USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1014 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 126 ASN : amide:sc= 1.22 K(o=1.3,f=0.076) USER MOD Set 1.2: A 128 GLN : amide:sc= 0.102 K(o=1.3,f=-0.034) USER MOD Set 2.1: A 56 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -164:sc=-0.00673 (180deg=-0.154) USER MOD Single : A 6 HIS : no HE2:sc= 1.22 K(o=1.2,f=-4.4!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0536 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= -0.0611 X(o=-0.061,f=0) USER MOD Single : A 34 SER OG : rot -20:sc= 1.25 USER MOD Single : A 37 LYS NZ :NH3+ 172:sc= 1.22 (180deg=1.17) USER MOD Single : A 41 GLN : amide:sc= -0.212 X(o=-0.21,f=0) USER MOD Single : A 45 ASN : amide:sc= 0.672 K(o=0.67,f=-0.016) USER MOD Single : A 48 LYS NZ :NH3+ -152:sc= 1.06 (180deg=0.162) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 HIS : no HD1:sc= 0.862 K(o=0.86,f=-5.2!) USER MOD Single : A 61 SER OG : rot -62:sc= 0.275 USER MOD Single : A 62 SER OG : rot 180:sc= 0.103 USER MOD Single : A 63 GLN : amide:sc= -0.583 K(o=-0.58,f=-2.2) USER MOD Single : A 65 HIS : no HD1:sc= -0.0127 X(o=-0.013,f=0) USER MOD Single : A 67 ASN : amide:sc= 0.688 K(o=0.69,f=-2) USER MOD Single : A 68 ASN : amide:sc= 0.462 K(o=0.46,f=-2.7!) USER MOD Single : A 72 GLN : amide:sc= -0.0226 K(o=-0.023,f=-1.5) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 91:sc= 1.51 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc=-0.00552 K(o=-0.0055,f=-0.94) USER MOD Single : A 101 THR OG1 : rot -146:sc= 0.848 USER MOD Single : A 107 GLN : amide:sc= -0.0189 K(o=-0.019,f=-1.9!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.0858 K(o=-0.086,f=-0.8) USER MOD Single : A 120 SER OG : rot 66:sc= 0.186 USER MOD Single : A 125 ASN : amide:sc= 0.609 K(o=0.61,f=-0.014) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.479 20.638 -7.783 1.00 0.00 N ATOM 2 CA MET A 1 -8.497 20.174 -8.729 1.00 0.00 C ATOM 3 C MET A 1 -9.319 19.102 -8.034 1.00 0.00 C ATOM 4 O MET A 1 -8.754 18.050 -7.742 1.00 0.00 O ATOM 5 CB MET A 1 -7.832 19.628 -10.001 1.00 0.00 C ATOM 6 CG MET A 1 -8.882 19.197 -11.024 1.00 0.00 C ATOM 7 SD MET A 1 -9.752 20.572 -11.803 1.00 0.00 S ATOM 8 CE MET A 1 -8.583 20.856 -13.161 1.00 0.00 C ATOM 0 H1 MET A 1 -6.898 21.375 -8.232 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.943 21.029 -6.938 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.872 19.840 -7.507 1.00 0.00 H new ATOM 0 HA MET A 1 -9.145 20.996 -9.033 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.187 20.392 -10.436 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.196 18.780 -9.748 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.398 18.601 -11.798 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.610 18.551 -10.533 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.936 21.682 -13.779 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.603 21.102 -12.752 1.00 0.00 H new ATOM 0 HE3 MET A 1 -8.506 19.955 -13.769 1.00 0.00 H new ATOM 18 N LYS A 2 -10.609 19.364 -7.790 1.00 0.00 N ATOM 19 CA LYS A 2 -11.577 18.639 -6.944 1.00 0.00 C ATOM 20 C LYS A 2 -11.580 19.295 -5.552 1.00 0.00 C ATOM 21 O LYS A 2 -10.970 20.355 -5.382 1.00 0.00 O ATOM 22 CB LYS A 2 -11.359 17.112 -6.877 1.00 0.00 C ATOM 23 CG LYS A 2 -11.406 16.387 -8.237 1.00 0.00 C ATOM 24 CD LYS A 2 -10.274 15.352 -8.394 1.00 0.00 C ATOM 25 CE LYS A 2 -10.652 14.158 -9.274 1.00 0.00 C ATOM 26 NZ LYS A 2 -11.657 13.301 -8.616 1.00 0.00 N ATOM 0 H LYS A 2 -11.051 20.174 -8.224 1.00 0.00 H new ATOM 0 HA LYS A 2 -12.560 18.727 -7.407 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -10.392 16.918 -6.412 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -12.118 16.680 -6.225 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -12.369 15.887 -8.345 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -11.336 17.122 -9.039 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -9.400 15.844 -8.820 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -9.986 14.989 -7.408 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -11.044 14.516 -10.226 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -9.761 13.571 -9.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -11.694 12.379 -9.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -11.396 13.163 -7.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -12.590 13.757 -8.670 1.00 0.00 H new ATOM 40 N ALA A 3 -12.332 18.747 -4.599 1.00 0.00 N ATOM 41 CA ALA A 3 -12.414 19.205 -3.213 1.00 0.00 C ATOM 42 C ALA A 3 -12.784 18.021 -2.305 1.00 0.00 C ATOM 43 O ALA A 3 -13.177 16.971 -2.826 1.00 0.00 O ATOM 44 CB ALA A 3 -13.487 20.303 -3.121 1.00 0.00 C ATOM 0 H ALA A 3 -12.926 17.938 -4.779 1.00 0.00 H new ATOM 0 HA ALA A 3 -11.454 19.607 -2.889 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -13.560 20.655 -2.092 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -13.213 21.134 -3.771 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -14.449 19.899 -3.435 1.00 0.00 H new ATOM 50 N LEU A 4 -12.720 18.242 -0.982 1.00 0.00 N ATOM 51 CA LEU A 4 -13.090 17.450 0.210 1.00 0.00 C ATOM 52 C LEU A 4 -11.904 17.331 1.185 1.00 0.00 C ATOM 53 O LEU A 4 -11.522 16.240 1.622 1.00 0.00 O ATOM 54 CB LEU A 4 -13.867 16.133 -0.015 1.00 0.00 C ATOM 55 CG LEU A 4 -15.391 16.365 0.004 1.00 0.00 C ATOM 56 CD1 LEU A 4 -15.933 17.096 -1.228 1.00 0.00 C ATOM 57 CD2 LEU A 4 -16.101 15.024 0.149 1.00 0.00 C ATOM 0 H LEU A 4 -12.341 19.137 -0.671 1.00 0.00 H new ATOM 0 HA LEU A 4 -13.869 18.042 0.690 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -13.576 15.697 -0.971 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -13.598 15.414 0.759 1.00 0.00 H new ATOM 0 HG LEU A 4 -15.590 17.017 0.855 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -17.012 17.218 -1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -15.463 18.076 -1.306 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -15.711 16.515 -2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -17.179 15.183 0.163 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -15.840 14.381 -0.692 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -15.792 14.548 1.080 1.00 0.00 H new ATOM 69 N GLU A 5 -11.297 18.469 1.527 1.00 0.00 N ATOM 70 CA GLU A 5 -10.250 18.611 2.527 1.00 0.00 C ATOM 71 C GLU A 5 -10.876 18.270 3.875 1.00 0.00 C ATOM 72 O GLU A 5 -11.656 19.039 4.439 1.00 0.00 O ATOM 73 CB GLU A 5 -9.677 20.034 2.535 1.00 0.00 C ATOM 74 CG GLU A 5 -8.604 20.191 1.456 1.00 0.00 C ATOM 75 CD GLU A 5 -7.943 21.568 1.483 1.00 0.00 C ATOM 76 OE1 GLU A 5 -6.939 21.733 2.207 1.00 0.00 O ATOM 77 OE2 GLU A 5 -8.399 22.476 0.746 1.00 0.00 O ATOM 0 H GLU A 5 -11.538 19.358 1.089 1.00 0.00 H new ATOM 0 HA GLU A 5 -9.417 17.944 2.305 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -10.477 20.755 2.367 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -9.251 20.254 3.514 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -7.842 19.423 1.592 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -9.052 20.026 0.476 1.00 0.00 H new ATOM 84 N HIS A 6 -10.604 17.060 4.333 1.00 0.00 N ATOM 85 CA HIS A 6 -11.068 16.482 5.586 1.00 0.00 C ATOM 86 C HIS A 6 -9.825 15.926 6.266 1.00 0.00 C ATOM 87 O HIS A 6 -9.314 16.538 7.200 1.00 0.00 O ATOM 88 CB HIS A 6 -12.187 15.459 5.316 1.00 0.00 C ATOM 89 CG HIS A 6 -13.044 15.163 6.521 1.00 0.00 C ATOM 90 ND1 HIS A 6 -13.054 13.980 7.233 1.00 0.00 N ATOM 91 CD2 HIS A 6 -13.989 15.995 7.058 1.00 0.00 C ATOM 92 CE1 HIS A 6 -14.004 14.085 8.182 1.00 0.00 C ATOM 93 NE2 HIS A 6 -14.579 15.302 8.097 1.00 0.00 N ATOM 0 H HIS A 6 -10.016 16.413 3.808 1.00 0.00 H new ATOM 0 HA HIS A 6 -11.534 17.203 6.258 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -12.822 15.833 4.513 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -11.740 14.530 4.963 1.00 0.00 H new ATOM 0 HD1 HIS A 6 -12.452 13.173 7.070 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -14.227 16.997 6.733 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -14.264 13.318 8.896 1.00 0.00 H new ATOM 102 N GLU A 7 -9.275 14.829 5.751 1.00 0.00 N ATOM 103 CA GLU A 7 -8.011 14.256 6.199 1.00 0.00 C ATOM 104 C GLU A 7 -6.964 14.823 5.235 1.00 0.00 C ATOM 105 O GLU A 7 -6.318 14.090 4.478 1.00 0.00 O ATOM 106 CB GLU A 7 -8.057 12.728 6.134 1.00 0.00 C ATOM 107 CG GLU A 7 -9.099 12.062 7.042 1.00 0.00 C ATOM 108 CD GLU A 7 -10.269 11.518 6.230 1.00 0.00 C ATOM 109 OE1 GLU A 7 -10.040 10.645 5.359 1.00 0.00 O ATOM 110 OE2 GLU A 7 -11.426 11.948 6.442 1.00 0.00 O ATOM 0 H GLU A 7 -9.707 14.302 4.992 1.00 0.00 H new ATOM 0 HA GLU A 7 -7.785 14.506 7.236 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -8.254 12.431 5.104 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -7.072 12.340 6.394 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -8.633 11.251 7.601 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -9.464 12.784 7.772 1.00 0.00 H new ATOM 117 N LYS A 8 -6.844 16.155 5.228 1.00 0.00 N ATOM 118 CA LYS A 8 -6.031 16.937 4.322 1.00 0.00 C ATOM 119 C LYS A 8 -6.564 16.784 2.896 1.00 0.00 C ATOM 120 O LYS A 8 -7.616 16.180 2.671 1.00 0.00 O ATOM 121 CB LYS A 8 -4.546 16.623 4.559 1.00 0.00 C ATOM 122 CG LYS A 8 -3.676 17.855 4.302 1.00 0.00 C ATOM 123 CD LYS A 8 -2.364 17.742 5.070 1.00 0.00 C ATOM 124 CE LYS A 8 -1.434 18.862 4.608 1.00 0.00 C ATOM 125 NZ LYS A 8 -0.100 18.784 5.227 1.00 0.00 N ATOM 0 H LYS A 8 -7.345 16.739 5.897 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.102 18.008 4.514 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -4.402 16.280 5.584 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -4.234 15.810 3.904 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -3.474 17.951 3.235 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -4.209 18.756 4.608 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -2.545 17.818 6.142 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -1.904 16.770 4.893 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -1.330 18.819 3.524 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.885 19.825 4.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 0.490 19.566 4.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -0.192 18.853 6.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 0.345 17.878 4.979 1.00 0.00 H new ATOM 139 N THR A 9 -5.898 17.420 1.945 1.00 0.00 N ATOM 140 CA THR A 9 -6.229 17.433 0.522 1.00 0.00 C ATOM 141 C THR A 9 -6.300 16.010 -0.045 1.00 0.00 C ATOM 142 O THR A 9 -5.234 15.418 -0.259 1.00 0.00 O ATOM 143 CB THR A 9 -5.172 18.265 -0.227 1.00 0.00 C ATOM 144 OG1 THR A 9 -3.883 18.049 0.333 1.00 0.00 O ATOM 145 CG2 THR A 9 -5.450 19.761 -0.150 1.00 0.00 C ATOM 0 H THR A 9 -5.066 17.972 2.153 1.00 0.00 H new ATOM 0 HA THR A 9 -7.213 17.883 0.388 1.00 0.00 H new ATOM 0 HB THR A 9 -5.214 17.941 -1.267 1.00 0.00 H new ATOM 0 HG1 THR A 9 -3.221 18.583 -0.154 1.00 0.00 H new ATOM 0 HG21 THR A 9 -4.676 20.303 -0.694 1.00 0.00 H new ATOM 0 HG22 THR A 9 -6.422 19.974 -0.594 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.450 20.078 0.893 1.00 0.00 H new ATOM 153 N PRO A 10 -7.489 15.446 -0.341 1.00 0.00 N ATOM 154 CA PRO A 10 -7.561 14.150 -1.001 1.00 0.00 C ATOM 155 C PRO A 10 -7.037 14.248 -2.442 1.00 0.00 C ATOM 156 O PRO A 10 -6.726 13.220 -3.041 1.00 0.00 O ATOM 157 CB PRO A 10 -9.032 13.733 -0.937 1.00 0.00 C ATOM 158 CG PRO A 10 -9.760 15.069 -0.968 1.00 0.00 C ATOM 159 CD PRO A 10 -8.833 15.995 -0.181 1.00 0.00 C ATOM 0 HA PRO A 10 -6.934 13.402 -0.515 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -9.311 13.100 -1.780 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -9.255 13.171 -0.030 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -9.909 15.422 -1.988 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -10.745 15.001 -0.507 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -8.886 17.015 -0.561 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -9.118 16.031 0.871 1.00 0.00 H new ATOM 167 N GLU A 11 -6.910 15.460 -2.992 1.00 0.00 N ATOM 168 CA GLU A 11 -6.319 15.748 -4.292 1.00 0.00 C ATOM 169 C GLU A 11 -4.832 15.408 -4.260 1.00 0.00 C ATOM 170 O GLU A 11 -4.330 14.673 -5.115 1.00 0.00 O ATOM 171 CB GLU A 11 -6.457 17.241 -4.621 1.00 0.00 C ATOM 172 CG GLU A 11 -7.902 17.715 -4.794 1.00 0.00 C ATOM 173 CD GLU A 11 -8.671 17.781 -3.479 1.00 0.00 C ATOM 174 OE1 GLU A 11 -8.059 18.160 -2.452 1.00 0.00 O ATOM 175 OE2 GLU A 11 -9.858 17.398 -3.486 1.00 0.00 O ATOM 0 H GLU A 11 -7.233 16.302 -2.516 1.00 0.00 H new ATOM 0 HA GLU A 11 -6.835 15.153 -5.045 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.989 17.821 -3.826 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.905 17.452 -5.537 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -7.901 18.701 -5.258 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.420 17.042 -5.477 1.00 0.00 H new ATOM 182 N LEU A 12 -4.136 15.949 -3.256 1.00 0.00 N ATOM 183 CA LEU A 12 -2.719 15.713 -3.044 1.00 0.00 C ATOM 184 C LEU A 12 -2.546 14.237 -2.750 1.00 0.00 C ATOM 185 O LEU A 12 -1.715 13.607 -3.375 1.00 0.00 O ATOM 186 CB LEU A 12 -2.177 16.584 -1.895 1.00 0.00 C ATOM 187 CG LEU A 12 -0.644 16.735 -1.807 1.00 0.00 C ATOM 188 CD1 LEU A 12 0.117 15.428 -1.583 1.00 0.00 C ATOM 189 CD2 LEU A 12 -0.061 17.417 -3.046 1.00 0.00 C ATOM 0 H LEU A 12 -4.553 16.570 -2.563 1.00 0.00 H new ATOM 0 HA LEU A 12 -2.149 15.988 -3.931 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.613 17.579 -1.987 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -2.533 16.166 -0.953 1.00 0.00 H new ATOM 0 HG LEU A 12 -0.503 17.357 -0.923 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.186 15.633 -1.535 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.208 14.974 -0.647 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.084 14.744 -2.407 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.020 17.502 -2.940 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.293 16.824 -3.931 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.494 18.412 -3.152 1.00 0.00 H new ATOM 201 N ALA A 13 -3.360 13.656 -1.869 1.00 0.00 N ATOM 202 CA ALA A 13 -3.253 12.253 -1.494 1.00 0.00 C ATOM 203 C ALA A 13 -3.417 11.348 -2.723 1.00 0.00 C ATOM 204 O ALA A 13 -2.752 10.314 -2.812 1.00 0.00 O ATOM 205 CB ALA A 13 -4.274 11.920 -0.403 1.00 0.00 C ATOM 0 H ALA A 13 -4.115 14.151 -1.395 1.00 0.00 H new ATOM 0 HA ALA A 13 -2.258 12.069 -1.088 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -4.185 10.868 -0.130 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.085 12.539 0.474 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -5.280 12.115 -0.775 1.00 0.00 H new ATOM 211 N ALA A 14 -4.249 11.750 -3.690 1.00 0.00 N ATOM 212 CA ALA A 14 -4.418 11.036 -4.947 1.00 0.00 C ATOM 213 C ALA A 14 -3.206 11.198 -5.872 1.00 0.00 C ATOM 214 O ALA A 14 -2.935 10.295 -6.664 1.00 0.00 O ATOM 215 CB ALA A 14 -5.689 11.515 -5.640 1.00 0.00 C ATOM 0 H ALA A 14 -4.826 12.588 -3.615 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.503 9.973 -4.720 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.814 10.979 -6.581 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.548 11.324 -4.997 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.615 12.584 -5.838 1.00 0.00 H new ATOM 221 N LYS A 15 -2.495 12.332 -5.815 1.00 0.00 N ATOM 222 CA LYS A 15 -1.246 12.492 -6.571 1.00 0.00 C ATOM 223 C LYS A 15 -0.137 11.704 -5.891 1.00 0.00 C ATOM 224 O LYS A 15 0.636 11.023 -6.549 1.00 0.00 O ATOM 225 CB LYS A 15 -0.804 13.964 -6.670 1.00 0.00 C ATOM 226 CG LYS A 15 -1.328 14.699 -7.906 1.00 0.00 C ATOM 227 CD LYS A 15 -0.827 14.046 -9.205 1.00 0.00 C ATOM 228 CE LYS A 15 -0.557 15.097 -10.289 1.00 0.00 C ATOM 229 NZ LYS A 15 -0.214 14.478 -11.585 1.00 0.00 N ATOM 0 H LYS A 15 -2.760 13.145 -5.259 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.432 12.123 -7.579 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.140 14.493 -5.778 1.00 0.00 H new ATOM 0 HB3 LYS A 15 0.285 14.004 -6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.418 14.700 -7.895 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -1.008 15.740 -7.874 1.00 0.00 H new ATOM 0 HD2 LYS A 15 0.086 13.485 -9.004 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -1.568 13.332 -9.565 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.438 15.728 -10.410 1.00 0.00 H new ATOM 0 HE3 LYS A 15 0.258 15.746 -9.