USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 923 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 61 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 62 SER OG : rot -46:sc= 0.0832! USER MOD Set 1.3: A 82 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 5 SER OG : rot -47:sc= -0.424 USER MOD Set 2.2: A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 32:sc= 0.387 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 17:sc= 0.546 USER MOD Single : A 18 THR OG1 : rot 16:sc= 0.221! USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot 160:sc= 0.014 USER MOD Single : A 36 GLN : amide:sc= -0.0125 X(o=-0.013,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc=-0.000955 X(o=-0.00096,f=-0.0062) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=-0.0057) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.224) USER MOD Single : A 51 ASN : amide:sc= -0.0475 K(o=-0.048,f=-1.2) USER MOD Single : A 53 GLN : amide:sc= -0.045 K(o=-0.045,f=-1.1!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 HIS : no HE2:sc= 0.0139! C(o=0.014!,f=-8.1!) USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 7:sc= 0.0557 USER MOD Single : A 77 MET CE :methyl -143:sc= -0.394 (180deg=-1.98!) USER MOD Single : A 79 CYS SG : rot 120:sc= -2.32 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.0102 X(o=-0.01,f=-0.064) USER MOD Single : A 98 CYS SG : rot -110:sc= -8.35! USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0.028) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0353 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.199 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= -0.0559 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.395 -6.340 30.950 1.00 0.00 N ATOM 2 CA GLY A 1 2.035 -4.943 30.781 1.00 0.00 C ATOM 3 C GLY A 1 1.983 -4.566 29.299 1.00 0.00 C ATOM 4 O GLY A 1 2.977 -4.698 28.586 1.00 0.00 O ATOM 0 H1 GLY A 1 2.424 -6.571 31.964 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.689 -6.940 30.478 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.331 -6.511 30.530 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.065 -4.755 31.242 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.760 -4.312 31.295 1.00 0.00 H new ATOM 8 N SER A 2 0.815 -4.104 28.880 1.00 0.00 N ATOM 9 CA SER A 2 0.620 -3.707 27.496 1.00 0.00 C ATOM 10 C SER A 2 1.502 -2.500 27.169 1.00 0.00 C ATOM 11 O SER A 2 1.382 -1.450 27.799 1.00 0.00 O ATOM 12 CB SER A 2 -0.849 -3.382 27.217 1.00 0.00 C ATOM 13 OG SER A 2 -1.577 -4.530 26.790 1.00 0.00 O ATOM 0 H SER A 2 -0.007 -3.995 29.475 1.00 0.00 H new ATOM 0 HA SER A 2 0.906 -4.543 26.857 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.308 -2.976 28.118 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.910 -2.608 26.452 1.00 0.00 H new ATOM 0 HG SER A 2 -2.510 -4.282 26.624 1.00 0.00 H new ATOM 19 N SER A 3 2.367 -2.688 26.183 1.00 0.00 N ATOM 20 CA SER A 3 3.268 -1.628 25.765 1.00 0.00 C ATOM 21 C SER A 3 3.715 -1.861 24.320 1.00 0.00 C ATOM 22 O SER A 3 3.642 -2.981 23.817 1.00 0.00 O ATOM 23 CB SER A 3 4.484 -1.542 26.690 1.00 0.00 C ATOM 24 OG SER A 3 4.245 -0.691 27.807 1.00 0.00 O ATOM 0 H SER A 3 2.463 -3.559 25.661 1.00 0.00 H new ATOM 0 HA SER A 3 2.733 -0.680 25.825 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.742 -2.540 27.043 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.341 -1.171 26.128 1.00 0.00 H new ATOM 0 HG SER A 3 3.298 -0.735 28.055 1.00 0.00 H new ATOM 30 N GLY A 4 4.168 -0.785 23.694 1.00 0.00 N ATOM 31 CA GLY A 4 4.627 -0.858 22.317 1.00 0.00 C ATOM 32 C GLY A 4 4.199 0.382 21.530 1.00 0.00 C ATOM 33 O GLY A 4 5.023 1.244 21.227 1.00 0.00 O ATOM 0 H GLY A 4 4.227 0.142 24.115 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.713 -0.949 22.296 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.223 -1.752 21.842 1.00 0.00 H new ATOM 37 N SER A 5 2.912 0.433 21.221 1.00 0.00 N ATOM 38 CA SER A 5 2.365 1.554 20.475 1.00 0.00 C ATOM 39 C SER A 5 2.148 2.747 21.408 1.00 0.00 C ATOM 40 O SER A 5 1.056 2.929 21.945 1.00 0.00 O ATOM 41 CB SER A 5 1.052 1.170 19.789 1.00 0.00 C ATOM 42 OG SER A 5 1.259 0.734 18.448 1.00 0.00 O ATOM 0 H SER A 5 2.232 -0.284 21.474 1.00 0.00 H new ATOM 0 HA SER A 5 3.080 1.832 19.701 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.564 0.378 20.357 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.377 2.026 19.792 1.00 0.00 H new ATOM 0 HG SER A 5 1.853 1.363 17.987 1.00 0.00 H new ATOM 48 N SER A 6 3.204 3.530 21.572 1.00 0.00 N ATOM 49 CA SER A 6 3.143 4.700 22.430 1.00 0.00 C ATOM 50 C SER A 6 2.720 5.925 21.615 1.00 0.00 C ATOM 51 O SER A 6 3.001 6.007 20.421 1.00 0.00 O ATOM 52 CB SER A 6 4.489 4.955 23.111 1.00 0.00 C ATOM 53 OG SER A 6 4.370 4.993 24.531 1.00 0.00 O ATOM 0 H SER A 6 4.108 3.376 21.124 1.00 0.00 H new ATOM 0 HA SER A 6 2.402 4.515 23.208 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.193 4.173 22.827 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.902 5.899 22.756 1.00 0.00 H new ATOM 0 HG SER A 6 5.251 5.156 24.929 1.00 0.00 H new ATOM 59 N GLY A 7 2.052 6.845 22.295 1.00 0.00 N ATOM 60 CA GLY A 7 1.588 8.061 21.649 1.00 0.00 C ATOM 61 C GLY A 7 0.149 7.904 21.152 1.00 0.00 C ATOM 62 O GLY A 7 -0.539 6.954 21.524 1.00 0.00 O ATOM 0 H GLY A 7 1.821 6.773 23.286 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.646 8.894 22.350 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.241 8.304 20.811 1.00 0.00 H new ATOM 66 N TYR A 8 -0.263 8.848 20.319 1.00 0.00 N ATOM 67 CA TYR A 8 -1.607 8.826 19.768 1.00 0.00 C ATOM 68 C TYR A 8 -1.595 8.350 18.314 1.00 0.00 C ATOM 69 O TYR A 8 -0.588 8.484 17.621 1.00 0.00 O ATOM 70 CB TYR A 8 -2.106 10.272 19.814 1.00 0.00 C ATOM 71 CG TYR A 8 -1.346 11.222 18.887 1.00 0.00 C ATOM 72 CD1 TYR A 8 -1.516 11.135 17.520 1.00 0.00 C ATOM 73 CD2 TYR A 8 -0.490 12.166 19.417 1.00 0.00 C ATOM 74 CE1 TYR A 8 -0.800 12.030 16.647 1.00 0.00 C ATOM 75 CE2 TYR A 8 0.225 13.061 18.544 1.00 0.00 C ATOM 76 CZ TYR A 8 0.035 12.949 17.203 1.00 0.00 C ATOM 77 OH TYR A 8 0.710 13.794 16.378 1.00 0.00 O ATOM 0 H TYR A 8 0.311 9.634 20.012 1.00 0.00 H new ATOM 0 HA TYR A 8 -2.243 8.146 20.335 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -3.163 10.289 19.548 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -2.029 10.640 20.837 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -2.186 10.396 17.105 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -0.356 12.234 20.487 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -0.923 11.973 15.576 1.00 0.00 H new ATOM 0 HE2 TYR A 8 0.897 13.805 18.946 1.00 0.00 H new ATOM 0 HH TYR A 8 1.268 14.397 16.913 1.00 0.00 H new ATOM 87 N PRO A 9 -2.756 7.788 17.884 1.00 0.00 N ATOM 88 CA PRO A 9 -2.889 7.291 16.525 1.00 0.00 C ATOM 89 C PRO A 9 -3.038 8.444 15.531 1.00 0.00 C ATOM 90 O PRO A 9 -3.808 9.375 15.765 1.00 0.00 O ATOM 91 CB PRO A 9 -4.101 6.375 16.558 1.00 0.00 C ATOM 92 CG PRO A 9 -4.876 6.753 17.810 1.00 0.00 C ATOM 93 CD PRO A 9 -3.970 7.612 18.677 1.00 0.00 C ATOM 0 HA PRO A 9 -2.006 6.749 16.187 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -4.713 6.505 15.666 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -3.799 5.328 16.587 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -5.783 7.298 17.548 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -5.187 5.859 18.351 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.435 8.571 18.907 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -3.755 7.125 19.628 1.00 0.00 H new ATOM 101 N ILE A 10 -2.290 8.346 14.442 1.00 0.00 N ATOM 102 CA ILE A 10 -2.329 9.370 13.412 1.00 0.00 C ATOM 103 C ILE A 10 -3.639 9.250 12.630 1.00 0.00 C ATOM 104 O ILE A 10 -4.287 10.254 12.339 1.00 0.00 O ATOM 105 CB ILE A 10 -1.079 9.294 12.533 1.00 0.00 C ATOM 106 CG1 ILE A 10 0.191 9.280 13.387 1.00 0.00 C ATOM 107 CG2 ILE A 10 -1.064 10.424 11.502 1.00 0.00 C ATOM 108 CD1 ILE A 10 1.430 9.041 12.522 1.00 0.00 C ATOM 0 H ILE A 10 -1.653 7.573 14.250 1.00 0.00 H new ATOM 0 HA ILE A 10 -2.314 10.363 13.861 1.00 0.00 H new ATOM 0 HB ILE A 10 -1.106 8.355 11.980 1.00 0.00 H new ATOM 0 HG12 ILE A 10 0.289 10.229 13.915 1.00 0.00 H new ATOM 0 HG13 ILE A 10 0.116 8.500 14.144 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -0.165 10.347 10.890 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.945 10.346 10.864 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.072 11.385 12.016 1.00 0.00 H new ATOM 0 HD11 ILE A 10 2.319 9.036 13.153 1.00 0.00 H new ATOM 0 HD12 ILE A 10 1.340 8.081 12.014 1.00 0.00 H new ATOM 0 HD13 ILE A 10 1.516 9.836 11.781 1.00 0.00 H new ATOM 120 N GLY A 11 -3.989 8.013 12.311 1.00 0.00 N ATOM 121 CA GLY A 11 -5.210 7.748 11.568 1.00 0.00 C ATOM 122 C GLY A 11 -5.409 6.246 11.358 1.00 0.00 C ATOM 123 O GLY A 11 -4.448 5.515 11.125 1.00 0.00 O ATOM 0 H GLY A 11 -3.449 7.183 12.553 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -6.064 8.160 12.106 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -5.169 8.252 10.602 1.00 0.00 H new ATOM 127 N GLU A 12 -6.664 5.830 11.447 1.00 0.00 N ATOM 128 CA GLU A 12 -7.002 4.428 11.269 1.00 0.00 C ATOM 129 C GLU A 12 -7.577 4.194 9.871 1.00 0.00 C ATOM 130 O GLU A 12 -8.343 5.013 9.366 1.00 0.00 O ATOM 131 CB GLU A 12 -7.978 3.958 12.350 1.00 0.00 C ATOM 132 CG GLU A 12 -8.249 2.457 12.228 1.00 0.00 C ATOM 133 CD GLU A 12 -9.599 2.197 11.556 1.00 0.00 C ATOM 134 OE1 GLU A 12 -10.621 2.574 12.170 1.00 0.00 O ATOM 135 OE2 GLU A 12 -9.580 1.627 10.444 1.00 0.00 O ATOM 0 H GLU A 12 -7.459 6.439 11.640 1.00 0.00 H new ATOM 0 HA GLU A 12 -6.090 3.839 11.368 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -7.568 4.178 13.336 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -8.915 4.509 12.264 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -7.454 1.986 11.650 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -8.237 2.000 13.217 1.00 0.00 H new ATOM 142 N ALA A 13 -7.186 3.072 9.285 1.00 0.00 N ATOM 143 CA ALA A 13 -7.653 2.720 7.955 1.00 0.00 C ATOM 144 C ALA A 13 -8.127 1.265 7.954 1.00 0.00 C ATOM 145 O ALA A 13 -7.440 0.384 8.469 1.00 0.00 O ATOM 146 CB ALA A 13 -6.537 2.970 6.939 1.00 0.00 C ATOM 0 H ALA A 13 -6.551 2.395 9.707 1.00 0.00 H new ATOM 0 HA ALA A 13 -8.500 3.343 7.669 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.887 2.706 5.941 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.257 4.023 6.958 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -5.671 2.359 7.193 1.00 0.00 H new ATOM 152 N SER A 14 -9.298 1.058 7.370 1.00 0.00 N ATOM 153 CA SER A 14 -9.872 -0.275 7.296 1.00 0.00 C ATOM 154 C SER A 14 -9.613 -0.880 5.914 1.00 0.00 C ATOM 155 O SER A 14 -9.434 -0.153 4.938 1.00 0.00 O ATOM 156 CB SER A 14 -11.373 -0.245 7.589 1.00 0.00 C ATOM 157 OG SER A 14 -11.649 0.185 8.919 1.00 0.00 O ATOM 0 H SER A 14 -9.865 1.791 6.944 1.00 0.00 H new ATOM 0 HA SER A 14 -9.394 -0.896 8.053 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.867 0.422 6.883 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.792 -1.239 7.435 1.00 0.00 H new ATOM 0 HG SER A 14 -10.858 0.630 9.290 1.00 0.00 H new ATOM 163 N ILE A 15 -9.601 -2.204 5.876 1.00 0.00 N ATOM 164 CA ILE A 15 -9.367 -2.915 4.631 1.00 0.00 C ATOM 165 C ILE A 15 -10.710 -3.314 4.016 1.00 0.00 C ATOM 166 O ILE A 15 -11.542 -3.930 4.680 1.00 0.00 O ATOM 167 CB ILE A 15 -8.419 -4.094 4.857 1.00 0.00 C ATOM 168 CG1 ILE A 15 -6.994 -3.609 5.126 1.00 0.00 C ATOM 169 CG2 ILE A 15 -8.478 -5.077 3.686 1.00 0.00 C ATOM 170 CD1 ILE A 15 -6.091 -4.768 5.554 1.00 0.00 C ATOM 0 H ILE A 15 -9.750 -2.803 6.688 1.00 0.00 H new ATOM 0 HA ILE A 15 -8.866 -2.268 3.911 1.00 0.00 H new ATOM 0 HB ILE A 15 -8.749 -4.631 5.746 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -6.590 -3.141 4.228 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -7.007 -2.847 5.905 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.795 -5.906 3.872 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -9.493 -5.460 3.583 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.188 -4.567 2.768 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -5.084 -4.395 5.739 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.484 -5.218 6.465 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -6.061 -5.517 4.763 1.00 0.00 H new ATOM 182 N LEU A 16 -10.880 -2.946 2.755 1.00 0.00 N ATOM 183 CA LEU A 16 -12.108 -3.258 2.043 1.00 0.00 C ATOM 184 C LEU A 16 -11.870 -4.460 1.127 1.00 0.00 C ATOM 185 O LEU A 16 -12.748 -5.308 0.969 1.00 0.00 O ATOM 186 CB LEU A 16 -12.632 -2.021 1.310 1.00 0.00 C ATOM 187 CG LEU A 16 -12.625 -0.716 2.109 1.00 0.00 C ATOM 188 CD1 LEU A 16 -12.975 0.476 1.215 1.00 0.00 C ATOM 189 CD2 LEU A 16 -13.549 -0.811 3.324 1.00 0.00 C ATOM 0 H LEU A 16 -10.188 -2.435 2.208 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.893 -3.541 2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.035 -1.876 0.410 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.654 -2.220 0.986 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.615 -0.552 2.485 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -12.963 1.391 1.807 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -12.243 0.555 0.411 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -13.968 0.332 0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -13.525 0.130 3.874 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.568 -1.011 2.992 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -13.214 -1.620 3.974 1.00 0.00 H new ATOM 201 N ALA A 17 -10.679 -4.496 0.548 1.00 0.00 N ATOM 202 CA ALA A 17 -10.315 -5.580 -0.348 1.00 0.00 C ATOM 203 C ALA A 17 -8.824 -5.886 -0.192 1.00 0.00 C ATOM 204 O ALA A 17 -8.045 -5.014 0.189 1.00 0.00 O ATOM 205 CB ALA A 17 -10.686 -5.203 -1.784 1.00 0.00 C ATOM 0 H ALA A 17 -9.954 -3.792 0.682 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.866 -6.486 -0.097 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -10.413 -6.017 -2.456 