 1.00 0.00 C ATOM 849 OD1 ASP A 55 26.584 73.550 7.341 1.00 0.00 O ATOM 850 OD2 ASP A 55 24.453 73.083 7.517 1.00 0.00 O ATOM 0 H ASP A 55 25.509 71.858 3.073 1.00 0.00 H new ATOM 0 HA ASP A 55 24.517 74.040 4.541 1.00 0.00 H new ATOM 0 HB2 ASP A 55 24.734 71.734 5.406 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.480 71.880 5.372 1.00 0.00 H new ATOM 855 N ARG A 56 26.380 75.666 4.876 1.00 0.00 N ATOM 856 CA ARG A 56 27.363 76.732 4.766 1.00 0.00 C ATOM 857 C ARG A 56 28.323 76.754 5.952 1.00 0.00 C ATOM 858 O ARG A 56 28.803 77.813 6.351 1.00 0.00 O ATOM 859 CB ARG A 56 26.643 78.069 4.625 1.00 0.00 C ATOM 860 CG ARG A 56 25.633 78.070 3.491 1.00 0.00 C ATOM 861 CD ARG A 56 25.028 79.442 3.265 1.00 0.00 C ATOM 862 NE ARG A 56 24.002 79.407 2.223 1.00 0.00 N ATOM 863 CZ ARG A 56 23.738 80.413 1.395 1.00 0.00 C ATOM 864 NH1 ARG A 56 24.419 81.546 1.478 1.00 0.00 N ATOM 865 NH2 ARG A 56 22.783 80.275 0.484 1.00 0.00 N ATOM 0 H ARG A 56 25.495 75.952 5.296 1.00 0.00 H new ATOM 0 HA ARG A 56 27.969 76.548 3.879 1.00 0.00 H new ATOM 0 HB2 ARG A 56 26.135 78.304 5.560 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.377 78.857 4.454 1.00 0.00 H new ATOM 0 HG2 ARG A 56 26.118 77.733 2.575 1.00 0.00 H new ATOM 0 HG3 ARG A 56 24.839 77.357 3.713 1.00 0.00 H new ATOM 0 HD2 ARG A 56 24.592 79.807 4.195 1.00 0.00 H new ATOM 0 HD3 ARG A 56 25.812 80.145 2.983 1.00 0.00 H new ATOM 0 HE ARG A 56 23.452 78.553 2.125 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.151 81.651 2.180 1.00 0.00 H new ATOM 0 HH12 ARG A 56 24.211 82.314 0.840 1.00 0.00 H new ATOM 0 HH21 ARG A 56 22.258 79.402 0.423 1.00 0.00 H new ATOM 0 HH22 ARG A 56 22.574 81.042 -0.155 1.00 0.00 H new ATOM 879 N ARG A 57 28.607 75.585 6.506 1.00 0.00 N ATOM 880 CA ARG A 57 29.601 75.470 7.564 1.00 0.00 C ATOM 881 C ARG A 57 30.640 74.403 7.210 1.00 0.00 C ATOM 882 O ARG A 57 31.775 74.446 7.692 1.00 0.00 O ATOM 883 CB ARG A 57 28.919 75.142 8.902 1.00 0.00 C ATOM 884 CG ARG A 57 29.189 73.734 9.416 1.00 0.00 C ATOM 885 CD ARG A 57 28.220 73.353 10.518 1.00 0.00 C ATOM 886 NE ARG A 57 26.846 73.294 10.028 1.00 0.00 N ATOM 887 CZ ARG A 57 25.789 73.066 10.802 1.00 0.00 C ATOM 888 NH1 ARG A 57 25.946 72.852 12.107 1.00 0.00 N ATOM 889 NH2 ARG A 57 24.576 73.034 10.267 1.00 0.00 N ATOM 0 H ARG A 57 28.165 74.704 6.242 1.00 0.00 H new ATOM 0 HA ARG A 57 30.115 76.426 7.664 1.00 0.00 H new ATOM 0 HB2 ARG A 57 29.252 75.860 9.652 1.00 0.00 H new ATOM 0 HB3 ARG A 57 27.843 75.275 8.790 1.00 0.00 H new ATOM 0 HG2 ARG A 57 29.106 73.023 8.594 1.00 0.00 H new ATOM 0 HG3 ARG A 57 30.211 73.671 9.790 1.00 0.00 H new ATOM 0 HD2 ARG A 57 28.501 72.385 10.932 1.00 0.00 H new ATOM 0 HD3 ARG A 57 28.287 74.078 11.329 1.00 0.00 H new ATOM 0 HE ARG A 57 26.687 73.436 9.031 1.00 0.00 H new ATOM 0 HH11 ARG A 57 26.880 72.863 12.517 1.00 0.00 H new ATOM 0 HH12 ARG A 57 25.132 72.678 12.697 1.00 0.00 H new ATOM 0 HH21 ARG A 57 24.456 73.184 9.265 1.00 0.00 H new ATOM 0 HH22 ARG A 57 23.763 72.859 10.857 1.00 0.00 H new ATOM 903 N LEU A 58 30.255 73.452 6.359 1.00 0.00 N ATOM 904 CA LEU A 58 31.141 72.345 6.008 1.00 0.00 C ATOM 905 C LEU A 58 32.068 72.698 4.850 1.00 0.00 C ATOM 906 O LEU A 58 31.834 73.659 4.112 1.00 0.00 O ATOM 907 CB LEU A 58 30.345 71.084 5.643 1.00 0.00 C ATOM 908 CG LEU A 58 29.734 70.298 6.814 1.00 0.00 C ATOM 909 CD1 LEU A 58 30.743 70.132 7.943 1.00 0.00 C ATOM 910 CD2 LEU A 58 28.456 70.954 7.311 1.00 0.00 C ATOM 0 H LEU A 58 29.343 73.426 5.904 1.00 0.00 H new ATOM 0 HA LEU A 58 31.746 72.149 6.893 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.539 71.372 4.968 1.00 0.00 H new ATOM 0 HB3 LEU A 58 31.002 70.414 5.088 1.00 0.00 H new ATOM 0 HG LEU A 58 29.473 69.305 6.449 1.00 0.00 H new ATOM 0 HD11 LEU A 58 30.287 69.573 8.760 1.00 0.00 H new ATOM 0 HD12 LEU A 58 31.615 69.591 7.575 1.00 0.00 H new ATOM 0 HD13 LEU A 58 31.051 71.114 8.303 1.00 0.00 H new ATOM 0 HD21 LEU A 58 28.048 70.375 8.139 1.00 0.00 H new ATOM 0 HD22 LEU A 58 28.675 71.967 7.650 1.00 0.00 H new ATOM 0 HD23 LEU A 58 27.728 70.992 6.501 1.00 0.00 H new ATOM 922 N SER A 59 33.126 71.912 4.712 1.00 0.00 N ATOM 923 CA SER A 59 34.056 72.034 3.604 1.00 0.00 C ATOM 924 C SER A 59 33.955 70.801 2.705 1.00 0.00 C ATOM 925 O SER A 59 34.302 69.695 3.121 1.00 0.00 O ATOM 926 CB SER A 59 35.477 72.192 4.150 1.00 0.00 C ATOM 927 OG SER A 59 35.702 71.305 5.235 1.00 0.00 O ATOM 0 H SER A 59 33.363 71.169 5.370 1.00 0.00 H new ATOM 0 HA SER A 59 33.808 72.913 3.009 1.00 0.00 H new ATOM 0 HB2 SER A 59 36.200 71.995 3.358 1.00 0.00 H new ATOM 0 HB3 SER A 59 35.634 73.220 4.476 1.00 0.00 H new ATOM 0 HG SER A 59 36.616 71.421 5.568 1.00 0.00 H new ATOM 933 N TYR A 60 33.467 70.985 1.486 1.00 0.00 N ATOM 934 CA TYR A 60 33.200 69.861 0.591 1.00 0.00 C ATOM 935 C TYR A 60 34.321 69.669 -0.420 1.00 0.00 C ATOM 936 O TYR A 60 34.616 70.567 -1.203 1.00 0.00 O ATOM 937 CB TYR A 60 31.882 70.080 -0.153 1.00 0.00 C ATOM 938 CG TYR A 60 30.692 70.257 0.760 1.00 0.00 C ATOM 939 CD1 TYR A 60 30.435 71.485 1.356 1.00 0.00 C ATOM 940 CD2 TYR A 60 29.832 69.199 1.033 1.00 0.00 C ATOM 941 CE1 TYR A 60 29.356 71.659 2.195 1.00 0.00 C ATOM 942 CE2 TYR A 60 28.748 69.367 1.876 1.00 0.00 C ATOM 943 CZ TYR A 60 28.517 70.600 2.454 1.00 0.00 C ATOM 944 OH TYR A 60 27.451 70.778 3.301 1.00 0.00 O ATOM 0 H TYR A 60 33.247 71.900 1.092 1.00 0.00 H new ATOM 0 HA TYR A 60 33.134 68.963 1.206 1.00 0.00 H new ATOM 0 HB2 TYR A 60 31.976 70.961 -0.788 1.00 0.00 H new ATOM 0 HB3 TYR A 60 31.701 69.230 -0.811 1.00 0.00 H new ATOM 0 HD1 TYR A 60 31.093 72.318 1.158 1.00 0.00 H new ATOM 0 HD2 TYR A 60 30.012 68.235 0.582 1.00 0.00 H new ATOM 0 HE1 TYR A 60 29.170 72.622 2.647 1.00 0.00 H new ATOM 0 HE2 TYR A 60 28.086 68.539 2.081 1.00 0.00 H new ATOM 0 HH TYR A 60 26.953 69.938 3.381 1.00 0.00 H new ATOM 954 N PHE A 61 34.934 68.490 -0.401 1.00 0.00 N ATOM 955 CA PHE A 61 35.987 68.151 -1.350 1.00 0.00 C ATOM 956 C PHE A 61 35.496 68.229 -2.788 1.00 0.00 C ATOM 957 O PHE A 61 34.461 67.655 -3.140 1.00 0.00 O ATOM 958 CB PHE A 61 36.533 66.749 -1.083 1.00 0.00 C ATOM 959 CG PHE A 61 37.591 66.701 -0.021 1.00 0.00 C ATOM 960 CD1 PHE A 61 38.845 67.242 -0.256 1.00 0.00 C ATOM 961 CD2 PHE A 61 37.340 66.111 1.204 1.00 0.00 C ATOM 962 CE1 PHE A 61 39.827 67.199 0.711 1.00 0.00 C ATOM 963 CE2 PHE A 61 38.320 66.063 2.175 1.00 0.00 C ATOM 964 CZ PHE A 61 39.566 66.609 1.928 1.00 0.00 C ATOM 0 H PHE A 61 34.717 67.749 0.266 1.00 0.00 H new ATOM 0 HA PHE A 61 36.782 68.884 -1.212 1.00 0.00 H new ATOM 0 HB2 PHE A 61 35.709 66.098 -0.791 1.00 0.00 H new ATOM 0 HB3 PHE A 61 36.943 66.347 -2.009 1.00 0.00 H new ATOM 0 HD1 PHE A 61 39.056 67.704 -1.209 1.00 0.00 H new ATOM 0 HD2 PHE A 61 36.368 65.684 1.403 1.00 0.00 H new ATOM 0 HE1 PHE A 61 40.799 67.627 0.515 1.00 0.00 H new ATOM 0 HE2 PHE A 61 38.113 65.599 3.128 1.00 0.00 H new ATOM 0 HZ PHE A 61 40.333 66.573 2.688 1.00 0.00 H new ATOM 974 N LEU A 62 36.246 68.946 -3.605 1.00 0.00 N ATOM 975 CA LEU A 62 35.986 69.011 -5.030 1.00 0.00 C ATOM 976 C LEU A 62 36.988 68.141 -5.759 1.00 0.00 C ATOM 977 O LEU A 62 38.074 67.878 -5.245 1.00 0.00 O ATOM 978 CB LEU A 62 36.088 70.446 -5.540 1.00 0.00 C ATOM 979 CG LEU A 62 35.073 71.420 -4.952 1.00 0.00 C ATOM 980 CD1 LEU A 62 35.322 72.817 -5.489 1.00 0.00 C ATOM 981 CD2 LEU A 62 33.656 70.965 -5.272 1.00 0.00 C ATOM 0 H LEU A 62 37.049 69.497 -3.301 1.00 0.00 H new ATOM 0 HA LEU A 62 34.973 68.653 -5.216 1.00 0.00 H new ATOM 0 HB2 LEU A 62 37.090 70.819 -5.328 1.00 0.00 H new ATOM 0 HB3 LEU A 62 35.974 70.438 -6.624 1.00 0.00 H new ATOM 0 HG LEU A 62 35.188 71.439 -3.868 1.00 0.00 H new ATOM 0 HD11 LEU A 62 34.592 73.506 -5.063 1.00 0.00 H new ATOM 0 HD12 LEU A 62 36.327 73.138 -5.215 1.00 0.00 H new ATOM 0 HD13 LEU A 62 35.226 72.812 -6.575 1.00 0.00 H new ATOM 0 HD21 LEU A 62 32.942 71.670 -4.846 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.523 70.923 -6.353 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.487 69.976 -4.847 1.00 0.00 H new ATOM 993 N GLY A 63 36.648 67.713 -6.961 1.00 0.00 N ATOM 994 CA GLY A 63 37.514 66.814 -7.694 1.00 0.00 C ATOM 995 C GLY A 63 38.684 67.515 -8.358 1.00 0.00 C ATOM 996 O GLY A 63 39.052 67.168 -9.471 1.00 0.00 O ATOM 0 H GLY A 63 35.788 67.971 -7.444 1.00 0.00 H new ATOM 0 HA2 GLY A 63 37.895 66.052 -7.014 1.00 0.00 H new ATOM 0 HA3 GLY A 63 36.929 66.298 -8.455 1.00 0.00 H new ATOM 1000 N LEU A 64 39.277 68.490 -7.680 1.00 0.00 N ATOM 1001 CA LEU A 64 40.414 69.222 -8.231 1.00 0.00 C ATOM 1002 C LEU A 64 41.696 68.764 -7.549 1.00 0.00 C ATOM 1003 O LEU A 64 41.862 68.949 -6.347 1.00 0.00 O ATOM 1004 CB LEU A 64 40.228 70.732 -8.048 1.00 0.00 C ATOM 1005 CG LEU A 64 41.252 71.611 -8.775 1.00 0.00 C ATOM 1006 CD1 LEU A 64 41.156 71.409 -10.278 1.00 0.00 C ATOM 1007 CD2 LEU A 64 41.045 73.076 -8.428 1.00 0.00 C ATOM 0 H LEU A 64 38.991 68.793 -6.749 1.00 0.00 H new ATOM 0 HA LEU A 64 40.480 69.015 -9.299 1.00 0.00 H new ATOM 0 HB2 LEU A 64 39.230 71.003 -8.394 1.00 0.00 H new ATOM 0 HB3 LEU A 64 40.269 70.960 -6.983 1.00 0.00 H new ATOM 0 HG LEU A 64 42.248 71.315 -8.446 1.00 0.00 H new ATOM 0 HD11 LEU A 64 41.890 72.041 -10.778 1.00 0.00 H new ATOM 0 HD12 LEU A 64 41.353 70.364 -10.518 1.00 0.00 H new ATOM 0 HD13 LEU A 64 40.156 71.677 -10.618 1.00 0.00 H new ATOM 0 HD21 LEU A 64 41.782 73.682 -8.954 1.00 0.00 H new ATOM 0 HD22 LEU A 64 40.043 73.383 -8.727 1.00 0.00 H new ATOM 0 HD23 LEU A 64 41.162 73.215 -7.353 1.00 0.00 H new ATOM 1019 N ARG A 65 42.595 68.171 -8.321 1.00 0.00 N ATOM 1020 CA ARG A 65 43.793 67.551 -7.770 1.00 0.00 C ATOM 1021 C ARG A 65 45.066 68.260 -8.224 1.00 0.00 C ATOM 1022 O ARG A 65 45.274 68.475 -9.419 1.00 0.00 O ATOM 1023 CB ARG A 65 43.847 66.085 -8.209 1.00 0.00 C ATOM 1024 CG ARG A 65 45.081 65.326 -7.734 1.00 0.00 C ATOM 1025 CD ARG A 65 45.164 63.957 -8.397 1.00 0.00 C ATOM 1026 NE ARG A 65 46.272 63.149 -7.888 1.00 0.00 N ATOM 1027 CZ ARG A 65 46.181 62.329 -6.842 1.00 0.00 C ATOM 1028 NH1 ARG A 65 45.049 62.235 -6.156 1.00 0.00 N ATOM 1029 NH2 ARG A 65 47.226 61.600 -6.481 1.00 0.00 N ATOM 0 H ARG A 65 42.517 68.106 -9.336 1.00 0.00 