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.039 15.222 -12.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 0.641 13.896 -11.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -1.002 13.879 -11.903 1.00 0.00 H new ATOM 243 N LEU A 16 -0.074 11.798 -4.571 1.00 0.00 N ATOM 244 CA LEU A 16 0.948 11.248 -3.705 1.00 0.00 C ATOM 245 C LEU A 16 0.884 9.730 -3.893 1.00 0.00 C ATOM 246 O LEU A 16 1.912 9.066 -3.925 1.00 0.00 O ATOM 247 CB LEU A 16 0.594 11.713 -2.279 1.00 0.00 C ATOM 248 CG LEU A 16 1.506 11.355 -1.099 1.00 0.00 C ATOM 249 CD1 LEU A 16 1.999 9.917 -0.991 1.00 0.00 C ATOM 250 CD2 LEU A 16 2.684 12.328 -1.184 1.00 0.00 C ATOM 0 H LEU A 16 -0.790 12.298 -4.043 1.00 0.00 H new ATOM 0 HA LEU A 16 1.967 11.571 -3.918 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.512 12.800 -2.305 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.398 11.324 -2.050 1.00 0.00 H new ATOM 0 HG LEU A 16 0.907 11.444 -0.193 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.632 9.815 -0.110 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.145 9.245 -0.904 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.573 9.661 -1.882 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.379 12.130 -0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.196 12.197 -2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 16 2.317 13.351 -1.107 1.00 0.00 H new ATOM 262 N ALA A 17 -0.318 9.172 -4.092 1.00 0.00 N ATOM 263 CA ALA A 17 -0.487 7.769 -4.412 1.00 0.00 C ATOM 264 C ALA A 17 0.316 7.378 -5.650 1.00 0.00 C ATOM 265 O ALA A 17 0.957 6.337 -5.610 1.00 0.00 O ATOM 266 CB ALA A 17 -1.969 7.434 -4.596 1.00 0.00 C ATOM 0 H ALA A 17 -1.194 9.691 -4.033 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.103 7.187 -3.574 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -2.076 6.376 -4.836 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.509 7.654 -3.675 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.379 8.033 -5.409 1.00 0.00 H new ATOM 272 N ALA A 18 0.329 8.194 -6.711 1.00 0.00 N ATOM 273 CA ALA A 18 1.163 7.956 -7.885 1.00 0.00 C ATOM 274 C ALA A 18 2.647 8.017 -7.514 1.00 0.00 C ATOM 275 O ALA A 18 3.423 7.170 -7.949 1.00 0.00 O ATOM 276 CB ALA A 18 0.847 8.964 -8.993 1.00 0.00 C ATOM 0 H ALA A 18 -0.241 9.038 -6.775 1.00 0.00 H new ATOM 0 HA ALA A 18 0.941 6.957 -8.260 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.481 8.766 -9.857 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -0.200 8.870 -9.282 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.034 9.975 -8.630 1.00 0.00 H new ATOM 282 N GLU A 19 3.041 9.004 -6.704 1.00 0.00 N ATOM 283 CA GLU A 19 4.422 9.184 -6.262 1.00 0.00 C ATOM 284 C GLU A 19 4.910 7.947 -5.489 1.00 0.00 C ATOM 285 O GLU A 19 6.045 7.509 -5.689 1.00 0.00 O ATOM 286 CB GLU A 19 4.561 10.483 -5.441 1.00 0.00 C ATOM 287 CG GLU A 19 4.147 11.731 -6.237 1.00 0.00 C ATOM 288 CD GLU A 19 4.558 13.046 -5.569 1.00 0.00 C ATOM 289 OE1 GLU A 19 4.128 13.347 -4.430 1.00 0.00 O ATOM 290 OE2 GLU A 19 5.281 13.836 -6.225 1.00 0.00 O ATOM 0 H GLU A 19 2.401 9.707 -6.334 1.00 0.00 H new ATOM 0 HA GLU A 19 5.064 9.286 -7.137 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.947 10.409 -4.543 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.595 10.592 -5.112 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.593 11.683 -7.231 1.00 0.00 H new ATOM 0 HG3 GLU A 19 3.065 11.724 -6.372 1.00 0.00 H new ATOM 297 N ALA A 20 4.071 7.370 -4.623 1.00 0.00 N ATOM 298 CA ALA A 20 4.307 6.132 -3.904 1.00 0.00 C ATOM 299 C ALA A 20 4.324 4.941 -4.858 1.00 0.00 C ATOM 300 O ALA A 20 5.236 4.126 -4.789 1.00 0.00 O ATOM 301 CB ALA A 20 3.202 5.958 -2.852 1.00 0.00 C ATOM 0 H ALA A 20 3.165 7.782 -4.399 1.00 0.00 H new ATOM 0 HA ALA A 20 5.281 6.177 -3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.365 5.031 -2.303 1.00 0.00 H new ATOM 0 HB2 ALA A 20 3.224 6.799 -2.159 1.00 0.00 H new ATOM 0 HB3 ALA A 20 2.231 5.920 -3.347 1.00 0.00 H new ATOM 307 N ILE A 21 3.323 4.836 -5.732 1.00 0.00 N ATOM 308 CA ILE A 21 3.158 3.767 -6.712 1.00 0.00 C ATOM 309 C ILE A 21 4.393 3.626 -7.579 1.00 0.00 C ATOM 310 O ILE A 21 4.803 2.508 -7.870 1.00 0.00 O ATOM 311 CB ILE A 21 1.882 4.036 -7.555 1.00 0.00 C ATOM 312 CG1 ILE A 21 0.679 3.414 -6.826 1.00 0.00 C ATOM 313 CG2 ILE A 21 1.957 3.584 -9.025 1.00 0.00 C ATOM 314 CD1 ILE A 21 -0.679 3.826 -7.391 1.00 0.00 C ATOM 0 H ILE A 21 2.573 5.525 -5.777 1.00 0.00 H new ATOM 0 HA ILE A 21 3.034 2.816 -6.193 1.00 0.00 H new ATOM 0 HB ILE A 21 1.772 5.118 -7.632 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.764 2.328 -6.870 1.00 0.00 H new ATOM 0 HG13 ILE A 21 0.722 3.694 -5.774 1.00 0.00 H new ATOM 0 HG21 ILE A 21 1.017 3.817 -9.526 1.00 0.00 H new ATOM 0 HG22 ILE A 21 2.773 4.106 -9.525 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.134 2.509 -9.067 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.472 3.343 -6.820 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -0.789 4.908 -7.322 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -0.746 3.521 -8.435 1.00 0.00 H new ATOM 326 N GLU A 22 4.994 4.736 -7.998 1.00 0.00 N ATOM 327 CA GLU A 22 6.083 4.627 -8.942 1.00 0.00 C ATOM 328 C GLU A 22 7.277 3.958 -8.216 1.00 0.00 C ATOM 329 O GLU A 22 8.004 3.158 -8.816 1.00 0.00 O ATOM 330 CB GLU A 22 6.369 6.035 -9.489 1.00 0.00 C ATOM 331 CG GLU A 22 7.478 6.025 -10.544 1.00 0.00 C ATOM 332 CD GLU A 22 6.954 5.260 -11.771 1.00 0.00 C ATOM 333 OE1 GLU A 22 5.885 5.635 -12.317 1.00 0.00 O ATOM 334 OE2 GLU A 22 7.534 4.219 -12.149 1.00 0.00 O ATOM 0 H GLU A 22 4.752 5.684 -7.708 1.00 0.00 H new ATOM 0 HA GLU A 22 5.855 3.998 -9.803 1.00 0.00 H new ATOM 0 HB2 GLU A 22 5.458 6.447 -9.924 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.656 6.692 -8.668 1.00 0.00 H new ATOM 0 HG2 GLU A 22 7.754 7.043 -10.818 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.375 5.547 -10.150 1.00 0.00 H new ATOM 341 N ARG A 23 7.425 4.199 -6.903 1.00 0.00 N ATOM 342 CA ARG A 23 8.442 3.584 -6.055 1.00 0.00 C ATOM 343 C ARG A 23 8.088 2.148 -5.681 1.00 0.00 C ATOM 344 O ARG A 23 8.999 1.317 -5.626 1.00 0.00 O ATOM 345 CB ARG A 23 8.616 4.399 -4.760 1.00 0.00 C ATOM 346 CG ARG A 23 9.972 4.113 -4.103 1.00 0.00 C ATOM 347 CD ARG A 23 10.147 5.038 -2.901 1.00 0.00 C ATOM 348 NE ARG A 23 11.503 4.962 -2.339 1.00 0.00 N ATOM 349 CZ ARG A 23 11.970 5.735 -1.353 1.00 0.00 C ATOM 350 NH1 ARG A 23 11.203 6.678 -0.819 1.00 0.00 N ATOM 351 NH2 ARG A 23 13.204 5.574 -0.897 1.00 0.00 N ATOM 0 H ARG A 23 6.821 4.845 -6.395 1.00 0.00 H new ATOM 0 HA ARG A 23 9.369 3.574 -6.629 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.534 5.463 -4.983 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.813 4.156 -4.064 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.025 3.071 -3.787 1.00 0.00 H new ATOM 0 HG3 ARG A 23 10.778 4.270 -4.820 1.00 0.00 H new ATOM 0 HD2 ARG A 23 9.936 6.065 -3.200 1.00 0.00 H new ATOM 0 HD3 ARG A 23 9.421 4.774 -2.132 1.00 0.00 H new ATOM 0 HE ARG A 23 12.137 4.266 -2.731 1.00 0.00 H new ATOM 0 HH11 ARG A 23 10.252 6.816 -1.161 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.565 7.265 -0.067 1.00 0.00 H new ATOM 0 HH21 ARG A 23 13.806 4.856 -1.299 1.00 0.00 H new ATOM 0 HH22 ARG A 23 13.551 6.169 -0.145 1.00 0.00 H new ATOM 365 N ASP A 24 6.827 1.862 -5.355 1.00 0.00 N ATOM 366 CA ASP A 24 6.381 0.565 -4.858 1.00 0.00 C ATOM 367 C ASP A 24 5.782 -0.277 -5.986 1.00 0.00 C ATOM 368 O ASP A 24 4.632 -0.043 -6.370 1.00 0.00 O ATOM 369 CB ASP A 24 5.345 0.682 -3.733 1.00 0.00 C ATOM 370 CG ASP A 24 4.949 -0.711 -3.220 1.00 0.00 C ATOM 371 OD1 ASP A 24 5.742 -1.674 -3.378 1.00 0.00 O ATOM 372 OD2 ASP A 24 3.826 -0.856 -2.697 1.00 0.00 O ATOM 0 H ASP A 24 6.072 2.543 -5.432 1.00 0.00 H new ATOM 0 HA ASP A 24 7.270 0.080 -4.455 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.753 1.275 -2.915 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.462 1.207 -4.097 1.00 0.00 H new ATOM 377 N PRO A 25 6.490 -1.302 -6.489 1.00 0.00 N ATOM 378 CA PRO A 25 5.943 -2.160 -7.522 1.00 0.00 C ATOM 379 C PRO A 25 4.687 -2.893 -7.049 1.00 0.00 C ATOM 380 O PRO A 25 3.871 -3.238 -7.896 1.00 0.00 O ATOM 381 CB PRO A 25 7.059 -3.133 -7.902 1.00 0.00 C ATOM 382 CG PRO A 25 7.913 -3.194 -6.638 1.00 0.00 C ATOM 383 CD PRO A 25 7.792 -1.790 -6.062 1.00 0.00 C ATOM 0 HA PRO A 25 5.624 -1.575 -8.385 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.665 -4.113 -8.169 1.00 0.00 H new ATOM 0 HB3 PRO A 25 7.631 -2.775 -8.758 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.546 -3.947 -5.941 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.949 -3.447 -6.865 1.00 0.00 H new ATOM 0 HD2 PRO A 25 7.868 -1.805 -4.975 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.591 -1.146 -6.428 1.00 0.00 H new ATOM 391 N TRP A 26 4.478 -3.111 -5.743 1.00 0.00 N ATOM 392 CA TRP A 26 3.235 -3.719 -5.293 1.00 0.00 C ATOM 393 C TRP A 26 2.087 -2.732 -5.437 1.00 0.00 C ATOM 394 O TRP A 26 1.069 -3.100 -6.018 1.00 0.00 O ATOM 395 CB TRP A 26 3.326 -4.250 -3.867 1.00 0.00 C ATOM 396 CG TRP A 26 2.043 -4.864 -3.393 1.00 0.00 C ATOM 397 CD1 TRP A 26 1.295 -4.409 -2.372 1.00 0.00 C ATOM 398 CD2 TRP A 26 1.321 -6.011 -3.918 1.00 0.00 C ATOM 399 NE1 TRP A 26 0.173 -5.201 -2.203 1.00 0.00 N ATOM 400 CE2 TRP A 26 0.148 -6.226 -3.134 1.00 0.00 C ATOM 401 CE3 TRP A 26 1.580 -6.925 -4.953 1.00 0.00 C ATOM 402 CZ2 TRP A 26 -0.716 -7.308 -3.390 1.00 0.00 C ATOM 403 CZ3 TRP A 26 0.774 -8.057 -5.153 1.00 0.00 C ATOM 404 CH2 TRP A 26 -0.396 -8.227 -4.402 1.00 0.00 C ATOM 0 H TRP A 26 5.140 -2.880 -5.002 1.00 0.00 H new ATOM 0 HA TRP A 26 3.044 -4.582 -5.931 1.00 0.00 H new ATOM 0 HB2 TRP A 26 4.122 -4.993 -3.811 1.00 0.00 H new ATOM 0 HB3 TRP A 26 3.603 -3.435 -3.198 1.00 0.00 H new ATOM 0 HD1 TRP A 26 1.536 -3.546 -1.769 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -0.540 -5.050 -1.489 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.419 -6.753 -5.611 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -1.620 -7.430 -2.811 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 1.056 -8.797 -5.887 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -1.050 -9.063 -4.601 1.00 0.00 H new ATOM 415 N ALA A 27 2.218 -1.488 -4.967 1.00 0.00 N ATOM 416 CA ALA A 27 1.181 -0.482 -5.143 1.00 0.00 C ATOM 417 C ALA A 27 0.859 -0.296 -6.628 1.00 0.00 C ATOM 418 O ALA A 27 -0.320 -0.208 -6.989 1.00 0.00 O ATOM 419 CB ALA A 27 1.618 0.849 -4.530 1.00 0.00 C ATOM 0 H ALA A 27 3.039 -1.158 -4.460 1.00 0.00 H new ATOM 0 HA ALA A 27 0.282 -0.825 -4.631 1.00 0.00 H new ATOM 0 HB1 ALA A 27 0.831 1.590 -4.670 1.00 0.00 H new ATOM 0 HB2 ALA A 27 1.804 0.715 -3.464 1.00 0.00 H new ATOM 0 HB3 ALA A 27 2.531 1.192 -5.018 1.00 0.00 H new ATOM 425 N ALA A 28 1.890 -0.249 -7.482 1.00 0.00 N ATOM 426 CA ALA A 28 1.723 -0.154 -8.924 1.00 0.00 C ATOM 427 C ALA A 28 0.937 -1.357 -9.428 1.00 0.00 C ATOM 428 O ALA A 28 -0.038 -1.208 -10.166 1.00 0.00 O ATOM 429 CB ALA A 28 3.088 -0.092 -9.623 1.00 0.00 C ATOM 0 H ALA A 28 2.865 -0.276 -7.183 1.00 0.00 H new ATOM 0 HA ALA A 28 1.176 0.760 -9.154 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.942 -0.021 -10.701 1.00 0.00 H new ATOM 0 HB2 ALA A 28 3.637 0.782 -9.273 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.656 -0.993 -9.392 1.00 0.00 H new ATOM 435 N GLN A 29 1.343 -2.552 -9.002 1.00 0.00 N ATOM 436 CA GLN A 29 0.684 -3.786 -9.372 1.00 0.00 C ATOM 437 C GLN A 29 -0.771 -3.772 -8.908 1.00 0.00 C ATOM 438 O GLN A 29 -1.622 -4.160 -9.692 1.00 0.00 O ATOM 439 CB GLN A 29 1.429 -5.001 -8.821 1.00 0.00 C ATOM 440 CG GLN A 29 2.622 -5.455 -9.678 1.00 0.00 C ATOM 441 CD GLN A 29 3.433 -6.553 -8.984 1.00 0.00 C ATOM 442 OE1 GLN A 29 3.066 -7.077 -7.935 1.00 0.00 O ATOM 443 NE2 GLN A 29 4.575 -6.936 -9.523 1.00 0.00 N ATOM 0 H GLN A 29 2.145 -2.683 -8.386 1.00 0.00 H new ATOM 0 HA GLN A 29 0.695 -3.865 -10.459 1.00 0.00 H new ATOM 0 HB2 GLN A 29 1.785 -4.769 -7.817 1.00 0.00 H new ATOM 0 HB3 GLN A 29 0.728 -5.830 -8.727 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.261 -5.822 -10.639 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.267 -4.601 -9.884 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.896 -6.512 -10.394 1.00 0.00 H new ATOM 0 HE22 GLN A 29 5.137 -7.656 -9.069 1.00 0.00 H new ATOM 452 N VAL A 30 -1.109 -3.290 -7.707 1.00 0.00 N ATOM 453 CA VAL A 30 -2.504 -3.263 -7.257 1.00 0.00 C ATOM 454 C VAL A 30 -3.333 -2.394 -8.199 1.00 0.00 C ATOM 455 O VAL A 30 -4.455 -2.770 -8.548 1.00 0.00 O ATOM 456 CB VAL A 30 -2.620 -2.817 -5.776 1.00 0.00 C ATOM 457 CG1 VAL A 30 -4.078 -2.602 -5.328 1.00 0.00 C ATOM 458 CG2 VAL A 30 -2.016 -3.849 -4.812 1.00 0.00 C ATOM 0 H VAL A 30 -0.440 -2.916 -7.034 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.907 -4.275 -7.294 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.071 -1.876 -5.734 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.096 -2.291 -4.283 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.538 -1.830 -5.944 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.634 -3.533 -5.439 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.120 -3.494 -3.787 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.539 -4.799 -4.922 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.960 -3.988 -5.042 1.00 0.00 H new ATOM 468 N SER A 31 -2.767 -1.285 -8.674 1.00 0.00 N ATOM 469 CA SER A 31 -3.402 -0.444 -9.670 1.00 0.00 C ATOM 470 C SER A 31 -3.646 -1.246 -10.952 1.00 0.00 C ATOM 471 O SER A 31 -4.731 -1.184 -11.530 1.00 0.00 O ATOM 472 CB SER A 31 -2.506 0.783 -9.904 1.00 0.00 C ATOM 473 OG SER A 31 -3.269 1.926 -10.235 1.00 0.00 O ATOM 0 H SER A 31 -1.852 -0.949 -8.373 1.00 0.00 H new ATOM 0 HA SER A 31 -4.377 -0.098 -9.328 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.920 0.983 -9.007 1.00 0.00 H new ATOM 0 HB3 SER A 31 -1.799 0.571 -10.706 1.00 0.00 H new ATOM 0 HG SER A 31 -2.671 2.689 -10.376 1.00 0.00 H new ATOM 479 N GLN A 32 -2.664 -2.050 -11.357 1.00 0.00 N ATOM 480 CA GLN A 32 -2.650 -2.812 -12.599 1.00 0.00 C ATOM 481 C GLN A 32 -3.598 -4.015 -12.516 1.00 0.00 C ATOM 482 O GLN A 32 -4.179 -4.418 -13.526 1.00 0.00 O ATOM 483 CB GLN A 32 -1.186 -3.200 -12.856 1.00 0.00 C ATOM 484 CG GLN A 32 -0.906 -3.997 -14.129 1.00 0.00 C ATOM 485 CD GLN A 32 0.589 -3.932 -14.433 1.00 0.00 C ATOM 486 OE1 GLN A 32 1.026 -3.089 -15.214 1.00 0.00 O ATOM 487 NE2 GLN A 32 1.420 -4.751 -13.813 1.00 0.00 N ATOM 0 H GLN A 32 -1.820 -2.192 -10.802 1.00 0.00 H new ATOM 0 HA GLN A 32 -3.020 -2.227 -13.441 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -0.591 -2.287 -12.887 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -0.833 -3.782 -12.005 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -1.220 -5.033 -14.002 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -1.478 -3.590 -14.962 1.00 0.00 H new ATOM 0 HE21 GLN A 32 1.058 -5.451 -13.165 1.00 0.00 H new ATOM 0 HE22 GLN A 32 2.424 -4.684 -13.982 1.00 0.00 H new ATOM 496 N LEU A 33 -3.799 -4.565 -11.316 1.00 0.00 N ATOM 497 CA LEU A 33 -4.760 -5.629 -11.039 1.00 0.00 C ATOM 498 C LEU A 33 -6.170 -5.052 -10.966 1.00 0.00 C ATOM 499 O LEU A 33 -7.146 -5.740 -11.262 1.00 0.00 O ATOM 500 CB LEU A 33 -4.462 -6.299 -9.686 1.00 0.00 C ATOM 501 CG LEU A 33 -3.162 -7.108 -9.552 1.00 0.00 C ATOM 502 CD1 LEU A 33 -3.199 -7.951 -8.271 1.00 0.00 C ATOM 503 CD2 LEU A 33 -2.940 -7.993 -10.773 1.00 0.00 C ATOM 0 H LEU A 33 -3.281 -4.272 -10.488 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.681 -6.361 -11.843 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.451 -5.520 -8.923 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.294 -6.963 -9.452 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.326 -6.411 -9.491 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.274 -8.521 -8.184 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.304 -7.295 -7.407 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.045 -8.637 -8.311 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -2.013 -8.554 -10.652 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.774 -8.687 -10.876 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.874 -7.371 -11.666 1.00 0.00 H new ATOM 515 N SER A 34 -6.257 -3.792 -10.544 1.00 0.00 N ATOM 516 CA SER A 34 -7.475 -3.042 -10.278 1.00 0.00 C ATOM 517 C SER A 34 -8.451 -3.878 -9.431 1.00 0.00 C ATOM 518 O SER A 34 -9.569 -4.189 -9.858 1.00 0.00 O ATOM 519 CB SER A 34 -8.073 -2.534 -11.599 1.00 0.00 C ATOM 520 OG SER A 34 -7.108 -1.922 -12.450 1.00 0.00 O ATOM 0 H SER A 34 -5.421 -3.234 -10.368 1.00 0.00 H new ATOM 0 HA SER A 34 -7.249 -2.159 -9.681 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.536 -3.368 -12.126 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.864 -1.816 -11.381 1.00 0.00 H new ATOM 0 HG SER A 34 -6.331 -1.649 -11.920 1.00 0.00 H new ATOM 526 N LEU A 35 -8.013 -4.251 -8.220 1.00 0.00 N ATOM 527 CA LEU A 35 -8.845 -4.952 -7.234 1.00 0.00 C ATOM 528 C LEU A 35 -10.140 -4.177 -6.957 1.00 0.00 C ATOM 529 O LEU A 35 -10.141 -2.956 -7.095 1.00 0.00 O ATOM 530 CB LEU A 35 -8.068 -5.179 -5.918 1.00 0.00 C ATOM 531 CG LEU A 35 -7.307 -6.516 -5.828 1.00 0.00 C ATOM 532 CD1 LEU A 35 -6.481 -6.849 -7.060 1.00 0.00 C ATOM 533 CD2 LEU A 35 -6.348 -6.477 -4.639 1.00 0.00 C ATOM 0 H LEU A 35 -7.063 -4.073 -7.895 1.00 0.00 H new ATOM 0 HA LEU A 35 -9.107 -5.923 -7.653 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.355 -4.364 -5.790 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -8.770 -5.122 -5.086 1.00 0.00 H new ATOM 0 HG LEU A 35 -8.076 -7.282 -5.725 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.978 -7.805 -6.914 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.135 -6.912 -7.930 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.737 -6.069 -7.221 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -5.809 -7.422 -4.575 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -5.636 -5.662 -4.772 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.913 -6.318 -3.721 1.00 0.00 H new ATOM 545 N PRO A 36 -11.221 -4.859 -6.534 1.00 0.00 N ATOM 546 CA PRO A 36 -12.537 -4.252 -6.353 1.00 0.00 C ATOM 547 C PRO A 36 -12.553 -3.267 -5.179 1.00 0.00 C ATOM 548 O PRO A 36 -12.270 -2.088 -5.363 1.00 0.00 O ATOM 549 CB PRO A 36 -13.516 -5.430 -6.245 1.00 0.00 C ATOM 550 CG PRO A 36 -12.649 -6.583 -5.738 1.00 0.00 C ATOM 551 CD PRO A 36 -11.304 -6.305 -6.393 1.00 0.00 C ATOM 0 HA PRO A 36 -12.834 -3.618 -7.189 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.331 -5.210 -5.556 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -13.968 -5.664 -7.209 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -12.576 -6.587 -4.650 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -13.051 -7.552 -6.034 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -10.486 -6.686 -5.782 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.233 -6.797 -7.363 1.00 0.00 H new ATOM 559 N LYS A 37 -12.876 -3.700 -3.956 1.00 0.00 N ATOM 560 CA LYS A 37 -12.793 -2.832 -2.775 1.00 0.00 C ATOM 561 C LYS A 37 -12.550 -3.654 -1.518 1.00 0.00 C ATOM 562 O LYS A 37 -11.663 -3.319 -0.738 1.00 0.00 O ATOM 563 CB LYS A 37 -14.056 -1.968 -2.633 1.00 0.00 C ATOM 564 CG LYS A 37 -13.818 -0.756 -1.713 1.00 0.00 C ATOM 565 CD LYS A 37 -13.828 0.626 -2.381 1.00 0.00 C ATOM 566 CE LYS A 37 -12.579 0.979 -3.206 1.00 0.00 C ATOM 567 NZ LYS A 37 -12.645 0.521 -4.609 1.00 0.00 N ATOM 0 H LYS A 37 -13.198 -4.647 -3.757 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.945 -2.160 -2.910 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.372 -1.621 -3.617 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.868 -2.574 -2.233 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.581 -0.764 -0.935 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.856 -0.888 -1.217 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -14.700 0.688 -3.032 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -13.954 1.382 -1.606 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.439 2.060 -3.192 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -11.703 0.538 -2.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -11.838 0.907 -5.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.612 -0.518 -4.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.532 0.851 -5.041 1.00 0.00 H new ATOM 581 N LEU A 38 -13.281 -4.762 -1.360 1.00 0.00 N ATOM 582 CA LEU A 38 -13.084 -5.723 -0.275 1.00 0.00 C ATOM 583 C LEU A 38 -11.623 -6.163 -0.290 1.00 0.00 C ATOM 584 O LEU A 38 -10.894 -6.009 0.685 1.00 0.00 O ATOM 585 CB LEU A 38 -14.045 -6.918 -0.467 1.00 0.00 C ATOM 586 CG LEU A 38 -13.710 -8.186 0.353 1.00 0.00 C ATOM 587 CD1 LEU A 38 -13.633 -7.935 1.862 1.00 0.00 C ATOM 588 CD2 LEU A 38 -14.757 -9.266 0.062 1.00 0.00 C ATOM 0 H LEU A 38 -14.038 -5.019 -1.994 1.00 0.00 H new ATOM 0 HA LEU A 38 -13.306 -5.275 0.694 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -15.053 -6.595 -0.207 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -14.058 -7.184 -1.524 1.00 0.00 H new ATOM 0 HG LEU A 38 -12.717 -8.512 0.043 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -13.395 -8.867 2.374 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -12.857 -7.198 2.069 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -14.593 -7.561 2.218 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -14.525 -10.162 0.638 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -15.745 -8.900 0.342 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -14.747 -9.505 -1.001 1.00 0.00 H new ATOM 600 N VAL A 39 -11.206 -6.692 -1.437 1.00 0.00 N ATOM 601 CA VAL A 39 -9.875 -7.264 -1.604 1.00 0.00 C ATOM 602 C VAL A 39 -8.835 -6.150 -1.727 1.00 0.00 C ATOM 603 O VAL A 39 -7.683 -6.347 -1.353 1.00 0.00 O ATOM 604 CB VAL A 39 -9.880 -8.248 -2.790 1.00 0.00 C ATOM 605 CG1 VAL A 39 -8.592 -9.081 -2.864 1.00 0.00 C ATOM 606 CG2 VAL A 39 -11.080 -9.195 -2.638 1.00 0.00 C ATOM 0 H VAL A 39 -11.783 -6.736 -2.277 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.593 -7.841 -0.724 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.948 -7.665 -3.709 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.645 -9.758 -3.716 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.736 -8.417 -2.981 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.480 -9.660 -1.947 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.097 -9.898 -3.471 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.993 -9.745 -1.701 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -12.003 -8.615 -2.634 1.00 0.00 H new ATOM 616 N GLU A 40 -9.223 -4.961 -2.196 1.00 0.00 N ATOM 617 CA GLU A 40 -8.321 -3.821 -2.214 1.00 0.00 C ATOM 618 C GLU A 40 -7.902 -3.502 -0.773 1.00 0.00 C ATOM 619 O GLU A 40 -6.715 -3.360 -0.523 1.00 0.00 O ATOM 620 CB GLU A 40 -8.977 -2.634 -2.929 1.00 0.00 C ATOM 621 CG GLU A 40 -8.037 -1.427 -2.982 1.00 0.00 C ATOM 622 CD GLU A 40 -8.533 -0.330 -3.922 1.00 0.00 C ATOM 623 OE1 GLU A 40 -9.745 -0.018 -3.965 1.00 0.00 O ATOM 624 OE2 GLU A 40 -7.704 0.273 -4.635 1.00 0.00 O ATOM 0 H GLU A 40 -10.154 -4.769 -2.566 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.418 -4.052 -2.779 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.255 -2.926 -3.942 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -9.897 -2.359 -2.413 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.925 -1.016 -1.979 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.049 -1.756 -3.304 1.00 0.00 H new ATOM 631 N GLN A 41 -8.825 -3.497 0.194 1.00 0.00 N ATOM 632 CA GLN A 41 -8.521 -3.238 1.607 1.00 0.00 C ATOM 633 C GLN A 41 -7.546 -4.271 2.199 1.00 0.00 C ATOM 634 O GLN A 41 -6.894 -3.997 3.210 1.00 0.00 O ATOM 635 CB GLN A 41 -9.838 -3.216 2.399 1.00 0.00 C ATOM 636 CG GLN A 41 -9.792 -2.373 3.688 1.00 0.00 C ATOM 637 CD GLN A 41 -11.171 -2.154 4.326 1.00 0.00 C ATOM 638 OE1 GLN A 41 -11.441 -1.124 4.945 1.00 0.00 O ATOM 639 NE2 GLN A 41 -12.079 -3.110 4.224 1.00 0.00 N ATOM 0 H GLN A 41 -9.814 -3.674 0.017 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.022 -2.272 1.679 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.628 -2.830 1.755 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.109 -4.239 2.658 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.140 -2.864 4.411 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.346 -1.404 3.463 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.863 -3.966 3.713 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.995 -2.991 4.656 1.00 0.00 H new ATOM 648 N VAL A 42 -7.454 -5.458 1.594 1.00 0.00 N ATOM 649 CA VAL A 42 -6.504 -6.505 1.942 1.00 0.00 C ATOM 650 C VAL A 42 -5.162 -6.151 1.319 1.00 0.00 C ATOM 651 O VAL A 42 -4.220 -5.881 2.057 1.00 0.00 O ATOM 652 CB VAL A 42 -7.080 -7.874 1.521 1.00 0.00 C ATOM 653 CG1 VAL A 42 -6.102 -9.052 1.517 1.00 0.00 C ATOM 654 CG2 VAL A 42 -8.223 -8.178 2.486 1.00 0.00 C ATOM 0 H VAL A 42 -8.064 -5.721 0.820 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.337 -6.581 3.016 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.384 -7.780 0.479 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.623 -9.957 1.205 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.286 -8.845 0.824 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.699 -9.194 2.520 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.668 -9.140 2.232 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.839 -8.214 3.505 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.980 -7.397 2.411 1.00 0.00 H new ATOM 664 N ALA A 43 -5.078 -6.065 -0.011 1.00 0.00 N ATOM 665 CA ALA A 43 -3.825 -5.755 -0.690 1.00 0.00 C ATOM 666 C ALA A 43 -3.232 -4.412 -0.243 1.00 0.00 C ATOM 667 O ALA A 43 -2.022 -4.231 -0.344 1.00 0.00 O ATOM 668 CB ALA A 43 -4.049 -5.767 -2.202 1.00 0.00 C ATOM 0 H ALA A 43 -5.869 -6.207 -0.639 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.100 -6.522 -0.418 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.113 -5.535 -2.710 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.395 -6.753 -2.511 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.799 -5.021 -2.465 1.00 0.00 H new ATOM 674 N LEU A 44 -4.069 -3.491 0.247 1.00 0.00 N ATOM 675 CA LEU A 44 -3.687 -2.206 0.804 1.00 0.00 C ATOM 676 C LEU A 44 -3.043 -2.350 2.171 1.00 0.00 C ATOM 677 O LEU A 44 -2.116 -1.597 2.457 1.00 0.00 O ATOM 678 CB LEU A 44 -4.876 -1.237 0.918 1.00 0.00 C ATOM 679 CG LEU A 44 -5.253 -0.498 -0.381 1.00 0.00 C ATOM 680 CD1 LEU A 44 -6.478 0.382 -0.102 1.00 0.00 C ATOM 681 CD2 LEU A 44 -4.119 0.382 -0.927 1.00 0.00 C ATOM 0 H LEU A 44 -5.078 -3.637 0.263 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.962 -1.791 0.104 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.746 -1.795 1.264 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.647 -0.496 1.684 1.00 0.00 H new ATOM 0 HG LEU A 44 -5.462 -1.253 -1.139 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.759 0.913 -1.011 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.309 -0.244 0.224 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -6.238 1.103 0.680 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.449 0.874 -1.842 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.854 1.135 -0.185 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -3.249 -0.238 -1.142 1.00 0.00 H new ATOM 693 N ASN A 45 -3.517 -3.269 3.020 1.00 0.00 N ATOM 694 CA ASN A 45 -2.991 -3.411 4.380 1.00 0.00 C ATOM 695 C ASN A 45 -1.951 -4.521 4.455 1.00 0.00 C ATOM 696 O ASN A 45 -1.688 -5.049 5.538 1.00 0.00 O ATOM 697 CB ASN A 45 -4.128 -3.605 5.389 1.00 0.00 C ATOM 698 CG ASN A 45 -4.754 -2.264 5.710 1.00 0.00 C ATOM 699 OD1 ASN A 45 -4.199 -1.484 6.477 1.00 0.00 O ATOM 700 ND2 ASN A 45 -5.900 -1.971 5.124 1.00 0.00 N ATOM 0 H ASN A 45 -4.263 -3.924 2.788 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.481 -2.486 4.649 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -4.880 -4.280 4.980 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -3.746 -4.067 6.299 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -6.350 -1.074 5.304 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -6.335 -2.642 4.491 1.00 0.00 H new ATOM 707 N ALA A 46 -1.357 -4.896 3.322 1.00 0.00 N ATOM 708 CA ALA A 46 -0.331 -5.907 3.265 1.00 0.00 C ATOM 709 C ALA A 46 0.805 -5.479 2.361 1.00 0.00 C ATOM 710 O ALA A 46 0.604 -4.702 1.435 1.00 0.00 O ATOM 711 CB ALA A 46 -0.948 -7.186 2.714 1.00 0.00 C ATOM 0 H ALA A 46 -1.586 -4.494 2.413 1.00 0.00 H new ATOM 0 HA ALA A 46 0.068 -6.064 4.267 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.187 -7.964 2.663 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.756 -7.511 3.369 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.343 -6.999 1.715 1.00 0.00 H new ATOM 717 N TRP A 47 1.992 -6.006 2.629 1.00 0.00 N ATOM 718 CA TRP A 47 3.163 -5.821 1.789 1.00 0.00 C ATOM 719 C TRP A 47 3.395 -7.146 1.079 1.00 0.00 C ATOM 720 O TRP A 47 3.013 -8.213 1.574 1.00 0.00 O ATOM 721 CB TRP A 47 4.371 -5.324 2.586 1.00 0.00 C ATOM 722 CG TRP A 47 4.899 -6.180 3.692 1.00 0.00 C ATOM 723 CD1 TRP A 47 4.511 -6.112 4.985 1.00 0.00 C ATOM 724 CD2 TRP A 47 5.993 -7.149 3.649 1.00 0.00 C ATOM 725 NE1 TRP A 47 5.319 -6.930 5.747 1.00 0.00 N ATOM 726 CE2 TRP A 47 6.278 -7.558 4.986 1.00 0.00 C ATOM 727 CE3 TRP A 47 6.824 -7.667 2.632 1.00 0.00 C ATOM 728 CZ2 TRP A 47 7.337 -8.421 5.302 1.00 0.00 C ATOM 729 CZ3 TRP A 47 7.883 -8.543 2.938 1.00 0.00 C ATOM 730 CH2 TRP A 47 8.141 -8.919 4.267 1.00 0.00 C ATOM 0 H TRP A 47 2.169 -6.584 3.451 1.00 0.00 H new ATOM 0 HA TRP A 47 3.004 -5.035 1.051 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.185 -5.154 1.882 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.111 -4.355 3.012 1.00 0.00 H new ATOM 0 HD1 TRP A 47 3.696 -5.512 5.362 1.00 0.00 H new ATOM 0 HE1 TRP A 47 5.218 -7.054 6.754 1.00 0.00 H new ATOM 0 HE3 TRP A 47 6.645 -7.387 1.604 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 7.531 -8.698 6.328 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 8.503 -8.930 2.143 1.00 0.00 H new ATOM 0 HH2 TRP A 47 8.957 -9.590 4.491 1.00 0.00 H new ATOM 741 N LYS A 48 4.017 -7.082 -0.093 1.00 0.00 N ATOM 742 CA LYS A 48 4.186 -8.232 -0.952 1.00 0.00 C ATOM 743 C LYS A 48 5.616 -8.721 -0.973 1.00 0.00 C ATOM 744 O LYS A 48 6.502 -8.033 -1.483 1.00 0.00 O ATOM 745 CB LYS A 48 3.696 -7.869 -2.358 1.00 0.00 C ATOM 746 CG LYS A 48 3.650 -9.100 -3.272 1.00 0.00 C ATOM 747 CD LYS A 48 4.323 -8.978 -4.646 1.00 0.00 C ATOM 748 CE LYS A 48 5.847 -9.073 -4.611 1.00 0.00 C ATOM 749 NZ LYS A 48 6.505 -7.787 -4.305 1.00 0.00 N ATOM 0 H LYS A 48 4.418 -6.223 -0.469 1.00 0.00 H new ATOM 0 HA LYS A 48 3.593 -9.058 -0.560 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.703 -7.424 -2.295 1.00 0.00 H new ATOM 0 HB3 LYS A 48 4.355 -7.117 -2.791 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.113 -9.932 -2.742 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.605 -9.365 -3.430 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.937 -9.762 -5.297 1.00 0.00 H new ATOM 0 HD3 LYS A 48 4.040 -8.025 -5.092 1.00 0.00 H new ATOM 0 HE2 LYS A 48 6.141 -9.811 -3.864 1.00 0.00 H new ATOM 0 HE3 LYS A 48 6.204 -9.436 -5.