USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1096 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 22 THR OG1 : rot 90:sc= 0.238 USER MOD Set 1.2: A 76 THR OG1 : rot -176:sc= -0.48 USER MOD Set 1.3: A 112 ASN : amide:sc= -2.81 K(o=-3.1,f=-4.9!) USER MOD Set 2.1: A 44 THR OG1 : rot 11:sc= 0.0656 USER MOD Set 2.2: A 61 GLN : amide:sc= -0.654 K(o=-0.59,f=-2.2!) USER MOD Set 3.1: A 47 HIS : no HE2:sc= -2.23 X(o=-2.2,f=-2) USER MOD Set 3.2: A 49 LYS NZ :NH3+ -171:sc= 0.0644 (180deg=0) USER MOD Set 3.3: A 58 THR OG1 : rot 170:sc= -0.0744 USER MOD Set 4.1: A 8 CYS SG : rot -177:sc= 0.943 USER MOD Set 4.2: A 124 GLN : amide:sc= -3.31 K(o=-2.4,f=-3.8) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -2.29 X(o=-2.3,f=-2.4) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= -0.0338 K(o=-0.034,f=-2.5!) USER MOD Single : A 14 ASN : amide:sc= -0.0336 K(o=-0.034,f=-2.6!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 163:sc= -5.2! (180deg=-5.76!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 SER OG : rot 180:sc= -1.25 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 85:sc= 0.569 USER MOD Single : A 40 THR OG1 : rot 62:sc= 0.736 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0725 USER MOD Single : A 51 SER OG : rot 140:sc= -0.608 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.136 X(o=-0.14,f=-0.14) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.0289 X(o=-0.029,f=0) USER MOD Single : A 70 TYR OH : rot 180:sc= -0.0778 USER MOD Single : A 73 ASN : amide:sc= -3.64! C(o=-3.6!,f=-20!) USER MOD Single : A 74 THR OG1 : rot -19:sc= 1.21 USER MOD Single : A 78 CYS SG : rot 180:sc= -1.39 USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.044 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.0694 K(o=-0.069,f=-0.94) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot 120:sc= -0.302 USER MOD Single : A 115 HIS : no HD1:sc= -1.55 K(o=-1.5,f=-4!) USER MOD Single : A 131 ASN : amide:sc= 0.0336 K(o=0.034,f=-0.49) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= -0.0629 X(o=-0.063,f=-0.067) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.861 -7.818 -20.107 1.00 0.00 N ATOM 2 CA GLY A 1 7.109 -7.963 -19.317 1.00 0.00 C ATOM 3 C GLY A 1 6.893 -7.920 -17.792 1.00 0.00 C ATOM 4 O GLY A 1 7.320 -8.815 -17.067 1.00 0.00 O ATOM 0 H1 GLY A 1 6.086 -7.857 -21.122 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.207 -8.590 -19.868 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.414 -6.905 -19.886 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.586 -8.907 -19.580 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.800 -7.168 -19.599 1.00 0.00 H new ATOM 9 N SER A 2 6.221 -6.855 -17.353 1.00 0.00 N ATOM 10 CA SER A 2 5.775 -6.718 -15.953 1.00 0.00 C ATOM 11 C SER A 2 4.371 -7.322 -15.789 1.00 0.00 C ATOM 12 O SER A 2 4.219 -8.538 -15.829 1.00 0.00 O ATOM 13 CB SER A 2 5.842 -5.261 -15.461 1.00 0.00 C ATOM 14 OG SER A 2 7.171 -4.887 -15.104 1.00 0.00 O ATOM 0 H SER A 2 5.969 -6.065 -17.947 1.00 0.00 H new ATOM 0 HA SER A 2 6.464 -7.277 -15.319 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.474 -4.596 -16.242 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.185 -5.137 -14.600 1.00 0.00 H new ATOM 0 HG SER A 2 7.178 -3.956 -14.798 1.00 0.00 H new ATOM 20 N HIS A 3 3.344 -6.474 -15.756 1.00 0.00 N ATOM 21 CA HIS A 3 1.944 -6.852 -15.480 1.00 0.00 C ATOM 22 C HIS A 3 1.051 -5.734 -16.053 1.00 0.00 C ATOM 23 O HIS A 3 1.554 -4.669 -16.414 1.00 0.00 O ATOM 24 CB HIS A 3 1.706 -6.963 -13.969 1.00 0.00 C ATOM 25 CG HIS A 3 2.736 -7.862 -13.237 1.00 0.00 C ATOM 26 ND1 HIS A 3 3.882 -7.415 -12.772 1.00 0.00 N ATOM 27 CD2 HIS A 3 2.673 -9.170 -13.062 1.00 0.00 C ATOM 28 CE1 HIS A 3 4.565 -8.467 -12.288 1.00 0.00 C ATOM 29 NE2 HIS A 3 3.812 -9.539 -12.463 1.00 0.00 N ATOM 0 H HIS A 3 3.458 -5.474 -15.924 1.00 0.00 H new ATOM 0 HA HIS A 3 1.717 -7.817 -15.933 1.00 0.00 H new ATOM 0 HB2 HIS A 3 1.734 -5.965 -13.532 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.705 -7.359 -13.796 1.00 0.00 H new ATOM 0 HD2 HIS A 3 1.858 -9.818 -13.348 1.00 0.00 H new ATOM 0 HE1 HIS A 3 5.547 -8.441 -11.839 1.00 0.00 H new ATOM 0 HE2 HIS A 3 4.058 -10.490 -12.187 1.00 0.00 H new ATOM 37 N MET A 4 -0.242 -6.023 -16.145 1.00 0.00 N ATOM 38 CA MET A 4 -1.263 -5.155 -16.776 1.00 0.00 C ATOM 39 C MET A 4 -2.673 -5.714 -16.536 1.00 0.00 C ATOM 40 O MET A 4 -2.820 -6.887 -16.191 1.00 0.00 O ATOM 41 CB MET A 4 -1.011 -4.991 -18.286 1.00 0.00 C ATOM 42 CG MET A 4 -0.802 -6.322 -19.019 1.00 0.00 C ATOM 43 SD MET A 4 -0.485 -6.124 -20.808 1.00 0.00 S ATOM 44 CE MET A 4 -2.054 -6.686 -21.432 1.00 0.00 C ATOM 0 H MET A 4 -0.633 -6.890 -15.776 1.00 0.00 H new ATOM 0 HA MET A 4 -1.187 -4.172 -16.312 1.00 0.00 H new ATOM 0 HB2 MET A 4 -1.857 -4.468 -18.733 1.00 0.00 H new ATOM 0 HB3 MET A 4 -0.133 -4.362 -18.434 1.00 0.00 H new ATOM 0 HG2 MET A 4 0.037 -6.850 -18.565 1.00 0.00 H new ATOM 0 HG3 MET A 4 -1.684 -6.947 -18.881 1.00 0.00 H new ATOM 0 HE1 MET A 4 -2.051 -6.637 -22.521 1.00 0.00 H new ATOM 0 HE2 MET A 4 -2.224 -7.715 -21.116 1.00 0.00 H new ATOM 0 HE3 MET A 4 -2.849 -6.051 -21.042 1.00 0.00 H new ATOM 54 N GLY A 5 -3.655 -4.808 -16.591 1.00 0.00 N ATOM 55 CA GLY A 5 -5.078 -5.171 -16.426 1.00 0.00 C ATOM 56 C GLY A 5 -5.868 -4.060 -15.728 1.00 0.00 C ATOM 57 O GLY A 5 -6.709 -3.408 -16.341 1.00 0.00 O ATOM 0 H GLY A 5 -3.496 -3.813 -16.749 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -5.518 -5.372 -17.403 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -5.154 -6.091 -15.847 1.00 0.00 H new ATOM 61 N ALA A 6 -5.517 -3.828 -14.466 1.00 0.00 N ATOM 62 CA ALA A 6 -6.103 -2.737 -13.661 1.00 0.00 C ATOM 63 C ALA A 6 -5.156 -1.530 -13.610 1.00 0.00 C ATOM 64 O ALA A 6 -3.974 -1.650 -13.907 1.00 0.00 O ATOM 65 CB ALA A 6 -6.423 -3.219 -12.244 1.00 0.00 C ATOM 0 H ALA A 6 -4.822 -4.383 -13.966 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.033 -2.428 -14.139 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -6.854 -2.399 -11.669 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.136 -4.042 -12.292 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -5.508 -3.560 -11.760 1.00 0.00 H new ATOM 71 N ALA A 7 -5.697 -0.376 -13.231 1.00 0.00 N ATOM 72 CA ALA A 7 -4.968 0.908 -13.226 1.00 0.00 C ATOM 73 C ALA A 7 -5.757 1.958 -12.442 1.00 0.00 C ATOM 74 O ALA A 7 -6.852 2.350 -12.836 1.00 0.00 O ATOM 75 CB ALA A 7 -4.741 1.416 -14.657 1.00 0.00 C ATOM 0 H ALA A 7 -6.663 -0.295 -12.914 1.00 0.00 H new ATOM 0 HA ALA A 7 -4.001 0.742 -12.751 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -4.202 2.363 -14.626 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -4.156 0.684 -15.214 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -5.703 1.562 -15.148 1.00 0.00 H new ATOM 81 N CYS A 8 -5.332 2.134 -11.200 1.00 0.00 N ATOM 82 CA CYS A 8 -5.964 3.122 -10.311 1.00 0.00 C ATOM 83 C CYS A 8 -4.954 4.160 -9.808 1.00 0.00 C ATOM 84 O CYS A 8 -3.779 4.103 -10.162 1.00 0.00 O ATOM 85 CB CYS A 8 -6.631 2.343 -9.181 1.00 0.00 C ATOM 86 SG CYS A 8 -7.940 1.236 -9.819 1.00 0.00 S ATOM 0 H CYS A 8 -4.561 1.616 -10.779 1.00 0.00 H new ATOM 0 HA CYS A 8 -6.714 3.704 -10.846 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -5.882 1.756 -8.650 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -7.060 3.039 -8.460 1.00 0.00 H new ATOM 0 HG CYS A 8 -8.519 0.630 -8.825 1.00 0.00 H new ATOM 92 N ASN A 9 -5.402 4.992 -8.875 1.00 0.00 N ATOM 93 CA ASN A 9 -4.578 6.083 -8.330 1.00 0.00 C ATOM 94 C ASN A 9 -4.576 6.011 -6.810 1.00 0.00 C ATOM 95 O ASN A 9 -5.627 5.950 -6.162 1.00 0.00 O ATOM 96 CB ASN A 9 -5.091 7.466 -8.732 1.00 0.00 C ATOM 97 CG ASN A 9 -5.168 7.698 -10.240 1.00 0.00 C ATOM 98 OD1 ASN A 9 -5.667 6.902 -11.027 1.00 0.00 O ATOM 99 ND2 ASN A 9 -4.790 8.881 -10.649 1.00 0.00 N ATOM 0 H ASN A 9 -6.338 4.937 -8.473 1.00 0.00 H new ATOM 0 HA ASN A 9 -3.576 5.953 -8.740 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -6.083 7.611 -8.304 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -4.441 8.223 -8.293 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.910 9.145 -11.627 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -4.375 9.540 -9.990 1.00 0.00 H new ATOM 106 N VAL A 10 -3.359 5.943 -6.299 1.00 0.00 N ATOM 107 CA VAL A 10 -3.112 5.876 -4.852 1.00 0.00 C ATOM 108 C VAL A 10 -1.971 6.856 -4.534 1.00 0.00 C ATOM 109 O VAL A 10 -1.123 7.151 -5.374 1.00 0.00 O ATOM 110 CB VAL A 10 -2.859 4.434 -4.334 1.00 0.00 C ATOM 111 CG1 VAL A 10 -3.803 3.386 -4.937 1.00 0.00 C ATOM 112 CG2 VAL A 10 -1.416 3.953 -4.454 1.00 0.00 C ATOM 0 H VAL A 10 -2.511 5.932 -6.865 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.010 6.175 -4.311 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.080 4.526 -3.271 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.566 2.404 -4.528 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.834 3.641 -4.692 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.681 3.367 -6.020 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.338 2.937 -4.067 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.114 3.967 -5.501 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.764 4.611 -3.879 1.00 0.00 H new ATOM 122 N LEU A 11 -2.038 7.417 -3.346 1.00 0.00 N ATOM 123 CA LEU A 11 -0.993 8.305 -2.840 1.00 0.00 C ATOM 124 C LEU A 11 0.099 7.433 -2.209 1.00 0.00 C ATOM 125 O LEU A 11 -0.120 6.754 -1.206 1.00 0.00 O ATOM 126 CB LEU A 11 -1.680 9.263 -1.857 1.00 0.00 C ATOM 127 CG LEU A 11 -0.885 10.484 -1.393 1.00 0.00 C ATOM 128 CD1 LEU A 11 0.311 10.055 -0.561 1.00 0.00 C ATOM 129 CD2 LEU A 11 -0.465 11.368 -2.568 1.00 0.00 C ATOM 0 H LEU A 11 -2.813 7.276 -2.699 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.504 8.905 -3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.601 9.617 -2.320 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.966 8.692 -0.974 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.537 11.089 -0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 11 0.865 10.937 -0.239 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -0.033 9.504 0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 11 0.961 9.416 -1.160 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.097 12.224 -2.196 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.160 10.793 -3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -1.352 11.718 -3.095 1.00 0.00 H new ATOM 141 N PHE A 12 1.270 7.540 -2.815 1.00 0.00 N ATOM 142 CA PHE A 12 2.502 6.845 -2.423 1.00 0.00 C ATOM 143 C PHE A 12 3.042 7.499 -1.158 1.00 0.00 C ATOM 144 O PHE A 12 3.208 8.719 -1.094 1.00 0.00 O ATOM 145 CB PHE A 12 3.554 7.022 -3.519 1.00 0.00 C ATOM 146 CG PHE A 12 4.772 6.122 -3.333 1.00 0.00 C ATOM 147 CD1 PHE A 12 5.783 6.482 -2.448 1.00 0.00 C ATOM 148 CD2 PHE A 12 4.866 4.930 -4.045 1.00 0.00 C ATOM 149 CE1 PHE A 12 6.873 5.645 -2.265 1.00 0.00 C ATOM 150 CE2 PHE A 12 5.946 4.095 -3.856 1.00 0.00 C ATOM 151 CZ PHE A 12 6.962 4.454 -2.968 1.00 0.00 C ATOM 0 H PHE A 12 1.402 8.138 -3.631 1.00 0.00 H new ATOM 0 HA PHE A 12 2.291 5.787 -2.264 1.00 0.00 H new ATOM 0 HB2 PHE A 12 3.100 6.812 -4.487 1.00 0.00 H new ATOM 0 HB3 PHE A 12 3.878 8.062 -3.538 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.719 7.413 -1.904 1.00 0.00 H new ATOM 0 HD2 PHE A 12 4.091 4.659 -4.747 1.00 0.00 H new ATOM 0 HE1 PHE A 12 7.655 5.922 -1.573 1.00 0.00 H new ATOM 0 HE2 PHE A 12 6.007 3.161 -4.396 1.00 0.00 H new ATOM 0 HZ PHE A 12 7.815 3.806 -2.829 1.00 0.00 H new ATOM 161 N ILE A 13 3.458 6.622 -0.263 1.00 0.00 N ATOM 162 CA ILE A 13 4.064 7.079 0.988 1.00 0.00 C ATOM 163 C ILE A 13 5.543 6.658 1.009 1.00 0.00 C ATOM 164 O ILE A 13 6.405 7.457 0.654 1.00 0.00 O ATOM 165 CB ILE A 13 3.270 6.577 2.202 1.00 0.00 C ATOM 166 CG1 ILE A 13 1.752 6.833 2.167 1.00 0.00 C ATOM 167 CG2 ILE A 13 3.897 7.212 3.429 1.00 0.00 C ATOM 168 CD1 ILE A 13 1.317 8.290 2.066 1.00 0.00 C ATOM 0 H ILE A 13 3.393 5.610 -0.368 1.00 0.00 H new ATOM 0 HA ILE A 13 4.028 8.167 1.048 1.00 0.00 H new ATOM 0 HB ILE A 13 3.336 5.489 2.208 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.333 6.291 1.319 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.312 6.406 3.068 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.364 6.884 4.321 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.943 6.912 3.500 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.836 8.297 3.349 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.228 8.344 2.049 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.695 8.843 2.926 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.716 8.726 1.150 1.00 0.00 H new ATOM 180 N ASN A 14 5.788 5.439 1.490 1.00 0.00 N ATOM 181 CA ASN A 14 7.130 4.845 1.638 1.00 0.00 C ATOM 182 C ASN A 14 7.024 3.423 2.209 1.00 0.00 C ATOM 183 O ASN A 14 5.981 3.012 2.729 1.00 0.00 O ATOM 184 CB ASN A 14 7.994 5.706 2.572 1.00 0.00 C ATOM 185 CG ASN A 14 9.482 5.373 2.491 1.00 0.00 C ATOM 186 OD1 ASN A 14 10.004 4.841 1.514 1.00 0.00 O ATOM 187 ND2 ASN A 14 10.182 5.637 3.562 1.00 0.00 N ATOM 0 H ASN A 14 5.042 4.815 1.798 1.00 0.00 H new ATOM 0 HA ASN A 14 7.596 4.803 0.654 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.849 6.757 2.324 1.00 0.00 H new ATOM 0 HB3 ASN A 14 7.653 5.571 3.599 1.00 0.00 H new ATOM 0 HD21 ASN A 14 11.174 5.401 3.594 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.737 6.079 4.366 1.00 0.00 H new ATOM 194 N SER A 15 8.117 2.696 2.016 1.00 0.00 N ATOM 195 CA SER A 15 8.292 1.314 2.488 1.00 0.00 C ATOM 196 C SER A 15 9.136 1.310 3.760 1.00 0.00 C ATOM 197 O SER A 15 10.197 1.924 3.865 1.00 0.00 O ATOM 198 CB SER A 15 8.963 0.441 1.426 1.00 0.00 C ATOM 199 OG SER A 15 10.173 1.030 0.943 1.00 0.00 O ATOM 0 H SER A 15 8.931 3.053 1.515 1.00 0.00 H new ATOM 0 HA SER A 15 7.305 0.900 2.694 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.179 -0.541 1.846 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.276 0.288 0.594 1.00 0.00 H new ATOM 0 HG SER A 15 10.575 0.444 0.268 1.00 0.00 H new ATOM 205 N VAL A 16 8.536 0.698 4.763 1.00 0.00 N ATOM 206 CA VAL A 16 9.142 0.586 6.101 1.00 0.00 C ATOM 207 C VAL A 16 9.261 -0.887 6.487 1.00 0.00 C ATOM 208 O VAL A 16 8.329 -1.672 6.306 1.00 0.00 O ATOM 209 CB VAL A 16 8.400 1.423 7.161 1.00 0.00 C ATOM 210 CG1 VAL A 16 8.648 2.918 6.947 1.00 0.00 C ATOM 211 CG2 VAL A 16 6.892 1.184 7.157 1.00 0.00 C ATOM 0 H VAL A 16 7.617 0.262 4.687 1.00 0.00 H new ATOM 0 HA VAL A 16 10.145 1.011 6.061 1.00 0.00 H new ATOM 0 HB VAL A 16 8.799 1.102 8.123 1.00 0.00 H new ATOM 0 HG11 VAL A 16 8.114 3.488 7.707 1.00 0.00 H new ATOM 0 HG12 VAL A 16 9.716 3.124 7.022 1.00 0.00 H new ATOM 0 HG13 VAL A 16 8.291 3.208 5.959 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.424 1.801 7.924 1.00 0.00 H new ATOM 0 HG22 VAL A 16 6.484 1.448 6.181 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.690 0.133 7.363 1.00 0.00 H new ATOM 221 N GLU A 17 10.494 -1.271 6.795 1.00 0.00 N ATOM 222 CA GLU A 17 10.802 -2.666 7.162 1.00 0.00 C ATOM 223 C GLU A 17 10.070 -3.048 8.453 1.00 0.00 C ATOM 224 O GLU A 17 10.085 -2.327 9.447 1.00 0.00 O ATOM 225 CB GLU A 17 12.311 -2.924 7.285 1.00 0.00 C ATOM 226 CG GLU A 17 12.996 -2.174 8.433 1.00 0.00 C ATOM 227 CD GLU A 17 14.031 -1.190 7.898 1.00 0.00 C ATOM 228 OE1 GLU A 17 13.614 -0.054 7.586 1.00 0.00 O ATOM 229 OE2 GLU A 17 15.195 -1.624 7.768 1.00 0.00 O ATOM 0 H GLU A 17 11.300 -0.646 6.801 1.00 0.00 H new ATOM 0 HA GLU A 17 10.446 -3.302 6.351 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.474 -3.993 7.419 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.792 -2.644 6.348 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.249 -1.639 9.020 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.478 -2.887 9.102 1.00 0.00 H new ATOM 236 N MET A 18 9.426 -4.197 8.379 1.00 0.00 N ATOM 237 CA MET A 18 8.610 -4.716 9.490 1.00 0.00 C ATOM 238 C MET A 18 9.162 -6.015 10.061 1.00 0.00 C ATOM 239 O MET A 18 8.435 -6.812 10.652 1.00 0.00 O ATOM 240 CB MET A 18 7.169 -4.937 9.024 1.00 0.00 C ATOM 241 CG MET A 18 6.544 -3.731 8.321 1.00 0.00 C ATOM 242 SD MET A 18 6.969 -2.050 8.912 1.00 0.00 S ATOM 243 CE MET A 18 6.768 -2.248 10.661 1.00 0.00 C ATOM 0 H MET A 18 9.445 -4.803 7.559 1.00 0.00 H new ATOM 0 HA MET A 18 8.639 -3.968 10.282 1.00 0.00 H new ATOM 0 HB2 MET A 18 7.145 -5.790 8.346 1.00 0.00 H new ATOM 0 HB3 MET A 18 6.556 -5.198 9.887 1.00 0.00 H new ATOM 0 HG2 MET A 18 6.812 -3.788 7.266 1.00 0.00 H new ATOM 0 HG3 MET A 18 5.461 -3.838 8.381 1.00 0.00 H new ATOM 0 HE1 MET A 18 7.269 -1.430 11.180 1.00 0.00 H new ATOM 0 HE2 MET A 18 5.707 -2.239 10.909 1.00 