USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 916 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 115 ASN : amide:sc= 0.479 X(o=1.7,f=1.5) USER MOD Set 1.2: A 118 TYR OH : rot 77:sc= 1.19 USER MOD Set 2.1: A 91 THR OG1 : rot 170:sc= 2.26 USER MOD Set 2.2: A 112 TYR OH : rot -14:sc= 2.43 USER MOD Set 3.1: A 38 SER OG : rot 82:sc= 1.2 USER MOD Set 3.2: A 42 TYR OH : rot 180:sc= 0.738 USER MOD Single : A 22 ASN :FLIP amide:sc= 0 F(o=-2.1!,f=0) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 30 THR OG1 : rot 58:sc= 1.28 USER MOD Single : A 34 THR OG1 : rot -83:sc= -0.384 USER MOD Single : A 36 SER OG : rot 39:sc= 0.299 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 THR OG1 : rot 35:sc= 0.0712 USER MOD Single : A 46 THR OG1 : rot 84:sc= 1.26 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-0.97,f=0) USER MOD Single : A 50 TYR OH : rot -151:sc= 0.268 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -120:sc= 0.931 USER MOD Single : A 61 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 64 MET CE :methyl -115:sc= -0.714 (180deg=-1.4) USER MOD Single : A 68 LYS NZ :NH3+ 166:sc= -0.0131 (180deg=-0.227) USER MOD Single : A 75 ASN : amide:sc= -0.6 K(o=-0.6,f=-1.4) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -0.397 X(o=-0.4,f=-0.6) USER MOD Single : A 82 LYS NZ :NH3+ -152:sc= 1.11 (180deg=0.626) USER MOD Single : A 87 HIS : no HD1:sc= 1.16 K(o=1.2,f=-4.4!) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.0324 USER MOD Single : A 97 THR OG1 : rot 157:sc= -2.78! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.0594 X(o=-0.059,f=-0.059) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ -114:sc= -0.254 (180deg=-1.89!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 125 ASN : amide:sc= -0.444 K(o=-0.44,f=-6!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -74:sc= 1.07 USER MOD Single : A 135 THR OG1 : rot 150:sc= 0.281 USER MOD Single : A 136 ASN :FLIP amide:sc= -0.138 F(o=-0.74,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 31.351 -1.014 -0.299 1.00 0.00 N ATOM 2 CA ASP A 20 30.652 -2.270 -0.592 1.00 0.00 C ATOM 3 C ASP A 20 29.852 -2.734 0.603 1.00 0.00 C ATOM 4 O ASP A 20 30.344 -2.711 1.746 1.00 0.00 O ATOM 5 CB ASP A 20 31.600 -3.399 -1.030 1.00 0.00 C ATOM 6 CG ASP A 20 32.264 -3.165 -2.359 1.00 0.00 C ATOM 7 OD1 ASP A 20 31.586 -3.219 -3.396 1.00 0.00 O ATOM 8 OD2 ASP A 20 33.493 -2.953 -2.390 1.00 0.00 O ATOM 0 HA ASP A 20 29.986 -2.051 -1.426 1.00 0.00 H new ATOM 0 HB2 ASP A 20 32.370 -3.527 -0.269 1.00 0.00 H new ATOM 0 HB3 ASP A 20 31.039 -4.332 -1.076 1.00 0.00 H new ATOM 13 N CYS A 21 28.641 -3.142 0.335 1.00 0.00 N ATOM 14 CA CYS A 21 27.703 -3.599 1.327 1.00 0.00 C ATOM 15 C CYS A 21 28.237 -4.864 1.926 1.00 0.00 C ATOM 16 O CYS A 21 28.823 -5.673 1.226 1.00 0.00 O ATOM 17 CB CYS A 21 26.377 -3.923 0.650 1.00 0.00 C ATOM 18 SG CYS A 21 25.966 -2.837 -0.732 1.00 0.00 S ATOM 0 H CYS A 21 28.266 -3.167 -0.613 1.00 0.00 H new ATOM 0 HA CYS A 21 27.560 -2.832 2.088 1.00 0.00 H new ATOM 0 HB2 CYS A 21 26.407 -4.952 0.292 1.00 0.00 H new ATOM 0 HB3 CYS A 21 25.580 -3.866 1.391 1.00 0.00 H new ATOM 23 N ASN A 22 28.100 -5.027 3.201 1.00 0.00 N ATOM 24 CA ASN A 22 28.534 -6.257 3.836 1.00 0.00 C ATOM 25 C ASN A 22 27.347 -6.954 4.464 1.00 0.00 C ATOM 26 O ASN A 22 27.496 -7.840 5.306 1.00 0.00 O ATOM 27 CB ASN A 22 29.622 -6.002 4.888 1.00 0.00 C ATOM 28 CG ASN A 22 31.034 -5.797 4.341 1.00 0.00 C ATOM 29 OD1 ASN A 22 31.173 -5.219 3.188 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 32.009 -6.165 4.993 1.00 0.00 N flip ATOM 0 H ASN A 22 27.695 -4.336 3.832 1.00 0.00 H new ATOM 0 HA ASN A 22 28.968 -6.898 3.068 1.00 0.00 H new ATOM 0 HB2 ASN A 22 29.344 -5.121 5.466 1.00 0.00 H new ATOM 0 HB3 ASN A 22 29.638 -6.844 5.579 1.00 0.00 H new ATOM 0 HD21 ASN A 22 31.876 -6.617 5.897 1.00 0.00 H new ATOM 0 HD22 ASN A 22 32.951 -6.018 4.630 1.00 0.00 H new ATOM 37 N GLU A 23 26.173 -6.572 4.013 1.00 0.00 N ATOM 38 CA GLU A 23 24.927 -7.101 4.495 1.00 0.00 C ATOM 39 C GLU A 23 23.861 -6.896 3.424 1.00 0.00 C ATOM 40 O GLU A 23 24.036 -6.056 2.526 1.00 0.00 O ATOM 41 CB GLU A 23 24.514 -6.393 5.795 1.00 0.00 C ATOM 42 CG GLU A 23 24.364 -4.885 5.657 1.00 0.00 C ATOM 43 CD GLU A 23 23.944 -4.222 6.936 1.00 0.00 C ATOM 44 OE1 GLU A 23 24.827 -3.856 7.755 1.00 0.00 O ATOM 45 OE2 GLU A 23 22.731 -4.030 7.149 1.00 0.00 O ATOM 0 H GLU A 23 26.061 -5.868 3.284 1.00 0.00 H new ATOM 0 HA GLU A 23 25.038 -8.164 4.707 1.00 0.00 H new ATOM 0 HB2 GLU A 23 23.569 -6.812 6.140 1.00 0.00 H new ATOM 0 HB3 GLU A 23 25.257 -6.605 6.564 1.00 0.00 H new ATOM 0 HG2 GLU A 23 25.311 -4.459 5.327 1.00 0.00 H new ATOM 0 HG3 GLU A 23 23.629 -4.667 4.882 1.00 0.00 H new ATOM 52 N LEU A 24 22.806 -7.668 3.506 1.00 0.00 N ATOM 53 CA LEU A 24 21.649 -7.535 2.630 1.00 0.00 C ATOM 54 C LEU A 24 20.785 -6.394 3.119 1.00 0.00 C ATOM 55 O LEU A 24 20.844 -6.052 4.312 1.00 0.00 O ATOM 56 CB LEU A 24 20.849 -8.854 2.608 1.00 0.00 C ATOM 57 CG LEU A 24 21.411 -9.974 1.723 1.00 0.00 C ATOM 58 CD1 LEU A 24 20.625 -11.255 1.926 1.00 0.00 C ATOM 59 CD2 LEU A 24 21.313 -9.554 0.271 1.00 0.00 C ATOM 0 H LEU A 24 22.717 -8.420 4.190 1.00 0.00 H new ATOM 0 HA LEU A 24 21.979 -7.321 1.614 1.00 0.00 H new ATOM 0 HB2 LEU A 24 20.777 -9.228 3.629 1.00 0.00 H new ATOM 0 HB3 LEU A 24 19.834 -8.633 2.278 1.00 0.00 H new ATOM 0 HG LEU A 24 22.451 -10.152 1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 24 21.037 -12.039 1.291 1.00 0.00 H new ATOM 0 HD12 LEU A 24 20.692 -11.561 2.970 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.581 -11.087 1.663 1.00 0.00 H new ATOM 0 HD21 LEU A 24 21.711 -10.345 -0.364 1.00 0.00 H new ATOM 0 HD22 LEU A 24 20.269 -9.373 0.014 1.00 0.00 H new ATOM 0 HD23 LEU A 24 21.888 -8.641 0.117 1.00 0.00 H new ATOM 71 N PRO A 25 20.012 -5.751 2.215 1.00 0.00 N ATOM 72 CA PRO A 25 19.131 -4.649 2.582 1.00 0.00 C ATOM 73 C PRO A 25 18.189 -5.050 3.716 1.00 0.00 C ATOM 74 O PRO A 25 17.550 -6.126 3.653 1.00 0.00 O ATOM 75 CB PRO A 25 18.336 -4.352 1.296 1.00 0.00 C ATOM 76 CG PRO A 25 18.611 -5.498 0.383 1.00 0.00 C ATOM 77 CD PRO A 25 19.948 -6.037 0.773 1.00 0.00 C ATOM 0 HA PRO A 25 19.685 -3.783 2.943 1.00 0.00 H new ATOM 0 HB2 PRO A 25 17.270 -4.264 1.505 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.652 -3.409 0.849 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.841 -6.264 0.478 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.612 -5.174 -0.658 1.00 0.00 H new ATOM 0 HD2 PRO A 25 20.028 -7.105 0.569 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.755 -5.547 0.228 1.00 0.00 H new ATOM 85 N PRO A 26 18.131 -4.234 4.789 1.00 0.00 N ATOM 86 CA PRO A 26 17.294 -4.516 5.936 1.00 0.00 C ATOM 87 C PRO A 26 15.829 -4.584 5.549 1.00 0.00 C ATOM 88 O PRO A 26 15.271 -3.635 4.980 1.00 0.00 O ATOM 89 CB PRO A 26 17.561 -3.352 6.899 1.00 0.00 C ATOM 90 CG PRO A 26 18.149 -2.279 6.056 1.00 0.00 C ATOM 91 CD PRO A 26 18.877 -2.977 4.948 1.00 0.00 C ATOM 0 HA PRO A 26 17.522 -5.484 6.383 1.00 0.00 H new ATOM 0 HB2 PRO A 26 16.641 -3.017 7.378 1.00 0.00 H new ATOM 0 HB3 PRO A 26 18.245 -3.648 7.695 1.00 0.00 H new ATOM 0 HG2 PRO A 26 17.373 -1.624 5.661 1.00 0.00 H new ATOM 0 HG3 PRO A 26 18.828 -1.655 6.637 1.00 0.00 H new ATOM 0 HD2 PRO A 26 18.872 -2.388 4.031 1.00 0.00 H new ATOM 0 HD3 PRO A 26 19.921 -3.159 5.205 1.00 0.00 H new ATOM 99 N ARG A 27 15.218 -5.704 5.853 1.00 0.00 N ATOM 100 CA ARG A 27 13.845 -5.942 5.501 1.00 0.00 C ATOM 101 C ARG A 27 12.937 -5.039 6.285 1.00 0.00 C ATOM 102 O ARG A 27 13.268 -4.610 7.405 1.00 0.00 O ATOM 103 CB ARG A 27 13.496 -7.413 5.643 1.00 0.00 C ATOM 104 CG ARG A 27 14.306 -8.261 4.690 1.00 0.00 C ATOM 105 CD ARG A 27 13.955 -9.721 4.764 1.00 0.00 C ATOM 106 NE ARG A 27 14.764 -10.500 3.827 1.00 0.00 N ATOM 107 CZ ARG A 27 14.578 -11.784 3.523 1.00 0.00 C ATOM 108 NH1 ARG A 27 13.550 -12.457 4.036 1.00 0.00 N ATOM 109 NH2 ARG A 27 15.405 -12.385 2.678 1.00 0.00 N ATOM 0 H ARG A 27 15.662 -6.475 6.352 1.00 0.00 H new ATOM 0 HA ARG A 27 13.697 -5.696 4.450 1.00 0.00 H new ATOM 0 HB2 ARG A 27 13.680 -7.736 6.668 1.00 0.00 H new ATOM 0 HB3 ARG A 27 12.433 -7.558 5.449 1.00 0.00 H new ATOM 0 HG2 ARG A 27 14.148 -7.906 3.672 1.00 0.00 H new ATOM 0 HG3 ARG A 27 15.366 -8.136 4.911 1.00 0.00 H new ATOM 0 HD2 ARG A 27 14.114 -10.086 5.779 1.00 0.00 H new ATOM 0 HD3 ARG A 27 12.897 -9.857 4.538 1.00 0.00 H new ATOM 0 HE ARG A 27 15.537 -10.019 3.367 1.00 0.00 H new ATOM 0 HH11 ARG A 27 12.898 -11.990 4.666 1.00 0.00 H new ATOM 0 HH12 ARG A 27 13.414 -13.440 3.799 1.00 0.00 H new ATOM 0 HH21 ARG A 27 16.179 -11.865 2.264 1.00 0.00 H new ATOM 0 HH22 ARG A 27 15.267 -13.368 2.442 1.00 0.00 H new ATOM 123 N ARG A 28 11.833 -4.689 5.704 1.00 0.00 N ATOM 124 CA ARG A 28 10.997 -3.691 6.281 1.00 0.00 C ATOM 125 C ARG A 28 9.695 -4.305 6.748 1.00 0.00 C ATOM 126 O ARG A 28 9.479 -5.505 6.590 1.00 0.00 O ATOM 127 CB ARG A 28 10.737 -2.632 5.236 1.00 0.00 C ATOM 128 CG ARG A 28 11.991 -2.009 4.575 1.00 0.00 C ATOM 129 CD ARG A 28 12.777 -1.092 5.498 1.00 0.00 C ATOM 130 NE ARG A 28 13.393 -1.787 6.636 1.00 0.00 N ATOM 131 CZ ARG A 28 14.202 -1.229 7.537 1.00 0.00 C ATOM 132 NH1 ARG A 28 14.408 0.087 7.531 1.00 0.00 N ATOM 133 NH2 ARG A 28 14.770 -1.993 8.467 1.00 0.00 N ATOM 0 H ARG A 28 11.491 -5.083 4.827 1.00 0.00 H new ATOM 0 HA ARG A 28 11.486 -3.246 7.147 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.116 -3.067 4.453 1.00 0.00 H new ATOM 0 HB3 ARG A 28 10.157 -1.831 5.695 1.00 0.00 H new ATOM 0 HG2 ARG A 28 12.645 -2.810 4.230 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.684 -1.446 3.693 1.00 0.00 H new ATOM 0 HD2 ARG A 28 13.557 -0.594 4.922 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.113 -0.314 5.875 1.00 0.00 H new ATOM 0 HE ARG A 28 13.184 -2.779 6.746 1.00 0.00 H new ATOM 0 HH11 ARG A 28 13.946 0.672 6.835 1.00 0.00 H new ATOM 0 HH12 ARG A 28 15.028 0.509 8.222 1.00 0.00 H new ATOM 0 HH21 ARG A 28 14.585 -2.996 8.486 1.00 0.00 H new ATOM 0 HH22 ARG A 28 15.390 -1.576 9.161 1.00 0.00 H new ATOM 147 N ASN A 29 8.845 -3.490 7.328 1.00 0.00 N ATOM 148 CA ASN A 29 7.550 -3.938 7.816 1.00 0.00 C ATOM 149 C ASN A 29 6.573 -3.974 6.662 1.00 0.00 C ATOM 150 O ASN A 29 6.022 -5.018 6.327 1.00 0.00 O ATOM 151 CB ASN A 29 7.029 -2.987 8.908 1.00 0.00 C ATOM 152 CG ASN A 29 5.704 -3.434 9.519 1.00 0.00 C ATOM 153 OD1 ASN A 29 5.426 -4.627 9.643 1.00 0.00 O ATOM 154 ND2 ASN A 29 4.877 -2.493 9.880 1.00 0.00 N ATOM 0 H ASN A 29 9.026 -2.497 7.477 1.00 0.00 H new ATOM 0 HA ASN A 29 7.654 -4.934 8.246 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.776 -2.908 9.697 1.00 0.00 H new ATOM 0 HB3 ASN A 29 6.907 -1.990 8.484 1.00 0.00 H new ATOM 0 HD21 ASN A 29 3.970 -2.736 10.278 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.137 -1.514 9.764 1.00 0.00 H new ATOM 161 N THR A 30 6.383 -2.838 6.042 1.00 0.00 N ATOM 162 CA THR A 30 5.493 -2.733 4.926 1.00 0.00 C ATOM 163 C THR A 30 6.226 -2.859 3.601 1.00 0.00 C ATOM 164 O THR A 30 5.617 -2.977 2.558 1.00 0.00 O ATOM 165 CB THR A 30 4.704 -1.424 4.998 1.00 0.00 C ATOM 166 OG1 THR A 30 5.531 -0.402 5.597 1.00 0.00 O ATOM 167 CG2 THR A 30 3.438 -1.603 5.810 1.00 0.00 C ATOM 0 H THR A 30 6.842 -1.964 6.299 1.00 0.00 H new ATOM 0 HA THR A 30 4.792 -3.566 4.980 1.00 0.00 H new ATOM 0 HB THR A 30 4.422 -1.126 3.988 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.349 -0.292 5.069 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.893 -0.660 5.848 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.812 -2.365 5.345 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.696 -1.914 6.822 1.00 0.00 H new ATOM 175 N GLU A 31 7.531 -2.867 3.641 1.00 0.00 N ATOM 176 CA GLU A 31 8.279 -2.960 2.420 1.00 0.00 C ATOM 177 C GLU A 31 8.945 -4.289 2.272 1.00 0.00 C ATOM 178 O GLU A 31 9.432 -4.867 3.240 1.00 0.00 O ATOM 179 CB GLU A 31 9.297 -1.860 2.252 1.00 0.00 C ATOM 180 CG GLU A 31 8.768 -0.459 2.147 1.00 0.00 C ATOM 181 CD GLU A 31 8.391 0.127 3.491 1.00 0.00 C ATOM 182 OE1 GLU A 31 9.288 0.421 4.291 1.00 0.00 O ATOM 183 OE2 GLU A 31 7.206 0.277 3.780 1.00 0.00 O ATOM 0 H GLU A 31 8.090 -2.811 4.492 1.00 0.00 H new ATOM 0 HA GLU A 31 7.538 -2.842 1.629 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.984 -1.901 3.097 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.880 -2.071 1.356 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.521 0.175 1.678 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.895 -0.453 1.495 1.00 0.00 H new ATOM 190 N ILE A 32 8.969 -4.766 1.056 1.00 0.00 N ATOM 191 CA ILE A 32 9.568 -6.046 0.717 1.00 0.00 C ATOM 192 C ILE A 32 10.399 -5.777 -0.474 1.00 0.00 C ATOM 193 O ILE A 32 10.112 -4.841 -1.221 1.00 0.00 O ATOM 194 CB ILE A 32 8.460 -7.101 0.365 1.00 0.00 C ATOM 195 CG1 ILE A 32 7.361 -7.125 1.448 1.00 0.00 C ATOM 196 CG2 ILE A 32 9.067 -8.495 0.218 1.00 0.00 C ATOM 197 CD1 ILE A 32 6.164 -7.989 1.109 1.00 0.00 C ATOM 0 H ILE A 32 8.569 -4.275 0.256 1.00 0.00 H new ATOM 0 HA ILE A 32 10.146 -6.453 1.547 1.00 0.00 H new ATOM 0 HB ILE A 32 8.013 -6.808 -0.585 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.797 -7.480 2.382 1.00 0.00 H new ATOM 0 HG13 ILE A 32 7.019 -6.105 1.623 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.281 -9.210 -0.026 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.810 -8.486 -0.580 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.544 -8.785 1.154 1.00 0.00 H new ATOM 0 HD11 ILE A 32 5.442 -7.947 1.925 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.699 -7.623 0.194 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.488 -9.019 0.964 1.00 0.00 H new ATOM 209 N LEU A 33 11.430 -6.517 -0.613 1.00 0.00 N ATOM 210 CA LEU A 33 12.311 -6.383 -1.713 1.00 0.00 C ATOM 211 C LEU A 33 11.659 -6.840 -2.986 1.00 0.00 C ATOM 212 O LEU A 33 10.920 -7.838 -3.007 1.00 0.00 O ATOM 213 CB LEU A 33 13.566 -7.171 -1.480 1.00 0.00 C ATOM 214 CG LEU A 33 14.599 -6.604 -0.522 1.00 0.00 C ATOM 215 CD1 LEU A 33 15.132 -5.258 -0.958 1.00 0.00 C ATOM 216 CD2 LEU A 33 14.190 -6.613 0.931 1.00 0.00 C ATOM 0 H LEU A 33 11.694 -7.249 0.046 1.00 0.00 H new ATOM 0 HA LEU A 33 12.562 -5.327 -1.810 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.278 -8.157 -1.115 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.051 -7.318 -2.445 1.00 0.00 H new ATOM 0 HG LEU A 33 15.427 -7.311 -0.582 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.866 -4.905 -0.233 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.604 -5.353 -1.936 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.311 -4.544 -1.020 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.991 -6.190 1.537 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.285 -6.018 1.058 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.998 -7.638 1.249 1.00 0.00 H new ATOM 228 N THR A 34 11.923 -6.116 -4.022 1.00 0.00 N ATOM 229 CA THR A 34 11.385 -6.423 -5.325 1.00 0.00 C ATOM 230 C THR A 34 12.295 -7.404 -6.052 1.00 0.00 C ATOM 231 O THR A 34 11.837 -8.280 -6.803 1.00 0.00 O ATOM 232 CB THR A 34 11.252 -5.141 -6.150 1.00 0.00 C ATOM 233 OG1 THR A 34 12.486 -4.415 -6.069 1.00 0.00 O ATOM 234 CG2 THR A 34 10.112 -4.276 -5.636 1.00 0.00 C ATOM 0 H THR A 34 12.520 -5.289 -3.999 1.00 0.00 H new ATOM 0 HA THR A 34 10.401 -6.875 -5.199 1.00 0.00 H new ATOM 0 HB THR A 34 11.033 -5.404 -7.185 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.503 -3.890 -5.242 1.00 0.00 H new ATOM 0 HG21 THR A 34 10.040 -3.372 -6.240 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.176 -4.831 -5.701 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.301 -4.004 -4.598 1.00 0.00 H new ATOM 242 N GLY A 35 13.575 -7.260 -5.808 1.00 0.00 N ATOM 243 CA GLY A 35 14.548 -8.093 -6.434 1.00 0.00 C ATOM 244 C GLY A 35 14.937 -9.266 -5.576 1.00 0.00 C ATOM 245 O GLY A 35 14.617 -9.315 -4.376 1.00 0.00 O ATOM 0 H GLY A 35 13.961 -6.563 -5.171 1.00 0.00 H new ATOM 0 HA2 GLY A 35 14.155 -8.456 -7.384 1.00 0.00 H new ATOM 0 HA3 GLY A 35 15.436 -7.502 -6.661 1.00 0.00 H new ATOM 249 N SER A 36 15.616 -10.191 -6.178 1.00 0.00 N ATOM 250 CA SER A 36 16.094 -11.373 -5.529 1.00 0.00 C ATOM 251 C SER A 36 17.589 -11.224 -5.316 1.00 0.00 C ATOM 252 O SER A 36 18.348 -11.083 -6.284 1.00 0.00 O ATOM 253 CB SER A 36 15.770 -12.584 -6.408 1.00 0.00 C ATOM 254 OG SER A 36 16.219 -12.364 -7.752 1.00 0.00 O ATOM 0 H SER A 36 15.861 -10.144 -7.167 1.00 0.00 H new ATOM 0 HA SER A 36 15.615 -11.519 -4.561 1.00 0.00 H new ATOM 0 HB2 SER A 36 16.248 -13.475 -6.000 1.00 0.00 H new ATOM 0 HB3 SER A 36 14.696 -12.767 -6.403 1.00 0.00 H new ATOM 0 HG SER A 36 17.081 -11.898 -7.737 1.00 0.00 H new ATOM 260 N TRP A 37 18.000 -11.232 -4.085 1.00 0.00 N ATOM 261 CA TRP A 37 19.374 -10.976 -3.738 1.00 0.00 C ATOM 262 C TRP A 37 20.085 -12.294 -3.486 1.00 0.00 C ATOM 263 O TRP A 37 19.425 -13.327 -3.300 1.00 0.00 O ATOM 264 CB TRP A 37 19.413 -10.066 -2.507 1.00 0.00 C ATOM 265 CG TRP A 37 18.604 -8.813 -2.692 1.00 0.00 C ATOM 266 CD1 TRP A 37 17.268 -8.678 -2.479 1.00 0.00 C ATOM 267 CD2 TRP A 37 19.069 -7.530 -3.127 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.868 -7.415 -2.786 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.952 -6.681 -3.171 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.311 -7.019 -3.484 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.042 -5.348 -3.560 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.403 -5.698 -3.866 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.274 -4.875 -3.901 1.00 0.00 C ATOM 0 H TRP A 37 17.394 -11.416 -3.286 1.00 0.00 H new ATOM 0 HA TRP A 37 19.890 -10.470 -4.554 1.00 0.00 H new ATOM 0 HB2 TRP A 37 19.037 -10.613 -1.643 1.00 0.00 H new ATOM 0 HB3 TRP A 37 20.447 -9.798 -2.290 1.00 0.00 H new ATOM 0 HD1 TRP A 37 16.618 -9.461 -2.118 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.909 -7.071 -2.736 1.00 0.00 H new ATOM 0 HE3 TRP A 37 21.190 -7.647 -3.462 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.169 -4.713 -3.591 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.364 -5.292 -4.143 1.00 0.00 H new ATOM 0 HH2 TRP A 37 19.380 -3.844 -4.204 1.00 0.00 H new ATOM 284 N SER A 38 21.391 -12.292 -3.515 1.00 0.00 N ATOM 285 CA SER A 38 22.130 -13.532 -3.344 1.00 0.00 C ATOM 286 C SER A 38 23.255 -13.455 -2.314 1.00 0.00 C ATOM 287 O SER A 38 23.647 -14.473 -1.742 1.00 0.00 O ATOM 288 CB SER A 38 22.694 -13.966 -4.700 1.00 0.00 C ATOM 289 OG SER A 38 23.364 -12.873 -5.343 1.00 0.00 O ATOM 0 H SER A 38 21.967 -11.461 -3.653 1.00 0.00 H new ATOM 0 HA SER A 38 21.424 -14.266 -2.955 1.00 0.00 H new ATOM 0 HB2 SER A 38 23.389 -14.795 -4.562 1.00 0.00 H new ATOM 0 HB3 SER A 38 21.887 -14.329 -5.336 1.00 0.00 H new ATOM 0 HG SER A 38 24.272 -12.790 -4.984 1.00 0.00 H new ATOM 295 N ASP A 39 23.763 -12.280 -2.052 1.00 0.00 N ATOM 296 CA ASP A 39 24.976 -12.177 -1.236 1.00 0.00 C ATOM 297 C ASP A 39 24.848 -11.082 -0.262 1.00 0.00 C ATOM 298 O ASP A 39 24.055 -10.222 -0.435 1.00 0.00 O ATOM 299 CB ASP A 39 26.172 -11.830 -2.110 1.00 0.00 C ATOM 300 CG ASP A 39 26.422 -12.779 -3.261 1.00 0.00 C ATOM 301 OD1 ASP A 39 27.124 -13.797 -3.076 1.00 0.00 O ATOM 302 OD2 ASP A 39 25.937 -12.505 -4.386 1.00 0.00 O ATOM 0 H ASP A 39 23.378 -11.392 -2.375 1.00 0.00 H new ATOM 0 HA ASP A 39 25.113 -13.136 -0.737 1.00 0.00 H new ATOM 0 HB2 ASP A 39 26.030 -10.826 -2.511 1.00 0.00 H new ATOM 0 HB3 ASP A 39 27.064 -11.800 -1.484 1.00 0.00 H new ATOM 307 N GLN A 40 25.666 -11.089 0.737 1.00 0.00 N ATOM 308 CA GLN A 40 25.675 -10.007 1.675 1.00 0.00 C ATOM 309 C GLN A 40 26.541 -8.886 1.149 1.00 0.00 C ATOM 310 O GLN A 40 26.294 -7.715 1.402 1.00 0.00 O ATOM 311 CB GLN A 40 26.134 -10.471 3.056 1.00 0.00 C ATOM 312 CG GLN A 40 25.202 -11.493 3.683 1.00 0.00 C ATOM 313 CD GLN A 40 25.593 -11.853 5.093 1.00 0.00 C ATOM 314 OE1 GLN A 40 25.154 -11.215 6.053 1.00 0.00 O ATOM 315 NE2 GLN A 40 26.388 -12.871 5.246 1.00 0.00 N ATOM 0 H GLN A 40 26.339 -11.831 0.929 1.00 0.00 H new ATOM 0 HA GLN A 40 24.657 -9.634 1.791 1.00 0.00 H new ATOM 0 HB2 GLN A 40 27.132 -10.901 2.975 1.00 0.00 H new ATOM 0 HB3 GLN A 40 26.212 -9.607 3.716 1.00 0.00 H new ATOM 0 HG2 GLN A 40 24.185 -11.100 3.682 1.00 0.00 H new ATOM 0 HG3 GLN A 40 25.195 -12.395 3.071 1.00 0.00 H new ATOM 0 HE21 GLN A 40 26.732 -13.376 4.430 1.00 0.00 H new ATOM 0 HE22 GLN A 40 26.667 -13.164 6.182 1.00 0.00 H new ATOM 324 N THR A 41 27.528 -9.231 0.378 1.00 0.00 N ATOM 325 CA THR A 41 28.403 -8.242 -0.125 1.00 0.00 C ATOM 326 C THR A 41 28.030 -7.798 -1.552 1.00 0.00 C ATOM 327 O THR A 41 28.160 -8.556 -2.532 1.00 0.00 O ATOM 328 CB THR A 41 29.871 -8.681 0.014 1.00 0.00 C ATOM 329 OG1 THR A 41 30.093 -9.942 -0.652 1.00 0.00 O ATOM 330 CG2 THR A 41 30.211 -8.851 1.489 1.00 0.00 C ATOM 0 H THR A 41 27.738 -10.187 0.091 1.00 0.00 H new ATOM 0 HA THR A 41 28.284 -7.350 0.490 1.00 0.00 H new ATOM 0 HB THR A 41 30.501 -7.917 -0.441 1.00 0.00 H new ATOM 0 HG1 THR A 41 29.534 -9.991 -1.455 1.00 0.00 H new ATOM 0 HG21 THR A 41 31.251 -9.162 1.589 1.00 0.00 H new ATOM 0 HG22 THR A 41 30.064 -7.904 2.008 1.00 0.00 H new ATOM 0 HG23 THR A 41 29.562 -9.609 1.927 1.00 0.00 H new ATOM 338 N TYR A 42 27.521 -6.598 -1.638 1.00 0.00 N ATOM 339 CA TYR A 42 27.120 -5.964 -2.885 1.00 0.00 C ATOM 340 C TYR A 42 27.944 -4.718 -3.105 1.00 0.00 C ATOM 341 O TYR A 42 28.491 -4.184 -2.157 1.00 0.00 O ATOM 342 CB TYR A 42 25.614 -5.607 -2.871 1.00 0.00 C ATOM 343 CG TYR A 42 24.720 -6.727 -3.308 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.324 -7.712 -2.436 1.00 0.00 C ATOM 345 CD2 TYR A 42 24.291 -6.805 -4.624 1.00 0.00 C ATOM 346 CE1 TYR A 42 23.528 -8.752 -2.860 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.489 -7.834 -5.047 1.00 0.00 C ATOM 348 CZ TYR A 42 23.117 -8.810 -4.160 1.00 0.00 C ATOM 349 OH TYR A 42 22.335 -9.864 -4.582 1.00 0.00 O ATOM 0 H TYR A 42 27.365 -6.008 -0.821 1.00 0.00 H new ATOM 0 HA TYR A 42 27.292 -6.666 -3.701 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.332 -5.303 -1.863 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.448 -4.748 -3.521 1.00 0.00 H new ATOM 0 HD1 TYR A 42 24.641 -7.670 -1.405 1.00 0.00 H new ATOM 0 HD2 TYR A 42 24.593 -6.043 -5.327 1.00 0.00 H new ATOM 0 HE1 TYR A 42 23.229 -9.522 -2.164 1.00 0.00 H new ATOM 0 HE2 TYR A 42 23.153 -7.875 -6.073 1.00 0.00 H new ATOM 0 HH TYR A 42 22.127 -9.757 -5.534 1.00 0.00 H new ATOM 359 N PRO A 43 28.067 -4.246 -4.344 1.00 0.00 N ATOM 360 CA PRO A 43 28.806 -3.028 -4.625 1.00 0.00 C ATOM 361 C PRO A 43 28.053 -1.802 -4.107 1.00 0.00 C ATOM 362 O PRO A 43 26.807 -1.813 -4.002 1.00 0.00 O ATOM 363 CB PRO A 43 28.902 -3.004 -6.151 1.00 0.00 C ATOM 364 CG PRO A 43 27.745 -3.812 -6.616 1.00 0.00 C ATOM 365 CD PRO A 43 27.513 -4.857 -5.563 1.00 0.00 C ATOM 0 HA PRO A 43 29.782 -3.006 -4.141 1.00 0.00 H new ATOM 0 HB2 PRO A 43 28.853 -1.985 -6.535 1.00 0.00 H new ATOM 0 HB3 PRO A 43 29.845 -3.429 -6.495 1.00 0.00 H new ATOM 0 HG2 PRO A 43 26.861 -3.187 -6.746 1.00 0.00 H new ATOM 0 HG3 PRO A 43 27.955 -4.272 -7.582 1.00 0.00 H new ATOM 0 HD2 PRO A 43 26.453 -5.086 -5.451 1.00 0.00 H new ATOM 0 HD3 PRO A 43 28.017 -5.792 -5.808 1.00 0.00 H new ATOM 373 N GLU A 44 28.781 -0.758 -3.788 1.00 0.00 N ATOM 374 CA GLU A 44 28.180 0.442 -3.259 1.00 0.00 C ATOM 375 C GLU A 44 27.372 1.124 -4.361 1.00 0.00 C ATOM 376 O GLU A 44 27.680 0.977 -5.554 1.00 0.00 O ATOM 377 CB GLU A 44 29.240 1.406 -2.722 1.00 0.00 C ATOM 378 CG GLU A 44 28.638 2.547 -1.916 1.00 0.00 C ATOM 379 CD GLU A 44 29.572 3.672 -1.648 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.085 4.265 -2.610 1.00 0.00 O ATOM 381 OE2 GLU A 44 29.712 4.073 -0.499 1.00 0.00 O ATOM 0 H GLU A 44 29.795 -0.716 -3.886 1.00 0.00 H new ATOM 0 HA GLU A 44 27.528 0.167 -2.430 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.943 0.856 -2.097 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.809 1.816 -3.556 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.769 2.932 -2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.280 2.154 -0.964 1.00 0.00 H new ATOM 388 N GLY A 45 26.349 1.845 -3.980 1.00 0.00 N ATOM 389 CA GLY A 45 25.525 2.514 -4.945 1.00 0.00 C ATOM 390 C GLY A 45 24.418 1.635 -5.427 1.00 0.00 C ATOM 391 O GLY A 45 23.699 1.977 -6.366 1.00 0.00 O ATOM 0 H GLY A 45 26.069 1.982 -3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.106 3.418 -4.502 1.00 0.00 H new ATOM 0 HA3 GLY A 45 26.136 2.827 -5.791 1.00 0.00 H new ATOM 395 N THR A 46 24.284 0.493 -4.810 1.00 0.00 N ATOM 396 CA THR A 46 23.228 -0.408 -5.168 1.00 0.00 C ATOM 397 C THR A 46 21.946 -0.032 -4.483 1.00 0.00 C ATOM 398 O THR A 46 21.895 0.064 -3.265 1.00 0.00 O ATOM 399 CB THR A 46 23.605 -1.881 -4.924 1.00 0.00 C ATOM 400 OG1 THR A 46 24.769 -2.206 -5.692 1.00 0.00 O ATOM 401 CG2 THR A 46 22.467 -2.833 -5.285 1.00 0.00 C ATOM 0 H THR A 46 24.892 0.167 -4.059 1.00 0.00 H new ATOM 0 HA THR A 46 23.070 -0.312 -6.242 1.00 0.00 H new ATOM 0 HB THR A 46 23.807 -2.002 -3.860 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.572 -1.936 -5.199 1.00 0.00 H new ATOM 0 HG21 THR A 46 22.779 -3.860 -5.097 1.00 0.00 H new ATOM 0 HG22 THR A 46 21.592 -2.602 -4.677 1.00 0.00 H new ATOM 0 HG23 THR A 46 22.217 -2.717 -6.340 1.00 0.00 H new ATOM 409 N GLN A 47 20.933 0.236 -5.279 1.00 0.00 N ATOM 410 CA GLN A 47 19.676 0.640 -4.773 1.00 0.00 C ATOM 411 C GLN A 47 18.782 -0.561 -4.540 1.00 0.00 C ATOM 412 O GLN A 47 18.856 -1.566 -5.253 1.00 0.00 O ATOM 413 CB GLN A 47 19.032 1.639 -5.725 1.00 0.00 C ATOM 414 CG GLN A 47 18.634 1.048 -7.064 1.00 0.00 C ATOM 415 CD GLN A 47 18.149 2.081 -8.040 1.00 0.00 C ATOM 416 OE1 GLN A 47 17.578 3.142 -7.548 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 18.296 1.921 -9.243 1.00 0.00 N flip ATOM 0 H GLN A 47 20.977 0.174 -6.296 1.00 0.00 H new ATOM 0 HA GLN A 47 19.820 1.130 -3.810 1.00 0.00 H new ATOM 0 HB2 GLN A 47 18.147 2.061 -5.248 1.00 0.00 H new ATOM 0 HB3 GLN A 47 19.726 2.462 -5.895 1.00 0.00 H new ATOM 0 HG2 GLN A 47 19.489 0.524 -7.492 1.00 0.00 H new ATOM 0 HG3 GLN A 47 17.851 0.306 -6.909 1.00 0.00 H new ATOM 0 HE21 GLN A 47 18.748 1.077 -9.594 1.00 0.00 H new ATOM 0 HE22 GLN A 47 17.966 2.632 -9.896 1.00 0.00 H new ATOM 426 N ALA A 48 17.981 -0.459 -3.543 1.00 0.00 N ATOM 427 CA ALA A 48 17.047 -1.468 -3.198 1.00 0.00 C ATOM 428 C ALA A 48 15.673 -0.894 -3.369 1.00 0.00 C ATOM 429 O ALA A 48 15.322 0.111 -2.730 1.00 0.00 O ATOM 430 CB ALA A 48 17.267 -1.930 -1.773 1.00 0.00 C ATOM 0 H ALA A 48 17.956 0.353 -2.926 1.00 0.00 H new ATOM 0 HA ALA A 48 17.171 -2.339 -3.842 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.541 -2.705 -1.525 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.275 -2.332 -1.672 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.143 -1.086 -1.094 1.00 0.00 H new ATOM 436 N ILE A 49 14.939 -1.468 -4.265 1.00 0.00 N ATOM 437 CA ILE A 49 13.612 -1.025 -4.563 1.00 0.00 C ATOM 438 C ILE A 49 12.637 -1.774 -3.673 1.00 0.00 C ATOM 439 O ILE A 49 12.730 -3.005 -3.522 1.00 0.00 O ATOM 440 CB ILE A 49 13.288 -1.266 -6.061 1.00 0.00 C ATOM 441 CG1 ILE A 49 14.348 -0.568 -6.927 1.00 0.00 C ATOM 442 CG2 ILE A 49 11.889 -0.753 -6.402 1.00 0.00 C ATOM 443 CD1 ILE A 49 14.201 -0.788 -8.418 1.00 0.00 C ATOM 0 H ILE A 49 15.246 -2.268 -4.819 1.00 0.00 H new ATOM 0 HA ILE A 49 13.527 0.045 -4.372 1.00 0.00 H new ATOM 0 HB ILE A 49 13.307 -2.337 -6.264 1.00 0.00 H new ATOM 0 HG12 ILE A 49 14.311 0.503 -6.727 1.00 0.00 H new ATOM 0 HG13 ILE A 49 15.334 -0.916 -6.619 1.00 0.00 H new ATOM 0 HG21 ILE A 49 11.683 -0.932 -7.457 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.151 -1.277 -5.794 1.00 0.00 H new ATOM 0 HG23 ILE A 49 11.834 0.316 -6.198 1.00 0.00 H new ATOM 0 HD11 ILE A 49 14.994 -0.256 -8.944 1.00 0.00 H new ATOM 0 HD12 ILE A 49 14.271 -1.853 -8.637 1.00 0.00 H new ATOM 0 HD13 ILE A 49 13.232 -0.413 -8.747 1.00 0.00 H new ATOM 455 N TYR A 50 11.767 -1.050 -3.035 1.00 0.00 N ATOM 456 CA TYR A 50 10.812 -1.652 -2.170 1.00 0.00 C ATOM 457 C TYR A 50 9.424 -1.722 -2.761 1.00 0.00 C ATOM 458 O TYR A 50 8.946 -0.792 -3.417 1.00 0.00 O ATOM 459 CB TYR A 50 10.839 -1.034 -0.797 1.00 0.00 C ATOM 460 CG TYR A 50 12.076 -1.420 -0.013 1.00 0.00 C ATOM 461 CD1 TYR A 50 12.220 -2.701 0.517 1.00 0.00 C ATOM 462 CD2 TYR A 50 13.103 -0.522 0.188 1.00 0.00 C ATOM 463 CE1 TYR A 50 13.348 -3.060 1.216 1.00 0.00 C ATOM 464 CE2 TYR A 50 14.230 -0.880 0.886 1.00 0.00 C ATOM 465 CZ TYR A 50 14.349 -2.145 1.396 1.00 0.00 C ATOM 466 OH TYR A 50 15.478 -2.495 2.090 1.00 0.00 O ATOM 0 H TYR A 50 11.703 -0.034 -3.102 1.00 0.00 H new ATOM 0 HA TYR A 50 11.115 -2.692 -2.054 1.00 0.00 H new ATOM 0 HB2 TYR A 50 10.795 0.051 -0.889 1.00 0.00 H new ATOM 0 HB3 TYR A 50 9.951 -1.343 -0.245 1.00 0.00 H new ATOM 0 HD1 TYR A 50 11.431 -3.425 0.376 1.00 0.00 H new ATOM 0 HD2 TYR A 50 13.020 0.479 -0.210 1.00 0.00 H new ATOM 0 HE1 TYR A 50 13.443 -4.057 1.620 1.00 0.00 H new ATOM 0 HE2 TYR A 50 15.024 -0.163 1.033 1.00 0.00 H new ATOM 0 HH TYR A 50 15.855 -1.701 2.523 1.00 0.00 H new ATOM 476 N LYS A 51 8.807 -2.854 -2.507 1.00 0.00 N ATOM 477 CA LYS A 51 7.531 -3.264 -3.062 1.00 0.00 C ATOM 478 C LYS A 51 6.331 -2.546 -2.439 1.00 0.00 C ATOM 479 O LYS A 51 5.302 -2.391 -3.083 1.00 0.00 O ATOM 480 CB LYS A 51 7.403 -4.773 -2.850 1.00 0.00 C ATOM 481 CG LYS A 51 6.361 -5.413 -3.696 1.00 0.00 C ATOM 482 CD LYS A 51 6.415 -6.931 -3.612 1.00 0.00 C ATOM 483 CE LYS A 51 5.797 -7.593 -4.847 1.00 0.00 C ATOM 484 NZ LYS A 51 4.365 -7.271 -5.053 1.00 0.00 N ATOM 0 H LYS A 51 9.200 -3.552 -1.875 1.00 0.00 H new ATOM 0 HA LYS A 51 7.517 -2.996 -4.119 1.00 0.00 H new ATOM 0 HB2 LYS A 51 8.365 -5.242 -3.058 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.175 -4.965 -1.802 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.376 -5.067 -3.383 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.493 -5.102 -4.732 1.00 0.00 H new ATOM 0 HD2 LYS A 51 7.451 -7.252 -3.508 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.887 -7.264 -2.719 1.00 0.00 H new ATOM 0 HE2 LYS A 51 6.358 -7.286 -5.730 1.00 0.00 H new ATOM 0 HE3 LYS A 51 5.906 -8.674 -4.