USER MOD reduce.3.24.130724 H: found=0, std=0, add=1322, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1322 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 41 THR OG1 : rot -50:sc= 1.19 USER MOD Set 1.2: A 143 THR OG1 : rot -50:sc= 0.491 USER MOD Set 2.1: A 133 THR OG1 : rot 79:sc= 0.632 USER MOD Set 2.2: A 134 ASN : amide:sc= 0.314 K(o=0.95,f=-2.9!) USER MOD Set 3.1: A 34 MET CE :methyl 146:sc= -0.478 (180deg=-2.88!) USER MOD Set 3.2: A 113 TYR OH : rot 40:sc= 0.771 USER MOD Set 4.1: A 89 CYS SG : rot 180:sc= -1.55 USER MOD Set 4.2: A 93 THR OG1 : rot 74:sc= 0.962 USER MOD Set 5.1: A 85 GLN : amide:sc= 0.208 K(o=1.5,f=-6.4!) USER MOD Set 5.2: A 118 LYS NZ :NH3+ 125:sc= 1.28 (180deg=0) USER MOD Set 6.1: A 83 TYR OH : rot -96:sc= -0.64 USER MOD Set 6.2: A 92 GLN : amide:sc= -5.25! C(o=-5.9!,f=-6.6!) USER MOD Set 7.1: A 24 CYS SG : rot -172:sc= 0.906 USER MOD Set 7.2: A 80 SER OG : rot -139:sc= 2 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -153:sc= 0.149 (180deg=-0.633!) USER MOD Single : A 4 THR OG1 : rot 55:sc= -0.155 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HE2:sc= 0.486 K(o=0.49,f=-3.1!) USER MOD Single : A 13 MET CE :methyl 163:sc= -0.358 (180deg=-0.612) USER MOD Single : A 22 CYS SG : rot 60:sc= -0.787 USER MOD Single : A 23 TYR OH : rot 110:sc= -0.289 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 32 GLN : amide:sc= -0.0572 K(o=-0.057,f=-0.6) USER MOD Single : A 37 GLN : amide:sc= 0.719 K(o=0.72,f=-0.66) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 42 ASN : amide:sc= 0.0737 K(o=0.074,f=-5.3!) USER MOD Single : A 43 TYR OH : rot 30:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot 67:sc= -1.81! USER MOD Single : A 50 SER OG : rot -77:sc= 0.827 USER MOD Single : A 58 THR OG1 : rot -75:sc= 0.402 USER MOD Single : A 59 CYS SG : rot -49:sc= 0.872 USER MOD Single : A 62 SER OG : rot -67:sc= 0.142 USER MOD Single : A 65 SER OG : rot 180:sc= -0.0625 USER MOD Single : A 70 LYS NZ :NH3+ 178:sc= 0.77 (180deg=0.757) USER MOD Single : A 72 CYS SG : rot -26:sc= -1.47! USER MOD Single : A 75 MET CE :methyl 175:sc= -0.0365 (180deg=-0.0717) USER MOD Single : A 86 SER OG : rot -143:sc= 0.366 USER MOD Single : A 87 LYS NZ :NH3+ 171:sc=-0.00512 (180deg=-0.104) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 75:sc= 0.441 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 HIS : +bothHN:sc= -1 K(o=-1,f=-5.4!) USER MOD Single : A 105 GLN : amide:sc= -1.25 X(o=-1.2,f=-1.4) USER MOD Single : A 106 LYS NZ :NH3+ 167:sc= -0.0258 (180deg=-0.194) USER MOD Single : A 112 LYS NZ :NH3+ -161:sc= 2.32 (180deg=0.525) USER MOD Single : A 114 LYS NZ :NH3+ -161:sc= 1.35 (180deg=0.676) USER MOD Single : A 116 MET CE :methyl -174:sc= -2.5! (180deg=-2.56) USER MOD Single : A 117 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0204) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 CYS SG : rot 180:sc= 0 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 THR OG1 : rot -69:sc= -0.0104 USER MOD Single : A 138 LYS NZ :NH3+ -173:sc=-0.00626 (180deg=-0.0823) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0424) USER MOD Single : A 150 SER OG : rot -32:sc= 0.315 USER MOD Single : A 155 HIS : no HD1:sc=-0.00381 X(o=-0.0038,f=0) USER MOD Single : A 156 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 157 HIS : no HE2:sc= -0.0162 X(o=-0.016,f=-0.4) USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 159 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 160 HIS : no HD1:sc= -0.135 K(o=-0.13,f=-0.76) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.158 8.857 24.499 1.00 0.00 N ATOM 2 CA MET A 1 11.511 8.087 23.402 1.00 0.00 C ATOM 3 C MET A 1 11.762 8.742 22.036 1.00 0.00 C ATOM 4 O MET A 1 11.826 9.967 21.930 1.00 0.00 O ATOM 5 CB MET A 1 10.001 7.955 23.657 1.00 0.00 C ATOM 6 CG MET A 1 9.269 9.285 23.778 1.00 0.00 C ATOM 7 SD MET A 1 9.885 10.287 25.145 1.00 0.00 S ATOM 8 CE MET A 1 8.839 11.737 25.010 1.00 0.00 C ATOM 0 H1 MET A 1 12.377 8.218 25.289 1.00 0.00 H new ATOM 0 H2 MET A 1 13.037 9.289 24.149 1.00 0.00 H new ATOM 0 H3 MET A 1 11.512 9.604 24.827 1.00 0.00 H new ATOM 0 HA MET A 1 11.956 7.092 23.386 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.556 7.381 22.845 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.847 7.384 24.573 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.375 9.841 22.847 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.204 9.099 23.918 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.102 12.450 25.792 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.983 12.200 24.034 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.795 11.444 25.123 1.00 0.00 H new ATOM 20 N GLY A 2 11.902 7.918 20.997 1.00 0.00 N ATOM 21 CA GLY A 2 12.119 8.433 19.647 1.00 0.00 C ATOM 22 C GLY A 2 13.560 8.864 19.394 1.00 0.00 C ATOM 23 O GLY A 2 13.847 10.055 19.237 1.00 0.00 O ATOM 0 H GLY A 2 11.869 6.901 21.064 1.00 0.00 H new ATOM 0 HA2 GLY A 2 11.844 7.666 18.924 1.00 0.00 H new ATOM 0 HA3 GLY A 2 11.457 9.283 19.478 1.00 0.00 H new ATOM 27 N ILE A 3 14.473 7.895 19.358 1.00 0.00 N ATOM 28 CA ILE A 3 15.894 8.173 19.122 1.00 0.00 C ATOM 29 C ILE A 3 