0.00 H new ATOM 0 HE3 MET A 18 7.205 -3.197 10.972 1.00 0.00 H new ATOM 253 N GLU A 19 10.463 -6.213 9.842 1.00 0.00 N ATOM 254 CA GLU A 19 11.175 -7.449 10.199 1.00 0.00 C ATOM 255 C GLU A 19 10.494 -8.681 9.562 1.00 0.00 C ATOM 256 O GLU A 19 9.661 -8.549 8.662 1.00 0.00 O ATOM 257 CB GLU A 19 11.230 -7.553 11.727 1.00 0.00 C ATOM 258 CG GLU A 19 12.662 -7.496 12.246 1.00 0.00 C ATOM 259 CD GLU A 19 12.707 -8.220 13.590 1.00 0.00 C ATOM 260 OE1 GLU A 19 12.646 -9.469 13.538 1.00 0.00 O ATOM 261 OE2 GLU A 19 12.753 -7.522 14.624 1.00 0.00 O ATOM 0 H GLU A 19 11.063 -5.512 9.406 1.00 0.00 H new ATOM 0 HA GLU A 19 12.192 -7.421 9.808 1.00 0.00 H new ATOM 0 HB2 GLU A 19 10.651 -6.742 12.168 1.00 0.00 H new ATOM 0 HB3 GLU A 19 10.765 -8.486 12.045 1.00 0.00 H new ATOM 0 HG2 GLU A 19 13.343 -7.966 11.537 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.985 -6.461 12.360 1.00 0.00 H new ATOM 268 N SER A 20 10.798 -9.865 10.080 1.00 0.00 N ATOM 269 CA SER A 20 10.212 -11.125 9.585 1.00 0.00 C ATOM 270 C SER A 20 9.047 -11.571 10.485 1.00 0.00 C ATOM 271 O SER A 20 9.137 -12.514 11.268 1.00 0.00 O ATOM 272 CB SER A 20 11.296 -12.200 9.559 1.00 0.00 C ATOM 273 OG SER A 20 10.971 -13.174 8.568 1.00 0.00 O ATOM 0 H SER A 20 11.453 -9.989 10.852 1.00 0.00 H new ATOM 0 HA SER A 20 9.823 -10.969 8.579 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.265 -11.751 9.340 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.378 -12.673 10.537 1.00 0.00 H new ATOM 0 HG SER A 20 11.666 -13.865 8.548 1.00 0.00 H new ATOM 279 N LEU A 21 8.031 -10.715 10.499 1.00 0.00 N ATOM 280 CA LEU A 21 6.791 -10.987 11.252 1.00 0.00 C ATOM 281 C LEU A 21 5.543 -10.967 10.369 1.00 0.00 C ATOM 282 O LEU A 21 4.949 -12.013 10.121 1.00 0.00 O ATOM 283 CB LEU A 21 6.666 -10.125 12.523 1.00 0.00 C ATOM 284 CG LEU A 21 6.813 -8.610 12.340 1.00 0.00 C ATOM 285 CD1 LEU A 21 5.458 -7.897 12.316 1.00 0.00 C ATOM 286 CD2 LEU A 21 7.696 -8.039 13.449 1.00 0.00 C ATOM 0 H LEU A 21 8.032 -9.825 10.001 1.00 0.00 H new ATOM 0 HA LEU A 21 6.869 -12.014 11.609 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.693 -10.321 12.974 1.00 0.00 H new ATOM 0 HB3 LEU A 21 7.421 -10.457 13.236 1.00 0.00 H new ATOM 0 HG LEU A 21 7.283 -8.436 11.372 1.00 0.00 H new ATOM 0 HD11 LEU A 21 5.613 -6.826 12.184 1.00 0.00 H new ATOM 0 HD12 LEU A 21 4.859 -8.281 11.490 1.00 0.00 H new ATOM 0 HD13 LEU A 21 4.936 -8.075 13.256 1.00 0.00 H new ATOM 0 HD21 LEU A 21 7.798 -6.962 13.315 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.240 -8.243 14.418 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.681 -8.505 13.406 1.00 0.00 H new ATOM 298 N THR A 22 5.272 -9.808 9.760 1.00 0.00 N ATOM 299 CA THR A 22 4.075 -9.608 8.921 1.00 0.00 C ATOM 300 C THR A 22 2.758 -9.826 9.703 1.00 0.00 C ATOM 301 O THR A 22 2.744 -10.215 10.871 1.00 0.00 O ATOM 302 CB THR A 22 4.255 -10.446 7.631 1.00 0.00 C ATOM 303 OG1 THR A 22 4.675 -9.588 6.567 1.00 0.00 O ATOM 304 CG2 THR A 22 3.074 -11.321 7.205 1.00 0.00 C ATOM 0 H THR A 22 5.869 -8.984 9.831 1.00 0.00 H new ATOM 0 HA THR A 22 3.978 -8.567 8.614 1.00 0.00 H new ATOM 0 HB THR A 22 5.022 -11.181 7.876 1.00 0.00 H new ATOM 0 HG1 THR A 22 5.654 -9.545 6.548 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.328 -11.855 6.289 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.850 -12.039 7.994 1.00 0.00 H new ATOM 0 HG23 THR A 22 2.201 -10.693 7.028 1.00 0.00 H new ATOM 312 N GLY A 23 1.684 -9.310 9.098 1.00 0.00 N ATOM 313 CA GLY A 23 0.308 -9.495 9.593 1.00 0.00 C ATOM 314 C GLY A 23 -0.311 -8.166 10.058 1.00 0.00 C ATOM 315 O GLY A 23 0.245 -7.109 9.742 1.00 0.00 O ATOM 0 H GLY A 23 1.740 -8.749 8.248 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -0.308 -9.927 8.804 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.311 -10.205 10.420 1.00 0.00 H new ATOM 319 N PRO A 24 -1.312 -8.217 10.954 1.00 0.00 N ATOM 320 CA PRO A 24 -1.968 -7.001 11.477 1.00 0.00 C ATOM 321 C PRO A 24 -1.092 -6.161 12.427 1.00 0.00 C ATOM 322 O PRO A 24 -1.472 -5.063 12.819 1.00 0.00 O ATOM 323 CB PRO A 24 -3.251 -7.516 12.132 1.00 0.00 C ATOM 324 CG PRO A 24 -2.852 -8.897 12.649 1.00 0.00 C ATOM 325 CD PRO A 24 -1.890 -9.425 11.583 1.00 0.00 C ATOM 0 HA PRO A 24 -2.169 -6.289 10.677 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.580 -6.863 12.941 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.072 -7.576 11.417 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -2.371 -8.835 13.625 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.719 -9.547 12.762 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -1.114 -10.048 12.026 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -2.412 -10.040 10.850 1.00 0.00 H new ATOM 333 N GLN A 25 0.139 -6.623 12.661 1.00 0.00 N ATOM 334 CA GLN A 25 1.156 -5.888 13.434 1.00 0.00 C ATOM 335 C GLN A 25 2.114 -5.111 12.521 1.00 0.00 C ATOM 336 O GLN A 25 2.362 -3.934 12.762 1.00 0.00 O ATOM 337 CB GLN A 25 1.932 -6.856 14.334 1.00 0.00 C ATOM 338 CG GLN A 25 3.042 -6.125 15.099 1.00 0.00 C ATOM 339 CD GLN A 25 3.071 -6.498 16.572 1.00 0.00 C ATOM 340 OE1 GLN A 25 2.215 -6.112 17.361 1.00 0.00 O ATOM 341 NE2 GLN A 25 4.071 -7.246 16.963 1.00 0.00 N ATOM 0 H GLN A 25 0.466 -7.526 12.318 1.00 0.00 H new ATOM 0 HA GLN A 25 0.640 -5.157 14.057 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.249 -7.328 15.040 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.366 -7.652 13.729 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.006 -6.360 14.648 1.00 0.00 H new ATOM 0 HG3 GLN A 25 2.899 -5.049 15.002 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.771 -7.555 16.288 1.00 0.00 H new ATOM 0 HE22 GLN A 25 4.150 -7.520 17.942 1.00 0.00 H new ATOM 350 N ALA A 26 2.502 -5.723 11.407 1.00 0.00 N ATOM 351 CA ALA A 26 3.405 -5.097 10.426 1.00 0.00 C ATOM 352 C ALA A 26 2.759 -3.870 9.772 1.00 0.00 C ATOM 353 O ALA A 26 3.432 -2.895 9.478 1.00 0.00 O ATOM 354 CB ALA A 26 3.750 -6.133 9.367 1.00 0.00 C ATOM 0 H ALA A 26 2.205 -6.665 11.152 1.00 0.00 H new ATOM 0 HA ALA A 26 4.306 -4.756 10.936 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.419 -5.690 8.629 1.00 0.00 H new ATOM 0 HB2 ALA A 26 4.242 -6.985 9.838 1.00 0.00 H new ATOM 0 HB3 ALA A 26 2.837 -6.468 8.874 1.00 0.00 H new ATOM 360 N ILE A 27 1.432 -3.912 9.673 1.00 0.00 N ATOM 361 CA ILE A 27 0.610 -2.790 9.189 1.00 0.00 C ATOM 362 C ILE A 27 0.541 -1.687 10.263 1.00 0.00 C ATOM 363 O ILE A 27 0.787 -0.540 9.937 1.00 0.00 O ATOM 364 CB ILE A 27 -0.793 -3.275 8.786 1.00 0.00 C ATOM 365 CG1 ILE A 27 -0.711 -4.509 7.878 1.00 0.00 C ATOM 366 CG2 ILE A 27 -1.542 -2.164 8.035 1.00 0.00 C ATOM 367 CD1 ILE A 27 -1.959 -5.372 8.043 1.00 0.00 C ATOM 0 H ILE A 27 0.884 -4.734 9.928 1.00 0.00 H new ATOM 0 HA ILE A 27 1.075 -2.368 8.298 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.326 -3.537 9.700 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.611 -4.198 6.838 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.177 -5.091 8.124 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.534 -2.519 7.755 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -1.638 -1.290 8.679 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -0.986 -1.893 7.137 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.887 -6.244 7.393 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -2.041 -5.698 9.080 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.841 -4.791 7.774 1.00 0.00 H new ATOM 379 N SER A 28 0.499 -2.055 11.543 1.00 0.00 N ATOM 380 CA SER A 28 0.437 -1.062 12.642 1.00 0.00 C ATOM 381 C SER A 28 1.798 -0.438 12.958 1.00 0.00 C ATOM 382 O SER A 28 1.943 0.776 12.881 1.00 0.00 O ATOM 383 CB SER A 28 -0.146 -1.655 13.923 1.00 0.00 C ATOM 384 OG SER A 28 -1.369 -0.972 14.199 1.00 0.00 O ATOM 0 H SER A 28 0.506 -3.026 11.855 1.00 0.00 H new ATOM 0 HA SER A 28 -0.226 -0.278 12.276 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.323 -2.724 13.804 1.00 0.00 H new ATOM 0 HB3 SER A 28 0.553 -1.538 14.751 1.00 0.00 H new ATOM 0 HG SER A 28 -1.768 -1.334 15.018 1.00 0.00 H new ATOM 390 N LYS A 29 2.825 -1.280 13.026 1.00 0.00 N ATOM 391 CA LYS A 29 4.219 -0.843 13.225 1.00 0.00 C ATOM 392 C LYS A 29 4.779 -0.109 11.986 1.00 0.00 C ATOM 393 O LYS A 29 5.885 0.418 12.008 1.00 0.00 O ATOM 394 CB LYS A 29 5.010 -2.080 13.671 1.00 0.00 C ATOM 395 CG LYS A 29 6.427 -1.757 14.153 1.00 0.00 C ATOM 396 CD LYS A 29 6.815 -2.696 15.289 1.00 0.00 C ATOM 397 CE LYS A 29 6.941 -1.872 16.569 1.00 0.00 C ATOM 398 NZ LYS A 29 6.697 -2.706 17.751 1.00 0.00 N ATOM 0 H LYS A 29 2.722 -2.292 12.945 1.00 0.00 H new ATOM 0 HA LYS A 29 4.301 -0.086 14.005 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.467 -2.579 14.473 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.069 -2.783 12.840 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.133 -1.858 13.329 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.478 -0.722 14.491 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.063 -3.475 15.411 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.758 -3.195 15.064 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.937 -1.433 16.628 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.229 -1.047 16.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.788 -2.126 18.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.738 -3.105 17.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.392 -3.479 17.780 1.00 0.00 H new ATOM 412 N ALA A 30 4.009 -0.110 10.898 1.00 0.00 N ATOM 413 CA ALA A 30 4.300 0.657 9.679 1.00 0.00 C ATOM 414 C ALA A 30 3.431 1.910 9.572 1.00 0.00 C ATOM 415 O ALA A 30 3.972 2.997 9.659 1.00 0.00 O ATOM 416 CB ALA A 30 4.021 -0.208 8.467 1.00 0.00 C ATOM 0 H ALA A 30 3.148 -0.653 10.834 1.00 0.00 H new ATOM 0 HA ALA A 30 5.347 0.958 9.723 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.235 0.357 7.560 1.00 0.00 H new ATOM 0 HB2 ALA A 30 4.653 -1.095 8.500 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.973 -0.509 8.468 1.00 0.00 H new ATOM 422 N VAL A 31 2.116 1.769 9.739 1.00 0.00 N ATOM 423 CA VAL A 31 1.174 2.912 9.706 1.00 0.00 C ATOM 424 C VAL A 31 1.534 3.920 10.819 1.00 0.00 C ATOM 425 O VAL A 31 1.668 5.112 10.547 1.00 0.00 O ATOM 426 CB VAL A 31 -0.298 2.456 9.813 1.00 0.00 C ATOM 427 CG1 VAL A 31 -1.239 3.659 9.862 1.00 0.00 C ATOM 428 CG2 VAL A 31 -0.749 1.608 8.622 1.00 0.00 C ATOM 0 H VAL A 31 1.665 0.868 9.901 1.00 0.00 H new ATOM 0 HA VAL A 31 1.274 3.405 8.739 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.345 1.864 10.727 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.270 3.312 9.937 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.999 4.274 10.730 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.121 4.251 8.954 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.791 1.318 8.755 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.648 2.187 7.704 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.129 0.714 8.557 1.00 0.00 H new ATOM 438 N ALA A 32 1.898 3.390 11.986 1.00 0.00 N ATOM 439 CA ALA A 32 2.320 4.198 13.148 1.00 0.00 C ATOM 440 C ALA A 32 3.763 4.716 13.027 1.00 0.00 C ATOM 441 O ALA A 32 4.069 5.800 13.513 1.00 0.00 O ATOM 442 CB ALA A 32 2.131 3.419 14.451 1.00 0.00 C ATOM 0 H ALA A 32 1.911 2.385 12.161 1.00 0.00 H new ATOM 0 HA ALA A 32 1.674 5.076 13.165 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.449 4.035 15.292 1.00 0.00 H new ATOM 0 HB2 ALA A 32 1.079 3.157 14.569 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.730 2.509 14.421 1.00 0.00 H new ATOM 448 N GLU A 33 4.571 4.040 12.209 1.00 0.00 N ATOM 449 CA GLU A 33 5.964 4.463 11.938 1.00 0.00 C ATOM 450 C GLU A 33 6.132 5.109 10.551 1.00 0.00 C ATOM 451 O GLU A 33 7.210 5.158 9.962 1.00 0.00 O ATOM 452 CB GLU A 33 6.912 3.272 12.079 1.00 0.00 C ATOM 453 CG GLU A 33 6.982 2.803 13.533 1.00 0.00 C ATOM 454 CD GLU A 33 8.424 2.470 13.898 1.00 0.00 C ATOM 455 OE1 GLU A 33 9.125 3.432 14.280 1.00 0.00 O ATOM 456 OE2 GLU A 33 8.788 1.277 13.823 1.00 0.00 O ATOM 0 H GLU A 33 4.292 3.192 11.716 1.00 0.00 H new ATOM 0 HA GLU A 33 6.214 5.225 12.677 1.00 0.00 H new ATOM 0 HB2 GLU A 33 6.572 2.454 11.444 1.00 0.00 H new ATOM 0 HB3 GLU A 33 7.908 3.551 11.734 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.600 3.580 14.195 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.350 1.926 13.673 1.00 0.00 H new ATOM 463 N THR A 34 4.998 5.529 10.005 1.00 0.00 N ATOM 464 CA THR A 34 4.948 6.182 8.691 1.00 0.00 C ATOM 465 C THR A 34 4.113 7.466 8.719 1.00 0.00 C ATOM 466 O THR A 34 4.553 8.481 8.191 1.00 0.00 O ATOM 467 CB THR A 34 4.473 5.167 7.650 1.00 0.00 C ATOM 468 OG1 THR A 34 5.420 4.103 7.558 1.00 0.00 O ATOM 469 CG2 THR A 34 4.419 5.786 6.274 1.00 0.00 C ATOM 0 H THR A 34 4.087 5.430 10.453 1.00 0.00 H new ATOM 0 HA THR A 34 5.948 6.511 8.408 1.00 0.00 H new ATOM 0 HB THR A 34 3.487 4.822 7.960 1.00 0.00 H new ATOM 0 HG1 THR A 34 5.234 3.439 8.254 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.078 5.042 5.554 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.727 6.628 6.281 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.413 6.135 5.993 1.00 0.00 H new ATOM 477 N LEU A 35 2.991 7.447 9.436 1.00 0.00 N ATOM 478 CA LEU A 35 2.213 8.678 9.678 1.00 0.00 C ATOM 479 C LEU A 35 2.958 9.688 10.564 1.00 0.00 C ATOM 480 O LEU A 35 2.732 10.892 10.479 1.00 0.00 O ATOM 481 CB LEU A 35 0.858 8.339 10.292 1.00 0.00 C ATOM 482 CG LEU A 35 -0.169 7.977 9.222 1.00 0.00 C ATOM 483 CD1 LEU A 35 -1.374 7.358 9.913 1.00 0.00 C ATOM 484 CD2 LEU A 35 -0.648 9.235 8.493 1.00 0.00 C ATOM 0 H LEU A 35 2.597 6.607 9.859 1.00 0.00 H new ATOM 0 HA LEU A 35 2.066 9.152 8.708 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.970 7.506 10.986 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.497 9.189 10.871 1.00 0.00 H new ATOM 0 HG LEU A 35 0.286 7.291 8.508 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.123 7.090 9.168 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.064 6.463 10.453 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.800 8.076 10.614 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.380 8.959 7.734 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.107 9.917 9.208 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.201 9.725 8.017 1.00 0.00 H new ATOM 496 N VAL A 36 3.835 9.141 11.400 1.00 0.00 N ATOM 497 CA VAL A 36 4.684 9.916 12.330 1.00 0.00 C ATOM 498 C VAL A 36 6.173 9.818 11.934 1.00 0.00 C ATOM 499 O VAL A 36 7.018 10.433 12.585 1.00 0.00 O ATOM 500 CB VAL A 36 4.474 9.444 13.790 1.00 0.00 C ATOM 501 CG1 VAL A 36 4.977 10.491 14.791 1.00 0.00 C ATOM 502 CG2 VAL A 36 3.018 9.113 14.146 1.00 0.00 C ATOM 0 H VAL A 36 3.986 8.134 11.460 1.00 0.00 H new ATOM 0 HA VAL A 36 4.385 10.962 12.263 1.00 0.00 H new ATOM 0 HB VAL A 36 5.053 8.523 13.859 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.816 10.130 15.807 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.041 10.664 14.632 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.432 11.424 14.646 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.962 8.791 15.186 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.399 9.999 14.006 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.658 8.313 13.499 1.00 0.00 H new ATOM 512 N ALA A 37 6.488 9.079 10.855 1.00 0.00 N ATOM 513 CA ALA A 37 7.858 8.935 10.320 1.00 0.00 C ATOM 514 C ALA A 37 8.578 10.293 10.330 1.00 0.00 C ATOM 515 O ALA A 37 7.984 11.325 10.056 1.00 0.00 O ATOM 516 CB ALA A 37 7.812 8.398 8.887 1.00 0.00 C ATOM 0 H ALA A 37 5.791 8.558 10.322 1.00 0.00 H new ATOM 0 HA ALA A 37 8.402 8.233 10.952 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.827 8.296 8.504 1.00 0.00 H new ATOM 0 HB2 ALA A 37 7.322 7.424 8.879 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.254 9.090 8.257 1.00 0.00 H new ATOM 522 N ASP A 38 9.668 10.307 11.088 1.00 0.00 N ATOM 523 CA ASP A 38 10.434 11.544 11.290 1.00 0.00 C ATOM 524 C ASP A 38 11.864 11.399 10.754 1.00 0.00 C ATOM 525 O ASP A 38 12.633 10.619 11.319 1.00 0.00 O ATOM 526 CB ASP A 38 10.380 11.999 12.755 1.00 0.00 C ATOM 527 CG ASP A 38 9.460 13.208 12.996 1.00 0.00 C ATOM 528 OD1 ASP A 38 8.925 13.769 12.013 1.00 0.00 O ATOM 529 OD2 ASP A 38 9.448 13.658 14.163 1.00 0.00 O ATOM 0 H ASP A 38 10.043 9.490 11.570 1.00 0.00 H new ATOM 0 HA ASP A 38 9.967 12.340 10.709 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.040 11.167 13.372 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.388 12.250 13.085 1.00 0.00 H new ATOM 534 N PRO A 39 12.129 12.056 9.617 1.00 0.00 N ATOM 535 CA PRO A 39 11.185 12.894 8.845 1.00 0.00 C ATOM 536 C PRO A 39 