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.759 -5.025 -1.848 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.150 -4.299 -2.073 1.00 0.00 H new ATOM 211 N THR A 18 -8.472 -7.127 -0.495 1.00 0.00 N ATOM 212 CA THR A 18 -7.088 -7.558 -0.394 1.00 0.00 C ATOM 213 C THR A 18 -6.689 -8.367 -1.630 1.00 0.00 C ATOM 214 O THR A 18 -7.442 -9.229 -2.081 1.00 0.00 O ATOM 215 CB THR A 18 -6.929 -8.332 0.916 1.00 0.00 C ATOM 216 OG1 THR A 18 -7.649 -9.542 0.694 1.00 0.00 O ATOM 217 CG2 THR A 18 -7.665 -7.669 2.082 1.00 0.00 C ATOM 0 H THR A 18 -9.121 -7.848 -0.810 1.00 0.00 H new ATOM 0 HA THR A 18 -6.409 -6.706 -0.370 1.00 0.00 H new ATOM 0 HB THR A 18 -5.870 -8.420 1.159 1.00 0.00 H new ATOM 0 HG1 THR A 18 -7.807 -9.657 -0.266 1.00 0.00 H new ATOM 0 HG21 THR A 18 -7.519 -8.259 2.987 1.00 0.00 H new ATOM 0 HG22 THR A 18 -7.271 -6.664 2.237 1.00 0.00 H new ATOM 0 HG23 THR A 18 -8.729 -7.611 1.854 1.00 0.00 H new ATOM 225 N PHE A 19 -5.507 -8.059 -2.143 1.00 0.00 N ATOM 226 CA PHE A 19 -4.999 -8.747 -3.318 1.00 0.00 C ATOM 227 C PHE A 19 -3.470 -8.718 -3.352 1.00 0.00 C ATOM 228 O PHE A 19 -2.835 -8.204 -2.432 1.00 0.00 O ATOM 229 CB PHE A 19 -5.539 -8.001 -4.540 1.00 0.00 C ATOM 230 CG PHE A 19 -5.121 -6.531 -4.607 1.00 0.00 C ATOM 231 CD1 PHE A 19 -3.828 -6.203 -4.872 1.00 0.00 C ATOM 232 CD2 PHE A 19 -6.042 -5.552 -4.401 1.00 0.00 C ATOM 233 CE1 PHE A 19 -3.440 -4.838 -4.934 1.00 0.00 C ATOM 234 CE2 PHE A 19 -5.654 -4.187 -4.462 1.00 0.00 C ATOM 235 CZ PHE A 19 -4.361 -3.859 -4.728 1.00 0.00 C ATOM 0 H PHE A 19 -4.886 -7.342 -1.767 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.315 -9.790 -3.305 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.196 -8.507 -5.442 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -6.627 -8.059 -4.536 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.096 -6.980 -5.035 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -7.069 -5.812 -4.191 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -2.413 -4.578 -5.145 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -6.385 -3.410 -4.297 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.066 -2.821 -4.776 1.00 0.00 H new ATOM 245 N THR A 20 -2.923 -9.276 -4.422 1.00 0.00 N ATOM 246 CA THR A 20 -1.480 -9.321 -4.588 1.00 0.00 C ATOM 247 C THR A 20 -1.074 -8.651 -5.902 1.00 0.00 C ATOM 248 O THR A 20 -1.905 -8.456 -6.787 1.00 0.00 O ATOM 249 CB THR A 20 -1.038 -10.782 -4.489 1.00 0.00 C ATOM 250 OG1 THR A 20 -1.877 -11.331 -3.476 1.00 0.00 O ATOM 251 CG2 THR A 20 0.375 -10.929 -3.922 1.00 0.00 C ATOM 0 H THR A 20 -3.453 -9.701 -5.183 1.00 0.00 H new ATOM 0 HA THR A 20 -0.974 -8.760 -3.803 1.00 0.00 H new ATOM 0 HB THR A 20 -1.083 -11.242 -5.476 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.659 -12.278 -3.348 1.00 0.00 H new ATOM 0 HG21 THR A 20 0.639 -11.985 -3.873 1.00 0.00 H new ATOM 0 HG22 THR A 20 1.082 -10.408 -4.567 1.00 0.00 H new ATOM 0 HG23 THR A 20 0.412 -10.499 -2.921 1.00 0.00 H new ATOM 259 N VAL A 21 0.205 -8.316 -5.987 1.00 0.00 N ATOM 260 CA VAL A 21 0.733 -7.671 -7.178 1.00 0.00 C ATOM 261 C VAL A 21 2.011 -8.388 -7.616 1.00 0.00 C ATOM 262 O VAL A 21 2.669 -9.041 -6.808 1.00 0.00 O ATOM 263 CB VAL A 21 0.944 -6.179 -6.915 1.00 0.00 C ATOM 264 CG1 VAL A 21 -0.392 -5.433 -6.885 1.00 0.00 C ATOM 265 CG2 VAL A 21 1.726 -5.955 -5.620 1.00 0.00 C ATOM 0 H VAL A 21 0.892 -8.479 -5.251 1.00 0.00 H new ATOM 0 HA VAL A 21 0.021 -7.744 -8.000 1.00 0.00 H new ATOM 0 HB VAL A 21 1.535 -5.775 -7.737 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.213 -4.374 -6.696 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -0.896 -5.551 -7.844 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -1.019 -5.842 -6.093 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.862 -4.886 -5.457 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.174 -6.382 -4.783 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.701 -6.437 -5.695 1.00 0.00 H new ATOM 275 N THR A 22 2.325 -8.241 -8.895 1.00 0.00 N ATOM 276 CA THR A 22 3.513 -8.867 -9.451 1.00 0.00 C ATOM 277 C THR A 22 4.577 -7.811 -9.758 1.00 0.00 C ATOM 278 O THR A 22 4.280 -6.783 -10.365 1.00 0.00 O ATOM 279 CB THR A 22 3.090 -9.678 -10.678 1.00 0.00 C ATOM 280 OG1 THR A 22 1.946 -10.403 -10.237 1.00 0.00 O ATOM 281 CG2 THR A 22 4.104 -10.765 -11.038 1.00 0.00 C ATOM 0 H THR A 22 1.777 -7.698 -9.562 1.00 0.00 H new ATOM 0 HA THR A 22 3.973 -9.549 -8.736 1.00 0.00 H new ATOM 0 HB THR A 22 2.958 -9.009 -11.528 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.605 -10.955 -10.972 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.756 -11.311 -11.915 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.068 -10.306 -11.255 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.211 -11.454 -10.201 1.00 0.00 H new ATOM 289 N GLU A 23 5.795 -8.101 -9.324 1.00 0.00 N ATOM 290 CA GLU A 23 6.905 -7.190 -9.544 1.00 0.00 C ATOM 291 C GLU A 23 8.190 -7.975 -9.815 1.00 0.00 C ATOM 292 O GLU A 23 8.843 -8.444 -8.884 1.00 0.00 O ATOM 293 CB GLU A 23 7.081 -6.243 -8.355 1.00 0.00 C ATOM 294 CG GLU A 23 6.010 -5.149 -8.363 1.00 0.00 C ATOM 295 CD GLU A 23 6.648 -3.758 -8.366 1.00 0.00 C ATOM 296 OE1 GLU A 23 7.171 -3.371 -7.299 1.00 0.00 O ATOM 297 OE2 GLU A 23 6.598 -3.114 -9.436 1.00 0.00 O ATOM 0 H GLU A 23 6.037 -8.955 -8.821 1.00 0.00 H new ATOM 0 HA GLU A 23 6.682 -6.582 -10.421 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.023 -6.807 -7.424 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.071 -5.788 -8.391 1.00 0.00 H new ATOM 0 HG2 GLU A 23 5.374 -5.264 -9.241 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.368 -5.257 -7.489 1.00 0.00 H new ATOM 304 N GLY A 24 8.515 -8.092 -11.094 1.00 0.00 N ATOM 305 CA GLY A 24 9.711 -8.812 -11.499 1.00 0.00 C ATOM 306 C GLY A 24 9.628 -10.285 -11.093 1.00 0.00 C ATOM 307 O GLY A 24 10.546 -10.812 -10.466 1.00 0.00 O ATOM 0 H GLY A 24 7.971 -7.701 -11.863 1.00 0.00 H new ATOM 0 HA2 GLY A 24 9.838 -8.735 -12.579 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.588 -8.354 -11.042 1.00 0.00 H new ATOM 311 N LYS A 25 8.520 -10.908 -11.467 1.00 0.00 N ATOM 312 CA LYS A 25 8.305 -12.309 -11.149 1.00 0.00 C ATOM 313 C LYS A 25 7.713 -12.424 -9.744 1.00 0.00 C ATOM 314 O LYS A 25 6.680 -13.065 -9.552 1.00 0.00 O ATOM 315 CB LYS A 25 9.598 -13.105 -11.339 1.00 0.00 C ATOM 316 CG LYS A 25 9.342 -14.385 -12.137 1.00 0.00 C ATOM 317 CD LYS A 25 10.573 -15.293 -12.128 1.00 0.00 C ATOM 318 CE LYS A 25 10.730 -16.017 -13.467 1.00 0.00 C ATOM 319 NZ LYS A 25 11.962 -15.571 -14.156 1.00 0.00 N ATOM 0 H LYS A 25 7.761 -10.468 -11.988 1.00 0.00 H new ATOM 0 HA LYS A 25 7.582 -12.749 -11.836 1.00 0.00 H new ATOM 0 HB2 LYS A 25 10.335 -12.491 -11.857 1.00 0.00 H new ATOM 0 HB3 LYS A 25 10.020 -13.357 -10.366 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.490 -14.917 -11.714 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.081 -14.131 -13.164 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.465 -14.700 -11.924 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.485 -16.023 -11.324 1.00 0.00 H new ATOM 0 HE2 LYS A 25 10.768 -17.094 -13.303 1.00 0.00 H new ATOM 0 HE3 LYS A 25 9.862 -15.821 -14.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.053 -16.072 -15.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.911 -14.547 -14.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.788 -15.780 -13.560 1.00 0.00 H new ATOM 333 N LYS A 26 8.392 -11.794 -8.796 1.00 0.00 N ATOM 334 CA LYS A 26 7.945 -11.818 -7.414 1.00 0.00 C ATOM 335 C LYS A 26 6.481 -11.378 -7.348 1.00 0.00 C ATOM 336 O LYS A 26 5.973 -10.756 -8.279 1.00 0.00 O ATOM 337 CB LYS A 26 8.878 -10.983 -6.535 1.00 0.00 C ATOM 338 CG LYS A 26 9.446 -11.820 -5.387 1.00 0.00 C ATOM 339 CD LYS A 26 8.706 -11.530 -4.079 1.00 0.00 C ATOM 340 CE LYS A 26 9.416 -10.436 -3.279 1.00 0.00 C ATOM 341 NZ LYS A 26 10.025 -11.001 -2.054 1.00 0.00 N ATOM 0 H LYS A 26 9.248 -11.264 -8.958 1.00 0.00 H new ATOM 0 HA LYS A 26 7.992 -12.832 -7.016 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.694 -10.587 -7.139 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.335 -10.128 -6.132 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.363 -12.880 -5.629 1.00 0.00 H new ATOM 0 HG3 LYS A 26 10.507 -11.603 -5.264 1.00 0.00 H new ATOM 0 HD2 LYS A 26 7.683 -11.221 -4.296 1.00 0.00 H new ATOM 0 HD3 LYS A 26 8.644 -12.440 -3.482 1.00 0.00 H new ATOM 0 HE2 LYS A 26 10.186 -9.970 -3.893 1.00 0.00 H new ATOM 0 HE3 LYS A 26 8.705 -9.654 -3.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.503 -10.245 -1.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 9.283 -11.425 -1.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 10.718 -11.731 -2.316 1.00 0.00 H new ATOM 355 N LYS A 27 5.844 -11.719 -6.237 1.00 0.00 N ATOM 356 CA LYS A 27 4.448 -11.367 -6.037 1.00 0.00 C ATOM 357 C LYS A 27 4.277 -10.750 -4.648 1.00 0.00 C ATOM 358 O LYS A 27 4.186 -11.468 -3.653 1.00 0.00 O ATOM 359 CB LYS A 27 3.549 -12.580 -6.287 1.00 0.00 C ATOM 360 CG LYS A 27 3.857 -13.704 -5.296 1.00 0.00 C ATOM 361 CD LYS A 27 2.639 -14.014 -4.423 1.00 0.00 C ATOM 362 CE LYS A 27 2.789 -15.373 -3.736 1.00 0.00 C ATOM 363 NZ LYS A 27 3.489 -15.224 -2.441 1.00 0.00 N ATOM 0 H LYS A 27 6.269 -12.235 -5.466 1.00 0.00 H new ATOM 0 HA LYS A 27 4.137 -10.614 -6.761 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.503 -12.287 -6.196 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.692 -12.939 -7.306 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.157 -14.600 -5.839 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.698 -13.417 -4.665 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.518 -13.234 -3.671 1.00 0.00 H new ATOM 0 HD3 LYS A 27 1.737 -14.010 -5.035 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.806 -15.817 -3.576 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.345 -16.054 -4.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 3.583 -16.155 -1.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 4.434 -14.821 -2.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 2.943 -14.591 -1.822 1.00 0.00 H new ATOM 377 N ILE A 28 4.237 -9.426 -4.624 1.00 0.00 N ATOM 378 CA ILE A 28 4.077 -8.704 -3.373 1.00 0.00 C ATOM 379 C ILE A 28 2.587 -8.497 -3.096 1.00 0.00 C ATOM 380 O ILE A 28 1.854 -8.008 -3.954 1.00 0.00 O ATOM 381 CB ILE A 28 4.885 -7.405 -3.398 1.00 0.00 C ATOM 382 CG1 ILE A 28 6.356 -7.680 -3.715 1.00 0.00 C ATOM 383 CG2 ILE A 28 4.716 -6.630 -2.089 1.00 0.00 C ATOM 384 CD1 ILE A 28 6.606 -7.654 -5.224 1.00 0.00 C ATOM 0 H ILE A 28 4.313 -8.834 -5.451 1.00 0.00 H new ATOM 0 HA ILE A 28 4.478 -9.286 -2.543 1.00 0.00 H new ATOM 0 HB ILE A 28 4.496 -6.776 -4.198 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.983 -6.934 -3.226 1.00 0.00 H new ATOM 0 HG13 ILE A 28 6.643 -8.651 -3.312 1.00 0.00 H new ATOM 0 HG21 ILE A 28 5.300 -5.711 -2.132 1.00 0.00 H new ATOM 0 HG22 ILE A 28 3.664 -6.385 -1.945 1.00 0.00 H new ATOM 0 HG23 ILE A 28 5.063 -7.242 -1.256 1.00 0.00 H new ATOM 0 HD11 ILE A 28 7.659 -7.852 -5.422 1.00 0.00 H new ATOM 0 HD12 ILE A 28 5.996 -8.417 -5.707 1.00 0.00 H new ATOM 0 HD13 ILE A 28 6.341 -6.674 -5.620 1.00 0.00 H new ATOM 396 N PRO A 29 2.172 -8.889 -1.861 1.00 0.00 N ATOM 397 CA PRO A 29 0.783 -8.751 -1.460 1.00 0.00 C ATOM 398 C PRO A 29 0.445 -7.291 -1.148 1.00 0.00 C ATOM 399 O PRO A 29 1.242 -6.583 -0.534 1.00 0.00 O ATOM 400 CB PRO A 29 0.628 -9.667 -0.257 1.00 0.00 C ATOM 401 CG PRO A 29 2.036 -9.925 0.255 1.00 0.00 C ATOM 402 CD PRO A 29 3.012 -9.472 -0.819 1.00 0.00 C ATOM 0 HA PRO A 29 0.087 -9.032 -2.250 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.012 -9.201 0.512 1.00 0.00 H new ATOM 0 HB3 PRO A 29 0.137 -10.599 -0.537 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.210 -9.381 1.183 1.00 0.00 H new ATOM 0 HG3 PRO A 29 2.174 -10.984 0.475 1.00 0.00 H new ATOM 0 HD2 PRO A 29 3.721 -8.742 -0.428 1.00 0.00 H new ATOM 0 HD3 PRO A 29 3.595 -10.309 -1.203 1.00 0.00 H new ATOM 410 N VAL A 30 -0.739 -6.885 -1.584 1.00 0.00 N ATOM 411 CA VAL A 30 -1.192 -5.523 -1.359 1.00 0.00 C ATOM 412 C VAL A 30 -2.550 -5.552 -0.655 1.00 0.00 C ATOM 413 O VAL A 30 -3.364 -6.439 -0.905 1.00 0.00 O ATOM 414 CB VAL A 30 -1.221 -4.756 -2.682 1.00 0.00 C ATOM 415 CG1 VAL A 30 -2.008 -3.451 -2.542 1.00 0.00 C ATOM 416 CG2 VAL A 30 0.197 -4.489 -3.192 1.00 0.00 C ATOM 0 H VAL A 30 -1.398 -7.475 -2.092 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.499 -4.993 -0.706 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.731 -5.377 -3.418 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.013 -2.925 -3.497 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.033 -3.674 -2.245 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.539 -2.823 -1.784 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.148 -3.942 -4.134 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.743 -3.897 -2.457 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.712 -5.437 -3.349 1.00 0.00 H new ATOM 426 N ALA A 31 -2.752 -4.571 0.212 1.00 0.00 N ATOM 427 CA ALA A 31 -3.998 -4.472 0.954 1.00 0.00 C ATOM 428 C ALA A 31 -4.641 -3.110 0.685 1.00 0.00 C ATOM 429 O ALA A 31 -4.043 -2.072 0.963 1.00 0.00 O ATOM 430 CB ALA A 31 -3.726 -4.705 2.442 1.00 0.00 C ATOM 0 H ALA A 31 -2.074 -3.837 0.418 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.701 -5.238 0.627 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.660 -4.631 2.999 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.298 -5.697 2.583 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.026 -3.953 2.806 1.00 0.00 H new ATOM 436 N ASP A 32 -5.851 -3.159 0.146 1.00 0.00 N ATOM 437 CA ASP A 32 -6.581 -1.942 -0.164 1.00 0.00 C ATOM 438 C ASP A 32 -7.433 -1.542 1.043 1.00 0.00 C ATOM 439 O ASP A 32 -8.359 -2.259 1.419 1.00 0.00 O ATOM 440 CB ASP A 32 -7.518 -2.150 -1.355 1.00 0.00 C ATOM 441 CG ASP A 32 -7.065 -1.487 -2.657 1.00 0.00 C ATOM 442 OD1 ASP A 32 -6.028 -0.791 -2.609 1.00 0.00 O ATOM 443 OD2 ASP A 32 -7.767 -1.690 -3.672 1.00 0.00 O ATOM 0 H ASP A 32 -6.343 -4.022 -0.084 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.855 -1.166 -0.407 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.628 -3.220 -1.529 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.504 -1.767 -1.094 1.00 0.00 H new ATOM 448 N CYS A 33 -7.089 -0.398 1.617 1.00 0.00 N ATOM 449 CA CYS A 33 -7.810 0.106 2.773 1.00 0.00 C ATOM 450 C CYS A 33 -8.245 1.543 2.479 1.00 0.00 C ATOM 451 O CYS A 33 -7.546 2.276 1.782 1.00 0.00 O ATOM 452 CB CYS A 33 -6.969 0.013 4.048 1.00 0.00 C ATOM 453 SG CYS A 33 -5.244 0.512 3.698 1.00 0.00 S ATOM 0 H CYS A 33 -6.320 0.194 1.303 1.00 0.00 H new ATOM 0 HA CYS A 33 -8.692 -0.509 2.952 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -7.392 0.655 4.820 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -6.990 -1.006 4.434 1.00 0.00 H new ATOM 0 HG CYS A 33 -4.654 0.841 4.808 1.00 0.00 H new ATOM 459 N ARG A 34 -9.397 1.902 3.026 1.00 0.00 N ATOM 460 CA ARG A 34 -9.934 3.238 2.831 1.00 0.00 C ATOM 461 C ARG A 34 -9.824 4.048 4.125 1.00 0.00 C ATOM 462 O ARG A 34 -10.373 3.657 5.154 1.00 0.00 O ATOM 463 CB ARG A 34 -11.399 3.185 2.393 1.00 0.00 C ATOM 464 CG ARG A 34 -11.795 4.461 1.648 1.00 0.00 C ATOM 465 CD ARG A 34 -13.014 5.119 2.298 1.00 0.00 C ATOM 466 NE ARG A 34 -13.803 5.842 1.276 1.00 0.00 N ATOM 467 CZ ARG A 34 -15.102 6.145 1.405 1.00 0.00 C ATOM 468 NH1 ARG A 34 -15.766 5.788 2.513 1.00 0.00 N ATOM 469 NH2 ARG A 34 -15.737 6.804 0.427 1.00 0.00 N ATOM 0 H ARG A 34 -9.974 1.291 3.604 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.350 3.719 2.046 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -11.559 2.320 1.750 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -12.039 3.056 3.266 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -10.958 5.160 1.645 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -12.016 4.225 0.607 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -13.633 4.362 2.779 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -12.692 5.810 3.077 1.00 0.00 H new ATOM 0 HE ARG A 34 -13.328 6.128 0.420 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -15.283 5.286 3.258 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -16.755 6.018 2.612 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -15.232 7.075 -0.417 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -16.726 7.034 0.526 1.00 0.00 H new ATOM 483 N VAL A 35 -9.112 5.161 4.030 1.00 0.00 N ATOM 484 CA VAL A 35 -8.924 6.029 5.180 1.00 0.00 C ATOM 485 C VAL A 35 -10.289 6.487 5.696 1.00 0.00 C ATOM 486 O VAL A 35 -11.131 6.939 4.921 1.00 0.00 O ATOM 487 CB VAL A 35 -8.003 7.194 4.811 1.00 0.00 C ATOM 488 CG1 VAL A 35 -7.653 8.029 6.045 1.00 0.00 C ATOM 489 CG2 VAL A 35 -6.738 6.692 4.112 1.00 0.00 C ATOM 0 H VAL A 35 -8.658 5.482 3.175 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.434 5.489 5.990 1.00 0.00 H new ATOM 0 HB VAL A 35 -8.539 7.837 4.113 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.998 8.850 5.755 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.566 8.431 6.483 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.145 7.401 6.777 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.101 7.540 3.860 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.199 6.017 4.777 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.012 6.161 3.200 1.00 0.00 H new ATOM 499 N GLN A 36 -10.466 6.356 7.003 1.00 0.00 N ATOM 500 CA GLN A 36 -11.715 6.751 7.632 1.00 0.00 C ATOM 501 C GLN A 36 -11.486 7.941 8.566 1.00 0.00 C ATOM 502 O GLN A 36 -12.326 8.834 8.657 1.00 0.00 O ATOM 503 CB GLN A 36 -12.345 5.577 8.384 1.00 0.00 C ATOM 504 CG GLN A 36 -12.788 4.479 7.415 1.00 0.00 C ATOM 505 CD GLN A 36 -14.306 4.490 7.230 1.00 0.00 C ATOM 506 OE1 GLN A 36 -14.882 5.403 6.661 1.00 0.00 O ATOM 507 NE2 GLN A 36 -14.921 3.427 7.741 1.00 0.00 N ATOM 0 H GLN A 36 -9.765 5.982 7.643 1.00 0.00 H new ATOM 0 HA GLN A 36 -12.412 7.056 6.851 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.628 5.170 9.097 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -13.202 5.927 8.959 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.300 4.621 6.451 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -12.471 3.507 7.792 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -14.379 2.698 8.205 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -15.935 3.341 7.669 1.00 0.00 H new ATOM 516 N LYS A 37 -10.343 7.914 9.237 1.00 0.00 N ATOM 517 CA LYS A 37 -9.993 8.979 10.161 1.00 0.00 C ATOM 518 C LYS A 37 -8.479 9.203 10.124 1.00 0.00 C ATOM 519 O LYS A 37 -7.705 8.253 10.221 1.00 0.00 O ATOM 520 CB LYS A 37 -10.535 8.676 11.559 1.00 0.00 C ATOM 521 CG LYS A 37 -12.064 8.609 11.551 1.00 0.00 C ATOM 522 CD LYS A 37 -12.621 8.643 12.975 1.00 0.00 C ATOM 523 CE LYS A 37 -13.316 9.976 13.261 1.00 0.00 C ATOM 524 NZ LYS A 37 -14.040 9.917 14.550 1.00 0.00 N ATOM 0 H LYS A 37 -9.648 7.171 9.159 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.463 9.915 9.858 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.128 7.729 11.914 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.205 9.446 12.256 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -12.465 9.446 10.980 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.389 7.697 11.051 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.327 7.824 13.113 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -11.812 8.490 13.689 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.579 10.779 13.288 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.013 10.210 12.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.506 10.830 14.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -14.756 9.164 14.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.367 9.716 15.317 1.00 0.00 H new ATOM 538 N GLY A 38 -8.104 10.466 9.982 1.00 0.00 N ATOM 539 CA GLY A 38 -6.697 10.827 9.931 1.00 0.00 C ATOM 540 C GLY A 38 -6.161 10.742 8.501 1.00 0.00 C ATOM 541 O GLY A 38 -6.878 11.039 7.546 1.00 0.00 O ATOM 0 H GLY A 38 -8.749 11.252 9.901 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -6.563 11.839 10.314 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.124 10.163 10.578 1.00 0.00 H new ATOM 545 N GLN A 39 -4.904 10.335 8.397 1.00 0.00 N ATOM 546 CA GLN A 39 -4.264 10.207 7.099 1.00 0.00 C ATOM 547 C GLN A 39 -3.204 9.103 7.136 1.00 0.00 C ATOM 548 O GLN A 39 -2.827 8.636 8.210 1.00 0.00 O ATOM 549 CB GLN A 39 -3.654 11.538 6.655 1.00 0.00 C ATOM 550 CG GLN A 39 -2.793 12.144 7.766 1.00 0.00 C ATOM 551 CD GLN A 39 -2.098 13.419 7.286 1.00 0.00 C ATOM 552 OE1 GLN A 39 -2.708 14.320 6.735 1.00 0.00 O ATOM 553 NE2 GLN A 39 -0.790 13.446 7.526 1.00 0.00 N ATOM 0 H GLN A 39 -4.312 10.090 9.191 1.00 0.00 H new ATOM 0 HA GLN A 39 -5.023 9.931 6.367 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -3.047 11.384 5.763 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -4.448 12.234 6.385 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -3.416 12.369 8.632 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -2.047 11.418 8.090 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -0.341 12.658 7.992 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -0.236 14.255 7.244 1.00 0.00 H new ATOM 562 N LEU A 40 -2.755 8.718 5.951 1.00 0.00 N ATOM 563 CA LEU A 40 -1.747 7.678 5.834 1.00 0.00 C ATOM 564 C LEU A 40 -0.486 8.265 5.197 1.00 0.00 C ATOM 565 O LEU A 40 -0.545 8.837 4.109 1.00 0.00 O ATOM 566 CB LEU A 40 -2.309 6.468 5.085 1.00 0.00 C ATOM 567 CG LEU A 40 -3.628 5.904 5.616 1.00 0.00 C ATOM 568 CD1 LEU A 40 -4.081 4.698 4.790 1.00 0.00 C ATOM 569 CD2 LEU A 40 -3.522 5.571 7.105 1.00 0.00 C ATOM 0 H LEU A 40 -3.071 9.108 5.063 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.464 7.309 6.820 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.450 6.746 4.040 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.563 5.674 5.106 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.394 6.672 5.512 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.021 4.316 5.189 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.223 5.000 3.752 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.322 3.917 4.840 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.473 5.172 7.457 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.738 4.829 7.257 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.279 6.475 7.664 1.00 0.00 H new ATOM 581 N GLU A 41 0.624 8.103 5.901 1.00 0.00 N ATOM 582 CA GLU A 41 1.897 8.610 5.417 1.00 0.00 C ATOM 583 C GLU A 41 2.802 7.453 4.989 1.00 0.00 C ATOM 584 O GLU A 41 2.419 6.289 5.097 1.00 0.00 O ATOM 585 CB GLU A 41 2.581 9.477 6.477 1.00 0.00 C ATOM 586 CG GLU A 41 1.565 10.364 7.198 1.00 0.00 C ATOM 587 CD GLU A 41 2.260 11.524 7.914 1.00 0.00 C ATOM 588 OE1 GLU A 41 3.178 12.104 7.295 1.00 0.00 O ATOM 589 OE2 GLU A 41 1.857 11.805 9.064 1.00 0.00 O ATOM 0 H GLU A 41 0.669 7.628 6.803 1.00 0.00 H new ATOM 0 HA GLU A 41 1.708 9.239 4.547 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.090 8.840 7.200 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.343 10.099 6.007 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.844 10.755 6.480 1.00 0.00 H new ATOM 0 HG3 GLU A 41 1.005 9.769 7.920 1.00 0.00 H new ATOM 596 N ARG A 42 3.984 7.813 4.511 1.00 0.00 N ATOM 597 CA ARG A 42 4.946 6.819 4.066 1.00 0.00 C ATOM 598 C ARG A 42 6.066 6.665 5.097 1.00 0.00 C ATOM 599 O ARG A 42 6.620 5.579 5.259 1.00 0.00 O ATOM 600 CB ARG A 42 5.553 7.206 2.716 1.00 0.00 C ATOM 601 CG ARG A 42 6.623 6.199 2.288 1.00 0.00 C ATOM 602 CD ARG A 42 5.985 4.933 1.711 1.00 0.00 C ATOM 603 NE ARG A 42 6.553 4.643 0.376 1.00 0.00 N ATOM 604 CZ ARG A 42 7.788 4.163 0.173 1.00 0.00 C ATOM 605 NH1 ARG A 42 8.591 3.916 1.217 1.00 0.00 N ATOM 606 NH2 ARG A 42 8.219 3.930 -1.074 1.00 0.00 N ATOM 0 H ARG A 42 4.298 8.780 4.422 1.00 0.00 H new ATOM 0 HA ARG A 42 4.418 5.872 3.955 1.00 0.00 H new ATOM 0 HB2 ARG A 42 4.769 7.252 1.960 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.991 8.202 2.782 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.277 6.653 1.544 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.246 5.939 3.144 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.159 4.091 2.380 1.00 0.00 H new ATOM 0 HD3 ARG A 42 4.905 5.062 1.636 1.00 0.00 H new ATOM 0 HE ARG A 42 5.968 4.819 -0.441 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.262 4.093 2.166 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.531 3.551 1.062 1.00 0.00 H new ATOM 0 HH21 ARG A 42 7.607 4.118 -1.868 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.159 3.565 -1.229 1.00 0.00 H new ATOM 620 N HIS A 43 6.365 7.768 5.767 1.00 0.00 N ATOM 621 CA HIS A 43 7.410 7.770 6.777 1.00 0.00 C ATOM 622 C HIS A 43 6.782 7.622 8.164 1.00 0.00 C ATOM 623 O HIS A 43 7.117 8.367 9.084 1.00 0.00 O ATOM 624 CB HIS A 43 8.285 9.019 6.652 1.00 0.00 C ATOM 625 CG HIS A 43 9.641 8.760 6.042 1.00 0.00 C ATOM 626 ND1 HIS A 43 10.825 8.979 6.724 1.00 0.00 N ATOM 627 CD2 HIS A 43 9.989 8.297 4.807 1.00 0.00 C ATOM 628 CE1 HIS A 43 11.833 8.661 5.926 1.00 0.00 C ATOM 629 NE2 HIS A 43 11.313 8.238 4.738 1.00 0.00 N ATOM 0 H HIS A 43 5.902 8.667 5.630 1.00 0.00 H new ATOM 0 HA HIS A 43 8.072 6.918 6.623 1.00 0.00 H new ATOM 0 HB2 HIS A 43 7.761 9.758 6.046 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.420 9.456 7.641 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.303 8.024 4.019 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.883 8.725 6.173 1.00 0.00 H new ATOM 0 HE2 HIS A 43 11.853 7.928 3.930 1.00 0.00 H new ATOM 637 N LYS A 44 5.881 6.656 8.271 1.00 0.00 N ATOM 638 CA LYS A 44 5.203 6.401 9.531 1.00 0.00 C ATOM 639 C LYS A 44 5.137 4.892 9.773 1.00 0.00 C ATOM 640 O LYS A 44 5.415 4.102 8.872 1.00 0.00 O ATOM 641 CB LYS A 44 3.836 7.088 9.552 1.00 0.00 C ATOM 642 CG LYS A 44 3.982 8.604 9.402 1.00 0.00 C ATOM 643 CD LYS A 44 4.566 9.227 10.671 1.00 0.00 C ATOM 644 CE LYS A 44 4.519 10.755 10.604 1.00 0.00 C ATOM 645 NZ LYS A 44 5.869 11.304 10.352 1.00 0.00 N ATOM 0 H LYS A 44 5.605 6.041 7.506 1.00 0.00 H new ATOM 0 HA LYS A 44 5.764 6.833 10.360 1.00 0.00 H new ATOM 0 HB2 LYS A 44 3.216 6.697 8.745 1.00 0.00 H new ATOM 0 HB3 LYS A 44 3.324 6.859 10.487 1.00 0.00 H new ATOM 0 HG2 LYS A 44 4.627 8.828 8.552 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.009 9.047 9.190 1.00 0.00 H new ATOM 0 HD2 LYS A 44 4.008 8.880 11.541 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.597 8.897 10.801 1.00 0.00 H new ATOM 0 HE2 LYS A 44 3.839 11.069 9.813 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.126 11.154 11.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 5.819 12.342 10.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.509 11.019 11.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 6.230 10.937 9.448 1.00 0.00 H new ATOM 659 N LYS A 45 4.765 4.536 10.994 1.00 0.00 N ATOM 660 CA LYS A 45 4.659 3.136 11.366 1.00 0.00 C ATOM 661 C LYS A 45 3.209 2.677 11.197 1.00 0.00 C ATOM 662 O LYS A 45 2.285 3.485 11.274 1.00 0.00 O ATOM 663 CB LYS A 45 5.214 2.911 12.774 1.00 0.00 C ATOM 664 CG LYS A 45 6.740 2.803 12.750 1.00 0.00 C ATOM 665 CD LYS A 45 7.386 4.184 12.612 1.00 0.00 C ATOM 666 CE LYS A 45 8.830 4.167 13.117 1.00 0.00 C ATOM 667 NZ LYS A 45 9.406 5.530 13.086 1.00 0.00 N ATOM 0 H LYS A 45 4.533 5.194 11.738 1.00 0.00 H new ATOM 0 HA LYS A 45 5.269 2.520 10.706 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.914 3.734 13.423 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.788 2.001 13.196 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.089 2.324 13.665 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.050 2.168 11.920 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.366 4.496 11.568 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.809 4.917 13.175 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.861 3.776 14.134 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.430 3.498 12.