16.255 7.922 17.651 1.00 0.00 C ATOM 30 O ILE A 3 16.491 6.781 17.236 1.00 0.00 O ATOM 31 CB ILE A 3 16.827 7.320 20.033 1.00 0.00 C ATOM 32 CG1 ILE A 3 16.581 7.615 21.528 1.00 0.00 C ATOM 33 CG2 ILE A 3 18.298 7.566 19.683 1.00 0.00 C ATOM 34 CD1 ILE A 3 15.274 7.071 22.069 1.00 0.00 C ATOM 0 H ILE A 3 14.256 6.907 19.489 1.00 0.00 H new ATOM 0 HA ILE A 3 16.051 9.223 19.370 1.00 0.00 H new ATOM 0 HB ILE A 3 16.591 6.271 19.852 1.00 0.00 H new ATOM 0 HG12 ILE A 3 17.403 7.195 22.108 1.00 0.00 H new ATOM 0 HG13 ILE A 3 16.602 8.694 21.681 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.932 6.961 20.331 1.00 0.00 H new ATOM 0 HG22 ILE A 3 18.475 7.292 18.643 1.00 0.00 H new ATOM 0 HG23 ILE A 3 18.535 8.620 19.826 1.00 0.00 H new ATOM 0 HD11 ILE A 3 15.184 7.324 23.125 1.00 0.00 H new ATOM 0 HD12 ILE A 3 14.442 7.510 21.519 1.00 0.00 H new ATOM 0 HD13 ILE A 3 15.255 5.987 21.953 1.00 0.00 H new ATOM 46 N THR A 4 16.268 8.989 16.864 1.00 0.00 N ATOM 47 CA THR A 4 16.623 8.906 15.439 1.00 0.00 C ATOM 48 C THR A 4 17.612 10.011 15.047 1.00 0.00 C ATOM 49 O THR A 4 18.038 10.805 15.888 1.00 0.00 O ATOM 50 CB THR A 4 15.369 8.997 14.534 1.00 0.00 C ATOM 51 OG1 THR A 4 15.746 8.884 13.154 1.00 0.00 O ATOM 52 CG2 THR A 4 14.616 10.307 14.758 1.00 0.00 C ATOM 0 H THR A 4 16.037 9.930 17.183 1.00 0.00 H new ATOM 0 HA THR A 4 17.095 7.935 15.289 1.00 0.00 H new ATOM 0 HB THR A 4 14.706 8.173 14.798 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.259 8.059 13.021 1.00 0.00 H new ATOM 0 HG21 THR A 4 13.742 10.340 14.108 1.00 0.00 H new ATOM 0 HG22 THR A 4 14.297 10.370 15.798 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.271 11.147 14.527 1.00 0.00 H new ATOM 60 N THR A 5 17.987 10.056 13.772 1.00 0.00 N ATOM 61 CA THR A 5 18.939 11.058 13.276 1.00 0.00 C ATOM 62 C THR A 5 18.224 12.161 12.481 1.00 0.00 C ATOM 63 O THR A 5 17.532 11.884 11.499 1.00 0.00 O ATOM 64 CB THR A 5 20.023 10.411 12.377 1.00 0.00 C ATOM 65 OG1 THR A 5 20.676 9.337 13.079 1.00 0.00 O ATOM 66 CG2 THR A 5 21.067 11.436 11.940 1.00 0.00 C ATOM 0 H THR A 5 17.648 9.411 13.058 1.00 0.00 H new ATOM 0 HA THR A 5 19.416 11.498 14.152 1.00 0.00 H new ATOM 0 HB THR A 5 19.525 10.021 11.489 1.00 0.00 H new ATOM 0 HG1 THR A 5 21.357 8.935 12.501 1.00 0.00 H new ATOM 0 HG21 THR A 5 21.813 10.950 11.311 1.00 0.00 H new ATOM 0 HG22 THR A 5 20.581 12.233 11.377 1.00 0.00 H new ATOM 0 HG23 THR A 5 21.553 11.858 12.820 1.00 0.00 H new ATOM 74 N LEU A 6 18.396 13.409 12.913 1.00 0.00 N ATOM 75 CA LEU A 6 17.789 14.562 12.237 1.00 0.00 C ATOM 76 C LEU A 6 