10.151 12.082 8.039 1.00 0.00 C ATOM 537 O PRO A 39 10.360 10.899 7.771 1.00 0.00 O ATOM 538 CB PRO A 39 12.082 13.754 7.956 1.00 0.00 C ATOM 539 CG PRO A 39 13.296 12.859 7.699 1.00 0.00 C ATOM 540 CD PRO A 39 13.475 12.089 9.008 1.00 0.00 C ATOM 0 HA PRO A 39 10.558 13.494 9.504 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.582 14.028 7.027 1.00 0.00 H new ATOM 0 HB3 PRO A 39 12.366 14.683 8.451 1.00 0.00 H new ATOM 0 HG2 PRO A 39 13.124 12.185 6.860 1.00 0.00 H new ATOM 0 HG3 PRO A 39 14.181 13.447 7.458 1.00 0.00 H new ATOM 0 HD2 PRO A 39 13.851 11.082 8.826 1.00 0.00 H new ATOM 0 HD3 PRO A 39 14.193 12.584 9.662 1.00 0.00 H new ATOM 548 N THR A 40 8.992 12.700 7.816 1.00 0.00 N ATOM 549 CA THR A 40 7.881 12.060 7.071 1.00 0.00 C ATOM 550 C THR A 40 8.088 12.161 5.554 1.00 0.00 C ATOM 551 O THR A 40 8.510 13.213 5.067 1.00 0.00 O ATOM 552 CB THR A 40 6.489 12.512 7.584 1.00 0.00 C ATOM 553 OG1 THR A 40 5.876 11.376 8.196 1.00 0.00 O ATOM 554 CG2 THR A 40 5.495 13.097 6.568 1.00 0.00 C ATOM 0 H THR A 40 8.787 13.646 8.137 1.00 0.00 H new ATOM 0 HA THR A 40 7.899 10.991 7.282 1.00 0.00 H new ATOM 0 HB THR A 40 6.700 13.348 8.251 1.00 0.00 H new ATOM 0 HG1 THR A 40 6.420 11.081 8.956 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.570 13.365 7.078 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.926 13.986 6.107 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.283 12.355 5.798 1.00 0.00 H new ATOM 562 N PRO A 41 7.814 11.069 4.830 1.00 0.00 N ATOM 563 CA PRO A 41 7.862 11.075 3.363 1.00 0.00 C ATOM 564 C PRO A 41 6.691 11.880 2.791 1.00 0.00 C ATOM 565 O PRO A 41 5.621 12.016 3.385 1.00 0.00 O ATOM 566 CB PRO A 41 7.826 9.603 2.958 1.00 0.00 C ATOM 567 CG PRO A 41 7.039 8.946 4.090 1.00 0.00 C ATOM 568 CD PRO A 41 7.459 9.727 5.335 1.00 0.00 C ATOM 0 HA PRO A 41 8.757 11.557 2.970 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.337 9.463 1.994 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.829 9.185 2.870 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.964 9.013 3.920 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.281 7.887 4.182 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.649 9.779 6.063 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.305 9.254 5.833 1.00 0.00 H new ATOM 576 N THR A 42 6.999 12.486 1.659 1.00 0.00 N ATOM 577 CA THR A 42 6.059 13.322 0.896 1.00 0.00 C ATOM 578 C THR A 42 5.019 12.466 0.176 1.00 0.00 C ATOM 579 O THR A 42 5.252 11.327 -0.231 1.00 0.00 O ATOM 580 CB THR A 42 6.821 14.203 -0.101 1.00 0.00 C ATOM 581 OG1 THR A 42 7.888 13.453 -0.697 1.00 0.00 O ATOM 582 CG2 THR A 42 7.334 15.476 0.576 1.00 0.00 C ATOM 0 H THR A 42 7.921 12.417 1.228 1.00 0.00 H new ATOM 0 HA THR A 42 5.530 13.967 1.598 1.00 0.00 H new ATOM 0 HB THR A 42 6.140 14.514 -0.893 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.370 14.020 -1.334 1.00 0.00 H new ATOM 0 HG21 THR A 42 7.871 16.084 -0.152 1.00 0.00 H new ATOM 0 HG22 THR A 42 6.491 16.043 0.971 1.00 0.00 H new ATOM 0 HG23 THR A 42 8.006 15.209 1.392 1.00 0.00 H new ATOM 590 N ALA A 43 3.826 13.037 0.150 1.00 0.00 N ATOM 591 CA ALA A 43 2.641 12.455 -0.482 1.00 0.00 C ATOM 592 C ALA A 43 2.696 12.563 -2.020 1.00 0.00 C ATOM 593 O ALA A 43 2.411 13.621 -2.579 1.00 0.00 O ATOM 594 CB ALA A 43 1.448 13.199 0.135 1.00 0.00 C ATOM 0 H ALA A 43 3.644 13.944 0.579 1.00 0.00 H new ATOM 0 HA ALA A 43 2.564 11.383 -0.298 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.521 12.816 -0.291 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.442 13.045 1.214 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.533 14.264 -0.079 1.00 0.00 H new ATOM 600 N THR A 44 3.120 11.491 -2.697 1.00 0.00 N ATOM 601 CA THR A 44 3.183 11.499 -4.178 1.00 0.00 C ATOM 602 C THR A 44 2.070 10.672 -4.845 1.00 0.00 C ATOM 603 O THR A 44 1.754 9.571 -4.414 1.00 0.00 O ATOM 604 CB THR A 44 4.612 11.188 -4.675 1.00 0.00 C ATOM 605 OG1 THR A 44 5.015 12.308 -5.464 1.00 0.00 O ATOM 606 CG2 THR A 44 4.828 9.897 -5.478 1.00 0.00 C ATOM 0 H THR A 44 3.421 10.619 -2.262 1.00 0.00 H new ATOM 0 HA THR A 44 2.966 12.514 -4.511 1.00 0.00 H new ATOM 0 HB THR A 44 5.209 11.016 -3.779 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.372 13.039 -5.347 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.878 9.814 -5.758 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.546 9.038 -4.869 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.213 9.921 -6.378 1.00 0.00 H new ATOM 614 N ILE A 45 1.533 11.181 -5.946 1.00 0.00 N ATOM 615 CA ILE A 45 0.471 10.476 -6.699 1.00 0.00 C ATOM 616 C ILE A 45 1.105 9.381 -7.570 1.00 0.00 C ATOM 617 O ILE A 45 1.990 9.633 -8.395 1.00 0.00 O ATOM 618 CB ILE A 45 -0.385 11.456 -7.525 1.00 0.00 C ATOM 619 CG1 ILE A 45 -1.025 12.484 -6.580 1.00 0.00 C ATOM 620 CG2 ILE A 45 -1.465 10.720 -8.340 1.00 0.00 C ATOM 621 CD1 ILE A 45 -1.489 13.769 -7.272 1.00 0.00 C ATOM 0 H ILE A 45 1.806 12.078 -6.348 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.211 10.002 -5.993 1.00 0.00 H new ATOM 0 HB ILE A 45 0.261 11.966 -8.239 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -1.879 12.023 -6.084 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.306 12.743 -5.802 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.048 11.444 -8.909 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -0.989 10.019 -9.025 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.124 10.176 -7.663 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -1.929 14.441 -6.535 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.636 14.256 -7.744 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -2.233 13.526 -8.030 1.00 0.00 H new ATOM 633 N VAL A 46 0.606 8.175 -7.339 1.00 0.00 N ATOM 634 CA VAL A 46 1.009 6.977 -8.096 1.00 0.00 C ATOM 635 C VAL A 46 -0.189 6.194 -8.644 1.00 0.00 C ATOM 636 O VAL A 46 -1.321 6.321 -8.175 1.00 0.00 O ATOM 637 CB VAL A 46 1.977 6.059 -7.321 1.00 0.00 C ATOM 638 CG1 VAL A 46 3.284 6.790 -7.032 1.00 0.00 C ATOM 639 CG2 VAL A 46 1.398 5.479 -6.033 1.00 0.00 C ATOM 0 H VAL A 46 -0.093 7.989 -6.620 1.00 0.00 H new ATOM 0 HA VAL A 46 1.565 7.358 -8.952 1.00 0.00 H new ATOM 0 HB VAL A 46 2.161 5.206 -7.974 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.957 6.130 -6.485 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.751 7.086 -7.971 1.00 0.00 H new ATOM 0 HG13 VAL A 46 3.080 7.677 -6.433 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.144 4.846 -5.551 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.122 6.291 -5.360 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.514 4.885 -6.266 1.00 0.00 H new ATOM 649 N HIS A 47 0.128 5.368 -9.627 1.00 0.00 N ATOM 650 CA HIS A 47 -0.837 4.481 -10.293 1.00 0.00 C ATOM 651 C HIS A 47 -0.584 3.032 -9.853 1.00 0.00 C ATOM 652 O HIS A 47 0.476 2.464 -10.108 1.00 0.00 O ATOM 653 CB HIS A 47 -0.727 4.729 -11.800 1.00 0.00 C ATOM 654 CG HIS A 47 -0.971 3.499 -12.707 1.00 0.00 C ATOM 655 ND1 HIS A 47 -1.898 2.579 -12.543 1.00 0.00 N ATOM 656 CD2 HIS A 47 -0.064 3.047 -13.553 1.00 0.00 C ATOM 657 CE1 HIS A 47 -1.531 1.520 -13.288 1.00 0.00 C ATOM 658 NE2 HIS A 47 -0.404 1.808 -13.912 1.00 0.00 N ATOM 0 H HIS A 47 1.075 5.287 -9.997 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.869 4.687 -10.010 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -1.441 5.506 -12.074 1.00 0.00 H new ATOM 0 HB3 HIS A 47 0.268 5.121 -12.012 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -2.734 2.654 -11.963 1.00 0.00 H new ATOM 0 HD2 HIS A 47 0.805 3.588 -13.896 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.070 0.587 -13.363 1.00 0.00 H new ATOM 666 N PHE A 48 -1.582 2.508 -9.156 1.00 0.00 N ATOM 667 CA PHE A 48 -1.572 1.123 -8.653 1.00 0.00 C ATOM 668 C PHE A 48 -2.184 0.195 -9.715 1.00 0.00 C ATOM 669 O PHE A 48 -3.341 0.356 -10.109 1.00 0.00 O ATOM 670 CB PHE A 48 -2.385 1.066 -7.357 1.00 0.00 C ATOM 671 CG PHE A 48 -1.889 -0.011 -6.396 1.00 0.00 C ATOM 672 CD1 PHE A 48 -2.086 -1.356 -6.682 1.00 0.00 C ATOM 673 CD2 PHE A 48 -1.264 0.339 -5.205 1.00 0.00 C ATOM 674 CE1 PHE A 48 -1.692 -2.318 -5.772 1.00 0.00 C ATOM 675 CE2 PHE A 48 -0.841 -0.622 -4.306 1.00 0.00 C ATOM 676 CZ PHE A 48 -1.060 -1.966 -4.584 1.00 0.00 C ATOM 0 H PHE A 48 -2.428 3.025 -8.918 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.552 0.797 -8.451 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -2.341 2.036 -6.862 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.431 0.878 -7.598 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -2.546 -1.649 -7.614 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.106 1.383 -4.977 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -1.878 -3.360 -5.987 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.343 -0.330 -3.393 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.743 -2.727 -3.886 1.00 0.00 H new ATOM 686 N LYS A 49 -1.336 -0.688 -10.229 1.00 0.00 N ATOM 687 CA LYS A 49 -1.717 -1.685 -11.250 1.00 0.00 C ATOM 688 C LYS A 49 -1.806 -3.067 -10.595 1.00 0.00 C ATOM 689 O LYS A 49 -0.799 -3.619 -10.156 1.00 0.00 O ATOM 690 CB LYS A 49 -0.695 -1.712 -12.397 1.00 0.00 C ATOM 691 CG LYS A 49 -1.105 -2.647 -13.546 1.00 0.00 C ATOM 692 CD LYS A 49 -1.133 -1.923 -14.896 1.00 0.00 C ATOM 693 CE LYS A 49 0.265 -1.633 -15.440 1.00 0.00 C ATOM 694 NZ LYS A 49 0.217 -0.486 -16.353 1.00 0.00 N ATOM 0 H LYS A 49 -0.355 -0.741 -9.954 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.686 -1.411 -11.667 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.567 -0.702 -12.786 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.272 -2.028 -12.007 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.408 -3.484 -13.598 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.090 -3.065 -13.339 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.680 -2.530 -15.617 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.678 -0.985 -14.789 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.949 -1.426 -14.617 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.651 -2.509 -15.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.133 -0.388 -16.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.532 -0.635 -17.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.016 0.380 -15.813 1.00 0.00 H new ATOM 708 N VAL A 50 -3.046 -3.496 -10.401 1.00 0.00 N ATOM 709 CA VAL A 50 -3.339 -4.823 -9.826 1.00 0.00 C ATOM 710 C VAL A 50 -3.700 -5.787 -10.966 1.00 0.00 C ATOM 711 O VAL A 50 -4.666 -5.606 -11.703 1.00 0.00 O ATOM 712 CB VAL A 50 -4.463 -4.786 -8.773 1.00 0.00 C ATOM 713 CG1 VAL A 50 -4.632 -6.143 -8.076 1.00 0.00 C ATOM 714 CG2 VAL A 50 -4.238 -3.719 -7.700 1.00 0.00 C ATOM 0 H VAL A 50 -3.876 -2.949 -10.631 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.447 -5.168 -9.304 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.367 -4.538 -9.329 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.434 -6.077 -7.341 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.880 -6.904 -8.816 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.702 -6.413 -7.576 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -5.062 -3.741 -6.987 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.302 -3.919 -7.179 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.190 -2.736 -8.169 1.00 0.00 H new ATOM 724 N SER A 51 -2.790 -6.719 -11.163 1.00 0.00 N ATOM 725 CA SER A 51 -2.905 -7.797 -12.159 1.00 0.00 C ATOM 726 C SER A 51 -2.859 -9.143 -11.420 1.00 0.00 C ATOM 727 O SER A 51 -2.516 -9.184 -10.236 1.00 0.00 O ATOM 728 CB SER A 51 -1.775 -7.617 -13.186 1.00 0.00 C ATOM 729 OG SER A 51 -1.009 -8.806 -13.406 1.00 0.00 O ATOM 0 H SER A 51 -1.923 -6.760 -10.628 1.00 0.00 H new ATOM 0 HA SER A 51 -3.847 -7.767 -12.706 1.00 0.00 H new ATOM 0 HB2 SER A 51 -2.204 -7.290 -14.133 1.00 0.00 H new ATOM 0 HB3 SER A 51 -1.110 -6.823 -12.847 1.00 0.00 H new ATOM 0 HG SER A 51 -0.804 -8.891 -14.361 1.00 0.00 H new ATOM 735 N ALA A 52 -3.260 -10.197 -12.133 1.00 0.00 N ATOM 736 CA ALA A 52 -3.240 -11.595 -11.654 1.00 0.00 C ATOM 737 C ALA A 52 -1.856 -11.955 -11.091 1.00 0.00 C ATOM 738 O ALA A 52 -0.877 -12.101 -11.821 1.00 0.00 O ATOM 739 CB ALA A 52 -3.603 -12.524 -12.818 1.00 0.00 C ATOM 0 H ALA A 52 -3.618 -10.108 -13.084 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.968 -11.713 -10.851 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -3.591 -13.559 -12.475 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -4.598 -12.275 -13.185 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.878 -12.400 -13.622 1.00 0.00 H new ATOM 745 N GLN A 53 -1.774 -11.823 -9.765 1.00 0.00 N ATOM 746 CA GLN A 53 -0.525 -11.955 -8.989 1.00 0.00 C ATOM 747 C GLN A 53 0.597 -10.997 -9.446 1.00 0.00 C ATOM 748 O GLN A 53 1.760 -11.383 -9.564 1.00 0.00 O ATOM 749 CB GLN A 53 -0.061 -13.416 -8.998 1.00 0.00 C ATOM 750 CG GLN A 53 -1.043 -14.317 -8.247 1.00 0.00 C ATOM 751 CD GLN A 53 -0.815 -15.786 -8.583 1.00 0.00 C ATOM 752 OE1 GLN A 53 -1.681 -16.469 -9.112 1.00 0.00 O ATOM 753 NE2 GLN A 53 0.365 -16.297 -8.313 1.00 0.00 N ATOM 0 H GLN A 53 -2.586 -11.617 -9.183 1.00 0.00 H new ATOM 0 HA GLN A 53 -0.751 -11.654 -7.966 1.00 0.00 H new ATOM 0 HB2 GLN A 53 0.039 -13.762 -10.027 1.00 0.00 H new ATOM 0 HB3 GLN A 53 0.926 -13.489 -8.540 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -0.931 -14.166 -7.173 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -2.065 -14.038 -8.503 1.00 0.00 H new ATOM 0 HE21 GLN A 53 1.082 -15.721 -7.872 1.00 0.00 H new ATOM 0 HE22 GLN A 53 0.564 -17.270 -8.545 1.00 0.00 H new ATOM 762 N GLY A 54 0.250 -9.705 -9.487 1.00 0.00 N ATOM 763 CA GLY A 54 1.207 -8.655 -9.879 1.00 0.00 C ATOM 764 C GLY A 54 0.690 -7.258 -9.550 1.00 0.00 C ATOM 765 O GLY A 54 -0.487 -6.952 -9.729 1.00 0.00 O ATOM 0 H GLY A 54 -0.681 -9.359 -9.255 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.156 -8.820 -9.368 1.00 0.00 H new ATOM 0 HA3 GLY A 54 1.405 -8.726 -10.949 1.00 0.00 H new ATOM 769 N ILE A 55 1.573 -6.502 -8.920 1.00 0.00 N ATOM 770 CA ILE A 55 1.291 -5.134 -8.449 1.00 0.00 C ATOM 771 C ILE A 55 2.410 -4.225 -8.973 1.00 0.00 C ATOM 772 O ILE A 55 3.585 -4.502 -8.764 1.00 0.00 O ATOM 773 CB ILE A 55 1.247 -5.141 -6.905 1.00 0.00 C ATOM 774 CG1 ILE A 55 0.198 -6.101 -6.306 1.00 0.00 C ATOM 775 CG2 ILE A 55 1.199 -3.741 -6.286 1.00 0.00 C ATOM 776 CD1 ILE A 55 -1.248 -5.927 -6.780 1.00 0.00 C ATOM 0 H ILE A 55 2.522 -6.814 -8.713 1.00 0.00 H new ATOM 0 HA ILE A 55 0.331 -4.768 -8.813 1.00 0.00 H new ATOM 0 HB ILE A 55 2.210 -5.559 -6.613 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.507 -7.123 -6.527 1.00 0.00 H new ATOM 0 HG13 ILE A 55 0.216 -5.990 -5.222 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.170 -3.824 -5.200 1.00 0.00 H new ATOM 0 HG22 ILE A 55 2.086 -3.181 -6.583 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.307 -3.220 -6.634 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.884 -6.661 -6.285 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.593 -4.923 -6.534 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -1.297 -6.073 -7.859 1.00 0.00 H new ATOM 788 N THR A 56 2.018 -3.083 -9.506 1.00 0.00 N ATOM 789 CA THR A 56 2.984 -2.114 -10.061 1.00 0.00 C ATOM 790 C THR A 56 2.581 -0.702 -9.626 1.00 0.00 C ATOM 791 O THR A 56 1.394 -0.408 -9.460 1.00 0.00 O ATOM 792 CB THR A 56 3.058 -2.268 -11.591 1.00 0.00 C ATOM 793 OG1 THR A 56 3.217 -3.649 -11.938 1.00 0.00 O ATOM 794 CG2 THR A 56 4.244 -1.510 -12.188 1.00 0.00 C ATOM 0 H THR A 56 1.043 -2.791 -9.573 1.00 0.00 H new ATOM 0 HA THR A 56 3.986 -2.305 -9.676 1.00 0.00 H new ATOM 0 HB THR A 56 2.129 -1.860 -11.991 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.262 -3.738 -12.913 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.256 -1.647 -13.269 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.151 -0.449 -11.958 1.00 0.00 H new ATOM 0 HG23 THR A 56 5.172 -1.893 -11.763 1.00 0.00 H new ATOM 802 N LEU A 57 3.601 0.073 -9.276 1.00 0.00 N ATOM 803 CA LEU A 57 3.452 1.459 -8.803 1.00 0.00 C ATOM 804 C LEU A 57 4.345 2.406 -9.601 1.00 0.00 C ATOM 805 O LEU A 57 5.553 2.191 -9.707 1.00 0.00 O ATOM 806 CB LEU A 57 3.786 1.527 -7.312 1.00 0.00 C ATOM 807 CG LEU A 57 2.706 0.807 -6.505 1.00 0.00 C ATOM 808 CD1 LEU A 57 3.302 0.241 -5.218 1.00 0.00 C ATOM 809 CD2 LEU A 57 1.563 1.773 -6.203 1.00 0.00 C ATOM 0 H LEU A 57 4.571 -0.241 -9.310 1.00 0.00 H new ATOM 0 HA LEU A 57 2.420 1.775 -8.952 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.757 1.069 -7.127 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.858 2.567 -6.993 1.00 0.00 H new ATOM 0 HG LEU A 57 2.311 -0.025 -7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.524 -0.270 -4.651 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.095 -0.465 -5.464 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.713 1.054 -4.619 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.794 1.258 -5.628 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.943 2.617 -5.627 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.135 2.134 -7.138 1.00 0.00 H new ATOM 821 N THR A 58 3.678 3.376 -10.209 1.00 0.00 N ATOM 822 CA THR A 58 4.318 4.344 -11.126 1.00 0.00 C ATOM 823 C THR A 58 3.998 5.766 -10.651 1.00 0.00 C ATOM 824 O THR A 58 2.880 6.035 -10.210 1.00 0.00 O ATOM 825 CB THR A 58 3.848 4.180 -12.593 1.00 0.00 C ATOM 826 OG1 THR A 58 2.593 4.824 -12.821 1.00 0.00 O ATOM 827 CG2 THR A 58 3.701 2.720 -13.040 1.00 0.00 C ATOM 0 H THR A 58 2.676 3.525 -10.089 1.00 0.00 H new ATOM 0 HA THR A 58 5.391 4.154 -11.107 1.00 0.00 H new ATOM 0 HB THR A 58 4.640 4.647 -13.179 1.00 0.00 H new ATOM 0 HG1 THR A 58 2.404 4.841 -13.782 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.369 2.689 -14.078 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.662 2.214 -12.951 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.967 2.218 -12.409 1.00 0.00 H new ATOM 835 N ASP A 59 4.969 6.663 -10.755 1.00 0.00 N ATOM 836 CA ASP A 59 4.736 8.083 -10.441 1.00 0.00 C ATOM 837 C ASP A 59 4.061 8.795 -11.622 1.00 0.00 C ATOM 838 O ASP A 59 4.698 9.090 -12.630 1.00 0.00 O ATOM 839 CB ASP A 59 6.054 8.767 -10.087 1.00 0.00 C ATOM 840 CG ASP A 59 5.844 10.206 -9.622 1.00 0.00 C ATOM 841 OD1 ASP A 59 5.718 11.082 -10.502 1.00 0.00 O ATOM 842 OD2 ASP A 59 5.881 10.426 -8.399 1.00 0.00 O ATOM 0 H ASP A 59 5.920 6.445 -11.051 1.00 0.00 H new ATOM 0 HA ASP A 59 4.069 8.143 -9.581 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.556 8.202 -9.302 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.712 8.759 -10.956 1.00 0.00 H new ATOM 847 N ASN A 60 2.813 9.172 -11.381 1.00 0.00 N ATOM 848 CA ASN A 60 2.035 9.984 -12.338 1.00 0.00 C ATOM 849 C ASN A 60 1.918 11.456 -11.905 1.00 0.00 C ATOM 850 O ASN A 60 1.517 12.306 -12.695 1.00 0.00 O ATOM 851 CB ASN A 60 0.650 9.358 -12.548 1.00 0.00 C ATOM 852 CG ASN A 60 -0.163 10.108 -13.610 1.00 0.00 C ATOM 853 OD1 ASN A 60 0.200 10.217 -14.771 1.00 0.00 O ATOM 854 ND2 ASN A 60 -1.266 10.694 -13.200 1.00 0.00 N ATOM 0 H ASN A 60 2.305 8.933 -10.529 1.00 0.00 H new ATOM 0 HA ASN A 60 2.575 9.986 -13.285 1.00 0.00 H new ATOM 0 HB2 ASN A 60 0.764 8.316 -12.848 1.00 0.00 H new ATOM 0 HB3 ASN A 60 0.104 9.360 -11.605 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -1.824 11.244 -13.853 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -1.563 10.599 -12.229 1.00 0.00 H new ATOM 861 N GLN A 61 2.320 11.750 -10.667 1.00 0.00 N ATOM 862 CA GLN A 61 2.219 13.101 -10.096 1.00 0.00 C ATOM 863 C GLN A 61 2.970 14.125 -10.971 1.00 0.00 C ATOM 864 O GLN A 61 2.323 14.918 -11.644 1.00 0.00 O ATOM 865 CB GLN A 61 2.732 13.102 -8.654 1.00 0.00 C ATOM 866 CG GLN A 61 2.364 14.418 -7.963 1.00 0.00 C ATOM 867 CD GLN A 61 3.324 14.698 -6.816 1.00 0.00 C ATOM 868 OE1 GLN A 61 3.065 14.424 -5.649 1.00 0.00 O ATOM 869 NE2 GLN A 61 4.520 15.114 -7.162 1.00 0.00 N ATOM 0 H GLN A 61 2.724 11.063 -10.031 1.00 0.00 H new ATOM 0 HA GLN A 61 1.171 13.400 -10.080 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.302 12.263 -8.107 1.00 0.00 H new ATOM 0 HB3 GLN A 61 3.814 12.968 -8.645 1.00 0.00 H new ATOM 0 HG2 GLN A 61 2.397 15.236 -8.682 1.00 0.00 H new ATOM 0 HG3 GLN A 61 1.342 14.366 -7.587 1.00 0.00 H new ATOM 0 HE21 GLN A 61 4.720 15.338 -8.137 1.00 0.00 H new ATOM 0 HE22 GLN A 61 5.249 15.213 -6.456 1.00 0.00 H new ATOM 878 N ARG A 62 4.300 14.005 -11.010 1.00 0.00 N ATOM 879 CA ARG A 62 5.201 14.911 -11.766 1.00 0.00 C ATOM 880 C ARG A 62 6.635 14.379 -11.921 1.00 0.00 C ATOM 881 O ARG A 62 7.610 15.086 -11.680 1.00 0.00 O ATOM 882 CB ARG A 62 5.209 16.302 -11.117 1.00 0.00 C ATOM 883 CG ARG A 62 4.300 17.248 -11.895 1.00 0.00 C ATOM 884 CD ARG A 62 3.530 18.133 -10.921 1.00 0.00 C ATOM 885 NE ARG A 62 4.042 19.509 -10.975 1.00 0.00 N ATOM 886 CZ ARG A 62 3.704 20.494 -10.138 1.00 0.00 C ATOM 887 NH1 ARG A 62 2.917 20.274 -9.091 1.00 0.00 N ATOM 888 NH2 ARG A 62 4.185 21.710 -10.318 1.00 0.00 N ATOM 0 H ARG A 62 4.799 13.267 -10.513 1.00 0.00 H new ATOM 0 HA ARG A 62 4.798 14.972 -12.777 1.00 0.00 H new ATOM 0 HB2 ARG A 62 4.873 16.231 -10.082 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.225 16.696 -11.096 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.893 17.864 -12.571 1.00 0.00 H new ATOM 0 HG3 ARG A 62 3.605 16.677 -12.511 1.00 0.00 H new ATOM 0 HD2 ARG A 62 2.469 18.122 -11.169 1.00 0.00 H new ATOM 0 HD3 ARG A 62 3.625 17.741 -9.908 1.00 0.00 H new ATOM 0 HE ARG A 62 4.711 19.731 -11.713 1.00 0.00 H new ATOM 0 HH11 ARG A 62 2.557 19.337 -8.912 1.00 0.00 H new ATOM 0 HH12 ARG A 62 2.673 21.042 -8.466 1.00 0.00 H new ATOM 0 HH21 ARG A 62 4.816 21.899 -11.097 1.00 0.00 H new ATOM 0 HH22 ARG A 62 3.926 22.461 -9.678 1.00 0.00 H new ATOM 902 N LYS A 63 6.731 13.087 -12.241 1.00 0.00 N ATOM 903 CA LYS A 63 8.000 12.341 -12.404 1.00 0.00 C ATOM 904 C LYS A 63 8.966 12.547 -11.221 1.00 0.00 C ATOM 905 O LYS A 63 9.766 13.478 -11.171 1.00 0.00 O ATOM 906 CB LYS A 63 8.686 12.635 -13.749 1.00 0.00 C ATOM 907 CG LYS A 63 7.922 12.065 -14.950 1.00 0.00 C ATOM 908 CD LYS A 63 6.792 12.977 -15.438 1.00 0.00 C ATOM 909 CE LYS A 63 5.876 12.220 -16.401 1.00 0.00 C ATOM 910 NZ LYS A 63 5.768 12.901 -17.699 1.00 0.00 N ATOM 0 H LYS A 63 5.909 12.505 -12.401 1.00 0.00 H new ATOM 0 HA LYS A 63 7.725 11.286 -12.408 1.00 0.00 H new ATOM 0 HB2 LYS A 63 8.789 13.713 -13.870 1.00 0.00 H new ATOM 0 HB3 LYS A 63 9.693 12.218 -13.735 1.00 0.00 H new ATOM 0 HG2 LYS A 63 8.621 11.895 -15.769 1.00 0.00 H new ATOM 0 HG3 LYS A 63 7.505 11.095 -14.679 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.216 13.340 -14.587 1.00 0.00 H new ATOM 0 HD3 LYS A 63 7.211 13.852 -15.936 1.00 0.00 H new ATOM 0 HE2 LYS A 63 6.260 11.211 -16.551 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.885 12.122 -15.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.139 12.358 -18.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.378 13.855 -17.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.710 12.972 -18.133 1.00 0.00 H new ATOM 924 N LEU A 64 8.761 11.710 -10.212 1.00 0.00 N ATOM 925 CA LEU A 64 9.520 11.781 -8.949 1.00 0.00 C ATOM 926 C LEU A 64 9.924 10.374 -8.480 1.00 0.00 C ATOM 927 O LEU A 64 11.100 10.021 -8.477 1.00 0.00 O ATOM 928 CB LEU A 64 8.687 12.564 -7.919 1.00 0.00 C ATOM 929 CG LEU A 64 9.537 13.217 -6.822 1.00 0.00 C ATOM 930 CD1 LEU A 64 8.780 14.418 -6.253 1.00 0.00 C ATOM 931 CD2 LEU A 64 9.847 12.241 -5.683 1.00 0.00 C ATOM 0 H LEU A 64 8.068 10.962 -10.236 1.00 0.00 H new ATOM 0 HA LEU A 64 10.458 12.319 -9.089 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.116 13.336 -8.435 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.966 11.890 -7.457 1.00 0.00 H new ATOM 0 HG LEU A 64 10.482 13.527 -7.269 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.378 14.888 -5.472 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.591 15.139 -7.048 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.831 14.084 -5.832 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.451 12.744 -4.927 1.00 0.00 H new ATOM 0 HD22 LEU A 64 8.915 11.898 -5.234 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.396 11.386 -6.076 1.00 0.00 H new ATOM 943 N PHE A 65 8.927 9.605 -8.051 1.00 0.00 N ATOM 944 CA PHE A 65 9.096 8.190 -7.678 1.00 0.00 C ATOM 945 C PHE A 65 9.342 7.289 -8.903 1.00 0.00 C ATOM 946 O PHE A 65 8.729 7.452 -9.958 1.00 0.00 O ATOM 947 CB PHE A 65 7.847 7.783 -6.881 1.00 0.00 C ATOM 948 CG PHE A 65 7.671 6.279 -6.667 1.00 0.00 C ATOM 949 CD1 PHE A 65 8.674 5.489 -6.112 1.00 0.00 C ATOM 950 CD2 PHE A 65 6.530 5.683 -7.183 1.00 0.00 C ATOM 951 CE1 PHE A 65 8.532 4.109 -6.089 1.00 0.00 C ATOM 952 CE2 PHE A 65 6.375 4.309 -7.141 1.00 0.00 C ATOM 953 CZ PHE A 65 7.383 3.513 -6.599 1.00 0.00 C ATOM 0 H PHE A 65 7.970 9.942 -7.949 1.00 0.00 H new ATOM 0 HA PHE A 65 9.987 8.061 -7.063 1.00 0.00 H new ATOM 0 HB2 PHE A 65 7.883 8.270 -5.907 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.966 8.166 -7.397 1.00 0.00 H new ATOM 0 HD1 PHE A 65 9.560 5.949 -5.700 1.00 0.00 H new ATOM 0 HD2 PHE A 65 5.756 6.296 -7.621 1.00 0.00 H new ATOM 0 HE1 PHE A 65 9.317 3.495 -5.673 1.00 0.00 H new ATOM 0 HE2 PHE A 65 5.475 3.854 -7.527 1.00 0.00 H new ATOM 0 HZ PHE A 65 7.272 2.439 -6.575 1.00 0.00 H new ATOM 963 N PHE A 66 10.200 6.298 -8.688 1.00 0.00 N ATOM 964 CA PHE A 66 10.497 5.247 -9.681 1.00 0.00 C ATOM 965 C PHE A 66 9.304 4.301 -9.891 1.00 0.00 C ATOM 966 O PHE A 66 8.260 4.440 -9.264 1.00 0.00 O ATOM 967 CB PHE A 66 11.736 4.460 -9.240 1.00 0.00 C ATOM 968 CG PHE A 66 13.013 5.218 -9.586 1.00 0.00 C ATOM 969 CD1 PHE A 66 13.590 5.054 -10.844 1.00 0.00 C ATOM 970 CD2 PHE A 66 13.618 6.049 -8.650 1.00 0.00 C ATOM 971 CE1 PHE A 66 14.765 5.712 -11.160 1.00 0.00 C ATOM 972 CE2 PHE A 66 14.794 6.708 -8.967 1.00 0.00 C ATOM 973 CZ PHE A 66 15.375 6.541 -10.222 1.00 0.00 C ATOM 0 H PHE A 66 10.718 6.192 -7.816 1.00 0.00 H new ATOM 0 HA PHE A 66 10.693 5.731 -10.638 1.00 0.00 H new ATOM 0 HB2 PHE A 66 11.695 4.281 -8.166 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.744 3.484 -9.726 1.00 0.00 H new ATOM 0 HD1 PHE A 66 13.119 4.412 -11.574 1.00 0.00 H new ATOM 0 HD2 PHE A 66 13.171 6.181 -7.676 1.00 0.00 H new ATOM 0 HE1 PHE A 66 15.210 5.583 -12.136 1.00 0.00 H new ATOM 0 HE2 PHE A 66 15.262 7.354 -8.239 1.00 0.00 H new ATOM 0 HZ PHE A 66 16.294 7.052 -10.466 1.00 0.00 H new ATOM 983 N ARG A 67 9.462 3.359 -10.810 1.00 0.00 N ATOM 984 CA ARG A 67 8.423 2.346 -11.046 1.00 0.00 C ATOM 985 C ARG A 67 8.914 0.986 -10.538 1.00 0.00 C ATOM 986 O ARG A 67 9.989 0.513 -10.907 1.00 0.00 O ATOM 987 CB ARG A 67 8.060 2.279 -12.531 1.00 0.00 C ATOM 988 CG ARG A 67 6.887 1.317 -12.714 1.00 0.00 C ATOM 989 CD ARG A 67 7.171 0.249 -13.763 1.00 0.00 C ATOM 990 NE ARG A 67 6.902 0.775 -15.109 1.00 0.00 N ATOM 991 CZ ARG A 67 6.847 0.045 -16.227 1.00 0.00 C ATOM 992 NH1 ARG A 67 7.066 -1.263 -16.206 1.00 0.00 N ATOM 993 NH2 ARG A 67 6.575 0.619 -17.383 1.00 0.00 N ATOM 0 H ARG A 67 10.287 3.268 -11.403 1.00 0.00 H new ATOM 0 HA ARG A 67 7.521 2.622 -10.500 1.00 0.00 H new ATOM 0 HB2 ARG A 67 7.795 3.270 -12.899 1.00 0.00 H new ATOM 0 HB3 ARG A 67 8.918 1.942 -13.113 1.00 0.00 H new ATOM 0 HG2 ARG A 67 6.662 0.837 -11.762 1.00 0.00 H new ATOM 0 HG3 ARG A 67 6.000 1.880 -13.004 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.210 -0.074 -13.692 1.00 0.00 H new ATOM 0 HD3 ARG A 67 6.551 -0.628 -13.577 1.00 0.00 H new ATOM 0 HE ARG A 67 6.744 1.779 -15.197 1.00 0.00 H new ATOM 0 HH11 ARG A 67 7.281 -1.730 -15.325 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.019 -1.802 -17.071 1.00 0.00 H new ATOM 0 HH21 ARG A 67 6.406 1.624 -17.426 1.00 0.00 H new ATOM 0 HH22 ARG A 67 6.534 0.058 -18.234 1.00 0.00 H new ATOM 1007 N ARG A 68 8.105 0.426 -9.651 1.00 0.00 N ATOM 1008 CA ARG A 68 8.357 -0.909 -9.074 1.00 0.00 C ATOM 1009 C ARG A 68 7.201 -1.891 -9.295 1.00 0.00 C ATOM 1010 O ARG A 68 6.061 -1.478 -9.499 1.00 0.00 O ATOM 1011 CB ARG A 68 8.691 -0.794 -7.587 1.00 0.00 C ATOM 1012 CG ARG A 68 10.062 -0.141 -7.426 1.00 0.00 C ATOM 1013 CD ARG A 68 10.776 -0.706 -6.206 1.00 0.00 C ATOM 1014 NE ARG A 68 12.171 -0.981 -6.571 1.00 0.00 N ATOM 1015 CZ ARG A 68 13.120 -1.438 -5.750 1.00 0.00 C ATOM 1016 NH1 ARG A 68 12.866 -1.726 -4.480 1.00 0.00 N ATOM 1017 NH2 ARG A 68 14.343 -1.637 -6.208 1.00 0.00 N ATOM 0 H ARG A 68 7.256 0.873 -9.305 1.00 0.00 H new ATOM 0 HA ARG A 68 9.215 -1.321 -9.606 1.00 0.00 H new ATOM 0 HB2 ARG A 68 7.931 -0.202 -7.077 1.00 0.00 H new ATOM 0 HB3 ARG A 68 8.689 -1.781 -7.125 1.00 0.00 H new ATOM 0 HG2 ARG A 68 10.662 -0.314 -8.319 1.00 0.00 H new ATOM 0 HG3 ARG A 68 9.949 0.938 -7.322 1.00 0.00 H new ATOM 0 HD2 ARG A 68 10.733 0.003 -5.379 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.285 -1.619 -5.869 1.00 0.00 H new ATOM 0 HE ARG A 68 12.440 -0.807 -7.539 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.925 -1.600 -4.107 1.00 0.00 H new ATOM 0 HH12 ARG A 68 13.612 -2.074 -3.877 1.00 0.00 H new ATOM 0 HH21 ARG A 68 14.560 -1.442 -7.185 1.00 0.00 H new ATOM 0 HH22 ARG A 68 15.071 -1.986 -5.584 1.00 0.00 H new ATOM 1031 N HIS A 69 7.558 -3.173 -9.267 1.00 0.00 N ATOM 1032 CA HIS A 69 6.611 -4.291 -9.452 1.00 0.00 C ATOM 1033 C HIS A 69 6.789 -5.337 -8.340 1.00 0.00 C ATOM 1034 O HIS A 69 7.892 -5.813 -8.086 1.00 0.00 O ATOM 1035 CB HIS A 69 6.703 -4.910 -10.853 1.00 0.00 C ATOM 1036 CG HIS A 69 8.109 -5.434 -11.248 1.00 0.00 C ATOM 1037 ND1 HIS A 69 9.016 -4.749 -11.911 1.00 0.00 N ATOM 1038 CD2 HIS A 69 8.602 -6.621 -10.942 1.00 0.00 C ATOM 1039 CE1 HIS A 69 10.115 -5.522 -12.007 1.00 0.00 C ATOM 1040 NE2 HIS A 69 9.853 -6.669 -11.407 1.00 0.00 N ATOM 0 H HIS A 69 8.520 -3.477 -9.114 1.00 0.00 H new ATOM 0 HA HIS A 69 5.602 -3.887 -9.373 1.00 0.00 H new ATOM 0 HB2 HIS A 69 5.993 -5.735 -10.916 1.00 0.00 H new ATOM 0 HB3 HIS A 69 6.391 -4.164 -11.584 1.00 0.00 H new ATOM 0 HD2 HIS A 69 8.087 -7.409 -10.412 1.00 0.00 H new ATOM 0 HE1 HIS A 69 11.044 -5.252 -12.488 1.00 0.00 H new ATOM 0 HE2 HIS A 69 10.495 -7.456 -11.315 1.00 0.00 H new ATOM 1048 N TYR A 70 5.722 -5.496 -7.576 1.00 0.00 N ATOM 1049 CA TYR A 70 5.633 -6.415 -6.430 1.00 0.00 C ATOM 1050 C TYR A 70 4.567 -7.491 -6.700 1.00 0.00 C ATOM 1051 O TYR A 70 3.384 -7.164 -6.778 1.00 0.00 O ATOM 1052 CB TYR A 70 5.285 -5.635 -5.158 1.00 0.00 C ATOM 1053 CG TYR A 70 6.330 -4.558 -4.877 1.00 0.00 C ATOM 1054 CD1 TYR A 70 7.506 -4.890 -4.218 1.00 0.00 C ATOM 1055 CD2 TYR A 70 6.078 -3.240 -5.243 1.00 0.00 C ATOM 1056 CE1 TYR A 70 8.422 -3.901 -3.903 1.00 0.00 C ATOM 1057 CE2 TYR A 70 6.991 -2.249 -4.925 1.00 0.00 C ATOM 1058 CZ TYR A 70 8.163 -2.580 -4.252 1.00 0.00 C ATOM 1059 OH TYR A 70 8.957 -1.591 -3.776 1.00 0.00 O ATOM 0 H TYR A 70 4.859 -4.976 -7.733 1.00 0.00 H new ATOM 0 HA TYR A 70 6.598 -6.902 -6.291 1.00 0.00 H new ATOM 0 HB2 TYR A 70 4.303 -5.175 -5.266 1.00 0.00 H new ATOM 0 HB3 TYR A 70 5.225 -6.319 -4.312 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.706 -5.917 -3.952 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.172 -2.990 -5.774 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.336 -4.155 -3.387 1.00 0.00 H new ATOM 0 HE2 TYR A 70 6.794 -1.223 -5.198 1.00 0.00 H new ATOM 0 HH TYR A 70 8.642 -0.727 -4.114 1.00 0.00 H new ATOM 1069 N PRO A 71 4.982 -8.704 -7.072 1.00 0.00 N ATOM 1070 CA PRO A 71 4.028 -9.802 -7.327 1.00 0.00 C ATOM 1071 C PRO A 71 3.337 -10.260 -6.028 1.00 0.00 C ATOM 1072 O PRO A 71 3.758 -9.896 -4.931 1.00 0.00 O ATOM 1073 CB PRO A 71 4.844 -10.856 -8.081 1.00 0.00 C ATOM 1074 CG PRO A 71 6.313 -10.576 -7.742 1.00 0.00 C ATOM 1075 CD PRO A 71 6.377 -9.106 -7.331 1.00 0.00 C ATOM 0 HA PRO A 71 3.172 -9.519 -7.940 1.00 0.00 H new ATOM 0 HB2 PRO A 71 4.558 -11.863 -7.776 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.672 -10.788 -9.155 1.00 0.00 H new ATOM 0 HG2 PRO A 71 6.657 -11.222 -6.935 1.00 0.00 H new ATOM 0 HG3 PRO A 71 6.955 -10.769 -8.601 1.00 0.00 H new ATOM 0 HD2 PRO A 71 6.994 -8.974 -6.442 1.00 0.00 H new ATOM 0 HD3 PRO A 71 6.820 -8.498 -8.120 1.00 0.00 H new ATOM 1083 N LEU A 72 2.185 -10.919 -6.153 1.00 0.00 N ATOM 1084 CA LEU A 72 1.360 -11.321 -4.983 1.00 0.00 C ATOM 1085 C LEU A 72 2.106 -12.109 -3.892 1.00 0.00 C ATOM 1086 O LEU A 72 1.918 -11.861 -2.705 1.00 0.00 O ATOM 1087 CB LEU A 72 0.150 -12.129 -5.451 1.00 0.00 C ATOM 1088 CG LEU A 72 -1.193 -11.542 -5.004 1.00 0.00 C ATOM 1089 CD1 LEU A 72 -1.463 -10.163 -5.616 1.00 0.00 C ATOM 1090 CD2 LEU A 72 -2.308 -12.507 -5.398 1.00 0.00 C ATOM 0 H LEU A 72 1.789 -11.193 -7.052 1.00 0.00 H new ATOM 0 HA LEU A 72 1.058 -10.384 -4.516 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.165 -12.192 -6.539 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.236 -13.147 -5.072 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.159 -11.410 -3.923 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.427 -9.792 -5.267 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.677 -9.471 -5.314 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.477 -10.244 -6.703 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.269 -12.100 -5.085 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.306 -12.643 -6.480 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -2.146 -13.469 -4.911 1.00 0.00 H new ATOM 1102 N ASN A 73 2.996 -13.001 -4.327 1.00 0.00 N ATOM 1103 CA ASN A 73 4.014 -13.685 -3.487 1.00 0.00 C ATOM 1104 C ASN A 73 4.703 -12.764 -2.456 1.00 0.00 C ATOM 1105 O ASN A 73 4.852 -13.111 -1.286 1.00 0.00 O ATOM 1106 CB ASN A 73 5.075 -14.340 -4.399 1.00 0.00 C ATOM 1107 CG ASN A 73 5.729 -13.384 -5.412 1.00 0.00 C ATOM 1108 OD1 ASN A 73 5.489 -12.191 -5.433 1.00 0.00 O ATOM 1109 ND2 ASN A 73 6.497 -13.879 -6.352 1.00 0.00 N ATOM 0 H ASN A 73 3.040 -13.286 -5.305 1.00 0.00 H new ATOM 0 HA ASN A 73 3.481 -14.438 -2.906 1.00 0.00 H new ATOM 0 HB2 ASN A 73 5.855 -14.774 -3.773 1.00 0.00 H new ATOM 0 HB3 ASN A 73 4.610 -15.162 -4.943 1.00 0.00 H new ATOM 0 HD21 ASN A 73 6.876 -13.268 -7.075 1.00 0.00 H new ATOM 0 HD22 ASN A 73 6.715 -14.875 -6.360 1.00 0.00 H new ATOM 1116 N THR A 74 4.920 -11.520 -2.881 1.00 0.00 N ATOM 1117 CA THR A 74 5.523 -10.421 -2.109 1.00 0.00 C ATOM 1118 C THR A 74 4.415 -9.491 -1.575 1.00 0.00 C ATOM 1119 O THR A 74 4.508 -8.275 -1.686 1.00 0.00 O ATOM 1120 CB THR A 74 6.562 -9.632 -2.948 1.00 0.00 C ATOM 1121 OG1 THR A 74 5.945 -8.809 -3.942 1.00 0.00 O ATOM 1122 CG2 THR A 74 7.581 -10.532 -3.654 1.00 0.00 C ATOM 0 H THR A 74 4.667 -11.230 -3.826 1.00 0.00 H new ATOM 0 HA THR A 74 6.062 -10.850 -1.264 1.00 0.00 H new ATOM 0 HB THR A 74 7.081 -9.012 -2.216 1.00 0.00 H new ATOM 0 HG1 THR A 74 5.032 -9.124 -4.107 1.00 0.00 H new ATOM 0 HG21 THR A 74 8.278 -9.916 -4.223 1.00 0.00 H new ATOM 0 HG22 THR A 74 8.131 -11.111 -2.912 1.00 0.00 H new ATOM 0 HG23 THR A 74 7.061 -11.210 -4.330 1.00 0.00 H new ATOM 1130 N VAL A 75 3.348 -10.072 -1.031 1.00 0.00 N ATOM 1131 CA VAL A 75 2.156 -9.358 -0.503 1.00 0.00 C ATOM 1132 C VAL A 75 1.431 -10.341 0.437 1.00 0.00 C ATOM 1133 O VAL A 75 0.470 -11.021 0.088 1.00 0.00 O ATOM 1134 CB VAL A 75 1.172 -8.844 -1.594 1.00 0.00 C ATOM 1135 CG1 VAL A 75 -0.036 -8.131 -0.975 1.00 0.00 C ATOM 1136 CG2 VAL A 75 1.760 -7.846 -2.597 1.00 0.00 C ATOM 0 H VAL A 75 3.273 -11.085 -0.936 1.00 0.00 H new ATOM 0 HA VAL A 75 2.499 -8.458 0.007 1.00 0.00 H new ATOM 0 HB VAL A 75 0.906 -9.761 -2.119 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.700 -7.786 -1.767 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.573 -8.822 -0.326 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.306 -7.277 -0.391 1.00 0.00 H new ATOM 0 HG21 VAL A 75 0.991 -7.553 -3.312 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.117 -6.964 -2.066 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.591 -8.311 -3.128 1.00 0.00 H new ATOM 1146 N THR A 76 1.928 -10.370 1.663 1.00 0.00 N ATOM 1147 CA THR A 76 1.382 -11.206 2.750 1.00 0.00 C ATOM 1148 C THR A 76 0.024 -10.682 3.235 1.00 0.00 C ATOM 1149 O THR A 76 -0.970 -11.401 3.281 1.00 0.00 O ATOM 1150 CB THR A 76 2.367 -11.249 3.923 1.00 0.00 C ATOM 1151 OG1 THR A 76 2.780 -9.924 4.295 1.00 0.00 O ATOM 1152 CG2 THR A 76 3.572 -12.127 3.597 1.00 0.00 C ATOM 0 H THR A 76 2.732 -9.811 1.947 1.00 0.00 H new ATOM 0 HA THR A 76 1.236 -12.212 2.356 1.00 0.00 H new ATOM 0 HB THR A 76 1.853 -11.693 4.776 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.458 -9.979 5.000 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.254 -12.139 4.447 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.236 -13.142 3.387 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.088 -11.727 2.724 1.00 0.00 H new ATOM 1160 N PHE A 77 0.024 -9.400 3.580 1.00 0.00 N ATOM 1161 CA PHE A 77 -1.163 -8.699 4.087 1.00 0.00 C ATOM 1162 C PHE A 77 -1.320 -7.394 3.317 1.00 0.00 C ATOM 1163 O PHE A 77 -0.349 -6.655 3.201 1.00 0.00 O ATOM 1164 CB PHE A 77 -0.947 -8.367 5.561 1.00 0.00 C ATOM 1165 CG PHE A 77 -2.209 -8.673 6.351 1.00 0.00 C ATOM 1166 CD1 PHE A 77 -3.282 -7.791 6.358 1.00 0.00 C ATOM 1167 CD2 PHE A 77 -2.247 -9.830 7.119 1.00 0.00 C ATOM 1168 CE1 PHE A 77 -4.386 -8.058 7.148 1.00 0.00 C ATOM 1169 CE2 PHE A 77 -3.354 -10.099 7.903 1.00 0.00 C ATOM 1170 CZ PHE A 77 -4.425 -9.214 7.924 1.00 0.00 C ATOM 0 H PHE A 77 0.852 -8.807 3.517 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.048 -9.323 3.967 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.112 -8.946 5.955 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.685 -7.315 5.671 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.255 -6.900 5.749 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.414 -10.518 7.104 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -5.218 -7.370 7.163 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -3.386 -10.998 8.500 1.00 0.00 H new ATOM 0 HZ PHE A 77 -5.286 -9.422 8.541 1.00 0.00 H new ATOM 1180 N CYS A 78 -2.518 -7.180 2.795 1.00 0.00 N ATOM 1181 CA CYS A 78 -2.880 -5.960 2.049 1.00 0.00 C ATOM 1182 C CYS A 78 -4.203 -5.366 2.554 1.00 0.00 C ATOM 1183 O CYS A 78 -5.269 -5.505 1.958 1.00 0.00 O ATOM 1184 CB CYS A 78 -2.886 -6.292 0.552 1.00 0.00 C ATOM 1185 SG CYS A 78 -3.788 -7.830 0.123 1.00 0.00 S ATOM 0 H CYS A 78 -3.283 -7.850 2.872 1.00 0.00 H new ATOM 0 HA CYS A 78 -2.141 -5.177 2.218 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -3.333 -5.459 0.009 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -1.856 -6.381 0.207 1.00 0.00 H new ATOM 0 HG CYS A 78 -3.736 -8.019 -1.162 1.00 0.00 H new ATOM 1191 N ASP A 79 -4.095 -4.753 3.728 1.00 0.00 N ATOM 1192 CA ASP A 79 -5.252 -4.162 4.423 1.00 0.00 C ATOM 1193 C ASP A 79 -4.907 -2.747 4.906 1.00 0.00 C ATOM 1194 O ASP A 79 -3.752 -2.322 4.914 1.00 0.00 O ATOM 1195 CB ASP A 79 -5.697 -5.061 5.587 1.00 0.00 C ATOM 1196 CG ASP A 79 -7.163 -4.844 5.987 1.00 0.00 C ATOM 1197 OD1 ASP A 79 -7.415 -3.892 6.758 1.00 0.00 O ATOM 1198 OD2 ASP A 79 -8.017 -5.595 5.474 1.00 0.00 O ATOM 0 H ASP A 79 -3.213 -4.648 4.229 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.087 -4.088 3.727 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.553 -6.105 5.308 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -5.059 -4.871 6.450 1.00 0.00 H new ATOM 1203 N LEU A 80 -5.953 -2.002 5.232 1.00 0.00 N ATOM 1204 CA LEU A 80 -5.807 -0.670 5.833 1.00 0.00 C ATOM 1205 C LEU A 80 -5.215 -0.804 7.240 1.00 0.00 C ATOM 1206 O LEU A 80 -5.075 -1.896 7.791 1.00 0.00 O ATOM 1207 CB LEU A 80 -7.155 0.051 5.920 1.00 0.00 C ATOM 1208 CG LEU A 80 -7.879 0.159 4.580 1.00 0.00 C ATOM 1209 CD1 LEU A 80 -8.997 -0.879 4.508 1.00 0.00 C ATOM 1210 CD2 LEU A 80 -8.468 1.555 4.442 1.00 0.00 C ATOM 0 H LEU A 80 -6.920 -2.293 5.092 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.142 -0.083 5.199 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.795 -0.477 6.627 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -6.997 1.053 6.319 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.173 -0.024 3.770 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -9.509 -0.796 3.549 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -8.573 -1.878 4.608 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -9.708 -0.705 5.316 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -8.986 1.638 3.487 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.172 1.735 5.254 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.668 2.294 4.486 1.00 0.00 H new ATOM 1222 N ASP A 81 -4.814 0.339 7.773 1.00 0.00 N ATOM 1223 CA ASP A 81 -4.378 0.437 9.178 1.00 0.00 C ATOM 1224 C ASP A 81 -5.357 -0.212 10.178 1.00 0.00 C ATOM 1225 O ASP A 81 -6.509 0.218 10.267 1.00 0.00 O ATOM 1226 CB ASP A 81 -4.148 1.892 9.580 1.00 0.00 C ATOM 1227 CG ASP A 81 -5.097 2.909 8.946 1.00 0.00 C ATOM 1228 OD1 ASP A 81 -6.319 2.660 8.980 1.00 0.00 O ATOM 1229 OD2 ASP A 81 -4.550 3.934 8.507 1.00 0.00 O ATOM 0 H ASP A 81 -4.777 1.221 7.261 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.443 -0.121 9.228 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -4.233 1.969 10.664 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.125 2.165 9.320 1.00 0.00 H new ATOM 1234 N PRO A 82 -4.865 -1.145 11.002 1.00 0.00 N ATOM 1235 CA PRO A 82 -5.675 -1.775 12.060 1.00 0.00 C ATOM 1236 C PRO A 82 -6.024 -0.800 13.197 1.00 0.00 C ATOM 1237 O PRO A 82 -7.033 -0.980 13.871 1.00 0.00 O ATOM 1238 CB PRO A 82 -4.857 -2.984 12.514 1.00 0.00 C ATOM 1239 CG PRO A 82 -3.413 -2.559 12.263 1.00 0.00 C ATOM 1240 CD PRO A 82 -3.483 -1.665 11.025 1.00 0.00 C ATOM 0 HA PRO A 82 -6.655 -2.084 11.696 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.030 -3.212 13.566 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -5.116 -3.878 11.947 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.004 -2.021 13.118 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -2.770 -3.422 12.093 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.758 -0.854 11.084 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -3.259 -2.228 10.119 1.00 0.00 H new ATOM 1248 N GLN A 83 -5.241 0.274 13.331 1.00 0.00 N ATOM 1249 CA GLN A 83 -5.534 1.370 14.276 1.00 0.00 C ATOM 1250 C GLN A 83 -6.594 2.380 13.806 1.00 0.00 C ATOM 1251 O GLN A 83 -6.784 3.419 14.437 1.00 0.00 O ATOM 1252 CB GLN A 83 -4.244 2.113 14.632 1.00 0.00 C ATOM 1253 CG GLN A 83 -3.480 1.373 15.730 1.00 0.00 C ATOM 1254 CD GLN A 83 -2.796 2.357 16.680 1.00 0.00 C ATOM 1255 OE1 GLN A 83 -2.108 3.298 16.301 1.00 0.00 O ATOM 1256 NE2 GLN A 83 -2.962 2.124 17.960 1.00 0.00 N ATOM 0 H GLN A 83 -4.387 0.414 12.792 1.00 0.00 H new ATOM 0 HA GLN A 83 -5.965 0.880 15.149 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -3.616 2.208 13.746 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -4.480 3.124 14.964 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -4.166 0.738 16.291 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -2.734 0.718 15.281 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -3.537 1.338 18.265 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -2.517 2.729 18.650 1.00 0.00 H new ATOM 1265 N GLU A 84 -7.300 2.057 12.717 1.00 0.00 N ATOM 1266 CA GLU A 84 -8.307 2.945 12.094 1.00 0.00 C ATOM 1267 C GLU A 84 -7.801 4.381 11.841 1.00 0.00 C ATOM 1268 O GLU A 84 -8.496 5.382 12.011 1.00 0.00 O ATOM 1269 CB GLU A 84 -9.611 2.958 12.900 1.00 0.00 C ATOM 1270 CG GLU A 84 -10.396 1.654 12.764 1.00 0.00 C ATOM 1271 CD GLU A 84 -11.859 1.895 13.138 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -12.503 2.688 12.415 1.00 0.00 O ATOM 1273 OE2 GLU A 84 -12.313 1.258 14.112 1.00 0.00 O ATOM 0 H GLU A 84 -7.193 1.165 12.233 1.00 0.00 H new ATOM 0 HA GLU A 84 -8.505 2.519 11.110 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -9.383 3.133 13.951 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -10.232 3.789 12.566 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -10.328 1.282 11.742 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -9.966 0.890 13.411 1.00 0.00 H new ATOM 1280 N ARG A 85 -6.555 4.423 11.394 1.00 0.00 N ATOM 1281 CA ARG A 85 -5.852 5.670 11.050 1.00 0.00 C ATOM 1282 C ARG A 85 -6.185 6.086 9.608 1.00 0.00 C ATOM 1283 O ARG A 85 -6.876 5.387 8.865 1.00 0.00 O ATOM 1284 CB ARG A 85 -4.345 5.472 11.264 1.00 0.00 C ATOM 1285 CG ARG A 85 -3.946 5.591 12.735 1.00 0.00 C ATOM 1286 CD ARG A 85 -3.139 6.873 12.957 1.00 0.00 C ATOM 1287 NE ARG A 85 -3.062 7.207 14.386 1.00 0.00 N ATOM 1288 CZ ARG A 85 -4.033 7.778 15.112 1.00 0.00 C ATOM 1289 NH1 ARG A 85 -5.191 8.138 14.570 1.00 0.00 N ATOM 1290 NH2 ARG A 85 -3.848 8.008 16.398 1.00 0.00 N ATOM 0 H ARG A 85 -5.988 3.586 11.255 1.00 0.00 H new ATOM 0 HA ARG A 85 -6.183 6.481 11.699 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -4.053 4.491 10.889 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -3.797 6.212 10.681 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -4.837 5.599 13.362 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -3.356 4.724 13.031 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -2.134 6.748 12.555 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -3.601 7.696 12.412 1.00 0.00 H new ATOM 0 HE ARG A 85 -2.191 6.984 14.869 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -5.359 7.982 13.576 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -5.912 8.571 15.148 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -2.965 7.751 16.840 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -4.588 8.443 16.950 1.00 0.00 H new ATOM 1304 N LYS A 86 -5.638 7.228 9.223 1.00 0.00 N ATOM 1305 CA LYS A 86 -5.851 7.844 7.899 1.00 0.00 C ATOM 1306 C LYS A 86 -4.722 8.836 7.627 1.00 0.00 C ATOM 1307 O LYS A 86 -4.166 9.431 8.549 1.00 0.00 O ATOM 1308 CB LYS A 86 -7.228 8.522 7.806 1.00 0.00 C ATOM 1309 CG LYS A 86 -7.538 9.435 8.997 1.00 0.00 C ATOM 1310 CD LYS A 86 -8.980 9.197 9.432 1.00 0.00 C ATOM 1311 CE LYS A 86 -9.114 9.367 10.944 1.00 0.00 C ATOM 1312 NZ LYS A 86 -10.275 8.601 11.411 1.00 0.00 N ATOM 0 H LYS A 86 -5.020 7.772 9.825 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.837 7.065 7.137 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.276 9.107 6.887 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -7.999 7.754 7.736 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.855 9.227 9.821 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.394 10.479 8.720 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.641 9.897 8.921 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -9.293 8.194 9.143 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.209 9.021 11.443 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.233 10.421 11.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -10.373 8.712 12.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -11.134 8.952 10.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -10.142 7.595 11.182 1.00 0.00 H new ATOM 1326 N TRP A 87 -4.306 8.857 6.370 1.00 0.00 N ATOM 1327 CA TRP A 87 -3.229 9.752 5.928 1.00 0.00 C ATOM 1328 C TRP A 87 -3.908 10.947 5.280 1.00 0.00 C ATOM 1329 O TRP A 87 -4.609 10.838 4.282 1.00 0.00 O ATOM 1330 CB TRP A 87 -2.327 9.060 4.912 1.00 0.00 C ATOM 1331 CG TRP A 87 -1.119 9.899 4.494 1.00 0.00 C ATOM 1332 CD1 TRP A 87 -1.143 10.938 3.665 1.00 0.00 C ATOM 1333 CD2 TRP A 87 0.183 9.709 4.884 1.00 0.00 C ATOM 1334 NE1 TRP A 87 0.091 11.424 3.535 1.00 0.00 N ATOM 1335 CE2 TRP A 87 0.933 10.712 4.266 1.00 0.00 C ATOM 1336 CE3 TRP A 87 0.809 8.710 5.606 1.00 0.00 C ATOM 1337 CZ2 TRP A 87 2.315 10.708 4.397 1.00 0.00 C ATOM 1338 CZ3 TRP A 87 2.181 8.743 5.782 1.00 0.00 C ATOM 1339 CH2 TRP A 87 2.935 9.738 5.179 1.00 0.00 C ATOM 0 H TRP A 87 -4.693 8.268 5.633 1.00 0.00 H new ATOM 0 HA TRP A 87 -2.603 10.047 6.770 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -1.976 8.118 5.333 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -2.913 8.815 4.026 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -2.023 11.327 3.175 1.00 0.00 H new ATOM 0 HE1 TRP A 87 0.348 12.225 2.958 1.00 0.00 H new ATOM 0 HE3 TRP A 87 0.228 7.905 6.032 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 2.908 11.457 3.893 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 2.665 7.993 6.390 1.00 0.00 H new ATOM 0 HH2 TRP A 87 4.006 9.760 5.316 1.00 0.00 H new ATOM 1350 N THR A 88 -3.668 12.091 5.890 1.00 0.00 N ATOM 1351 CA THR A 88 -4.313 13.357 5.499 1.00 0.00 C ATOM 1352 C THR A 88 -4.201 13.610 3.986 1.00 0.00 C ATOM 1353 O THR A 88 -5.215 13.824 3.337 1.00 0.00 O ATOM 1354 CB THR A 88 -3.680 14.506 6.286 1.00 0.00 C ATOM 1355 OG1 THR A 88 -3.482 14.094 7.645 1.00 0.00 O ATOM 1356 CG2 THR A 88 -4.612 15.711 6.259 1.00 0.00 C ATOM 0 H THR A 88 -3.021 12.183 6.673 1.00 0.00 H new ATOM 0 HA THR A 88 -5.376 13.292 5.733 1.00 0.00 H new ATOM 0 HB THR A 88 -2.723 14.773 5.838 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.075 14.827 8.153 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.163 16.531 6.819 1.00 0.00 H new ATOM 0 HG22 THR A 88 -4.774 16.023 5.227 1.00 0.00 H new ATOM 0 HG23 THR A 88 -5.567 15.443 6.711 1.00 0.00 H new ATOM 1364 N LYS A 89 -2.983 13.452 3.463 1.00 0.00 N ATOM 1365 CA LYS A 89 -2.566 13.642 2.049 1.00 0.00 C ATOM 1366 C LYS A 89 -2.479 15.114 1.622 1.00 0.00 C ATOM 1367 O LYS A 89 -1.697 15.465 0.743 1.00 0.00 O ATOM 1368 CB LYS A 89 -3.342 12.759 1.046 1.00 0.00 C ATOM 1369 CG LYS A 89 -4.627 13.280 0.387 1.00 0.00 C ATOM 1370 CD LYS A 89 -4.352 14.053 -0.904 1.00 0.00 C ATOM 1371 CE LYS A 89 -5.582 13.981 -1.809 1.00 0.00 C ATOM 1372 NZ LYS A 89 -5.839 15.277 -2.445 1.00 0.00 N ATOM 0 H LYS A 89 -2.197 13.168 4.048 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.540 13.275 2.015 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -2.651 12.498 0.244 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -3.596 11.833 1.561 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -5.286 12.440 0.170 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -5.155 13.926 1.088 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.115 15.092 -0.676 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -3.485 13.633 -1.415 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -5.432 13.219 -2.574 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -6.451 13.679 -1.