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.216 5.579 13.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.723 5.751 12.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.684 6.219 13.380 1.00 0.00 H new ATOM 681 N PHE A 46 3.055 1.381 10.969 1.00 0.00 N ATOM 682 CA PHE A 46 1.733 0.804 10.788 1.00 0.00 C ATOM 683 C PHE A 46 1.673 -0.617 11.350 1.00 0.00 C ATOM 684 O PHE A 46 2.691 -1.166 11.771 1.00 0.00 O ATOM 685 CB PHE A 46 1.468 0.756 9.282 1.00 0.00 C ATOM 686 CG PHE A 46 1.449 2.130 8.610 1.00 0.00 C ATOM 687 CD1 PHE A 46 2.603 2.837 8.473 1.00 0.00 C ATOM 688 CD2 PHE A 46 0.277 2.645 8.148 1.00 0.00 C ATOM 689 CE1 PHE A 46 2.584 4.112 7.849 1.00 0.00 C ATOM 690 CE2 PHE A 46 0.259 3.920 7.524 1.00 0.00 C ATOM 691 CZ PHE A 46 1.413 4.627 7.387 1.00 0.00 C ATOM 0 H PHE A 46 3.824 0.714 10.905 1.00 0.00 H new ATOM 0 HA PHE A 46 0.990 1.405 11.313 1.00 0.00 H new ATOM 0 HB2 PHE A 46 2.234 0.142 8.808 1.00 0.00 H new ATOM 0 HB3 PHE A 46 0.511 0.264 9.107 1.00 0.00 H new ATOM 0 HD1 PHE A 46 3.533 2.428 8.839 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.639 2.084 8.256 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.500 4.674 7.741 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -0.671 4.329 7.158 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.399 5.597 6.912 1.00 0.00 H new ATOM 701 N LYS A 47 0.471 -1.174 11.340 1.00 0.00 N ATOM 702 CA LYS A 47 0.265 -2.521 11.843 1.00 0.00 C ATOM 703 C LYS A 47 -1.072 -3.055 11.326 1.00 0.00 C ATOM 704 O LYS A 47 -1.984 -2.282 11.037 1.00 0.00 O ATOM 705 CB LYS A 47 0.390 -2.548 13.368 1.00 0.00 C ATOM 706 CG LYS A 47 -0.469 -1.456 14.008 1.00 0.00 C ATOM 707 CD LYS A 47 -0.784 -1.790 15.467 1.00 0.00 C ATOM 708 CE LYS A 47 0.161 -1.050 16.416 1.00 0.00 C ATOM 709 NZ LYS A 47 1.274 -1.933 16.831 1.00 0.00 N ATOM 0 H LYS A 47 -0.371 -0.716 10.991 1.00 0.00 H new ATOM 0 HA LYS A 47 1.041 -3.190 11.471 1.00 0.00 H new ATOM 0 HB2 LYS A 47 0.084 -3.524 13.744 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.433 -2.409 13.653 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.052 -0.500 13.955 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -1.398 -1.344 13.448 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.816 -1.519 15.691 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -0.695 -2.865 15.625 1.00 0.00 H new ATOM 0 HE2 LYS A 47 0.558 -0.162 15.924 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -0.388 -0.710 17.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 1.906 -1.416 17.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 0.891 -2.768 17.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.808 -2.237 15.992 1.00 0.00 H new ATOM 723 N LEU A 48 -1.146 -4.374 11.224 1.00 0.00 N ATOM 724 CA LEU A 48 -2.357 -5.021 10.747 1.00 0.00 C ATOM 725 C LEU A 48 -3.100 -5.641 11.932 1.00 0.00 C ATOM 726 O LEU A 48 -2.555 -6.489 12.636 1.00 0.00 O ATOM 727 CB LEU A 48 -2.028 -6.021 9.636 1.00 0.00 C ATOM 728 CG LEU A 48 -3.225 -6.709 8.977 1.00 0.00 C ATOM 729 CD1 LEU A 48 -4.049 -5.711 8.160 1.00 0.00 C ATOM 730 CD2 LEU A 48 -2.775 -7.905 8.136 1.00 0.00 C ATOM 0 H LEU A 48 -0.387 -5.012 11.463 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.028 -4.289 10.297 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.462 -5.502 8.863 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.374 -6.790 10.048 1.00 0.00 H new ATOM 0 HG LEU A 48 -3.874 -7.095 9.764 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -4.894 -6.225 7.702 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.417 -4.921 8.815 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.424 -5.275 7.381 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -3.645 -8.376 7.679 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -2.094 -7.565 7.356 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.265 -8.627 8.774 1.00 0.00 H new ATOM 742 N ILE A 49 -4.333 -5.193 12.116 1.00 0.00 N ATOM 743 CA ILE A 49 -5.157 -5.693 13.203 1.00 0.00 C ATOM 744 C ILE A 49 -6.304 -6.526 12.627 1.00 0.00 C ATOM 745 O ILE A 49 -7.151 -6.006 11.904 1.00 0.00 O ATOM 746 CB ILE A 49 -5.622 -4.542 14.097 1.00 0.00 C ATOM 747 CG1 ILE A 49 -4.430 -3.838 14.749 1.00 0.00 C ATOM 748 CG2 ILE A 49 -6.638 -5.027 15.133 1.00 0.00 C ATOM 749 CD1 ILE A 49 -3.592 -3.098 13.704 1.00 0.00 C ATOM 0 H ILE A 49 -4.782 -4.489 11.530 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.576 -6.352 13.848 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.127 -3.807 13.471 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -4.786 -3.133 15.501 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.809 -4.570 15.266 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.952 -4.189 15.755 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -7.506 -5.445 14.623 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.181 -5.793 15.760 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -2.751 -2.606 14.194 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -3.218 -3.809 12.968 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -4.209 -2.351 13.205 1.00 0.00 H new ATOM 761 N ARG A 50 -6.294 -7.806 12.970 1.00 0.00 N ATOM 762 CA ARG A 50 -7.322 -8.716 12.496 1.00 0.00 C ATOM 763 C ARG A 50 -8.032 -9.377 13.680 1.00 0.00 C ATOM 764 O ARG A 50 -7.441 -10.192 14.386 1.00 0.00 O ATOM 765 CB ARG A 50 -6.726 -9.801 11.597 1.00 0.00 C ATOM 766 CG ARG A 50 -7.777 -10.854 11.238 1.00 0.00 C ATOM 767 CD ARG A 50 -7.144 -12.024 10.482 1.00 0.00 C ATOM 768 NE ARG A 50 -6.824 -11.616 9.095 1.00 0.00 N ATOM 769 CZ ARG A 50 -6.501 -12.472 8.116 1.00 0.00 C ATOM 770 NH1 ARG A 50 -6.454 -13.788 8.365 1.00 0.00 N ATOM 771 NH2 ARG A 50 -6.226 -12.012 6.888 1.00 0.00 N ATOM 0 H ARG A 50 -5.590 -8.234 13.571 1.00 0.00 H new ATOM 0 HA ARG A 50 -8.039 -8.134 11.917 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -6.333 -9.349 10.686 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -5.887 -10.278 12.104 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -8.256 -11.220 12.146 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.557 -10.401 10.627 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.238 -12.350 10.992 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -7.827 -12.873 10.472 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.851 -10.621 8.871 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.664 -14.138 9.300 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -6.208 -14.440 7.620 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -6.263 -11.010 6.699 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -5.980 -12.663 6.143 1.00 0.00 H new ATOM 785 N ASN A 51 -9.290 -9.002 13.859 1.00 0.00 N ATOM 786 CA ASN A 51 -10.086 -9.548 14.945 1.00 0.00 C ATOM 787 C ASN A 51 -9.777 -8.785 16.233 1.00 0.00 C ATOM 788 O ASN A 51 -10.427 -8.996 17.256 1.00 0.00 O ATOM 789 CB ASN A 51 -9.759 -11.024 15.179 1.00 0.00 C ATOM 790 CG ASN A 51 -11.005 -11.801 15.611 1.00 0.00 C ATOM 791 OD1 ASN A 51 -12.012 -11.238 16.005 1.00 0.00 O ATOM 792 ND2 ASN A 51 -10.879 -13.121 15.514 1.00 0.00 N ATOM 0 H ASN A 51 -9.778 -8.327 13.270 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.137 -9.450 14.674 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -9.353 -11.459 14.266 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -8.988 -11.112 15.944 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -11.655 -13.728 15.778 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -10.006 -13.527 15.176 1.00 0.00 H new ATOM 799 N GLY A 52 -8.784 -7.912 16.142 1.00 0.00 N ATOM 800 CA GLY A 52 -8.380 -7.116 17.289 1.00 0.00 C ATOM 801 C GLY A 52 -6.922 -7.393 17.663 1.00 0.00 C ATOM 802 O GLY A 52 -6.315 -6.633 18.415 1.00 0.00 O ATOM 0 H GLY A 52 -8.248 -7.738 15.292 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.506 -6.057 17.064 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.026 -7.341 18.138 1.00 0.00 H new ATOM 806 N GLN A 53 -6.403 -8.485 17.120 1.00 0.00 N ATOM 807 CA GLN A 53 -5.028 -8.872 17.387 1.00 0.00 C ATOM 808 C GLN A 53 -4.110 -8.378 16.268 1.00 0.00 C ATOM 809 O GLN A 53 -4.525 -8.292 15.113 1.00 0.00 O ATOM 810 CB GLN A 53 -4.910 -10.387 17.565 1.00 0.00 C ATOM 811 CG GLN A 53 -4.830 -11.093 16.211 1.00 0.00 C ATOM 812 CD GLN A 53 -5.064 -12.598 16.362 1.00 0.00 C ATOM 813 OE1 GLN A 53 -5.783 -13.056 17.235 1.00 0.00 O ATOM 814 NE2 GLN A 53 -4.418 -13.338 15.467 1.00 0.00 N ATOM 0 H GLN A 53 -6.910 -9.114 16.497 1.00 0.00 H new ATOM 0 HA GLN A 53 -4.714 -8.404 18.320 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -4.022 -10.620 18.153 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -5.769 -10.759 18.123 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -5.573 -10.672 15.533 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -3.852 -10.917 15.762 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -3.832 -12.890 14.763 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -4.508 -14.354 15.485 1.00 0.00 H new ATOM 823 N VAL A 54 -2.880 -8.066 16.648 1.00 0.00 N ATOM 824 CA VAL A 54 -1.900 -7.582 15.691 1.00 0.00 C ATOM 825 C VAL A 54 -1.144 -8.773 15.096 1.00 0.00 C ATOM 826 O VAL A 54 -0.751 -9.686 15.820 1.00 0.00 O ATOM 827 CB VAL A 54 -0.977 -6.560 16.357 1.00 0.00 C ATOM 828 CG1 VAL A 54 0.328 -6.408 15.573 1.00 0.00 C ATOM 829 CG2 VAL A 54 -1.680 -5.211 16.520 1.00 0.00 C ATOM 0 H VAL A 54 -2.539 -8.139 17.607 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.393 -7.065 14.868 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.729 -6.930 17.352 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.966 -5.676 16.067 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.842 -7.368 15.532 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.107 -6.071 14.560 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -1.002 -4.503 16.996 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.972 -4.832 15.541 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.568 -5.336 17.140 1.00 0.00 H new ATOM 839 N ILE A 55 -0.964 -8.723 13.785 1.00 0.00 N ATOM 840 CA ILE A 55 -0.262 -9.786 13.085 1.00 0.00 C ATOM 841 C ILE A 55 1.087 -9.261 12.590 1.00 0.00 C ATOM 842 O ILE A 55 2.104 -9.943 12.709 1.00 0.00 O ATOM 843 CB ILE A 55 -1.141 -10.368 11.976 1.00 0.00 C ATOM 844 CG1 ILE A 55 -1.969 -9.273 11.301 1.00 0.00 C ATOM 845 CG2 ILE A 55 -2.017 -11.504 12.509 1.00 0.00 C ATOM 846 CD1 ILE A 55 -3.307 -9.078 12.017 1.00 0.00 C ATOM 0 H ILE A 55 -1.292 -7.963 13.189 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.052 -10.615 13.762 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.490 -10.795 11.213 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.411 -8.337 11.303 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -2.145 -9.536 10.258 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -2.632 -11.900 11.700 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -1.383 -12.298 12.904 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -2.661 -11.125 13.302 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -3.876 -8.294 11.517 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -3.872 -10.009 11.991 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -3.127 -8.791 13.053 1.00 0.00 H new ATOM 858 N TRP A 56 1.052 -8.054 12.045 1.00 0.00 N ATOM 859 CA TRP A 56 2.259 -7.429 11.532 1.00 0.00 C ATOM 860 C TRP A 56 2.383 -6.044 12.169 1.00 0.00 C ATOM 861 O TRP A 56 1.402 -5.306 12.254 1.00 0.00 O ATOM 862 CB TRP A 56 2.245 -7.385 10.003 1.00 0.00 C ATOM 863 CG TRP A 56 3.380 -6.558 9.394 1.00 0.00 C ATOM 864 CD1 TRP A 56 4.560 -6.991 8.932 1.00 0.00 C ATOM 865 CD2 TRP A 56 3.392 -5.128 9.198 1.00 0.00 C ATOM 866 NE1 TRP A 56 5.330 -5.950 8.455 1.00 0.00 N ATOM 867 CE2 TRP A 56 4.597 -4.781 8.622 1.00 0.00 C ATOM 868 CE3 TRP A 56 2.417 -4.160 9.498 1.00 0.00 C ATOM 869 CZ2 TRP A 56 4.939 -3.463 8.296 1.00 0.00 C ATOM 870 CZ3 TRP A 56 2.775 -2.848 9.166 1.00 0.00 C ATOM 871 CH2 TRP A 56 3.984 -2.482 8.586 1.00 0.00 C ATOM 0 H TRP A 56 0.206 -7.492 11.948 1.00 0.00 H new ATOM 0 HA TRP A 56 3.139 -8.014 11.799 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.305 -8.404 9.620 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.291 -6.975 9.670 1.00 0.00 H new ATOM 0 HD1 TRP A 56 4.870 -8.026 8.933 1.00 0.00 H new ATOM 0 HE1 TRP A 56 6.265 -6.025 8.054 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.468 -4.409 9.949 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 5.889 -3.217 7.845 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 2.061 -2.065 9.375 1.00 0.00 H new ATOM 0 HH2 TRP A 56 4.185 -1.445 8.360 1.00 0.00 H new ATOM 882 N LYS A 57 3.596 -5.732 12.600 1.00 0.00 N ATOM 883 CA LYS A 57 3.860 -4.448 13.227 1.00 0.00 C ATOM 884 C LYS A 57 5.190 -3.897 12.709 1.00 0.00 C ATOM 885 O LYS A 57 6.248 -4.466 12.975 1.00 0.00 O ATOM 886 CB LYS A 57 3.798 -4.573 14.751 1.00 0.00 C ATOM 887 CG LYS A 57 4.953 -5.427 15.279 1.00 0.00 C ATOM 888 CD LYS A 57 4.462 -6.420 16.334 1.00 0.00 C ATOM 889 CE LYS A 57 5.116 -6.148 17.690 1.00 0.00 C ATOM 890 NZ LYS A 57 6.234 -7.088 17.924 1.00 0.00 N ATOM 0 H LYS A 57 4.407 -6.346 12.527 1.00 0.00 H new ATOM 0 HA LYS A 57 3.089 -3.727 12.958 1.00 0.00 H new ATOM 0 HB2 LYS A 57 3.838 -3.582 15.203 1.00 0.00 H new ATOM 0 HB3 LYS A 57 2.848 -5.019 15.044 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.417 -5.967 14.454 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.719 -4.783 15.710 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.378 -6.350 16.428 1.00 0.00 H new ATOM 0 HD3 LYS A 57 4.689 -7.437 16.014 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.483 -5.122 17.724 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.376 -6.249 18.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 6.667 -6.890 18.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.875 -8.064 17.