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 4.020 -7.755 -5.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.816 -7.588 -4.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.253 -6.243 -5.169 1.00 0.00 H new ATOM 498 N CYS A 52 6.460 -2.159 -1.186 1.00 0.00 N ATOM 499 CA CYS A 52 5.383 -1.487 -0.424 1.00 0.00 C ATOM 500 C CYS A 52 4.208 -2.395 -0.045 1.00 0.00 C ATOM 501 O CYS A 52 3.279 -1.929 0.569 1.00 0.00 O ATOM 502 CB CYS A 52 4.870 -0.223 -1.127 1.00 0.00 C ATOM 503 SG CYS A 52 6.026 1.177 -1.094 1.00 0.00 S ATOM 0 H CYS A 52 7.316 -2.295 -0.648 1.00 0.00 H new ATOM 0 HA CYS A 52 5.864 -1.200 0.511 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.643 -0.466 -2.165 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.934 0.083 -0.659 1.00 0.00 H new ATOM 508 N ARG A 53 4.292 -3.698 -0.375 1.00 0.00 N ATOM 509 CA ARG A 53 3.214 -4.690 -0.075 1.00 0.00 C ATOM 510 C ARG A 53 1.978 -4.523 -0.970 1.00 0.00 C ATOM 511 O ARG A 53 1.697 -3.428 -1.480 1.00 0.00 O ATOM 512 CB ARG A 53 2.782 -4.704 1.414 1.00 0.00 C ATOM 513 CG ARG A 53 3.704 -5.442 2.359 1.00 0.00 C ATOM 514 CD ARG A 53 3.148 -5.400 3.773 1.00 0.00 C ATOM 515 NE ARG A 53 1.766 -5.909 3.832 1.00 0.00 N ATOM 516 CZ ARG A 53 0.825 -5.483 4.692 1.00 0.00 C ATOM 517 NH1 ARG A 53 1.173 -4.794 5.779 1.00 0.00 N ATOM 518 NH2 ARG A 53 -0.446 -5.823 4.510 1.00 0.00 N ATOM 0 H ARG A 53 5.098 -4.101 -0.853 1.00 0.00 H new ATOM 0 HA ARG A 53 3.672 -5.654 -0.298 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.691 -3.673 1.756 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.790 -5.151 1.481 1.00 0.00 H new ATOM 0 HG2 ARG A 53 3.817 -6.477 2.035 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.696 -4.991 2.337 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.783 -5.994 4.431 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.174 -4.375 4.144 1.00 0.00 H new ATOM 0 HE ARG A 53 1.504 -6.640 3.170 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.156 -4.589 5.960 1.00 0.00 H new ATOM 0 HH12 ARG A 53 0.457 -4.472 6.430 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.709 -6.408 3.717 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -1.159 -5.499 5.163 1.00 0.00 H new ATOM 532 N PRO A 54 1.240 -5.629 -1.199 1.00 0.00 N ATOM 533 CA PRO A 54 0.020 -5.606 -1.992 1.00 0.00 C ATOM 534 C PRO A 54 -1.074 -4.733 -1.370 1.00 0.00 C ATOM 535 O PRO A 54 -1.643 -5.061 -0.324 1.00 0.00 O ATOM 536 CB PRO A 54 -0.418 -7.078 -2.050 1.00 0.00 C ATOM 537 CG PRO A 54 0.256 -7.726 -0.897 1.00 0.00 C ATOM 538 CD PRO A 54 1.545 -6.991 -0.711 1.00 0.00 C ATOM 0 HA PRO A 54 0.193 -5.171 -2.976 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.502 -7.170 -1.976 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.122 -7.541 -2.991 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.361 -7.667 -0.000 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.434 -8.784 -1.092 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.855 -6.983 0.334 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.354 -7.449 -1.280 1.00 0.00 H new ATOM 546 N GLY A 55 -1.329 -3.607 -1.997 1.00 0.00 N ATOM 547 CA GLY A 55 -2.380 -2.737 -1.536 1.00 0.00 C ATOM 548 C GLY A 55 -1.898 -1.342 -1.281 1.00 0.00 C ATOM 549 O GLY A 55 -2.684 -0.398 -1.209 1.00 0.00 O ATOM 0 H GLY A 55 -0.826 -3.276 -2.821 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.179 -2.712 -2.277 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.808 -3.143 -0.620 1.00 0.00 H new ATOM 553 N TYR A 56 -0.626 -1.184 -1.160 1.00 0.00 N ATOM 554 CA TYR A 56 -0.084 0.119 -0.921 1.00 0.00 C ATOM 555 C TYR A 56 0.425 0.730 -2.219 1.00 0.00 C ATOM 556 O TYR A 56 0.505 0.056 -3.261 1.00 0.00 O ATOM 557 CB TYR A 56 1.029 0.081 0.132 1.00 0.00 C ATOM 558 CG TYR A 56 0.589 -0.329 1.539 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.560 -1.667 1.927 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.236 0.628 2.483 1.00 0.00 C ATOM 561 CE1 TYR A 56 0.187 -2.037 3.206 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.134 0.267 3.768 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.156 -1.066 4.125 1.00 0.00 C ATOM 564 OH TYR A 56 -0.524 -1.433 5.410 1.00 0.00 O ATOM 0 H TYR A 56 0.062 -1.935 -1.221 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.885 0.746 -0.530 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.801 -0.611 -0.205 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.488 1.068 0.187 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.834 -2.431 1.214 1.00 0.00 H new ATOM 0 HD2 TYR A 56 0.250 1.673 2.209 1.00 0.00 H new ATOM 0 HE1 TYR A 56 0.164 -3.080 3.484 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -0.404 1.026 4.488 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.734 -0.631 5.932 1.00 0.00 H new ATOM 574 N ARG A 57 0.714 1.990 -2.164 1.00 0.00 N ATOM 575 CA ARG A 57 1.282 2.723 -3.253 1.00 0.00 C ATOM 576 C ARG A 57 2.421 3.528 -2.693 1.00 0.00 C ATOM 577 O ARG A 57 2.730 3.430 -1.516 1.00 0.00 O ATOM 578 CB ARG A 57 0.283 3.697 -3.916 1.00 0.00 C ATOM 579 CG ARG A 57 -0.169 4.868 -3.034 1.00 0.00 C ATOM 580 CD ARG A 57 -0.754 6.004 -3.874 1.00 0.00 C ATOM 581 NE ARG A 57 0.232 6.511 -4.867 1.00 0.00 N ATOM 582 CZ ARG A 57 0.262 7.745 -5.411 1.00 0.00 C ATOM 583 NH1 ARG A 57 -0.603 8.683 -5.029 1.00 0.00 N ATOM 584 NH2 ARG A 57 1.192 8.035 -6.319 1.00 0.00 N ATOM 0 H ARG A 57 0.556 2.558 -1.332 1.00 0.00 H new ATOM 0 HA ARG A 57 1.593 2.013 -4.019 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.738 4.099 -4.821 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.598 3.134 -4.225 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.915 4.521 -2.319 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.678 5.239 -2.457 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.646 5.653 -4.392 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.065 6.819 -3.220 1.00 0.00 H new ATOM 0 HE ARG A 57 0.958 5.860 -5.166 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -1.301 8.473 -4.316 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -0.567 9.611 -5.450 1.00 0.00 H new ATOM 0 HH21 ARG A 57 1.872 7.327 -6.596 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.224 8.965 -6.737 1.00 0.00 H new ATOM 598 N SER A 58 3.015 4.322 -3.503 1.00 0.00 N ATOM 599 CA SER A 58 4.051 5.178 -3.085 1.00 0.00 C ATOM 600 C SER A 58 4.116 6.310 -4.072 1.00 0.00 C ATOM 601 O SER A 58 3.288 6.380 -4.975 1.00 0.00 O ATOM 602 CB SER A 58 5.351 4.400 -3.054 1.00 0.00 C ATOM 603 OG SER A 58 5.633 3.869 -4.335 1.00 0.00 O ATOM 0 H SER A 58 2.787 4.394 -4.495 1.00 0.00 H new ATOM 0 HA SER A 58 3.874 5.573 -2.085 1.00 0.00 H new ATOM 0 HB2 SER A 58 6.165 5.051 -2.735 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.283 3.593 -2.325 1.00 0.00 H new ATOM 0 HG SER A 58 5.686 2.892 -4.280 1.00 0.00 H new ATOM 609 N LEU A 59 5.065 7.177 -3.915 1.00 0.00 N ATOM 610 CA LEU A 59 5.234 8.280 -4.827 1.00 0.00 C ATOM 611 C LEU A 59 6.422 8.020 -5.749 1.00 0.00 C ATOM 612 O LEU A 59 6.929 8.924 -6.396 1.00 0.00 O ATOM 613 CB LEU A 59 5.397 9.585 -4.041 1.00 0.00 C ATOM 614 CG LEU A 59 4.166 10.041 -3.231 1.00 0.00 C ATOM 615 CD1 LEU A 59 4.473 11.302 -2.447 1.00 0.00 C ATOM 616 CD2 LEU A 59 2.964 10.269 -4.141 1.00 0.00 C ATOM 0 H LEU A 59 5.746 7.147 -3.156 1.00 0.00 H new ATOM 0 HA LEU A 59 4.347 8.377 -5.453 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.237 9.471 -3.356 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.661 10.378 -4.741 1.00 0.00 H new ATOM 0 HG LEU A 59 3.920 9.245 -2.529 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.590 11.604 -1.884 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.295 11.111 -1.758 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.755 12.099 -3.135 1.00 0.00 H new ATOM 0 HD21 LEU A 59 2.111 10.590 -3.543 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.204 11.039 -4.874 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.717 9.341 -4.657 1.00 0.00 H new ATOM 628 N GLY A 60 6.851 6.765 -5.796 1.00 0.00 N ATOM 629 CA GLY A 60 7.940 6.380 -6.675 1.00 0.00 C ATOM 630 C GLY A 60 8.781 5.264 -6.099 1.00 0.00 C ATOM 631 O GLY A 60 9.975 5.160 -6.413 1.00 0.00 O ATOM 0 H GLY A 60 6.463 6.004 -5.239 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.533 6.065 -7.636 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.573 7.247 -6.865 1.00 0.00 H new ATOM 635 N ASN A 61 8.135 4.407 -5.286 1.00 0.00 N ATOM 636 CA ASN A 61 8.773 3.298 -4.544 1.00 0.00 C ATOM 637 C ASN A 61 9.706 3.801 -3.460 1.00 0.00 C ATOM 638 O ASN A 61 10.337 4.856 -3.586 1.00 0.00 O ATOM 639 CB ASN A 61 9.516 2.287 -5.452 1.00 0.00 C ATOM 640 CG ASN A 61 8.617 1.472 -6.369 1.00 0.00 C ATOM 641 OD1 ASN A 61 8.323 1.878 -7.496 1.00 0.00 O ATOM 642 ND2 ASN A 61 8.208 0.311 -5.920 1.00 0.00 N ATOM 0 H ASN A 61 7.130 4.466 -5.121 1.00 0.00 H new ATOM 0 HA ASN A 61 7.945 2.763 -4.079 1.00 0.00 H new ATOM 0 HB2 ASN A 61 10.237 2.830 -6.063 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.084 1.603 -4.821 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.628 -0.288 -6.508 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.470 0.006 -4.983 1.00 0.00 H new ATOM 649 N VAL A 62 9.753 3.092 -2.365 1.00 0.00 N ATOM 650 CA VAL A 62 10.723 3.397 -1.354 1.00 0.00 C ATOM 651 C VAL A 62 12.040 2.852 -1.842 1.00 0.00 C ATOM 652 O VAL A 62 12.174 1.652 -2.082 1.00 0.00 O ATOM 653 CB VAL A 62 10.361 2.797 0.028 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.492 3.011 1.027 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.091 3.440 0.553 1.00 0.00 C ATOM 0 H VAL A 62 9.137 2.307 -2.153 1.00 0.00 H new ATOM 0 HA VAL A 62 10.763 4.475 -1.200 1.00 0.00 H new ATOM 0 HB VAL A 62 10.205 1.725 -0.095 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.214 2.581 1.989 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.397 2.526 0.661 1.00 0.00 H new ATOM 0 HG13 VAL A 62 11.675 4.079 1.146 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.842 3.014 1.525 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.243 4.514 0.656 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.274 3.255 -0.144 1.00 0.00 H new ATOM 665 N ILE A 63 12.969 3.723 -2.064 1.00 0.00 N ATOM 666 CA ILE A 63 14.227 3.325 -2.603 1.00 0.00 C ATOM 667 C ILE A 63 15.302 3.508 -1.573 1.00 0.00 C ATOM 668 O ILE A 63 15.463 4.599 -1.005 1.00 0.00 O ATOM 669 CB ILE A 63 14.592 4.146 -3.876 1.00 0.00 C ATOM 670 CG1 ILE A 63 13.470 4.078 -4.920 1.00 0.00 C ATOM 671 CG2 ILE A 63 15.904 3.649 -4.488 1.00 0.00 C ATOM 672 CD1 ILE A 63 13.180 2.685 -5.428 1.00 0.00 C ATOM 0 H ILE A 63 12.879 4.722 -1.879 1.00 0.00 H new ATOM 0 HA ILE A 63 14.150 2.275 -2.883 1.00 0.00 H new ATOM 0 HB ILE A 63 14.718 5.185 -3.571 1.00 0.00 H new ATOM 0 HG12 ILE A 63 12.560 4.491 -4.486 1.00 0.00 H new ATOM 0 HG13 ILE A 63 13.737 4.713 -5.765 1.00 0.00 H new ATOM 0 HG21 ILE A 63 16.138 4.238 -5.375 1.00 0.00 H new ATOM 0 HG22 ILE A 63 16.708 3.755 -3.760 1.00 0.00 H new ATOM 0 HG23 ILE A 63 15.802 2.600 -4.765 1.00 0.00 H new ATOM 0 HD11 ILE A 63 12.375 2.726 -6.162 1.00 0.00 H new ATOM 0 HD12 ILE A 63 14.075 2.274 -5.894 1.00 0.00 H new ATOM 0 HD13 ILE A 63 12.880 2.049 -4.595 1.00 0.00 H new ATOM 684 N MET A 64 16.001 2.466 -1.303 1.00 0.00 N ATOM 685 CA MET A 64 17.152 2.533 -0.448 1.00 0.00 C ATOM 686 C MET A 64 18.359 2.336 -1.292 1.00 0.00 C ATOM 687 O MET A 64 18.232 1.987 -2.451 1.00 0.00 O ATOM 688 CB MET A 64 17.106 1.519 0.698 1.00 0.00 C ATOM 689 CG MET A 64 16.121 1.893 1.791 1.00 0.00 C ATOM 690 SD MET A 64 16.106 0.730 3.182 1.00 0.00 S ATOM 691 CE MET A 64 17.773 0.932 3.815 1.00 0.00 C ATOM 0 H MET A 64 15.798 1.534 -1.665 1.00 0.00 H new ATOM 0 HA MET A 64 17.175 3.510 0.034 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.840 0.541 0.298 1.00 0.00 H new ATOM 0 HB3 MET A 64 18.102 1.426 1.132 1.00 0.00 H new ATOM 0 HG2 MET A 64 16.364 2.888 2.163 1.00 0.00 H new ATOM 0 HG3 MET A 64 15.120 1.948 1.363 1.00 0.00 H new ATOM 0 HE1 MET A 64 18.326 0.001 3.689 1.00 0.00 H new ATOM 0 HE2 MET A 64 18.276 1.730 3.268 1.00 0.00 H new ATOM 0 HE3 MET A 64 17.732 1.188 4.874 1.00 0.00 H new ATOM 701 N VAL A 65 19.505 2.577 -0.765 1.00 0.00 N ATOM 702 CA VAL A 65 20.715 2.392 -1.535 1.00 0.00 C ATOM 703 C VAL A 65 21.873 2.145 -0.591 1.00 0.00 C ATOM 704 O VAL A 65 21.858 2.586 0.563 1.00 0.00 O ATOM 705 CB VAL A 65 21.011 3.599 -2.510 1.00 0.00 C ATOM 706 CG1 VAL A 65 21.599 4.757 -1.808 1.00 0.00 C ATOM 707 CG2 VAL A 65 21.901 3.223 -3.663 1.00 0.00 C ATOM 0 H VAL A 65 19.647 2.902 0.191 1.00 0.00 H new ATOM 0 HA VAL A 65 20.577 1.522 -2.178 1.00 0.00 H new ATOM 0 HB VAL A 65 20.035 3.878 -2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 65 21.784 5.560 -2.522 1.00 0.00 H new ATOM 0 HG12 VAL A 65 20.909 5.106 -1.040 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.539 4.461 -1.343 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.066 4.096 -4.295 1.00 0.00 H new ATOM 0 HG22 VAL A 65 22.858 2.865 -3.283 1.00 0.00 H new ATOM 0 HG23 VAL A 65 21.425 2.436 -4.248 1.00 0.00 H new ATOM 717 N CYS A 66 22.808 1.410 -1.054 1.00 0.00 N ATOM 718 CA CYS A 66 23.960 1.059 -0.305 1.00 0.00 C ATOM 719 C CYS A 66 24.995 2.164 -0.404 1.00 0.00 C ATOM 720 O CYS A 66 25.341 2.615 -1.508 1.00 0.00 O ATOM 721 CB CYS A 66 24.506 -0.227 -0.860 1.00 0.00 C ATOM 722 SG CYS A 66 25.804 -1.006 0.113 1.00 0.00 S ATOM 0 H CYS A 66 22.797 1.020 -1.997 1.00 0.00 H new ATOM 0 HA CYS A 66 23.705 0.928 0.747 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.683 -0.934 -0.967 1.00 0.00 H new ATOM 0 HB3 CYS A 66 24.893 -0.035 -1.861 1.00 0.00 H new ATOM 727 N ARG A 67 25.469 2.585 0.729 1.00 0.00 N ATOM 728 CA ARG A 67 26.430 3.639 0.861 1.00 0.00 C ATOM 729 C ARG A 67 27.325 3.275 2.032 1.00 0.00 C ATOM 730 O ARG A 67 26.823 2.995 3.115 1.00 0.00 O ATOM 731 CB ARG A 67 25.695 4.948 1.192 1.00 0.00 C ATOM 732 CG ARG A 67 26.569 6.201 1.309 1.00 0.00 C ATOM 733 CD ARG A 67 26.733 6.946 -0.015 1.00 0.00 C ATOM 734 NE ARG A 67 27.427 6.190 -1.068 1.00 0.00 N ATOM 735 CZ ARG A 67 27.065 6.211 -2.369 1.00 0.00 C ATOM 736 NH1 ARG A 67 25.898 6.741 -2.734 1.00 0.00 N ATOM 737 NH2 ARG A 67 27.858 5.682 -3.292 1.00 0.00 N ATOM 0 H ARG A 67 25.185 2.187 1.624 1.00 0.00 H new ATOM 0 HA ARG A 67 27.004 3.766 -0.057 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.944 5.124 0.422 1.00 0.00 H new ATOM 0 HB3 ARG A 67 25.161 4.813 2.133 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.131 6.874 2.046 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.553 5.916 1.683 1.00 0.00 H new ATOM 0 HD2 ARG A 67 25.746 7.228 -0.381 1.00 0.00 H new ATOM 0 HD3 ARG A 67 27.281 7.870 0.170 1.00 0.00 H new ATOM 0 HE ARG A 67 28.227 5.617 -0.801 1.00 0.00 H new ATOM 0 HH11 ARG A 67 25.273 7.133 -2.029 1.00 0.00 H new ATOM 0 HH12 ARG A 67 25.629 6.754 -3.718 1.00 0.00 H new ATOM 0 HH21 ARG A 67 28.745 5.257 -3.020 1.00 0.00 H new ATOM 0 HH22 ARG A 67 27.581 5.700 -4.273 1.00 0.00 H new ATOM 751 N LYS A 68 28.628 3.230 1.799 1.00 0.00 N ATOM 752 CA LYS A 68 29.638 2.975 2.852 1.00 0.00 C ATOM 753 C LYS A 68 29.447 1.637 3.556 1.00 0.00 C ATOM 754 O LYS A 68 29.792 1.476 4.740 1.00 0.00 O ATOM 755 CB LYS A 68 29.613 4.103 3.861 1.00 0.00 C ATOM 756 CG LYS A 68 29.970 5.458 3.256 1.00 0.00 C ATOM 757 CD LYS A 68 31.402 5.477 2.726 1.00 0.00 C ATOM 758 CE LYS A 68 31.775 6.838 2.159 1.00 0.00 C ATOM 759 NZ LYS A 68 31.717 7.903 3.182 1.00 0.00 N ATOM 0 H LYS A 68 29.032 3.368 0.873 1.00 0.00 H new ATOM 0 HA LYS A 68 30.609 2.929 2.360 1.00 0.00 H new ATOM 0 HB2 LYS A 68 28.620 4.161 4.307 1.00 0.00 H new ATOM 0 HB3 LYS A 68 30.311 3.877 4.667 1.00 0.00 H new ATOM 0 HG2 LYS A 68 29.278 5.689 2.446 1.00 0.00 H new ATOM 0 HG3 LYS A 68 29.850 6.237 4.009 1.00 0.00 H new ATOM 0 HD2 LYS A 68 32.091 5.217 3.530 1.00 0.00 H new ATOM 0 HD3 LYS A 68 31.514 4.718 1.952 1.00 0.00 H new ATOM 0 HE2 LYS A 68 32.781 6.792 1.741 1.00 0.00 H new ATOM 0 HE3 LYS A 68 31.100 7.086 1.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 32.198 8.753 2.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 30.724 8.129 3.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 32.188 7.577 4.050 1.00 0.00 H new ATOM 773 N GLY A 69 28.908 0.689 2.846 1.00 0.00 N ATOM 774 CA GLY A 69 28.747 -0.623 3.395 1.00 0.00 C ATOM 775 C GLY A 69 27.397 -0.839 4.003 1.00 0.00 C ATOM 776 O GLY A 69 26.989 -1.993 4.234 1.00 0.00 O ATOM 0 H GLY A 69 28.574 0.800 1.889 1.00 0.00 H new ATOM 0 HA2 GLY A 69 28.909 -1.362 2.610 1.00 0.00 H new ATOM 0 HA3 GLY A 69 29.512 -0.790 4.153 1.00 0.00 H new ATOM 780 N GLU A 70 26.696 0.237 4.279 1.00 0.00 N ATOM 781 CA GLU A 70 25.391 0.129 4.871 1.00 0.00 C ATOM 782 C GLU A 70 24.315 0.524 3.875 1.00 0.00 C ATOM 783 O GLU A 70 24.600 1.095 2.827 1.00 0.00 O ATOM 784 CB GLU A 70 25.298 0.944 6.171 1.00 0.00 C ATOM 785 CG GLU A 70 25.573 2.431 6.032 1.00 0.00 C ATOM 786 CD GLU A 70 25.576 3.125 7.366 1.00 0.00 C ATOM 787 OE1 GLU A 70 24.482 3.449 7.889 1.00 0.00 O ATOM 788 OE2 GLU A 70 26.670 3.332 7.934 1.00 0.00 O ATOM 0 H GLU A 70 27.010 1.191 4.102 1.00 0.00 H new ATOM 0 HA GLU A 70 25.223 -0.914 5.139 1.00 0.00 H new ATOM 0 HB2 GLU A 70 24.300 0.815 6.590 1.00 0.00 H new ATOM 0 HB3 GLU A 70 26.002 0.528 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 70 26.536 2.578 5.543 1.00 0.00 H new ATOM 0 HG3 GLU A 70 24.817 2.882 5.389 1.00 0.00 H new ATOM 795 N TRP A 71 23.106 0.227 4.199 1.00 0.00 N ATOM 796 CA TRP A 71 22.000 0.519 3.356 1.00 0.00 C ATOM 797 C TRP A 71 21.274 1.643 3.963 1.00 0.00 C ATOM 798 O TRP A 71 20.872 1.588 5.135 1.00 0.00 O ATOM 799 CB TRP A 71 21.089 -0.698 3.166 1.00 0.00 C ATOM 800 CG TRP A 71 21.724 -1.831 2.409 1.00 0.00 C ATOM 801 CD1 TRP A 71 22.528 -2.807 2.910 1.00 0.00 C ATOM 802 CD2 TRP A 71 21.588 -2.108 1.009 1.00 0.00 C ATOM 803 NE1 TRP A 71 22.903 -3.667 1.910 1.00 0.00 N ATOM 804 CE2 TRP A 71 22.347 -3.261 0.734 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.904 -1.491 -0.037 1.00 0.00 C ATOM 806 CZ2 TRP A 71 22.437 -3.812 -0.551 1.00 0.00 C ATOM 807 CZ3 TRP A 71 20.998 -2.040 -1.300 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.762 -3.186 -1.543 1.00 0.00 C ATOM 0 H TRP A 71 22.853 -0.234 5.073 1.00 0.00 H new ATOM 0 HA TRP A 71 22.351 0.784 2.359 1.00 0.00 H new ATOM 0 HB2 TRP A 71 20.777 -1.060 4.145 1.00 0.00 H new ATOM 0 HB3 TRP A 71 20.188 -0.384 2.640 1.00 0.00 H new ATOM 0 HD1 TRP A 71 22.827 -2.892 3.944 1.00 0.00 H new ATOM 0 HE1 TRP A 71 23.504 -4.483 2.028 1.00 0.00 H new ATOM 0 HE3 TRP A 71 20.314 -0.603 0.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 23.021 -4.700 -0.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.470 -1.574 -2.119 1.00 0.00 H new ATOM 0 HH2 TRP A 71 21.815 -3.581 -2.547 1.00 0.00 H new ATOM 819 N VAL A 72 21.146 2.668 3.221 1.00 0.00 N ATOM 820 CA VAL A 72 20.541 3.836 3.689 1.00 0.00 C ATOM 821 C VAL A 72 19.481 4.223 2.754 1.00 0.00 C ATOM 822 O VAL A 72 19.136 3.490 1.831 1.00 0.00 O ATOM 823 CB VAL A 72 21.578 4.929 3.819 1.00 0.00 C ATOM 824 CG1 VAL A 72 22.024 5.764 2.626 1.00 0.00 C ATOM 825 CG2 VAL A 72 21.973 5.349 5.207 1.00 0.00 C ATOM 0 H VAL A 72 21.466 2.716 2.254 1.00 0.00 H new ATOM 0 HA VAL A 72 20.102 3.669 4.673 1.00 0.00 H new ATOM 0 HB VAL A 72 22.385 4.278 3.483 1.00 0.00 H new ATOM 0 HG11 VAL A 72 22.773 6.487 2.948 1.00 0.00 H new ATOM 0 HG12 VAL A 72 22.453 5.112 1.865 1.00 0.00 H new ATOM 0 HG13 VAL A 72 21.166 6.292 2.210 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.722 6.138 5.149 1.00 0.00 H new ATOM 0 HG22 VAL A 72 21.096 5.719 5.738 1.00 0.00 H new ATOM 0 HG23 VAL A 72 22.387 4.494 5.742 1.00 0.00 H new ATOM 835 N ALA A 73 19.025 5.344 2.944 1.00 0.00 N ATOM 836 CA ALA A 73 17.902 5.809 2.267 1.00 0.00 C ATOM 837 C ALA A 73 18.247 6.697 1.091 1.00 0.00 C ATOM 838 O ALA A 73 18.778 7.798 1.256 1.00 0.00 O ATOM 839 CB ALA A 73 17.070 6.515 3.248 1.00 0.00 C ATOM 0 H ALA A 73 19.424 6.014 3.601 1.00 0.00 H new ATOM 0 HA ALA A 73 17.364 4.966 1.833 1.00 0.00 H new ATOM 0 HB1 ALA A 73 16.175 6.898 2.758 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.782 5.827 4.043 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.634 7.345 3.673 1.00 0.00 H new ATOM 845 N LEU A 74 18.000 6.178 -0.092 1.00 0.00 N ATOM 846 CA LEU A 74 18.102 6.939 -1.319 1.00 0.00 C ATOM 847 C LEU A 74 16.945 7.899 -1.300 1.00 0.00 C ATOM 848 O LEU A 74 17.095 9.111 -1.427 1.00 0.00 O ATOM 849 CB LEU A 74 17.936 5.978 -2.502 1.00 0.00 C ATOM 850 CG LEU A 74 18.167 6.488 -3.959 1.00 0.00 C ATOM 851 CD1 LEU A 74 17.261 7.624 -4.404 1.00 0.00 C ATOM 852 CD2 LEU A 74 19.625 6.767 -4.256 1.00 0.00 C ATOM 0 H LEU A 74 17.720 5.207 -0.231 1.00 0.00 H new ATOM 0 HA LEU A 74 19.057 7.457 -1.408 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.617 5.142 -2.339 1.00 0.00 H new ATOM 0 HB3 LEU A 74 16.923 5.578 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 74 17.862 5.645 -4.578 1.00 0.00 H new ATOM 0 HD11 LEU A 74 17.504 7.903 -5.429 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.221 7.302 -4.352 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.408 8.484 -3.750 1.00 0.00 H new ATOM 0 HD21 LEU A 74 19.726 7.119 -5.283 1.00 0.00 H new ATOM 0 HD22 LEU A 74 19.996 7.531 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 74 20.204 5.853 -4.127 1.00 0.00 H new ATOM 864 N ASN A 75 15.775 7.348 -1.125 1.00 0.00 N ATOM 865 CA ASN A 75 14.601 8.144 -1.082 1.00 0.00 C ATOM 866 C ASN A 75 13.824 7.955 0.211 1.00 0.00 C ATOM 867 O ASN A 75 12.870 7.184 0.256 1.00 0.00 O ATOM 868 CB ASN A 75 13.699 7.928 -2.302 1.00 0.00 C ATOM 869 CG ASN A 75 13.734 9.082 -3.301 1.00 0.00 C ATOM 870 OD1 ASN A 75 12.754 9.348 -3.994 1.00 0.00 O ATOM 871 ND2 ASN A 75 14.840 9.775 -3.385 1.00 0.00 N ATOM 0 H ASN A 75 15.619 6.346 -1.010 1.00 0.00 H new ATOM 0 HA ASN A 75 14.942 9.179 -1.112 1.00 0.00 H new ATOM 0 HB2 ASN A 75 14.001 7.011 -2.808 1.00 0.00 H new ATOM 0 HB3 ASN A 75 12.673 7.783 -1.964 1.00 0.00 H new ATOM 0 HD21 ASN A 75 14.904 10.557 -4.037 1.00 0.00 H new ATOM 0 HD22 ASN A 75 15.639 9.534 -2.799 1.00 0.00 H new ATOM 878 N PRO A 76 14.251 8.628 1.307 1.00 0.00 N ATOM 879 CA PRO A 76 13.543 8.576 2.603 1.00 0.00 C ATOM 880 C PRO A 76 12.264 9.410 2.561 1.00 0.00 C ATOM 881 O PRO A 76 11.400 9.307 3.438 1.00 0.00 O ATOM 882 CB PRO A 76 14.549 9.195 3.575 1.00 0.00 C ATOM 883 CG PRO A 76 15.367 10.107 2.731 1.00 0.00 C ATOM 884 CD PRO A 76 15.471 9.459 1.391 1.00 0.00 C ATOM 0 HA PRO A 76 13.237 7.567 2.878 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.046 9.738 4.375 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.166 8.431 4.048 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.899 11.088 2.653 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.354 10.259 3.167 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.508 10.198 0.591 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.374 8.854 1.308 1.00 0.00 H new ATOM 892 N LEU A 77 12.160 10.227 1.511 1.00 0.00 N ATOM 893 CA LEU A 77 11.000 11.065 1.274 1.00 0.00 C ATOM 894 C LEU A 77 9.821 10.176 0.919 1.00 0.00 C ATOM 895 O LEU A 77 8.662 10.491 1.216 1.00 0.00 O ATOM 896 CB LEU A 77 11.230 12.059 0.091 1.00 0.00 C ATOM 897 CG LEU A 77 12.386 13.096 0.168 1.00 0.00 C ATOM 898 CD1 LEU A 77 12.347 13.909 1.446 1.00 0.00 C ATOM 899 CD2 LEU A 77 13.756 12.464 -0.053 1.00 0.00 C ATOM 0 H LEU A 77 12.887 10.321 0.801 1.00 0.00 H new ATOM 0 HA LEU A 77 10.813 11.642 2.180 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.386 11.464 -0.809 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.303 12.615 -0.052 1.00 0.00 H new ATOM 0 HG LEU A 77 12.222 13.789 -0.657 1.00 0.00 H new ATOM 0 HD11 LEU A 77 13.175 14.618 1.451 1.00 0.00 H new ATOM 0 HD12 LEU A 77 11.403 14.452 1.503 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.435 13.243 2.304 1.00 0.00 H new ATOM 0 HD21 LEU A 77 14.526 13.233 0.011 1.00 0.00 H new ATOM 0 HD22 LEU A 77 13.935 11.707 0.710 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.788 12.000 -1.039 1.00 0.00 H new ATOM 911 N ARG A 78 10.126 9.052 0.306 1.00 0.00 N ATOM 912 CA ARG A 78 9.119 8.154 -0.167 1.00 0.00 C ATOM 913 C ARG A 78 8.610 7.289 0.958 1.00 0.00 C ATOM 914 O ARG A 78 9.361 6.888 1.855 1.00 0.00 O ATOM 915 CB ARG A 78 9.641 7.289 -1.313 1.00 0.00 C ATOM 916 CG ARG A 78 10.137 8.076 -2.522 1.00 0.00 C ATOM 917 CD ARG A 78 9.061 8.963 -3.116 1.00 0.00 C ATOM 918 NE ARG A 78 9.525 9.621 -4.334 1.00 0.00 N ATOM 919 CZ ARG A 78 9.218 10.863 -4.731 1.00 0.00 C ATOM 920 NH1 ARG A 78 8.504 11.672 -3.948 1.00 0.00 N ATOM 921 NH2 ARG A 78 9.661 11.300 -5.899 1.00 0.00 N ATOM 0 H ARG A 78 11.082 8.744 0.126 1.00 0.00 H new ATOM 0 HA ARG A 78 8.292 8.752 -0.549 1.00 0.00 H new ATOM 0 HB2 ARG A 78 10.455 6.667 -0.941 1.00 0.00 H new ATOM 0 HB3 ARG A 78 8.847 6.615 -1.634 1.00 0.00 H new ATOM 0 HG2 ARG A 78 10.988 8.690 -2.228 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.492 7.381 -3.283 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.177 8.366 -3.338 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.763 9.715 -2.385 1.00 0.00 H new ATOM 0 HE ARG A 78 10.143 9.083 -4.941 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.185 11.347 -3.035 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.277 12.616 -4.262 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.231 10.693 -6.488 1.00 0.00 H new ATOM 0 HH22 ARG A 78 9.433 12.244 -6.210 1.00 0.00 H new ATOM 935 N LYS A 79 7.350 7.021 0.911 1.00 0.00 N ATOM 936 CA LYS A 79 6.690 6.233 1.900 1.00 0.00 C ATOM 937 C LYS A 79 5.682 5.377 1.180 1.00 0.00 C ATOM 938 O LYS A 79 5.297 5.702 0.034 1.00 0.00 O ATOM 939 CB LYS A 79 5.968 7.148 2.909 1.00 0.00 C ATOM 940 CG LYS A 79 4.816 7.947 2.302 1.00 0.00 C ATOM 941 CD LYS A 79 4.148 8.871 3.307 1.00 0.00 C ATOM 942 CE LYS A 79 5.046 10.025 3.694 1.00 0.00 C ATOM 943 NZ LYS A 79 4.396 10.948 4.641 1.00 0.00 N ATOM 0 H LYS A 79 6.734 7.350 0.168 1.00 0.00 H new ATOM 0 HA LYS A 79 7.406 5.621 2.448 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.584 6.539 3.727 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.691 7.841 3.339 1.00 0.00 H new ATOM 0 HG2 LYS A 79 5.190 8.537 1.465 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.074 7.258 1.900 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.221 9.258 2.884 1.00 0.00 H new ATOM 0 HD3 LYS A 79 3.880 8.305 4.199 1.00 0.00 H new ATOM 0 HE2 LYS A 79 5.961 9.636 4.140 1.00 0.00 H new ATOM 0 HE3 LYS A 79 5.336 10.573 2.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.050 11.722 4.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 3.536 11.341 4.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 4.142 10.433 5.508 1.00 0.00 H new ATOM 957 N CYS A 80 5.283 4.318 1.785 1.00 0.00 N ATOM 958 CA CYS A 80 4.276 3.490 1.217 1.00 0.00 C ATOM 959 C CYS A 80 2.930 3.902 1.787 1.00 0.00 C ATOM 960 O CYS A 80 2.646 3.715 2.972 1.00 0.00 O ATOM 961 CB CYS A 80 4.589 2.020 1.468 1.00 0.00 C ATOM 962 SG CYS A 80 6.265 1.546 0.888 1.00 0.00 S ATOM 0 H CYS A 80 5.642 3.999 2.685 1.00 0.00 H new ATOM 0 HA CYS A 80 4.245 3.618 0.135 1.00 0.00 H new ATOM 0 HB2 CYS A 80 4.505 1.812 2.535 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.846 1.403 0.963 1.00 0.00 H new ATOM 967 N GLN A 81 2.158 4.545 0.965 1.00 0.00 N ATOM 968 CA GLN A 81 0.843 5.027 1.338 1.00 0.00 C ATOM 969 C GLN A 81 -0.160 3.997 0.932 1.00 0.00 C ATOM 970 O GLN A 81 0.137 3.156 0.111 1.00 0.00 O ATOM 971 CB GLN A 81 0.530 6.332 0.604 1.00 0.00 C ATOM 972 CG GLN A 81 1.491 7.461 0.898 1.00 0.00 C ATOM 973 CD GLN A 81 1.198 8.713 0.096 1.00 0.00 C ATOM 974 OE1 GLN A 81 0.697 8.651 -1.030 1.00 0.00 O ATOM 975 NE2 GLN A 81 1.486 9.850 0.668 1.00 0.00 N ATOM 0 H GLN A 81 2.418 4.758 0.002 1.00 0.00 H new ATOM 0 HA GLN A 81 0.810 5.207 2.413 1.00 0.00 H new ATOM 0 HB2 GLN A 81 0.532 6.140 -0.469 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -0.478 6.651 0.869 1.00 0.00 H new ATOM 0 HG2 GLN A 81 1.449 7.699 1.961 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.508 7.130 0.686 1.00 0.00 H new ATOM 0 HE21 GLN A 81 1.900 9.862 1.600 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.297 10.727 0.183 1.00 0.00 H new ATOM 984 N LYS A 82 -1.321 4.035 1.491 1.00 0.00 N ATOM 985 CA LYS A 82 -2.358 3.141 1.050 1.00 0.00 C ATOM 986 C LYS A 82 -2.874 3.684 -0.259 1.00 0.00 C ATOM 987 O LYS A 82 -2.847 4.890 -0.467 1.00 0.00 O ATOM 988 CB LYS A 82 -3.481 3.071 2.066 1.00 0.00 C ATOM 989 CG LYS A 82 -3.036 2.614 3.439 1.00 0.00 C ATOM 990 CD LYS A 82 -4.207 2.560 4.375 1.00 0.00 C ATOM 991 CE LYS A 82 -3.782 2.278 5.794 1.00 0.00 C ATOM 992 NZ LYS A 82 -4.941 2.271 6.702 1.00 0.00 N ATOM 0 H LYS A 82 -1.583 4.666 2.248 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.967 2.130 0.932 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.942 4.055 2.153 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.249 2.391 1.698 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.572 1.630 3.369 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -2.281 3.296 3.830 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.744 3.508 4.339 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.901 1.787 4.044 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.274 1.315 5.840 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.066 3.032 6.