H new ATOM 0 HA ARG A 65 43.740 67.627 -6.684 1.00 0.00 H new ATOM 0 HB2 ARG A 65 42.958 65.575 -7.838 1.00 0.00 H new ATOM 0 HB3 ARG A 65 43.808 66.044 -9.297 1.00 0.00 H new ATOM 0 HG2 ARG A 65 45.978 65.901 -7.964 1.00 0.00 H new ATOM 0 HG3 ARG A 65 45.047 65.209 -6.651 1.00 0.00 H new ATOM 0 HD2 ARG A 65 44.227 63.423 -8.237 1.00 0.00 H new ATOM 0 HD3 ARG A 65 45.278 64.086 -9.473 1.00 0.00 H new ATOM 0 HE ARG A 65 47.171 63.218 -8.364 1.00 0.00 H new ATOM 0 HH11 ARG A 65 44.240 62.793 -6.428 1.00 0.00 H new ATOM 0 HH12 ARG A 65 44.988 61.605 -5.356 1.00 0.00 H new ATOM 0 HH21 ARG A 65 48.099 61.667 -7.004 1.00 0.00 H new ATOM 0 HH22 ARG A 65 47.157 60.972 -5.680 1.00 0.00 H new ATOM 1043 N ASP A 66 45.901 68.627 -7.258 1.00 0.00 N ATOM 1044 CA ASP A 66 47.268 69.060 -7.530 1.00 0.00 C ATOM 1045 C ASP A 66 48.220 68.169 -6.750 1.00 0.00 C ATOM 1046 O ASP A 66 48.305 68.250 -5.527 1.00 0.00 O ATOM 1047 CB ASP A 66 47.489 70.528 -7.154 1.00 0.00 C ATOM 1048 CG ASP A 66 48.946 70.952 -7.287 1.00 0.00 C ATOM 1049 OD1 ASP A 66 49.585 70.609 -8.309 1.00 0.00 O ATOM 1050 OD2 ASP A 66 49.456 71.641 -6.375 1.00 0.00 O ATOM 0 H ASP A 66 45.652 68.633 -6.269 1.00 0.00 H new ATOM 0 HA ASP A 66 47.456 68.975 -8.600 1.00 0.00 H new ATOM 0 HB2 ASP A 66 46.871 71.160 -7.791 1.00 0.00 H new ATOM 0 HB3 ASP A 66 47.159 70.690 -6.128 1.00 0.00 H new ATOM 1055 N GLU A 67 48.912 67.294 -7.459 1.00 0.00 N ATOM 1056 CA GLU A 67 49.730 66.279 -6.817 1.00 0.00 C ATOM 1057 C GLU A 67 51.199 66.673 -6.794 1.00 0.00 C ATOM 1058 O GLU A 67 51.815 66.837 -7.844 1.00 0.00 O ATOM 1059 CB GLU A 67 49.577 64.950 -7.544 1.00 0.00 C ATOM 1060 CG GLU A 67 50.432 63.843 -6.960 1.00 0.00 C ATOM 1061 CD GLU A 67 50.426 62.608 -7.824 1.00 0.00 C ATOM 1062 OE1 GLU A 67 51.133 62.603 -8.854 1.00 0.00 O ATOM 1063 OE2 GLU A 67 49.705 61.654 -7.488 1.00 0.00 O ATOM 0 H GLU A 67 48.924 67.266 -8.479 1.00 0.00 H new ATOM 0 HA GLU A 67 49.386 66.183 -5.787 1.00 0.00 H new ATOM 0 HB2 GLU A 67 48.531 64.646 -7.513 1.00 0.00 H new ATOM 0 HB3 GLU A 67 49.839 65.086 -8.593 1.00 0.00 H new ATOM 0 HG2 GLU A 67 51.456 64.199 -6.844 1.00 0.00 H new ATOM 0 HG3 GLU A 67 50.067 63.590 -5.964 1.00 0.00 H new ATOM 1070 N ASN A 68 51.750 66.805 -5.592 1.00 0.00 N ATOM 1071 CA ASN A 68 53.172 67.092 -5.397 1.00 0.00 C ATOM 1072 C ASN A 68 53.496 68.504 -5.856 1.00 0.00 C ATOM 1073 O ASN A 68 54.654 68.826 -6.121 1.00 0.00 O ATOM 1074 CB ASN A 68 54.043 66.077 -6.149 1.00 0.00 C ATOM 1075 CG ASN A 68 53.841 64.649 -5.667 1.00 0.00 C ATOM 1076 OD1 ASN A 68 53.822 63.715 -6.468 1.00 0.00 O ATOM 1077 ND2 ASN A 68 53.714 64.463 -4.362 1.00 0.00 N ATOM 0 H ASN A 68 51.225 66.716 -4.722 1.00 0.00 H new ATOM 0 HA ASN A 68 53.391 67.010 -4.332 1.00 0.00 H new ATOM 0 HB2 ASN A 68 53.817 66.131 -7.214 1.00 0.00 H new ATOM 0 HB3 ASN A 68 55.092 66.349 -6.032 1.00 0.00 H new ATOM 0 HD21 ASN A 68 53.596 63.521 -3.990 1.00 0.00 H new ATOM 0 HD22 ASN A 68 53.735 65.262 -3.729 1.00 0.00 H new ATOM 1084 N ALA A 69 52.463 69.343 -5.910 1.00 0.00 N ATOM 1085 CA ALA A 69 52.589 70.710 -6.395 1.00 0.00 C ATOM 1086 C ALA A 69 53.128 70.728 -7.822 1.00 0.00 C ATOM 1087 O ALA A 69 54.277 71.099 -8.069 1.00 0.00 O ATOM 1088 CB ALA A 69 53.461 71.545 -5.467 1.00 0.00 C ATOM 0 H ALA A 69 51.518 69.092 -5.619 1.00 0.00 H new ATOM 0 HA ALA A 69 51.595 71.158 -6.403 1.00 0.00 H new ATOM 0 HB1 ALA A 69 53.537 72.561 -5.855 1.00 0.00 H new ATOM 0 HB2 ALA A 69 53.015 71.569 -4.473 1.00 0.00 H new ATOM 0 HB3 ALA A 69 54.456 71.104 -5.408 1.00 0.00 H new ATOM 1094 N LYS A 70 52.298 70.284 -8.753 1.00 0.00 N ATOM 1095 CA LYS A 70 52.656 70.271 -10.161 1.00 0.00 C ATOM 1096 C LYS A 70 52.213 71.562 -10.819 1.00 0.00 C ATOM 1097 O LYS A 70 52.662 71.904 -11.914 1.00 0.00 O ATOM 1098 CB LYS A 70 52.008 69.080 -10.876 1.00 0.00 C ATOM 1099 CG LYS A 70 52.603 67.738 -10.490 1.00 0.00 C ATOM 1100 CD LYS A 70 51.934 66.589 -11.232 1.00 0.00 C ATOM 1101 CE LYS A 70 52.692 65.280 -11.038 1.00 0.00 C ATOM 1102 NZ LYS A 70 52.643 64.797 -9.629 1.00 0.00 N ATOM 0 H LYS A 70 51.364 69.925 -8.555 1.00 0.00 H new ATOM 0 HA LYS A 70 53.739 70.176 -10.238 1.00 0.00 H new ATOM 0 HB2 LYS A 70 50.941 69.071 -10.654 1.00 0.00 H new ATOM 0 HB3 LYS A 70 52.109 69.216 -11.953 1.00 0.00 H new ATOM 0 HG2 LYS A 70 53.671 67.738 -10.707 1.00 0.00 H new ATOM 0 HG3 LYS A 70 52.496 67.588 -9.416 1.00 0.00 H new ATOM 0 HD2 LYS A 70 50.910 66.473 -10.878 1.00 0.00 H new ATOM 0 HD3 LYS A 70 51.879 66.824 -12.295 1.00 0.00 H new ATOM 0 HE2 LYS A 70 52.271 64.519 -11.695 1.00 0.00 H new ATOM 0 HE3 LYS A 70 53.731 65.418 -11.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 53.610 64.617 -9.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 52.194 65.519 -9.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 52.091 63.917 -9.583 1.00 0.00 H new ATOM 1116 N GLY A 71 51.318 72.276 -10.146 1.00 0.00 N ATOM 1117 CA GLY A 71 50.745 73.477 -10.715 1.00 0.00 C ATOM 1118 C GLY A 71 49.734 73.130 -11.781 1.00 0.00 C ATOM 1119 O GLY A 71 49.299 73.984 -12.555 1.00 0.00 O ATOM 0 H GLY A 71 50.979 72.042 -9.213 1.00 0.00 H new ATOM 0 HA2 GLY A 71 50.268 74.065 -9.931 1.00 0.00 H new ATOM 0 HA3 GLY A 71 51.534 74.096 -11.142 1.00 0.00 H new ATOM 1123 N GLN A 72 49.369 71.857 -11.815 1.00 0.00 N ATOM 1124 CA GLN A 72 48.426 71.347 -12.788 1.00 0.00 C ATOM 1125 C GLN A 72 47.122 71.002 -12.101 1.00 0.00 C ATOM 1126 O GLN A 72 46.836 69.831 -11.854 1.00 0.00 O ATOM 1127 CB GLN A 72 48.970 70.097 -13.482 1.00 0.00 C ATOM 1128 CG GLN A 72 50.274 70.309 -14.228 1.00 0.00 C ATOM 1129 CD GLN A 72 50.781 69.029 -14.861 1.00 0.00 C ATOM 1130 OE1 GLN A 72 49.997 68.160 -15.249 1.00 0.00 O ATOM 1131 NE2 GLN A 72 52.093 68.901 -14.967 1.00 0.00 N ATOM 0 H GLN A 72 49.720 71.152 -11.167 1.00 0.00 H new ATOM 0 HA GLN A 72 48.264 72.121 -13.539 1.00 0.00 H new ATOM 0 HB2 GLN A 72 49.116 69.317 -12.735 1.00 0.00 H new ATOM 0 HB3 GLN A 72 48.220 69.731 -14.183 1.00 0.00 H new ATOM 0 HG2 GLN A 72 50.131 71.064 -15.001 1.00 0.00 H new ATOM 0 HG3 GLN A 72 51.026 70.696 -13.540 1.00 0.00 H new ATOM 0 HE21 GLN A 72 52.707 69.644 -14.633 1.00 0.00 H new ATOM 0 HE22 GLN A 72 52.491 68.059 -15.383 1.00 0.00 H new ATOM 1140 N TRP A 73 46.357 72.022 -11.756 1.00 0.00 N ATOM 1141 CA TRP A 73 45.067 71.813 -11.126 1.00 0.00 C ATOM 1142 C TRP A 73 44.123 71.149 -12.116 1.00 0.00 C ATOM 1143 O TRP A 73 43.634 71.785 -13.047 1.00 0.00 O ATOM 1144 CB TRP A 73 44.492 73.142 -10.631 1.00 0.00 C ATOM 1145 CG TRP A 73 45.348 73.803 -9.594 1.00 0.00 C ATOM 1146 CD1 TRP A 73 46.312 74.748 -9.806 1.00 0.00 C ATOM 1147 CD2 TRP A 73 45.320 73.565 -8.184 1.00 0.00 C ATOM 1148 NE1 TRP A 73 46.888 75.106 -8.613 1.00 0.00 N ATOM 1149 CE2 TRP A 73 46.297 74.396 -7.601 1.00 0.00 C ATOM 1150 CE3 TRP A 73 44.566 72.730 -7.355 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 46.536 74.416 -6.230 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 44.805 72.751 -5.994 1.00 0.00 C ATOM 1153 CH2 TRP A 73 45.784 73.588 -5.444 1.00 0.00 C ATOM 0 H TRP A 73 46.606 73.000 -11.901 1.00 0.00 H new ATOM 0 HA TRP A 73 45.189 71.160 -10.262 1.00 0.00 H new ATOM 0 HB2 TRP A 73 44.372 73.817 -11.478 1.00 0.00 H new ATOM 0 HB3 TRP A 73 43.498 72.970 -10.217 1.00 0.00 H new ATOM 0 HD1 TRP A 73 46.581 75.153 -10.770 1.00 0.00 H new ATOM 0 HE1 TRP A 73 47.636 75.790 -8.498 1.00 0.00 H new ATOM 0 HE3 TRP A 73 43.810 72.080 -7.770 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 47.288 75.062 -5.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 44.227 72.111 -5.344 1.00 0.00 H new ATOM 0 HH2 TRP A 73 45.948 73.579 -4.377 1.00 0.00 H new ATOM 1164 N ARG A 74 43.897 69.863 -11.929 1.00 0.00 N ATOM 1165 CA ARG A 74 43.113 69.086 -12.868 1.00 0.00 C ATOM 1166 C ARG A 74 41.949 68.422 -12.159 1.00 0.00 C ATOM 1167 O ARG A 74 42.072 68.017 -11.002 1.00 0.00 O ATOM 1168 CB ARG A 74 44.001 68.028 -13.519 1.00 0.00 C ATOM 1169 CG ARG A 74 43.386 67.362 -14.738 1.00 0.00 C ATOM 1170 CD ARG A 74 44.298 66.279 -15.289 1.00 0.00 C ATOM 1171 NE ARG A 74 45.672 66.751 -15.451 1.00 0.00 N ATOM 1172 CZ ARG A 74 46.388 66.590 -16.562 1.00 0.00 C ATOM 1173 NH1 ARG A 74 45.837 66.028 -17.634 1.00 0.00 N ATOM 1174 NH2 ARG A 74 47.648 67.008 -16.613 1.00 0.00 N ATOM 0 H ARG A 74 44.247 69.333 -11.131 1.00 0.00 H new ATOM 0 HA ARG A 74 42.717 69.749 -13.637 1.00 0.00 H new ATOM 0 HB2 ARG A 74 44.945 68.490 -13.809 1.00 0.00 H new ATOM 0 HB3 ARG A 74 44.235 67.262 -12.780 1.00 0.00 H new ATOM 0 HG2 ARG A 74 42.422 66.929 -14.472 1.00 0.00 H new ATOM 0 HG3 ARG A 74 43.198 68.110 -15.508 1.00 0.00 H new ATOM 0 HD2 ARG A 74 44.286 65.420 -14.619 1.00 0.00 H new ATOM 0 HD3 ARG A 74 43.916 65.938 -16.251 1.00 0.00 H new ATOM 0 HE ARG A 74 46.109 67.233 -14.665 1.00 0.00 H new ATOM 0 HH11 ARG A 74 44.865 65.720 -17.606 1.00 0.00 H new ATOM 0 HH12 ARG A 74 46.386 65.905 -18.485 1.00 0.00 H new ATOM 0 HH21 ARG A 74 48.071 67.454 -15.799 1.00 0.00 H new ATOM 0 HH22 ARG A 74 48.193 66.883 -17.466 1.00 0.00 H new ATOM 1188 N TRP A 75 40.824 68.316 -12.842 1.00 0.00 N ATOM 1189 CA TRP A 75 39.662 67.677 -12.262 1.00 0.00 C ATOM 1190 C TRP A 75 39.727 66.169 -12.487 1.00 0.00 C ATOM 1191 O TRP A 75 39.987 65.709 -13.599 1.00 0.00 O ATOM 1192 CB TRP A 75 38.374 68.271 -12.840 1.00 0.00 C ATOM 1193 CG TRP A 75 38.221 69.742 -12.575 1.00 0.00 C ATOM 1194 CD1 TRP A 75 38.560 70.761 -13.416 1.00 0.00 C ATOM 1195 CD2 TRP A 75 37.692 70.359 -11.393 1.00 0.00 C ATOM 1196 NE1 TRP A 75 38.280 71.971 -12.832 1.00 0.00 N ATOM 1197 CE2 TRP A 75 37.744 71.752 -11.590 1.00 0.00 C ATOM 1198 CE3 TRP A 75 37.179 69.871 -10.190 1.00 0.00 C ATOM 1199 CZ2 TRP A 75 37.305 72.659 -10.626 1.00 0.00 C ATOM 1200 CZ3 TRP A 75 36.743 70.769 -9.235 1.00 0.00 C ATOM 1201 CH2 TRP A 75 36.807 72.150 -9.458 1.00 0.00 C ATOM 0 H TRP A 75 40.692 68.662 -13.792 1.00 0.00 H new ATOM 0 HA TRP A 75 39.657 67.861 -11.188 1.00 0.00 H new ATOM 0 HB2 TRP A 75 38.355 68.100 -13.916 1.00 0.00 H new ATOM 0 HB3 TRP A 75 37.519 67.743 -12.418 1.00 0.00 H new ATOM 0 HD1 TRP A 75 38.987 70.634 -14.400 1.00 0.00 H new ATOM 0 HE1 TRP A 75 38.444 72.885 -13.254 1.00 0.00 H new ATOM 0 HE3 TRP A 75 37.124 68.808 -10.