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.947 -6.972 17.176 1.00 0.00 H new ATOM 904 N GLY A 58 5.094 -2.795 11.979 1.00 0.00 N ATOM 905 CA GLY A 58 6.276 -2.161 11.422 1.00 0.00 C ATOM 906 C GLY A 58 5.896 -0.963 10.550 1.00 0.00 C ATOM 907 O GLY A 58 4.958 -0.233 10.866 1.00 0.00 O ATOM 0 H GLY A 58 4.215 -2.325 11.761 1.00 0.00 H new ATOM 0 HA2 GLY A 58 6.932 -1.835 12.229 1.00 0.00 H new ATOM 0 HA3 GLY A 58 6.836 -2.884 10.829 1.00 0.00 H new ATOM 911 N SER A 59 6.644 -0.797 9.469 1.00 0.00 N ATOM 912 CA SER A 59 6.397 0.301 8.549 1.00 0.00 C ATOM 913 C SER A 59 6.089 -0.246 7.153 1.00 0.00 C ATOM 914 O SER A 59 6.503 -1.352 6.811 1.00 0.00 O ATOM 915 CB SER A 59 7.593 1.254 8.495 1.00 0.00 C ATOM 916 OG SER A 59 8.833 0.553 8.471 1.00 0.00 O ATOM 0 H SER A 59 7.421 -1.404 9.209 1.00 0.00 H new ATOM 0 HA SER A 59 5.536 0.863 8.910 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.515 1.884 7.609 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.568 1.917 9.360 1.00 0.00 H new ATOM 0 HG SER A 59 9.572 1.196 8.435 1.00 0.00 H new ATOM 922 N LEU A 60 5.366 0.556 6.385 1.00 0.00 N ATOM 923 CA LEU A 60 4.999 0.167 5.034 1.00 0.00 C ATOM 924 C LEU A 60 6.200 0.363 4.107 1.00 0.00 C ATOM 925 O LEU A 60 6.887 1.380 4.182 1.00 0.00 O ATOM 926 CB LEU A 60 3.744 0.918 4.583 1.00 0.00 C ATOM 927 CG LEU A 60 2.554 0.873 5.543 1.00 0.00 C ATOM 928 CD1 LEU A 60 1.464 1.857 5.112 1.00 0.00 C ATOM 929 CD2 LEU A 60 2.016 -0.553 5.683 1.00 0.00 C ATOM 0 H LEU A 60 5.025 1.473 6.673 1.00 0.00 H new ATOM 0 HA LEU A 60 4.739 -0.891 4.999 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.010 1.961 4.414 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.426 0.511 3.623 1.00 0.00 H new ATOM 0 HG LEU A 60 2.898 1.186 6.529 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.630 1.805 5.811 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.869 2.869 5.105 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.116 1.599 4.112 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.171 -0.557 6.371 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.692 -0.917 4.708 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.802 -1.202 6.070 1.00 0.00 H new ATOM 941 N THR A 61 6.417 -0.628 3.254 1.00 0.00 N ATOM 942 CA THR A 61 7.523 -0.577 2.314 1.00 0.00 C ATOM 943 C THR A 61 7.185 0.347 1.142 1.00 0.00 C ATOM 944 O THR A 61 8.073 0.770 0.404 1.00 0.00 O ATOM 945 CB THR A 61 7.844 -2.010 1.884 1.00 0.00 C ATOM 946 OG1 THR A 61 6.806 -2.338 0.965 1.00 0.00 O ATOM 947 CG2 THR A 61 7.666 -3.017 3.023 1.00 0.00 C ATOM 0 H THR A 61 5.845 -1.471 3.195 1.00 0.00 H new ATOM 0 HA THR A 61 8.415 -0.153 2.775 1.00 0.00 H new ATOM 0 HB THR A 61 8.869 -2.057 1.515 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.938 -3.251 0.635 1.00 0.00 H new ATOM 0 HG21 THR A 61 7.906 -4.018 2.665 1.00 0.00 H new ATOM 0 HG22 THR A 61 8.331 -2.757 3.846 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.633 -2.994 3.370 1.00 0.00 H new ATOM 955 N SER A 62 5.898 0.634 1.008 1.00 0.00 N ATOM 956 CA SER A 62 5.432 1.500 -0.061 1.00 0.00 C ATOM 957 C SER A 62 3.970 1.883 0.176 1.00 0.00 C ATOM 958 O SER A 62 3.228 1.146 0.824 1.00 0.00 O ATOM 959 CB SER A 62 5.590 0.825 -1.425 1.00 0.00 C ATOM 960 OG SER A 62 6.794 0.069 -1.510 1.00 0.00 O ATOM 0 H SER A 62 5.164 0.282 1.622 1.00 0.00 H new ATOM 0 HA SER A 62 6.042 2.403 -0.060 1.00 0.00 H new ATOM 0 HB2 SER A 62 4.737 0.171 -1.607 1.00 0.00 H new ATOM 0 HB3 SER A 62 5.582 1.583 -2.208 1.00 0.00 H new ATOM 0 HG SER A 62 7.539 0.599 -1.157 1.00 0.00 H new ATOM 966 N LEU A 63 3.598 3.035 -0.362 1.00 0.00 N ATOM 967 CA LEU A 63 2.238 3.525 -0.217 1.00 0.00 C ATOM 968 C LEU A 63 1.895 4.425 -1.406 1.00 0.00 C ATOM 969 O LEU A 63 2.504 5.479 -1.586 1.00 0.00 O ATOM 970 CB LEU A 63 2.054 4.203 1.142 1.00 0.00 C ATOM 971 CG LEU A 63 0.823 5.101 1.282 1.00 0.00 C ATOM 972 CD1 LEU A 63 -0.403 4.289 1.702 1.00 0.00 C ATOM 973 CD2 LEU A 63 1.098 6.262 2.241 1.00 0.00 C ATOM 0 H LEU A 63 4.215 3.644 -0.899 1.00 0.00 H new ATOM 0 HA LEU A 63 1.531 2.696 -0.231 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.004 3.429 1.908 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.941 4.801 1.351 1.00 0.00 H new ATOM 0 HG LEU A 63 0.603 5.534 0.306 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.264 4.951 1.794 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.610 3.527 0.950 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.210 3.809 2.661 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.207 6.885 2.323 1.00 0.00 H new ATOM 0 HD22 LEU A 63 1.357 5.868 3.224 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.926 6.860 1.860 1.00 0.00 H new ATOM 985 N LYS A 64 0.922 3.978 -2.186 1.00 0.00 N ATOM 986 CA LYS A 64 0.492 4.730 -3.352 1.00 0.00 C ATOM 987 C LYS A 64 -1.030 4.883 -3.322 1.00 0.00 C ATOM 988 O LYS A 64 -1.724 4.092 -2.685 1.00 0.00 O ATOM 989 CB LYS A 64 1.020 4.082 -4.633 1.00 0.00 C ATOM 990 CG LYS A 64 2.549 4.048 -4.641 1.00 0.00 C ATOM 991 CD LYS A 64 3.088 3.959 -6.070 1.00 0.00 C ATOM 992 CE LYS A 64 4.193 2.906 -6.175 1.00 0.00 C ATOM 993 NZ LYS A 64 5.344 3.436 -6.939 1.00 0.00 N ATOM 0 H LYS A 64 0.419 3.104 -2.033 1.00 0.00 H new ATOM 0 HA LYS A 64 0.914 5.735 -3.334 1.00 0.00 H new ATOM 0 HB2 LYS A 64 0.630 3.068 -4.719 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.661 4.636 -5.500 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.939 4.943 -4.157 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.900 3.194 -4.062 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.277 3.709 -6.754 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.476 4.930 -6.377 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.517 2.610 -5.177 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.806 2.012 -6.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.085 2.708 -7.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.034 3.697 -7.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.723 4.276 -6.457 1.00 0.00 H new ATOM 1007 N HIS A 65 -1.505 5.905 -4.018 1.00 0.00 N ATOM 1008 CA HIS A 65 -2.932 6.171 -4.079 1.00 0.00 C ATOM 1009 C HIS A 65 -3.552 5.384 -5.235 1.00 0.00 C ATOM 1010 O HIS A 65 -4.086 5.971 -6.175 1.00 0.00 O ATOM 1011 CB HIS A 65 -3.200 7.674 -4.174 1.00 0.00 C ATOM 1012 CG HIS A 65 -4.587 8.021 -4.660 1.00 0.00 C ATOM 1013 ND1 HIS A 65 -5.727 7.398 -4.182 1.00 0.00 N ATOM 1014 CD2 HIS A 65 -5.006 8.931 -5.585 1.00 0.00 C ATOM 1015 CE1 HIS A 65 -6.778 7.917 -4.799 1.00 0.00 C ATOM 1016 NE2 HIS A 65 -6.329 8.867 -5.669 1.00 0.00 N ATOM 0 H HIS A 65 -0.927 6.559 -4.545 1.00 0.00 H new ATOM 0 HA HIS A 65 -3.408 5.833 -3.159 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -3.047 8.123 -3.192 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -2.468 8.121 -4.846 1.00 0.00 H new ATOM 0 HD1 HIS A 65 -5.753 6.664 -3.475 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -4.369 9.592 -6.153 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -7.809 7.637 -4.641 1.00 0.00 H new ATOM 1024 N HIS A 66 -3.460 4.066 -5.128 1.00 0.00 N ATOM 1025 CA HIS A 66 -4.005 3.193 -6.153 1.00 0.00 C ATOM 1026 C HIS A 66 -3.027 3.104 -7.326 1.00 0.00 C ATOM 1027 O HIS A 66 -2.638 2.011 -7.733 1.00 0.00 O ATOM 1028 CB HIS A 66 -5.399 3.658 -6.578 1.00 0.00 C ATOM 1029 CG HIS A 66 -6.249 2.570 -7.191 1.00 0.00 C ATOM 1030 ND1 HIS A 66 -6.696 2.616 -8.500 1.00 0.00 N ATOM 1031 CD2 HIS A 66 -6.728 1.408 -6.661 1.00 0.00 C ATOM 1032 CE1 HIS A 66 -7.411 1.526 -8.736 1.00 0.00 C ATOM 1033 NE2 HIS A 66 -7.430 0.779 -7.595 1.00 0.00 N ATOM 0 H HIS A 66 -3.016 3.582 -4.347 1.00 0.00 H new ATOM 0 HA HIS A 66 -4.128 2.187 -5.751 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -5.917 4.063 -5.708 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -5.296 4.472 -7.295 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -6.564 1.059 -5.652 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -7.894 1.273 -9.668 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -7.906 -0.116 -7.479 1.00 0.00 H new ATOM 1041 N LYS A 67 -2.656 4.270 -7.835 1.00 0.00 N ATOM 1042 CA LYS A 67 -1.730 4.338 -8.953 1.00 0.00 C ATOM 1043 C LYS A 67 -1.087 5.725 -8.993 1.00 0.00 C ATOM 1044 O LYS A 67 -1.265 6.468 -9.957 1.00 0.00 O ATOM 1045 CB LYS A 67 -2.433 3.948 -10.255 1.00 0.00 C ATOM 1046 CG LYS A 67 -1.898 2.618 -10.789 1.00 0.00 C ATOM 1047 CD LYS A 67 -2.178 2.476 -12.287 1.00 0.00 C ATOM 1048 CE LYS A 67 -1.830 1.070 -12.779 1.00 0.00 C ATOM 1049 NZ LYS A 67 -2.732 0.670 -13.882 1.00 0.00 N ATOM 0 H LYS A 67 -2.980 5.175 -7.494 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.924 3.616 -8.825 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.507 3.870 -10.084 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.285 4.729 -11.001 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -0.825 2.555 -10.608 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -2.361 1.792 -10.249 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -3.229 2.685 -12.485 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -1.597 3.213 -12.841 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.795 1.043 -13.120 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -1.914 0.359 -11.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.483 -0.287 -14.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.716 0.676 -13.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -2.632 1.339 -14.672 1.00 0.00 H new ATOM 1063 N ASP A 68 -0.352 6.033 -7.934 1.00 0.00 N ATOM 1064 CA ASP A 68 0.318 7.318 -7.836 1.00 0.00 C ATOM 1065 C ASP A 68 1.221 7.324 -6.600 1.00 0.00 C ATOM 1066 O ASP A 68 0.834 6.829 -5.542 1.00 0.00 O ATOM 1067 CB ASP A 68 -0.692 8.457 -7.689 1.00 0.00 C ATOM 1068 CG ASP A 68 -0.319 9.751 -8.415 1.00 0.00 C ATOM 1069 OD1 ASP A 68 0.629 9.692 -9.228 1.00 0.00 O ATOM 1070 OD2 ASP A 68 -0.989 10.769 -8.142 1.00 0.00 O ATOM 0 H ASP A 68 -0.206 5.414 -7.136 1.00 0.00 H new ATOM 0 HA ASP A 68 0.898 7.466 -8.747 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -1.658 8.116 -8.060 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.817 8.676 -6.629 1.00 0.00 H new ATOM 1075 N ASP A 69 2.406 7.891 -6.775 1.00 0.00 N ATOM 1076 CA ASP A 69 3.366 7.969 -5.687 1.00 0.00 C ATOM 1077 C ASP A 69 2.949 9.081 -4.723 1.00 0.00 C ATOM 1078 O ASP A 69 3.406 10.217 -4.846 1.00 0.00 O ATOM 1079 CB ASP A 69 4.766 8.296 -6.211 1.00 0.00 C ATOM 1080 CG ASP A 69 5.132 7.630 -7.538 1.00 0.00 C ATOM 1081 OD1 ASP A 69 4.459 6.632 -7.877 1.00 0.00 O ATOM 1082 OD2 ASP A 69 6.076 8.133 -8.184 1.00 0.00 O ATOM 0 H ASP A 69 2.723 8.301 -7.654 1.00 0.00 H new ATOM 0 HA ASP A 69 3.386 7.002 -5.184 1.00 0.00 H new ATOM 0 HB2 ASP A 69 4.850 9.376 -6.329 1.00 0.00 H new ATOM 0 HB3 ASP A 69 5.497 7.999 -5.459 1.00 0.00 H new ATOM 1087 N ILE A 70 2.087 8.716 -3.786 1.00 0.00 N ATOM 1088 CA ILE A 70 1.603 9.669 -2.802 1.00 0.00 C ATOM 1089 C ILE A 70 2.365 9.471 -1.490 1.00 0.00 C ATOM 1090 O ILE A 70 2.739 8.351 -1.148 1.00 0.00 O ATOM 1091 CB ILE A 70 0.085 9.562 -2.653 1.00 0.00 C ATOM 1092 CG1 ILE A 70 -0.468 10.723 -1.823 1.00 0.00 C ATOM 1093 CG2 ILE A 70 -0.315 8.203 -2.075 1.00 0.00 C ATOM 1094 CD1 ILE A 70 -1.285 11.680 -2.694 1.00 0.00 C ATOM 0 H ILE A 70 1.711 7.773 -3.687 1.00 0.00 H new ATOM 0 HA ILE A 70 1.796 10.689 -3.133 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.361 9.634 -3.645 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -1.093 10.334 -1.019 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.354 11.264 -1.355 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.400 8.153 -1.979 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.027 7.410 -2.740 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.142 8.076 -1.094 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.666 12.496 -2.080 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.651 12.085 -3.483 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.121 11.142 -3.141 1.00 0.00 H new ATOM 1106 N SER A 71 2.573 10.578 -0.790 1.00 0.00 N ATOM 1107 CA SER A 71 3.283 10.540 0.477 1.00 0.00 C ATOM 1108 C SER A 71 2.289 10.618 1.637 1.00 0.00 C ATOM 1109 O SER A 71 2.567 10.130 2.731 1.00 0.00 O ATOM 1110 CB SER A 71 4.300 11.679 0.572 1.00 0.00 C ATOM 1111 OG SER A 71 3.669 12.946 0.732 1.00 0.00 O ATOM 0 H SER A 71 2.262 11.506 -1.077 1.00 0.00 H new ATOM 0 HA SER A 71 3.827 9.597 0.536 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.969 11.498 1.413 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.915 11.692 -0.328 1.00 0.00 H new ATOM 0 HG SER A 71 4.352 13.646 0.790 1.00 0.00 H new ATOM 1117 N VAL A 72 1.150 11.235 1.358 1.00 0.00 N ATOM 1118 CA VAL A 72 0.113 11.383 2.365 1.00 0.00 C ATOM 1119 C VAL A 72 -1.256 11.158 1.718 1.00 0.00 C ATOM 1120 O VAL A 72 -1.534 11.691 0.644 1.00 0.00 O ATOM 1121 CB VAL A 72 0.235 12.747 3.046 1.00 0.00 C ATOM 1122 CG1 VAL A 72 -1.100 13.177 3.657 1.00 0.00 C ATOM 1123 CG2 VAL A 72 1.343 12.736 4.101 1.00 0.00 C ATOM 0 H VAL A 72 0.923 11.638 0.449 1.00 0.00 H new ATOM 0 HA VAL A 72 0.231 10.633 3.147 1.00 0.00 H new ATOM 0 HB VAL A 72 0.505 13.478 2.284 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -0.985 14.150 4.135 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -1.854 13.245 2.873 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -1.414 12.443 4.399 1.00 0.00 H new ATOM 0 HG21 VAL A 72 1.409 13.718 4.570 1.00 0.00 H new ATOM 0 HG22 VAL A 72 1.116 11.986 4.859 1.00 0.00 H new ATOM 0 HG23 VAL A 72 2.295 12.496 3.627 1.00 0.00 H new ATOM 1133 N ILE A 73 -2.074 10.369 2.398 1.00 0.00 N ATOM 1134 CA ILE A 73 -3.407 10.067 1.903 1.00 0.00 C ATOM 1135 C ILE A 73 -4.446 10.664 2.854 1.00 0.00 C ATOM 1136 O ILE A 73 -4.394 10.433 4.061 1.00 0.00 O ATOM 1137 CB ILE A 73 -3.568 8.562 1.682 1.00 0.00 C ATOM 1138 CG1 ILE A 73 -2.668 8.075 0.545 1.00 0.00 C ATOM 1139 CG2 ILE A 73 -5.035 8.197 1.448 1.00 0.00 C ATOM 1140 CD1 ILE A 73 -3.257 8.446 -0.818 1.00 0.00 C ATOM 0 H ILE A 73 -1.840 9.929 3.288 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.565 10.527 0.928 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.248 8.047 2.588 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -1.676 8.514 0.648 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.546 6.994 0.610 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -5.122 7.122 1.294 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.625 8.488 2.317 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -5.404 8.721 0.567 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -2.598 8.088 -1.609 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.239 7.985 -0.928 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.355 9.529 -0.889 1.00 0.00 H new ATOM 1152 N LYS A 74 -5.366 11.421 2.274 1.00 0.00 N ATOM 1153 CA LYS A 74 -6.416 12.052 3.054 1.00 0.00 C ATOM 1154 C LYS A 74 -7.552 11.052 3.278 1.00 0.00 C ATOM 1155 O LYS A 74 -7.518 9.941 2.751 1.00 0.00 O ATOM 1156 CB LYS A 74 -6.866 13.356 2.391 1.00 0.00 C ATOM 1157 CG LYS A 74 -5.670 14.264 2.100 1.00 0.00 C ATOM 1158 CD LYS A 74 -6.001 15.268 0.994 1.00 0.00 C ATOM 1159 CE LYS A 74 -4.724 15.832 0.366 1.00 0.00 C ATOM 1160 NZ LYS A 74 -4.688 17.305 0.498 1.00 0.00 N ATOM 0 H LYS A 74 -5.406 11.611 1.273 1.00 0.00 H new ATOM 0 HA LYS A 74 -6.042 12.334 4.038 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.392 13.133 1.463 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -7.571 13.874 3.041 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -5.384 14.797 3.007 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.813 13.659 1.803 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -6.605 14.783 0.227 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -6.599 16.082 1.404 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -3.850 15.396 0.851 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.676 15.554 -0.