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 7.450 -7.769 -4.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 5.935 -7.006 -4.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 6.594 -7.679 -3.274 1.00 0.00 H new ATOM 763 N GLU A 49 5.827 -9.912 -0.444 1.00 0.00 N ATOM 764 CA GLU A 49 7.080 -10.634 -0.477 1.00 0.00 C ATOM 765 C GLU A 49 6.948 -11.605 -1.659 1.00 0.00 C ATOM 766 O GLU A 49 5.847 -12.094 -1.921 1.00 0.00 O ATOM 767 CB GLU A 49 7.213 -11.387 0.845 1.00 0.00 C ATOM 768 CG GLU A 49 8.586 -12.029 1.066 1.00 0.00 C ATOM 769 CD GLU A 49 8.466 -13.490 1.494 1.00 0.00 C ATOM 770 OE1 GLU A 49 7.716 -13.783 2.457 1.00 0.00 O ATOM 771 OE2 GLU A 49 9.082 -14.358 0.836 1.00 0.00 O ATOM 0 H GLU A 49 5.092 -10.425 0.043 1.00 0.00 H new ATOM 0 HA GLU A 49 7.958 -9.999 -0.597 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.010 -10.698 1.665 1.00 0.00 H new ATOM 0 HB3 GLU A 49 6.450 -12.164 0.886 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.169 -11.966 0.147 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.130 -11.471 1.828 1.00 0.00 H new ATOM 778 N GLU A 50 8.019 -11.901 -2.387 1.00 0.00 N ATOM 779 CA GLU A 50 7.975 -12.767 -3.566 1.00 0.00 C ATOM 780 C GLU A 50 9.053 -13.846 -3.459 1.00 0.00 C ATOM 781 O GLU A 50 10.117 -13.621 -2.870 1.00 0.00 O ATOM 782 CB GLU A 50 8.065 -11.879 -4.820 1.00 0.00 C ATOM 783 CG GLU A 50 8.470 -12.598 -6.116 1.00 0.00 C ATOM 784 CD GLU A 50 8.415 -11.698 -7.360 1.00 0.00 C ATOM 785 OE1 GLU A 50 7.631 -10.716 -7.402 1.00 0.00 O ATOM 786 OE2 GLU A 50 9.146 -11.967 -8.341 1.00 0.00 O ATOM 0 H GLU A 50 8.951 -11.545 -2.176 1.00 0.00 H new ATOM 0 HA GLU A 50 7.036 -13.315 -3.638 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.097 -11.404 -4.977 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.784 -11.082 -4.628 1.00 0.00 H new ATOM 0 HG2 GLU A 50 9.482 -12.988 -6.004 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.813 -13.454 -6.268 1.00 0.00 H new ATOM 793 N SER A 51 8.769 -15.010 -4.042 1.00 0.00 N ATOM 794 CA SER A 51 9.637 -16.153 -4.192 1.00 0.00 C ATOM 795 C SER A 51 9.509 -16.595 -5.657 1.00 0.00 C ATOM 796 O SER A 51 8.642 -16.110 -6.390 1.00 0.00 O ATOM 797 CB SER A 51 9.188 -17.250 -3.205 1.00 0.00 C ATOM 798 OG SER A 51 10.198 -17.551 -2.254 1.00 0.00 O ATOM 0 H SER A 51 7.850 -15.181 -4.451 1.00 0.00 H new ATOM 0 HA SER A 51 10.680 -15.932 -3.967 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.286 -16.925 -2.686 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.930 -18.153 -3.758 1.00 0.00 H new ATOM 0 HG SER A 51 9.877 -18.248 -1.645 1.00 0.00 H new ATOM 804 N ASP A 52 10.342 -17.553 -6.052 1.00 0.00 N ATOM 805 CA ASP A 52 10.528 -18.093 -7.398 1.00 0.00 C ATOM 806 C ASP A 52 9.247 -18.143 -8.233 1.00 0.00 C ATOM 807 O ASP A 52 9.185 -17.525 -9.296 1.00 0.00 O ATOM 808 CB ASP A 52 11.112 -19.493 -7.217 1.00 0.00 C ATOM 809 CG ASP A 52 11.152 -20.311 -8.503 1.00 0.00 C ATOM 810 OD1 ASP A 52 11.712 -19.843 -9.517 1.00 0.00 O ATOM 811 OD2 ASP A 52 10.670 -21.463 -8.452 1.00 0.00 O ATOM 0 H ASP A 52 10.958 -18.012 -5.381 1.00 0.00 H new ATOM 0 HA ASP A 52 11.190 -17.434 -7.959 1.00 0.00 H new ATOM 0 HB2 ASP A 52 12.123 -19.407 -6.820 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.523 -20.030 -6.474 1.00 0.00 H new ATOM 816 N ASN A 53 8.201 -18.794 -7.720 1.00 0.00 N ATOM 817 CA ASN A 53 6.878 -18.858 -8.349 1.00 0.00 C ATOM 818 C ASN A 53 5.772 -18.532 -7.334 1.00 0.00 C ATOM 819 O ASN A 53 4.593 -18.785 -7.610 1.00 0.00 O ATOM 820 CB ASN A 53 6.674 -20.248 -9.003 1.00 0.00 C ATOM 821 CG ASN A 53 6.940 -20.264 -10.507 1.00 0.00 C ATOM 822 OD1 ASN A 53 7.900 -20.872 -10.966 1.00 0.00 O ATOM 823 ND2 ASN A 53 6.089 -19.658 -11.321 1.00 0.00 N ATOM 0 H ASN A 53 8.250 -19.302 -6.837 1.00 0.00 H new ATOM 0 HA ASN A 53 6.818 -18.104 -9.134 1.00 0.00 H new ATOM 0 HB2 ASN A 53 7.334 -20.968 -8.519 1.00 0.00 H new ATOM 0 HB3 ASN A 53 5.652 -20.579 -8.820 1.00 0.00 H new ATOM 0 HD21 ASN A 53 6.233 -19.697 -12.330 1.00 0.00 H new ATOM 0 HD22 ASN A 53 5.290 -19.152 -10.939 1.00 0.00 H new ATOM 830 N ALA A 54 6.107 -17.957 -6.171 1.00 0.00 N ATOM 831 CA ALA A 54 5.151 -17.735 -5.098 1.00 0.00 C ATOM 832 C ALA A 54 5.194 -16.285 -4.657 1.00 0.00 C ATOM 833 O ALA A 54 6.144 -15.558 -4.954 1.00 0.00 O ATOM 834 CB ALA A 54 5.482 -18.673 -3.932 1.00 0.00 C ATOM 0 H ALA A 54 7.051 -17.636 -5.956 1.00 0.00 H new ATOM 0 HA ALA A 54 4.142 -17.950 -5.449 1.00 0.00 H new ATOM 0 HB1 ALA A 54 4.770 -18.513 -3.123 1.00 0.00 H new ATOM 0 HB2 ALA A 54 5.422 -19.708 -4.269 1.00 0.00 H new ATOM 0 HB3 ALA A 54 6.490 -18.466 -3.574 1.00 0.00 H new ATOM 840 N VAL A 55 4.168 -15.867 -3.928 1.00 0.00 N ATOM 841 CA VAL A 55 4.064 -14.531 -3.383 1.00 0.00 C ATOM 842 C VAL A 55 3.431 -14.658 -1.998 1.00 0.00 C ATOM 843 O VAL A 55 2.356 -15.228 -1.844 1.00 0.00 O ATOM 844 CB VAL A 55 3.269 -13.631 -4.349 1.00 0.00 C ATOM 845 CG1 VAL A 55 3.225 -12.208 -3.812 1.00 0.00 C ATOM 846 CG2 VAL A 55 3.915 -13.498 -5.740 1.00 0.00 C ATOM 0 H VAL A 55 3.373 -16.463 -3.698 1.00 0.00 H new ATOM 0 HA VAL A 55 5.037 -14.052 -3.273 1.00 0.00 H new ATOM 0 HB VAL A 55 2.290 -14.104 -4.431 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.662 -11.577 -4.499 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.741 -12.203 -2.835 1.00 0.00 H new ATOM 0 HG13 VAL A 55 4.241 -11.824 -3.716 1.00 0.00 H new ATOM 0 HG21 VAL A 55 3.301 -12.851 -6.366 1.00 0.00 H new ATOM 0 HG22 VAL A 55 4.911 -13.067 -5.639 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.991 -14.483 -6.201 1.00 0.00 H new ATOM 856 N CYS A 56 4.089 -14.137 -0.972 1.00 0.00 N ATOM 857 CA CYS A 56 3.554 -14.083 0.380 1.00 0.00 C ATOM 858 C CYS A 56 3.072 -12.659 0.632 1.00 0.00 C ATOM 859 O CYS A 56 3.853 -11.710 0.593 1.00 0.00 O ATOM 860 CB CYS A 56 4.604 -14.555 1.390 1.00 0.00 C ATOM 861 SG CYS A 56 5.088 -16.256 0.987 1.00 0.00 S ATOM 0 H CYS A 56 5.022 -13.735 -1.057 1.00 0.00 H new ATOM 0 HA CYS A 56 2.708 -14.759 0.500 1.00 0.00 H new ATOM 0 HB2 CYS A 56 5.474 -13.899 1.362 1.00 0.00 H new ATOM 0 HB3 CYS A 56 4.201 -14.508 2.402 1.00 0.00 H new ATOM 0 HG CYS A 56 5.981 -16.666 1.838 1.00 0.00 H new ATOM 867 N LEU A 57 1.775 -12.493 0.859 1.00 0.00 N ATOM 868 CA LEU A 57 1.139 -11.222 1.170 1.00 0.00 C ATOM 869 C LEU A 57 1.109 -11.068 2.687 1.00 0.00 C ATOM 870 O LEU A 57 0.278 -11.673 3.366 1.00 0.00 O ATOM 871 CB LEU A 57 -0.263 -11.184 0.527 1.00 0.00 C ATOM 872 CG LEU A 57 -0.409 -10.194 -0.639 1.00 0.00 C ATOM 873 CD1 LEU A 57 -0.449 -8.762 -0.123 1.00 0.00 C ATOM 874 CD2 LEU A 57 0.691 -10.329 -1.688 1.00 0.00 C ATOM 0 H LEU A 57 1.114 -13.269 0.830 1.00 0.00 H new ATOM 0 HA LEU A 57 1.693 -10.378 0.759 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.511 -12.184 0.170 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.993 -10.929 1.295 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.351 -10.442 -1.128 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.553 -8.075 -0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.297 -8.642 0.551 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.474 -8.543 0.413 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.527 -9.601 -2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.661 -10.148 -1.224 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.672 -11.335 -2.108 1.00 0.00 H new ATOM 886 N HIS A 58 2.056 -10.307 3.232 1.00 0.00 N ATOM 887 CA HIS A 58 2.182 -10.072 4.666 1.00 0.00 C ATOM 888 C HIS A 58 1.202 -8.971 5.056 1.00 0.00 C ATOM 889 O HIS A 58 1.518 -7.794 4.879 1.00 0.00 O ATOM 890 CB HIS A 58 3.619 -9.662 5.021 1.00 0.00 C ATOM 891 CG HIS A 58 4.695 -10.707 4.839 1.00 0.00 C ATOM 892 ND1 HIS A 58 5.634 -11.078 5.784 1.00 0.00 N ATOM 893 CD2 HIS A 58 5.031 -11.328 3.669 1.00 0.00 C ATOM 894 CE1 HIS A 58 6.524 -11.890 5.186 1.00 0.00 C ATOM 895 NE2 HIS A 58 6.161 -12.082 3.913 1.00 0.00 N ATOM 0 H HIS A 58 2.768 -9.829 2.679 1.00 0.00 H new ATOM 0 HA HIS A 58 1.954 -10.986 5.214 1.00 0.00 H new ATOM 0 HB2 HIS A 58 3.883 -8.795 4.416 1.00 0.00 H new ATOM 0 HB3 HIS A 58 3.632 -9.340 6.062 1.00 0.00 H new ATOM 0 HD2 HIS A 58 4.509 -11.244 2.727 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.395 -12.319 5.659 1.00 0.00 H new ATOM 0 HE2 HIS A 58 6.637 -12.682 3.239 1.00 0.00 H new ATOM 904 N LEU A 59 0.014 -9.325 5.542 1.00 0.00 N ATOM 905 CA LEU A 59 -1.006 -8.374 5.968 1.00 0.00 C ATOM 906 C LEU A 59 -0.778 -8.010 7.425 1.00 0.00 C ATOM 907 O LEU A 59 -0.371 -8.853 8.228 1.00 0.00 O ATOM 908 CB LEU A 59 -2.410 -8.995 5.797 1.00 0.00 C ATOM 909 CG LEU A 59 -3.569 -7.991 6.035 1.00 0.00 C ATOM 910 CD1 LEU A 59 -4.354 -7.675 4.763 1.00 0.00 C ATOM 911 CD2 LEU A 59 -4.613 -8.528 7.005 1.00 0.00 C ATOM 0 H LEU A 59 -0.270 -10.298 5.652 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.941 -7.476 5.354 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.496 -9.404 4.790 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.516 -9.829 6.490 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.064 -7.107 6.424 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -5.151 -6.968 4.993 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.685 -7.239 4.021 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.787 -8.593 4.365 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.402 -7.788 7.137 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.041 -9.447 6.606 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.144 -8.734 7.967 1.00 0.00 H new ATOM 923 N ARG A 60 -1.052 -6.753 7.778 1.00 0.00 N ATOM 924 CA ARG A 60 -1.014 -6.312 9.160 1.00 0.00 C ATOM 925 C ARG A 60 -2.076 -7.122 9.886 1.00 0.00 C ATOM 926 O ARG A 60 -3.269 -6.993 9.598 1.00 0.00 O ATOM 927 CB ARG A 60 -1.363 -4.823 9.295 1.00 0.00 C ATOM 928 CG ARG A 60 -0.334 -3.830 8.743 1.00 0.00 C ATOM 929 CD ARG A 60 0.902 -3.738 9.651 1.00 0.00 C ATOM 930 NE ARG A 60 1.652 -2.495 9.394 1.00 0.00 N ATOM 931 CZ ARG A 60 1.617 -1.378 10.132 1.00 0.00 C ATOM 932 NH1 ARG A 60 0.823 -1.271 11.193 1.00 0.00 N ATOM 933 NH2 ARG A 60 2.391 -0.354 9.801 1.00 0.00 N ATOM 0 H ARG A 60 -1.304 -6.021 7.113 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.013 -6.452 9.567 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -2.313 -4.647 8.790 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -1.518 -4.603 10.351 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -0.030 -4.138 7.743 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -0.791 -2.845 8.648 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.594 -3.772 10.696 1.00 0.00 H new ATOM 0 HD3 ARG A 60 1.548 -4.599 9.481 1.00 0.00 H new ATOM 0 HE ARG A 60 2.257 -2.485 8.573 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.222 -2.050 11.461 1.00 0.00 H new ATOM 0 HH12 ARG A 60 0.815 -0.409 11.739 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.006 -0.421 8.990 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.371 0.501 10.357 1.00 0.00 H new ATOM 947 N SER A 61 -1.668 -7.926 10.854 1.00 0.00 N ATOM 948 CA SER A 61 -2.555 -8.668 11.733 1.00 0.00 C ATOM 949 C SER A 61 -3.519 -7.702 12.440 1.00 0.00 C ATOM 950 O SER A 61 -4.642 -8.076 12.786 1.00 0.00 O ATOM 951 CB SER A 61 -1.723 -9.499 12.715 1.00 0.00 C ATOM 952 OG SER A 61 -0.681 -8.731 13.286 1.00 0.00 O ATOM 0 H SER A 61 -0.681 -8.085 11.055 1.00 0.00 H new ATOM 0 HA SER A 61 -3.167 -9.362 11.157 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.368 -9.885 13.505 1.00 0.00 H new ATOM 0 HB3 SER A 61 -1.301 -10.361 12.198 1.00 0.00 H new ATOM 0 HG SER A 61 -0.067 -8.437 12.581 1.00 0.00 H new ATOM 958 N SER A 62 -3.130 -6.432 12.584 1.00 0.00 N ATOM 959 CA SER A 62 -3.914 -5.345 13.148 1.00 0.00 C ATOM 960 C SER A 62 -5.206 -5.129 12.333 1.00 0.00 C ATOM 961 O SER A 62 -6.245 -4.778 12.895 1.00 0.00 O ATOM 962 CB SER A 62 -3.031 -4.082 13.160 1.00 0.00 C ATOM 963 OG SER A 62 -1.643 -4.383 13.281 1.00 0.00 O ATOM 0 H SER A 62 -2.203 -6.124 12.290 1.00 0.00 H new ATOM 0 HA SER A 62 -4.222 -5.583 14.166 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.198 -3.518 12.242 1.00 0.00 H new ATOM 0 HB3 SER A 62 -3.333 -3.440 13.988 1.00 0.00 H new ATOM 0 HG SER A 62 -1.127 -3.550 13.282 1.00 0.00 H new ATOM 969 N GLN A 63 -5.180 -5.438 11.030 1.00 0.00 N ATOM 970 CA GLN A 63 -6.279 -5.323 10.073 1.00 0.00 C ATOM 971 C GLN A 63 -6.712 -6.697 9.525 1.00 0.00 C ATOM 972 O GLN A 63 -7.457 -6.756 8.539 1.00 0.00 O ATOM 973 CB GLN A 63 -5.880 -4.357 8.936 1.00 0.00 C ATOM 974 CG GLN A 63 -5.898 -2.873 9.332 1.00 0.00 C ATOM 975 CD GLN A 63 -4.748 -2.469 10.246 1.00 0.00 C ATOM 976 OE1 GLN A 63 -3.583 -2.711 9.970 1.00 0.00 O ATOM 977 NE2 GLN A 63 -5.035 -1.841 11.374 1.00 0.00 N ATOM 0 H GLN A 63 -4.333 -5.799 10.591 1.00 0.00 H new ATOM 0 HA GLN A 63 -7.145 -4.914 10.592 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -4.880 -4.616 8.589 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -6.557 -4.505 8.095 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -5.863 -2.265 8.428 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -6.842 -2.650 9.830 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -6.006 -1.636 11.611 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -4.286 -1.562 12.007 1.00 0.00 H new ATOM 986 N ARG A 64 -6.301 -7.824 10.134 1.00 0.00 N ATOM 987 CA ARG A 64 -6.693 -9.157 9.655 1.00 0.00 C ATOM 988 C ARG A 64 -8.192 -9.412 9.633 1.00 0.00 C ATOM 989 O ARG A 64 -8.597 -10.403 9.038 1.00 0.00 O ATOM 990 CB ARG A 64 -5.880 -10.301 10.272 1.00 0.00 C ATOM 991 CG ARG A 64 -6.257 -10.755 11.688 1.00 0.00 C ATOM 992 CD ARG A 64 -7.318 -11.870 11.672 1.00 0.00 C ATOM 993 NE ARG A 64 -7.705 -12.279 13.025 1.00 0.00 N ATOM 994 CZ ARG A 64 -7.061 -13.134 13.824 1.00 0.00 C ATOM 995 NH1 ARG A 64 -5.959 -13.749 13.418 1.00 0.00 N ATOM 996 NH2 ARG A 64 -7.527 -13.336 15.052 1.00 0.00 N ATOM 0 H ARG A 64 -5.699 -7.836 10.957 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.414 -9.147 8.601 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -5.958 -11.164 9.610 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.832 -10.001 10.283 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -5.365 -11.110 12.204 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.635 -9.903 12.253 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.199 -11.524 11.132 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -6.930 -12.732 11.130 1.00 0.00 H new ATOM 0 HE ARG A 64 -8.560 -11.865 13.397 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.591 -13.572 12.483 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -5.479 -14.399 14.040 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -8.362 -12.842 15.368 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.050 -13.985 15.678 1.00 0.00 H new ATOM 1010 N HIS A 65 -9.023 -8.522 10.185 1.00 0.00 N ATOM 1011 CA HIS A 65 -10.476 -8.621 10.078 1.00 0.00 C ATOM 1012 C HIS A 65 -10.932 -8.734 8.614 1.00 0.00 C ATOM 1013 O HIS A 65 -12.074 -9.119 8.383 1.00 0.00 O ATOM 1014 CB HIS A 65 -11.129 -7.381 10.708 1.00 0.00 C ATOM 1015 CG HIS A 65 -10.964 -7.305 12.199 1.00 0.00 C ATOM 1016 ND1 HIS A 65 -10.425 -6.254 12.917 1.00 0.00 N ATOM 1017 CD2 HIS A 65 -11.294 -8.296 13.076 1.00 0.00 C ATOM 1018 CE1 HIS A 65 -10.427 -6.610 14.214 1.00 0.00 C ATOM 1019 NE2 HIS A 65 -10.935 -7.847 14.328 1.00 0.00 N ATOM 0 H HIS A 65 -8.704 -7.713 10.718 1.00 0.00 H new ATOM 0 HA HIS A 65 -10.784 -9.523 10.606 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -10.699 -6.486 10.257 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -12.192 -7.379 10.468 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -11.748 -9.246 12.836 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -10.076 -5.999 15.032 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -11.038 -8.369 15.198 1.00 0.00 H new ATOM 1028 N LEU A 66 -10.082 -8.385 7.637 1.00 0.00 N ATOM 1029 CA LEU A 66 -10.366 -8.542 6.217 1.00 0.00 C ATOM 1030 C LEU A 66 -9.571 -9.684 5.572 1.00 0.00 C ATOM 1031 O LEU A 66 -9.910 -10.030 4.440 1.00 0.00 O ATOM 1032 CB LEU A 66 -10.082 -7.228 5.464 1.00 0.00 C ATOM 1033 CG LEU A 66 -11.033 -6.041 5.691 1.00 0.00 C ATOM 1034 CD1 LEU A 66 -12.486 -6.390 5.348 1.00 0.00 C ATOM 1035 CD2 LEU A 66 -10.980 -5.438 7.096 1.00 0.00 C ATOM 0 H LEU A 66 -9.165 -7.980 7.823 1.00 0.00 H new ATOM 0 HA LEU A 66 -11.423 -8.796 6.140 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.075 -6.904 5.728 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.076 -7.450 4.397 1.00 0.00 H new ATOM 0 HG LEU A 66 -10.663 -5.280 5.004 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.120 -5.521 5.524 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.552 -6.681 4.300 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.820 -7.216 5.976 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.683 -4.608 7.162 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.247 -6.199 7.829 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.972 -5.076 7.299 1.00 0.00 H new ATOM 1047 N ASN A 67 -8.550 -10.278 6.216 1.00 0.00 N ATOM 1048 CA ASN A 67 -7.852 -11.445 5.662 1.00 0.00 C ATOM 1049 C ASN A 67 -8.831 -12.599 5.654 1.00 0.00 C ATOM 1050 O ASN A 67 -9.086 -13.207 6.692 1.00 0.00 O ATOM 1051 CB ASN A 67 -6.605 -11.914 6.431 1.00 0.00 C ATOM 1052 CG ASN A 67 -6.082 -13.224 5.834 1.00 0.00 C ATOM 1053 OD1 ASN A 67 -6.224 -13.479 4.637 1.00 0.00 O ATOM 1054 ND2 ASN A 67 -5.475 -14.084 6.621 1.00 0.00 N ATOM 0 H ASN A 67 -8.193 -9.967 7.119 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.500 -11.137 4.677 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -5.830 -11.149 6.384 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -6.849 -12.057 7.484 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -5.122 -14.962 6.241 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -5.357 -13.873 7.612 1.00 0.00 H new ATOM 1061 N ASN A 68 -9.430 -12.854 4.503 1.00 0.00 N ATOM 1062 CA ASN A 68 -10.368 -13.954 4.338 1.00 0.00 C ATOM 1063 C ASN A 68 -10.047 -14.772 3.096 1.00 0.00 C ATOM 1064 O ASN A 68 -9.391 -14.273 2.177 1.00 0.00 O ATOM 1065 CB ASN A 68 -11.798 -13.417 4.372 1.00 0.00 C ATOM 1066 CG ASN A 68 -12.202 -12.703 3.099 1.00 0.00 C ATOM 1067 OD1 ASN A 68 -12.733 -13.314 2.179 1.00 0.00 O ATOM 1068 ND2 ASN A 68 -11.951 -11.412 2.992 1.00 0.00 N ATOM 0 H ASN A 68 -9.281 -12.305 3.656 1.00 0.00 H new ATOM 0 HA ASN A 68 -10.270 -14.651 5.170 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.485 -14.244 4.550 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.901 -12.731 5.213 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -12.199 -10.913 2.138 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -11.509 -10.913 3.764 1.00 0.00 H new ATOM 1075 N ARG A 69 -10.531 -16.017 3.043 1.00 0.00 N ATOM 1076 CA ARG A 69 -10.222 -16.923 1.937 1.00 0.00 C ATOM 1077 C ARG A 69 -10.756 -16.414 0.608 1.00 0.00 C ATOM 1078 O ARG A 69 -10.083 -16.489 -0.415 1.00 0.00 O ATOM 1079 CB ARG A 69 -10.730 -18.337 2.228 1.00 0.00 C ATOM 1080 CG ARG A 69 -12.241 -18.616 2.249 1.00 0.00 C ATOM 1081 CD ARG A 69 -12.467 -20.129 2.350 1.00 0.00 C ATOM 1082 NE ARG A 69 -13.899 -20.461 2.302 1.00 0.00 N ATOM 1083 CZ ARG A 69 -14.686 -20.744 3.346 1.00 0.00 C ATOM 1084 NH1 ARG A 69 -14.196 -20.828 4.579 1.00 0.00 N ATOM 1085 NH2 ARG A 69 -15.985 -20.942 3.163 1.00 0.00 N ATOM 0 H ARG A 69 -11.140 -16.419 3.756 1.00 0.00 H new ATOM 0 HA ARG A 69 -9.136 -16.960 1.850 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -10.287 -19.001 1.486 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.331 -18.633 3.198 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -12.706 -18.108 3.094 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -12.709 -18.225 1.346 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -11.948 -20.631 1.534 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -12.036 -20.502 3.279 1.00 0.00 H new ATOM 0 HE ARG A 69 -14.336 -20.477 1.380 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -13.201 -20.675 4.744 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -14.815 -21.045 5.360 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -16.384 -20.878 2.226 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -16.585 -21.158 3.959 1.00 0.00 H new ATOM 1099 N GLY A 70 -11.963 -15.872 0.644 1.00 0.00 N ATOM 1100 CA GLY A 70 -12.598 -15.253 -0.510 1.00 0.00 C ATOM 1101 C GLY A 70 -11.724 -14.141 -1.087 1.00 0.00 C ATOM 1102 O GLY A 70 -11.546 -14.065 -2.306 1.00 0.00 O ATOM 0 H GLY A 70 -12.537 -15.849 1.487 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -12.784 -16.007 -1.275 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -13.567 -14.846 -0.221 1.00 0.00 H new ATOM 1106 N ALA A 71 -11.161 -13.279 -0.228 1.00 0.00 N ATOM 1107 CA ALA A 71 -10.256 -12.233 -0.677 1.00 0.00 C ATOM 1108 C ALA A 71 -8.971 -12.841 -1.222 1.00 0.00 C ATOM 1109 O ALA A 71 -8.526 -12.412 -2.280 1.00 0.00 O ATOM 1110 CB ALA A 71 -9.968 -11.224 0.438 1.00 0.00 C ATOM 0 H ALA A 71 -11.322 -13.293 0.779 1.00 0.00 H new ATOM 0 HA ALA A 71 -10.743 -11.686 -1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.288 -10.456 0.068 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.901 -10.759 0.758 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.510 -11.737 1.283 1.00 0.00 H new ATOM 1116 N GLN A 72 -8.401 -13.839 -0.541 1.00 0.00 N ATOM 1117 CA GLN A 72 -7.183 -14.518 -0.954 1.00 0.00 C ATOM 1118 C GLN A 72 -7.338 -15.048 -2.374 1.00 0.00 C ATOM 1119 O GLN A 72 -6.487 -14.760 -3.207 1.00 0.00 O ATOM 1120 CB GLN A 72 -6.832 -15.627 0.062 1.00 0.00 C ATOM 1121 CG GLN A 72 -5.772 -16.655 -0.399 1.00 0.00 C ATOM 1122 CD GLN A 72 -6.351 -18.047 -0.698 1.00 0.00 C ATOM 1123 OE1 GLN A 72 -7.509 -18.213 -1.083 1.00 0.00 O ATOM 1124 NE2 GLN A 72 -5.587 -19.106 -0.504 1.00 0.00 N ATOM 0 H GLN A 72 -8.787 -14.201 0.331 1.00 0.00 H new ATOM 0 HA GLN A 72 -6.349 -13.816 -0.965 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -6.477 -15.155 0.978 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -7.746 -16.165 0.314 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -5.277 -16.277 -1.294 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -5.008 -16.747 0.373 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -4.625 -18.989 -0.185 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -5.959 -20.041 -0.673 1.00 0.00 H new ATOM 1133 N GLN A 73 -8.409 -15.782 -2.668 1.00 0.00 N ATOM 1134 CA GLN A 73 -8.568 -16.411 -3.970 1.00 0.00 C ATOM 1135 C GLN A 73 -8.756 -15.367 -5.069 1.00 0.00 C ATOM 1136 O GLN A 73 -8.211 -15.518 -6.160 1.00 0.00 O ATOM 1137 CB GLN A 73 -9.738 -17.391 -3.929 1.00 0.00 C ATOM 1138 CG GLN A 73 -9.692 -18.336 -5.139 1.00 0.00 C ATOM 1139 CD GLN A 73 -10.724 -19.448 -5.010 1.00 0.00 C ATOM 1140 OE1 GLN A 73 -11.912 -19.177 -4.821 1.00 0.00 O ATOM 1141 NE2 GLN A 73 -10.320 -20.700 -5.092 1.00 0.00 N ATOM 0 H GLN A 73 -9.178 -15.954 -2.020 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.659 -16.964 -4.206 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -9.702 -17.970 -3.006 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -10.680 -16.842 -3.925 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.876 -17.770 -6.052 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.696 -18.769 -5.227 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.334 -20.908 -5.249 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.993 -21.460 -4.999 1.00 0.00 H new ATOM 1150 N LYS A 74 -9.498 -14.293 -4.789 1.00 0.00 N ATOM 1151 CA LYS A 74 -9.628 -13.178 -5.729 1.00 0.00 C ATOM 1152 C LYS A 74 -8.250 -12.575 -5.994 1.00 0.00 C ATOM 1153 O LYS A 74 -7.908 -12.311 -7.146 1.00 0.00 O ATOM 1154 CB LYS A 74 -10.585 -12.126 -5.155 1.00 0.00 C ATOM 1155 CG LYS A 74 -10.714 -10.850 -6.013 1.00 0.00 C ATOM 1156 CD LYS A 74 -11.457 -11.054 -7.335 1.00 0.00 C ATOM 1157 CE LYS A 74 -12.954 -11.228 -7.066 1.00 0.00 C ATOM 1158 NZ LYS A 74 -13.751 -11.136 -8.301 1.00 0.00 N ATOM 0 H LYS A 74 -10.017 -14.172 -3.920 1.00 0.00 H new ATOM 0 HA LYS A 74 -10.039 -13.536 -6.673 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.572 -12.574 -5.040 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.244 -11.847 -4.158 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.232 -10.086 -5.432 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.716 -10.467 -6.226 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -11.293 -10.199 -7.991 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.066 -11.931 -7.851 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -13.127 -12.195 -6.594 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.287 -10.465 -6.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -14.758 -11.259 -8.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.606 -10.204 -8.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -13.452 -11.880 -8.963 1.00 0.00 H new ATOM 1172 N LEU A 75 -7.474 -12.338 -4.934 1.00 0.00 N ATOM 1173 CA LEU A 75 -6.126 -11.795 -5.037 1.00 0.00 C ATOM 1174 C LEU A 75 -5.281 -12.734 -5.895 1.00 0.00 C ATOM 1175 O LEU A 75 -4.537 -12.275 -6.756 1.00 0.00 O ATOM 1176 CB LEU A 75 -5.512 -11.623 -3.629 1.00 0.00 C ATOM 1177 CG LEU A 75 -4.823 -10.280 -3.350 1.00 0.00 C ATOM 1178 CD1 LEU A 75 -4.332 -10.280 -1.897 1.00 0.00 C ATOM 1179 CD2 LEU A 75 -3.705 -9.886 -4.320 1.00 0.00 C ATOM 0 H LEU A 75 -7.770 -12.520 -3.975 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.154 -10.812 -5.508 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.302 -11.763 -2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.785 -12.420 -3.472 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.574 -9.508 -3.515 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.839 -9.333 -1.680 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.181 -10.410 -1.226 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.626 -11.098 -1.751 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.292 -8.921 -4.026 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.919 -10.641 -4.295 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.108 -9.815 -5.330 1.00 0.00 H new ATOM 1191 N ALA A 76 -5.410 -14.044 -5.667 1.00 0.00 N ATOM 1192 CA ALA A 76 -4.614 -15.088 -6.287 1.00 0.00 C ATOM 1193 C ALA A 76 -4.895 -15.140 -7.767 1.00 0.00 C ATOM 1194 O ALA A 76 -3.959 -15.185 -8.552 1.00 0.00 O ATOM 1195 CB ALA A 76 -4.905 -16.439 -5.636 1.00 0.00 C ATOM 0 H ALA A 76 -6.103 -14.414 -5.017 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.558 -14.860 -6.140 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.300 -17.210 -6.113 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.662 -16.391 -4.575 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.961 -16.681 -5.756 1.00 0.00 H new ATOM 1201 N GLU A 77 -6.165 -15.100 -8.144 1.00 0.00 N ATOM 1202 CA GLU A 77 -6.612 -15.097 -9.518 1.00 0.00 C ATOM 1203 C GLU A 77 -6.031 -13.889 -10.257 1.00 0.00 C ATOM 1204 O GLU A 77 -5.561 -14.029 -11.389 1.00 0.00 O ATOM 1205 CB GLU A 77 -8.147 -15.057 -9.470 1.00 0.00 C ATOM 1206 CG GLU A 77 -8.812 -15.138 -10.840 1.00 0.00 C ATOM 1207 CD GLU A 77 -10.231 -14.583 -10.802 1.00 0.00 C ATOM 1208 OE1 GLU A 77 -11.117 -15.161 -10.127 1.00 0.00 O ATOM 1209 OE2 GLU A 77 -10.502 -13.617 -11.554 1.00 0.00 O ATOM 0 H GLU A 77 -6.934 -15.068 -7.474 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.275 -15.980 -10.060 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.503 -15.884 -8.855 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.461 -14.136 -8.979 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.221 -14.581 -11.567 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.834 -16.175 -11.175 1.00 0.00 H new ATOM 1216 N ALA A 78 -6.040 -12.715 -9.620 1.00 0.00 N ATOM 1217 CA ALA A 78 -5.524 -11.490 -10.206 1.00 0.00 C ATOM 1218 C ALA A 78 -3.998 -11.568 -10.356 1.00 0.00 C ATOM 1219 O ALA A 78 -3.478 -11.315 -11.441 1.00 0.00 O ATOM 1220 CB ALA A 78 -5.988 -10.302 -9.360 1.00 0.00 C ATOM 0 H ALA A 78 -6.410 -12.594 -8.677 1.00 0.00 H new ATOM 0 HA ALA A 78 -5.918 -11.352 -11.213 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -5.606 -9.377 -9.791 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.077 -10.271 -9.342 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -5.612 -10.411 -8.343 1.00 0.00 H new ATOM 1226 N LEU A 79 -3.270 -11.969 -9.308 1.00 0.00 N ATOM 1227 CA LEU A 79 -1.819 -12.150 -9.362 1.00 0.00 C ATOM 1228 C LEU A 79 -1.433 -13.219 -10.387 1.00 0.00 C ATOM 1229 O LEU A 79 -0.430 -13.076 -11.080 1.00 0.00 O ATOM 1230 CB LEU A 79 -1.274 -12.520 -7.968 1.00 0.00 C ATOM 1231 CG LEU A 79 -0.236 -11.506 -7.463 1.00 0.00 C ATOM 1232 CD1 LEU A 79 -0.027 -11.717 -5.963 1.00 0.00 C ATOM 1233 CD2 LEU A 79 1.107 -11.632 -8.192 1.00 0.00 C ATOM 0 H LEU A 79 -3.675 -12.178 -8.395 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.372 -11.207 -9.676 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.100 -12.575 -7.259 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.822 -13.511 -8.008 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.619 -10.506 -7.664 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.708 -11.002 -5.594 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.972 -11.569 -5.440 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.331 -12.731 -5.785 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.805 -10.894 -7.798 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.512 -12.632 -8.039 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.960 -11.460 -9.258 1.00 0.00 H new ATOM 1245 N SER A 80 -2.231 -14.277 -10.506 1.00 0.00 N ATOM 1246 CA SER A 80 -2.028 -15.349 -11.468 1.00 0.00 C ATOM 1247 C SER A 80 -2.222 -14.834 -12.894 1.00 0.00 C ATOM 1248 O SER A 80 -1.432 -15.162 -13.777 1.00 0.00 O ATOM 1249 CB SER A 80 -2.976 -16.508 -11.133 1.00 0.00 C ATOM 1250 OG SER A 80 -2.634 -17.040 -9.864 1.00 0.00 O ATOM 0 H SER A 80 -3.055 -14.413 -9.921 1.00 0.00 H new ATOM 0 HA SER A 80 -1.004 -15.718 -11.406 1.00 0.00 H new ATOM 0 HB2 SER A 80 -4.009 -16.159 -11.128 1.00 0.00 H new ATOM 0 HB3 SER A 80 -2.906 -17.283 -11.896 1.00 0.00 H new ATOM 0 HG SER A 80 -3.146 -16.579 -9.167 1.00 0.00 H new ATOM 1256 N MET A 81 -3.207 -13.959 -13.118 1.00 0.00 N ATOM 1257 CA MET A 81 -3.411 -13.315 -14.407 1.00 0.00 C ATOM 1258 C MET A 81 -2.216 -12.412 -14.718 1.00 0.00 C ATOM 1259 O MET A 81 -1.751 -12.390 -15.855 1.00 0.00 O ATOM 1260 CB MET A 81 -4.744 -12.550 -14.389 1.00 0.00 C ATOM 1261 CG MET A 81 -4.949 -11.701 -15.645 1.00 0.00 C ATOM 1262 SD MET A 81 -6.525 -10.814 -15.689 1.00 0.00 S ATOM 1263 CE MET A 81 -6.107 -9.594 -16.962 1.00 0.00 C ATOM 0 H MET A 81 -3.883 -13.681 -12.406 1.00 0.00 H new ATOM 0 HA MET A 81 -3.473 -14.056 -15.204 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.566 -13.260 -14.296 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.778 -11.907 -13.510 1.00 0.00 H new ATOM 0 HG2 MET A 81 -4.136 -10.979 -15.719 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.883 -12.346 -16.521 1.00 0.00 H new ATOM 0 HE1 MET A 81 -6.963 -8.942 -17.136 1.00 0.00 H new ATOM 0 HE2 MET A 81 -5.258 -8.997 -16.629 1.00 0.00 H new ATOM 0 HE3 MET A 81 -5.848 -10.108 -17.888 1.00 0.00 H new ATOM 1273 N LEU A 82 -1.705 -11.680 -13.726 1.00 0.00 N ATOM 1274 CA LEU A 82 -0.538 -10.816 -13.885 1.00 0.00 C ATOM 1275 C LEU A 82 0.712 -11.627 -14.232 1.00 0.00 C ATOM 1276 O LEU A 82 1.496 -11.213 -15.090 1.00 0.00 O ATOM 1277 CB LEU A 82 -0.353 -10.006 -12.595 1.00 0.00 C ATOM 1278 CG LEU A 82 0.983 -9.253 -12.465 1.00 0.00 C ATOM 1279 CD1 LEU A 82 1.081 -8.088 -13.457 1.00 0.00 C ATOM 1280 CD2 LEU A 82 1.095 -8.729 -11.034 1.00 0.00 C ATOM 0 H LEU A 82 -2.094 -11.672 -12.783 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.698 -10.132 -14.718 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.165 -9.283 -12.523 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.452 -10.682 -11.746 1.00 0.00 H new ATOM 0 HG LEU A 82 1.799 -9.938 -12.694 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.039 -7.583 -13.332 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.002 -8.469 -14.475 1.00 0.00 H new ATOM 0 HD13 LEU A 82 0.272 -7.382 -13.270 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.035 -8.191 -10.916 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.263 -8.056 -10.827 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.067 -9.566 -10.337 1.00 0.00 H new ATOM 1292 N LYS A 83 0.937 -12.757 -13.557 1.00 0.00 N ATOM 1293 CA LYS A 83 2.108 -13.598 -13.789 1.00 0.00 C ATOM 1294 C LYS A 83 1.945 -14.467 -15.037 1.00 0.00 C ATOM 1295 O LYS A 83 2.949 -14.905 -15.591 1.00 0.00 O ATOM 1296 CB LYS A 83 2.369 -14.463 -12.541 1.00 0.00 C ATOM 1297 CG LYS A 83 3.850 -14.845 -12.345 1.00 0.00 C ATOM 1298 CD LYS A 83 4.625 -13.863 -11.450 1.00 0.00 C ATOM 1299 CE LYS A 83 4.608 -12.425 -11.982 1.00 0.00 C ATOM 1300 NZ LYS A 83 5.385 -11.498 -11.136 1.00 0.00 N ATOM 0 H LYS A 83 0.311 -13.112 -12.835 1.00 0.00 H new ATOM 0 HA LYS A 83 2.969 -12.953 -13.967 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.023 -13.925 -11.659 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.775 -15.374 -12.612 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.905 -15.842 -11.909 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.336 -14.896 -13.320 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.197 -13.879 -10.448 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.658 -14.199 -11.361 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.011 -12.411 -12.995 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.577 -12.077 -12.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.341 -10.540 -11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.986 -11.488 -10.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.376 -11.812 -11.096 1.00 0.00 H new ATOM 1314 N GLY A 84 0.720 -14.719 -15.498 1.00 0.00 N ATOM 1315 CA GLY A 84 0.434 -15.629 -16.600 1.00 0.00 C ATOM 1316 C GLY A 84 0.573 -17.103 -16.195 1.00 0.00 C ATOM 1317 O GLY A 84 0.462 -17.980 -17.055 1.00 0.00 O ATOM 0 H GLY A 84 -0.116 -14.286 -15.106 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.578 -15.449 -16.963 1.00 0.00 H new ATOM 0 HA3 GLY A 84 1.111 -15.417 -17.427 1.00 0.00 H new ATOM 1321 N SER A 85 0.833 -17.393 -14.921 1.00 0.00 N ATOM 1322 CA SER A 85 0.890 -18.717 -14.319 1.00 0.00 C ATOM 1323 C SER A 85 0.261 -18.620 -12.930 1.00 0.00 C ATOM 1324 O SER A 85 0.226 -17.530 -12.358 1.00 0.00 O ATOM 1325 CB SER A 85 2.351 -19.163 -14.208 1.00 0.00 C ATOM 1326 OG SER A 85 2.922 -19.428 -15.480 1.00 0.00 O ATOM 0 H SER A 85 1.021 -16.658 -14.240 1.00 0.00 H new ATOM 0 HA SER A 85 0.352 -19.446 -14.926 1.00 0.00 H new ATOM 0 HB2 SER A 85 2.930 -18.388 -13.705 1.00 0.00 H new ATOM 0 HB3 SER A 85 2.411 -20.058 -13.589 1.00 0.00 H new ATOM 0 HG SER A 85 3.854 -19.708 -15.368 1.00 0.00 H new ATOM 1332 N THR A 86 -0.201 -19.734 -12.365 1.00 0.00 N ATOM 1333 CA THR A 86 -0.785 -19.746 -11.030 1.00 0.00 C ATOM 1334 C THR A 86 0.285 -19.367 -10.003 1.00 0.00 C ATOM 1335 O THR A 86 1.281 -20.078 -9.830 1.00 0.00 O ATOM 1336 CB THR A 86 -1.445 -21.104 -10.750 1.00 0.00 C ATOM 1337 OG1 THR A 86 -2.334 -21.378 -11.819 1.00 0.00 O ATOM 1338 CG2 THR A 86 -2.231 -21.087 -9.434 1.00 0.00 C ATOM 0 H THR A 86 -0.180 -20.647 -12.819 1.00 0.00 H new ATOM 0 HA THR A 86 -1.578 -19.002 -10.956 1.00 0.00 H new ATOM 0 HB THR A 86 -0.672 -21.868 -10.665 1.00 0.00 H new ATOM 0 HG1 THR A 86 -2.770 -22.243 -11.668 1.00 0.00 H new ATOM 0 HG21 THR A 86 -2.684 -22.064 -9.268 1.00 0.00 H new ATOM 0 HG22 THR A 86 -1.556 -20.856 -8.610 1.00 0.00 H new ATOM 0 HG23 THR A 86 -3.012 -20.329 -9.487 1.00 0.00 H new ATOM 1346 N VAL A 87 0.118 -18.217 -9.360 1.00 0.00 N ATOM 1347 CA VAL A 87 0.966 -17.760 -8.270 1.00 0.00 C ATOM 1348 C VAL A 87 0.556 -18.530 -7.020 1.00 0.00 C ATOM 1349 O VAL A 87 -0.633 -18.770 -6.794 1.00 0.00 O ATOM 1350 CB VAL A 87 0.803 -16.235 -8.123 1.00 0.00 C ATOM 1351 CG1 VAL A 87 1.513 -15.707 -6.873 1.00 0.00 C ATOM 1352 CG2 VAL A 87 1.400 -15.529 -9.349 1.00 0.00 C ATOM 0 H VAL A 87 -0.630 -17.562 -9.589 1.00 0.00 H new ATOM 0 HA VAL A 87 2.024 -17.948 -8.454 1.00 0.00 H new ATOM 0 HB VAL A 87 -0.264 -16.029 -8.037 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.375 -14.628 -6.805 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.093 -16.183 -5.987 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.577 -15.933 -6.936 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.283 -14.451 -9.241 1.00 0.00 H new ATOM 0 HG22 VAL A 87 2.459 -15.772 -9.429 1.00 0.00 H new ATOM 0 HG23 VAL A 87 0.882 -15.862 -10.249 1.00 0.00 H new ATOM 1362 N GLU A 88 1.526 -18.903 -6.185 1.00 0.00 N ATOM 1363 CA GLU A 88 1.243 -19.518 -4.903 1.00 0.00 C ATOM 1364 C GLU A 88 1.168 -18.335 -3.953 1.00 0.00 C ATOM 1365 O GLU A 88 2.170 -17.897 -3.390 1.00 0.00 O ATOM 1366 CB GLU A 88 2.327 -20.546 -4.556 1.00 0.00 C ATOM 1367 CG GLU A 88 1.955 -21.935 -5.098 1.00 0.00 C ATOM 1368 CD GLU A 88 0.910 -22.606 -4.204 1.00 0.00 C ATOM 1369 OE1 GLU A 88 1.296 -23.251 -3.202 1.00 0.00 O ATOM 1370 OE2 GLU A 88 -0.310 -22.480 -4.475 1.00 0.00 O ATOM 0 H GLU A 88 2.520 -18.786 -6.382 1.00 0.00 H new ATOM 0 HA GLU A 88 0.319 -20.095 -4.868 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.282 -20.230 -4.976 1.00 0.00 H new ATOM 0 HB3 GLU A 88 2.455 -20.595 -3.475 1.00 0.00 H new ATOM 0 HG2 GLU A 88 1.567 -21.842 -6.112 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.847 -22.559 -5.154 1.00 0.00 H new ATOM 1377 N LEU A 89 -0.022 -17.740 -3.883 1.00 0.00 N ATOM 1378 CA LEU A 89 -0.272 -16.527 -3.131 1.00 0.00 C ATOM 1379 C LEU A 89 -0.658 -16.938 -1.720 1.00 0.00 C ATOM 1380 O LEU A 89 -1.767 -17.435 -1.517 1.00 0.00 O ATOM 1381 CB LEU A 89 -1.324 -15.677 -3.840 1.00 0.00 C ATOM 1382 CG LEU A 89 -1.763 -14.428 -3.053 1.00 0.00 C ATOM 1383 CD1 LEU A 89 -0.690 -13.485 -2.527 1.00 0.00 C ATOM 1384 CD2 LEU A 89 -2.580 -13.575 -4.004 1.00 0.00 C ATOM 0 H LEU A 89 -0.850 -18.100 -4.359 1.00 0.00 H new ATOM 0 HA LEU A 89 0.613 -15.894 -3.068 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.930 -15.363 -4.807 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.200 -16.294 -4.038 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.262 -14.839 -2.176 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.161 -12.657 -1.997 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.033 -14.025 -1.846 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.107 -13.096 -3.362 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.915 -12.675 -3.489 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -1.967 -13.296 -4.861 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -3.447 -14.140 -4.347 1.00 0.00 H new ATOM 1396 N THR A 90 0.262 -16.800 -0.771 1.00 0.00 N ATOM 1397 CA THR A 90 0.008 -17.039 0.641 1.00 0.00 C ATOM 1398 C THR A 90 -0.400 -15.709 1.269 1.00 0.00 C ATOM 1399 O THR A 90 0.003 -14.655 0.779 1.00 0.00 O ATOM 1400 CB THR A 90 1.305 -17.518 1.326 1.00 0.00 C ATOM 1401 OG1 THR A 90 2.037 -18.429 0.523 1.00 0.00 O ATOM 1402 CG2 THR A 90 1.033 -18.202 2.669 1.00 0.00 C ATOM 0 H THR A 90 1.221 -16.514 -0.967 1.00 0.00 H new ATOM 0 HA THR A 90 -0.770 -17.793 0.761 1.00 0.00 H new ATOM 0 HB THR A 90 1.890 -16.611 1.481 1.00 0.00 H new ATOM 0 HG1 THR A 90 2.850 -18.703 0.997 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.976 -18.521 3.112 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.536 -17.502 3.340 1.00 0.00 H new ATOM 0 HG23 THR A 90 0.393 -19.071 2.512 1.00 0.00 H new ATOM 1410 N ILE A 91 -1.150 -15.741 2.364 1.00 0.00 N ATOM 1411 CA ILE A 91 -1.492 -14.567 3.148 1.00 0.00 C ATOM 1412 C ILE A 91 -0.956 -14.920 4.530 1.00 0.00 C ATOM 1413 O ILE A 91 -1.298 -15.978 5.064 1.00 0.00 O ATOM 1414 CB ILE A 91 -2.999 -14.229 3.196 1.00 0.00 C ATOM 1415 CG1 ILE A 91 -3.764 -14.317 1.859 1.00 0.00 C ATOM 1416 CG2 ILE A 91 -3.147 -12.826 3.817 1.00 0.00 C ATOM 1417 CD1 ILE A 91 -3.430 -13.272 0.793 1.00 0.00 C ATOM 0 H ILE A 91 -1.545 -16.604 2.737 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.065 -13.664 2.710 1.00 0.00 H new ATOM 0 HB ILE A 91 -3.468 -15.005 3.801 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.586 -15.304 1.432 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -4.830 -14.251 2.075 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.203 -12.559 3.864 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -2.727 -12.827 4.823 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.616 -12.099 3.203 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -4.038 -13.450 -0.094 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -3.638 -12.276 1.182 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.375 -13.345 0.530 1.00 0.00 H new ATOM 1429 N VAL A 92 -0.093 -14.075 5.082 1.00 0.00 N ATOM 1430 CA VAL A 92 0.399 -14.224 6.445 1.00 0.00 C ATOM 1431 C VAL A 92 -0.044 -12.974 7.204 1.00 0.00 C ATOM 1432 O VAL A 92 -0.220 -11.914 6.601 1.00 0.00 O ATOM 1433 CB VAL A 92 1.918 -14.521 6.470 1.00 0.00 C ATOM 1434 CG1 VAL A 92 2.271 -15.743 5.604 1.00 0.00 C ATOM 1435 CG2 VAL A 92 2.797 -13.357 5.997 1.00 0.00 C ATOM 0 H VAL A 92 0.286 -13.264 4.594 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.023 -15.093 6.949 1.00 0.00 H new ATOM 0 HB VAL A 92 2.130 -14.707 7.523 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.346 -15.921 5.646 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.743 -16.620 5.979 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.975 -15.555 4.572 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.846 -13.650 6.046 1.00 0.00 H new ATOM 0 HG22 VAL A 92 2.540 -13.101 4.969 1.00 0.00 H new ATOM 0 HG23 VAL A 92 2.631 -12.492 6.639 1.00 0.00 H new ATOM 1445 N GLU A 93 -0.265 -13.088 8.509 1.00 0.00 N ATOM 1446 CA GLU A 93 -0.762 -12.017 9.354 1.00 0.00 C ATOM 1447 C GLU A 93 0.356 -11.707 10.338 1.00 0.00 C ATOM 1448 O GLU A 93 0.566 -12.460 11.291 1.00 0.00 O ATOM 1449 CB GLU A 93 -2.038 -12.439 10.088 1.00 0.00 C ATOM 1450 CG GLU A 93 -3.224 -12.749 9.167 1.00 0.00 C ATOM 1451 CD GLU A 93 -4.421 -13.305 9.946 1.00 0.00 C ATOM 1452 OE1 GLU A 93 -4.354 -13.454 11.187 1.00 0.00 O ATOM 1453 OE2 GLU A 93 -5.445 -13.625 9.311 1.00 0.00 O ATOM 0 H GLU A 93 -0.097 -13.955 9.020 1.00 0.00 H new ATOM 0 HA GLU A 93 -1.026 -11.139 8.764 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.821 -13.321 10.691 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.326 -11.645 10.777 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -3.522 -11.842 8.641 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.917 -13.470 8.410 1.00 0.00 H new ATOM 1460 N ASP A 94 1.083 -10.621 10.106 1.00 0.00 N ATOM 1461 CA ASP A 94 2.264 -10.246 10.870 1.00 0.00 C ATOM 1462 C ASP A 94 2.033 -8.868 11.486 1.00 0.00 C ATOM 1463 O ASP A 94 1.045 -8.195 11.191 1.00 0.00 O ATOM 1464 CB ASP A 94 3.479 -10.294 9.935 1.00 0.00 C ATOM 1465 CG ASP A 94 4.820 -10.099 10.645 1.00 0.00 C ATOM 1466 OD1 ASP A 94 4.905 -10.237 11.886 1.00 0.00 O ATOM 1467 OD2 ASP A 94 5.819 -9.845 9.936 1.00 0.00 O ATOM 0 H ASP A 94 0.861 -9.960 9.362 1.00 0.00 H new ATOM 0 HA ASP A 94 2.456 -10.936 11.692 1.00 0.00 H new ATOM 0 HB2 ASP A 94 3.489 -11.254 9.419 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.368 -9.523 9.172 1.00 0.00 H new ATOM 1472 N ASP A 95 2.887 -8.438 12.398 1.00 0.00 N ATOM 1473 CA ASP A 95 2.766 -7.180 13.124 1.00 0.00 C ATOM 1474 C ASP A 95 4.073 -6.395 13.146 1.00 0.00 C ATOM 1475 O ASP A 95 4.046 -5.192 13.421 1.00 0.00 O ATOM 1476 CB ASP A 95 2.287 -7.458 14.554 1.00 0.00 C ATOM 1477 CG ASP A 95 3.391 -7.989 15.468 1.00 0.00 C ATOM 1478 OD1 ASP A 95 3.574 -9.222 15.531 1.00 0.00 O ATOM 1479 OD2 ASP A 95 4.064 -7.161 16.128 1.00 0.00 O ATOM 0 H ASP A 95 3.714 -8.972 12.665 1.00 0.00 H new ATOM 0 HA ASP A 95 2.035 -6.563 12.601 1.00 0.00 H new ATOM 0 HB2 ASP A 95 1.883 -6.540 14.980 1.00 0.00 H new ATOM 0 HB3 ASP A 95 1.472 -8.181 14.523 1.00 0.00 H new ATOM 1484 N ASN A 96 5.190 -7.053 12.840 1.00 0.00 N ATOM 1485 CA ASN A 96 6.508 -6.453 12.704 1.00 0.00 C ATOM 1486 C ASN A 96 6.537 -5.606 11.422 1.00 0.00 C ATOM 1487 O ASN A 96 6.317 -6.165 10.347 1.00 0.00 O ATOM 1488 CB ASN A 96 7.525 -7.593 12.643 1.00 0.00 C ATOM 1489 CG ASN A 96 8.937 -7.106 12.382 1.00 0.00 C ATOM 1490 OD1 ASN A 96 9.350 -6.083 12.926 1.00 0.00 O ATOM 1491 ND2 ASN A 96 9.694 -7.835 11.584 1.00 0.00 N ATOM 0 H ASN A 96 5.197 -8.059 12.674 1.00 0.00 H new ATOM 0 HA