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 37.356 73.724 -10.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 36.346 70.400 -8.301 1.00 0.00 H new ATOM 0 HH2 TRP A 75 36.456 72.827 -8.693 1.00 0.00 H new ATOM 1212 N VAL A 76 39.497 65.415 -11.412 1.00 0.00 N ATOM 1213 CA VAL A 76 39.616 63.955 -11.418 1.00 0.00 C ATOM 1214 C VAL A 76 38.701 63.309 -12.464 1.00 0.00 C ATOM 1215 O VAL A 76 38.994 62.227 -12.975 1.00 0.00 O ATOM 1216 CB VAL A 76 39.318 63.368 -10.011 1.00 0.00 C ATOM 1217 CG1 VAL A 76 37.883 63.653 -9.586 1.00 0.00 C ATOM 1218 CG2 VAL A 76 39.608 61.876 -9.965 1.00 0.00 C ATOM 0 H VAL A 76 39.222 65.800 -10.509 1.00 0.00 H new ATOM 0 HA VAL A 76 40.646 63.721 -11.687 1.00 0.00 H new ATOM 0 HB VAL A 76 39.982 63.862 -9.302 1.00 0.00 H new ATOM 0 HG11 VAL A 76 37.705 63.230 -8.597 1.00 0.00 H new ATOM 0 HG12 VAL A 76 37.720 64.730 -9.554 1.00 0.00 H new ATOM 0 HG13 VAL A 76 37.195 63.203 -10.302 1.00 0.00 H new ATOM 0 HG21 VAL A 76 39.390 61.494 -8.968 1.00 0.00 H new ATOM 0 HG22 VAL A 76 38.984 61.361 -10.696 1.00 0.00 H new ATOM 0 HG23 VAL A 76 40.658 61.702 -10.199 1.00 0.00 H new ATOM 1228 N ASP A 77 37.596 63.980 -12.771 1.00 0.00 N ATOM 1229 CA ASP A 77 36.697 63.559 -13.846 1.00 0.00 C ATOM 1230 C ASP A 77 37.470 63.441 -15.159 1.00 0.00 C ATOM 1231 O ASP A 77 37.617 62.349 -15.715 1.00 0.00 O ATOM 1232 CB ASP A 77 35.559 64.585 -13.977 1.00 0.00 C ATOM 1233 CG ASP A 77 34.771 64.479 -15.270 1.00 0.00 C ATOM 1234 OD1 ASP A 77 35.180 65.104 -16.274 1.00 0.00 O ATOM 1235 OD2 ASP A 77 33.723 63.799 -15.280 1.00 0.00 O ATOM 0 H ASP A 77 37.297 64.826 -12.287 1.00 0.00 H new ATOM 0 HA ASP A 77 36.274 62.582 -13.613 1.00 0.00 H new ATOM 0 HB2 ASP A 77 34.875 64.462 -13.137 1.00 0.00 H new ATOM 0 HB3 ASP A 77 35.979 65.588 -13.902 1.00 0.00 H new ATOM 1240 N GLN A 78 38.000 64.578 -15.590 1.00 0.00 N ATOM 1241 CA GLN A 78 38.739 64.728 -16.838 1.00 0.00 C ATOM 1242 C GLN A 78 38.801 66.211 -17.143 1.00 0.00 C ATOM 1243 O GLN A 78 39.756 66.703 -17.746 1.00 0.00 O ATOM 1244 CB GLN A 78 38.070 63.976 -18.004 1.00 0.00 C ATOM 1245 CG GLN A 78 38.829 64.072 -19.324 1.00 0.00 C ATOM 1246 CD GLN A 78 38.478 65.315 -20.126 1.00 0.00 C ATOM 1247 OE1 GLN A 78 37.342 65.793 -20.091 1.00 0.00 O ATOM 1248 NE2 GLN A 78 39.452 65.860 -20.834 1.00 0.00 N ATOM 0 H GLN A 78 37.925 65.449 -15.065 1.00 0.00 H new ATOM 0 HA GLN A 78 39.735 64.299 -16.725 1.00 0.00 H new ATOM 0 HB2 GLN A 78 37.966 62.925 -17.733 1.00 0.00 H new ATOM 0 HB3 GLN A 78 37.064 64.370 -18.146 1.00 0.00 H new ATOM 0 HG2 GLN A 78 39.900 64.068 -19.121 1.00 0.00 H new ATOM 0 HG3 GLN A 78 38.615 63.188 -19.924 1.00 0.00 H new ATOM 0 HE21 GLN A 78 40.379 65.435 -20.838 1.00 0.00 H new ATOM 0 HE22 GLN A 78 39.276 66.706 -21.377 1.00 0.00 H new ATOM 1257 N THR A 79 37.761 66.903 -16.686 1.00 0.00 N ATOM 1258 CA THR A 79 37.601 68.338 -16.883 1.00 0.00 C ATOM 1259 C THR A 79 38.915 69.098 -16.676 1.00 0.00 C ATOM 1260 O THR A 79 39.550 68.999 -15.621 1.00 0.00 O ATOM 1261 CB THR A 79 36.546 68.890 -15.906 1.00 0.00 C ATOM 1262 OG1 THR A 79 35.437 67.981 -15.812 1.00 0.00 O ATOM 1263 CG2 THR A 79 36.046 70.255 -16.354 1.00 0.00 C ATOM 0 H THR A 79 36.997 66.476 -16.162 1.00 0.00 H new ATOM 0 HA THR A 79 37.279 68.486 -17.914 1.00 0.00 H new ATOM 0 HB THR A 79 37.016 68.996 -14.928 1.00 0.00 H new ATOM 0 HG1 THR A 79 34.772 68.339 -15.187 1.00 0.00 H new ATOM 0 HG21 THR A 79 35.302 70.620 -15.646 1.00 0.00 H new ATOM 0 HG22 THR A 79 36.882 70.953 -16.395 1.00 0.00 H new ATOM 0 HG23 THR A 79 35.595 70.171 -17.343 1.00 0.00 H new ATOM 1271 N PRO A 80 39.358 69.828 -17.708 1.00 0.00 N ATOM 1272 CA PRO A 80 40.523 70.708 -17.610 1.00 0.00 C ATOM 1273 C PRO A 80 40.255 71.884 -16.675 1.00 0.00 C ATOM 1274 O PRO A 80 39.102 72.203 -16.374 1.00 0.00 O ATOM 1275 CB PRO A 80 40.735 71.196 -19.050 1.00 0.00 C ATOM 1276 CG PRO A 80 39.955 70.248 -19.898 1.00 0.00 C ATOM 1277 CD PRO A 80 38.786 69.832 -19.060 1.00 0.00 C ATOM 0 HA PRO A 80 41.395 70.199 -17.200 1.00 0.00 H new ATOM 0 HB2 PRO A 80 40.382 72.220 -19.176 1.00 0.00 H new ATOM 0 HB3 PRO A 80 41.791 71.188 -19.318 1.00 0.00 H new ATOM 0 HG2 PRO A 80 39.626 70.726 -20.821 1.00 0.00 H new ATOM 0 HG3 PRO A 80 40.560 69.387 -20.183 1.00 0.00 H new ATOM 0 HD2 PRO A 80 37.954 70.530 -19.148 1.00 0.00 H new ATOM 0 HD3 PRO A 80 38.410 68.850 -19.346 1.00 0.00 H new ATOM 1285 N PHE A 81 41.318 72.520 -16.209 1.00 0.00 N ATOM 1286 CA PHE A 81 41.186 73.631 -15.280 1.00 0.00 C ATOM 1287 C PHE A 81 40.571 74.842 -15.968 1.00 0.00 C ATOM 1288 O PHE A 81 40.851 75.113 -17.135 1.00 0.00 O ATOM 1289 CB PHE A 81 42.551 74.003 -14.698 1.00 0.00 C ATOM 1290 CG PHE A 81 42.490 75.042 -13.612 1.00 0.00 C ATOM 1291 CD1 PHE A 81 41.871 74.761 -12.404 1.00 0.00 C ATOM 1292 CD2 PHE A 81 43.048 76.296 -13.799 1.00 0.00 C ATOM 1293 CE1 PHE A 81 41.811 75.712 -11.403 1.00 0.00 C ATOM 1294 CE2 PHE A 81 42.988 77.251 -12.802 1.00 0.00 C ATOM 1295 CZ PHE A 81 42.371 76.959 -11.603 1.00 0.00 C ATOM 0 H PHE A 81 42.279 72.287 -16.458 1.00 0.00 H new ATOM 0 HA PHE A 81 40.526 73.318 -14.471 1.00 0.00 H new ATOM 0 HB2 PHE A 81 43.022 73.104 -14.301 1.00 0.00 H new ATOM 0 HB3 PHE A 81 43.190 74.369 -15.502 1.00 0.00 H new ATOM 0 HD1 PHE A 81 41.431 73.788 -12.243 1.00 0.00 H new ATOM 0 HD2 PHE A 81 43.535 76.530 -14.734 1.00 0.00 H new ATOM 0 HE1 PHE A 81 41.327 75.481 -10.466 1.00 0.00 H new ATOM 0 HE2 PHE A 81 43.424 78.226 -12.961 1.00 0.00 H new ATOM 0 HZ PHE A 81 42.326 77.704 -10.822 1.00 0.00 H new ATOM 1305 N ASN A 82 39.727 75.560 -15.242 1.00 0.00 N ATOM 1306 CA ASN A 82 39.130 76.783 -15.755 1.00 0.00 C ATOM 1307 C ASN A 82 39.818 78.001 -15.151 1.00 0.00 C ATOM 1308 O ASN A 82 39.492 78.410 -14.038 1.00 0.00 O ATOM 1309 CB ASN A 82 37.628 76.839 -15.443 1.00 0.00 C ATOM 1310 CG ASN A 82 36.800 75.923 -16.324 1.00 0.00 C ATOM 1311 OD1 ASN A 82 36.385 76.312 -17.414 1.00 0.00 O ATOM 1312 ND2 ASN A 82 36.530 74.715 -15.852 1.00 0.00 N ATOM 0 H ASN A 82 39.440 75.316 -14.294 1.00 0.00 H new ATOM 0 HA ASN A 82 39.262 76.789 -16.837 1.00 0.00 H new ATOM 0 HB2 ASN A 82 37.470 76.569 -14.399 1.00 0.00 H new ATOM 0 HB3 ASN A 82 37.276 77.864 -15.564 1.00 0.00 H new ATOM 0 HD21 ASN A 82 35.959 74.070 -16.398 1.00 0.00 H new ATOM 0 HD22 ASN A 82 36.893 74.430 -14.943 1.00 0.00 H new ATOM 1319 N PRO A 83 40.790 78.594 -15.864 1.00 0.00 N ATOM 1320 CA PRO A 83 41.509 79.780 -15.384 1.00 0.00 C ATOM 1321 C PRO A 83 40.598 80.995 -15.315 1.00 0.00 C ATOM 1322 O PRO A 83 40.781 81.877 -14.480 1.00 0.00 O ATOM 1323 CB PRO A 83 42.611 79.998 -16.431 1.00 0.00 C ATOM 1324 CG PRO A 83 42.666 78.732 -17.218 1.00 0.00 C ATOM 1325 CD PRO A 83 41.278 78.163 -17.181 1.00 0.00 C ATOM 0 HA PRO A 83 41.898 79.641 -14.375 1.00 0.00 H new ATOM 0 HB2 PRO A 83 42.381 80.849 -17.072 1.00 0.00 H new ATOM 0 HB3 PRO A 83 43.569 80.207 -15.955 1.00 0.00 H new ATOM 0 HG2 PRO A 83 42.982 78.923 -18.243 1.00 0.00 H new ATOM 0 HG3 PRO A 83 43.385 78.035 -16.787 1.00 0.00 H new ATOM 0 HD2 PRO A 83 40.659 78.551 -17.990 1.00 0.00 H new ATOM 0 HD3 PRO A 83 41.282 77.077 -17.276 1.00 0.00 H new ATOM 1333 N ARG A 84 39.605 81.023 -16.194 1.00 0.00 N ATOM 1334 CA ARG A 84 38.657 82.124 -16.254 1.00 0.00 C ATOM 1335 C ARG A 84 37.577 81.963 -15.186 1.00 0.00 C ATOM 1336 O ARG A 84 36.812 82.886 -14.909 1.00 0.00 O ATOM 1337 CB ARG A 84 38.034 82.184 -17.645 1.00 0.00 C ATOM 1338 CG ARG A 84 37.174 83.412 -17.871 1.00 0.00 C ATOM 1339 CD ARG A 84 37.000 83.688 -19.346 1.00 0.00 C ATOM 1340 NE ARG A 84 36.173 84.866 -19.581 1.00 0.00 N ATOM 1341 CZ ARG A 84 36.262 85.636 -20.659 1.00 0.00 C ATOM 1342 NH1 ARG A 84 37.168 85.374 -21.596 1.00 0.00 N ATOM 1343 NH2 ARG A 84 35.448 86.672 -20.791 1.00 0.00 N ATOM 0 H ARG A 84 39.436 80.288 -16.880 1.00 0.00 H new ATOM 0 HA ARG A 84 39.183 83.058 -16.059 1.00 0.00 H new ATOM 0 HB2 ARG A 84 38.828 82.164 -18.391 1.00 0.00 H new ATOM 0 HB3 ARG A 84 37.428 81.292 -17.801 1.00 0.00 H new ATOM 0 HG2 ARG A 84 36.198 83.267 -17.407 1.00 0.00 H new ATOM 0 HG3 ARG A 84 37.632 84.275 -17.388 1.00 0.00 H new ATOM 0 HD2 ARG A 84 37.977 83.832 -19.807 1.00 0.00 H new ATOM 0 HD3 ARG A 84 36.545 82.822 -19.827 1.00 0.00 H new ATOM 0 HE ARG A 84 35.483 85.114 -18.872 1.00 0.00 H new ATOM 0 HH11 ARG A 84 37.798 84.579 -21.488 1.00 0.00 H new ATOM 0 HH12 ARG A 84 37.233 85.968 -22.423 1.00 0.00 H new ATOM 0 HH21 ARG A 84 34.758 86.874 -20.067 1.00 0.00 H new ATOM 0 HH22 ARG A 84 35.511 87.268 -21.616 1.00 0.00 H new ATOM 1357 N ARG A 85 37.534 80.786 -14.577 1.00 0.00 N ATOM 1358 CA ARG A 85 36.539 80.485 -13.558 1.00 0.00 C ATOM 1359 C ARG A 85 37.214 79.923 -12.315 1.00 0.00 C ATOM 1360 O ARG A 85 36.890 78.827 -11.859 1.00 0.00 O ATOM 1361 CB ARG A 85 35.502 79.488 -14.091 1.00 0.00 C ATOM 1362 CG ARG A 85 34.687 80.023 -15.257 1.00 0.00 C ATOM 1363 CD ARG A 85 33.743 78.972 -15.817 1.00 0.00 C ATOM 1364 NE ARG A 85 32.965 79.492 -16.938 1.00 0.00 N ATOM 1365 CZ ARG A 85 32.489 78.748 -17.934 1.00 0.00 C ATOM 1366 NH1 ARG A 85 32.714 77.436 -17.965 1.00 0.00 N ATOM 1367 NH2 ARG A 85 31.787 79.325 -18.900 1.00 0.00 N ATOM 0 H ARG A 85 38.180 80.021 -14.772 1.00 0.00 H new ATOM 0 HA ARG A 85 36.025 81.410 -13.295 1.00 0.00 H new ATOM 0 HB2 ARG A 85 36.013 78.577 -14.403 1.00 0.00 H new ATOM 0 HB3 ARG A 85 34.826 79.213 -13.282 1.00 0.00 H new ATOM 0 HG2 ARG A 85 34.113 80.890 -14.931 1.00 0.00 H new ATOM 0 HG3 ARG A 85 35.360 80.364 -16.044 1.00 0.00 H new ATOM 0 HD2 ARG A 85 34.316 78.104 -16.143 1.00 0.00 H new ATOM 0 HD3 ARG A 85 33.068 78.632 -15.031 1.00 0.00 H new ATOM 0 HE ARG A 85 32.773 80.494 -16.959 1.00 0.00 H new ATOM 0 HH11 ARG A 85 33.255 76.994 -17.222 1.00 0.00 H new ATOM 0 HH12 ARG A 85 32.346 76.873 -18.732 1.00 0.00 H new ATOM 0 HH21 ARG A 85 31.616 80.330 -18.875 1.00 0.00 H new ATOM 0 HH22 ARG A 85 31.418 78.763 -19.667 1.00 0.00 H new ATOM 1381 N VAL A 86 38.164 80.670 -11.781 1.00 0.00 N ATOM 1382 CA VAL A 86 38.868 80.250 -10.587 1.00 0.00 C ATOM 1383 C VAL A 86 38.322 80.994 -9.373 1.00 0.00 C ATOM 1384 O VAL A 86 38.032 82.190 -9.442 1.00 0.00 O ATOM 1385 CB VAL