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.815 17.671 0.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -5.512 17.717 0.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -4.712 17.564 1.505 1.00 0.00 H new ATOM 1174 N THR A 75 -8.532 11.482 4.058 1.00 0.00 N ATOM 1175 CA THR A 75 -9.676 10.638 4.358 1.00 0.00 C ATOM 1176 C THR A 75 -10.591 10.527 3.136 1.00 0.00 C ATOM 1177 O THR A 75 -10.779 11.500 2.407 1.00 0.00 O ATOM 1178 CB THR A 75 -10.377 11.211 5.592 1.00 0.00 C ATOM 1179 OG1 THR A 75 -9.407 11.090 6.629 1.00 0.00 O ATOM 1180 CG2 THR A 75 -11.539 10.335 6.064 1.00 0.00 C ATOM 0 H THR A 75 -8.558 12.405 4.492 1.00 0.00 H new ATOM 0 HA THR A 75 -9.366 9.618 4.587 1.00 0.00 H new ATOM 0 HB THR A 75 -10.745 12.212 5.369 1.00 0.00 H new ATOM 0 HG1 THR A 75 -8.555 10.794 6.247 1.00 0.00 H new ATOM 0 HG21 THR A 75 -12.002 10.786 6.942 1.00 0.00 H new ATOM 0 HG22 THR A 75 -12.278 10.250 5.267 1.00 0.00 H new ATOM 0 HG23 THR A 75 -11.166 9.343 6.320 1.00 0.00 H new ATOM 1188 N GLY A 76 -11.136 9.334 2.951 1.00 0.00 N ATOM 1189 CA GLY A 76 -12.027 9.083 1.831 1.00 0.00 C ATOM 1190 C GLY A 76 -11.237 8.703 0.577 1.00 0.00 C ATOM 1191 O GLY A 76 -11.822 8.370 -0.452 1.00 0.00 O ATOM 0 H GLY A 76 -10.978 8.530 3.558 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.720 8.281 2.086 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.627 9.971 1.632 1.00 0.00 H new ATOM 1195 N MET A 77 -9.920 8.766 0.705 1.00 0.00 N ATOM 1196 CA MET A 77 -9.044 8.433 -0.406 1.00 0.00 C ATOM 1197 C MET A 77 -8.569 6.981 -0.313 1.00 0.00 C ATOM 1198 O MET A 77 -8.109 6.541 0.740 1.00 0.00 O ATOM 1199 CB MET A 77 -7.832 9.368 -0.399 1.00 0.00 C ATOM 1200 CG MET A 77 -8.203 10.750 -0.940 1.00 0.00 C ATOM 1201 SD MET A 77 -7.440 11.007 -2.533 1.00 0.00 S ATOM 1202 CE MET A 77 -5.724 10.796 -2.093 1.00 0.00 C ATOM 0 H MET A 77 -9.438 9.042 1.560 1.00 0.00 H new ATOM 0 HA MET A 77 -9.603 8.555 -1.334 1.00 0.00 H new ATOM 0 HB2 MET A 77 -7.447 9.462 0.616 1.00 0.00 H new ATOM 0 HB3 MET A 77 -7.034 8.939 -1.004 1.00 0.00 H new ATOM 0 HG2 MET A 77 -9.286 10.836 -1.028 1.00 0.00 H new ATOM 0 HG3 MET A 77 -7.877 11.522 -0.243 1.00 0.00 H new ATOM 0 HE1 MET A 77 -5.113 11.495 -2.664 1.00 0.00 H new ATOM 0 HE2 MET A 77 -5.595 10.988 -1.028 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.413 9.776 -2.318 1.00 0.00 H new ATOM 1212 N ASP A 78 -8.697 6.278 -1.429 1.00 0.00 N ATOM 1213 CA ASP A 78 -8.287 4.885 -1.486 1.00 0.00 C ATOM 1214 C ASP A 78 -6.782 4.812 -1.754 1.00 0.00 C ATOM 1215 O ASP A 78 -6.233 5.651 -2.466 1.00 0.00 O ATOM 1216 CB ASP A 78 -9.005 4.146 -2.618 1.00 0.00 C ATOM 1217 CG ASP A 78 -10.532 4.235 -2.581 1.00 0.00 C ATOM 1218 OD1 ASP A 78 -11.046 5.312 -2.954 1.00 0.00 O ATOM 1219 OD2 ASP A 78 -11.150 3.225 -2.181 1.00 0.00 O ATOM 0 H ASP A 78 -9.079 6.647 -2.300 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.540 4.419 -0.533 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.656 4.544 -3.571 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -8.716 3.095 -2.587 1.00 0.00 H new ATOM 1224 N CYS A 79 -6.158 3.801 -1.168 1.00 0.00 N ATOM 1225 CA CYS A 79 -4.728 3.607 -1.334 1.00 0.00 C ATOM 1226 C CYS A 79 -4.391 2.164 -0.952 1.00 0.00 C ATOM 1227 O CYS A 79 -5.145 1.518 -0.225 1.00 0.00 O ATOM 1228 CB CYS A 79 -3.921 4.617 -0.516 1.00 0.00 C ATOM 1229 SG CYS A 79 -4.401 4.520 1.247 1.00 0.00 S ATOM 0 H CYS A 79 -6.617 3.107 -0.577 1.00 0.00 H new ATOM 0 HA CYS A 79 -4.454 3.780 -2.375 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -2.855 4.415 -0.623 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -4.094 5.625 -0.894 1.00 0.00 H new ATOM 0 HG CYS A 79 -3.363 4.205 1.963 1.00 0.00 H new ATOM 1235 N GLY A 80 -3.258 1.700 -1.459 1.00 0.00 N ATOM 1236 CA GLY A 80 -2.812 0.346 -1.180 1.00 0.00 C ATOM 1237 C GLY A 80 -1.452 0.350 -0.479 1.00 0.00 C ATOM 1238 O GLY A 80 -0.544 1.075 -0.881 1.00 0.00 O ATOM 0 H GLY A 80 -2.635 2.238 -2.062 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -3.546 -0.161 -0.554 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.744 -0.217 -2.111 1.00 0.00 H new ATOM 1242 N LEU A 81 -1.355 -0.469 0.558 1.00 0.00 N ATOM 1243 CA LEU A 81 -0.121 -0.570 1.319 1.00 0.00 C ATOM 1244 C LEU A 81 0.314 -2.035 1.386 1.00 0.00 C ATOM 1245 O LEU A 81 -0.524 -2.935 1.399 1.00 0.00 O ATOM 1246 CB LEU A 81 -0.283 0.087 2.692 1.00 0.00 C ATOM 1247 CG LEU A 81 -1.389 -0.483 3.582 1.00 0.00 C ATOM 1248 CD1 LEU A 81 -0.965 -1.818 4.196 1.00 0.00 C ATOM 1249 CD2 LEU A 81 -1.813 0.530 4.647 1.00 0.00 C ATOM 0 H LEU A 81 -2.111 -1.069 0.889 1.00 0.00 H new ATOM 0 HA LEU A 81 0.679 -0.022 0.821 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.664 0.005 3.226 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.475 1.150 2.544 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.262 -0.678 2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.769 -2.201 4.824 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.753 -2.533 3.401 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.070 -1.672 4.801 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.600 0.099 5.266 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -0.956 0.781 5.272 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.185 1.433 4.163 1.00 0.00 H new ATOM 1261 N SER A 82 1.624 -2.228 1.427 1.00 0.00 N ATOM 1262 CA SER A 82 2.181 -3.569 1.492 1.00 0.00 C ATOM 1263 C SER A 82 3.190 -3.661 2.638 1.00 0.00 C ATOM 1264 O SER A 82 3.949 -2.723 2.879 1.00 0.00 O ATOM 1265 CB SER A 82 2.844 -3.955 0.169 1.00 0.00 C ATOM 1266 OG SER A 82 3.749 -2.953 -0.287 1.00 0.00 O ATOM 0 H SER A 82 2.316 -1.479 1.416 1.00 0.00 H new ATOM 0 HA SER A 82 1.366 -4.269 1.676 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.378 -4.897 0.293 1.00 0.00 H new ATOM 0 HB3 SER A 82 2.076 -4.121 -0.587 1.00 0.00 H new ATOM 0 HG SER A 82 4.153 -3.238 -1.133 1.00 0.00 H new ATOM 1272 N LEU A 83 3.167 -4.800 3.315 1.00 0.00 N ATOM 1273 CA LEU A 83 4.070 -5.027 4.430 1.00 0.00 C ATOM 1274 C LEU A 83 5.381 -5.617 3.907 1.00 0.00 C ATOM 1275 O LEU A 83 5.462 -6.033 2.752 1.00 0.00 O ATOM 1276 CB LEU A 83 3.394 -5.885 5.501 1.00 0.00 C ATOM 1277 CG LEU A 83 2.002 -5.430 5.945 1.00 0.00 C ATOM 1278 CD1 LEU A 83 1.393 -6.421 6.940 1.00 0.00 C ATOM 1279 CD2 LEU A 83 2.043 -4.007 6.506 1.00 0.00 C ATOM 0 H LEU A 83 2.537 -5.576 3.112 1.00 0.00 H new ATOM 0 HA LEU A 83 4.316 -4.084 4.918 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.319 -6.906 5.126 1.00 0.00 H new ATOM 0 HB3 LEU A 83 4.042 -5.914 6.377 1.00 0.00 H new ATOM 0 HG LEU A 83 1.353 -5.412 5.069 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.404 -6.074 7.240 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.307 -7.401 6.471 1.00 0.00 H new ATOM 0 HD13 LEU A 83 2.034 -6.494 7.819 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.041 -3.708 6.814 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.712 -3.974 7.366 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.405 -3.323 5.738 1.00 0.00 H new ATOM 1291 N ASP A 84 6.376 -5.634 4.782 1.00 0.00 N ATOM 1292 CA ASP A 84 7.680 -6.165 4.422 1.00 0.00 C ATOM 1293 C ASP A 84 7.745 -7.645 4.804 1.00 0.00 C ATOM 1294 O ASP A 84 8.826 -8.181 5.046 1.00 0.00 O ATOM 1295 CB ASP A 84 8.798 -5.435 5.168 1.00 0.00 C ATOM 1296 CG ASP A 84 10.205 -5.667 4.614 1.00 0.00 C ATOM 1297 OD1 ASP A 84 10.374 -6.680 3.902 1.00 0.00 O ATOM 1298 OD2 ASP A 84 11.079 -4.827 4.916 1.00 0.00 O ATOM 0 H ASP A 84 6.305 -5.289 5.739 1.00 0.00 H new ATOM 0 HA ASP A 84 7.815 -6.029 3.349 1.00 0.00 H new ATOM 0 HB2 ASP A 84 8.588 -4.365 5.149 1.00 0.00 H new ATOM 0 HB3 ASP A 84 8.780 -5.745 6.213 1.00 0.00 H new ATOM 1303 N GLU A 85 6.574 -8.265 4.847 1.00 0.00 N ATOM 1304 CA GLU A 85 6.485 -9.672 5.196 1.00 0.00 C ATOM 1305 C GLU A 85 5.276 -10.313 4.510 1.00 0.00 C ATOM 1306 O GLU A 85 4.173 -10.305 5.054 1.00 0.00 O ATOM 1307 CB GLU A 85 6.417 -9.858 6.713 1.00 0.00 C ATOM 1308 CG GLU A 85 6.998 -11.212 7.126 1.00 0.00 C ATOM 1309 CD GLU A 85 8.523 -11.146 7.227 1.00 0.00 C ATOM 1310 OE1 GLU A 85 9.001 -10.470 8.164 1.00 0.00 O ATOM 1311 OE2 GLU A 85 9.177 -11.773 6.366 1.00 0.00 O ATOM 0 H GLU A 85 5.679 -7.818 4.646 1.00 0.00 H new ATOM 0 HA GLU A 85 7.387 -10.172 4.842 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.967 -9.057 7.206 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.382 -9.786 7.046 1.00 0.00 H new ATOM 0 HG2 GLU A 85 6.579 -11.514 8.086 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.711 -11.972 6.399 1.00 0.00 H new ATOM 1318 N GLU A 86 5.526 -10.854 3.326 1.00 0.00 N ATOM 1319 CA GLU A 86 4.472 -11.498 2.561 1.00 0.00 C ATOM 1320 C GLU A 86 3.759 -12.547 3.417 1.00 0.00 C ATOM 1321 O GLU A 86 2.623 -12.920 3.129 1.00 0.00 O ATOM 1322 CB GLU A 86 5.028 -12.121 1.279 1.00 0.00 C ATOM 1323 CG GLU A 86 6.137 -13.127 1.595 1.00 0.00 C ATOM 1324 CD GLU A 86 6.371 -14.074 0.416 1.00 0.00 C ATOM 1325 OE1 GLU A 86 5.371 -14.390 -0.265 1.00 0.00 O ATOM 1326 OE2 GLU A 86 7.544 -14.460 0.223 1.00 0.00 O ATOM 0 H GLU A 86 6.443 -10.859 2.878 1.00 0.00 H new ATOM 0 HA GLU A 86 3.745 -10.740 2.271 1.00 0.00 H new ATOM 0 HB2 GLU A 86 4.225 -12.618 0.734 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.417 -11.338 0.629 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.060 -12.595 1.828 1.00 0.00 H new ATOM 0 HG3 GLU A 86 5.869 -13.703 2.481 1.00 0.00 H new ATOM 1333 N LYS A 87 4.456 -12.992 4.452 1.00 0.00 N ATOM 1334 CA LYS A 87 3.904 -13.990 5.352 1.00 0.00 C ATOM 1335 C LYS A 87 2.564 -13.493 5.898 1.00 0.00 C ATOM 1336 O LYS A 87 1.602 -14.255 5.979 1.00 0.00 O ATOM 1337 CB LYS A 87 4.917 -14.349 6.441 1.00 0.00 C ATOM 1338 CG LYS A 87 5.950 -15.350 5.920 1.00 0.00 C ATOM 1339 CD LYS A 87 6.364 -16.332 7.018 1.00 0.00 C ATOM 1340 CE LYS A 87 7.264 -17.435 6.457 1.00 0.00 C ATOM 1341 NZ LYS A 87 7.538 -18.457 7.491 1.00 0.00 N ATOM 0 H LYS A 87 5.398 -12.680 4.687 1.00 0.00 H new ATOM 0 HA LYS A 87 3.706 -14.918 4.816 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.422 -13.446 6.785 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.397 -14.771 7.301 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.536 -15.898 5.074 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.827 -14.816 5.555 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.889 -15.797 7.810 1.00 0.00 H new ATOM 0 HD3 LYS A 87 5.476 -16.776 7.467 1.00 0.00 H new ATOM 0 HE2 LYS A 87 6.785 -17.900 5.596 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.202 -17.004 6.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 8.150 -19.198 7.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 8.015 -18.012 8.