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.636 2.549 7.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.656 2.943 6.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.351 1.316 6.734 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.276 2.837 -1.157 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.751 3.333 -2.427 1.00 0.00 C ATOM 1008 C ARG A 83 -5.167 3.861 -2.293 1.00 0.00 C ATOM 1009 O ARG A 83 -5.974 3.294 -1.544 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.652 2.276 -3.527 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.495 1.039 -3.301 1.00 0.00 C ATOM 1012 CD ARG A 83 -4.214 0.005 -4.364 1.00 0.00 C ATOM 1013 NE ARG A 83 -2.791 -0.352 -4.398 1.00 0.00 N ATOM 1014 CZ ARG A 83 -2.232 -1.228 -5.235 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -2.979 -1.896 -6.109 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -0.931 -1.436 -5.184 1.00 0.00 N ATOM 0 H ARG A 83 -3.288 1.823 -1.047 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.103 4.158 -2.725 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.945 2.730 -4.474 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.610 1.974 -3.628 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.284 0.623 -2.316 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.552 1.305 -3.315 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.810 -0.887 -4.173 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.518 0.389 -5.338 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.178 0.108 -3.725 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.986 -1.740 -6.143 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.545 -2.564 -6.746 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.360 -0.929 -4.508 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.496 -2.104 -5.820 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.465 4.978 -2.959 1.00 0.00 N ATOM 1031 CA PRO A 84 -6.799 5.545 -2.954 1.00 0.00 C ATOM 1032 C PRO A 84 -7.736 4.663 -3.785 1.00 0.00 C ATOM 1033 O PRO A 84 -7.320 4.061 -4.789 1.00 0.00 O ATOM 1034 CB PRO A 84 -6.617 6.922 -3.601 1.00 0.00 C ATOM 1035 CG PRO A 84 -5.393 6.796 -4.439 1.00 0.00 C ATOM 1036 CD PRO A 84 -4.525 5.775 -3.768 1.00 0.00 C ATOM 0 HA PRO A 84 -7.238 5.615 -1.959 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -7.483 7.191 -4.206 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.500 7.700 -2.847 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -5.646 6.485 -5.452 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -4.877 7.753 -4.519 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.002 5.156 -4.497 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -3.764 6.246 -3.146 1.00 0.00 H new ATOM 1044 N CYS A 85 -8.962 4.569 -3.379 1.00 0.00 N ATOM 1045 CA CYS A 85 -9.893 3.657 -4.027 1.00 0.00 C ATOM 1046 C CYS A 85 -10.864 4.391 -4.916 1.00 0.00 C ATOM 1047 O CYS A 85 -11.561 3.780 -5.745 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.642 2.909 -2.961 1.00 0.00 C ATOM 1049 SG CYS A 85 -9.553 2.332 -1.652 1.00 0.00 S ATOM 0 H CYS A 85 -9.356 5.104 -2.605 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.331 2.969 -4.658 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.409 3.556 -2.536 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.155 2.057 -3.408 1.00 0.00 H new ATOM 1054 N GLY A 86 -10.933 5.685 -4.741 1.00 0.00 N ATOM 1055 CA GLY A 86 -11.819 6.466 -5.515 1.00 0.00 C ATOM 1056 C GLY A 86 -13.246 6.323 -5.071 1.00 0.00 C ATOM 1057 O GLY A 86 -13.538 5.746 -4.013 1.00 0.00 O ATOM 0 H GLY A 86 -10.378 6.208 -4.063 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.525 7.514 -5.452 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -11.736 6.174 -6.562 1.00 0.00 H new ATOM 1061 N HIS A 87 -14.114 6.811 -5.890 1.00 0.00 N ATOM 1062 CA HIS A 87 -15.543 6.825 -5.653 1.00 0.00 C ATOM 1063 C HIS A 87 -16.091 5.381 -5.706 1.00 0.00 C ATOM 1064 O HIS A 87 -15.963 4.707 -6.724 1.00 0.00 O ATOM 1065 CB HIS A 87 -16.174 7.715 -6.740 1.00 0.00 C ATOM 1066 CG HIS A 87 -17.636 8.028 -6.608 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -18.121 8.991 -5.761 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -18.709 7.545 -7.268 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -19.419 9.092 -5.901 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -19.806 8.224 -6.810 1.00 0.00 N ATOM 0 H HIS A 87 -13.852 7.231 -6.782 1.00 0.00 H new ATOM 0 HA HIS A 87 -15.785 7.224 -4.668 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -15.628 8.658 -6.764 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -16.018 7.232 -7.705 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -18.704 6.768 -8.018 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -20.062 9.772 -5.362 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -20.766 8.080 -7.123 1.00 0.00 H new ATOM 1079 N PRO A 88 -16.691 4.895 -4.601 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.233 3.513 -4.511 1.00 0.00 C ATOM 1081 C PRO A 88 -18.584 3.387 -5.158 1.00 0.00 C ATOM 1082 O PRO A 88 -19.157 2.298 -5.254 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.377 3.302 -3.003 1.00 0.00 C ATOM 1084 CG PRO A 88 -17.622 4.667 -2.447 1.00 0.00 C ATOM 1085 CD PRO A 88 -16.856 5.630 -3.319 1.00 0.00 C ATOM 0 HA PRO A 88 -16.592 2.791 -5.016 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.203 2.628 -2.775 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -16.477 2.858 -2.578 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -18.686 4.902 -2.452 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -17.286 4.730 -1.412 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.402 6.563 -3.460 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.893 5.888 -2.879 1.00 0.00 H new ATOM 1093 N GLY A 89 -19.104 4.495 -5.555 1.00 0.00 N ATOM 1094 CA GLY A 89 -20.389 4.529 -6.124 1.00 0.00 C ATOM 1095 C GLY A 89 -21.324 5.257 -5.218 1.00 0.00 C ATOM 1096 O GLY A 89 -21.337 5.016 -3.994 1.00 0.00 O ATOM 0 H GLY A 89 -18.642 5.402 -5.491 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -20.353 5.021 -7.096 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -20.749 3.514 -6.293 1.00 0.00 H new ATOM 1100 N ASP A 90 -22.088 6.111 -5.796 1.00 0.00 N ATOM 1101 CA ASP A 90 -22.997 6.974 -5.088 1.00 0.00 C ATOM 1102 C ASP A 90 -24.357 6.354 -4.994 1.00 0.00 C ATOM 1103 O ASP A 90 -24.610 5.278 -5.545 1.00 0.00 O ATOM 1104 CB ASP A 90 -23.075 8.362 -5.757 1.00 0.00 C ATOM 1105 CG ASP A 90 -23.260 8.287 -7.262 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -24.389 8.096 -7.742 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -22.233 8.385 -7.990 1.00 0.00 O ATOM 0 H ASP A 90 -22.108 6.242 -6.807 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.613 7.107 -4.077 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -23.903 8.922 -5.322 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -22.163 8.917 -5.536 1.00 0.00 H new ATOM 1112 N THR A 91 -25.214 7.002 -4.278 1.00 0.00 N ATOM 1113 CA THR A 91 -26.534 6.543 -4.078 1.00 0.00 C ATOM 1114 C THR A 91 -27.386 7.703 -3.580 1.00 0.00 C ATOM 1115 O THR A 91 -26.995 8.406 -2.645 1.00 0.00 O ATOM 1116 CB THR A 91 -26.576 5.368 -3.058 1.00 0.00 C ATOM 1117 OG1 THR A 91 -27.935 4.992 -2.761 1.00 0.00 O ATOM 1118 CG2 THR A 91 -25.817 5.708 -1.775 1.00 0.00 C ATOM 0 H THR A 91 -25.005 7.883 -3.809 1.00 0.00 H new ATOM 0 HA THR A 91 -26.926 6.170 -5.024 1.00 0.00 H new ATOM 0 HB THR A 91 -26.077 4.517 -3.521 1.00 0.00 H new ATOM 0 HG1 THR A 91 -27.939 4.159 -2.244 1.00 0.00 H new ATOM 0 HG21 THR A 91 -25.868 4.864 -1.087 1.00 0.00 H new ATOM 0 HG22 THR A 91 -24.775 5.918 -2.014 1.00 0.00 H new ATOM 0 HG23 THR A 91 -26.266 6.584 -1.308 1.00 0.00 H new ATOM 1126 N PRO A 92 -28.511 7.972 -4.227 1.00 0.00 N ATOM 1127 CA PRO A 92 -29.427 9.005 -3.783 1.00 0.00 C ATOM 1128 C PRO A 92 -30.457 8.455 -2.785 1.00 0.00 C ATOM 1129 O PRO A 92 -31.282 9.203 -2.245 1.00 0.00 O ATOM 1130 CB PRO A 92 -30.104 9.423 -5.082 1.00 0.00 C ATOM 1131 CG PRO A 92 -30.146 8.176 -5.906 1.00 0.00 C ATOM 1132 CD PRO A 92 -28.962 7.338 -5.488 1.00 0.00 C ATOM 0 HA PRO A 92 -28.931 9.822 -3.260 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -31.106 9.811 -4.899 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -29.544 10.211 -5.585 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -31.079 7.636 -5.743 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -30.096 8.413 -6.969 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -29.243 6.296 -5.334 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -28.177 7.348 -6.244 1.00 0.00 H new ATOM 1140 N PHE A 93 -30.409 7.148 -2.558 1.00 0.00 N ATOM 1141 CA PHE A 93 -31.329 6.495 -1.650 1.00 0.00 C ATOM 1142 C PHE A 93 -30.644 6.097 -0.357 1.00 0.00 C ATOM 1143 O PHE A 93 -31.138 6.384 0.733 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.970 5.254 -2.295 1.00 0.00 C ATOM 1145 CG PHE A 93 -32.840 5.545 -3.487 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -34.187 5.823 -3.328 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -32.313 5.530 -4.762 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -34.988 6.083 -4.424 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -33.101 5.788 -5.860 1.00 0.00 C ATOM 1150 CZ PHE A 93 -34.443 6.066 -5.693 1.00 0.00 C ATOM 0 H PHE A 93 -29.735 6.520 -2.996 1.00 0.00 H new ATOM 0 HA PHE A 93 -32.113 7.218 -1.424 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -31.178 4.569 -2.598 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -32.567 4.738 -1.543 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -34.616 5.837 -2.337 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -31.264 5.312 -4.901 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -36.037 6.299 -4.288 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -32.671 5.773 -6.850 1.00 0.00 H new ATOM 0 HZ PHE A 93 -35.065 6.270 -6.552 1.00 0.00 H new ATOM 1160 N GLY A 94 -29.494 5.481 -0.469 1.00 0.00 N ATOM 1161 CA GLY A 94 -28.839 4.966 0.699 1.00 0.00 C ATOM 1162 C GLY A 94 -27.688 5.811 1.153 1.00 0.00 C ATOM 1163 O GLY A 94 -27.463 6.908 0.646 1.00 0.00 O ATOM 0 H GLY A 94 -28.999 5.327 -1.348 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -29.564 4.887 1.509 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -28.481 3.958 0.492 1.00 0.00 H new ATOM 1167 N THR A 95 -26.969 5.316 2.103 1.00 0.00 N ATOM 1168 CA THR A 95 -25.833 5.996 2.650 1.00 0.00 C ATOM 1169 C THR A 95 -24.817 4.906 3.027 1.00 0.00 C ATOM 1170 O THR A 95 -25.163 3.719 3.023 1.00 0.00 O ATOM 1171 CB THR A 95 -26.248 6.787 3.923 1.00 0.00 C ATOM 1172 OG1 THR A 95 -27.514 7.452 3.700 1.00 0.00 O ATOM 1173 CG2 THR A 95 -25.212 7.853 4.274 1.00 0.00 C ATOM 0 H THR A 95 -27.154 4.410 2.533 1.00 0.00 H new ATOM 0 HA THR A 95 -25.415 6.704 1.935 1.00 0.00 H new ATOM 0 HB THR A 95 -26.326 6.072 4.742 1.00 0.00 H new ATOM 0 HG1 THR A 95 -27.770 7.947 4.506 1.00 0.00 H new ATOM 0 HG21 THR A 95 -25.530 8.389 5.168 1.00 0.00 H new ATOM 0 HG22 THR A 95 -24.249 7.377 4.459 1.00 0.00 H new ATOM 0 HG23 THR A 95 -25.117 8.554 3.445 1.00 0.00 H new ATOM 1181 N PHE A 96 -23.601 5.270 3.314 1.00 0.00 N ATOM 1182 CA PHE A 96 -22.616 4.299 3.693 1.00 0.00 C ATOM 1183 C PHE A 96 -21.708 4.868 4.741 1.00 0.00 C ATOM 1184 O PHE A 96 -21.604 6.096 4.877 1.00 0.00 O ATOM 1185 CB PHE A 96 -21.812 3.794 2.478 1.00 0.00 C ATOM 1186 CG PHE A 96 -21.020 4.847 1.747 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -19.711 5.121 2.106 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -21.579 5.538 0.685 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -18.975 6.068 1.424 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -20.846 6.484 -0.009 1.00 0.00 C ATOM 1191 CZ PHE A 96 -19.540 6.751 0.362 1.00 0.00 C ATOM 0 H PHE A 96 -23.267 6.234 3.293 1.00 0.00 H new ATOM 0 HA PHE A 96 -23.137 3.437 4.110 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -21.127 3.016 2.815 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -22.502 3.328 1.775 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -19.261 4.587 2.930 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -22.600 5.336 0.395 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.957 6.276 1.719 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -21.292 7.013 -0.838 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.964 7.490 -0.175 1.00 0.00 H new ATOM 1201 N THR A 97 -21.089 4.007 5.482 1.00 0.00 N ATOM 1202 CA THR A 97 -20.189 4.387 6.503 1.00 0.00 C ATOM 1203 C THR A 97 -18.804 3.817 6.232 1.00 0.00 C ATOM 1204 O THR A 97 -18.673 2.810 5.527 1.00 0.00 O ATOM 1205 CB THR A 97 -20.744 3.905 7.832 1.00 0.00 C ATOM 1206 OG1 THR A 97 -21.687 2.842 7.583 1.00 0.00 O ATOM 1207 CG2 THR A 97 -21.462 5.003 8.514 1.00 0.00 C ATOM 0 H THR A 97 -21.203 2.998 5.386 1.00 0.00 H new ATOM 0 HA THR A 97 -20.085 5.472 6.532 1.00 0.00 H new ATOM 0 HB THR A 97 -19.920 3.561 8.457 1.00 0.00 H new ATOM 0 HG1 THR A 97 -21.772 2.286 8.385 1.00 0.00 H new ATOM 0 HG21 THR A 97 -21.855 4.645 9.465 1.00 0.00 H new ATOM 0 HG22 THR A 97 -20.776 5.830 8.693 1.00 0.00 H new ATOM 0 HG23 THR A 97 -22.285 5.344 7.887 1.00 0.00 H new ATOM 1215 N LEU A 98 -17.785 4.466 6.743 1.00 0.00 N ATOM 1216 CA LEU A 98 -16.429 4.029 6.522 1.00 0.00 C ATOM 1217 C LEU A 98 -15.786 3.601 7.811 1.00 0.00 C ATOM 1218 O LEU A 98 -15.866 