A 86 40.395 80.463 -10.711 1.00 0.00 C ATOM 1386 CG1 VAL A 86 40.758 81.937 -10.801 1.00 0.00 C ATOM 1387 CG2 VAL A 86 41.120 79.792 -9.561 1.00 0.00 C ATOM 0 H VAL A 86 38.464 81.570 -12.157 1.00 0.00 H new ATOM 0 HA VAL A 86 38.701 79.180 -10.460 1.00 0.00 H new ATOM 0 HB VAL A 86 40.718 79.998 -11.643 1.00 0.00 H new ATOM 0 HG11 VAL A 86 41.840 82.041 -10.887 1.00 0.00 H new ATOM 0 HG12 VAL A 86 40.281 82.376 -11.677 1.00 0.00 H new ATOM 0 HG13 VAL A 86 40.414 82.452 -9.904 1.00 0.00 H new ATOM 0 HG21 VAL A 86 42.193 79.952 -9.665 1.00 0.00 H new ATOM 0 HG22 VAL A 86 40.779 80.218 -8.618 1.00 0.00 H new ATOM 0 HG23 VAL A 86 40.910 78.722 -9.573 1.00 0.00 H new ATOM 1397 N PHE A 87 38.148 80.277 -8.272 1.00 0.00 N ATOM 1398 CA PHE A 87 37.574 80.862 -7.072 1.00 0.00 C ATOM 1399 C PHE A 87 38.437 80.533 -5.858 1.00 0.00 C ATOM 1400 O PHE A 87 38.061 79.714 -5.023 1.00 0.00 O ATOM 1401 CB PHE A 87 36.142 80.347 -6.858 1.00 0.00 C ATOM 1402 CG PHE A 87 35.304 80.339 -8.110 1.00 0.00 C ATOM 1403 CD1 PHE A 87 34.728 81.506 -8.585 1.00 0.00 C ATOM 1404 CD2 PHE A 87 35.103 79.162 -8.815 1.00 0.00 C ATOM 1405 CE1 PHE A 87 33.967 81.498 -9.742 1.00 0.00 C ATOM 1406 CE2 PHE A 87 34.342 79.147 -9.969 1.00 0.00 C ATOM 1407 CZ PHE A 87 33.773 80.317 -10.434 1.00 0.00 C ATOM 0 H PHE A 87 38.396 79.291 -8.186 1.00 0.00 H new ATOM 0 HA PHE A 87 37.541 81.944 -7.196 1.00 0.00 H new ATOM 0 HB2 PHE A 87 36.186 79.335 -6.456 1.00 0.00 H new ATOM 0 HB3 PHE A 87 35.651 80.967 -6.108 1.00 0.00 H new ATOM 0 HD1 PHE A 87 34.874 82.431 -8.048 1.00 0.00 H new ATOM 0 HD2 PHE A 87 35.547 78.245 -8.458 1.00 0.00 H new ATOM 0 HE1 PHE A 87 33.525 82.415 -10.104 1.00 0.00 H new ATOM 0 HE2 PHE A 87 34.192 78.222 -10.506 1.00 0.00 H new ATOM 0 HZ PHE A 87 33.178 80.309 -11.336 1.00 0.00 H new ATOM 1417 N TRP A 88 39.606 81.157 -5.784 1.00 0.00 N ATOM 1418 CA TRP A 88 40.527 80.929 -4.671 1.00 0.00 C ATOM 1419 C TRP A 88 40.056 81.645 -3.412 1.00 0.00 C ATOM 1420 O TRP A 88 39.138 82.468 -3.460 1.00 0.00 O ATOM 1421 CB TRP A 88 41.935 81.418 -5.022 1.00 0.00 C ATOM 1422 CG TRP A 88 42.651 80.573 -6.027 1.00 0.00 C ATOM 1423 CD1 TRP A 88 43.253 81.000 -7.175 1.00 0.00 C ATOM 1424 CD2 TRP A 88 42.847 79.156 -5.975 1.00 0.00 C ATOM 1425 NE1 TRP A 88 43.822 79.936 -7.832 1.00 0.00 N ATOM 1426 CE2 TRP A 88 43.581 78.794 -7.118 1.00 0.00 C ATOM 1427 CE3 TRP A 88 42.474 78.160 -5.070 1.00 0.00 C ATOM 1428 CZ2 TRP A 88 43.948 77.480 -7.382 1.00 0.00 C ATOM 1429 CZ3 TRP A 88 42.838 76.856 -5.333 1.00 0.00 C ATOM 1430 CH2 TRP A 88 43.569 76.526 -6.480 1.00 0.00 C ATOM 0 H TRP A 88 39.941 81.824 -6.479 1.00 0.00 H new ATOM 0 HA TRP A 88 40.549 79.855 -4.485 1.00 0.00 H new ATOM 0 HB2 TRP A 88 41.868 82.437 -5.404 1.00 0.00 H new ATOM 0 HB3 TRP A 88 42.530 81.458 -4.110 1.00 0.00 H new ATOM 0 HD1 TRP A 88 43.278 82.024 -7.517 1.00 0.00 H new ATOM 0 HE1 TRP A 88 44.340 79.989 -8.709 1.00 0.00 H new ATOM 0 HE3 TRP A 88 41.911 78.406 -4.182 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 44.511 77.222 -8.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 42.554 76.076 -4.642 1.00 0.00 H new ATOM 0 HH2 TRP A 88 43.839 75.495 -6.656 1.00 0.00 H new ATOM 1441 N HIS A 89 40.683 81.329 -2.288 1.00 0.00 N ATOM 1442 CA HIS A 89 40.428 82.050 -1.052 1.00 0.00 C ATOM 1443 C HIS A 89 41.459 83.155 -0.871 1.00 0.00 C ATOM 1444 O HIS A 89 42.624 82.888 -0.579 1.00 0.00 O ATOM 1445 CB HIS A 89 40.445 81.108 0.156 1.00 0.00 C ATOM 1446 CG HIS A 89 39.083 80.640 0.560 1.00 0.00 C ATOM 1447 ND1 HIS A 89 38.316 81.292 1.501 1.00 0.00 N ATOM 1448 CD2 HIS A 89 38.340 79.600 0.131 1.00 0.00 C ATOM 1449 CE1 HIS A 89 37.155 80.679 1.622 1.00 0.00 C ATOM 1450 NE2 HIS A 89 37.143 79.647 0.802 1.00 0.00 N ATOM 0 H HIS A 89 41.370 80.580 -2.208 1.00 0.00 H new ATOM 0 HA HIS A 89 39.434 82.493 -1.118 1.00 0.00 H new ATOM 0 HB2 HIS A 89 41.065 80.242 -0.076 1.00 0.00 H new ATOM 0 HB3 HIS A 89 40.911 81.618 0.999 1.00 0.00 H new ATOM 0 HD1 HIS A 89 38.602 82.120 2.023 1.00 0.00 H new ATOM 0 HD2 HIS A 89 38.632 78.865 -0.605 1.00 0.00 H new ATOM 0 HE1 HIS A 89 36.351 80.972 2.281 1.00 0.00 H new ATOM 1459 N LYS A 90 41.030 84.393 -1.071 1.00 0.00 N ATOM 1460 CA LYS A 90 41.928 85.532 -0.965 1.00 0.00 C ATOM 1461 C LYS A 90 42.475 85.656 0.453 1.00 0.00 C ATOM 1462 O LYS A 90 41.718 85.614 1.427 1.00 0.00 O ATOM 1463 CB LYS A 90 41.211 86.820 -1.372 1.00 0.00 C ATOM 1464 CG LYS A 90 42.119 88.035 -1.372 1.00 0.00 C ATOM 1465 CD LYS A 90 41.358 89.309 -1.683 1.00 0.00 C ATOM 1466 CE LYS A 90 42.260 90.523 -1.562 1.00 0.00 C ATOM 1467 NZ LYS A 90 41.533 91.785 -1.850 1.00 0.00 N ATOM 0 H LYS A 90 40.067 84.633 -1.307 1.00 0.00 H new ATOM 0 HA LYS A 90 42.765 85.371 -1.645 1.00 0.00 H new ATOM 0 HB2 LYS A 90 40.786 86.692 -2.367 1.00 0.00 H new ATOM 0 HB3 LYS A 90 40.379 86.996 -0.690 1.00 0.00 H new ATOM 0 HG2 LYS A 90 42.601 88.128 -0.399 1.00 0.00 H new ATOM 0 HG3 LYS A 90 42.911 87.896 -2.108 1.00 0.00 H new ATOM 0 HD2 LYS A 90 40.948 89.255 -2.691 1.00 0.00 H new ATOM 0 HD3 LYS A 90 40.514 89.409 -1.000 1.00 0.00 H new ATOM 0 HE2 LYS A 90 42.677 90.566 -0.556 1.00 0.00 H new ATOM 0 HE3 LYS A 90 43.099 90.422 -2.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 42.185 92.590 -1.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 41.156 91.755 -2.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 40.748 91.895 -1.177 1.00 0.00 H new ATOM 1481 N ASN A 91 43.797 85.787 0.545 1.00 0.00 N ATOM 1482 CA ASN A 91 44.508 85.897 1.820 1.00 0.00 C ATOM 1483 C ASN A 91 44.485 84.573 2.584 1.00 0.00 C ATOM 1484 O ASN A 91 44.767 84.520 3.782 1.00 0.00 O ATOM 1485 CB ASN A 91 43.949 87.038 2.680 1.00 0.00 C ATOM 1486 CG ASN A 91 44.205 88.403 2.062 1.00 0.00 C ATOM 1487 OD1 ASN A 91 43.357 88.953 1.360 1.00 0.00 O ATOM 1488 ND2 ASN A 91 45.384 88.952 2.307 1.00 0.00 N ATOM 0 H ASN A 91 44.411 85.820 -0.269 1.00 0.00 H new ATOM 0 HA ASN A 91 45.547 86.134 1.593 1.00 0.00 H new ATOM 0 HB2 ASN A 91 42.876 86.897 2.814 1.00 0.00 H new ATOM 0 HB3 ASN A 91 44.402 86.999 3.671 1.00 0.00 H new ATOM 0 HD21 ASN A 91 45.615 89.862 1.909 1.00 0.00 H new ATOM 0 HD22 ASN A 91 46.061 88.465 2.894 1.00 0.00 H new ATOM 1495 N GLU A 92 44.160 83.505 1.871 1.00 0.00 N ATOM 1496 CA GLU A 92 44.253 82.157 2.406 1.00 0.00 C ATOM 1497 C GLU A 92 45.113 81.308 1.478 1.00 0.00 C ATOM 1498 O GLU A 92 44.819 81.192 0.289 1.00 0.00 O ATOM 1499 CB GLU A 92 42.861 81.536 2.565 1.00 0.00 C ATOM 1500 CG GLU A 92 42.072 82.105 3.736 1.00 0.00 C ATOM 1501 CD GLU A 92 40.642 81.604 3.788 1.00 0.00 C ATOM 1502 OE1 GLU A 92 40.422 80.442 4.190 1.00 0.00 O ATOM 1503 OE2 GLU A 92 39.726 82.376 3.435 1.00 0.00 O ATOM 0 H GLU A 92 43.826 83.549 0.908 1.00 0.00 H new ATOM 0 HA GLU A 92 44.714 82.196 3.393 1.00 0.00 H new ATOM 0 HB2 GLU A 92 42.295 81.692 1.646 1.00 0.00 H new ATOM 0 HB3 GLU A 92 42.965 80.459 2.697 1.00 0.00 H new ATOM 0 HG2 GLU A 92 42.576 81.845 4.667 1.00 0.00 H new ATOM 0 HG3 GLU A 92 42.068 83.193 3.669 1.00 0.00 H new ATOM 1510 N PRO A 93 46.207 80.735 1.999 1.00 0.00 N ATOM 1511 CA PRO A 93 47.111 79.900 1.206 1.00 0.00 C ATOM 1512 C PRO A 93 46.424 78.634 0.701 1.00 0.00 C ATOM 1513 O PRO A 93 46.005 77.787 1.493 1.00 0.00 O ATOM 1514 CB PRO A 93 48.234 79.548 2.187 1.00 0.00 C ATOM 1515 CG PRO A 93 47.637 79.737 3.540 1.00 0.00 C ATOM 1516 CD PRO A 93 46.652 80.859 3.398 1.00 0.00 C ATOM 0 HA PRO A 93 47.463 80.414 0.311 1.00 0.00 H new ATOM 0 HB2 PRO A 93 48.575 78.522 2.046 1.00 0.00 H new ATOM 0 HB3 PRO A 93 49.100 80.194 2.044 1.00 0.00 H new ATOM 0 HG2 PRO A 93 47.146 78.826 3.881 1.00 0.00 H new ATOM 0 HG3 PRO A 93 48.404 79.980 4.275 1.00 0.00 H new ATOM 0 HD2 PRO A 93 45.821 80.757 4.096 1.00 0.00 H new ATOM 0 HD3 PRO A 93 47.113 81.828 3.590 1.00 0.00 H new ATOM 1524 N ASP A 94 46.297 78.517 -0.613 1.00 0.00 N ATOM 1525 CA ASP A 94 45.674 77.348 -1.219 1.00 0.00 C ATOM 1526 C ASP A 94 46.709 76.515 -1.967 1.00 0.00 C ATOM 1527 O ASP A 94 46.853 76.640 -3.188 1.00 0.00 O ATOM 1528 CB ASP A 94 44.541 77.746 -2.176 1.00 0.00 C ATOM 1529 CG ASP A 94 43.332 78.331 -1.468 1.00 0.00 C ATOM 1530 OD1 ASP A 94 42.830 77.694 -0.516 1.00 0.00 O ATOM 1531 OD2 ASP A 94 42.877 79.428 -1.867 1.00 0.00 O ATOM 0 H ASP A 94 46.617 79.218 -1.281 1.00 0.00 H new ATOM 0 HA ASP A 94 45.248 76.752 -0.412 1.00 0.00 H new ATOM 0 HB2 ASP A 94 44.920 78.474 -2.893 1.00 0.00 H new ATOM 0 HB3 ASP A 94 44.231 76.869 -2.745 1.00 0.00 H new ATOM 1536 N ASN A 95 47.446 75.690 -1.222 1.00 0.00 N ATOM 1537 CA ASN A 95 48.452 74.789 -1.793 1.00 0.00 C ATOM 1538 C ASN A 95 49.174 74.041 -0.678 1.00 0.00 C ATOM 1539 O ASN A 95 50.057 74.593 -0.018 1.00 0.00 O ATOM 1540 CB ASN A 95 49.483 75.549 -2.637 1.00 0.00 C ATOM 1541 CG ASN A 95 50.392 74.620 -3.424 1.00 0.00 C ATOM 1542 OD1 ASN A 95 51.574 74.906 -3.614 1.00 0.00 O ATOM 1543 ND2 ASN A 95 49.842 73.512 -3.905 1.00 0.00 N ATOM 0 H ASN A 95 47.364 75.626 -0.207 1.00 0.00 H new ATOM 0 HA ASN A 95 47.930 74.085 -2.441 1.00 0.00 H new ATOM 0 HB2 ASN A 95 48.963 76.214 -3.327 1.00 0.00 H new ATOM 0 HB3 ASN A 95 50.089 76.178 -1.985 1.00 0.00 H new ATOM 0 HD21 ASN A 95 50.403 72.861 -4.455 1.00 0.00 H new ATOM 0 HD22 ASN A 95 48.858 73.311 -3.725 1.00 0.00 H new ATOM 1550 N SER A 96 48.799 72.789 -0.466 1.00 0.00 N ATOM 1551 CA SER A 96 49.362 71.992 0.618 1.00 0.00 C ATOM 1552 C SER A 96 50.656 71.295 0.204 1.00 0.00 C ATOM 1553 O SER A 96 51.122 70.385 0.887 1.00 0.00 O ATOM 1554 CB SER A 96 48.330 70.970 1.099 1.00 0.00 C ATOM 1555 OG SER A 96 47.092 71.599 1.397 1.00 0.00 O ATOM 0 H SER A 96 48.105 72.300 -1.031 1.00 0.00 H new ATOM 0 HA SER A 96 49.611 72.668 1.436 1.00 0.00 H new ATOM 0 HB2 SER A 96 48.181 70.210 0.332 1.00 0.00 H new ATOM 0 HB3 SER A 96 48.705 70.459 1.986 1.00 0.00 H new ATOM 0 HG SER A 96 46.674 71.909 0.566 1.00 0.00 H new ATOM 1561 N GLN A 97 51.217 71.757 -0.916 1.00 0.00 N ATOM 1562 CA GLN A 97 52.514 71.300 -1.461 1.00 0.00 C ATOM 1563 C GLN A 97 52.684 69.771 -1.461 1.00 0.00 C ATOM 1564 O GLN A 97 53.805 69.256 -1.479 1.00 0.00 O ATOM 1565 CB GLN A 97 53.687 71.988 -0.738 1.00 0.00 C ATOM 1566 CG GLN A 97 53.757 71.743 0.762 1.00 0.00 C