ASN A 96 6.747 -5.800 13.544 1.00 0.00 H new ATOM 0 HB2 ASN A 96 7.503 -8.144 13.583 1.00 0.00 H new ATOM 0 HB3 ASN A 96 7.235 -8.291 11.858 1.00 0.00 H new ATOM 0 HD21 ASN A 96 10.658 -7.556 11.400 1.00 0.00 H new ATOM 0 HD22 ASN A 96 9.315 -8.677 11.151 1.00 0.00 H new ATOM 1498 N PRO A 97 6.764 -4.283 11.473 1.00 0.00 N ATOM 1499 CA PRO A 97 6.678 -3.390 10.311 1.00 0.00 C ATOM 1500 C PRO A 97 7.927 -3.436 9.410 1.00 0.00 C ATOM 1501 O PRO A 97 8.487 -2.401 9.043 1.00 0.00 O ATOM 1502 CB PRO A 97 6.437 -2.018 10.935 1.00 0.00 C ATOM 1503 CG PRO A 97 7.264 -2.081 12.219 1.00 0.00 C ATOM 1504 CD PRO A 97 7.033 -3.514 12.682 1.00 0.00 C ATOM 0 HA PRO A 97 5.884 -3.681 9.624 1.00 0.00 H new ATOM 0 HB2 PRO A 97 6.768 -1.212 10.280 1.00 0.00 H new ATOM 0 HB3 PRO A 97 5.381 -1.848 11.142 1.00 0.00 H new ATOM 0 HG2 PRO A 97 8.319 -1.878 12.034 1.00 0.00 H new ATOM 0 HG3 PRO A 97 6.925 -1.355 12.958 1.00 0.00 H new ATOM 0 HD2 PRO A 97 7.907 -3.902 13.206 1.00 0.00 H new ATOM 0 HD3 PRO A 97 6.194 -3.570 13.376 1.00 0.00 H new ATOM 1512 N ALA A 98 8.343 -4.638 9.020 1.00 0.00 N ATOM 1513 CA ALA A 98 9.571 -4.906 8.272 1.00 0.00 C ATOM 1514 C ALA A 98 9.656 -4.206 6.919 1.00 0.00 C ATOM 1515 O ALA A 98 10.743 -3.897 6.429 1.00 0.00 O ATOM 1516 CB ALA A 98 9.728 -6.417 8.078 1.00 0.00 C ATOM 0 H ALA A 98 7.814 -5.486 9.224 1.00 0.00 H new ATOM 0 HA ALA A 98 10.384 -4.495 8.871 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.643 -6.619 7.521 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.781 -6.905 9.051 1.00 0.00 H new ATOM 0 HB3 ALA A 98 8.873 -6.804 7.524 1.00 0.00 H new ATOM 1522 N VAL A 99 8.507 -3.975 6.310 1.00 0.00 N ATOM 1523 CA VAL A 99 8.309 -3.365 4.997 1.00 0.00 C ATOM 1524 C VAL A 99 7.062 -2.477 5.118 1.00 0.00 C ATOM 1525 O VAL A 99 6.371 -2.493 6.145 1.00 0.00 O ATOM 1526 CB VAL A 99 8.199 -4.483 3.928 1.00 0.00 C ATOM 1527 CG1 VAL A 99 7.954 -3.986 2.492 1.00 0.00 C ATOM 1528 CG2 VAL A 99 9.449 -5.383 3.888 1.00 0.00 C ATOM 0 H VAL A 99 7.620 -4.225 6.748 1.00 0.00 H new ATOM 0 HA VAL A 99 9.143 -2.740 4.676 1.00 0.00 H new ATOM 0 HB VAL A 99 7.322 -5.041 4.255 1.00 0.00 H new ATOM 0 HG11 VAL A 99 7.892 -4.840 1.817 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.020 -3.426 2.455 1.00 0.00 H new ATOM 0 HG13 VAL A 99 8.777 -3.340 2.185 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.321 -6.149 3.123 1.00 0.00 H new ATOM 0 HG22 VAL A 99 10.325 -4.779 3.653 1.00 0.00 H new ATOM 0 HG23 VAL A 99 9.586 -5.859 4.859 1.00 0.00 H new ATOM 1538 N ARG A 100 6.788 -1.632 4.124 1.00 0.00 N ATOM 1539 CA ARG A 100 5.586 -0.812 4.071 1.00 0.00 C ATOM 1540 C ARG A 100 4.575 -1.443 3.123 1.00 0.00 C ATOM 1541 O ARG A 100 4.939 -1.932 2.053 1.00 0.00 O ATOM 1542 CB ARG A 100 5.946 0.607 3.596 1.00 0.00 C ATOM 1543 CG ARG A 100 6.866 1.369 4.563 1.00 0.00 C ATOM 1544 CD ARG A 100 6.169 1.736 5.882 1.00 0.00 C ATOM 1545 NE ARG A 100 7.143 2.007 6.948 1.00 0.00 N ATOM 1546 CZ ARG A 100 7.776 1.080 7.683 1.00 0.00 C ATOM 1547 NH1 ARG A 100 7.461 -0.212 7.603 1.00 0.00 N ATOM 1548 NH2 ARG A 100 8.740 1.440 8.513 1.00 0.00 N ATOM 0 H ARG A 100 7.406 -1.499 3.324 1.00 0.00 H new ATOM 0 HA ARG A 100 5.146 -0.750 5.066 1.00 0.00 H new ATOM 0 HB2 ARG A 100 6.432 0.542 2.622 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.028 1.178 3.457 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.744 0.760 4.778 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.221 2.279 4.079 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.540 2.613 5.731 1.00 0.00 H new ATOM 0 HD3 ARG A 100 5.512 0.921 6.187 1.00 0.00 H new ATOM 0 HE ARG A 100 7.356 2.984 7.147 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.722 -0.518 6.971 1.00 0.00 H new ATOM 0 HH12 ARG A 100 7.959 -0.895 8.174 1.00 0.00 H new ATOM 0 HH21 ARG A 100 9.002 2.422 8.595 1.00 0.00 H new ATOM 0 HH22 ARG A 100 9.221 0.735 9.072 1.00 0.00 H new ATOM 1562 N THR A 101 3.315 -1.465 3.542 1.00 0.00 N ATOM 1563 CA THR A 101 2.205 -1.897 2.704 1.00 0.00 C ATOM 1564 C THR A 101 2.021 -0.775 1.655 1.00 0.00 C ATOM 1565 O THR A 101 2.586 0.309 1.835 1.00 0.00 O ATOM 1566 CB THR A 101 0.981 -2.113 3.615 1.00 0.00 C ATOM 1567 OG1 THR A 101 0.541 -0.878 4.140 1.00 0.00 O ATOM 1568 CG2 THR A 101 1.285 -3.058 4.789 1.00 0.00 C ATOM 0 H THR A 101 3.034 -1.181 4.480 1.00 0.00 H new ATOM 0 HA THR A 101 2.367 -2.840 2.182 1.00 0.00 H new ATOM 0 HB THR A 101 0.207 -2.568 2.996 1.00 0.00 H new ATOM 0 HG1 THR A 101 0.195 -1.013 5.047 1.00 0.00 H new ATOM 0 HG21 THR A 101 0.391 -3.177 5.401 1.00 0.00 H new ATOM 0 HG22 THR A 101 1.593 -4.030 4.403 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.087 -2.638 5.396 1.00 0.00 H new ATOM 1576 N PRO A 102 1.240 -0.918 0.573 1.00 0.00 N ATOM 1577 CA PRO A 102 1.116 0.153 -0.408 1.00 0.00 C ATOM 1578 C PRO A 102 0.362 1.349 0.198 1.00 0.00 C ATOM 1579 O PRO A 102 0.563 2.483 -0.245 1.00 0.00 O ATOM 1580 CB PRO A 102 0.412 -0.474 -1.608 1.00 0.00 C ATOM 1581 CG PRO A 102 -0.456 -1.527 -0.959 1.00 0.00 C ATOM 1582 CD PRO A 102 0.381 -2.024 0.218 1.00 0.00 C ATOM 0 HA PRO A 102 2.077 0.561 -0.719 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -0.179 0.257 -2.160 1.00 0.00 H new ATOM 0 HB3 PRO A 102 1.120 -0.909 -2.313 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -1.406 -1.110 -0.625 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -0.689 -2.335 -1.652 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -0.253 -2.314 1.056 1.00 0.00 H new ATOM 0 HD3 PRO A 102 0.965 -2.902 -0.058 1.00 0.00 H new ATOM 1590 N LEU A 103 -0.481 1.120 1.216 1.00 0.00 N ATOM 1591 CA LEU A 103 -1.157 2.167 1.971 1.00 0.00 C ATOM 1592 C LEU A 103 -0.101 2.879 2.818 1.00 0.00 C ATOM 1593 O LEU A 103 0.016 4.100 2.752 1.00 0.00 O ATOM 1594 CB LEU A 103 -2.277 1.540 2.823 1.00 0.00 C ATOM 1595 CG LEU A 103 -3.287 2.527 3.446 1.00 0.00 C ATOM 1596 CD1 LEU A 103 -4.462 1.737 4.039 1.00 0.00 C ATOM 1597 CD2 LEU A 103 -2.697 3.402 4.554 1.00 0.00 C ATOM 0 H LEU A 103 -0.712 0.180 1.538 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.631 2.899 1.318 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.826 0.833 2.201 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.816 0.966 3.627 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.600 3.191 2.640 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.179 2.429 4.481 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -4.949 1.163 3.251 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -4.093 1.057 4.807 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.468 4.068 4.941 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.327 2.768 5.360 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.875 3.994 4.151 1.00 0.00 H new ATOM 1609 N GLU A 104 0.713 2.133 3.569 1.00 0.00 N ATOM 1610 CA GLU A 104 1.774 2.707 4.393 1.00 0.00 C ATOM 1611 C GLU A 104 2.832 3.400 3.530 1.00 0.00 C ATOM 1612 O GLU A 104 3.473 4.331 4.010 1.00 0.00 O ATOM 1613 CB GLU A 104 2.377 1.640 5.309 1.00 0.00 C ATOM 1614 CG GLU A 104 1.425 1.313 6.471 1.00 0.00 C ATOM 1615 CD GLU A 104 1.472 -0.167 6.841 1.00 0.00 C ATOM 1616 OE1 GLU A 104 2.581 -0.677 7.132 1.00 0.00 O ATOM 1617 OE2 GLU A 104 0.397 -0.809 6.818 1.00 0.00 O ATOM 0 H GLU A 104 0.654 1.116 3.621 1.00 0.00 H new ATOM 0 HA GLU A 104 1.341 3.477 5.032 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.581 0.736 4.735 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.331 1.990 5.703 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.692 1.914 7.340 1.00 0.00 H new ATOM 0 HG3 GLU A 104 0.407 1.587 6.195 1.00 0.00 H new ATOM 1624 N TRP A 105 3.019 2.998 2.270 1.00 0.00 N ATOM 1625 CA TRP A 105 3.898 3.689 1.335 1.00 0.00 C ATOM 1626 C TRP A 105 3.229 5.022 0.980 1.00 0.00 C ATOM 1627 O TRP A 105 3.872 6.066 1.023 1.00 0.00 O ATOM 1628 CB TRP A 105 4.154 2.862 0.066 1.00 0.00 C ATOM 1629 CG TRP A 105 5.309 1.903 0.094 1.00 0.00 C ATOM 1630 CD1 TRP A 105 5.234 0.559 -0.029 1.00 0.00 C ATOM 1631 CD2 TRP A 105 6.738 2.209 0.120 1.00 0.00 C ATOM 1632 NE1 TRP A 105 6.504 0.022 -0.081 1.00 0.00 N ATOM 1633 CE2 TRP A 105 7.472 0.998 -0.017 1.00 0.00 C ATOM 1634 CE3 TRP A 105 7.491 3.396 0.214 1.00 0.00 C ATOM 1635 CZ2 TRP A 105 8.874 0.967 -0.072 1.00 0.00 C ATOM 1636 CZ3 TRP A 105 8.896 3.389 0.129 1.00 0.00 C ATOM 1637 CH2 TRP A 105 9.588 2.174 -0.008 1.00 0.00 C ATOM 0 H TRP A 105 2.560 2.179 1.872 1.00 0.00 H new ATOM 0 HA TRP A 105 4.871 3.848 1.799 1.00 0.00 H new ATOM 0 HB2 TRP A 105 3.250 2.295 -0.156 1.00 0.00 H new ATOM 0 HB3 TRP A 105 4.309 3.553 -0.762 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.317 -0.010 -0.079 1.00 0.00 H new ATOM 0 HE1 TRP A 105 6.701 -0.976 -0.157 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.977 4.335 0.355 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 9.397 0.026 -0.162 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 9.443 4.319 0.169 1.00 0.00 H new ATOM 0 HH2 TRP A 105 10.667 2.169 -0.064 1.00 0.00 H new ATOM 1648 N ARG A 106 1.923 5.028 0.689 1.00 0.00 N ATOM 1649 CA ARG A 106 1.158 6.253 0.426 1.00 0.00 C ATOM 1650 C ARG A 106 1.145 7.198 1.627 1.00 0.00 C ATOM 1651 O ARG A 106 0.894 8.392 1.471 1.00 0.00 O ATOM 1652 CB ARG A 106 -0.264 5.876 0.005 1.00 0.00 C ATOM 1653 CG ARG A 106 -0.887 6.903 -0.949 1.00 0.00 C ATOM 1654 CD ARG A 106 -1.810 7.928 -0.268 1.00 0.00 C ATOM 1655 NE ARG A 106 -3.074 8.077 -1.005 1.00 0.00 N ATOM 1656 CZ ARG A 106 -3.941 7.080 -1.222 1.00 0.00 C ATOM 1657 NH1 ARG A 106 -3.915 5.971 -0.488 1.00 0.00 N ATOM 1658 NH2 ARG A 106 -4.801 7.197 -2.220 1.00 0.00 N ATOM 0 H ARG A 106 1.363 4.177 0.629 1.00 0.00 H new ATOM 0 HA ARG A 106 1.647 6.796 -0.383 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.249 4.899 -0.478 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.890 5.784 0.893 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -0.086 7.437 -1.461 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -1.455 6.373 -1.713 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.017 7.612 0.754 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -1.305 8.892 -0.208 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.305 8.999 -1.375 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -3.226 5.868 0.257 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -4.585 5.223 -0.670 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.794 8.033 -2.804 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -5.471 6.451 -2.406 1.00 0.00 H new ATOM 1672 N GLN A 107 1.336 6.666 2.826 1.00 0.00 N ATOM 1673 CA GLN A 107 1.491 7.456 4.035 1.00 0.00 C ATOM 1674 C GLN A 107 2.936 7.968 4.059 1.00 0.00 C ATOM 1675 O GLN A 107 3.159 9.161 4.247 1.00 0.00 O ATOM 1676 CB GLN A 107 1.185 6.577 5.265 1.00 0.00 C ATOM 1677 CG GLN A 107 1.240 7.320 6.610 1.00 0.00 C ATOM 1678 CD GLN A 107 -0.014 8.140 6.906 1.00 0.00 C ATOM 1679 OE1 GLN A 107 -0.780 8.505 6.013 1.00 0.00 O ATOM 1680 NE2 GLN A 107 -0.264 8.448 8.164 1.00 0.00 N ATOM 0 H GLN A 107 1.388 5.660 2.986 1.00 0.00 H new ATOM 0 HA GLN A 107 0.801 8.300 4.056 1.00 0.00 H new ATOM 0 HB2 GLN A 107 0.193 6.140 5.146 1.00 0.00 H new ATOM 0 HB3 GLN A 107 1.896 5.751 5.291 1.00 0.00 H new ATOM 0 HG2 GLN A 107 1.388 6.595 7.410 1.00 0.00 H new ATOM 0 HG3 GLN A 107 2.106 7.981 6.615 1.00 0.00 H new ATOM 0 HE21 GLN A 107 0.373 8.143 8.900 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -1.095 8.991 8.401 1.00 0.00 H new ATOM 1689 N ALA A 108 3.912 7.084 3.825 1.00 0.00 N ATOM 1690 CA ALA A 108 5.331 7.352 3.934 1.00 0.00 C ATOM 1691 C ALA A 108 5.730 8.453 2.977 1.00 0.00 C ATOM 1692 O ALA A 108 6.289 9.430 3.431 1.00 0.00 O ATOM 1693 CB ALA A 108 6.160 6.082 3.699 1.00 0.00 C ATOM 0 H ALA A 108 3.715 6.124 3.543 1.00 0.00 H new ATOM 0 HA ALA A 108 5.538 7.688 4.950 1.00 0.00 H new ATOM 0 HB1 ALA A 108 7.220 6.318 3.788 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.892 5.330 4.441 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.957 5.695 2.701 1.00 0.00 H new ATOM 1699 N ILE A 109 5.421 8.357 1.684 1.00 0.00 N ATOM 1700 CA ILE A 109 5.880 9.361 0.708 1.00 0.00 C ATOM 1701 C ILE A 109 5.346 10.764 1.080 1.00 0.00 C ATOM 1702 O ILE A 109 5.969 11.773 0.746 1.00 0.00 O ATOM 1703 CB ILE A 109 5.545 8.913 -0.746 1.00 0.00 C ATOM 1704 CG1 ILE A 109 6.561 7.893 -1.308 1.00 0.00 C ATOM 1705 CG2 ILE A 109 5.543 10.042 -1.785 1.00 0.00 C ATOM 1706 CD1 ILE A 109 6.255 6.465 -0.907 1.00 0.00 C ATOM 0 H ILE A 109 4.860 7.604 1.285 1.00 0.00 H new ATOM 0 HA ILE A 109 6.967 9.438 0.746 1.00 0.00 H new ATOM 0 HB ILE A 109 4.545 8.496 -0.623 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.573 7.964 -2.396 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.560 8.155 -0.960 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.300 9.633 -2.766 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.799 10.790 -1.509 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.529 10.506 -1.820 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.005 5.799 -1.333 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.271 6.381 0.180 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.269 6.186 -1.278 1.00 0.00 H new ATOM 1718 N TYR A 110 4.221 10.853 1.798 1.00 0.00 N ATOM 1719 CA TYR A 110 3.701 12.120 2.302 1.00 0.00 C ATOM 1720 C TYR A 110 4.545 12.551 3.494 1.00 0.00 C ATOM 1721 O TYR A 110 5.132 13.630 3.517 1.00 0.00 O ATOM 1722 CB TYR A 110 2.217 11.962 2.685 1.00 0.00 C ATOM 1723 CG TYR A 110 1.360 13.217 2.566 1.00 0.00 C ATOM 1724 CD1 TYR A 110 1.876 14.523 2.711 1.00 0.00 C ATOM 1725 CD2 TYR A 110 -0.006 13.045 2.304 1.00 0.00 C ATOM 1726 CE1 TYR A 110 1.036 15.638 2.512 1.00 0.00 C ATOM 1727 CE2 TYR A 110 -0.850 14.147 2.092 1.00 0.00 C ATOM 1728 CZ TYR A 110 -0.327 15.455 2.174 1.00 0.00 C ATOM 1729 OH TYR A 110 -1.141 16.518 1.928 1.00 0.00 O ATOM 0 H TYR A 110 3.648 10.046 2.044 1.00 0.00 H new ATOM 0 HA TYR A 110 3.760 12.891 1.533 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.780 11.187 2.056 1.00 0.00 H new ATOM 0 HB3 TYR A 110 2.164 11.605 3.714 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.913 14.668 2.974 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.417 12.047 2.264 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.434 16.636 2.618 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -1.895 13.994 1.867 1.00 0.00 H new ATOM 0 HH TYR A 110 -2.041 16.197 1.711 1.00 0.00 H new ATOM 1739 N GLU A 111 4.576 11.701 4.510 1.00 0.00 N ATOM 1740 CA GLU A 111 5.208 11.910 5.795 1.00 0.00 C ATOM 1741 C GLU A 111 6.737 12.030 5.659 1.00 0.00 C ATOM 1742 O GLU A 111 7.397 12.530 6.565 1.00 0.00 O ATOM 1743 CB GLU A 111 4.782 10.713 6.662 1.00 0.00 C ATOM 1744 CG GLU A 111 4.819 11.051 8.143 1.00 0.00 C ATOM 1745 CD GLU A 111 4.725 9.799 9.021 1.00 0.00 C ATOM 1746 OE1 GLU A 111 5.664 8.963 9.022 1.00 0.00 O ATOM 1747 OE2 GLU A 111 3.703 9.642 9.731 1.00 0.00 O ATOM 0 H GLU A 111 4.129 10.786 4.449 1.00 0.00 H new ATOM 0 HA GLU A 111 4.897 12.849 6.254 1.00 0.00 H new ATOM 0 HB2 GLU A 111 3.775 10.403 6.385 1.00 0.00 H new ATOM 0 HB3 GLU A 111 5.441 9.868 6.465 1.00 0.00 H new ATOM 0 HG2 GLU A 111 5.742 11.584 8.370 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.995 11.724 8.382 1.00 0.00 H new ATOM 1754 N GLU A 112 7.327 11.617 4.540 1.00 0.00 N ATOM 1755 CA GLU A 112 8.722 11.755 4.179 1.00 0.00 C ATOM 1756 C GLU A 112 8.994 13.195 3.798 1.00 0.00 C ATOM 1757 O GLU A 112 10.016 13.736 4.195 1.00 0.00 O ATOM 1758 CB GLU A 112 9.052 10.852 2.981 1.00 0.00 C ATOM 1759 CG GLU A 112 9.455 9.424 3.366 1.00 0.00 C ATOM 1760 CD GLU A 112 10.697 9.394 4.256 1.00 0.00 C ATOM 1761 OE1 GLU A 112 11.829 9.394 3.721 1.00 0.00 O ATOM 1762 OE2 GLU A 112 10.536 9.313 5.499 1.00 0.00 O ATOM 0 H GLU A 112 6.795 11.142 3.811 1.00 0.00 H new ATOM 0 HA GLU A 112 9.340 11.464 5.028 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.184 10.808 2.323 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.862 11.305 2.410 1.00 0.00 H new ATOM 0 HG2 GLU A 112 8.627 8.942 3.885 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.644 8.846 2.462 1.00 0.00 H new ATOM 1769 N LYS A 113 8.076 13.862 3.097 1.00 0.00 N ATOM 1770 CA LYS A 113 8.269 15.266 2.746 1.00 0.00 C ATOM 1771 C LYS A 113 8.260 16.150 4.000 1.00 0.00 C ATOM 1772 O LYS A 113 8.749 17.281 3.973 1.00 0.00 O ATOM 1773 CB LYS A 113 7.214 15.687 1.716 1.00 0.00 C ATOM 1774 CG LYS A 113 7.768 16.837 0.869 1.00 0.00 C ATOM 1775 CD LYS A 113 6.711 17.400 -0.077 1.00 0.00 C ATOM 1776 CE LYS A 113 7.245 18.666 -0.756 1.00 0.00 C ATOM 1777 NZ LYS A 113 7.008 19.871 0.063 1.00 0.00 N ATOM 0 H LYS A 113 7.201 13.456 2.765 1.00 0.00 H new ATOM 0 HA LYS A 113 9.249 15.398 2.288 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.954 14.842 1.078 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.300 15.999 2.221 1.00 0.00 H new ATOM 0 HG2 LYS A 113 8.130 17.630 1.524 1.00 0.00 H new ATOM 0 HG3 LYS A 113 8.623 16.485 0.292 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.449 16.656 -0.829 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.800 17.629 0.476 1.00 0.00 H new ATOM 0 HE2 LYS A 113 8.314 18.556 -0.940 1.00 0.00 H new ATOM 0 HE3 LYS A 113 6.765 18.787 -1.