4.295 8.815 1.00 0.00 O ATOM 1219 CB LEU A 98 -15.576 5.136 5.906 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.970 5.651 4.523 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -15.022 6.756 4.113 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.939 4.531 3.494 1.00 0.00 C ATOM 0 H LEU A 98 -17.871 5.304 7.318 1.00 0.00 H new ATOM 0 HA LEU A 98 -16.481 3.186 5.833 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -15.579 5.983 6.592 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -14.549 4.775 5.849 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.988 6.037 4.570 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -15.300 7.126 3.126 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -15.078 7.570 4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -14.004 6.369 4.082 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -16.224 4.925 2.518 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.933 4.116 3.438 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -16.639 3.748 3.787 1.00 0.00 H new ATOM 1234 N THR A 99 -15.150 2.483 7.775 1.00 0.00 N ATOM 1235 CA THR A 99 -14.409 1.988 8.905 1.00 0.00 C ATOM 1236 C THR A 99 -12.996 1.656 8.453 1.00 0.00 C ATOM 1237 O THR A 99 -12.775 1.340 7.263 1.00 0.00 O ATOM 1238 CB THR A 99 -15.089 0.742 9.565 1.00 0.00 C ATOM 1239 OG1 THR A 99 -14.298 0.237 10.651 1.00 0.00 O ATOM 1240 CG2 THR A 99 -15.308 -0.362 8.561 1.00 0.00 C ATOM 0 H THR A 99 -15.123 1.873 6.958 1.00 0.00 H new ATOM 0 HA THR A 99 -14.386 2.764 9.670 1.00 0.00 H new ATOM 0 HB THR A 99 -16.055 1.073 9.945 1.00 0.00 H new ATOM 0 HG1 THR A 99 -14.745 -0.540 11.048 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.782 -1.212 9.052 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.952 -0.002 7.759 1.00 0.00 H new ATOM 0 HG23 THR A 99 -14.349 -0.671 8.145 1.00 0.00 H new ATOM 1248 N GLY A 100 -12.040 1.817 9.344 1.00 0.00 N ATOM 1249 CA GLY A 100 -10.673 1.469 9.047 1.00 0.00 C ATOM 1250 C GLY A 100 -9.936 2.595 8.385 1.00 0.00 C ATOM 1251 O GLY A 100 -9.034 3.189 8.972 1.00 0.00 O ATOM 0 H GLY A 100 -12.189 2.188 10.282 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.161 1.193 9.969 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.655 0.593 8.398 1.00 0.00 H new ATOM 1255 N GLY A 101 -10.342 2.915 7.194 1.00 0.00 N ATOM 1256 CA GLY A 101 -9.671 3.939 6.441 1.00 0.00 C ATOM 1257 C GLY A 101 -10.162 5.328 6.750 1.00 0.00 C ATOM 1258 O GLY A 101 -9.363 6.246 6.864 1.00 0.00 O ATOM 0 H GLY A 101 -11.135 2.483 6.719 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.601 3.886 6.644 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.804 3.743 5.377 1.00 0.00 H new ATOM 1262 N ASN A 102 -11.494 5.480 6.855 1.00 0.00 N ATOM 1263 CA ASN A 102 -12.172 6.790 7.145 1.00 0.00 C ATOM 1264 C ASN A 102 -12.184 7.717 5.901 1.00 0.00 C ATOM 1265 O ASN A 102 -12.806 8.776 5.882 1.00 0.00 O ATOM 1266 CB ASN A 102 -11.569 7.473 8.413 1.00 0.00 C ATOM 1267 CG ASN A 102 -12.238 8.777 8.803 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -13.224 8.784 9.530 1.00 0.00 O ATOM 1269 ND2 ASN A 102 -11.669 9.873 8.397 1.00 0.00 N ATOM 0 H ASN A 102 -12.147 4.705 6.743 1.00 0.00 H new ATOM 0 HA ASN A 102 -13.217 6.584 7.375 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -11.637 6.779 9.251 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -10.509 7.660 8.240 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -12.042 10.778 8.683 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -10.849 9.828 7.792 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.538 7.254 4.862 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.466 7.897 3.560 1.00 0.00 C ATOM 1278 C VAL A 103 -11.421 6.768 2.565 1.00 0.00 C ATOM 1279 O VAL A 103 -11.430 5.602 2.980 1.00 0.00 O ATOM 1280 CB VAL A 103 -10.200 8.803 3.366 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -10.219 10.006 4.280 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -8.931 8.012 3.569 1.00 0.00 C ATOM 0 H VAL A 103 -11.020 6.376 4.895 1.00 0.00 H new ATOM 0 HA VAL A 103 -12.320 8.564 3.440 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.225 9.167 2.339 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.324 10.605 4.112 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.103 10.608 4.071 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.244 9.674 5.318 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -8.069 8.664 3.429 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -8.915 7.602 4.579 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.891 7.197 2.846 1.00 0.00 H new ATOM 1292 N PHE A 104 -11.333 7.057 1.303 1.00 0.00 N ATOM 1293 CA PHE A 104 -11.336 6.004 0.321 1.00 0.00 C ATOM 1294 C PHE A 104 -9.916 5.505 0.073 1.00 0.00 C ATOM 1295 O PHE A 104 -9.262 5.897 -0.900 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.999 6.461 -0.978 1.00 0.00 C ATOM 1297 CG PHE A 104 -13.361 7.062 -0.782 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -14.381 6.334 -0.198 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.619 8.356 -1.191 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.627 6.886 -0.021 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.866 8.915 -1.016 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.872 8.178 -0.431 1.00 0.00 C ATOM 0 H PHE A 104 -11.259 8.002 0.926 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.925 5.174 0.711 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.355 7.193 -1.466 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.081 5.609 -1.653 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.196 5.319 0.123 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.834 8.936 -1.653 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.414 6.307 0.439 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -15.054 9.929 -1.337 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.851 8.612 -0.294 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.446 4.672 0.976 1.00 0.00 N ATOM 1313 CA GLU A 105 -8.101 4.128 0.936 1.00 0.00 C ATOM 1314 C GLU A 105 -8.145 2.615 1.170 1.00 0.00 C ATOM 1315 O GLU A 105 -9.074 2.117 1.813 1.00 0.00 O ATOM 1316 CB GLU A 105 -7.244 4.789 2.024 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.778 4.554 3.446 1.00 0.00 C ATOM 1318 CD GLU A 105 -6.854 5.027 4.551 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -6.422 6.193 4.543 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -6.585 4.235 5.492 1.00 0.00 O ATOM 0 H GLU A 105 -9.994 4.347 1.772 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.664 4.329 -0.042 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.226 4.405 1.958 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.193 5.861 1.835 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.737 5.062 3.549 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.966 3.489 3.578 1.00 0.00 H new ATOM 1327 N TYR A 106 -7.180 1.895 0.609 1.00 0.00 N ATOM 1328 CA TYR A 106 -7.041 0.442 0.793 1.00 0.00 C ATOM 1329 C TYR A 106 -7.213 0.037 2.258 1.00 0.00 C ATOM 1330 O TYR A 106 -6.514 0.544 3.146 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.679 -0.043 0.228 1.00 0.00 C ATOM 1332 CG TYR A 106 -5.258 -1.443 0.654 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.719 -2.567 -0.007 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -4.389 -1.625 1.730 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -5.332 -3.835 0.389 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -4.001 -2.884 2.132 1.00 0.00 C ATOM 1337 CZ TYR A 106 -4.473 -3.986 1.462 1.00 0.00 C ATOM 1338 OH TYR A 106 -4.087 -5.242 1.869 1.00 0.00 O ATOM 0 H TYR A 106 -6.463 2.300 0.007 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.840 -0.047 0.235 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.724 -0.011 -0.861 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.906 0.660 0.536 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.391 -2.453 -0.845 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -4.013 -0.761 2.258 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -5.699 -4.703 -0.138 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -3.329 -3.004 2.969 1.00 0.00 H new ATOM 0 HH TYR A 106 -3.481 -5.166 2.636 1.00 0.00 H new ATOM 1348 N GLY A 107 -8.171 -0.836 2.501 1.00 0.00 N ATOM 1349 CA GLY A 107 -8.441 -1.297 3.839 1.00 0.00 C ATOM 1350 C GLY A 107 -9.750 -0.764 4.386 1.00 0.00 C ATOM 1351 O GLY A 107 -10.278 -1.288 5.373 1.00 0.00 O ATOM 0 H GLY A 107 -8.774 -1.238 1.784 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.465 -2.387 3.846 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.626 -0.992 4.496 1.00 0.00 H new ATOM 1355 N VAL A 108 -10.285 0.268 3.763 1.00 0.00 N ATOM 1356 CA VAL A 108 -11.519 0.868 4.233 1.00 0.00 C ATOM 1357 C VAL A 108 -12.724 0.021 3.799 1.00 0.00 C ATOM 1358 O VAL A 108 -12.694 -0.638 2.744 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.682 2.340 3.717 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -12.030 2.410 2.241 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -12.673 3.128 4.543 1.00 0.00 C ATOM 0 H VAL A 108 -9.887 0.707 2.933 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.475 0.899 5.322 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.704 2.805 3.838 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -12.130 3.453 1.940 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -11.239 1.938 1.658 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -12.971 1.889 2.064 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.752 4.141 4.148 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -13.649 2.644 4.500 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -12.334 3.168 5.578 1.00 0.00 H new ATOM 1371 N LYS A 109 -13.743 0.001 4.619 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.966 -0.670 4.273 1.00 0.00 C ATOM 1373 C LYS A 109 -16.038 0.373 4.150 1.00 0.00 C ATOM 1374 O LYS A 109 -16.198 1.190 5.059 1.00 0.00 O ATOM 1375 CB LYS A 109 -15.392 -1.658 5.361 1.00 0.00 C ATOM 1376 CG LYS A 109 -16.510 -2.591 4.923 1.00 0.00 C ATOM 1377 CD LYS A 109 -17.030 -3.526 6.034 1.00 0.00 C ATOM 1378 CE LYS A 109 -16.006 -4.570 6.536 1.00 0.00 C ATOM 1379 NZ LYS A 109 -14.983 -4.020 7.460 1.00 0.00 N ATOM 0 H LYS A 109 -13.748 0.446 5.537 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.815 -1.221 3.345 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.529 -2.252 5.660 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -15.716 -1.102 6.240 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -17.341 -1.993 4.550 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -16.155 -3.198 4.090 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -17.352 -2.918 6.880 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -17.911 -4.051 5.665 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -16.541 -5.374 7.041 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -15.503 -5.012 5.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -14.047 -4.067 7.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -15.211 -3.030 7.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -14.973 -4.577 8.338 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.732 0.377 3.046 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.845 1.253 2.849 1.00 0.00 C ATOM 1395 C ALA A 110 -19.112 0.463 3.063 1.00 0.00 C ATOM 1396 O ALA A 110 -19.647 -0.145 2.122 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.821 1.880 1.460 1.00 0.00 C ATOM 0 H ALA A 110 -16.537 -0.234 2.253 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.793 2.074 3.564 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.681 2.540 1.344 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.903 2.455 1.336 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.862 1.094 0.705 1.00 0.00 H new ATOM 1403 N VAL A 111 -19.541 0.417 4.292 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.705 -0.339 4.690 1.00 0.00 C ATOM 1405 C VAL A 111 -21.974 0.432 4.387 1.00 0.00 C ATOM 1406 O VAL A 111 -22.146 1.558 4.821 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.600 -0.822 6.168 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -20.222 0.276 7.121 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -21.830 -1.598 6.628 1.00 0.00 C ATOM 0 H VAL A 111 -19.088 0.910 5.062 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.751 -1.250 4.094 1.00 0.00 H new ATOM 0 HB VAL A 111 -19.772 -1.530 6.185 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -20.165 -0.124 8.133 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -19.252 0.686 6.838 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -20.974 1.065 7.084 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -21.698 -1.908 7.665 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -22.712 -0.962 6.549 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -21.960 -2.479 6.000 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.838 -0.184 3.636 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.978 0.476 3.061 1.00 0.00 C ATOM 1421 C TYR A 112 -25.239 0.163 3.828 1.00 0.00 C ATOM 1422 O TYR A 112 -25.446 -0.950 4.301 1.00 0.00 O ATOM 1423 CB TYR A 112 -24.081 0.024 1.598 1.00 0.00 C ATOM 1424 CG TYR A 112 -25.104 0.718 0.720 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -26.426 0.298 0.682 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -24.729 1.758 -0.107 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -27.344 0.899 -0.143 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -25.640 2.358 -0.941 1.00 0.00 C ATOM 1429 CZ TYR A 112 -26.948 1.927 -0.952 1.00 0.00 C ATOM 1430 OH TYR A 112 -27.859 2.522 -1.796 1.00 0.00 O ATOM 0 H TYR A 112 -22.772 -1.174 3.401 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.854 1.558 3.111 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -23.101 0.151 1.137 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -24.301 -1.044 1.591 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -26.739 -0.519 1.315 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -23.706 2.104 -0.098 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -28.370 0.562 -0.153 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -25.331 3.166 -1.587 1.00 0.00 H new ATOM 0 HH TYR A 112 -28.660 1.961 -1.860 1.00 0.00 H new ATOM 1440 N THR A 113 -26.053 1.159 3.959 1.00 0.00 N ATOM 1441 CA THR A 113 -27.318 1.054 4.590 1.00 0.00 C ATOM 1442 C THR A 113 -28.272 1.848 3.703 1.00 0.00 C ATOM 1443 O THR A 113 -27.805 2.660 2.886 1.00 0.00 O ATOM 