18.544 14.875 10.931 1.00 0.00 C ATOM 77 O LEU A 6 19.630 15.457 10.945 1.00 0.00 O ATOM 78 CB LEU A 6 17.778 15.777 13.194 1.00 0.00 C ATOM 79 CG LEU A 6 16.971 17.016 12.739 1.00 0.00 C ATOM 80 CD1 LEU A 6 16.550 17.853 13.946 1.00 0.00 C ATOM 81 CD2 LEU A 6 17.776 17.881 11.768 1.00 0.00 C ATOM 0 H LEU A 6 18.953 13.652 13.732 1.00 0.00 H new ATOM 0 HA LEU A 6 16.758 14.328 11.971 1.00 0.00 H new ATOM 0 HB2 LEU A 6 17.383 15.449 14.155 1.00 0.00 H new ATOM 0 HB3 LEU A 6 18.810 16.086 13.362 1.00 0.00 H new ATOM 0 HG LEU A 6 16.082 16.656 12.222 1.00 0.00 H new ATOM 0 HD11 LEU A 6 15.983 18.720 13.607 1.00 0.00 H new ATOM 0 HD12 LEU A 6 15.929 17.250 14.608 1.00 0.00 H new ATOM 0 HD13 LEU A 6 17.437 18.187 14.485 1.00 0.00 H new ATOM 0 HD21 LEU A 6 17.180 18.743 11.468 1.00 0.00 H new ATOM 0 HD22 LEU A 6 18.688 18.223 12.256 1.00 0.00 H new ATOM 0 HD23 LEU A 6 18.034 17.294 10.886 1.00 0.00 H new ATOM 93 N ASP A 7 17.971 14.457 9.806 1.00 0.00 N ATOM 94 CA ASP A 7 18.594 14.637 8.488 1.00 0.00 C ATOM 95 C ASP A 7 17.852 15.713 7.669 1.00 0.00 C ATOM 96 O ASP A 7 17.781 15.650 6.440 1.00 0.00 O ATOM 97 CB ASP A 7 18.599 13.289 7.748 1.00 0.00 C ATOM 98 CG ASP A 7 19.391 13.322 6.448 1.00 0.00 C ATOM 99 OD1 ASP A 7 20.621 13.534 6.501 1.00 0.00 O ATOM 100 OD2 ASP A 7 18.797 13.124 5.370 1.00 0.00 O ATOM 0 H ASP A 7 17.067 13.986 9.776 1.00 0.00 H new ATOM 0 HA ASP A 7 19.620 14.980 8.619 1.00 0.00 H new ATOM 0 HB2 ASP A 7 19.018 12.524 8.402 1.00 0.00 H new ATOM 0 HB3 ASP A 7 17.571 12.996 7.533 1.00 0.00 H new ATOM 105 N ASP A 8 17.346 16.735 8.360 1.00 0.00 N ATOM 106 CA ASP A 8 16.543 17.783 7.715 1.00 0.00 C ATOM 107 C ASP A 8 17.237 19.178 7.571 1.00 0.00 C ATOM 108 O ASP A 8 16.562 20.136 7.190 1.00 0.00 O ATOM 109 CB ASP A 8 15.230 17.950 8.490 1.00 0.00 C ATOM 110 CG ASP A 8 14.600 16.616 8.856 1.00 0.00 C ATOM 111 OD1 ASP A 8 13.823 16.071 8.048 1.00 0.00 O ATOM 112 OD2 ASP A 8 14.884 16.104 9.961 1.00 0.00 O ATOM 0 H ASP A 8 17.476 16.862 9.364 1.00 0.00 H new ATOM 0 HA ASP A 8 16.382 17.439 6.693 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.418 18.522 9.399 1.00 0.00 H new ATOM 0 HB3 ASP A 8 14.528 18.528 7.889 1.00 0.00 H new ATOM 117 N PRO A 9 18.563 19.354 7.844 1.00 0.00 N ATOM 118 CA PRO A 9 19.224 20.660 7.638 1.00 0.00 C ATOM 119 C PRO A 9 19.177 21.108 6.168 1.00 0.00 C ATOM 120 O PRO A 9 18.971 22.285 5.869 1.00 0.00 O ATOM 121 CB PRO A 9 20.676 20.416 8.088 1.00 0.00 C ATOM 122 CG PRO A 9 20.852 18.939 8.031 1.00 0.00 C ATOM 123 CD PRO A 9 19.508 18.354 8.363 1.00 0.00 C ATOM 0 HA PRO A 9 18.730 