ATOM 1567 CD GLN A 97 54.797 72.608 1.441 1.00 0.00 C ATOM 1568 OE1 GLN A 97 55.960 72.223 1.567 1.00 0.00 O ATOM 1569 NE2 GLN A 97 54.387 73.788 1.881 1.00 0.00 N ATOM 0 H GLN A 97 50.777 72.477 -1.489 1.00 0.00 H new ATOM 0 HA GLN A 97 52.520 71.598 -2.509 1.00 0.00 H new ATOM 0 HB2 GLN A 97 54.620 71.649 -1.189 1.00 0.00 H new ATOM 0 HB3 GLN A 97 53.620 73.062 -0.912 1.00 0.00 H new ATOM 0 HG2 GLN A 97 52.781 71.939 1.205 1.00 0.00 H new ATOM 0 HG3 GLN A 97 53.986 70.693 0.945 1.00 0.00 H new ATOM 0 HE21 GLN A 97 53.414 74.069 1.757 1.00 0.00 H new ATOM 0 HE22 GLN A 97 55.044 74.416 2.344 1.00 0.00 H new ATOM 1578 N GLY A 98 51.570 69.059 -1.504 1.00 0.00 N ATOM 1579 CA GLY A 98 51.590 67.612 -1.573 1.00 0.00 C ATOM 1580 C GLY A 98 50.566 67.142 -2.571 1.00 0.00 C ATOM 1581 O GLY A 98 50.378 67.793 -3.592 1.00 0.00 O ATOM 0 H GLY A 98 50.635 69.466 -1.492 1.00 0.00 H new ATOM 0 HA2 GLY A 98 52.582 67.265 -1.863 1.00 0.00 H new ATOM 0 HA3 GLY A 98 51.378 67.188 -0.592 1.00 0.00 H new ATOM 1585 N GLU A 99 49.898 66.035 -2.313 1.00 0.00 N ATOM 1586 CA GLU A 99 48.743 65.699 -3.121 1.00 0.00 C ATOM 1587 C GLU A 99 47.519 66.341 -2.489 1.00 0.00 C ATOM 1588 O GLU A 99 46.831 65.756 -1.647 1.00 0.00 O ATOM 1589 CB GLU A 99 48.570 64.188 -3.324 1.00 0.00 C ATOM 1590 CG GLU A 99 48.545 63.360 -2.052 1.00 0.00 C ATOM 1591 CD GLU A 99 48.264 61.903 -2.339 1.00 0.00 C ATOM 1592 OE1 GLU A 99 49.146 61.221 -2.901 1.00 0.00 O ATOM 1593 OE2 GLU A 99 47.149 61.431 -2.023 1.00 0.00 O ATOM 0 H GLU A 99 50.125 65.371 -1.573 1.00 0.00 H new ATOM 0 HA GLU A 99 48.888 66.094 -4.127 1.00 0.00 H new ATOM 0 HB2 GLU A 99 47.642 64.015 -3.868 1.00 0.00 H new ATOM 0 HB3 GLU A 99 49.382 63.828 -3.956 1.00 0.00 H new ATOM 0 HG2 GLU A 99 49.502 63.452 -1.539 1.00 0.00 H new ATOM 0 HG3 GLU A 99 47.783 63.752 -1.378 1.00 0.00 H new ATOM 1600 N ASN A 100 47.301 67.584 -2.863 1.00 0.00 N ATOM 1601 CA ASN A 100 46.281 68.402 -2.244 1.00 0.00 C ATOM 1602 C ASN A 100 45.121 68.645 -3.189 1.00 0.00 C ATOM 1603 O ASN A 100 45.227 68.442 -4.404 1.00 0.00 O ATOM 1604 CB ASN A 100 46.876 69.730 -1.768 1.00 0.00 C ATOM 1605 CG ASN A 100 47.817 70.361 -2.781 1.00 0.00 C ATOM 1606 OD1 ASN A 100 49.027 70.143 -2.732 1.00 0.00 O ATOM 1607 ND2 ASN A 100 47.280 71.170 -3.674 1.00 0.00 N ATOM 0 H ASN A 100 47.824 68.054 -3.602 1.00 0.00 H new ATOM 0 HA ASN A 100 45.897 67.862 -1.379 1.00 0.00 H new ATOM 0 HB2 ASN A 100 46.066 70.427 -1.551 1.00 0.00 H new ATOM 0 HB3 ASN A 100 47.414 69.566 -0.835 1.00 0.00 H new ATOM 0 HD21 ASN A 100 47.873 71.641 -4.357 1.00 0.00 H new ATOM 0 HD22 ASN A 100 46.272 71.324 -3.681 1.00 0.00 H new ATOM 1614 N CYS A 101 44.014 69.070 -2.613 1.00 0.00 N ATOM 1615 CA CYS A 101 42.787 69.269 -3.353 1.00 0.00 C ATOM 1616 C CYS A 101 41.949 70.363 -2.703 1.00 0.00 C ATOM 1617 O CYS A 101 41.987 70.551 -1.485 1.00 0.00 O ATOM 1618 CB CYS A 101 42.014 67.951 -3.413 1.00 0.00 C ATOM 1619 SG CYS A 101 42.304 66.866 -1.983 1.00 0.00 S ATOM 0 H CYS A 101 43.941 69.287 -1.619 1.00 0.00 H new ATOM 0 HA CYS A 101 43.021 69.587 -4.369 1.00 0.00 H new ATOM 0 HB2 CYS A 101 40.948 68.168 -3.482 1.00 0.00 H new ATOM 0 HB3 CYS A 101 42.291 67.419 -4.323 1.00 0.00 H new ATOM 1624 N VAL A 102 41.202 71.094 -3.514 1.00 0.00 N ATOM 1625 CA VAL A 102 40.420 72.210 -3.014 1.00 0.00 C ATOM 1626 C VAL A 102 39.037 71.760 -2.564 1.00 0.00 C ATOM 1627 O VAL A 102 38.460 70.817 -3.115 1.00 0.00 O ATOM 1628 CB VAL A 102 40.273 73.327 -4.067 1.00 0.00 C ATOM 1629 CG1 VAL A 102 41.638 73.802 -4.525 1.00 0.00 C ATOM 1630 CG2 VAL A 102 39.442 72.859 -5.254 1.00 0.00 C ATOM 0 H VAL A 102 41.121 70.935 -4.518 1.00 0.00 H new ATOM 0 HA VAL A 102 40.964 72.608 -2.158 1.00 0.00 H new ATOM 0 HB VAL A 102 39.750 74.163 -3.603 1.00 0.00 H new ATOM 0 HG11 VAL A 102 41.518 74.590 -5.268 1.00 0.00 H new ATOM 0 HG12 VAL A 102 42.194 74.189 -3.671 1.00 0.00 H new ATOM 0 HG13 VAL A 102 42.185 72.968 -4.965 1.00 0.00 H new ATOM 0 HG21 VAL A 102 39.356 73.668 -5.979 1.00 0.00 H new ATOM 0 HG22 VAL A 102 39.926 72.002 -5.722 1.00 0.00 H new ATOM 0 HG23 VAL A 102 38.448 72.572 -4.911 1.00 0.00 H new ATOM 1640 N VAL A 103 38.523 72.426 -1.548 1.00 0.00 N ATOM 1641 CA VAL A 103 37.183 72.166 -1.061 1.00 0.00 C ATOM 1642 C VAL A 103 36.318 73.410 -1.198 1.00 0.00 C ATOM 1643 O VAL A 103 36.826 74.535 -1.188 1.00 0.00 O ATOM 1644 CB VAL A 103 37.182 71.717 0.421 1.00 0.00 C ATOM 1645 CG1 VAL A 103 37.960 70.426 0.595 1.00 0.00 C ATOM 1646 CG2 VAL A 103 37.747 72.804 1.324 1.00 0.00 C ATOM 0 H VAL A 103 39.019 73.158 -1.040 1.00 0.00 H new ATOM 0 HA VAL A 103 36.777 71.357 -1.668 1.00 0.00 H new ATOM 0 HB VAL A 103 36.147 71.538 0.712 1.00 0.00 H new ATOM 0 HG11 VAL A 103 37.945 70.131 1.644 1.00 0.00 H new ATOM 0 HG12 VAL A 103 37.504 69.642 -0.009 1.00 0.00 H new ATOM 0 HG13 VAL A 103 38.991 70.577 0.275 1.00 0.00 H new ATOM 0 HG21 VAL A 103 37.734 72.461 2.358 1.00 0.00 H new ATOM 0 HG22 VAL A 103 38.772 73.026 1.028 1.00 0.00 H new ATOM 0 HG23 VAL A 103 37.140 73.705 1.233 1.00 0.00 H new ATOM 1656 N LEU A 104 35.019 73.203 -1.334 1.00 0.00 N ATOM 1657 CA LEU A 104 34.069 74.295 -1.274 1.00 0.00 C ATOM 1658 C LEU A 104 33.764 74.589 0.177 1.00 0.00 C ATOM 1659 O LEU A 104 33.052 73.833 0.839 1.00 0.00 O ATOM 1660 CB LEU A 104 32.772 73.964 -2.021 1.00 0.00 C ATOM 1661 CG LEU A 104 32.809 74.184 -3.533 1.00 0.00 C ATOM 1662 CD1 LEU A 104 31.472 73.813 -4.153 1.00 0.00 C ATOM 1663 CD2 LEU A 104 33.157 75.632 -3.853 1.00 0.00 C ATOM 0 H LEU A 104 34.600 72.286 -1.487 1.00 0.00 H new ATOM 0 HA LEU A 104 34.510 75.166 -1.759 1.00 0.00 H new ATOM 0 HB2 LEU A 104 32.519 72.921 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 104 31.968 74.569 -1.603 1.00 0.00 H new ATOM 0 HG LEU A 104 33.581 73.541 -3.957 1.00 0.00 H new ATOM 0 HD11 LEU A 104 31.513 73.975 -5.230 1.00 0.00 H new ATOM 0 HD12 LEU A 104 31.256 72.764 -3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 104 30.686 74.434 -3.723 1.00 0.00 H new ATOM 0 HD21 LEU A 104 33.179 75.771 -4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 104 32.406 76.291 -3.418 1.00 0.00 H new ATOM 0 HD23 LEU A 104 34.135 75.872 -3.437 1.00 0.00 H new ATOM 1675 N VAL A 105 34.349 75.657 0.676 1.00 0.00 N ATOM 1676 CA VAL A 105 34.173 76.031 2.062 1.00 0.00 C ATOM 1677 C VAL A 105 33.619 77.444 2.166 1.00 0.00 C ATOM 1678 O VAL A 105 34.018 78.344 1.408 1.00 0.00 O ATOM 1679 CB VAL A 105 35.499 75.911 2.852 1.00 0.00 C ATOM 1680 CG1 VAL A 105 36.581 76.778 2.236 1.00 0.00 C ATOM 1681 CG2 VAL A 105 35.303 76.275 4.315 1.00 0.00 C ATOM 0 H VAL A 105 34.952 76.282 0.141 1.00 0.00 H new ATOM 0 HA VAL A 105 33.456 75.339 2.505 1.00 0.00 H new ATOM 0 HB VAL A 105 35.818 74.870 2.798 1.00 0.00 H new ATOM 0 HG11 VAL A 105 37.501 76.675 2.811 1.00 0.00 H new ATOM 0 HG12 VAL A 105 36.758 76.463 1.208 1.00 0.00 H new ATOM 0 HG13 VAL A 105 36.262 77.820 2.246 1.00 0.00 H new ATOM 0 HG21 VAL A 105 36.252 76.181 4.844 1.00 0.00 H new ATOM 0 HG22 VAL A 105 34.946 77.302 4.390 1.00 0.00 H new ATOM 0 HG23 VAL A 105 34.570 75.603 4.762 1.00 0.00 H new ATOM 1691 N TYR A 106 32.678 77.617 3.080 1.00 0.00 N ATOM 1692 CA TYR A 106 32.078 78.912 3.331 1.00 0.00 C ATOM 1693 C TYR A 106 32.908 79.665 4.363 1.00 0.00 C ATOM 1694 O TYR A 106 32.780 79.441 5.566 1.00 0.00 O ATOM 1695 CB TYR A 106 30.640 78.733 3.826 1.00 0.00 C ATOM 1696 CG TYR A 106 29.804 80.000 3.832 1.00 0.00 C ATOM 1697 CD1 TYR A 106 29.758 80.832 4.946 1.00 0.00 C ATOM 1698 CD2 TYR A 106 29.036 80.343 2.729 1.00 0.00 C ATOM 1699 CE1 TYR A 106 28.972 81.971 4.955 1.00 0.00 C ATOM 1700 CE2 TYR A 106 28.253 81.481 2.728 1.00 0.00 C ATOM 1701 CZ TYR A 106 28.222 82.289 3.842 1.00 0.00 C ATOM 1702 OH TYR A 106 27.427 83.416 3.845 1.00 0.00 O ATOM 0 H TYR A 106 32.312 76.866 3.665 1.00 0.00 H new ATOM 0 HA TYR A 106 32.056 79.489 2.406 1.00 0.00 H new ATOM 0 HB2 TYR A 106 30.145 77.991 3.199 1.00 0.00 H new ATOM 0 HB3 TYR A 106 30.667 78.328 4.838 1.00 0.00 H new ATOM 0 HD1 TYR A 106 30.345 80.585 5.818 1.00 0.00 H new ATOM 0 HD2 TYR A 106 29.050 79.709 1.855 1.00 0.00 H new ATOM 0 HE1 TYR A 106 28.946 82.607 5.828 1.00 0.00 H new ATOM 0 HE2 TYR A 106 27.668 81.736 1.857 1.00 0.00 H new ATOM 0 HH TYR A 106 27.881 84.135 4.333 1.00 0.00 H new ATOM 1712 N ASN A 107 33.788 80.524 3.876 1.00 0.00 N ATOM 1713 CA ASN A 107 34.623 81.346 4.741 1.00 0.00 C ATOM 1714 C ASN A 107 34.744 82.729 4.131 1.00 0.00 C ATOM 1715 O ASN A 107 34.731 82.863 2.907 1.00 0.00 O ATOM 1716 CB ASN A 107 36.013 80.722 4.941 1.00 0.00 C ATOM 1717 CG ASN A 107 36.839 81.467 5.975 1.00 0.00 C ATOM 1718 OD1 ASN A 107 36.297 82.046 6.916 1.00 0.00 O ATOM 1719 ND2 ASN A 107 38.152 81.468 5.808 1.00 0.00 N ATOM 0 H ASN A 107 33.944 80.672 2.879 1.00 0.00 H new ATOM 0 HA ASN A 107 34.157 81.412 5.724 1.00 0.00 H new ATOM 0 HB2 ASN A 107 35.901 79.683 5.250 1.00 0.00 H new ATOM 0 HB3 ASN A 107 36.546 80.716 3.990 1.00 0.00 H new ATOM 0 HD21 ASN A 107 38.750 81.960 6.472 1.00 0.00 H new ATOM 0 HD22 ASN A 107 38.566 80.977 5.016 1.00 0.00 H new ATOM 1726 N GLN A 108 34.846 83.746 4.983 1.00 0.00 N ATOM 1727 CA GLN A 108 34.804 85.144 4.555 1.00 0.00 C ATOM 1728 C GLN A 108 33.432 85.460 3.961 1.00 0.00 C ATOM 1729 O GLN A 108 33.283 86.393 3.166 1.00 0.00 O ATOM 1730 CB GLN A 108 35.908 85.463 3.534 1.00 0.00 C ATOM 1731 CG GLN A 108 37.314 85.111 4.004 1.00 0.00 C ATOM 1732 CD GLN A 108 38.388 85.687 3.102 1.00 0.00 C ATOM 1733 OE1 GLN A 108 38.224 86.766 2.529 1.00 0.00 O ATOM 1734 NE2 GLN A 108 39.483 84.962 2.945 1.00 0.00 N ATOM 0 H GLN A 108 34.960 83.626 5.989 1.00 0.00 H new ATOM 0 HA GLN A 108 34.978 85.768 5.431 1.00 0.00 H new ATOM 0 HB2 GLN A 108 35.700 84.923 2.610 1.00 0.00 H new ATOM 0 HB3 GLN A 108 35.872 86.526 3.297 1.00 0.00 H new ATOM 0 HG2 GLN A 108 37.458 85.482 5.019 1.00 0.00 H new ATOM 0 HG3 GLN A 108 37.420 84.027 4.043 1.00 0.00 H new ATOM 0 HE21 GLN A 108 39.581 84.074 3.437 1.00 0.00 H new ATOM 0 HE22 GLN A 108 40.229 85.291 2.332 1.00 0.00 H new ATOM 1743 N ASP A 109 32.435 84.673 4.378 1.00 0.00 N ATOM 1744 CA ASP A 109 31.046 84.826 3.933 1.00 0.00 C ATOM 1745 C ASP A 109 30.900 84.504 2.440 1.00 