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 6.642 -18.881 7.806 1.00 0.00 H new ATOM 1355 N VAL A 88 2.545 -12.219 6.259 1.00 0.00 N ATOM 1356 CA VAL A 88 1.339 -11.611 6.795 1.00 0.00 C ATOM 1357 C VAL A 88 0.319 -11.432 5.669 1.00 0.00 C ATOM 1358 O VAL A 88 0.659 -10.949 4.590 1.00 0.00 O ATOM 1359 CB VAL A 88 1.685 -10.299 7.503 1.00 0.00 C ATOM 1360 CG1 VAL A 88 0.439 -9.671 8.132 1.00 0.00 C ATOM 1361 CG2 VAL A 88 2.779 -10.513 8.551 1.00 0.00 C ATOM 0 H VAL A 88 3.346 -11.591 6.191 1.00 0.00 H new ATOM 0 HA VAL A 88 0.885 -12.259 7.544 1.00 0.00 H new ATOM 0 HB VAL A 88 2.069 -9.606 6.755 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.712 -8.740 8.629 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.297 -9.465 7.355 1.00 0.00 H new ATOM 0 HG13 VAL A 88 0.013 -10.360 8.861 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.006 -9.565 9.039 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.434 -11.231 9.295 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.677 -10.896 8.066 1.00 0.00 H new ATOM 1371 N GLU A 89 -0.911 -11.830 5.959 1.00 0.00 N ATOM 1372 CA GLU A 89 -1.983 -11.720 4.984 1.00 0.00 C ATOM 1373 C GLU A 89 -3.123 -10.866 5.543 1.00 0.00 C ATOM 1374 O GLU A 89 -3.516 -11.028 6.697 1.00 0.00 O ATOM 1375 CB GLU A 89 -2.488 -13.102 4.566 1.00 0.00 C ATOM 1376 CG GLU A 89 -3.884 -13.011 3.947 1.00 0.00 C ATOM 1377 CD GLU A 89 -4.395 -14.395 3.542 1.00 0.00 C ATOM 1378 OE1 GLU A 89 -4.820 -15.134 4.457 1.00 0.00 O ATOM 1379 OE2 GLU A 89 -4.350 -14.684 2.327 1.00 0.00 O ATOM 0 H GLU A 89 -1.189 -12.229 6.855 1.00 0.00 H new ATOM 0 HA GLU A 89 -1.589 -11.229 4.094 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -1.796 -13.544 3.849 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -2.513 -13.762 5.433 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -4.573 -12.559 4.660 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.857 -12.359 3.074 1.00 0.00 H new ATOM 1386 N PHE A 90 -3.621 -9.975 4.699 1.00 0.00 N ATOM 1387 CA PHE A 90 -4.708 -9.095 5.094 1.00 0.00 C ATOM 1388 C PHE A 90 -6.066 -9.718 4.763 1.00 0.00 C ATOM 1389 O PHE A 90 -6.136 -10.864 4.321 1.00 0.00 O ATOM 1390 CB PHE A 90 -4.547 -7.799 4.296 1.00 0.00 C ATOM 1391 CG PHE A 90 -3.092 -7.387 4.065 1.00 0.00 C ATOM 1392 CD1 PHE A 90 -2.409 -7.876 2.996 1.00 0.00 C ATOM 1393 CD2 PHE A 90 -2.482 -6.532 4.929 1.00 0.00 C ATOM 1394 CE1 PHE A 90 -1.058 -7.494 2.781 1.00 0.00 C ATOM 1395 CE2 PHE A 90 -1.131 -6.150 4.714 1.00 0.00 C ATOM 1396 CZ PHE A 90 -0.448 -6.639 3.645 1.00 0.00 C ATOM 0 H PHE A 90 -3.292 -9.843 3.743 1.00 0.00 H new ATOM 0 HA PHE A 90 -4.672 -8.918 6.169 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -5.038 -7.916 3.330 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -5.063 -6.995 4.821 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.894 -8.555 2.310 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.025 -6.144 5.778 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.515 -7.882 1.932 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.646 -5.471 5.400 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.579 -6.348 3.482 1.00 0.00 H new ATOM 1406 N LYS A 91 -7.111 -8.937 4.991 1.00 0.00 N ATOM 1407 CA LYS A 91 -8.462 -9.398 4.723 1.00 0.00 C ATOM 1408 C LYS A 91 -9.438 -8.231 4.891 1.00 0.00 C ATOM 1409 O LYS A 91 -9.125 -7.248 5.562 1.00 0.00 O ATOM 1410 CB LYS A 91 -8.798 -10.610 5.594 1.00 0.00 C ATOM 1411 CG LYS A 91 -9.046 -10.191 7.044 1.00 0.00 C ATOM 1412 CD LYS A 91 -9.637 -11.346 7.855 1.00 0.00 C ATOM 1413 CE LYS A 91 -11.157 -11.217 7.965 1.00 0.00 C ATOM 1414 NZ LYS A 91 -11.802 -12.541 7.811 1.00 0.00 N ATOM 0 H LYS A 91 -7.049 -7.988 5.359 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.549 -9.741 3.692 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.682 -11.111 5.200 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -7.980 -11.329 5.554 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -8.110 -9.865 7.497 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.726 -9.339 7.069 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.382 -12.295 7.382 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.196 -11.358 8.852 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.422 -10.787 8.931 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -11.526 -10.535 7.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -12.834 -12.436 7.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.563 -12.937 6.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -11.463 -13.181 8.557 1.00 0.00 H new ATOM 1428 N PRO A 92 -10.630 -8.381 4.254 1.00 0.00 N ATOM 1429 CA PRO A 92 -11.652 -7.352 4.327 1.00 0.00 C ATOM 1430 C PRO A 92 -12.342 -7.359 5.693 1.00 0.00 C ATOM 1431 O PRO A 92 -13.281 -8.122 5.914 1.00 0.00 O ATOM 1432 CB PRO A 92 -12.602 -7.659 3.181 1.00 0.00 C ATOM 1433 CG PRO A 92 -12.339 -9.106 2.798 1.00 0.00 C ATOM 1434 CD PRO A 92 -11.034 -9.531 3.451 1.00 0.00 C ATOM 0 HA PRO A 92 -11.243 -6.346 4.230 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -13.639 -7.518 3.485 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -12.424 -6.993 2.337 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -13.158 -9.744 3.131 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -12.275 -9.209 1.715 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -11.171 -10.418 4.070 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.279 -9.777 2.704 1.00 0.00 H new ATOM 1442 N GLY A 93 -11.848 -6.502 6.574 1.00 0.00 N ATOM 1443 CA GLY A 93 -12.405 -6.400 7.913 1.00 0.00 C ATOM 1444 C GLY A 93 -11.318 -6.059 8.934 1.00 0.00 C ATOM 1445 O GLY A 93 -11.619 -5.628 10.046 1.00 0.00 O ATOM 0 H GLY A 93 -11.068 -5.872 6.387 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -13.180 -5.633 7.931 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.882 -7.342 8.185 1.00 0.00 H new ATOM 1449 N ASP A 94 -10.076 -6.267 8.521 1.00 0.00 N ATOM 1450 CA ASP A 94 -8.943 -5.987 9.386 1.00 0.00 C ATOM 1451 C ASP A 94 -8.852 -4.479 9.629 1.00 0.00 C ATOM 1452 O ASP A 94 -9.676 -3.715 9.128 1.00 0.00 O ATOM 1453 CB ASP A 94 -7.632 -6.442 8.741 1.00 0.00 C ATOM 1454 CG ASP A 94 -7.316 -7.930 8.901 1.00 0.00 C ATOM 1455 OD1 ASP A 94 -8.233 -8.663 9.330 1.00 0.00 O ATOM 1456 OD2 ASP A 94 -6.163 -8.302 8.591 1.00 0.00 O ATOM 0 H ASP A 94 -9.830 -6.626 7.599 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.091 -6.527 10.321 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -7.666 -6.205 7.678 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -6.814 -5.864 9.170 1.00 0.00 H new ATOM 1461 N GLN A 95 -7.843 -4.095 10.396 1.00 0.00 N ATOM 1462 CA GLN A 95 -7.633 -2.693 10.711 1.00 0.00 C ATOM 1463 C GLN A 95 -6.167 -2.313 10.494 1.00 0.00 C ATOM 1464 O GLN A 95 -5.291 -3.177 10.497 1.00 0.00 O ATOM 1465 CB GLN A 95 -8.074 -2.380 12.143 1.00 0.00 C ATOM 1466 CG GLN A 95 -9.550 -1.982 12.187 1.00 0.00 C ATOM 1467 CD GLN A 95 -10.108 -2.103 13.607 1.00 0.00 C ATOM 1468 OE1 GLN A 95 -10.067 -3.150 14.231 1.00 0.00 O ATOM 1469 NE2 GLN A 95 -10.631 -0.975 14.080 1.00 0.00 N ATOM 0 H GLN A 95 -7.161 -4.731 10.809 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.247 -2.095 10.038 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -7.910 -3.251 12.777 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.464 -1.572 12.547 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.665 -0.957 11.833 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -10.122 -2.618 11.512 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -10.633 -0.133 13.504 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -11.030 -0.952 15.018 1.00 0.00 H new ATOM 1478 N VAL A 96 -5.945 -1.020 10.310 1.00 0.00 N ATOM 1479 CA VAL A 96 -4.600 -0.515 10.092 1.00 0.00 C ATOM 1480 C VAL A 96 -4.379 0.727 10.957 1.00 0.00 C ATOM 1481 O VAL A 96 -4.799 1.824 10.594 1.00 0.00 O ATOM 1482 CB VAL A 96 -4.375 -0.253 8.601 1.00 0.00 C ATOM 1483 CG1 VAL A 96 -3.180 0.677 8.382 1.00 0.00 C ATOM 1484 CG2 VAL A 96 -4.197 -1.565 7.834 1.00 0.00 C ATOM 0 H VAL A 96 -6.674 -0.307 10.307 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.860 -1.257 10.394 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.263 0.245 8.211 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.042 0.847 7.314 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.364 1.629 8.880 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.282 0.219 8.796 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.039 -1.350 6.777 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.335 -2.103 8.228 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -5.091 -2.178 7.950 1.00 0.00 H new ATOM 1494 N ILE A 97 -3.719 0.512 12.086 1.00 0.00 N ATOM 1495 CA ILE A 97 -3.437 1.601 13.007 1.00 0.00 C ATOM 1496 C ILE A 97 -2.120 2.270 12.610 1.00 0.00 C ATOM 1497 O ILE A 97 -1.055 1.663 12.716 1.00 0.00 O ATOM 1498 CB ILE A 97 -3.462 1.100 14.452 1.00 0.00 C ATOM 1499 CG1 ILE A 97 -4.718 0.268 14.723 1.00 0.00 C ATOM 1500 CG2 ILE A 97 -3.322 2.262 15.437 1.00 0.00 C ATOM 1501 CD1 ILE A 97 -5.954 1.162 14.836 1.00 0.00 C ATOM 0 H ILE A 97 -3.372 -0.400 12.384 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.213 2.364 12.945 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.604 0.445 14.601 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.860 -0.455 13.920 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -4.590 -0.300 15.644 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.343 1.879 16.457 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.377 2.776 15.262 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -4.147 2.961 15.295 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.832 0.546 15.029 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -5.819 1.868 15.656 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -6.093 1.710 13.904 1.00 0.00 H new ATOM 1513 N CYS A 98 -2.234 3.511 12.161 1.00 0.00 N ATOM 1514 CA CYS A 98 -1.065 4.269 11.749 1.00 0.00 C ATOM 1515 C CYS A 98 -0.715 5.257 12.863 1.00 0.00 C ATOM 1516 O CYS A 98 -1.262 6.358 12.915 1.00 0.00 O ATOM 1517 CB CYS A 98 -1.292 4.975 10.410 1.00 0.00 C ATOM 1518 SG CYS A 98 -2.210 3.875 9.271 1.00 0.00 S ATOM 0 H CYS A 98 -3.119 4.011 12.073 1.00 0.00 H new ATOM 0 HA CYS A 98 -0.226 3.591 11.590 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -1.850 5.898 10.566 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -0.335 5.252 9.969 1.00 0.00 H new ATOM 0 HG CYS A 98 -1.422 3.487 8.313 1.00 0.00 H new ATOM 1524 N TYR A 99 0.194 4.829 13.726 1.00 0.00 N ATOM 1525 CA TYR A 99 0.623 5.662 14.836 1.00 0.00 C ATOM 1526 C TYR A 99 2.007 6.258 14.571 1.00 0.00 C ATOM 1527 O TYR A 99 2.694 5.850 13.636 1.00 0.00 O ATOM 1528 CB TYR A 99 0.703 4.737 16.052 1.00 0.00 C ATOM 1529 CG TYR A 99 1.944 3.842 16.072 1.00 0.00 C ATOM 1530 CD1 TYR A 99 1.940 2.640 15.394 1.00 0.00 C ATOM 1531 CD2 TYR A 99 3.068 4.237 16.769 1.00 0.00 C ATOM 1532 CE1 TYR A 99 3.108 1.798 15.413 1.00 0.00 C ATOM 1533 CE2 TYR A 99 4.237 3.396 16.787 1.00 0.00 C ATOM 1534 CZ TYR A 99 4.199 2.218 16.109 1.00 0.00 C ATOM 1535 OH TYR A 99 5.302 1.422 16.127 1.00 0.00 O ATOM 0 H TYR A 99 0.646 3.916 13.679 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.071 6.489 14.986 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.690 5.343 16.958 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.187 4.108 16.076 1.00 0.00 H new ATOM 0 HD1 TYR A 99 1.060 2.331 14.849 1.00 0.00 H new ATOM 0 HD2 TYR A 99 3.071 5.177 17.301 1.00 0.00 H new ATOM 0 HE1 TYR A 99 3.118 0.855 14.887 1.00 0.00 H new ATOM 0 HE2 TYR A 99 5.124 3.694 17.327 1.00 0.00 H new ATOM 0 HH TYR A 99 6.004 1.848 16.661 1.00 0.00 H new ATOM 1545 N GLU A 100 2.375 7.214 15.411 1.00 0.00 N ATOM 1546 CA GLU A 100 3.665 7.870 15.280 1.00 0.00 C ATOM 1547 C GLU A 100 4.614 7.403 16.385 1.00 0.00 C ATOM 1548 O GLU A 100 4.307 7.536 17.569 1.00 0.00 O ATOM 1549 CB GLU A 100 3.510 9.392 15.298 1.00 0.00 C ATOM 1550 CG GLU A 100 4.688 10.072 14.597 1.00 0.00 C ATOM 1551 CD GLU A 100 5.589 10.786 15.606 1.00 0.00 C ATOM 1552 OE1 GLU A 100 5.032 11.304 16.598 1.00 0.00 O ATOM 1553 OE2 GLU A 100 6.815 10.798 15.363 1.00 0.00 O ATOM 0 H GLU A 100 1.802 7.550 16.185 1.00 0.00 H new ATOM 0 HA GLU A 100 4.095 7.592 14.318 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.579 9.672 14.806 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.444 9.742 16.328 1.00 0.00 H new ATOM 0 HG2 GLU A 100 5.267 9.329 14.049 1.00 0.00 H new ATOM 0 HG3 GLU A 100 4.316 10.789 13.865 1.00 0.00 H new ATOM 1560 N GLU A 101 5.747 6.864 15.959 1.00 0.00 N ATOM 1561 CA GLU A 101 6.743 6.376 16.898 1.00 0.00 C ATOM 1562 C GLU A 101 7.275 7.527 17.753 1.00 0.00 C ATOM 1563 O GLU A 101 8.190 8.239 17.342 1.00 0.00 O ATOM 1564 CB GLU A 101 7.882 5.663 16.168 1.00 0.00 C ATOM 1565 CG GLU A 101 8.199 4.318 16.825 1.00 0.00 C ATOM 1566 CD GLU A 101 9.509 4.388 17.612 1.00 0.00 C ATOM 1567 OE1 GLU A 101 9.556 5.193 18.567 1.00 0.00 O ATOM 1568 OE2 GLU A 101 10.434 3.634 17.241 1.00 0.00 O ATOM 0 H GLU A 101 5.997 6.754 14.976 1.00 0.00 H new ATOM 0 HA GLU A 101 6.267 5.650 17.557 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.608 5.506 15.125 1.00 0.00 H new ATOM 0 HB3 GLU A 101 8.772 6.293 16.173 1.00 0.00 H new ATOM 0 HG2 GLU A 101 7.385 4.034 17.492 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.270 3.544 16.061 1.00 0.00 H new ATOM 1575 N ASN A 102 6.681 7.674 18.928 1.00 0.00 N ATOM 1576 CA ASN A 102 7.084 8.727 19.845 1.00 0.00 C ATOM 1577 C ASN A 102 7.224 8.145 21.253 1.00 0.00 C ATOM 1578 O ASN A 102 6.658 7.095 21.554 1.00 0.00 O ATOM 1579 CB ASN A 102 6.039 9.843 19.896 1.00 0.00 C ATOM 1580 CG ASN A 102 6.698 11.218 19.773 1.00 0.00 C ATOM 1581 OD1 ASN A 102 7.001 11.696 18.692 1.00 0.00 O ATOM 1582 ND2 ASN A 102 6.903 11.825 20.938 1.00 0.00 N ATOM 0 H ASN A 102 5.923 7.081 19.266 1.00 0.00 H new ATOM 0 HA ASN A 102 8.031 9.136 19.493 1.00 0.00 H new ATOM 0 HB2 ASN A 102 5.318 9.708 19.090 1.00 0.00 H new ATOM 0 HB3 ASN A 102 5.484 9.784 20.833 1.00 0.00 H new ATOM 0 HD21 ASN A 102 7.338 12.747 20.963 1.00 0.00 H new ATOM 0 HD22 ASN A 102 6.625 11.368 21.807 1.00 0.00 H new ATOM 1589 N LYS A 103 7.981 8.853 22.079 1.00 0.00 N ATOM 1590 CA LYS A 103 8.202 8.420 23.448 1.00 0.00 C ATOM 1591 C LYS A 103 7.461 9.359 24.401 1.00 0.00 C ATOM 1592 O LYS A 103 7.707 10.564 24.407 1.00 0.00 O ATOM 1593 CB LYS A 103 9.700 8.305 23.738 1.00 0.00 C ATOM 1594 CG LYS A 103 10.230 6.924 23.347 1.00 0.00 C ATOM 1595 CD LYS A 103 11.059 6.315 24.479 1.00 0.00 C ATOM 1596 CE LYS A 103 10.469 4.978 24.932 1.00 0.00 C ATOM 1597 NZ LYS A 103 10.520 4.862 26.407 1.00 0.00 N ATOM 0 H LYS A 103 8.449 9.723 21.826 1.00 0.00 H new ATOM 0 HA LYS A 103 7.793 7.421 23.603 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.241 9.075 23.188 1.00 0.00 H new ATOM 0 HB3 LYS A 103 9.884 8.482 24.798 1.00 0.00 H new ATOM 0 HG2 LYS A 103 9.396 6.265 23.107 1.00 0.00 H new ATOM 0 HG3 LYS A 103 10.840 7.006 22.448 1.00 0.00 H new ATOM 0 HD2 LYS A 103 12.086 6.169 24.144 1.00 0.00 H new ATOM 0 HD3 LYS A 103 11.093 7.006 25.322 1.00 0.00 H new ATOM 0 HE2 LYS A 103 9.437 4.895 24.590 1.00 0.00 H new ATOM 0 HE3 LYS A 103 11.023 4.157 24.