21.457 8.195 1.00 0.00 H new ATOM 0 HB2 PRO A 9 21.383 20.924 7.432 1.00 0.00 H new ATOM 0 HB3 PRO A 9 20.846 20.796 9.095 1.00 0.00 H new ATOM 0 HG2 PRO A 9 21.183 18.622 7.042 1.00 0.00 H new ATOM 0 HG3 PRO A 9 21.609 18.608 8.742 1.00 0.00 H new ATOM 0 HD2 PRO A 9 19.365 17.382 7.890 1.00 0.00 H new ATOM 0 HD3 PRO A 9 19.388 18.207 9.436 1.00 0.00 H new ATOM 131 N LEU A 10 19.374 20.157 5.256 1.00 0.00 N ATOM 132 CA LEU A 10 19.276 20.418 3.814 1.00 0.00 C ATOM 133 C LEU A 10 17.941 19.904 3.260 1.00 0.00 C ATOM 134 O LEU A 10 17.367 20.485 2.338 1.00 0.00 O ATOM 135 CB LEU A 10 20.440 19.741 3.076 1.00 0.00 C ATOM 136 CG LEU A 10 21.842 20.146 3.555 1.00 0.00 C ATOM 137 CD1 LEU A 10 22.920 19.401 2.770 1.00 0.00 C ATOM 138 CD2 LEU A 10 22.032 21.657 3.444 1.00 0.00 C ATOM 0 H LEU A 10 19.604 19.191 5.489 1.00 0.00 H new ATOM 0 HA LEU A 10 19.327 21.495 3.656 1.00 0.00 H new ATOM 0 HB2 LEU A 10 20.336 18.661 3.180 1.00 0.00 H new ATOM 0 HB3 LEU A 10 20.357 19.968 2.013 1.00 0.00 H new ATOM 0 HG LEU A 10 21.939 19.868 4.604 1.00 0.00 H new ATOM 0 HD11 LEU A 10 23.905 19.704 3.127 1.00 0.00 H new ATOM 0 HD12 LEU A 10 22.797 18.327 2.912 1.00 0.00 H new ATOM 0 HD13 LEU A 10 22.829 19.639 1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 10 23.031 21.924 3.788 1.00 0.00 H new ATOM 0 HD22 LEU A 10 21.912 21.963 2.405 1.00 0.00 H new ATOM 0 HD23 LEU A 10 21.289 22.163 4.060 1.00 0.00 H new ATOM 150 N GLY A 11 17.459 18.804 3.831 1.00 0.00 N ATOM 151 CA GLY A 11 16.211 18.198 3.388 1.00 0.00 C ATOM 152 C GLY A 11 16.398 16.768 2.896 1.00 0.00 C ATOM 153 O GLY A 11 15.972 15.820 3.555 1.00 0.00 O ATOM 0 H GLY A 11 17.915 18.315 4.601 1.00 0.00 H new ATOM 0 HA2 GLY A 11 15.496 18.205 4.210 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.782 18.801 2.587 1.00 0.00 H new ATOM 157 N HIS A 12 17.042 16.618 1.734 1.00 0.00 N ATOM 158 CA HIS A 12 17.276 15.300 1.116 1.00 0.00 C ATOM 159 C HIS A 12 15.962 14.577 0.771 1.00 0.00 C ATOM 160 O HIS A 12 15.960 13.367 0.574 1.00 0.00 O ATOM 161 CB HIS A 12 18.134 14.409 2.031 1.00 0.00 C ATOM 162 CG HIS A 12 19.518 14.929 2.277 1.00 0.00 C ATOM 163 ND1 HIS A 12 20.234 14.633 3.414 1.00 0.00 N ATOM 164 CD2 HIS A 12 20.332 15.700 1.517 1.00 0.00 C ATOM 165 CE1 HIS A 12 21.423 15.193 3.346 1.00 0.00 C ATOM 166 NE2 HIS A 12 21.511 15.848 2.206 1.00 0.00 N ATOM 0 H HIS A 12 17.415 17.399 1.195 1.00 0.00 H new ATOM 0 HA HIS A 12 17.812 15.483 0.185 1.00 0.00 H new ATOM 0 HB2 HIS A 12 17.626 14.296 2.988 1.00 0.00 H new ATOM 0 HB3 HIS A 12 18.205 13.416 1.588 1.00 0.00 H new ATOM 0 