0.00 C ATOM 1746 O ASP A 109 29.943 84.918 1.786 1.00 0.00 O ATOM 1747 CB ASP A 109 30.539 86.241 4.251 1.00 0.00 C ATOM 1748 CG ASP A 109 29.041 86.391 4.073 1.00 0.00 C ATOM 1749 OD1 ASP A 109 28.282 85.754 4.835 1.00 0.00 O ATOM 1750 OD2 ASP A 109 28.618 87.165 3.188 1.00 0.00 O ATOM 0 H ASP A 109 32.570 83.907 5.038 1.00 0.00 H new ATOM 0 HA ASP A 109 30.431 84.111 4.478 1.00 0.00 H new ATOM 0 HB2 ASP A 109 30.804 86.493 5.278 1.00 0.00 H new ATOM 0 HB3 ASP A 109 31.049 86.957 3.606 1.00 0.00 H new ATOM 1755 N LYS A 110 31.835 83.730 1.904 1.00 0.00 N ATOM 1756 CA LYS A 110 31.773 83.343 0.502 1.00 0.00 C ATOM 1757 C LYS A 110 32.054 81.855 0.328 1.00 0.00 C ATOM 1758 O LYS A 110 32.765 81.246 1.131 1.00 0.00 O ATOM 1759 CB LYS A 110 32.773 84.150 -0.333 1.00 0.00 C ATOM 1760 CG LYS A 110 34.232 83.875 0.012 1.00 0.00 C ATOM 1761 CD LYS A 110 35.185 84.574 -0.947 1.00 0.00 C ATOM 1762 CE LYS A 110 34.951 86.075 -0.970 1.00 0.00 C ATOM 1763 NZ LYS A 110 35.939 86.785 -1.823 1.00 0.00 N ATOM 0 H LYS A 110 32.638 83.361 2.414 1.00 0.00 H new ATOM 0 HA LYS A 110 30.762 83.554 0.153 1.00 0.00 H new ATOM 0 HB2 LYS A 110 32.612 83.929 -1.388 1.00 0.00 H new ATOM 0 HB3 LYS A 110 32.572 85.212 -0.196 1.00 0.00 H new ATOM 0 HG2 LYS A 110 34.433 84.208 1.030 1.00 0.00 H new ATOM 0 HG3 LYS A 110 34.415 82.801 -0.014 1.00 0.00 H new ATOM 0 HD2 LYS A 110 36.214 84.370 -0.652 1.00 0.00 H new ATOM 0 HD3 LYS A 110 35.055 84.169 -1.951 1.00 0.00 H new ATOM 0 HE2 LYS A 110 33.945 86.278 -1.337 1.00 0.00 H new ATOM 0 HE3 LYS A 110 35.005 86.465 0.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 35.740 87.806 -1.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 36.898 86.614 -1.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 35.871 86.433 -2.799 1.00 0.00 H new ATOM 1777 N TRP A 111 31.479 81.279 -0.716 1.00 0.00 N ATOM 1778 CA TRP A 111 31.801 79.919 -1.119 1.00 0.00 C ATOM 1779 C TRP A 111 32.975 79.940 -2.083 1.00 0.00 C ATOM 1780 O TRP A 111 32.839 80.372 -3.227 1.00 0.00 O ATOM 1781 CB TRP A 111 30.608 79.248 -1.799 1.00 0.00 C ATOM 1782 CG TRP A 111 29.555 78.758 -0.858 1.00 0.00 C ATOM 1783 CD1 TRP A 111 28.347 79.340 -0.601 1.00 0.00 C ATOM 1784 CD2 TRP A 111 29.611 77.572 -0.060 1.00 0.00 C ATOM 1785 NE1 TRP A 111 27.643 78.579 0.301 1.00 0.00 N ATOM 1786 CE2 TRP A 111 28.401 77.491 0.651 1.00 0.00 C ATOM 1787 CE3 TRP A 111 30.566 76.567 0.120 1.00 0.00 C ATOM 1788 CZ2 TRP A 111 28.124 76.447 1.527 1.00 0.00 C ATOM 1789 CZ3 TRP A 111 30.290 75.533 0.990 1.00 0.00 C ATOM 1790 CH2 TRP A 111 29.077 75.479 1.684 1.00 0.00 C ATOM 0 H TRP A 111 30.782 81.736 -1.304 1.00 0.00 H new ATOM 0 HA TRP A 111 32.056 79.351 -0.225 1.00 0.00 H new ATOM 0 HB2 TRP A 111 30.156 79.956 -2.494 1.00 0.00 H new ATOM 0 HB3 TRP A 111 30.969 78.407 -2.391 1.00 0.00 H new ATOM 0 HD1 TRP A 111 27.997 80.262 -1.041 1.00 0.00 H new ATOM 0 HE1 TRP A 111 26.709 78.789 0.653 1.00 0.00 H new ATOM 0 HE3 TRP A 111 31.504 76.600 -0.413 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 27.188 76.402 2.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 31.022 74.753 1.138 1.00 0.00 H new ATOM 0 HH2 TRP A 111 28.889 74.656 2.358 1.00 0.00 H new ATOM 1801 N ALA A 112 34.129 79.486 -1.627 1.00 0.00 N ATOM 1802 CA ALA A 112 35.315 79.502 -2.466 1.00 0.00 C ATOM 1803 C ALA A 112 36.172 78.274 -2.217 1.00 0.00 C ATOM 1804 O ALA A 112 35.984 77.567 -1.222 1.00 0.00 O ATOM 1805 CB ALA A 112 36.113 80.779 -2.234 1.00 0.00 C ATOM 0 H ALA A 112 34.270 79.106 -0.691 1.00 0.00 H new ATOM 0 HA ALA A 112 34.998 79.481 -3.509 1.00 0.00 H new ATOM 0 HB1 ALA A 112 36.998 80.775 -2.870 1.00 0.00 H new ATOM 0 HB2 ALA A 112 35.495 81.643 -2.477 1.00 0.00 H new ATOM 0 HB3 ALA A 112 36.417 80.833 -1.189 1.00 0.00 H new ATOM 1811 N TRP A 113 37.113 78.035 -3.121 1.00 0.00 N ATOM 1812 CA TRP A 113 37.980 76.870 -3.044 1.00 0.00 C ATOM 1813 C TRP A 113 39.072 77.090 -2.010 1.00 0.00 C ATOM 1814 O TRP A 113 39.781 78.093 -2.056 1.00 0.00 O ATOM 1815 CB TRP A 113 38.636 76.585 -4.401 1.00 0.00 C ATOM 1816 CG TRP A 113 37.673 76.393 -5.535 1.00 0.00 C ATOM 1817 CD1 TRP A 113 36.328 76.171 -5.453 1.00 0.00 C ATOM 1818 CD2 TRP A 113 37.993 76.400 -6.930 1.00 0.00 C ATOM 1819 NE1 TRP A 113 35.794 76.045 -6.714 1.00 0.00 N ATOM 1820 CE2 TRP A 113 36.798 76.178 -7.637 1.00 0.00 C ATOM 1821 CE3 TRP A 113 39.179 76.571 -7.650 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 36.753 76.126 -9.029 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 39.134 76.520 -9.031 1.00 0.00 C ATOM 1824 CH2 TRP A 113 37.929 76.298 -9.707 1.00 0.00 C ATOM 0 H TRP A 113 37.295 78.639 -3.922 1.00 0.00 H new ATOM 0 HA TRP A 113 37.364 76.018 -2.756 1.00 0.00 H new ATOM 0 HB2 TRP A 113 39.305 77.410 -4.646 1.00 0.00 H new ATOM 0 HB3 TRP A 113 39.253 75.691 -4.310 1.00 0.00 H new ATOM 0 HD1 TRP A 113 35.766 76.104 -4.533 1.00 0.00 H new ATOM 0 HE1 TRP A 113 34.810 75.879 -6.928 1.00 0.00 H new ATOM 0 HE3 TRP A 113 40.114 76.740 -7.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 35.824 75.956 -9.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 40.044 76.654 -9.597 1.00 0.00 H new ATOM 0 HH2 TRP A 113 37.927 76.262 -10.786 1.00 0.00 H new ATOM 1835 N ASN A 114 39.180 76.172 -1.070 1.00 0.00 N ATOM 1836 CA ASN A 114 40.278 76.184 -0.114 1.00 0.00 C ATOM 1837 C ASN A 114 41.031 74.873 -0.212 1.00 0.00 C ATOM 1838 O ASN A 114 40.432 73.803 -0.110 1.00 0.00 O ATOM 1839 CB ASN A 114 39.768 76.392 1.311 1.00 0.00 C ATOM 1840 CG ASN A 114 40.887 76.512 2.333 1.00 0.00 C ATOM 1841 OD1 ASN A 114 40.722 76.130 3.491 1.00 0.00 O ATOM 1842 ND2 ASN A 114 42.020 77.061 1.929 1.00 0.00 N ATOM 0 H ASN A 114 38.520 75.404 -0.945 1.00 0.00 H new ATOM 0 HA ASN A 114 40.943 77.014 -0.352 1.00 0.00 H new ATOM 0 HB2 ASN A 114 39.156 77.293 1.344 1.00 0.00 H new ATOM 0 HB3 ASN A 114 39.122 75.558 1.585 1.00 0.00 H new ATOM 0 HD21 ASN A 114 42.792 77.179 2.585 1.00 0.00 H new ATOM 0 HD22 ASN A 114 42.122 77.366 0.961 1.00 0.00 H new ATOM 1849 N ASP A 115 42.330 74.956 -0.422 1.00 0.00 N ATOM 1850 CA ASP A 115 43.131 73.765 -0.664 1.00 0.00 C ATOM 1851 C ASP A 115 43.555 73.097 0.636 1.00 0.00 C ATOM 1852 O ASP A 115 44.113 73.738 1.533 1.00 0.00 O ATOM 1853 CB ASP A 115 44.364 74.096 -1.495 1.00 0.00 C ATOM 1854 CG ASP A 115 45.224 72.874 -1.736 1.00 0.00 C ATOM 1855 OD1 ASP A 115 44.954 72.138 -2.706 1.00 0.00 O ATOM 1856 OD2 ASP A 115 46.171 72.643 -0.950 1.00 0.00 O ATOM 0 H ASP A 115 42.855 75.831 -0.431 1.00 0.00 H new ATOM 0 HA ASP A 115 42.503 73.068 -1.219 1.00 0.00 H new ATOM 0 HB2 ASP A 115 44.055 74.518 -2.452 1.00 0.00 H new ATOM 0 HB3 ASP A 115 44.952 74.859 -0.985 1.00 0.00 H new ATOM 1861 N VAL A 116 43.283 71.803 0.718 1.00 0.00 N ATOM 1862 CA VAL A 116 43.661 70.986 1.862 1.00 0.00 C ATOM 1863 C VAL A 116 44.179 69.635 1.376 1.00 0.00 C ATOM 1864 O VAL A 116 43.908 69.242 0.241 1.00 0.00 O ATOM 1865 CB VAL A 116 42.470 70.765 2.827 1.00 0.00 C ATOM 1866 CG1 VAL A 116 42.112 72.052 3.550 1.00 0.00 C ATOM 1867 CG2 VAL A 116 41.260 70.228 2.078 1.00 0.00 C ATOM 0 H VAL A 116 42.791 71.287 -0.011 1.00 0.00 H new ATOM 0 HA VAL A 116 44.442 71.515 2.408 1.00 0.00 H new ATOM 0 HB VAL A 116 42.774 70.026 3.569 1.00 0.00 H new ATOM 0 HG11 VAL A 116 41.273 71.871 4.222 1.00 0.00 H new ATOM 0 HG12 VAL A 116 42.971 72.396 4.127 1.00 0.00 H new ATOM 0 HG13 VAL A 116 41.835 72.814 2.821 1.00 0.00 H new ATOM 0 HG21 VAL A 116 40.436 70.081 2.776 1.00 0.00 H new ATOM 0 HG22 VAL A 116 40.962 70.941 1.310 1.00 0.00 H new ATOM 0 HG23 VAL A 116 41.514 69.277 1.611 1.00 0.00 H new ATOM 1877 N PRO A 117 44.960 68.919 2.205 1.00 0.00 N ATOM 1878 CA PRO A 117 45.453 67.580 1.860 1.00 0.00 C ATOM 1879 C PRO A 117 44.313 66.624 1.514 1.00 0.00 C ATOM 1880 O PRO A 117 43.287 66.605 2.191 1.00 0.00 O ATOM 1881 CB PRO A 117 46.172 67.109 3.134 1.00 0.00 C ATOM 1882 CG PRO A 117 45.756 68.058 4.211 1.00 0.00 C ATOM 1883 CD PRO A 117 45.428 69.353 3.528 1.00 0.00 C ATOM 0 HA PRO A 117 46.098 67.601 0.981 1.00 0.00 H new ATOM 0 HB2 PRO A 117 45.893 66.086 3.385 1.00 0.00 H new ATOM 0 HB3 PRO A 117 47.254 67.120 2.999 1.00 0.00 H new ATOM 0 HG2 PRO A 117 44.892 67.675 4.754 1.00 0.00 H new ATOM 0 HG3 PRO A 117 46.555 68.194 4.939 1.00 0.00 H new ATOM 0 HD2 PRO A 117 44.660 69.910 4.065 1.00 0.00 H new ATOM 0 HD3 PRO A 117 46.300 70.003 3.455 1.00 0.00 H new ATOM 1891 N CYS A 118 44.495 65.819 0.474 1.00 0.00 N ATOM 1892 CA CYS A 118 43.454 64.886 0.039 1.00 0.00 C ATOM 1893 C CYS A 118 43.258 63.751 1.043 1.00 0.00 C ATOM 1894 O CYS A 118 42.310 62.968 0.941 1.00 0.00 O ATOM 1895 CB CYS A 118 43.783 64.327 -1.345 1.00 0.00 C ATOM 1896 SG CYS A 118 43.686 65.563 -2.675 1.00 0.00 S ATOM 0 H CYS A 118 45.348 65.791 -0.084 1.00 0.00 H new ATOM 0 HA CYS A 118 42.517 65.439 -0.018 1.00 0.00 H new ATOM 0 HB2 CYS A 118 44.787 63.904 -1.327 1.00 0.00 H new ATOM 0 HB3 CYS A 118 43.097 63.510 -1.570 1.00 0.00 H new ATOM 1901 N ASN A 119 44.148 63.670 2.019 1.00 0.00 N ATOM 1902 CA ASN A 119 44.033 62.675 3.077 1.00 0.00 C ATOM 1903 C ASN A 119 43.415 63.289 4.326 1.00 0.00 C ATOM 1904 O ASN A 119 43.451 62.692 5.401 1.00 0.00 O ATOM 1905 CB ASN A 119 45.404 62.077 3.401 1.00 0.00 C ATOM 1906 CG ASN A 119 46.423 63.122 3.815 1.00 0.00 C ATOM 1907 OD1 ASN A 119 47.099 63.716 2.973 1.00 0.00 O ATOM 1908 ND2 ASN A 119 46.549 63.351 5.111 1.00 0.00 N ATOM 0 H ASN A 119 44.960 64.282 2.102 1.00 0.00 H new ATOM 0 HA ASN A 119 43.380 61.876 2.726 1.00 0.00 H new ATOM 0 HB2 ASN A 119 45.295 61.346 4.202 1.00 0.00 H new ATOM 0 HB3 ASN A 119 45.776 61.540 2.528 1.00 0.00 H new ATOM 0 HD21 ASN A 119 47.224 64.040 5.444 1.00 0.00 H new ATOM 0 HD22 ASN A 119 45.971 62.839 5.778 1.00 0.00 H new ATOM 1915 N PHE A 120 42.851 64.479 4.170 1.00 0.00 N ATOM 1916 CA PHE A 120 42.151 65.159 5.251 1.00 0.00 C ATOM 1917 C PHE A 120 40.683 64.747 5.249 1.00 0.00 C ATOM 1918 O PHE A 120 40.088 64.577 4.187 1.00 0.00 O ATOM 1919 CB PHE A 120 42.289 66.677 5.070 1.00 0.00 C ATOM 1920 CG PHE A 120 41.482 67.513 6.027 1.00 0.00 C ATOM 1921 CD1 PHE A 120 41.785 67.537 7.378 1.00 0.00 C ATOM 1922 CD2 PHE A 120 40.425 68.286 5.567 1.00 0.00 C ATOM 1923 