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -6.678 15.204 -3.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -6.004 15.996 -1.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -5.017 15.551 -3.020 1.00 0.00 H new ATOM 1386 N THR A 90 -3.219 15.935 2.357 1.00 0.00 N ATOM 1387 CA THR A 90 -3.269 17.393 2.126 1.00 0.00 C ATOM 1388 C THR A 90 -2.716 18.196 3.320 1.00 0.00 C ATOM 1389 O THR A 90 -2.600 19.415 3.221 1.00 0.00 O ATOM 1390 CB THR A 90 -4.726 17.775 1.801 1.00 0.00 C ATOM 1391 OG1 THR A 90 -5.261 16.829 0.868 1.00 0.00 O ATOM 1392 CG2 THR A 90 -4.842 19.161 1.160 1.00 0.00 C ATOM 0 H THR A 90 -3.804 15.620 3.131 1.00 0.00 H new ATOM 0 HA THR A 90 -2.624 17.648 1.285 1.00 0.00 H new ATOM 0 HB THR A 90 -5.271 17.779 2.745 1.00 0.00 H new ATOM 0 HG1 THR A 90 -6.189 17.065 0.658 1.00 0.00 H new ATOM 0 HG21 THR A 90 -5.889 19.379 0.952 1.00 0.00 H new ATOM 0 HG22 THR A 90 -4.444 19.912 1.842 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.276 19.180 0.229 1.00 0.00 H new ATOM 1400 N ASP A 91 -2.195 17.499 4.344 1.00 0.00 N ATOM 1401 CA ASP A 91 -1.628 18.084 5.585 1.00 0.00 C ATOM 1402 C ASP A 91 -2.696 18.846 6.392 1.00 0.00 C ATOM 1403 O ASP A 91 -3.207 19.861 5.930 1.00 0.00 O ATOM 1404 CB ASP A 91 -0.455 19.022 5.250 1.00 0.00 C ATOM 1405 CG ASP A 91 0.884 18.576 5.832 1.00 0.00 C ATOM 1406 OD1 ASP A 91 1.398 17.543 5.350 1.00 0.00 O ATOM 1407 OD2 ASP A 91 1.315 19.231 6.804 1.00 0.00 O ATOM 0 H ASP A 91 -2.152 16.480 4.337 1.00 0.00 H new ATOM 0 HA ASP A 91 -1.265 17.260 6.199 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -0.361 19.097 4.167 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -0.685 20.021 5.620 1.00 0.00 H new ATOM 1412 N GLY A 92 -3.090 18.261 7.537 1.00 0.00 N ATOM 1413 CA GLY A 92 -4.179 18.767 8.412 1.00 0.00 C ATOM 1414 C GLY A 92 -5.346 19.434 7.657 1.00 0.00 C ATOM 1415 O GLY A 92 -5.500 20.651 7.713 1.00 0.00 O ATOM 0 H GLY A 92 -2.657 17.408 7.892 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.570 17.937 9.001 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.759 19.486 9.115 1.00 0.00 H new ATOM 1419 N SER A 93 -6.136 18.593 6.984 1.00 0.00 N ATOM 1420 CA SER A 93 -7.213 18.961 6.026 1.00 0.00 C ATOM 1421 C SER A 93 -7.598 17.744 5.179 1.00 0.00 C ATOM 1422 O SER A 93 -6.725 17.147 4.549 1.00 0.00 O ATOM 1423 CB SER A 93 -6.763 20.058 5.043 1.00 0.00 C ATOM 1424 OG SER A 93 -7.686 20.240 3.964 1.00 0.00 O ATOM 0 H SER A 93 -6.047 17.582 7.089 1.00 0.00 H new ATOM 0 HA SER A 93 -8.050 19.321 6.625 1.00 0.00 H new ATOM 0 HB2 SER A 93 -6.648 20.999 5.581 1.00 0.00 H new ATOM 0 HB3 SER A 93 -5.784 19.800 4.640 1.00 0.00 H new ATOM 0 HG SER A 93 -7.358 20.946 3.369 1.00 0.00 H new ATOM 1430 N GLY A 94 -8.877 17.348 5.275 1.00 0.00 N ATOM 1431 CA GLY A 94 -9.463 16.279 4.440 1.00 0.00 C ATOM 1432 C GLY A 94 -8.689 14.952 4.568 1.00 0.00 C ATOM 1433 O GLY A 94 -7.746 14.741 3.809 1.00 0.00 O ATOM 0 H GLY A 94 -9.538 17.759 5.934 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.502 16.122 4.730 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -9.468 16.596 3.397 1.00 0.00 H new ATOM 1437 N PRO A 95 -9.025 14.102 5.548 1.00 0.00 N ATOM 1438 CA PRO A 95 -8.296 12.838 5.758 1.00 0.00 C ATOM 1439 C PRO A 95 -8.551 11.860 4.603 1.00 0.00 C ATOM 1440 O PRO A 95 -9.671 11.733 4.109 1.00 0.00 O ATOM 1441 CB PRO A 95 -8.804 12.331 7.107 1.00 0.00 C ATOM 1442 CG PRO A 95 -10.231 12.869 7.197 1.00 0.00 C ATOM 1443 CD PRO A 95 -10.148 14.230 6.502 1.00 0.00 C ATOM 0 HA PRO A 95 -7.213 12.960 5.771 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -8.785 11.242 7.156 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -8.188 12.698 7.928 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -10.941 12.208 6.700 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.558 12.967 8.232 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -11.079 14.468 5.987 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -9.967 15.030 7.220 1.00 0.00 H new ATOM 1451 N ALA A 96 -7.489 11.173 4.201 1.00 0.00 N ATOM 1452 CA ALA A 96 -7.544 10.193 3.102 1.00 0.00 C ATOM 1453 C ALA A 96 -7.113 8.824 3.622 1.00 0.00 C ATOM 1454 O ALA A 96 -5.972 8.591 4.022 1.00 0.00 O ATOM 1455 CB ALA A 96 -6.670 10.632 1.925 1.00 0.00 C ATOM 0 H ALA A 96 -6.564 11.272 4.620 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.569 10.130 2.737 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.731 9.889 1.130 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.020 11.594 1.551 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.635 10.726 2.255 1.00 0.00 H new ATOM 1461 N LYS A 97 -8.133 7.997 3.832 1.00 0.00 N ATOM 1462 CA LYS A 97 -7.971 6.631 4.358 1.00 0.00 C ATOM 1463 C LYS A 97 -6.765 5.919 3.732 1.00 0.00 C ATOM 1464 O LYS A 97 -6.633 5.838 2.508 1.00 0.00 O ATOM 1465 CB LYS A 97 -9.260 5.851 4.107 1.00 0.00 C ATOM 1466 CG LYS A 97 -9.583 4.988 5.325 1.00 0.00 C ATOM 1467 CD LYS A 97 -11.094 4.777 5.403 1.00 0.00 C ATOM 1468 CE LYS A 97 -11.635 5.174 6.779 1.00 0.00 C ATOM 1469 NZ LYS A 97 -11.411 4.129 7.789 1.00 0.00 N ATOM 0 H LYS A 97 -9.103 8.250 3.643 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.778 6.685 5.429 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -10.081 6.540 3.909 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -9.151 5.223 3.223 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -9.073 4.028 5.251 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -9.224 5.471 6.234 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -11.587 5.367 4.631 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -11.329 3.731 5.204 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -11.156 6.098 7.103 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -12.703 5.379 6.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.794 4.443 8.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -11.890 3.254 7.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -10.391 3.951 7.883 1.00 0.00 H new ATOM 1483 N LEU A 98 -5.813 5.642 4.615 1.00 0.00 N ATOM 1484 CA LEU A 98 -4.554 5.010 4.212 1.00 0.00 C ATOM 1485 C LEU A 98 -4.481 3.574 4.725 1.00 0.00 C ATOM 1486 O LEU A 98 -4.989 3.203 5.786 1.00 0.00 O ATOM 1487 CB LEU A 98 -3.312 5.826 4.611 1.00 0.00 C ATOM 1488 CG LEU A 98 -2.506 5.297 5.803 1.00 0.00 C ATOM 1489 CD1 LEU A 98 -1.015 5.504 5.569 1.00 0.00 C ATOM 1490 CD2 LEU A 98 -2.927 5.998 7.084 1.00 0.00 C ATOM 0 H LEU A 98 -5.884 5.843 5.613 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.549 4.984 3.122 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.649 5.884 3.748 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.630 6.844 4.837 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.705 4.230 5.903 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.456 5.123 6.424 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -0.710 4.969 4.669 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.810 6.568 5.446 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.344 5.610 7.920 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -2.752 7.070 6.987 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.987 5.818 7.266 1.00 0.00 H new ATOM 1502 N PHE A 99 -3.730 2.826 3.949 1.00 0.00 N ATOM 1503 CA PHE A 99 -3.513 1.392 4.150 1.00 0.00 C ATOM 1504 C PHE A 99 -2.021 1.061 4.122 1.00 0.00 C ATOM 1505 O PHE A 99 -1.202 1.851 3.648 1.00 0.00 O ATOM 1506 CB PHE A 99 -4.290 0.622 3.076 1.00 0.00 C ATOM 1507 CG PHE A 99 -3.915 1.025 1.658 1.00 0.00 C ATOM 1508 CD1 PHE A 99 -4.465 2.171 1.094 1.00 0.00 C ATOM 1509 CD2 PHE A 99 -3.077 0.210 0.909 1.00 0.00 C ATOM 1510 CE1 PHE A 99 -4.211 2.494 -0.221 1.00 0.00 C ATOM 1511 CE2 PHE A 99 -2.816 0.535 -0.409 1.00 0.00 C ATOM 1512 CZ PHE A 99 -3.388 1.667 -0.984 1.00 0.00 C ATOM 0 H PHE A 99 -3.236 3.197 3.137 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.881 1.093 5.132 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.110 -0.446 3.203 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.358 0.785 3.223 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -5.096 2.813 1.691 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -2.633 -0.669 1.352 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.646 3.381 -0.657 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.164 -0.094 -0.997 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.194 1.904 -2.020 1.00 0.00 H new ATOM 1522 N GLY A 100 -1.739 -0.104 4.707 1.00 0.00 N ATOM 1523 CA GLY A 100 -0.375 -0.643 4.774 1.00 0.00 C ATOM 1524 C GLY A 100 -0.387 -2.129 4.429 1.00 0.00 C ATOM 1525 O GLY A 100 -1.135 -2.922 5.001 1.00 0.00 O ATOM 0 H GLY A 100 -2.442 -0.699 5.145 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.272 -0.105 4.081 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.035 -0.496 5.773 1.00 0.00 H new ATOM 1529 N PHE A 101 0.477 -2.478 3.494 1.00 0.00 N ATOM 1530 CA PHE A 101 0.640 -3.885 3.118 1.00 0.00 C ATOM 1531 C PHE A 101 2.087 -4.326 3.326 1.00 0.00 C ATOM 1532 O PHE A 101 3.022 -3.574 3.060 1.00 0.00 O ATOM 1533 CB PHE A 101 0.176 -4.148 1.678 1.00 0.00 C ATOM 1534 CG PHE A 101 1.027 -3.478 0.613 1.00 0.00 C ATOM 1535 CD1 PHE A 101 2.284 -3.984 0.296 1.00 0.00 C ATOM 1536 CD2 PHE A 101 0.546 -2.337 -0.012 1.00 0.00 C ATOM 1537 CE1 PHE A 101 3.078 -3.342 -0.630 1.00 0.00 C ATOM 1538 CE2 PHE A 101 1.326 -1.718 -0.967 1.00 0.00 C ATOM 1539 CZ PHE A 101 2.590 -2.207 -1.277 1.00 0.00 C ATOM 0 H PHE A 101 1.071 -1.825 2.984 1.00 0.00 H new ATOM 0 HA PHE A 101 0.002 -4.482 3.769 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.174 -5.223 1.501 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -0.853 -3.805 1.572 1.00 0.00 H new ATOM 0 HD1 PHE A 101 2.639 -4.883 0.777 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.425 -1.939 0.245 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.067 -3.714 -0.852 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.951 -0.844 -1.479 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.195 -1.707 -2.020 1.00 0.00 H new ATOM 1549 N VAL A 102 2.226 -5.595 3.652 1.00 0.00 N ATOM 1550 CA VAL A 102 3.549 -6.218 3.840 1.00 0.00 C ATOM 1551 C VAL A 102 3.896 -7.098 2.635 1.00 0.00 C ATOM 1552 O VAL A 102 3.145 -7.988 2.252 1.00 0.00 O ATOM 1553 CB VAL A 102 3.706 -6.996 5.156 1.00 0.00 C ATOM 1554 CG1 VAL A 102 4.855 -6.355 5.931 1.00 0.00 C ATOM 1555 CG2 VAL A 102 2.457 -7.099 6.045 1.00 0.00 C ATOM 0 H VAL A 102 1.441 -6.231 3.796 1.00 0.00 H new ATOM 0 HA VAL A 102 4.260 -5.395 3.912 1.00 0.00 H new ATOM 0 HB VAL A 102 3.902 -8.032 4.879 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.997 -6.882 6.874 1.00 0.00 H new ATOM 0 HG12 VAL A 102 5.770 -6.415 5.341 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.620 -5.310 6.132 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.695 -7.670 6.942 1.00 0.00 H new ATOM 0 HG22 VAL A 102 2.128 -6.099 6.328 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.660 -7.601 5.496 1.00 0.00 H new ATOM 1565 N ALA A 103 5.076 -6.833 2.092 1.00 0.00 N ATOM 1566 CA ALA A 103 5.579 -7.456 0.856 1.00 0.00 C ATOM 1567 C ALA A 103 6.707 -8.468 1.117 1.00 0.00 C ATOM 1568 O ALA A 103 7.798 -8.074 1.530 1.00 0.00 O ATOM 1569 CB ALA A 103 6.057 -6.326 -0.065 1.00 0.00 C ATOM 0 H ALA A 103 5.731 -6.166 2.500 1.00 0.00 H new ATOM 0 HA ALA A 103 4.777 -8.028 0.390 1.00 0.00 H new ATOM 0 HB1 ALA A 103 6.438 -6.750 -0.994 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.223 -5.659 -0.286 1.00 0.00 H new ATOM 0 HB3 ALA A 103 6.850 -5.765 0.429 1.00 0.00 H new ATOM 1575 N ARG A 104 6.347 -9.758 1.114 1.00 0.00 N ATOM 1576 CA ARG A 104 7.319 -10.849 1.354 1.00 0.00 C ATOM 1577 C ARG A 104 8.043 -11.266 0.068 1.00 0.00 C ATOM 1578 O ARG A 104 7.578 -12.099 -0.708 1.00 0.00 O ATOM 1579 CB ARG A 104 6.661 -12.052 2.045 1.00 0.00 C ATOM 1580 CG ARG A 104 7.666 -13.115 2.508 1.00 0.00 C ATOM 1581 CD ARG A 104 7.723 -14.314 1.560 1.00 0.00 C ATOM 1582 NE ARG A 104 6.970 -15.440 2.132 1.00 0.00 N ATOM 1583 CZ ARG A 104 6.884 -16.673 1.619 1.00 0.00 C ATOM 1584 NH1 ARG A 104 7.389 -16.967 0.428 1.00 0.00 N ATOM 1585 NH2 ARG A 104 6.243 -17.621 2.279 1.00 0.00 N ATOM 0 H ARG A 104 5.393 -10.078 0.949 1.00 0.00 H new ATOM 0 HA ARG A 104 8.075 -10.456 2.033 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.093 -11.701 2.906 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.949 -12.511 1.359 1.00 0.00 H new ATOM 0 HG2 ARG A 104 8.657 -12.667 2.583 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.395 -13.457 3.507 1.00 0.00 H new ATOM 0 HD2 ARG A 104 7.307 -14.042 0.590 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.759 -14.606 1.391 1.00 0.00 H new ATOM 0 HE ARG A 104 6.466 -15.265 3.001 1.00 0.00 H new ATOM 0 HH11 ARG A 104 7.857 -16.245 -0.120 1.00 0.00 H new ATOM 0 HH12 ARG A 104 7.310 -17.915 0.060 1.00 0.00 H new ATOM 0 HH21 ARG A 104 5.813 -17.413 3.180 1.00 0.00 H new ATOM 0 HH22 ARG A 104 6.178 -18.560 1.887 1.00 0.00 H new ATOM 1599 N LYS A 105 9.215 -10.675 -0.112 1.00 0.00 N ATOM 1600 CA LYS A 105 10.054 -10.987 -1.279 1.00 0.00 C ATOM 1601 C LYS A 105 10.998 -12.144 -0.930 1.00 0.00 C ATOM 1602 O LYS A 105 12.044 -11.940 -0.314 1.00 0.00 O ATOM 1603 CB LYS A 105 10.815 -9.744 -1.749 1.00 0.00 C ATOM 1604 CG LYS A 105 11.543 -10.068 -3.055 1.00 0.00 C ATOM 1605 CD LYS A 105 13.033 -9.751 -2.964 1.00 0.00 C ATOM 1606 CE LYS A 105 13.330 -8.429 -3.666 1.00 0.00 C ATOM 1607 NZ LYS A 105 14.548 -8.592 -4.466 1.00 0.00 N ATOM 0 H LYS A 105 9.611 -9.982 0.523 1.00 0.00 H new ATOM 0 HA LYS A 105 9.423 -11.301 -2.110 1.00 0.00 H new ATOM 0 HB2 LYS A 105 10.124 -8.914 -1.899 1.00 0.00 H new ATOM 0 HB3 LYS A 105 11.529 -9.430 -0.988 1.00 0.00 H new ATOM 0 HG2 LYS A 105 11.409 -11.123 -3.294 1.00 0.00 H new ATOM 0 HG3 LYS A 105 11.099 -9.497 -3.871 1.00 0.00 H new ATOM 0 HD2 LYS A 105 13.338 -9.694 -1.919 1.00 0.00 H new ATOM 0 HD3 LYS A 105 13.612 -10.553 -3.421 1.00 0.00 H new ATOM 0 HE2 LYS A 105 12.494 -8.142 -4.303 1.00 0.00 H new ATOM 0 HE3 LYS A 105 13.461 -7.632 -2.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 14.766 -7.699 -4.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 15.340 -8.850 -3.