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.384 20.706 -0.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 5.986 19.990 0.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.487 19.767 0.980 1.00 0.00 H new ATOM 1791 N LEU A 114 7.670 15.650 5.086 1.00 0.00 N ATOM 1792 CA LEU A 114 7.661 16.259 6.406 1.00 0.00 C ATOM 1793 C LEU A 114 8.912 15.815 7.174 1.00 0.00 C ATOM 1794 O LEU A 114 9.572 16.628 7.818 1.00 0.00 O ATOM 1795 CB LEU A 114 6.380 15.855 7.158 1.00 0.00 C ATOM 1796 CG LEU A 114 5.141 16.710 6.846 1.00 0.00 C ATOM 1797 CD1 LEU A 114 4.654 16.600 5.397 1.00 0.00 C ATOM 1798 CD2 LEU A 114 4.011 16.341 7.812 1.00 0.00 C ATOM 0 H LEU A 114 7.162 14.766 5.062 1.00 0.00 H new ATOM 0 HA LEU A 114 7.672 17.345 6.315 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.153 14.815 6.923 1.00 0.00 H new ATOM 0 HB3 LEU A 114 6.576 15.905 8.229 1.00 0.00 H new ATOM 0 HG LEU A 114 5.440 17.750 6.980 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.777 17.233 5.259 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.446 16.924 4.721 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.392 15.565 5.179 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.132 16.947 7.592 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.763 15.286 7.696 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.333 16.528 8.837 1.00 0.00 H new ATOM 1810 N ALA A 115 9.260 14.526 7.111 1.00 0.00 N ATOM 1811 CA ALA A 115 10.363 13.972 7.889 1.00 0.00 C ATOM 1812 C ALA A 115 11.696 14.482 7.363 1.00 0.00 C ATOM 1813 O ALA A 115 12.597 14.717 8.160 1.00 0.00 O ATOM 1814 CB ALA A 115 10.352 12.442 7.863 1.00 0.00 C ATOM 0 H ALA A 115 8.785 13.843 6.521 1.00 0.00 H new ATOM 0 HA ALA A 115 10.233 14.300 8.920 1.00 0.00 H new ATOM 0 HB1 ALA A 115 11.187 12.062 8.452 1.00 0.00 H new ATOM 0 HB2 ALA A 115 9.415 12.078 8.284 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.447 12.095 6.834 1.00 0.00 H new ATOM 1820 N GLN A 116 11.821 14.680 6.048 1.00 0.00 N ATOM 1821 CA GLN A 116 13.026 15.203 5.419 1.00 0.00 C ATOM 1822 C GLN A 116 13.239 16.669 5.793 1.00 0.00 C ATOM 1823 O GLN A 116 14.376 17.126 5.863 1.00 0.00 O ATOM 1824 CB GLN A 116 12.997 14.992 3.897 1.00 0.00 C ATOM 1825 CG GLN A 116 12.086 15.962 3.122 1.00 0.00 C ATOM 1826 CD GLN A 116 11.945 15.580 1.649 1.00 0.00 C ATOM 1827 OE1 GLN A 116 11.990 14.415 1.268 1.00 0.00 O ATOM 1828 NE2 GLN A 116 11.756 16.544 0.762 1.00 0.00 N ATOM 0 H GLN A 116 11.073 14.477 5.384 1.00 0.00 H new ATOM 0 HA GLN A 116 13.881 14.643 5.798 1.00 0.00 H new ATOM 0 HB2 GLN A 116 14.013 15.086 3.513 1.00 0.00 H new ATOM 0 HB3 GLN A 116 12.673 13.972 3.693 1.00 0.00 H new ATOM 0 HG2 GLN A 116 11.100 15.979 3.586 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.490 16.972 3.195 1.00 0.00 H new ATOM 0 HE21 GLN A 116 11.717 17.517 1.067 1.00 0.00 H new ATOM 0 HE22 GLN A 116 11.650 16.314 -0.226 1.00 0.00 H new ATOM 1837 N ALA A 117 12.149 17.397 6.052 1.00 0.00 N ATOM 1838 CA ALA A 117 12.216 18.762 6.542 1.00 0.00 C ATOM 1839 C ALA A 117 12.837 18.732 7.938 1.00 0.00 C ATOM 1840 O ALA A 117 13.781 19.468 8.214 1.00 0.00 O ATOM 1841 CB ALA A 117 10.824 19.405 6.531 1.00 0.00 C ATOM 0 H ALA A 117 11.198 17.049 5.925 1.00 0.00 H new ATOM 0 HA ALA A 117 12.840 19.378 5.894 1.00 0.00 H new ATOM 0 HB1 ALA A 117 10.893 20.428 6.901 1.00 0.00 H new ATOM 0 HB2 ALA A 117 10.435 19.413 5.513 1.00 0.00 H new ATOM 0 HB3 ALA A 117 10.153 18.832 7.171 1.00 0.00 H new ATOM 1847 N ARG A 118 12.354 17.837 8.812 1.00 0.00 N ATOM 1848 CA ARG A 118 12.972 17.647 10.121 1.00 0.00 C ATOM 1849 C ARG A 118 14.427 17.224 9.960 1.00 0.00 C ATOM 1850 O ARG A 118 15.284 17.722 10.680 1.00 0.00 O ATOM 1851 CB ARG A 118 12.211 16.606 10.966 1.00 0.00 C ATOM 1852 CG ARG A 118 12.189 17.005 12.453 1.00 0.00 C ATOM 1853 CD ARG A 118 10.901 17.748 12.835 1.00 0.00 C ATOM 1854 NE ARG A 118 10.559 18.818 11.880 1.00 0.00 N ATOM 1855 CZ ARG A 118 9.466 18.864 11.108 1.00 0.00 C ATOM 1856 NH1 ARG A 118 8.404 18.103 11.355 1.00 0.00 N ATOM 1857 NH2 ARG A 118 9.423 19.670 10.062 1.00 0.00 N ATOM 0 H ARG A 118 11.545 17.241 8.634 1.00 0.00 H new ATOM 0 HA ARG A 118 12.928 18.600 10.647 1.00 0.00 H new ATOM 0 HB2 ARG A 118 11.190 16.511 10.597 1.00 0.00 H new ATOM 0 HB3 ARG A 118 12.682 15.629 10.856 1.00 0.00 H new ATOM 0 HG2 ARG A 118 12.287 16.111 13.069 1.00 0.00 H new ATOM 0 HG3 ARG A 118 13.050 17.638 12.670 1.00 0.00 H new ATOM 0 HD2 ARG A 118 10.077 17.036 12.888 1.00 0.00 H new ATOM 0 HD3 ARG A 118 11.015 18.177 13.830 1.00 0.00 H new ATOM 0 HE ARG A 118 11.215 19.595 11.800 1.00 0.00 H new ATOM 0 HH11 ARG A 118 8.409 17.463 12.150 1.00 0.00 H new ATOM 0 HH12 ARG A 118 7.585 18.159 10.750 1.00 0.00 H new ATOM 0 HH21 ARG A 118 10.225 20.260 9.840 1.00 0.00 H new ATOM 0 HH22 ARG A 118 8.588 19.702 9.477 1.00 0.00 H new ATOM 1871 N GLU A 119 14.700 16.318 9.023 1.00 0.00 N ATOM 1872 CA GLU A 119 16.000 15.713 8.791 1.00 0.00 C ATOM 1873 C GLU A 119 17.038 16.781 8.466 1.00 0.00 C ATOM 1874 O GLU A 119 18.191 16.594 8.836 1.00 0.00 O ATOM 1875 CB GLU A 119 15.888 14.661 7.680 1.00 0.00 C ATOM 1876 CG GLU A 119 17.117 13.757 7.561 1.00 0.00 C ATOM 1877 CD GLU A 119 16.896 12.594 6.590 1.00 0.00 C ATOM 1878 OE1 GLU A 119 16.178 12.750 5.576 1.00 0.00 O ATOM 1879 OE2 GLU A 119 17.501 11.518 6.801 1.00 0.00 O ATOM 0 H GLU A 119 13.987 15.974 8.380 1.00 0.00 H new ATOM 0 HA GLU A 119 16.335 15.210 9.698 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.010 14.042 7.865 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.727 15.167 6.728 1.00 0.00 H new ATOM 0 HG2 GLU A 119 17.969 14.349 7.226 1.00 0.00 H new ATOM 0 HG3 GLU A 119 17.370 13.362 8.545 1.00 0.00 H new ATOM 1886 N SER A 120 16.640 17.896 7.844 1.00 0.00 N ATOM 1887 CA SER A 120 17.511 19.040 7.601 1.00 0.00 C ATOM 1888 C SER A 120 17.997 19.639 8.925 1.00 0.00 C ATOM 1889 O SER A 120 19.188 19.868 9.098 1.00 0.00 O ATOM 1890 CB SER A 120 16.771 20.107 6.787 1.00 0.00 C ATOM 1891 OG SER A 120 16.264 19.572 5.577 1.00 0.00 O ATOM 0 H SER A 120 15.691 18.026 7.493 1.00 0.00 H new ATOM 0 HA SER A 120 18.377 18.697 7.034 1.00 0.00 H new ATOM 0 HB2 SER A 120 15.951 20.515 7.378 1.00 0.00 H new ATOM 0 HB3 SER A 120 17.447 20.933 6.567 1.00 0.00 H new ATOM 0 HG SER A 120 15.565 18.915 5.777 1.00 0.00 H new ATOM 1897 N ILE A 121 17.105 19.836 9.897 1.00 0.00 N ATOM 1898 CA ILE A 121 17.480 20.357 11.209 1.00 0.00 C ATOM 1899 C ILE A 121 18.397 19.340 11.906 1.00 0.00 C ATOM 1900 O ILE A 121 19.343 19.733 12.591 1.00 0.00 O ATOM 1901 CB ILE A 121 16.206 20.731 12.013 1.00 0.00 C ATOM 1902 CG1 ILE A 121 15.567 22.048 11.506 1.00 0.00 C ATOM 1903 CG2 ILE A 121 16.480 20.929 13.512 1.00 0.00 C ATOM 1904 CD1 ILE A 121 14.838 21.959 10.163 1.00 0.00 C ATOM 0 H ILE A 121 16.109 19.640 9.797 1.00 0.00 H new ATOM 0 HA ILE A 121 18.051 21.281 11.122 1.00 0.00 H new ATOM 0 HB ILE A 121 15.534 19.886 11.864 1.00 0.00 H new ATOM 0 HG12 ILE A 121 14.862 22.401 12.258 1.00 0.00 H new ATOM 0 HG13 ILE A 121 16.350 22.802 11.424 1.00 0.00 H new ATOM 0 HG21 ILE A 121 15.551 21.189 14.020 1.00 0.00 H new ATOM 0 HG22 ILE A 121 16.879 20.007 13.934 1.00 0.00 H new ATOM 0 HG23 ILE A 121 17.204 21.732 13.646 1.00 0.00 H new ATOM 0 HD11 ILE A 121 14.430 22.936 9.905 1.00 0.00 H new ATOM 0 HD12 ILE A 121 15.538 21.642 9.390 1.00 0.00 H new ATOM 0 HD13 ILE A 121 14.026 21.235 10.237 1.00 0.00 H new ATOM 1916 N ILE A 122 18.170 18.034 11.726 1.00 0.00 N ATOM 1917 CA ILE A 122 19.073 17.018 12.268 1.00 0.00 C ATOM 1918 C ILE A 122 20.365 16.926 11.422 1.00 0.00 C ATOM 1919 O ILE A 122 21.361 16.392 11.906 1.00 0.00 O ATOM 1920 CB ILE A 122 18.359 15.655 12.453 1.00 0.00 C ATOM 1921 CG1 ILE A 122 16.905 15.727 12.983 1.00 0.00 C ATOM 1922 CG2 ILE A 122 19.149 14.759 13.420 1.00 0.00 C ATOM 1923 CD1 ILE A 122 16.696 16.465 14.315 1.00 0.00 C ATOM 0 H ILE A 122 17.373 17.659 11.212 1.00 0.00 H new ATOM 0 HA ILE A 122 19.377 17.325 13.269 1.00 0.00 H new ATOM 0 HB ILE A 122 18.316 15.248 11.443 1.00 0.00 H new ATOM 0 HG12 ILE A 122 16.289 16.211 12.225 1.00 0.00 H new ATOM 0 HG13 ILE A 122 16.532 14.709 13.095 1.00 0.00 H new ATOM 0 HG21 ILE A 122 18.632 13.806 13.538 1.00 0.00 H new ATOM 0 HG22 ILE A 122 20.148 14.583 13.020 1.00 0.00 H new ATOM 0 HG23 ILE A 122 19.228 15.251 14.389 1.00 0.00 H new ATOM 0 HD11 ILE A 122 15.639 16.447 14.579 1.00 0.00 H new ATOM 0 HD12 ILE A 122 17.274 15.974 15.098 1.00 0.00 H new ATOM 0 HD13 ILE A 122 17.027 17.499 14.214 1.00 0.00 H new ATOM 1935 N ALA A 123 20.395 17.458 10.192 1.00 0.00 N ATOM 1936 CA ALA A 123 21.579 17.549 9.352 1.00 0.00 C ATOM 1937 C ALA A 123 22.475 18.653 9.908 1.00 0.00 C ATOM 1938 O ALA A 123 23.683 18.449 10.043 1.00 0.00 O ATOM 1939 CB ALA A 123 21.230 17.770 7.874 1.00 0.00 C ATOM 0 H ALA A 123 19.564 17.847 9.747 1.00 0.00 H new ATOM 0 HA ALA A 123 22.115 16.600 9.377 1.00 0.00 H new ATOM 0 HB1 ALA A 123 22.147 17.831 7.289 1.00 0.00 H new ATOM 0 HB2 ALA A 123 20.625 16.938 7.515 1.00 0.00 H new ATOM 0 HB3 ALA A 123 20.669 18.699 7.767 1.00 0.00 H new ATOM 1945 N ASP A 124 21.879 19.797 10.261 1.00 0.00 N ATOM 1946 CA ASP A 124 22.557 20.911 10.943 1.00 0.00 C ATOM 1947 C ASP A 124 23.006 20.415 12.334 1.00 0.00 C ATOM 1948 O ASP A 124 23.969 20.896 12.932 1.00 0.00 O ATOM 1949 CB ASP A 124 21.608 22.113 11.112 1.00 0.00 C ATOM 1950 CG ASP A 124 20.946 22.595 9.817 1.00 0.00 C ATOM 1951 OD1 ASP A 124 21.582 22.510 8.736 1.00 0.00 O ATOM 1952 OD2 ASP A 124 19.767 23.015 9.884 1.00 0.00 O ATOM 0 H ASP A 124 20.892 19.981 10.078 1.00 0.00 H new ATOM 0 HA ASP A 124 23.411 21.235 10.348 1.00 0.00 H new ATOM 0 HB2 ASP A 124 20.828 21.845 11.824 1.00 0.00 H new ATOM 0 HB3 ASP A 124 22.167 22.941 11.548 1.00 0.00 H new ATOM 1957 N ASN A 125 22.299 19.384 12.806 1.00 0.00 N ATOM 1958 CA ASN A 125 22.434 18.545 13.979 1.00 0.00 C ATOM 1959 C ASN A 125 22.483 19.295 15.292 1.00 0.00 C ATOM 1960 O ASN A 125 21.524 19.215 16.061 1.00 0.00 O ATOM 1961 CB ASN A 125 23.588 17.540 13.838 1.00 0.00 C ATOM 1962 CG ASN A 125 23.336 16.379 14.783 1.00 0.00 C ATOM 1963 OD1 ASN A 125 23.770 16.377 15.932 1.00 0.00 O ATOM 1964 ND2 ASN A 125 22.568 15.400 14.344 1.00 0.00 N ATOM 0 H ASN A 125 21.484 19.079 12.273 1.00 0.00 H new ATOM 0 HA ASN A 125 21.504 17.978 14.024 1.00 0.00 H new ATOM 0 HB2 ASN A 125 23.656 17.184 12.810 1.00 0.00 H new ATOM 0 HB3 ASN A 125 24.538 18.020 14.073 1.00 0.00 H new ATOM 0 HD21 ASN A 125 22.326 14.625 14.962 1.00 0.00 H new ATOM 0 HD22 ASN A 125 22.216 15.418 13.387 1.00 0.00 H new ATOM 1971 N ASN A 126 23.583 19.978 15.575 1.00 0.00 N ATOM 1972 CA ASN A 126 23.842 20.643 16.846 1.00 0.00 C ATOM 1973 C ASN A 126 24.179 22.126 16.661 1.00 0.00 C ATOM 1974 O ASN A 126 24.087 22.879 17.622 1.00 0.00 O ATOM 1975 CB ASN A 126 24.948 19.863 17.570 1.00 0.00 C ATOM 1976 CG ASN A 126 25.117 20.306 19.016 1.00 0.00 C ATOM 1977 OD1 ASN A 126 24.245 20.037 19.844 1.00 0.00 O ATOM 1978 ND2 ASN A 126 26.244 20.905 19.349 1.00 0.00 N ATOM 0 H ASN A 126 24.345 20.089 14.906 1.00 0.00 H new ATOM 0 HA ASN A 126 22.942 20.639 17.461 1.00 0.00 H new ATOM 0 HB2 ASN A 126 24.715 18.798 17.544 1.00 0.00 H new ATOM 0 HB3 ASN A 126 25.891 19.997 17.039 1.00 0.00 H new ATOM 0 HD21 ASN A 126 26.417 21.162 20.321 1.00 0.00 H new ATOM 0 HD22 ASN A 126 26.942 21.111 18.635 1.00 0.00 H new ATOM 1985 N ILE A 127 24.495 22.542 15.424 1.00 0.00 N ATOM 1986 CA ILE A 127 24.853 23.890 14.960 1.00 0.00 C ATOM 1987 C ILE A 127 26.011 24.491 15.778 1.00 0.00 C ATOM 1988 O ILE A 127 26.231 25.701 15.823 1.00 0.00 O ATOM 1989 CB ILE A 127 23.588 24.758 14.698 1.00 0.00 C ATOM 1990 CG1 ILE A 127 23.838 26.000 13.812 1.00 0.00 C ATOM 1991 CG2 ILE A 127 22.847 25.203 15.972 1.00 0.00 C ATOM 1992 CD1 ILE A 127 24.429 25.684 12.433 1.00 0.00 C ATOM 0 H ILE A 127 24.507 21.878 14.650 1.00 0.00 H new ATOM 0 HA ILE A 127 25.299 23.845 13.966 1.00 0.00 H new ATOM 0 HB ILE A 127 22.949 24.065 14.150 1.00 0.00 H new ATOM 0 HG12 ILE A 127 22.896 26.531 13.677 1.00 0.00 H new ATOM 0 HG13 ILE A 127 24.513 26.676 14.337 1.00 0.00 H new ATOM 0 HG21 ILE A 127 21.979 25.803 15.697 1.00 0.00 H new ATOM 0 HG22 ILE A 127 22.520 24.325 16.528 1.00 0.00 H new ATOM 0 HG23 ILE A 127 23.517 25.797 16.594 1.00 0.00 H new ATOM 0 HD11 ILE A 127 24.572 26.611 11.878 1.00 0.00 H new ATOM 0 HD12 ILE A 127 25.389 25.182 12.555 1.00 0.00 H new ATOM 0 HD13 ILE A 127 23.747 25.034 11.885 1.00 0.00 H new ATOM 2004 N GLN A 128 26.768 23.592 16.397 1.00 0.00 N ATOM 2005 CA GLN A 128 27.928 23.773 17.247 1.00 0.00 C ATOM 2006 C GLN A 128 28.632 22.426 17.238 1.00 0.00 C ATOM 2007 O GLN A 128 29.866 22.416 17.417 1.00 0.00 O ATOM 2008 CB GLN A 128 27.459 24.190 18.659 1.00 0.00 C ATOM 2009 CG GLN A 128 28.532 24.156 19.763 1.00 0.00 C ATOM 2010 CD GLN A 128 28.599 22.812 20.501 1.00 0.00 C ATOM 2011 OE1 GLN A 128 27.858 22.567 21.449 1.00 0.00 O ATOM 2012 NE2 GLN A 128 29.469 21.906 20.094 1.00 0.00 N ATOM 2013 OXT GLN A 128 27.909 21.406 17.156 1.00 0.00 O ATOM 0 H GLN A 128 26.552 22.600 16.299 1.00 0.00 H new ATOM 0 HA GLN A 128 28.605 24.557 16.907 1.00 0.00 H new ATOM 0 HB2 GLN A 128 27.056 25.201 18.603 1.00 0.00 H new ATOM 0 HB3 GLN A 128 26.639 23.536 18.956 1.00 0.00 H new ATOM 0 HG2 GLN A 128 29.505 24.369 19.321 1.00 0.00 H new ATOM 0 HG3 GLN A 128 28.328 24.949 20.483 1.00 0.00 H new ATOM 0 HE21 GLN A 128 30.085 22.108 19.307 1.00 0.00 H new ATOM 0 HE22 GLN A 128 29.525 21.004 20.567 1.00 0.00 H new TER 2022 GLN A 128