CE1 PHE A 120 41.048 68.312 8.254 1.00 0.00 C ATOM 1924 CE2 PHE A 120 39.686 69.065 6.438 1.00 0.00 C ATOM 1925 CZ PHE A 120 39.997 69.077 7.783 1.00 0.00 C ATOM 0 H PHE A 120 42.866 64.999 3.293 1.00 0.00 H new ATOM 0 HA PHE A 120 42.587 64.879 6.210 1.00 0.00 H new ATOM 0 HB2 PHE A 120 43.340 66.945 5.176 1.00 0.00 H new ATOM 0 HB3 PHE A 120 41.995 66.934 4.052 1.00 0.00 H new ATOM 0 HD1 PHE A 120 42.606 66.944 7.752 1.00 0.00 H new ATOM 0 HD2 PHE A 120 40.177 68.279 4.516 1.00 0.00 H new ATOM 0 HE1 PHE A 120 41.293 68.320 9.306 1.00 0.00 H new ATOM 0 HE2 PHE A 120 38.867 69.663 6.067 1.00 0.00 H new ATOM 0 HZ PHE A 120 39.420 69.683 8.466 1.00 0.00 H new ATOM 1935 N GLU A 121 40.113 64.551 6.428 1.00 0.00 N ATOM 1936 CA GLU A 121 38.702 64.205 6.538 1.00 0.00 C ATOM 1937 C GLU A 121 37.842 65.461 6.462 1.00 0.00 C ATOM 1938 O GLU A 121 38.040 66.405 7.230 1.00 0.00 O ATOM 1939 CB GLU A 121 38.404 63.462 7.847 1.00 0.00 C ATOM 1940 CG GLU A 121 39.213 62.190 8.049 1.00 0.00 C ATOM 1941 CD GLU A 121 40.524 62.434 8.766 1.00 0.00 C ATOM 1942 OE1 GLU A 121 40.541 62.378 10.014 1.00 0.00 O ATOM 1943 OE2 GLU A 121 41.543 62.677 8.091 1.00 0.00 O ATOM 0 H GLU A 121 40.603 64.625 7.320 1.00 0.00 H new ATOM 0 HA GLU A 121 38.462 63.544 5.705 1.00 0.00 H new ATOM 0 HB2 GLU A 121 38.594 64.135 8.683 1.00 0.00 H new ATOM 0 HB3 GLU A 121 37.344 63.211 7.874 1.00 0.00 H new ATOM 0 HG2 GLU A 121 38.620 61.475 8.619 1.00 0.00 H new ATOM 0 HG3 GLU A 121 39.414 61.735 7.079 1.00 0.00 H new ATOM 1950 N ALA A 122 36.897 65.470 5.537 1.00 0.00 N ATOM 1951 CA ALA A 122 35.994 66.596 5.361 1.00 0.00 C ATOM 1952 C ALA A 122 34.722 66.140 4.662 1.00 0.00 C ATOM 1953 O ALA A 122 34.451 64.938 4.568 1.00 0.00 O ATOM 1954 CB ALA A 122 36.669 67.713 4.577 1.00 0.00 C ATOM 0 H ALA A 122 36.734 64.700 4.888 1.00 0.00 H new ATOM 0 HA ALA A 122 35.731 66.988 6.344 1.00 0.00 H new ATOM 0 HB1 ALA A 122 35.975 68.545 4.458 1.00 0.00 H new ATOM 0 HB2 ALA A 122 37.553 68.053 5.116 1.00 0.00 H new ATOM 0 HB3 ALA A 122 36.963 67.342 3.595 1.00 0.00 H new ATOM 1960 N SER A 123 33.927 67.096 4.204 1.00 0.00 N ATOM 1961 CA SER A 123 32.708 66.793 3.477 1.00 0.00 C ATOM 1962 C SER A 123 33.025 66.566 2.001 1.00 0.00 C ATOM 1963 O SER A 123 34.163 66.752 1.573 1.00 0.00 O ATOM 1964 CB SER A 123 31.701 67.926 3.653 1.00 0.00 C ATOM 1965 OG SER A 123 31.482 68.189 5.028 1.00 0.00 O ATOM 0 H SER A 123 34.108 68.093 4.325 1.00 0.00 H new ATOM 0 HA SER A 123 32.267 65.880 3.876 1.00 0.00 H new ATOM 0 HB2 SER A 123 32.068 68.826 3.159 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.759 67.660 3.173 1.00 0.00 H new ATOM 0 HG SER A 123 32.285 68.597 5.415 1.00 0.00 H new ATOM 1971 N ARG A 124 32.027 66.179 1.219 1.00 0.00 N ATOM 1972 CA ARG A 124 32.264 65.803 -0.170 1.00 0.00 C ATOM 1973 C ARG A 124 31.020 65.990 -1.024 1.00 0.00 C ATOM 1974 O ARG A 124 29.900 65.974 -0.516 1.00 0.00 O ATOM 1975 CB ARG A 124 32.711 64.342 -0.242 1.00 0.00 C ATOM 1976 CG ARG A 124 31.846 63.410 0.591 1.00 0.00 C ATOM 1977 CD ARG A 124 32.330 61.970 0.538 1.00 0.00 C ATOM 1978 NE ARG A 124 32.084 61.343 -0.761 1.00 0.00 N ATOM 1979 CZ ARG A 124 31.398 60.208 -0.915 1.00 0.00 C ATOM 1980 NH1 ARG A 124 30.870 59.598 0.139 1.00 0.00 N ATOM 1981 NH2 ARG A 124 31.240 59.679 -2.121 1.00 0.00 N ATOM 0 H ARG A 124 31.054 66.117 1.518 1.00 0.00 H new ATOM 0 HA ARG A 124 33.046 66.455 -0.560 1.00 0.00 H new ATOM 0 HB2 ARG A 124 32.692 64.014 -1.281 1.00 0.00 H new ATOM 0 HB3 ARG A 124 33.744 64.268 0.097 1.00 0.00 H new ATOM 0 HG2 ARG A 124 31.841 63.751 1.626 1.00 0.00 H new ATOM 0 HG3 ARG A 124 30.817 63.458 0.235 1.00 0.00 H new ATOM 0 HD2 ARG A 124 33.398 61.941 0.755 1.00 0.00 H new ATOM 0 HD3 ARG A 124 31.830 61.393 1.316 1.00 0.00 H new ATOM 0 HE ARG A 124 32.457 61.798 -1.594 1.00 0.00 H new ATOM 0 HH11 ARG A 124 30.988 59.996 1.071 1.00 0.00 H new ATOM 0 HH12 ARG A 124 30.347 58.731 0.017 1.00 0.00 H new ATOM 0 HH21 ARG A 124 31.644 60.139 -2.937 1.00 0.00 H new ATOM 0 HH22 ARG A 124 30.715 58.812 -2.233 1.00 0.00 H new ATOM 1995 N ILE A 125 31.230 66.172 -2.322 1.00 0.00 N ATOM 1996 CA ILE A 125 30.136 66.218 -3.283 1.00 0.00 C ATOM 1997 C ILE A 125 30.417 65.237 -4.414 1.00 0.00 C ATOM 1998 O ILE A 125 31.467 65.306 -5.055 1.00 0.00 O ATOM 1999 CB ILE A 125 29.947 67.625 -3.894 1.00 0.00 C ATOM 2000 CG1 ILE A 125 29.888 68.691 -2.802 1.00 0.00 C ATOM 2001 CG2 ILE A 125 28.677 67.666 -4.736 1.00 0.00 C ATOM 2002 CD1 ILE A 125 29.865 70.105 -3.344 1.00 0.00 C ATOM 0 H ILE A 125 32.155 66.291 -2.735 1.00 0.00 H new ATOM 0 HA ILE A 125 29.224 65.955 -2.747 1.00 0.00 H new ATOM 0 HB ILE A 125 30.805 67.837 -4.532 1.00 0.00 H new ATOM 0 HG12 ILE A 125 28.999 68.528 -2.193 1.00 0.00 H new ATOM 0 HG13 ILE A 125 30.750 68.576 -2.145 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.554 68.662 -5.161 1.00 0.00 H new ATOM 0 HG22 ILE A 125 28.750 66.934 -5.541 1.00 0.00 H new ATOM 0 HG23 ILE A 125 27.817 67.431 -4.109 1.00 0.00 H new ATOM 0 HD11 ILE A 125 29.823 70.812 -2.515 1.00 0.00 H new ATOM 0 HD12 ILE A 125 30.767 70.285 -3.929 1.00 0.00 H new ATOM 0 HD13 ILE A 125 28.989 70.237 -3.978 1.00 0.00 H new ATOM 2014 N CYS A 126 29.496 64.319 -4.647 1.00 0.00 N ATOM 2015 CA CYS A 126 29.649 63.354 -5.723 1.00 0.00 C ATOM 2016 C CYS A 126 28.703 63.710 -6.864 1.00 0.00 C ATOM 2017 O CYS A 126 27.540 64.038 -6.633 1.00 0.00 O ATOM 2018 CB CYS A 126 29.366 61.938 -5.209 1.00 0.00 C ATOM 2019 SG CYS A 126 30.112 60.609 -6.209 1.00 0.00 S ATOM 0 H CYS A 126 28.636 64.221 -4.108 1.00 0.00 H new ATOM 0 HA CYS A 126 30.674 63.384 -6.091 1.00 0.00 H new ATOM 0 HB2 CYS A 126 29.734 61.856 -4.186 1.00 0.00 H new ATOM 0 HB3 CYS A 126 28.287 61.787 -5.173 1.00 0.00 H new ATOM 2024 N LYS A 127 29.207 63.671 -8.085 1.00 0.00 N ATOM 2025 CA LYS A 127 28.421 64.042 -9.250 1.00 0.00 C ATOM 2026 C LYS A 127 28.289 62.868 -10.215 1.00 0.00 C ATOM 2027 O LYS A 127 29.285 62.281 -10.633 1.00 0.00 O ATOM 2028 CB LYS A 127 29.069 65.234 -9.964 1.00 0.00 C ATOM 2029 CG LYS A 127 28.387 65.614 -11.271 1.00 0.00 C ATOM 2030 CD LYS A 127 29.102 66.763 -11.963 1.00 0.00 C ATOM 2031 CE LYS A 127 28.459 67.077 -13.303 1.00 0.00 C ATOM 2032 NZ LYS A 127 29.092 68.245 -13.972 1.00 0.00 N ATOM 0 H LYS A 127 30.163 63.384 -8.297 1.00 0.00 H new ATOM 0 HA LYS A 127 27.424 64.323 -8.912 1.00 0.00 H new ATOM 0 HB2 LYS A 127 29.058 66.095 -9.296 1.00 0.00 H new ATOM 0 HB3 LYS A 127 30.114 65.000 -10.165 1.00 0.00 H new ATOM 0 HG2 LYS A 127 28.362 64.749 -11.934 1.00 0.00 H new ATOM 0 HG3 LYS A 127 27.352 65.895 -11.074 1.00 0.00 H new ATOM 0 HD2 LYS A 127 29.076 67.648 -11.327 1.00 0.00 H new ATOM 0 HD3 LYS A 127 30.151 66.507 -12.110 1.00 0.00 H new ATOM 0 HE2 LYS A 127 28.533 66.205 -13.952 1.00 0.00 H new ATOM 0 HE3 LYS A 127 27.397 67.276 -13.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 28.904 68.204 -14.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 28.697 69.125 -13.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 30.119 68.224 -13.808 1.00 0.00 H new ATOM 2046 N ILE A 128 27.059 62.532 -10.559 1.00 0.00 N ATOM 2047 CA ILE A 128 26.801 61.483 -11.534 1.00 0.00 C ATOM 2048 C ILE A 128 26.205 62.105 -12.797 1.00 0.00 C ATOM 2049 O ILE A 128 25.428 63.065 -12.716 1.00 0.00 O ATOM 2050 CB ILE A 128 25.845 60.393 -10.968 1.00 0.00 C ATOM 2051 CG1 ILE A 128 25.895 59.123 -11.821 1.00 0.00 C ATOM 2052 CG2 ILE A 128 24.416 60.910 -10.890 1.00 0.00 C ATOM 2053 CD1 ILE A 128 25.002 58.013 -11.309 1.00 0.00 C ATOM 0 H ILE A 128 26.220 62.970 -10.178 1.00 0.00 H new ATOM 0 HA ILE A 128 27.746 60.994 -11.771 1.00 0.00 H new ATOM 0 HB ILE A 128 26.183 60.149 -9.961 1.00 0.00 H new ATOM 0 HG12 ILE A 128 25.604 59.370 -12.842 1.00 0.00 H new ATOM 0 HG13 ILE A 128 26.923 58.762 -11.860 1.00 0.00 H new ATOM 0 HG21 ILE A 128 23.768 60.129 -10.491 1.00 0.00 H new ATOM 0 HG22 ILE A 128 24.379 61.781 -10.236 1.00 0.00 H new ATOM 0 HG23 ILE A 128 24.076 61.190 -11.887 1.00 0.00 H new ATOM 0 HD11 ILE A 128 25.089 57.145 -11.963 1.00 0.00 H new ATOM 0 HD12 ILE A 128 25.306 57.738 -10.299 1.00 0.00 H new ATOM 0 HD13 ILE A 128 23.967 58.355 -11.296 1.00 0.00 H new ATOM 2065 N PRO A 129 26.592 61.612 -13.982 1.00 0.00 N ATOM 2066 CA PRO A 129 25.999 62.064 -15.235 1.00 0.00 C ATOM 2067 C PRO A 129 24.552 61.614 -15.347 1.00 0.00 C ATOM 2068 O PRO A 129 24.192 60.543 -14.855 1.00 0.00 O ATOM 2069 CB PRO A 129 26.841 61.391 -16.326 1.00 0.00 C ATOM 2070 CG PRO A 129 28.015 60.781 -15.631 1.00 0.00 C ATOM 2071 CD PRO A 129 27.628 60.594 -14.192 1.00 0.00 C ATOM 0 HA PRO A 129 25.995 63.151 -15.312 1.00 0.00 H new ATOM 0 HB2 PRO A 129 26.262 60.631 -16.851 1.00 0.00 H new ATOM 0 HB3 PRO A 129 27.164 62.117 -17.072 1.00 0.00 H new ATOM 0 HG2 PRO A 129 28.279 59.826 -16.086 1.00 0.00 H new ATOM 0 HG3 PRO A 129 28.890 61.426 -15.714 1.00 0.00 H new ATOM 0 HD2 PRO A 129 27.248 59.590 -14.006 1.00 0.00 H new ATOM 0 HD3 PRO A 129 28.477 60.742 -13.525 1.00 0.00 H new ATOM 2079 N GLY A 130 23.724 62.431 -15.981 1.00 0.00 N ATOM 2080 CA GLY A 130 22.341 62.057 -16.205 1.00 0.00 C ATOM 2081 C GLY A 130 22.214 61.002 -17.281 1.00 0.00 C ATOM 2082 O GLY A 130 21.595 61.228 -18.319 1.00 0.00 O ATOM 0 H GLY A 130 23.985 63.347 -16.345 1.00 0.00 H new ATOM 0 HA2 GLY A 130 21.910 61.683 -15.276 1.00 0.00 H new ATOM 0 HA3 GLY A 130 21.767 62.939 -16.490 1.00 0.00 H new ATOM 2086 N THR A 131 22.789 59.836 -17.016 1.00 0.00 N ATOM 2087 CA THR A 131 22.827 58.740 -17.974 1.00 0.00 C ATOM 2088 C THR A 131 21.502 57.965 -17.974 1.00 0.00 C ATOM 2089 O THR A 131 21.421 56.819 -18.414 1.00 0.00 O ATOM 2090 CB THR A 131 24.020 57.800 -17.672 1.00 0.00 C ATOM 2091 OG1 THR A 131 24.112 56.762 -18.657 1.00 0.00 O ATOM 2092 CG2 THR A 131 23.905 57.189 -16.282 1.00 0.00 C ATOM 0 H THR A 131 23.243 59.624 -16.128 1.00 0.00 H new ATOM 0 HA THR A 131 22.966 59.160 -18.970 1.00 0.00 H new ATOM 0 HB THR A 131 24.928 58.402 -17.708 1.00 0.00 H new ATOM 0 HG1 THR A 131 23.216 56.416 -18.852 1.00 0.00 H new ATOM 0 HG21 THR A 131 24.757 56.534 -16.101 1.00 0.00 H new ATOM 0 HG22 THR A 131 23.892 57.983 -15.535 1.00 0.00 H new ATOM 0 HG23 THR A 131 