HD1 HIS A 12 19.895 14.066 4.191 1.00 0.00 H new ATOM 0 HD2 HIS A 12 20.098 16.120 0.550 1.00 0.00 H new ATOM 0 HE1 HIS A 12 22.196 15.127 4.097 1.00 0.00 H new ATOM 175 N MET A 13 14.866 15.335 0.665 1.00 0.00 N ATOM 176 CA MET A 13 13.524 14.777 0.409 1.00 0.00 C ATOM 177 C MET A 13 13.004 13.962 1.616 1.00 0.00 C ATOM 178 O MET A 13 12.848 12.741 1.538 1.00 0.00 O ATOM 179 CB MET A 13 13.519 13.911 -0.869 1.00 0.00 C ATOM 180 CG MET A 13 13.971 14.659 -2.118 1.00 0.00 C ATOM 181 SD MET A 13 13.994 13.615 -3.594 1.00 0.00 S ATOM 182 CE MET A 13 12.265 13.158 -3.726 1.00 0.00 C ATOM 0 H MET A 13 14.878 16.351 0.753 1.00 0.00 H new ATOM 0 HA MET A 13 12.848 15.619 0.259 1.00 0.00 H new ATOM 0 HB2 MET A 13 14.170 13.050 -0.716 1.00 0.00 H new ATOM 0 HB3 MET A 13 12.513 13.525 -1.032 1.00 0.00 H new ATOM 0 HG2 MET A 13 13.306 15.506 -2.289 1.00 0.00 H new ATOM 0 HG3 MET A 13 14.969 15.065 -1.951 1.00 0.00 H new ATOM 0 HE1 MET A 13 12.065 12.778 -4.728 1.00 0.00 H new ATOM 0 HE2 MET A 13 12.036 12.385 -2.992 1.00 0.00 H new ATOM 0 HE3 MET A 13 11.642 14.033 -3.538 1.00 0.00 H new ATOM 192 N PRO A 14 12.719 14.643 2.750 1.00 0.00 N ATOM 193 CA PRO A 14 12.314 13.981 4.006 1.00 0.00 C ATOM 194 C PRO A 14 10.806 13.657 4.108 1.00 0.00 C ATOM 195 O PRO A 14 10.415 12.727 4.816 1.00 0.00 O ATOM 196 CB PRO A 14 12.711 15.021 5.055 1.00 0.00 C ATOM 197 CG PRO A 14 12.496 16.334 4.377 1.00 0.00 C ATOM 198 CD PRO A 14 12.800 16.111 2.912 1.00 0.00 C ATOM 0 HA PRO A 14 12.784 13.003 4.111 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.100 14.933 5.953 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.749 14.898 5.363 1.00 0.00 H new ATOM 0 HG2 PRO A 14 11.471 16.678 4.513 1.00 0.00 H new ATOM 0 HG3 PRO A 14 13.148 17.100 4.797 1.00 0.00 H new ATOM 0 HD2 PRO A 14 12.081 16.624 2.273 1.00 0.00 H new ATOM 0 HD3 PRO A 14 13.788 16.488 2.647 1.00 0.00 H new ATOM 206 N GLU A 15 9.965 14.433 3.424 1.00 0.00 N ATOM 207 CA GLU A 15 8.508 14.220 3.457 1.00 0.00 C ATOM 208 C GLU A 15 7.872 14.549 2.095 1.00 0.00 C ATOM 209 O GLU A 15 6.743 15.038 2.018 1.00 0.00 O ATOM 210 CB GLU A 15 7.868 15.081 4.564 1.00 0.00 C ATOM 211 CG GLU A 15 8.134 16.579 4.422 1.00 0.00 C ATOM 212 CD GLU A 15 7.328 17.422 5.398 1.00 0.00 C ATOM 213 OE1 GLU A 15 6.155 17.728 5.097 1.00 0.00 O ATOM 214 OE2 GLU A 15 7.860 17.788 6.470 1.00 0.00 O ATOM 0 H GLU A 15 10.262 15.215 2.840 1.00 0.00 H new ATOM 0 HA GLU A 15 8.324 13.168 3.674 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.791 14.913 4.563 1.00 0.00 H new ATOM 0 HB3 GLU A 15 8.242 14.747 5.532 