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 14.403 -9.343 -5.170 1.00 0.00 H new ATOM 1621 N GLN A 106 10.533 -13.352 -1.250 1.00 0.00 N ATOM 1622 CA GLN A 106 11.255 -14.609 -0.950 1.00 0.00 C ATOM 1623 C GLN A 106 11.516 -14.798 0.557 1.00 0.00 C ATOM 1624 O GLN A 106 11.233 -13.932 1.384 1.00 0.00 O ATOM 1625 CB GLN A 106 12.557 -14.698 -1.767 1.00 0.00 C ATOM 1626 CG GLN A 106 12.353 -15.601 -2.987 1.00 0.00 C ATOM 1627 CD GLN A 106 12.982 -15.067 -4.277 1.00 0.00 C ATOM 1628 OE1 GLN A 106 13.099 -13.873 -4.529 1.00 0.00 O ATOM 1629 NE2 GLN A 106 13.306 -15.960 -5.182 1.00 0.00 N ATOM 0 H GLN A 106 9.643 -13.497 -1.726 1.00 0.00 H new ATOM 0 HA GLN A 106 10.606 -15.432 -1.251 1.00 0.00 H new ATOM 0 HB2 GLN A 106 12.862 -13.702 -2.089 1.00 0.00 H new ATOM 0 HB3 GLN A 106 13.360 -15.092 -1.144 1.00 0.00 H new ATOM 0 HG2 GLN A 106 12.773 -16.584 -2.772 1.00 0.00 H new ATOM 0 HG3 GLN A 106 11.284 -15.739 -3.148 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.210 -16.954 -4.975 1.00 0.00 H new ATOM 0 HE22 GLN A 106 13.654 -15.660 -6.093 1.00 0.00 H new ATOM 1638 N GLY A 107 12.044 -15.979 0.896 1.00 0.00 N ATOM 1639 CA GLY A 107 12.362 -16.322 2.296 1.00 0.00 C ATOM 1640 C GLY A 107 13.859 -16.134 2.561 1.00 0.00 C ATOM 1641 O GLY A 107 14.576 -17.095 2.834 1.00 0.00 O ATOM 0 H GLY A 107 12.262 -16.716 0.225 1.00 0.00 H new ATOM 0 HA2 GLY A 107 11.784 -15.692 2.972 1.00 0.00 H new ATOM 0 HA3 GLY A 107 12.076 -17.354 2.499 1.00 0.00 H new ATOM 1645 N SER A 108 14.337 -14.915 2.333 1.00 0.00 N ATOM 1646 CA SER A 108 15.766 -14.579 2.508 1.00 0.00 C ATOM 1647 C SER A 108 15.928 -13.245 3.224 1.00 0.00 C ATOM 1648 O SER A 108 15.064 -12.378 3.115 1.00 0.00 O ATOM 1649 CB SER A 108 16.510 -14.526 1.173 1.00 0.00 C ATOM 1650 OG SER A 108 16.647 -15.858 0.675 1.00 0.00 O ATOM 0 H SER A 108 13.761 -14.132 2.025 1.00 0.00 H new ATOM 0 HA SER A 108 16.201 -15.374 3.114 1.00 0.00 H new ATOM 0 HB2 SER A 108 15.963 -13.910 0.459 1.00 0.00 H new ATOM 0 HB3 SER A 108 17.491 -14.068 1.304 1.00 0.00 H new ATOM 0 HG SER A 108 17.121 -15.840 -0.182 1.00 0.00 H new ATOM 1656 N THR A 109 16.915 -13.220 4.120 1.00 0.00 N ATOM 1657 CA THR A 109 17.255 -12.026 4.940 1.00 0.00 C ATOM 1658 C THR A 109 16.167 -11.742 5.996 1.00 0.00 C ATOM 1659 O THR A 109 16.252 -10.772 6.746 1.00 0.00 O ATOM 1660 CB THR A 109 17.492 -10.809 4.017 1.00 0.00 C ATOM 1661 OG1 THR A 109 18.386 -11.204 2.970 1.00 0.00 O ATOM 1662 CG2 THR A 109 18.089 -9.580 4.713 1.00 0.00 C ATOM 0 H THR A 109 17.512 -14.025 4.309 1.00 0.00 H new ATOM 0 HA THR A 109 18.176 -12.225 5.487 1.00 0.00 H new ATOM 0 HB THR A 109 16.510 -10.510 3.651 1.00 0.00 H new ATOM 0 HG1 THR A 109 18.547 -10.444 2.373 1.00 0.00 H new ATOM 0 HG21 THR A 109 18.219 -8.778 3.987 1.00 0.00 H new ATOM 0 HG22 THR A 109 17.417 -9.248 5.504 1.00 0.00 H new ATOM 0 HG23 THR A 109 19.056 -9.840 5.144 1.00 0.00 H new ATOM 1670 N THR A 110 15.190 -12.654 6.080 1.00 0.00 N ATOM 1671 CA THR A 110 14.091 -12.673 7.067 1.00 0.00 C ATOM 1672 C THR A 110 13.647 -11.261 7.494 1.00 0.00 C ATOM 1673 O THR A 110 13.911 -10.789 8.600 1.00 0.00 O ATOM 1674 CB THR A 110 14.500 -13.550 8.265 1.00 0.00 C ATOM 1675 OG1 THR A 110 15.812 -13.195 8.714 1.00 0.00 O ATOM 1676 CG2 THR A 110 14.448 -15.039 7.905 1.00 0.00 C ATOM 0 H THR A 110 15.138 -13.440 5.432 1.00 0.00 H new ATOM 0 HA THR A 110 13.212 -13.112 6.595 1.00 0.00 H new ATOM 0 HB THR A 110 13.788 -13.372 9.071 1.00 0.00 H new ATOM 0 HG1 THR A 110 16.060 -13.758 9.477 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.742 -15.633 8.770 1.00 0.00 H new ATOM 0 HG22 THR A 110 13.434 -15.306 7.609 1.00 0.00 H new ATOM 0 HG23 THR A 110 15.131 -15.238 7.079 1.00 0.00 H new ATOM 1684 N ASP A 111 12.955 -10.604 6.567 1.00 0.00 N ATOM 1685 CA ASP A 111 12.533 -9.198 6.722 1.00 0.00 C ATOM 1686 C ASP A 111 11.567 -8.821 5.592 1.00 0.00 C ATOM 1687 O ASP A 111 11.850 -9.019 4.413 1.00 0.00 O ATOM 1688 CB ASP A 111 13.765 -8.281 6.666 1.00 0.00 C ATOM 1689 CG ASP A 111 13.518 -6.947 7.372 1.00 0.00 C ATOM 1690 OD1 ASP A 111 12.834 -6.096 6.763 1.00 0.00 O ATOM 1691 OD2 ASP A 111 13.886 -6.845 8.561 1.00 0.00 O ATOM 0 H ASP A 111 12.666 -11.024 5.683 1.00 0.00 H new ATOM 0 HA ASP A 111 12.032 -9.078 7.683 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.613 -8.785 7.129 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.033 -8.097 5.626 1.00 0.00 H new ATOM 1696 N ASN A 112 10.423 -8.307 6.014 1.00 0.00 N ATOM 1697 CA ASN A 112 9.377 -7.790 5.119 1.00 0.00 C ATOM 1698 C ASN A 112 9.328 -6.265 5.154 1.00 0.00 C ATOM 1699 O ASN A 112 9.696 -5.644 6.150 1.00 0.00 O ATOM 1700 CB ASN A 112 8.027 -8.342 5.570 1.00 0.00 C ATOM 1701 CG ASN A 112 7.550 -9.400 4.585 1.00 0.00 C ATOM 1702 OD1 ASN A 112 8.180 -10.421 4.357 1.00 0.00 O ATOM 1703 ND2 ASN A 112 6.396 -9.177 4.005 1.00 0.00 N ATOM 0 H ASN A 112 10.182 -8.232 7.002 1.00 0.00 H new ATOM 0 HA ASN A 112 9.602 -8.104 4.100 1.00 0.00 H new ATOM 0 HB2 ASN A 112 8.114 -8.773 6.567 1.00 0.00 H new ATOM 0 HB3 ASN A 112 7.297 -7.535 5.634 1.00 0.00 H new ATOM 0 HD21 ASN A 112 6.012 -9.861 3.353 1.00 0.00 H new ATOM 0 HD22 ASN A 112 5.882 -8.319 4.206 1.00 0.00 H new ATOM 1710 N VAL A 113 8.824 -5.695 4.066 1.00 0.00 N ATOM 1711 CA VAL A 113 8.604 -4.244 3.985 1.00 0.00 C ATOM 1712 C VAL A 113 7.096 -3.964 3.866 1.00 0.00 C ATOM 1713 O VAL A 113 6.390 -4.634 3.110 1.00 0.00 O ATOM 1714 CB VAL A 113 9.492 -3.678 2.855 1.00 0.00 C ATOM 1715 CG1 VAL A 113 8.813 -3.388 1.508 1.00 0.00 C ATOM 1716 CG2 VAL A 113 10.280 -2.475 3.372 1.00 0.00 C ATOM 0 H VAL A 113 8.558 -6.209 3.226 1.00 0.00 H new ATOM 0 HA VAL A 113 8.911 -3.718 4.889 1.00 0.00 H new ATOM 0 HB VAL A 113 10.165 -4.496 2.596 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.549 -2.996 0.806 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.387 -4.309 1.110 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.020 -2.653 1.651 1.00 0.00 H new ATOM 0 HG21 VAL A 113 10.905 -2.079 2.572 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.587 -1.703 3.707 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.910 -2.784 4.206 1.00 0.00 H new ATOM 1726 N CYS A 114 6.614 -3.085 4.730 1.00 0.00 N ATOM 1727 CA CYS A 114 5.230 -2.598 4.638 1.00 0.00 C ATOM 1728 C CYS A 114 5.217 -1.206 4.018 1.00 0.00 C ATOM 1729 O CYS A 114 5.895 -0.283 4.464 1.00 0.00 O ATOM 1730 CB CYS A 114 4.520 -2.579 5.985 1.00 0.00 C ATOM 1731 SG CYS A 114 2.764 -2.069 5.963 1.00 0.00 S ATOM 0 H CYS A 114 7.151 -2.690 5.503 1.00 0.00 H new ATOM 0 HA CYS A 114 4.683 -3.296 4.004 1.00 0.00 H new ATOM 0 HB2 CYS A 114 4.582 -3.577 6.419 1.00 0.00 H new ATOM 0 HB3 CYS A 114 5.064 -1.908 6.650 1.00 0.00 H new ATOM 0 HG CYS A 114 2.026 -3.035 6.423 1.00 0.00 H new ATOM 1737 N HIS A 115 4.596 -1.194 2.854 1.00 0.00 N ATOM 1738 CA HIS A 115 4.393 0.038 2.088 1.00 0.00 C ATOM 1739 C HIS A 115 3.049 0.654 2.468 1.00 0.00 C ATOM 1740 O HIS A 115 2.036 -0.032 2.633 1.00 0.00 O ATOM 1741 CB HIS A 115 4.405 -0.278 0.602 1.00 0.00 C ATOM 1742 CG HIS A 115 5.510 0.468 -0.173 1.00 0.00 C ATOM 1743 ND1 HIS A 115 6.366 -0.118 -0.982 1.00 0.00 N ATOM 1744 CD2 HIS A 115 5.705 1.774 -0.206 1.00 0.00 C ATOM 1745 CE1 HIS A 115 7.138 0.844 -1.519 1.00 0.00 C ATOM 1746 NE2 HIS A 115 6.731 2.002 -1.031 1.00 0.00 N ATOM 0 H HIS A 115 4.217 -2.029 2.408 1.00 0.00 H new ATOM 0 HA HIS A 115 5.194 0.742 2.313 1.00 0.00 H new ATOM 0 HB2 HIS A 115 4.538 -1.351 0.467 1.00 0.00 H new ATOM 0 HB3 HIS A 115 3.435 -0.021 0.175 1.00 0.00 H new ATOM 0 HD2 HIS A 115 5.140 2.519 0.334 1.00 0.00 H new ATOM 0 HE1 HIS A 115 7.945 0.696 -2.222 1.00 0.00 H new ATOM 0 HE2 HIS A 115 7.132 2.915 -1.247 1.00 0.00 H new ATOM 1754 N LEU A 116 3.136 1.955 2.661 1.00 0.00 N ATOM 1755 CA LEU A 116 1.973 2.771 3.022 1.00 0.00 C ATOM 1756 C LEU A 116 1.482 3.562 1.819 1.00 0.00 C ATOM 1757 O LEU A 116 2.263 3.967 0.955 1.00 0.00 O ATOM 1758 CB LEU A 116 2.336 3.710 4.176 1.00 0.00 C ATOM 1759 CG LEU A 116 2.377 3.066 5.568 1.00 0.00 C ATOM 1760 CD1 LEU A 116 1.020 2.475 5.907 1.00 0.00 C ATOM 1761 CD2 LEU A 116 3.484 2.023 5.733 1.00 0.00 C ATOM 0 H LEU A 116 4.005 2.482 2.575 1.00 0.00 H new ATOM 0 HA LEU A 116 1.166 2.114 3.345 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.312 4.149 3.970 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.616 4.528 4.195 1.00 0.00 H new ATOM 0 HG LEU A 116 2.618 3.862 6.272 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.058 2.020 6.897 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.267 3.263 5.899 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.759 1.717 5.169 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.450 1.612 6.742 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.339 1.221 5.010 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.454 2.492 5.565 1.00 0.00 H new ATOM 1773 N PHE A 117 0.162 3.670 1.774 1.00 0.00 N ATOM 1774 CA PHE A 117 -0.538 4.387 0.701 1.00 0.00 C ATOM 1775 C PHE A 117 -1.851 4.995 1.192 1.00 0.00 C ATOM 1776 O PHE A 117 -2.621 4.343 1.895 1.00 0.00 O ATOM 1777 CB PHE A 117 -0.829 3.424 -0.452 1.00 0.00 C ATOM 1778 CG PHE A 117 0.415 2.964 -1.200 1.00 0.00 C ATOM 1779 CD1 PHE A 117 0.955 3.827 -2.143 1.00 0.00 C ATOM 1780 CD2 PHE A 117 1.031 1.742 -0.957 1.00 0.00 C ATOM 1781 CE1 PHE A 117 2.085 3.489 -2.844 1.00 0.00 C ATOM 1782 CE2 PHE A 117 2.181 1.410 -1.660 1.00 0.00 C ATOM 1783 CZ PHE A 117 2.719 2.277 -2.597 1.00 0.00 C ATOM 0 H PHE A 117 -0.459 3.266 2.475 1.00 0.00 H new ATOM 0 HA PHE A 117 0.107 5.198 0.364 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -1.349 2.550 -0.060 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -1.506 3.909 -1.156 1.00 0.00 H new ATOM 0 HD1 PHE A 117 0.479 4.779 -2.328 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.619 1.058 -0.229 1.00 0.00 H new ATOM 0 HE1 PHE A 117 2.482 4.164 -3.587 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.663 0.462 -1.474 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.621 2.014 -3.130 1.00 0.00 H new ATOM 1793 N ALA A 118 -2.101 6.217 0.746 1.00 0.00 N ATOM 1794 CA ALA A 118 -3.356 6.938 1.034 1.00 0.00 C ATOM 1795 C ALA A 118 -4.234 6.969 -0.221 1.00 0.00 C ATOM 1796 O ALA A 118 -3.736 6.971 -1.344 1.00 0.00 O ATOM 1797 CB ALA A 118 -3.044 8.368 1.475 1.00 0.00 C ATOM 0 H ALA A 118 -1.445 6.747 0.172 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.887 6.423 1.835 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.975 8.895 1.686 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.428 8.345 2.374 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.507 8.885 0.680 1.00 0.00 H new ATOM 1803 N GLU A 119 -5.545 6.855 -0.038 1.00 0.00 N ATOM 1804 CA GLU A 119 -6.491 6.976 -1.168 1.00 0.00 C ATOM 1805 C GLU A 119 -6.263 8.307 -1.915 1.00 0.00 C ATOM 1806 O GLU A 119 -6.209 9.372 -1.307 1.00 0.00 O ATOM 1807 CB GLU A 119 -7.928 6.910 -0.642 1.00 0.00 C ATOM 1808 CG GLU A 119 -8.957 7.081 -1.769 1.00 0.00 C ATOM 1809 CD GLU A 119 -10.299 7.648 -1.295 1.00 0.00 C ATOM 1810 OE1 GLU A 119 -10.305 8.390 -0.288 1.00 0.00 O ATOM 1811 OE2 GLU A 119 -11.310 7.282 -1.931 1.00 0.00 O ATOM 0 H GLU A 119 -5.984 6.681 0.866 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.323 6.154 -1.863 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.089 5.954 -0.145 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.077 7.688 0.107 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.542 7.741 -2.531 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.128 6.114 -2.243 1.00 0.00 H new ATOM 1818 N LEU A 120 -6.150 8.191 -3.235 1.00 0.00 N ATOM 1819 CA LEU A 120 -6.029 9.372 -4.113 1.00 0.00 C ATOM 1820 C LEU A 120 -7.308 9.563 -4.937 1.00 0.00 C ATOM 1821 O LEU A 120 -7.896 10.641 -4.945 1.00 0.00 O ATOM 1822 CB LEU A 120 -4.794 9.216 -5.015 1.00 0.00 C ATOM 1823 CG LEU A 120 -4.164 10.516 -5.547 1.00 0.00 C ATOM 1824 CD1 LEU A 120 -5.048 11.271 -6.544 1.00 0.00 C ATOM 1825 CD2 LEU A 120 -3.743 11.426 -4.390 1.00 0.00 C ATOM 0 H LEU A 120 -6.139 7.298 -3.728 1.00 0.00 H new ATOM 0 HA LEU A 120 -5.899 10.266 -3.503 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.032 8.670 -4.459 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -5.071 8.597 -5.868 1.00 0.00 H new ATOM 0 HG LEU A 120 -3.279 10.214 -6.107 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -4.535 12.175 -6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -5.250 10.635 -7.406 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -5.989 11.541 -6.064 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.300 12.339 -4.788 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -4.617 11.678 -3.789 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.012 10.909 -3.768 1.00 0.00 H new ATOM 1837 N ASP A 121 -7.741 8.495 -5.605 1.00 0.00 N ATOM 1838 CA ASP A 121 -9.010 8.500 -6.350 1.00 0.00 C ATOM 1839 C ASP A 121 -10.232 8.528 -5.416 1.00 0.00 C ATOM 1840 O ASP A 121 -10.477 7.531 -4.733 1.00 0.00 O ATOM 1841 CB ASP A 121 -9.072 7.312 -7.319 1.00 0.00 C ATOM 1842 CG ASP A 121 -8.564 7.650 -8.727 1.00 0.00 C ATOM 1843 OD1 ASP A 121 -7.912 8.706 -8.884 1.00 0.00 O ATOM 1844 OD2 ASP A 121 -8.819 6.805 -9.607 1.00 0.00 O ATOM 0 H ASP A 121 -7.234 7.611 -5.649 1.00 0.00 H new ATOM 0 HA ASP A 121 -9.043 9.420 -6.934 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -8.481 6.491 -6.914 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -10.102 6.960 -7.386 1.00 0.00 H new ATOM 1849 N PRO A 122 -11.053 9.588 -5.489 1.00 0.00 N ATOM 1850 CA PRO A 122 -12.317 9.673 -4.728 1.00 0.00 C ATOM 1851 C PRO A 122 -13.412 8.714 -5.239 1.00 0.00 C ATOM 1852 O PRO A 122 -14.472 8.590 -4.636 1.00 0.00 O ATOM 1853 CB PRO A 122 -12.724 11.143 -4.840 1.00 0.00 C ATOM 1854 CG PRO A 122 -12.184 11.560 -6.208 1.00 0.00 C ATOM 1855 CD PRO A 122 -10.870 10.787 -6.333 1.00 0.00 C ATOM 0 HA PRO A 122 -12.181 9.356 -3.694 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -13.805 11.266 -4.781 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.291 11.741 -4.038 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -12.878 11.301 -7.008 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -12.022 12.636 -6.263 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -10.669 10.514 -7.369 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -10.025 11.385 -5.992 1.00 0.00 H new ATOM 1863 N ASP A 123 -13.064 7.935 -6.263 1.00 0.00 N ATOM 1864 CA ASP A 123 -13.924 6.892 -6.850 1.00 0.00 C ATOM 1865 C ASP A 123 -13.507 5.487 -6.391 1.00 0.00 C ATOM 1866 O ASP A 123 -14.209 4.510 -6.640 1.00 0.00 O ATOM 1867 CB ASP A 123 -13.844 7.003 -8.376 1.00 0.00 C ATOM 1868 CG ASP A 123 -15.221 7.111 -9.043 1.00 0.00 C ATOM 1869 OD1 ASP A 123 -16.182 7.513 -8.351 1.00 0.00 O ATOM 1870 OD2 ASP A 123 -15.250 6.909 -10.275 1.00 0.00 O ATOM 0 H ASP A 123 -12.156 8.009 -6.722 1.00 0.00 H new ATOM 0 HA ASP A 123 -14.949 7.044 -6.512 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -13.249 7.877 -8.640 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -13.323 6.131 -8.771 1.00 0.00 H new ATOM 1875 N GLN A 124 -12.335 5.406 -5.760 1.00 0.00 N ATOM 1876 CA GLN A 124 -11.792 4.134 -5.284 1.00 0.00 C ATOM 1877 C GLN A 124 -11.033 4.346 -3.959 1.00 0.00 C ATOM 1878 O GLN A 124 -9.854 4.713 -3.964 1.00 0.00 O ATOM 1879 CB GLN A 124 -10.910 3.540 -6.375 1.00 0.00 C ATOM 1880 CG GLN A 124 -10.707 2.054 -6.096 1.00 0.00 C ATOM 1881 CD GLN A 124 -9.458 1.552 -6.804 1.00 0.00 C ATOM 1882 OE1 GLN A 124 -9.434 0.489 -7.404 1.00 0.00 O ATOM 1883 NE2 GLN A 124 -8.356 2.246 -6.610 1.00 0.00 N ATOM 0 H GLN A 124 -11.741 6.212 -5.566 1.00 0.00 H new ATOM 0 HA GLN A 124 -12.594 3.426 -5.075 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.374 3.680 -7.352 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -9.948 4.053 -6.402 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -10.617 1.887 -5.023 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -11.577 1.491 -6.434 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -8.393 3.132 -6.107 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -7.465 1.897 -6.963 1.00 0.00 H new ATOM 1892 N PRO A 125 -11.756 4.209 -2.841 1.00 0.00 N ATOM 1893 CA PRO A 125 -11.168 4.309 -1.497 1.00 0.00 C ATOM 1894 C PRO A 125 -10.207 3.161 -1.213 1.00 0.00 C ATOM 1895 O PRO A 125 -10.246 2.106 -1.848 1.00 0.00 O ATOM 1896 CB PRO A 125 -12.354 4.356 -0.532 1.00 0.00 C ATOM 1897 CG PRO A 125 -13.455 3.608 -1.278 1.00 0.00 C ATOM 1898 CD PRO A 125 -13.210 3.967 -2.746 1.00 0.00 C ATOM 0 HA PRO A 125 -10.553 5.202 -1.388 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -12.117 3.877 0.418 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -12.647 5.381 -0.307 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -13.391 2.532 -1.113 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.446 3.922 -0.949 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.520 3.158 -3.407 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -13.777 4.851 -3.036 1.00 0.00 H new ATOM 1906 N ALA A 126 -9.419 3.370 -0.169 1.00 0.00 N ATOM 1907 CA ALA A 126 -8.429 2.385 0.284 1.00 0.00 C ATOM 1908 C ALA A 126 -9.091 1.056 0.692 1.00 0.00 C ATOM 1909 O ALA A 126 -8.666 0.008 0.228 1.00 0.00 O ATOM 1910 CB ALA A 126 -7.653 3.027 1.425 1.00 0.00 C ATOM 0 H ALA A 126 -9.442 4.222 0.391 1.00 0.00 H new ATOM 0 HA ALA A 126 -7.748 2.122 -0.525 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.903 2.327 1.794 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.161 3.931 1.067 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -8.339 3.283 2.233 1.00 0.00 H new ATOM 1916 N ALA A 127 -10.265 1.143 1.324 1.00 0.00 N ATOM 1917 CA ALA A 127 -11.132 -0.019 1.617 1.00 0.00 C ATOM 1918 C ALA A 127 -11.547 -0.805 0.361 1.00 0.00 C ATOM 1919 O ALA A 127 -11.206 -1.976 0.270 1.00 0.00 O ATOM 1920 CB ALA A 127 -12.366 0.429 2.401 1.00 0.00 C ATOM 0 H ALA A 127 -10.651 2.028 1.653 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.540 -0.705 2.223 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -12.997 -0.435 2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -12.054 0.887 3.339 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -12.928 1.154 1.812 1.00 0.00 H new ATOM 1926 N ALA A 128 -12.072 -0.127 -0.662 1.00 0.00 N ATOM 1927 CA ALA A 128 -12.391 -0.760 -1.965 1.00 0.00 C ATOM 1928 C ALA A 128 -11.157 -1.372 -2.653 1.00 0.00 C ATOM 1929 O ALA A 128 -11.224 -2.489 -3.160 1.00 0.00 O ATOM 1930 CB ALA A 128 -13.075 0.240 -2.899 1.00 0.00 C ATOM 0 H ALA A 128 -12.290 0.869 -0.622 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.075 -1.581 -1.750 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.300 -0.245 -3.849 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -14.000 0.590 -2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.412 