22.983 56.612 -16.214 1.00 0.00 H new ATOM 2100 N THR A 132 20.449 58.637 -17.529 1.00 0.00 N ATOM 2101 CA THR A 132 19.116 58.057 -17.469 1.00 0.00 C ATOM 2102 C THR A 132 18.562 57.785 -18.870 1.00 0.00 C ATOM 2103 O THR A 132 17.541 57.128 -19.015 1.00 0.00 O ATOM 2104 CB THR A 132 18.151 58.990 -16.706 1.00 0.00 C ATOM 2105 OG1 THR A 132 16.822 58.453 -16.700 1.00 0.00 O ATOM 2106 CG2 THR A 132 18.132 60.371 -17.334 1.00 0.00 C ATOM 0 H THR A 132 20.496 59.601 -17.199 1.00 0.00 H new ATOM 0 HA THR A 132 19.197 57.109 -16.938 1.00 0.00 H new ATOM 0 HB THR A 132 18.508 59.068 -15.679 1.00 0.00 H new ATOM 0 HG1 THR A 132 16.723 57.816 -17.438 1.00 0.00 H new ATOM 0 HG21 THR A 132 17.446 61.013 -16.781 1.00 0.00 H new ATOM 0 HG22 THR A 132 19.134 60.799 -17.302 1.00 0.00 H new ATOM 0 HG23 THR A 132 17.802 60.295 -18.370 1.00 0.00 H new ATOM 2114 N LEU A 133 19.228 58.305 -19.897 1.00 0.00 N ATOM 2115 CA LEU A 133 18.825 58.041 -21.272 1.00 0.00 C ATOM 2116 C LEU A 133 19.212 56.618 -21.665 1.00 0.00 C ATOM 2117 O LEU A 133 18.453 55.907 -22.321 1.00 0.00 O ATOM 2118 CB LEU A 133 19.460 59.047 -22.248 1.00 0.00 C ATOM 2119 CG LEU A 133 20.993 59.046 -22.330 1.00 0.00 C ATOM 2120 CD1 LEU A 133 21.450 59.735 -23.602 1.00 0.00 C ATOM 2121 CD2 LEU A 133 21.612 59.736 -21.127 1.00 0.00 C ATOM 0 H LEU A 133 20.045 58.908 -19.803 1.00 0.00 H new ATOM 0 HA LEU A 133 17.742 58.153 -21.332 1.00 0.00 H new ATOM 0 HB2 LEU A 133 19.065 58.852 -23.245 1.00 0.00 H new ATOM 0 HB3 LEU A 133 19.134 60.048 -21.966 1.00 0.00 H new ATOM 0 HG LEU A 133 21.324 58.007 -22.338 1.00 0.00 H new ATOM 0 HD11 LEU A 133 22.539 59.728 -23.649 1.00 0.00 H new ATOM 0 HD12 LEU A 133 21.046 59.208 -24.466 1.00 0.00 H new ATOM 0 HD13 LEU A 133 21.093 60.765 -23.606 1.00 0.00 H new ATOM 0 HD21 LEU A 133 22.698 59.718 -21.216 1.00 0.00 H new ATOM 0 HD22 LEU A 133 21.269 60.770 -21.084 1.00 0.00 H new ATOM 0 HD23 LEU A 133 21.314 59.216 -20.216 1.00 0.00 H new ATOM 2133 N ASN A 134 20.400 56.213 -21.253 1.00 0.00 N ATOM 2134 CA ASN A 134 20.893 54.872 -21.529 1.00 0.00 C ATOM 2135 C ASN A 134 20.452 53.897 -20.443 1.00 0.00 C ATOM 2136 O ASN A 134 19.949 52.812 -20.731 1.00 0.00 O ATOM 2137 CB ASN A 134 22.422 54.886 -21.646 1.00 0.00 C ATOM 2138 CG ASN A 134 23.014 53.497 -21.818 1.00 0.00 C ATOM 2139 OD1 ASN A 134 23.068 52.966 -22.927 1.00 0.00 O ATOM 2140 ND2 ASN A 134 23.496 52.915 -20.731 1.00 0.00 N ATOM 0 H ASN A 134 21.046 56.797 -20.722 1.00 0.00 H new ATOM 0 HA ASN A 134 20.470 54.538 -22.476 1.00 0.00 H new ATOM 0 HB2 ASN A 134 22.711 55.506 -22.494 1.00 0.00 H new ATOM 0 HB3 ASN A 134 22.846 55.348 -20.754 1.00 0.00 H new ATOM 0 HD21 ASN A 134 23.931 51.995 -20.795 1.00 0.00 H new ATOM 0 HD22 ASN A 134 23.433 53.387 -19.829 1.00 0.00 H new ATOM 2147 N ALA A 135 20.619 54.301 -19.191 1.00 0.00 N ATOM 2148 CA ALA A 135 20.352 53.423 -18.060 1.00 0.00 C ATOM 2149 C ALA A 135 18.907 53.524 -17.576 1.00 0.00 C ATOM 2150 O ALA A 135 18.604 53.146 -16.446 1.00 0.00 O ATOM 2151 CB ALA A 135 21.313 53.732 -16.922 1.00 0.00 C ATOM 0 H ALA A 135 20.939 55.234 -18.933 1.00 0.00 H new ATOM 0 HA ALA A 135 20.506 52.399 -18.399 1.00 0.00 H new ATOM 0 HB1 ALA A 135 21.106 53.070 -16.081 1.00 0.00 H new ATOM 0 HB2 ALA A 135 22.338 53.579 -17.260 1.00 0.00 H new ATOM 0 HB3 ALA A 135 21.185 54.768 -16.609 1.00 0.00 H new ATOM 2157 N GLU A 136 18.016 54.004 -18.437 1.00 0.00 N ATOM 2158 CA GLU A 136 16.605 54.149 -18.076 1.00 0.00 C ATOM 2159 C GLU A 136 15.996 52.808 -17.664 1.00 0.00 C ATOM 2160 O GLU A 136 15.523 52.649 -16.537 1.00 0.00 O ATOM 2161 CB GLU A 136 15.804 54.766 -19.229 1.00 0.00 C ATOM 2162 CG GLU A 136 16.159 54.215 -20.600 1.00 0.00 C ATOM 2163 CD GLU A 136 14.956 53.659 -21.331 1.00 0.00 C ATOM 2164 OE1 GLU A 136 14.158 54.456 -21.868 1.00 0.00 O ATOM 2165 OE2 GLU A 136 14.804 52.424 -21.370 1.00 0.00 O ATOM 0 H GLU A 136 18.242 54.299 -19.387 1.00 0.00 H new ATOM 0 HA GLU A 136 16.554 54.822 -17.220 1.00 0.00 H new ATOM 0 HB2 GLU A 136 14.742 54.601 -19.048 1.00 0.00 H new ATOM 0 HB3 GLU A 136 15.963 55.844 -19.231 1.00 0.00 H new ATOM 0 HG2 GLU A 136 16.611 55.005 -21.200 1.00 0.00 H new ATOM 0 HG3 GLU A 136 16.908 53.430 -20.490 1.00 0.00 H new ATOM 2172 N ASN A 137 16.028 51.843 -18.572 1.00 0.00 N ATOM 2173 CA ASN A 137 15.487 50.517 -18.306 1.00 0.00 C ATOM 2174 C ASN A 137 16.372 49.748 -17.333 1.00 0.00 C ATOM 2175 O ASN A 137 15.893 48.886 -16.605 1.00 0.00 O ATOM 2176 CB ASN A 137 15.315 49.727 -19.611 1.00 0.00 C ATOM 2177 CG ASN A 137 16.588 49.661 -20.435 1.00 0.00 C ATOM 2178 OD1 ASN A 137 17.426 48.784 -20.238 1.00 0.00 O ATOM 2179 ND2 ASN A 137 16.735 50.583 -21.374 1.00 0.00 N ATOM 0 H ASN A 137 16.425 51.954 -19.505 1.00 0.00 H new ATOM 0 HA ASN A 137 14.507 50.644 -17.846 1.00 0.00 H new ATOM 0 HB2 ASN A 137 14.988 48.714 -19.376 1.00 0.00 H new ATOM 0 HB3 ASN A 137 14.526 50.187 -20.207 1.00 0.00 H new ATOM 0 HD21 ASN A 137 17.567 50.581 -21.965 1.00 0.00 H new ATOM 0 HD22 ASN A 137 16.017 51.295 -21.507 1.00 0.00 H new ATOM 2186 N LEU A 138 17.657 50.077 -17.306 1.00 0.00 N ATOM 2187 CA LEU A 138 18.585 49.435 -16.384 1.00 0.00 C ATOM 2188 C LEU A 138 18.182 49.769 -14.949 1.00 0.00 C ATOM 2189 O LEU A 138 18.067 48.887 -14.100 1.00 0.00 O ATOM 2190 CB LEU A 138 20.022 49.898 -16.680 1.00 0.00 C ATOM 2191 CG LEU A 138 21.160 49.049 -16.083 1.00 0.00 C ATOM 2192 CD1 LEU A 138 21.293 49.261 -14.582 1.00 0.00 C ATOM 2193 CD2 LEU A 138 20.942 47.575 -16.391 1.00 0.00 C ATOM 0 H LEU A 138 18.079 50.782 -17.910 1.00 0.00 H new ATOM 0 HA LEU A 138 18.547 48.353 -16.513 1.00 0.00 H new ATOM 0 HB2 LEU A 138 20.153 49.930 -17.762 1.00 0.00 H new ATOM 0 HB3 LEU A 138 20.132 50.919 -16.315 1.00 0.00 H new ATOM 0 HG LEU A 138 22.091 49.375 -16.547 1.00 0.00 H new ATOM 0 HD11 LEU A 138 22.106 48.645 -14.198 1.00 0.00 H new ATOM 0 HD12 LEU A 138 21.507 50.311 -14.380 1.00 0.00 H new ATOM 0 HD13 LEU A 138 20.362 48.979 -14.091 1.00 0.00 H new ATOM 0 HD21 LEU A 138 21.755 46.990 -15.962 1.00 0.00 H new ATOM 0 HD22 LEU A 138 19.995 47.250 -15.961 1.00 0.00 H new ATOM 0 HD23 LEU A 138 20.920 47.428 -17.471 1.00 0.00 H new ATOM 2205 N TYR A 139 17.942 51.051 -14.699 1.00 0.00 N ATOM 2206 CA TYR A 139 17.525 51.513 -13.383 1.00 0.00 C ATOM 2207 C TYR A 139 16.091 51.066 -13.098 1.00 0.00 C ATOM 2208 O TYR A 139 15.690 50.914 -11.943 1.00 0.00 O ATOM 2209 CB TYR A 139 17.642 53.040 -13.311 1.00 0.00 C ATOM 2210 CG TYR A 139 17.518 53.612 -11.915 1.00 0.00 C ATOM 2211 CD1 TYR A 139 18.603 53.614 -11.047 1.00 0.00 C ATOM 2212 CD2 TYR A 139 16.320 54.157 -11.471 1.00 0.00 C ATOM 2213 CE1 TYR A 139 18.495 54.141 -9.774 1.00 0.00 C ATOM 2214 CE2 TYR A 139 16.206 54.686 -10.201 1.00 0.00 C ATOM 2215 CZ TYR A 139 17.295 54.676 -9.356 1.00 0.00 C ATOM 2216 OH TYR A 139 17.182 55.200 -8.089 1.00 0.00 O ATOM 0 H TYR A 139 18.030 51.791 -15.395 1.00 0.00 H new ATOM 0 HA TYR A 139 18.175 51.076 -12.625 1.00 0.00 H new ATOM 0 HB2 TYR A 139 18.604 53.339 -13.729 1.00 0.00 H new ATOM 0 HB3 TYR A 139 16.870 53.481 -13.941 1.00 0.00 H new ATOM 0 HD1 TYR A 139 19.545 53.197 -11.372 1.00 0.00 H new ATOM 0 HD2 TYR A 139 15.464 54.167 -12.130 1.00 0.00 H new ATOM 0 HE1 TYR A 139 19.347 54.134 -9.110 1.00 0.00 H new ATOM 0 HE2 TYR A 139 15.267 55.106 -9.871 1.00 0.00 H new ATOM 0 HH TYR A 139 16.272 55.537 -7.954 1.00 0.00 H new ATOM 2226 N PHE A 140 15.327 50.853 -14.166 1.00 0.00 N ATOM 2227 CA PHE A 140 13.953 50.371 -14.051 1.00 0.00 C ATOM 2228 C PHE A 140 13.924 48.914 -13.591 1.00 0.00 C ATOM 2229 O PHE A 140 13.088 48.524 -12.776 1.00 0.00 O ATOM 2230 CB PHE A 140 13.227 50.518 -15.393 1.00 0.00 C ATOM 2231 CG PHE A 140 11.799 50.048 -15.372 1.00 0.00 C ATOM 2232 CD1 PHE A 140 10.827 50.770 -14.696 1.00 0.00 C ATOM 2233 CD2 PHE A 140 11.430 48.884 -16.025 1.00 0.00 C ATOM 2234 CE1 PHE A 140 9.514 50.339 -14.674 1.00 0.00 C ATOM 2235 CE2 PHE A 140 10.120 48.449 -16.009 1.00 0.00 C ATOM 2236 CZ PHE A 140 9.161 49.176 -15.331 1.00 0.00 C ATOM 0 H PHE A 140 15.638 51.007 -15.125 1.00 0.00 H new ATOM 0 HA PHE A 140 13.440 50.975 -13.303 1.00 0.00 H new ATOM 0 HB2 PHE A 140 13.249 51.566 -15.693 1.00 0.00 H new ATOM 0 HB3 PHE A 140 13.772 49.957 -16.152 1.00 0.00 H new ATOM 0 HD1 PHE A 140 11.099 51.679 -14.181 1.00 0.00 H new ATOM 0 HD2 PHE A 140 12.176 48.309 -16.553 1.00 0.00 H new ATOM 0 HE1 PHE A 140 8.766 50.910 -14.144 1.00 0.00 H new ATOM 0 HE2 PHE A 140 9.845 47.541 -16.526 1.00 0.00 H new ATOM 0 HZ PHE A 140 8.136 48.836 -15.314 1.00 0.00 H new ATOM 2246 N GLN A 141 14.852 48.118 -14.114 1.00 0.00 N ATOM 2247 CA GLN A 141 14.946 46.702 -13.765 1.00 0.00 C ATOM 2248 C GLN A 141 15.544 46.511 -12.377 1.00 0.00 C ATOM 2249 O GLN A 141 15.593 45.394 -11.857 1.00 0.00 O ATOM 2250 CB GLN A 141 15.794 45.958 -14.797 1.00 0.00 C ATOM 2251 CG GLN A 141 15.160 45.893 -16.178 1.00 0.00 C ATOM 2252 CD GLN A 141 13.812 45.198 -16.164 1.00 0.00 C ATOM 2253 OE1 GLN A 141 13.568 44.302 -15.354 1.00 0.00 O ATOM 2254 NE2 GLN A 141 12.925 45.607 -17.054 1.00 0.00 N ATOM 0 H GLN A 141 15.554 48.431 -14.785 1.00 0.00 H new ATOM 0 HA GLN A 141 13.935 46.293 -13.762 1.00 0.00 H new ATOM 0 HB2 GLN A 141 16.765 46.446 -14.876 1.00 0.00 H new ATOM 0 HB3 GLN A 141 15.975 44.943 -14.442 1.00 0.00 H new ATOM 0 HG2 GLN A 141 15.040 46.904 -16.568 1.00 0.00 H new ATOM 0 HG3 GLN A 141 15.830 45.367 -16.858 1.00 0.00 H new ATOM 0 HE21 GLN A 141 13.165 46.352 -17.708 1.00 0.00 H new ATOM 0 HE22 GLN A 141 12.000 45.178 -17.087 1.00 0.00 H new ATOM 2263 N SER A 142 16.011 47.597 -11.790 1.00 0.00 N ATOM 2264 CA SER A 142 16.557 47.562 -10.452 1.00 0.00 C ATOM 2265 C SER A 142 15.431 47.734 -9.432 1.00 0.00 C ATOM 2266 O SER A 142 14.842 46.711 -9.023 1.00 0.00 O ATOM 2267 CB SER A 142 17.619 48.656 -10.300 1.00 0.00 C ATOM 2268 OG SER A 142 18.123 48.715 -8.975 1.00 0.00 O ATOM 0 H SER A 142 16.022 48.519 -12.225 1.00 0.00 H new ATOM 0 HA SER A 142 17.034 46.599 -10.272 1.00 0.00 H new ATOM 0 HB2 SER A 142 18.439 48.467 -10.993 1.00 0.00 H new ATOM 0 HB3 SER A 142 17.189 49.621 -10.570 1.00 0.00 H new ATOM 0 HG SER A 142 18.799 49.422 -8.913 1.00 0.00 H new TER 2274 SER A 142