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.196 16.770 4.577 1.00 0.00 H new ATOM 0 HG3 GLU A 15 7.900 16.889 3.404 1.00 0.00 H new ATOM 221 N ARG A 16 8.599 14.250 1.020 1.00 0.00 N ATOM 222 CA ARG A 16 8.157 14.587 -0.339 1.00 0.00 C ATOM 223 C ARG A 16 7.022 13.681 -0.840 1.00 0.00 C ATOM 224 O ARG A 16 6.296 14.047 -1.762 1.00 0.00 O ATOM 225 CB ARG A 16 9.343 14.527 -1.313 1.00 0.00 C ATOM 226 CG ARG A 16 10.380 15.632 -1.111 1.00 0.00 C ATOM 227 CD ARG A 16 9.862 17.007 -1.538 1.00 0.00 C ATOM 228 NE ARG A 16 8.753 17.474 -0.709 1.00 0.00 N ATOM 229 CZ ARG A 16 7.703 18.103 -1.165 1.00 0.00 C ATOM 230 NH1 ARG A 16 7.566 18.332 -2.435 1.00 0.00 N ATOM 231 NH2 ARG A 16 6.785 18.490 -0.344 1.00 0.00 N ATOM 0 H ARG A 16 9.500 13.774 1.060 1.00 0.00 H new ATOM 0 HA ARG A 16 7.762 15.602 -0.298 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.835 13.560 -1.209 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.963 14.583 -2.333 1.00 0.00 H new ATOM 0 HG2 ARG A 16 10.669 15.667 -0.061 1.00 0.00 H new ATOM 0 HG3 ARG A 16 11.277 15.392 -1.681 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.677 17.729 -1.488 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.539 16.962 -2.578 1.00 0.00 H new ATOM 0 HE ARG A 16 8.802 17.297 0.294 1.00 0.00 H new ATOM 0 HH11 ARG A 16 8.283 18.020 -3.090 1.00 0.00 H new ATOM 0 HH12 ARG A 16 6.741 18.824 -2.778 1.00 0.00 H new ATOM 0 HH21 ARG A 16 6.882 18.304 0.654 1.00 0.00 H new ATOM 0 HH22 ARG A 16 5.963 18.982 -0.694 1.00 0.00 H new ATOM 245 N PHE A 17 6.873 12.501 -0.246 1.00 0.00 N ATOM 246 CA PHE A 17 5.821 11.562 -0.659 1.00 0.00 C ATOM 247 C PHE A 17 4.922 11.173 0.522 1.00 0.00 C ATOM 248 O PHE A 17 5.407 10.786 1.585 1.00 0.00 O ATOM 249 CB PHE A 17 6.441 10.302 -1.283 1.00 0.00 C ATOM 250 CG PHE A 17 7.187 10.563 -2.570 1.00 0.00 C ATOM 251 CD1 PHE A 17 8.511 10.981 -2.553 1.00 0.00 C ATOM 252 CD2 PHE A 17 6.563 10.394 -3.797 1.00 0.00 C ATOM 253 CE1 PHE A 17 9.191 11.223 -3.730 1.00 0.00 C ATOM 254 CE2 PHE A 17 7.239 10.637 -4.976 1.00 0.00 C ATOM 255 CZ PHE A 17 8.556 11.051 -4.943 1.00 0.00 C ATOM 0 H PHE A 17 7.460 12.168 0.519 1.00 0.00 H new ATOM 0 HA PHE A 17 5.204 12.064 -1.404 1.00 0.00 H new ATOM 0 HB2 PHE A 17 7.124 9.850 -0.564 1.00 0.00 H new ATOM 0 HB3 PHE A 17 5.651 9.575 -1.473 1.00 0.00 H new ATOM 0 HD1 PHE A 17 9.015 11.118 -1.608 1.00 0.00 H new ATOM 0 HD2 PHE A 17 5.534 10.068 -3.831 1.00 0.00 H new ATOM 0 HE1 PHE A 17 10.221 11.547 -3.701 1.00 0.00 H new ATOM 0 HE2 PHE A 17 6.738 10.503 -5.923 1.00 0.00 H new ATOM 0 HZ PHE A 17 9.088 