1.088 -3.072 1.00 0.00 H new ATOM 1936 N ILE A 129 -9.999 -0.749 -2.422 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.681 -1.263 -2.849 1.00 0.00 C ATOM 1938 C ILE A 129 -8.291 -2.528 -2.078 1.00 0.00 C ATOM 1939 O ILE A 129 -7.900 -3.511 -2.691 1.00 0.00 O ATOM 1940 CB ILE A 129 -7.632 -0.125 -2.810 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -7.538 0.525 -4.193 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -6.231 -0.449 -2.259 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -7.045 -0.395 -5.325 1.00 0.00 C ATOM 0 H ILE A 129 -9.942 0.141 -1.926 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.732 -1.590 -3.888 1.00 0.00 H new ATOM 0 HB ILE A 129 -8.019 0.562 -2.057 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.522 0.909 -4.463 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -6.868 1.383 -4.128 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -5.610 0.446 -2.296 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -6.316 -0.790 -1.227 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -5.775 -1.233 -2.864 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -7.015 0.163 -6.261 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.045 -0.760 -5.088 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -7.725 -1.241 -5.429 1.00 0.00 H new ATOM 1955 N VAL A 130 -8.495 -2.503 -0.768 1.00 0.00 N ATOM 1956 CA VAL A 130 -8.257 -3.614 0.170 1.00 0.00 C ATOM 1957 C VAL A 130 -9.243 -4.783 -0.029 1.00 0.00 C ATOM 1958 O VAL A 130 -8.908 -5.938 0.215 1.00 0.00 O ATOM 1959 CB VAL A 130 -8.203 -3.007 1.584 1.00 0.00 C ATOM 1960 CG1 VAL A 130 -8.459 -3.998 2.723 1.00 0.00 C ATOM 1961 CG2 VAL A 130 -6.817 -2.380 1.773 1.00 0.00 C ATOM 0 H VAL A 130 -8.849 -1.670 -0.298 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.301 -4.101 -0.021 1.00 0.00 H new ATOM 0 HB VAL A 130 -9.012 -2.278 1.643 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -8.400 -3.477 3.679 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.451 -4.435 2.609 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.709 -4.788 2.694 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.749 -1.941 2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -6.052 -3.148 1.662 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.663 -1.604 1.023 1.00 0.00 H new ATOM 1971 N ASN A 131 -10.433 -4.450 -0.511 1.00 0.00 N ATOM 1972 CA ASN A 131 -11.484 -5.423 -0.844 1.00 0.00 C ATOM 1973 C ASN A 131 -11.208 -6.124 -2.184 1.00 0.00 C ATOM 1974 O ASN A 131 -11.406 -7.328 -2.302 1.00 0.00 O ATOM 1975 CB ASN A 131 -12.840 -4.715 -0.860 1.00 0.00 C ATOM 1976 CG ASN A 131 -13.958 -5.753 -0.839 1.00 0.00 C ATOM 1977 OD1 ASN A 131 -14.504 -6.155 -1.857 1.00 0.00 O ATOM 1978 ND2 ASN A 131 -14.278 -6.233 0.340 1.00 0.00 N ATOM 0 H ASN A 131 -10.707 -3.483 -0.687 1.00 0.00 H new ATOM 0 HA ASN A 131 -11.493 -6.201 -0.081 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -12.927 -4.054 0.002 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.926 -4.091 -1.750 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.994 -6.955 0.419 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -13.811 -5.884 1.177 1.00 0.00 H new ATOM 1985 N PHE A 132 -10.548 -5.393 -3.076 1.00 0.00 N ATOM 1986 CA PHE A 132 -10.160 -5.867 -4.414 1.00 0.00 C ATOM 1987 C PHE A 132 -8.787 -6.560 -4.419 1.00 0.00 C ATOM 1988 O PHE A 132 -8.658 -7.674 -4.920 1.00 0.00 O ATOM 1989 CB PHE A 132 -10.205 -4.659 -5.357 1.00 0.00 C ATOM 1990 CG PHE A 132 -9.403 -4.848 -6.641 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -9.572 -5.962 -7.453 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -8.416 -3.912 -6.937 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -8.770 -6.134 -8.567 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -7.625 -4.086 -8.054 1.00 0.00 C ATOM 1995 CZ PHE A 132 -7.788 -5.197 -8.871 1.00 0.00 C ATOM 0 H PHE A 132 -10.258 -4.433 -2.892 1.00 0.00 H new ATOM 0 HA PHE A 132 -10.857 -6.634 -4.752 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -11.243 -4.451 -5.616 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -9.826 -3.784 -4.829 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -10.330 -6.694 -7.215 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.270 -3.055 -6.296 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -8.907 -6.997 -9.202 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -6.872 -3.351 -8.295 1.00 0.00 H new ATOM 0 HZ PHE A 132 -7.157 -5.333 -9.737 1.00 0.00 H new ATOM 2005 N VAL A 133 -7.807 -5.937 -3.770 1.00 0.00 N ATOM 2006 CA VAL A 133 -6.432 -6.469 -3.654 1.00 0.00 C ATOM 2007 C VAL A 133 -6.433 -7.847 -2.961 1.00 0.00 C ATOM 2008 O VAL A 133 -5.700 -8.749 -3.356 1.00 0.00 O ATOM 2009 CB VAL A 133 -5.512 -5.430 -2.975 1.00 0.00 C ATOM 2010 CG1 VAL A 133 -5.704 -5.282 -1.461 1.00 0.00 C ATOM 2011 CG2 VAL A 133 -4.045 -5.675 -3.331 1.00 0.00 C ATOM 0 H VAL A 133 -7.936 -5.040 -3.302 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.021 -6.639 -4.649 1.00 0.00 H new ATOM 0 HB VAL A 133 -5.823 -4.470 -3.386 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.014 -4.530 -1.078 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.728 -4.973 -1.253 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.507 -6.237 -0.974 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.422 -4.929 -2.839 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.751 -6.670 -2.998 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.915 -5.601 -4.411 1.00 0.00 H new ATOM 2021 N SER A 134 -7.380 -7.999 -2.037 1.00 0.00 N ATOM 2022 CA SER A 134 -7.629 -9.265 -1.328 1.00 0.00 C ATOM 2023 C SER A 134 -8.503 -10.231 -2.139 1.00 0.00 C ATOM 2024 O SER A 134 -8.219 -11.421 -2.143 1.00 0.00 O ATOM 2025 CB SER A 134 -8.266 -8.993 0.031 1.00 0.00 C ATOM 2026 OG SER A 134 -7.701 -9.896 0.981 1.00 0.00 O ATOM 0 H SER A 134 -8.004 -7.244 -1.753 1.00 0.00 H new ATOM 0 HA SER A 134 -6.662 -9.748 -1.187 1.00 0.00 H new ATOM 0 HB2 SER A 134 -8.087 -7.962 0.335 1.00 0.00 H new ATOM 0 HB3 SER A 134 -9.347 -9.126 -0.023 1.00 0.00 H new ATOM 0 HG SER A 134 -8.098 -9.734 1.862 1.00 0.00 H new ATOM 2032 N ARG A 135 -9.378 -9.698 -2.994 1.00 0.00 N ATOM 2033 CA ARG A 135 -10.245 -10.490 -3.892 1.00 0.00 C ATOM 2034 C ARG A 135 -9.460 -11.179 -5.026 1.00 0.00 C ATOM 2035 O ARG A 135 -9.906 -12.175 -5.592 1.00 0.00 O ATOM 2036 CB ARG A 135 -11.318 -9.557 -4.450 1.00 0.00 C ATOM 2037 CG ARG A 135 -12.709 -10.176 -4.359 1.00 0.00 C ATOM 2038 CD ARG A 135 -13.744 -9.053 -4.304 1.00 0.00 C ATOM 2039 NE ARG A 135 -15.071 -9.572 -4.662 1.00 0.00 N ATOM 2040 CZ ARG A 135 -16.223 -8.898 -4.583 1.00 0.00 C ATOM 2041 NH1 ARG A 135 -16.294 -7.697 -4.021 1.00 0.00 N ATOM 2042 NH2 ARG A 135 -17.344 -9.455 -5.013 1.00 0.00 N ATOM 0 H ARG A 135 -9.512 -8.691 -3.089 1.00 0.00 H new ATOM 0 HA ARG A 135 -10.700 -11.299 -3.321 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -11.302 -8.615 -3.901 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -11.091 -9.323 -5.490 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -12.894 -10.818 -5.220 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -12.786 -10.804 -3.471 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -13.771 -8.622 -3.303 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -13.461 -8.253 -4.988 1.00 0.00 H new ATOM 0 HE ARG A 135 -15.118 -10.533 -5.001 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -15.455 -7.264 -3.635 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -17.188 -7.207 -3.976 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -17.328 -10.397 -5.404 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -18.224 -8.942 -4.953 1.00 0.00 H new ATOM 2056 N VAL A 136 -8.329 -10.575 -5.392 1.00 0.00 N ATOM 2057 CA VAL A 136 -7.361 -11.128 -6.371 1.00 0.00 C ATOM 2058 C VAL A 136 -6.370 -12.108 -5.706 1.00 0.00 C ATOM 2059 O VAL A 136 -5.782 -12.957 -6.373 1.00 0.00 O ATOM 2060 CB VAL A 136 -6.646 -9.979 -7.117 1.00 0.00 C ATOM 2061 CG1 VAL A 136 -5.656 -10.449 -8.190 1.00 0.00 C ATOM 2062 CG2 VAL A 136 -7.677 -9.108 -7.829 1.00 0.00 C ATOM 0 H VAL A 136 -8.044 -9.671 -5.016 1.00 0.00 H new ATOM 0 HA VAL A 136 -7.910 -11.713 -7.109 1.00 0.00 H new ATOM 0 HB VAL A 136 -6.092 -9.440 -6.348 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -5.197 -9.583 -8.666 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -4.882 -11.061 -7.728 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.184 -11.038 -8.940 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -7.169 -8.299 -8.354 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -8.232 -9.713 -8.546 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -8.367 -8.689 -7.097 1.00 0.00 H new ATOM 2072 N MET A 137 -6.199 -11.963 -4.393 1.00 0.00 N ATOM 2073 CA MET A 137 -5.319 -12.826 -3.580 1.00 0.00 C ATOM 2074 C MET A 137 -6.053 -14.085 -3.080 1.00 0.00 C ATOM 2075 O MET A 137 -5.452 -15.148 -2.930 1.00 0.00 O ATOM 2076 CB MET A 137 -4.754 -11.999 -2.413 1.00 0.00 C ATOM 2077 CG MET A 137 -3.761 -12.791 -1.554 1.00 0.00 C ATOM 2078 SD MET A 137 -2.048 -12.152 -1.574 1.00 0.00 S ATOM 2079 CE MET A 137 -1.178 -13.673 -1.262 1.00 0.00 C ATOM 0 H MET A 137 -6.669 -11.238 -3.851 1.00 0.00 H new ATOM 0 HA MET A 137 -4.497 -13.182 -4.201 1.00 0.00 H new ATOM 0 HB2 MET A 137 -4.260 -11.111 -2.808 1.00 0.00 H new ATOM 0 HB3 MET A 137 -5.576 -11.654 -1.786 1.00 0.00 H new ATOM 0 HG2 MET A 137 -4.119 -12.799 -0.524 1.00 0.00 H new ATOM 0 HG3 MET A 137 -3.752 -13.826 -1.896 1.00 0.00 H new ATOM 0 HE1 MET A 137 -0.105 -13.480 -1.238 1.00 0.00 H new ATOM 0 HE2 MET A 137 -1.494 -14.083 -0.303 1.00 0.00 H new ATOM 0 HE3 MET A 137 -1.401 -14.389 -2.054 1.00 0.00 H new ATOM 2089 N LEU A 138 -7.337 -13.916 -2.776 1.00 0.00 N ATOM 2090 CA LEU A 138 -8.242 -14.942 -2.228 1.00 0.00 C ATOM 2091 C LEU A 138 -9.710 -14.483 -2.349 1.00 0.00 C ATOM 2092 O LEU A 138 -10.000 -13.378 -2.800 1.00 0.00 O ATOM 2093 CB LEU A 138 -7.844 -15.250 -0.770 1.00 0.00 C ATOM 2094 CG LEU A 138 -7.885 -14.050 0.188 1.00 0.00 C ATOM 2095 CD1 LEU A 138 -9.162 -14.062 1.033 1.00 0.00 C ATOM 2096 CD2 LEU A 138 -6.640 -14.035 1.076 1.00 0.00 C ATOM 0 H LEU A 138 -7.805 -13.019 -2.909 1.00 0.00 H new ATOM 0 HA LEU A 138 -8.150 -15.864 -2.803 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -8.508 -16.024 -0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.836 -15.664 -0.765 1.00 0.00 H new ATOM 0 HG LEU A 138 -7.893 -13.137 -0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -9.164 -13.201 1.702 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -10.032 -14.015 0.378 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -9.200 -14.979 1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.684 -13.179 1.749 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.599 -14.954 1.660 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -5.749 -13.961 0.452 1.00 0.00 H new ATOM 2108 N GLY A 139 -10.612 -15.342 -1.864 1.00 0.00 N ATOM 2109 CA GLY A 139 -12.063 -15.083 -1.911 1.00 0.00 C ATOM 2110 C GLY A 139 -12.758 -15.799 -0.752 1.00 0.00 C ATOM 2111 O GLY A 139 -13.049 -16.989 -0.838 1.00 0.00 O ATOM 0 H GLY A 139 -10.364 -16.231 -1.430 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -12.252 -14.011 -1.853 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -12.472 -15.428 -2.861 1.00 0.00 H new ATOM 2115 N SER A 140 -12.819 -15.094 0.374 1.00 0.00 N ATOM 2116 CA SER A 140 -13.462 -15.590 1.608 1.00 0.00 C ATOM 2117 C SER A 140 -13.844 -14.412 2.510 1.00 0.00 C ATOM 2118 O SER A 140 -13.114 -13.423 2.596 1.00 0.00 O ATOM 2119 CB SER A 140 -12.513 -16.521 2.372 1.00 0.00 C ATOM 2120 OG SER A 140 -13.178 -17.078 3.510 1.00 0.00 O ATOM 0 H SER A 140 -12.425 -14.158 0.467 1.00 0.00 H new ATOM 0 HA SER A 140 -14.358 -16.144 1.328 1.00 0.00 H new ATOM 0 HB2 SER A 140 -12.169 -17.320 1.715 1.00 0.00 H new ATOM 0 HB3 SER A 140 -11.629 -15.969 2.692 1.00 0.00 H new ATOM 0 HG SER A 140 -12.564 -17.672 3.990 1.00 0.00 H new ATOM 2126 N GLY A 141 -15.016 -14.553 3.135 1.00 0.00 N ATOM 2127 CA GLY A 141 -15.572 -13.515 4.022 1.00 0.00 C ATOM 2128 C GLY A 141 -17.064 -13.321 3.761 1.00 0.00 C ATOM 2129 O GLY A 141 -17.879 -14.038 4.336 1.00 0.00 O ATOM 0 H GLY A 141 -15.606 -15.380 3.045 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -15.414 -13.797 5.063 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -15.045 -12.574 3.863 1.00 0.00 H new ATOM 2133 N GLN A 142 -17.371 -12.418 2.825 1.00 0.00 N ATOM 2134 CA GLN A 142 -18.738 -11.991 2.436 1.00 0.00 C ATOM 2135 C GLN A 142 -19.480 -11.248 3.565 1.00 0.00 C ATOM 2136 O GLN A 142 -19.863 -10.091 3.389 1.00 0.00 O ATOM 2137 CB GLN A 142 -19.517 -13.195 1.865 1.00 0.00 C ATOM 2138 CG GLN A 142 -20.870 -12.877 1.216 1.00 0.00 C ATOM 2139 CD GLN A 142 -22.038 -12.889 2.206 1.00 0.00 C ATOM 2140 OE1 GLN A 142 -22.348 -13.877 2.862 1.00 0.00 O ATOM 2141 NE2 GLN A 142 -22.742 -11.788 2.297 1.00 0.00 N ATOM 0 H GLN A 142 -16.649 -11.938 2.288 1.00 0.00 H new ATOM 0 HA GLN A 142 -18.656 -11.247 1.643 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -18.889 -13.690 1.124 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -19.683 -13.910 2.671 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -20.816 -11.897 0.742 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -21.065 -13.603 0.427 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -22.480 -10.968 1.749 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -23.552 -11.750 2.916 1.00 0.00 H new ATOM 2150 N LYS A 143 -19.516 -11.854 4.749 1.00 0.00 N ATOM 2151 CA LYS A 143 -20.126 -11.272 5.955 1.00 0.00 C ATOM 2152 C LYS A 143 -19.153 -11.358 7.146 1.00 0.00 C ATOM 2153 O LYS A 143 -18.949 -12.417 7.733 1.00 0.00 O ATOM 2154 CB LYS A 143 -21.435 -12.005 6.255 1.00 0.00 C ATOM 2155 CG LYS A 143 -22.530 -11.023 6.678 1.00 0.00 C ATOM 2156 CD LYS A 143 -23.177 -11.470 7.990 1.00 0.00 C ATOM 2157 CE LYS A 143 -22.668 -10.663 9.189 1.00 0.00 C ATOM 2158 NZ LYS A 143 -23.478 -9.453 9.397 1.00 0.00 N ATOM 0 H LYS A 143 -19.117 -12.779 4.906 1.00 0.00 H new ATOM 0 HA LYS A 143 -20.342 -10.217 5.785 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -21.758 -12.556 5.372 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -21.273 -12.737 7.046 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -22.106 -10.026 6.797 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -23.287 -10.956 5.897 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -24.259 -11.363 7.915 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -22.972 -12.528 8.153 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -22.697 -11.282 10.086 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -21.627 -10.384 9.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -23.111 -8.926 10.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -23.430 -8.853 8.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -24.466 -9.723 9.574 1.00 0.00 H new ATOM 2172 N ARG A 144 -18.417 -10.262 7.316 1.00 0.00 N ATOM 2173 CA ARG A 144 -17.399 -10.087 8.386 1.00 0.00 C ATOM 2174 C ARG A 144 -16.984 -8.610 8.546 1.00 0.00 C ATOM 2175 O ARG A 144 -16.707 -8.204 9.695 1.00 0.00 O ATOM 2176 CB ARG A 144 -16.156 -10.917 8.026 1.00 0.00 C ATOM 2177 CG ARG A 144 -15.122 -11.084 9.146 1.00 0.00 C ATOM 2178 CD ARG A 144 -15.598 -12.025 10.256 1.00 0.00 C ATOM 2179 NE ARG A 144 -14.439 -12.821 10.688 1.00 0.00 N ATOM 2180 CZ ARG A 144 -14.392 -13.701 11.693 1.00 0.00 C ATOM 2181 NH1 ARG A 144 -15.434 -13.921 12.482 1.00 0.00 N ATOM 2182 NH2 ARG A 144 -13.274 -14.369 11.930 1.00 0.00 N ATOM 2183 OXT ARG A 144 -16.969 -7.912 7.506 1.00 99.99 O ATOM 0 H ARG A 144 -18.502 -9.446 6.709 1.00 0.00 H new ATOM 0 HA ARG A 144 -17.835 -10.420 9.328 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -16.482 -11.907 7.707 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -15.666 -10.452 7.171 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -14.194 -11.468 8.723 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -14.897 -10.108 9.575 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -16.006 -11.457 11.092 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -16.395 -12.674 9.893 1.00 0.00 H new ATOM 0 HE ARG A 144 -13.575 -12.687 10.162 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -16.305 -13.412 12.331 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -15.365 -14.600 13.240 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -12.452 -14.211 11.347 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -13.234 -15.041 12.696 1.00 0.00 H new TER 2197 ARG A 144