1444 CB THR A 113 -27.265 1.706 5.978 1.00 0.00 C ATOM 1445 OG1 THR A 113 -25.939 1.537 6.538 1.00 0.00 O ATOM 1446 CG2 THR A 113 -28.245 1.019 6.896 1.00 0.00 C ATOM 0 H THR A 113 -25.844 2.097 3.617 1.00 0.00 H new ATOM 0 HA THR A 113 -27.625 0.016 4.714 1.00 0.00 H new ATOM 0 HB THR A 113 -27.510 2.764 5.882 1.00 0.00 H new ATOM 0 HG1 THR A 113 -25.902 1.954 7.424 1.00 0.00 H new ATOM 0 HG21 THR A 113 -28.207 1.483 7.882 1.00 0.00 H new ATOM 0 HG22 THR A 113 -29.252 1.113 6.489 1.00 0.00 H new ATOM 0 HG23 THR A 113 -27.986 -0.036 6.981 1.00 0.00 H new ATOM 1454 N CYS A 114 -29.554 1.655 3.813 1.00 0.00 N ATOM 1455 CA CYS A 114 -30.423 2.401 2.947 1.00 0.00 C ATOM 1456 C CYS A 114 -31.659 2.857 3.693 1.00 0.00 C ATOM 1457 O CYS A 114 -31.755 4.016 4.101 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.776 1.578 1.701 1.00 0.00 C ATOM 1459 SG CYS A 114 -31.479 2.540 0.334 1.00 0.00 S ATOM 0 H CYS A 114 -30.009 1.015 4.465 1.00 0.00 H new ATOM 0 HA CYS A 114 -29.900 3.296 2.610 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -29.876 1.074 1.348 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.486 0.801 1.984 1.00 0.00 H new ATOM 1464 N ASN A 115 -32.551 1.938 3.951 1.00 0.00 N ATOM 1465 CA ASN A 115 -33.810 2.227 4.616 1.00 0.00 C ATOM 1466 C ASN A 115 -34.109 1.096 5.552 1.00 0.00 C ATOM 1467 O ASN A 115 -33.289 0.182 5.695 1.00 0.00 O ATOM 1468 CB ASN A 115 -34.988 2.375 3.607 1.00 0.00 C ATOM 1469 CG ASN A 115 -34.954 3.616 2.702 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -35.412 3.559 1.563 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -34.475 4.735 3.199 1.00 0.00 N ATOM 0 H ASN A 115 -32.430 0.955 3.706 1.00 0.00 H new ATOM 0 HA ASN A 115 -33.712 3.174 5.146 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -35.009 1.489 2.973 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -35.922 2.387 4.170 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -34.477 5.585 2.636 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -34.101 4.753 4.148 1.00 0.00 H new ATOM 1478 N GLU A 116 -35.231 1.155 6.212 1.00 0.00 N ATOM 1479 CA GLU A 116 -35.667 0.074 7.049 1.00 0.00 C ATOM 1480 C GLU A 116 -36.744 -0.684 6.285 1.00 0.00 C ATOM 1481 O GLU A 116 -37.388 -0.112 5.403 1.00 0.00 O ATOM 1482 CB GLU A 116 -36.206 0.603 8.379 1.00 0.00 C ATOM 1483 CG GLU A 116 -36.477 -0.492 9.392 1.00 0.00 C ATOM 1484 CD GLU A 116 -35.229 -1.269 9.748 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -34.929 -2.287 9.073 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -34.522 -0.877 10.711 1.00 0.00 O ATOM 0 H GLU A 116 -35.867 1.952 6.185 1.00 0.00 H new ATOM 0 HA GLU A 116 -34.834 -0.588 7.286 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -35.489 1.308 8.799 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -37.127 1.156 8.196 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -36.898 -0.051 10.296 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -37.226 -1.176 8.992 1.00 0.00 H new ATOM 1493 N GLY A 117 -36.898 -1.956 6.558 1.00 0.00 N ATOM 1494 CA GLY A 117 -37.882 -2.758 5.857 1.00 0.00 C ATOM 1495 C GLY A 117 -37.229 -3.516 4.730 1.00 0.00 C ATOM 1496 O GLY A 117 -37.464 -4.712 4.531 1.00 0.00 O ATOM 0 H GLY A 117 -36.357 -2.462 7.259 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -38.353 -3.456 6.549 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -38.671 -2.117 5.464 1.00 0.00 H new ATOM 1500 N TYR A 118 -36.391 -2.822 4.019 1.00 0.00 N ATOM 1501 CA TYR A 118 -35.620 -3.362 2.955 1.00 0.00 C ATOM 1502 C TYR A 118 -34.288 -2.675 3.019 1.00 0.00 C ATOM 1503 O TYR A 118 -34.217 -1.448 3.189 1.00 0.00 O ATOM 1504 CB TYR A 118 -36.309 -3.167 1.582 1.00 0.00 C ATOM 1505 CG TYR A 118 -36.418 -1.734 1.071 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -37.233 -0.797 1.695 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -35.704 -1.333 -0.051 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -37.329 0.492 1.211 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -35.800 -0.052 -0.538 1.00 0.00 C ATOM 1510 CZ TYR A 118 -36.611 0.857 0.092 1.00 0.00 C ATOM 1511 OH TYR A 118 -36.708 2.142 -0.398 1.00 0.00 O ATOM 0 H TYR A 118 -36.224 -1.828 4.175 1.00 0.00 H new ATOM 0 HA TYR A 118 -35.508 -4.441 3.061 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -35.765 -3.753 0.841 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -37.314 -3.585 1.643 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -37.799 -1.081 2.570 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -35.061 -2.042 -0.550 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -37.964 1.212 1.707 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -35.239 0.238 -1.414 1.00 0.00 H new ATOM 0 HH TYR A 118 -36.180 2.747 0.164 1.00 0.00 H new ATOM 1521 N GLN A 119 -33.251 -3.425 2.954 1.00 0.00 N ATOM 1522 CA GLN A 119 -31.957 -2.855 3.115 1.00 0.00 C ATOM 1523 C GLN A 119 -31.260 -2.737 1.798 1.00 0.00 C ATOM 1524 O GLN A 119 -30.973 -1.628 1.339 1.00 0.00 O ATOM 1525 CB GLN A 119 -31.133 -3.620 4.180 1.00 0.00 C ATOM 1526 CG GLN A 119 -30.987 -5.129 3.971 1.00 0.00 C ATOM 1527 CD GLN A 119 -30.222 -5.804 5.100 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -30.276 -5.378 6.257 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -29.480 -6.829 4.779 1.00 0.00 N ATOM 0 H GLN A 119 -33.267 -4.432 2.791 1.00 0.00 H new ATOM 0 HA GLN A 119 -32.068 -1.840 3.497 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -30.136 -3.182 4.220 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -31.594 -3.453 5.154 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -31.977 -5.578 3.888 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -30.473 -5.314 3.028 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -29.456 -7.159 3.814 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -28.925 -7.300 5.493 1.00 0.00 H new ATOM 1538 N LEU A 120 -31.050 -3.866 1.181 1.00 0.00 N ATOM 1539 CA LEU A 120 -30.352 -3.979 -0.073 1.00 0.00 C ATOM 1540 C LEU A 120 -30.290 -5.427 -0.475 1.00 0.00 C ATOM 1541 O LEU A 120 -30.436 -6.316 0.378 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.926 -3.393 0.062 1.00 0.00 C ATOM 1543 CG LEU A 120 -28.045 -3.981 1.181 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -27.314 -5.248 0.748 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -27.101 -2.939 1.708 1.00 0.00 C ATOM 0 H LEU A 120 -31.369 -4.763 1.547 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.883 -3.417 -0.841 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -28.409 -3.531 -0.888 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -29.012 -2.319 0.225 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.706 -4.283 1.993 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.708 -5.619 1.575 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -28.041 -6.008 0.461 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.669 -5.024 -0.102 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -26.486 -3.371 2.498 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -26.459 -2.587 0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -27.671 -2.101 2.109 1.00 0.00 H new ATOM 1557 N LEU A 121 -30.118 -5.670 -1.730 1.00 0.00 N ATOM 1558 CA LEU A 121 -29.907 -6.996 -2.213 1.00 0.00 C ATOM 1559 C LEU A 121 -28.445 -7.226 -2.399 1.00 0.00 C ATOM 1560 O LEU A 121 -27.737 -6.393 -2.990 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.657 -7.269 -3.501 1.00 0.00 C ATOM 1562 CG LEU A 121 -32.166 -7.349 -3.384 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -32.785 -7.556 -4.750 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -32.577 -8.474 -2.445 1.00 0.00 C ATOM 0 H LEU A 121 -30.119 -4.952 -2.455 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.301 -7.690 -1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -30.408 -6.485 -4.217 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.294 -8.208 -3.918 1.00 0.00 H new ATOM 0 HG LEU A 121 -32.528 -6.408 -2.970 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -33.869 -7.612 -4.653 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -32.521 -6.721 -5.399 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -32.411 -8.484 -5.182 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -33.664 -8.512 -2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.204 -9.423 -2.829 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.157 -8.293 -1.455 1.00 0.00 H new ATOM 1576 N GLY A 122 -28.001 -8.319 -1.900 1.00 0.00 N ATOM 1577 CA GLY A 122 -26.627 -8.668 -1.957 1.00 0.00 C ATOM 1578 C GLY A 122 -26.183 -9.173 -0.626 1.00 0.00 C ATOM 1579 O GLY A 122 -26.709 -8.743 0.406 1.00 0.00 O ATOM 0 H GLY A 122 -28.589 -9.009 -1.433 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -26.467 -9.431 -2.719 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -26.033 -7.801 -2.245 1.00 0.00 H new ATOM 1583 N GLU A 123 -25.251 -10.081 -0.618 1.00 0.00 N ATOM 1584 CA GLU A 123 -24.748 -10.615 0.619 1.00 0.00 C ATOM 1585 C GLU A 123 -23.680 -9.718 1.154 1.00 0.00 C ATOM 1586 O GLU A 123 -23.338 -9.735 2.338 1.00 0.00 O ATOM 1587 CB GLU A 123 -24.218 -12.018 0.430 1.00 0.00 C ATOM 1588 CG GLU A 123 -25.309 -12.995 0.088 1.00 0.00 C ATOM 1589 CD GLU A 123 -26.441 -12.978 1.090 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -26.204 -13.282 2.280 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -27.593 -12.635 0.693 1.00 0.00 O ATOM 0 H GLU A 123 -24.821 -10.470 -1.457 1.00 0.00 H new ATOM 0 HA GLU A 123 -25.567 -10.665 1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -23.470 -12.019 -0.363 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -23.716 -12.341 1.342 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -25.702 -12.763 -0.902 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -24.889 -14.000 0.037 1.00 0.00 H new ATOM 1598 N ILE A 124 -23.150 -8.934 0.278 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.148 -8.019 0.627 1.00 0.00 C ATOM 1600 C ILE A 124 -22.779 -6.638 0.709 1.00 0.00 C ATOM 1601 O ILE A 124 -22.919 -5.926 -0.288 1.00 0.00 O ATOM 1602 CB ILE A 124 -20.971 -8.065 -0.380 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.475 -9.526 -0.547 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -19.830 -7.172 0.080 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -19.936 -10.173 0.721 1.00 0.00 C ATOM 0 H ILE A 124 -23.411 -8.920 -0.708 1.00 0.00 H new ATOM 0 HA ILE A 124 -21.723 -8.278 1.597 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.325 -7.696 -1.342 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.299 -10.132 -0.924 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -19.693 -9.543 -1.306 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -19.016 -7.221 -0.643 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -20.182 -6.144 0.161 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.473 -7.510 1.053 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -19.615 -11.191 0.502 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -19.088 -9.597 1.091 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -20.719 -10.195 1.479 1.00 0.00 H new ATOM 1617 N ASN A 125 -23.200 -6.298 1.903 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.873 -5.029 2.226 1.00 0.00 C ATOM 1619 C ASN A 125 -22.844 -3.927 2.453 1.00 0.00 C ATOM 1620 O ASN A 125 -23.087 -2.948 3.155 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.759 -5.204 3.497 1.00 0.00 C ATOM 1622 CG ASN A 125 -24.003 -5.640 4.753 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -22.997 -6.348 4.686 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -24.500 -5.252 5.902 1.00 0.00 N ATOM 0 H ASN A 125 -23.088 -6.906 2.714 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.508 -4.746 1.387 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -25.263 -4.260 3.703 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -25.534 -5.940 3.283 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -24.052 -5.536 6.773 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -25.334 -4.666 5.925 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.735 -4.052 1.790 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.629 -3.174 1.954 1.00 0.00 C ATOM 1633 C TYR A 126 -19.726 -3.314 0.761 1.00 0.00 C ATOM 1634 O TYR A 126 -20.014 -4.077 -0.146 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.871 -3.512 3.262 1.00 0.00 C ATOM 1636 CG TYR A 126 -19.284 -4.917 3.315 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -20.032 -5.999 3.750 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -17.985 -5.145 2.933 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -19.494 -7.269 3.793 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -17.435 -6.403 2.974 1.00 0.00 C ATOM 1641 CZ TYR A 126 -18.192 -7.464 3.407 1.00 0.00 C ATOM 1642 OH TYR A 126 -17.652 -8.731 3.435 1.00 0.00 O ATOM 0 H TYR A 126 -21.575 -4.789 1.103 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.976 -2.143 2.026 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -19.064 -2.791 3.395 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -20.553 -3.386 4.103 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -21.055 -5.846 4.061 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -17.382 -4.316 2.593 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -20.093 -8.103 4.128 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -16.411 -6.557 2.667 1.00 0.00 H new ATOM 0 HH TYR A 126 -16.721 -8.697 3.130 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.684 -2.562 0.758 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.672 -2.590 -0.263 1.00 0.00 C ATOM 1654 C ARG A 127 -16.353 -2.395 0.434 1.00 0.00 C ATOM 1655 O ARG A 127 -16.181 -1.417 1.149 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.910 -1.445 -1.252 1.00 0.00 C ATOM 1657 CG ARG A 127 -19.131 -1.620 -2.136 1.00 0.00 C ATOM 1658 CD ARG A 127 -19.581 -0.299 -2.730 1.00 0.00 C ATOM 1659 NE ARG A 127 -20.099 0.596 -1.671 1.00 0.00 N ATOM 1660 CZ ARG A 127 -20.708 1.778 -1.860 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -20.812 2.307 -3.075 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -21.189 2.443 -0.812 1.00 0.00 N ATOM 0 H ARG A 127 -18.496 -1.879 1.492 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.690 -3.529 -0.816 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -18.012 -0.515 -0.693 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -17.030 -1.341 -1.886 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -18.903 -2.322 -2.938 