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 10.116 3.949 26.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 11.508 4.920 26.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 9.972 5.635 26.835 1.00 0.00 H new ATOM 1611 N VAL A 104 6.568 8.771 25.184 1.00 0.00 N ATOM 1612 CA VAL A 104 5.789 9.541 26.140 1.00 0.00 C ATOM 1613 C VAL A 104 5.030 8.583 27.061 1.00 0.00 C ATOM 1614 O VAL A 104 4.540 7.547 26.617 1.00 0.00 O ATOM 1615 CB VAL A 104 4.869 10.515 25.401 1.00 0.00 C ATOM 1616 CG1 VAL A 104 3.990 9.778 24.389 1.00 0.00 C ATOM 1617 CG2 VAL A 104 4.017 11.317 26.386 1.00 0.00 C ATOM 0 H VAL A 104 6.367 7.771 25.176 1.00 0.00 H new ATOM 0 HA VAL A 104 6.443 10.146 26.768 1.00 0.00 H new ATOM 0 HB VAL A 104 5.496 11.217 24.851 1.00 0.00 H new ATOM 0 HG11 VAL A 104 3.346 10.493 23.878 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.622 9.272 23.659 1.00 0.00 H new ATOM 0 HG13 VAL A 104 3.375 9.043 24.908 1.00 0.00 H new ATOM 0 HG21 VAL A 104 3.372 12.002 25.835 1.00 0.00 H new ATOM 0 HG22 VAL A 104 3.404 10.635 26.975 1.00 0.00 H new ATOM 0 HG23 VAL A 104 4.667 11.886 27.050 1.00 0.00 H new ATOM 1627 N PRO A 105 4.955 8.975 28.361 1.00 0.00 N ATOM 1628 CA PRO A 105 4.265 8.164 29.349 1.00 0.00 C ATOM 1629 C PRO A 105 2.747 8.281 29.190 1.00 0.00 C ATOM 1630 O PRO A 105 2.160 9.305 29.537 1.00 0.00 O ATOM 1631 CB PRO A 105 4.762 8.671 30.693 1.00 0.00 C ATOM 1632 CG PRO A 105 5.353 10.047 30.426 1.00 0.00 C ATOM 1633 CD PRO A 105 5.524 10.197 28.923 1.00 0.00 C ATOM 0 HA PRO A 105 4.473 7.100 29.239 1.00 0.00 H new ATOM 0 HB2 PRO A 105 3.947 8.729 31.414 1.00 0.00 H new ATOM 0 HB3 PRO A 105 5.511 7.999 31.112 1.00 0.00 H new ATOM 0 HG2 PRO A 105 4.698 10.826 30.815 1.00 0.00 H new ATOM 0 HG3 PRO A 105 6.312 10.155 30.932 1.00 0.00 H new ATOM 0 HD2 PRO A 105 5.007 11.082 28.552 1.00 0.00 H new ATOM 0 HD3 PRO A 105 6.574 10.305 28.653 1.00 0.00 H new ATOM 1641 N THR A 106 2.156 7.217 28.667 1.00 0.00 N ATOM 1642 CA THR A 106 0.718 7.188 28.458 1.00 0.00 C ATOM 1643 C THR A 106 -0.002 6.822 29.757 1.00 0.00 C ATOM 1644 O THR A 106 0.604 6.266 30.672 1.00 0.00 O ATOM 1645 CB THR A 106 0.427 6.221 27.309 1.00 0.00 C ATOM 1646 OG1 THR A 106 -0.959 6.411 27.037 1.00 0.00 O ATOM 1647 CG2 THR A 106 0.525 4.755 27.738 1.00 0.00 C ATOM 0 H THR A 106 2.646 6.369 28.382 1.00 0.00 H new ATOM 0 HA THR A 106 0.339 8.171 28.179 1.00 0.00 H new ATOM 0 HB THR A 106 1.125 6.408 26.493 1.00 0.00 H new ATOM 0 HG1 THR A 106 -1.232 5.823 26.302 1.00 0.00 H new ATOM 0 HG21 THR A 106 0.309 4.111 26.885 1.00 0.00 H new ATOM 0 HG22 THR A 106 1.531 4.549 28.103 1.00 0.00 H new ATOM 0 HG23 THR A 106 -0.196 4.559 28.532 1.00 0.00 H new ATOM 1655 N LYS A 107 -1.285 7.149 29.797 1.00 0.00 N ATOM 1656 CA LYS A 107 -2.095 6.862 30.970 1.00 0.00 C ATOM 1657 C LYS A 107 -3.575 6.915 30.587 1.00 0.00 C ATOM 1658 O LYS A 107 -4.128 7.994 30.381 1.00 0.00 O ATOM 1659 CB LYS A 107 -1.722 7.799 32.120 1.00 0.00 C ATOM 1660 CG LYS A 107 -1.553 7.022 33.427 1.00 0.00 C ATOM 1661 CD LYS A 107 -1.817 7.920 34.637 1.00 0.00 C ATOM 1662 CE LYS A 107 -1.276 7.285 35.920 1.00 0.00 C ATOM 1663 NZ LYS A 107 -0.314 8.193 36.582 1.00 0.00 N ATOM 0 H LYS A 107 -1.784 7.610 29.036 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.896 5.854 31.334 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -0.796 8.323 31.882 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.495 8.558 32.241 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.239 6.175 33.442 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.543 6.616 33.485 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -1.348 8.892 34.482 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.888 8.095 34.737 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -2.100 7.062 36.598 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.790 6.338 35.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.043 7.747 37.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.481 8.385 35.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -0.789 9.087 36.822 1.00 0.00 H new ATOM 1677 N THR A 108 -4.175 5.736 30.505 1.00 0.00 N ATOM 1678 CA THR A 108 -5.580 5.635 30.151 1.00 0.00 C ATOM 1679 C THR A 108 -6.237 4.475 30.902 1.00 0.00 C ATOM 1680 O THR A 108 -5.640 3.410 31.052 1.00 0.00 O ATOM 1681 CB THR A 108 -5.677 5.506 28.630 1.00 0.00 C ATOM 1682 OG1 THR A 108 -5.219 6.765 28.145 1.00 0.00 O ATOM 1683 CG2 THR A 108 -7.124 5.423 28.140 1.00 0.00 C ATOM 0 H THR A 108 -3.713 4.843 30.678 1.00 0.00 H new ATOM 0 HA THR A 108 -6.128 6.528 30.451 1.00 0.00 H new ATOM 0 HB THR A 108 -5.133 4.619 28.306 1.00 0.00 H new ATOM 0 HG1 THR A 108 -5.247 6.768 27.165 1.00 0.00 H new ATOM 0 HG21 THR A 108 -7.136 5.333 27.054 1.00 0.00 H new ATOM 0 HG22 THR A 108 -7.608 4.552 28.582 1.00 0.00 H new ATOM 0 HG23 THR A 108 -7.660 6.325 28.435 1.00 0.00 H new ATOM 1691 N SER A 109 -7.458 4.721 31.355 1.00 0.00 N ATOM 1692 CA SER A 109 -8.202 3.710 32.086 1.00 0.00 C ATOM 1693 C SER A 109 -9.639 3.638 31.565 1.00 0.00 C ATOM 1694 O SER A 109 -10.092 2.582 31.127 1.00 0.00 O ATOM 1695 CB SER A 109 -8.197 4.001 33.588 1.00 0.00 C ATOM 1696 OG SER A 109 -8.726 2.916 34.345 1.00 0.00 O ATOM 0 H SER A 109 -7.950 5.606 31.230 1.00 0.00 H new ATOM 0 HA SER A 109 -7.716 2.747 31.928 1.00 0.00 H new ATOM 0 HB2 SER A 109 -7.177 4.207 33.914 1.00 0.00 H new ATOM 0 HB3 SER A 109 -8.782 4.899 33.785 1.00 0.00 H new ATOM 0 HG SER A 109 -8.704 3.141 35.299 1.00 0.00 H new ATOM 1702 N TRP A 110 -10.315 4.775 31.629 1.00 0.00 N ATOM 1703 CA TRP A 110 -11.691 4.855 31.169 1.00 0.00 C ATOM 1704 C TRP A 110 -11.710 4.528 29.675 1.00 0.00 C ATOM 1705 O TRP A 110 -10.922 5.077 28.906 1.00 0.00 O ATOM 1706 CB TRP A 110 -12.299 6.222 31.489 1.00 0.00 C ATOM 1707 CG TRP A 110 -12.793 6.362 32.931 1.00 0.00 C ATOM 1708 CD1 TRP A 110 -12.062 6.401 34.053 1.00 0.00 C ATOM 1709 CD2 TRP A 110 -14.165 6.479 33.361 1.00 0.00 C ATOM 1710 NE1 TRP A 110 -12.860 6.535 35.171 1.00 0.00 N ATOM 1711 CE2 TRP A 110 -14.180 6.584 34.737 1.00 0.00 C ATOM 1712 CE3 TRP A 110 -15.355 6.496 32.613 1.00 0.00 C ATOM 1713 CZ2 TRP A 110 -15.357 6.713 35.484 1.00 0.00 C ATOM 1714 CZ3 TRP A 110 -16.523 6.626 33.374 1.00 0.00 C ATOM 1715 CH2 TRP A 110 -16.554 6.732 34.760 1.00 0.00 C ATOM 0 H TRP A 110 -9.936 5.649 31.993 1.00 0.00 H new ATOM 0 HA TRP A 110 -12.314 4.130 31.692 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -11.554 6.994 31.294 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -13.133 6.405 30.811 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -10.984 6.336 34.079 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -12.540 6.588 36.138 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -15.367 6.415 31.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -15.342 6.793 36.561 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -17.466 6.645 32.848 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -17.498 6.829 35.276 1.00 0.00 H new ATOM 1726 N ASP A 111 -12.617 3.634 29.308 1.00 0.00 N ATOM 1727 CA ASP A 111 -12.749 3.228 27.920 1.00 0.00 C ATOM 1728 C ASP A 111 -13.961 3.926 27.301 1.00 0.00 C ATOM 1729 O ASP A 111 -15.046 3.923 27.880 1.00 0.00 O ATOM 1730 CB ASP A 111 -12.964 1.717 27.806 1.00 0.00 C ATOM 1731 CG ASP A 111 -13.909 1.118 28.850 1.00 0.00 C ATOM 1732 OD1 ASP A 111 -13.595 1.266 30.051 1.00 0.00 O ATOM 1733 OD2 ASP A 111 -14.924 0.527 28.423 1.00 0.00 O ATOM 0 H ASP A 111 -13.268 3.180 29.949 1.00 0.00 H new ATOM 0 HA ASP A 111 -11.831 3.502 27.400 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -13.356 1.495 26.813 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -11.997 1.220 27.886 1.00 0.00 H new ATOM 1738 N PRO A 112 -13.730 4.523 26.101 1.00 0.00 N ATOM 1739 CA PRO A 112 -14.791 5.224 25.397 1.00 0.00 C ATOM 1740 C PRO A 112 -15.769 4.237 24.756 1.00 0.00 C ATOM 1741 O PRO A 112 -15.370 3.160 24.316 1.00 0.00 O ATOM 1742 CB PRO A 112 -14.077 6.098 24.379 1.00 0.00 C ATOM 1743 CG PRO A 112 -12.682 5.512 24.233 1.00 0.00 C ATOM 1744 CD PRO A 112 -12.458 4.547 25.385 1.00 0.00 C ATOM 0 HA PRO A 112 -15.407 5.831 26.061 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -14.604 6.096 23.425 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -14.032 7.134 24.716 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -12.583 4.996 23.278 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -11.932 6.303 24.247 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -12.188 3.555 25.024 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -11.646 4.883 26.031 1.00 0.00 H new ATOM 1752 N GLY A 113 -17.031 4.640 24.725 1.00 0.00 N ATOM 1753 CA GLY A 113 -18.069 3.804 24.145 1.00 0.00 C ATOM 1754 C GLY A 113 -17.659 3.302 22.759 1.00 0.00 C ATOM 1755 O GLY A 113 -16.917 3.976 22.045 1.00 0.00 O ATOM 0 H GLY A 113 -17.358 5.534 25.092 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -18.265 2.955 24.800 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -18.997 4.370 24.071 1.00 0.00 H new ATOM 1759 N PHE A 114 -18.159 2.123 22.420 1.00 0.00 N ATOM 1760 CA PHE A 114 -17.854 1.523 21.132 1.00 0.00 C ATOM 1761 C PHE A 114 -18.829 2.008 20.057 1.00 0.00 C ATOM 1762 O PHE A 114 -19.987 2.300 20.350 1.00 0.00 O ATOM 1763 CB PHE A 114 -18.005 0.010 21.297 1.00 0.00 C ATOM 1764 CG PHE A 114 -16.683 -0.758 21.241 1.00 0.00 C ATOM 1765 CD1 PHE A 114 -15.981 -0.818 20.078 1.00 0.00 C ATOM 1766 CD2 PHE A 114 -16.210 -1.380 22.354 1.00 0.00 C ATOM 1767 CE1 PHE A 114 -14.754 -1.531 20.025 1.00 0.00 C ATOM 1768 CE2 PHE A 114 -14.983 -2.092 22.302 1.00 0.00 C ATOM 1769 CZ PHE A 114 -14.280 -2.152 21.139 1.00 0.00 C ATOM 0 H PHE A 114 -18.773 1.567 23.015 1.00 0.00 H new ATOM 0 HA PHE A 114 -16.846 1.799 20.821 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -18.492 -0.194 22.251 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -18.665 -0.366 20.515 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -16.357 -0.323 19.194 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -16.768 -1.332 23.278 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -14.197 -1.580 19.101 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -14.608 -2.586 23.186 1.00 0.00 H new ATOM 0 HZ PHE A 114 -13.346 -2.692 21.100 1.00 0.00 H new ATOM 1779 N SER A 115 -18.324 2.078 18.834 1.00 0.00 N ATOM 1780 CA SER A 115 -19.135 2.522 17.714 1.00 0.00 C ATOM 1781 C SER A 115 -18.313 2.484 16.424 1.00 0.00 C ATOM 1782 O SER A 115 -17.151 2.887 16.413 1.00 0.00 O ATOM 1783 CB SER A 115 -19.682 3.931 17.954 1.00 0.00 C ATOM 1784 OG SER A 115 -20.832 4.200 17.157 1.00 0.00 O ATOM 0 H SER A 115 -17.363 1.834 18.595 1.00 0.00 H new ATOM 0 HA SER A 115 -19.983 1.844 17.616 1.00 0.00 H new ATOM 0 HB2 SER A 115 -19.936 4.047 19.008 1.00 0.00 H new ATOM 0 HB3 SER A 115 -18.907 4.664 17.731 1.00 0.00 H new ATOM 0 HG SER A 115 -21.152 5.108 17.340 1.00 0.00 H new ATOM 1790 N GLY A 116 -18.948 1.996 15.369 1.00 0.00 N ATOM 1791 CA GLY A 116 -18.290 1.900 14.077 1.00 0.00 C ATOM 1792 C GLY A 116 -18.988 0.876 13.180 1.00 0.00 C ATOM 1793 O GLY A 116 -19.916 0.195 13.615 1.00 0.00 O ATOM 0 H GLY A 116 -19.912 1.663 15.382 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -18.292 2.876 13.591 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -17.247 1.615 14.216 1.00 0.00 H new ATOM 1797 N PRO A 117 -18.504 0.797 11.912 1.00 0.00 N ATOM 1798 CA PRO A 117 -19.072 -0.132 10.950 1.00 0.00 C ATOM 1799 C PRO A 117 -18.628 -1.566 11.246 1.00 0.00 C ATOM 1800 O PRO A 117 -19.449 -2.482 11.264 1.00 0.00 O ATOM 1801 CB PRO A 117 -18.600 0.368 9.595 1.00 0.00 C ATOM 1802 CG PRO A 117 -17.413 1.276 9.875 1.00 0.00 C ATOM 1803 CD PRO A 117 -17.406 1.588 11.362 1.00 0.00 C ATOM 0 HA PRO A 117 -20.161 -0.166 10.990 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -18.312 -0.463 8.951 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -19.394 0.910 9.081 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -16.483 0.789 9.583 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -17.489 2.194 9.293 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -16.455 1.316 11.819 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -17.555 2.652 11.544 1.00 0.00 H new ATOM 1811 N SER A 118 -17.331 -1.716 11.470 1.00 0.00 N ATOM 1812 CA SER A 118 -16.768 -3.023 11.764 1.00 0.00 C ATOM 1813 C SER A 118 -16.886 -3.931 10.538 1.00 0.00 C ATOM 1814 O SER A 118 -15.885 -4.243 9.894 1.00 0.00 O ATOM 1815 CB SER A 118 -17.463 -3.664 12.967 1.00 0.00 C ATOM 1816 OG SER A 118 -17.333 -2.870 14.144 1.00 0.00 O ATOM 0 H SER A 118 -16.653 -0.954 11.454 1.00 0.00 H new ATOM 0 HA SER A 118 -15.715 -2.894 12.013 1.00 0.00 H new ATOM 0 HB2 SER A 118 -18.520 -3.807 12.741 1.00 0.00 H new ATOM 0 HB3 SER A 118 -17.039 -4.652 13.147 1.00 0.00 H new ATOM 0 HG SER A 118 -17.791 -3.312 14.889 1.00 0.00 H new ATOM 1822 N SER A 119 -18.117 -4.330 10.252 1.00 0.00 N ATOM 1823 CA SER A 119 -18.378 -5.195 9.115 1.00 0.00 C ATOM 1824 C SER A 119 -17.724 -6.561 9.336 1.00 0.00 C ATOM 1825 O SER A 119 -16.817 -6.693 10.156 1.00 0.00 O ATOM 1826 CB SER A 119 -17.869 -4.567 7.816 1.00 0.00 C ATOM 1827 OG SER A 119 -18.131 -5.393 6.685 1.00 0.00 O ATOM 0 H SER A 119 -18.944 -4.070 10.789 1.00 0.00 H new ATOM 0 HA SER A 119 -19.456 -5.325 9.025 1.00 0.00 H new ATOM 0 HB2 SER A 119 -18.343 -3.596 7.673 1.00 0.00 H new ATOM 0 HB3 SER A 119 -16.796 -4.390 7.895 1.00 0.00 H new ATOM 0 HG SER A 119 -17.793 -4.956 5.876 1.00 0.00 H new ATOM 1833 N GLY A 120 -18.210 -7.542 8.589 1.00 0.00 N ATOM 1834 CA GLY A 120 -17.684 -8.892 8.693 1.00 0.00 C ATOM 1835 C GLY A 120 -18.816 -9.921 8.722 1.00 0.00 C ATOM 1836 O GLY A 120 -18.565 -11.123 8.798 1.00 0.00 O ATOM 0 H GLY A 120 -18.962 -7.428 7.910 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -17.025 -9.095 7.849 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -17.082 -8.983 9.597 1.00 0.00 H new TER 1840 GLY A 120