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -19.944 -2.054 -1.554 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -18.746 0.179 -3.242 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -20.355 -0.474 -3.477 1.00 0.00 H new ATOM 0 HE ARG A 127 -19.982 0.286 -0.706 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -20.426 1.814 -3.880 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -21.278 3.206 -3.202 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -21.094 2.054 0.126 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -21.653 3.341 -0.947 1.00 0.00 H new ATOM 1676 N GLU A 128 -15.467 -3.319 0.293 1.00 0.00 N ATOM 1677 CA GLU A 128 -14.168 -3.224 0.922 1.00 0.00 C ATOM 1678 C GLU A 128 -13.145 -2.831 -0.101 1.00 0.00 C ATOM 1679 O GLU A 128 -13.231 -3.241 -1.242 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.795 -4.548 1.584 1.00 0.00 C ATOM 1681 CG GLU A 128 -14.467 -4.790 2.905 1.00 0.00 C ATOM 1682 CD GLU A 128 -14.049 -6.089 3.546 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -14.120 -7.155 2.883 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -13.670 -6.078 4.729 1.00 0.00 O ATOM 0 H GLU A 128 -15.609 -4.166 -0.258 1.00 0.00 H new ATOM 0 HA GLU A 128 -14.201 -2.461 1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -14.048 -5.363 0.906 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -12.715 -4.577 1.728 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -14.236 -3.966 3.581 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -15.548 -4.792 2.762 1.00 0.00 H new ATOM 1691 N CYS A 129 -12.220 -2.006 0.264 1.00 0.00 N ATOM 1692 CA CYS A 129 -11.220 -1.626 -0.681 1.00 0.00 C ATOM 1693 C CYS A 129 -10.020 -2.542 -0.605 1.00 0.00 C ATOM 1694 O CYS A 129 -9.282 -2.563 0.396 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.809 -0.181 -0.546 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.612 0.317 -1.815 1.00 0.00 S ATOM 0 H CYS A 129 -12.134 -1.588 1.191 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.670 -1.732 -1.668 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.693 0.453 -0.615 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.376 -0.020 0.441 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.851 -3.294 -1.650 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.787 -4.251 -1.810 1.00 0.00 C ATOM 1703 C ASP A 130 -7.686 -3.610 -2.692 1.00 0.00 C ATOM 1704 O ASP A 130 -7.681 -2.400 -2.901 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.384 -5.516 -2.486 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.432 -6.704 -2.551 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -8.326 -7.455 -1.577 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -7.735 -6.873 -3.578 1.00 0.00 O ATOM 0 H ASP A 130 -10.478 -3.259 -2.454 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.346 -4.533 -0.854 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.281 -5.814 -1.943 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.695 -5.259 -3.499 1.00 0.00 H new ATOM 1713 N THR A 131 -6.790 -4.414 -3.205 1.00 0.00 N ATOM 1714 CA THR A 131 -5.688 -3.987 -4.025 1.00 0.00 C ATOM 1715 C THR A 131 -6.203 -3.416 -5.357 1.00 0.00 C ATOM 1716 O THR A 131 -5.718 -2.391 -5.844 1.00 0.00 O ATOM 1717 CB THR A 131 -4.760 -5.199 -4.285 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.522 -6.281 -4.865 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.159 -5.685 -2.985 1.00 0.00 C ATOM 0 H THR A 131 -6.810 -5.423 -3.056 1.00 0.00 H new ATOM 0 HA THR A 131 -5.132 -3.203 -3.511 1.00 0.00 H new ATOM 0 HB THR A 131 -3.968 -4.887 -4.965 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.083 -6.693 -4.175 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.509 -6.537 -3.181 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.578 -4.882 -2.530 1.00 0.00 H new ATOM 0 HG23 THR A 131 -4.956 -5.986 -2.306 1.00 0.00 H new ATOM 1727 N ASP A 132 -7.183 -4.097 -5.929 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.842 -3.654 -7.156 1.00 0.00 C ATOM 1729 C ASP A 132 -8.652 -2.414 -6.891 1.00 0.00 C ATOM 1730 O ASP A 132 -8.648 -1.458 -7.673 1.00 0.00 O ATOM 1731 CB ASP A 132 -8.763 -4.754 -7.698 1.00 0.00 C ATOM 1732 CG ASP A 132 -9.760 -4.243 -8.735 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -9.388 -4.052 -9.907 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -10.945 -4.040 -8.389 1.00 0.00 O ATOM 0 H ASP A 132 -7.547 -4.974 -5.558 1.00 0.00 H new ATOM 0 HA ASP A 132 -7.073 -3.435 -7.896 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -8.155 -5.541 -8.144 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -9.309 -5.204 -6.869 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.311 -2.422 -5.785 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.185 -1.365 -5.430 1.00 0.00 C ATOM 1741 C GLY A 133 -11.326 -1.920 -4.658 1.00 0.00 C ATOM 1742 O GLY A 133 -11.145 -2.864 -3.913 1.00 0.00 O ATOM 0 H GLY A 133 -9.256 -3.172 -5.096 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -9.654 -0.621 -4.835 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -10.547 -0.859 -6.325 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.490 -1.411 -4.885 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.662 -1.819 -4.143 1.00 0.00 C ATOM 1748 C TRP A 134 -14.119 -3.210 -4.543 1.00 0.00 C ATOM 1749 O TRP A 134 -14.196 -3.533 -5.742 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.806 -0.825 -4.338 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.479 0.568 -3.907 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.126 1.616 -4.707 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.467 1.065 -2.571 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -13.915 2.734 -3.947 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.115 2.422 -2.636 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.729 0.496 -1.326 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.017 3.216 -1.513 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.629 1.289 -0.206 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.279 2.635 -0.308 1.00 0.00 C ATOM 0 H TRP A 134 -12.669 -0.697 -5.591 1.00 0.00 H new ATOM 0 HA TRP A 134 -13.383 -1.838 -3.089 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -15.087 -0.812 -5.391 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.675 -1.173 -3.780 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -14.028 1.570 -5.782 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -13.651 3.652 -4.304 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -15.005 -0.545 -1.242 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -13.743 4.258 -1.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.825 0.863 0.767 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -14.214 3.232 0.590 1.00 0.00 H new ATOM 1770 N THR A 135 -14.347 -4.027 -3.558 1.00 0.00 N ATOM 1771 CA THR A 135 -14.893 -5.324 -3.749 1.00 0.00 C ATOM 1772 C THR A 135 -16.401 -5.179 -3.825 1.00 0.00 C ATOM 1773 O THR A 135 -17.002 -4.501 -2.967 1.00 0.00 O ATOM 1774 CB THR A 135 -14.502 -6.273 -2.575 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.944 -5.728 -1.310 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.993 -6.471 -2.527 1.00 0.00 C ATOM 0 H THR A 135 -14.152 -3.800 -2.583 1.00 0.00 H new ATOM 0 HA THR A 135 -14.500 -5.763 -4.666 1.00 0.00 H new ATOM 0 HB THR A 135 -14.990 -7.233 -2.747 1.00 0.00 H new ATOM 0 HG1 THR A 135 -15.142 -6.460 -0.689 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.739 -7.136 -1.701 1.00 0.00 H new ATOM 0 HG22 THR A 135 -12.654 -6.911 -3.465 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.504 -5.508 -2.380 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.998 -5.754 -4.865 1.00 0.00 N ATOM 1785 CA ASN A 136 -18.439 -5.710 -5.095 1.00 0.00 C ATOM 1786 C ASN A 136 -18.882 -4.354 -5.590 1.00 0.00 C ATOM 1787 O ASN A 136 -18.124 -3.369 -5.565 1.00 0.00 O ATOM 1788 CB ASN A 136 -19.261 -6.161 -3.864 1.00 0.00 C ATOM 1789 CG ASN A 136 -19.141 -7.644 -3.586 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -18.163 -8.013 -2.799 1.00 0.00 O flip ATOM 1791 ND2 ASN A 136 -19.929 -8.453 -4.080 1.00 0.00 N flip ATOM 0 H ASN A 136 -16.488 -6.271 -5.581 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.644 -6.436 -5.882 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.929 -5.604 -2.988 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -20.310 -5.910 -4.022 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -20.679 -8.127 -4.689 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -19.831 -9.448 -3.880 1.00 0.00 H new ATOM 1798 N ASP A 137 -20.078 -4.300 -6.065 1.00 0.00 N ATOM 1799 CA ASP A 137 -20.620 -3.082 -6.591 1.00 0.00 C ATOM 1800 C ASP A 137 -21.486 -2.459 -5.491 1.00 0.00 C ATOM 1801 O ASP A 137 -21.502 -2.951 -4.350 1.00 0.00 O ATOM 1802 CB ASP A 137 -21.449 -3.410 -7.855 1.00 0.00 C ATOM 1803 CG ASP A 137 -21.711 -2.227 -8.790 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -22.398 -1.267 -8.401 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -21.248 -2.255 -9.945 1.00 0.00 O ATOM 0 H ASP A 137 -20.714 -5.097 -6.103 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.841 -2.376 -6.879 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -20.932 -4.188 -8.417 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -22.408 -3.825 -7.543 1.00 0.00 H new ATOM 1810 N ILE A 138 -22.176 -1.413 -5.816 1.00 0.00 N ATOM 1811 CA ILE A 138 -23.045 -0.703 -4.909 1.00 0.00 C ATOM 1812 C ILE A 138 -24.259 -1.585 -4.667 1.00 0.00 C ATOM 1813 O ILE A 138 -24.977 -1.902 -5.622 1.00 0.00 O ATOM 1814 CB ILE A 138 -23.537 0.603 -5.580 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -22.362 1.400 -6.140 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -24.335 1.469 -4.587 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -22.772 2.340 -7.240 1.00 0.00 C ATOM 0 H ILE A 138 -22.155 -1.009 -6.752 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.518 -0.468 -3.984 1.00 0.00 H new ATOM 0 HB ILE A 138 -24.196 0.324 -6.402 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -21.898 1.969 -5.335 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -21.608 0.710 -6.519 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -24.668 2.380 -5.085 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -25.202 0.911 -4.233 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -23.700 1.730 -3.740 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -21.897 2.881 -7.601 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -23.211 1.771 -8.060 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -23.505 3.050 -6.857 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.482 -2.037 -3.427 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.627 -2.866 -3.119 1.00 0.00 C ATOM 1831 C PRO A 139 -26.930 -2.109 -3.364 1.00 0.00 C ATOM 1832 O PRO A 139 -27.117 -0.978 -2.903 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.453 -3.242 -1.653 1.00 0.00 C ATOM 1834 CG PRO A 139 -24.470 -2.275 -1.105 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.640 -1.786 -2.251 1.00 0.00 C ATOM 0 HA PRO A 139 -25.683 -3.751 -3.753 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.401 -3.182 -1.118 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -25.094 -4.266 -1.551 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.979 -1.444 -0.617 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.842 -2.751 -0.351 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -23.401 -0.727 -2.149 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.693 -2.321 -2.316 1.00 0.00 H new ATOM 1843 N ILE A 140 -27.793 -2.740 -4.100 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.029 -2.153 -4.576 1.00 0.00 C ATOM 1845 C ILE A 140 -30.079 -2.156 -3.481 1.00 0.00 C ATOM 1846 O ILE A 140 -30.391 -3.214 -2.946 1.00 0.00 O ATOM 1847 CB ILE A 140 -29.592 -2.940 -5.826 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -28.658 -2.864 -7.058 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -30.992 -2.484 -6.208 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -27.385 -3.685 -6.967 1.00 0.00 C ATOM 0 H ILE A 140 -27.662 -3.706 -4.400 1.00 0.00 H new ATOM 0 HA ILE A 140 -28.808 -1.127 -4.870 1.00 0.00 H new ATOM 0 HB ILE A 140 -29.640 -3.982 -5.511 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -29.217 -3.189 -7.936 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -28.386 -1.821 -7.221 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -31.337 -3.053 -7.072 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -31.670 -2.649 -5.370 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -30.974 -1.423 -6.456 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -26.805 -3.560 -7.881 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -26.795 -3.349 -6.114 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -27.639 -4.737 -6.840 1.00 0.00 H new ATOM 1862 N CYS A 141 -30.611 -0.985 -3.148 1.00 0.00 N ATOM 1863 CA CYS A 141 -31.691 -0.877 -2.164 1.00 0.00 C ATOM 1864 C CYS A 141 -32.926 -1.552 -2.740 1.00 0.00 C ATOM 1865 O CYS A 141 -33.530 -1.032 -3.686 1.00 0.00 O ATOM 1866 CB CYS A 141 -32.054 0.589 -1.903 1.00 0.00 C ATOM 1867 SG CYS A 141 -30.706 1.654 -1.321 1.00 0.00 S ATOM 0 H CYS A 141 -30.314 -0.093 -3.544 1.00 0.00 H new ATOM 0 HA CYS A 141 -31.362 -1.341 -1.234 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -32.453 1.013 -2.825 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -32.856 0.618 -1.166 1.00 0.00 H new ATOM 1872 N GLU A 142 -33.298 -2.680 -2.208 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.384 -3.434 -2.735 1.00 0.00 C ATOM 1874 C GLU A 142 -34.729 -4.452 -1.678 1.00 0.00 C ATOM 1875 O GLU A 142 -35.925 -4.724 -1.440 1.00 0.00 O ATOM 1876 CB GLU A 142 -33.938 -4.111 -4.046 1.00 0.00 C ATOM 1877 CG GLU A 142 -35.035 -4.754 -4.863 1.00 0.00 C ATOM 1878 CD GLU A 142 -35.996 -3.749 -5.453 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -35.733 -3.261 -6.583 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -37.035 -3.460 -4.838 1.00 0.00 O ATOM 1881 OXT GLU A 142 -33.788 -4.897 -0.986 1.00 0.00 O ATOM 0 H GLU A 142 -32.851 -3.099 -1.393 1.00 0.00 H new ATOM 0 HA GLU A 142 -35.252 -2.818 -2.968 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -33.439 -3.366 -4.666 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -33.197 -4.873 -3.805 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -34.587 -5.337 -5.668 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -35.588 -5.452 -4.234 1.00 0.00 H new TER 1888 GLU A 142