11.240 -5.864 1.00 0.00 H new ATOM 265 N ASP A 18 3.608 11.286 0.332 1.00 0.00 N ATOM 266 CA ASP A 18 2.640 10.853 1.343 1.00 0.00 C ATOM 267 C ASP A 18 2.795 9.354 1.646 1.00 0.00 C ATOM 268 O ASP A 18 2.928 8.947 2.802 1.00 0.00 O ATOM 269 CB ASP A 18 1.214 11.142 0.862 1.00 0.00 C ATOM 270 CG ASP A 18 1.004 12.607 0.524 1.00 0.00 C ATOM 271 OD1 ASP A 18 1.407 13.021 -0.583 1.00 0.00 O ATOM 272 OD2 ASP A 18 0.436 13.344 1.361 1.00 0.00 O ATOM 0 H ASP A 18 3.188 11.674 -0.513 1.00 0.00 H new ATOM 0 HA ASP A 18 2.832 11.411 2.260 1.00 0.00 H new ATOM 0 HB2 ASP A 18 1.000 10.535 -0.017 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.505 10.845 1.635 1.00 0.00 H new ATOM 277 N ALA A 19 2.812 8.540 0.592 1.00 0.00 N ATOM 278 CA ALA A 19 2.872 7.085 0.740 1.00 0.00 C ATOM 279 C ALA A 19 3.569 6.398 -0.445 1.00 0.00 C ATOM 280 O ALA A 19 3.803 7.002 -1.494 1.00 0.00 O ATOM 281 CB ALA A 19 1.463 6.526 0.902 1.00 0.00 C ATOM 0 H ALA A 19 2.785 8.863 -0.375 1.00 0.00 H new ATOM 0 HA ALA A 19 3.466 6.876 1.629 1.00 0.00 H new ATOM 0 HB1 ALA A 19 1.512 5.443 1.012 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.999 6.960 1.788 1.00 0.00 H new ATOM 0 HB3 ALA A 19 0.869 6.775 0.022 1.00 0.00 H new ATOM 287 N PHE A 20 3.913 5.128 -0.255 1.00 0.00 N ATOM 288 CA PHE A 20 4.448 4.288 -1.331 1.00 0.00 C ATOM 289 C PHE A 20 3.522 3.088 -1.580 1.00 0.00 C ATOM 290 O PHE A 20 3.163 2.371 -0.649 1.00 0.00 O ATOM 291 CB PHE A 20 5.858 3.802 -0.974 1.00 0.00 C ATOM 292 CG PHE A 20 6.478 2.918 -2.028 1.00 0.00 C ATOM 293 CD1 PHE A 20 7.146 3.472 -3.111 1.00 0.00 C ATOM 294 CD2 PHE A 20 6.391 1.536 -1.938 1.00 0.00 C ATOM 295 CE1 PHE A 20 7.712 2.667 -4.079 1.00 0.00 C ATOM 296 CE2 PHE A 20 6.957 0.729 -2.903 1.00 0.00 C ATOM 297 CZ PHE A 20 7.619 1.294 -3.974 1.00 0.00 C ATOM 0 H PHE A 20 3.831 4.650 0.643 1.00 0.00 H new ATOM 0 HA PHE A 20 4.503 4.883 -2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.501 4.667 -0.813 1.00 0.00 H new ATOM 0 HB3 PHE A 20 5.817 3.256 -0.032 1.00 0.00 H new ATOM 0 HD1 PHE A 20 7.224 4.546 -3.197 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.874 1.087 -1.103 1.00 0.00 H new ATOM 0 HE1 PHE A 20 8.227 3.111 -4.918 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.882 -0.345 -2.820 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.064 0.663 -4.729 1.00 0.00 H new ATOM 307 N ILE A 21 3.139 2.872 -2.833 1.00 0.00 N ATOM 308 CA ILE A 21 2.215 1.788 -3.183 1.00 0.00 C ATOM 309 C ILE A 21 2.957 0.528 -3.661 1.00 0.00 C ATOM 310 O ILE A 21 3.532 0.504 -4.753 1.00 0.00 O ATOM 311 CB ILE A 21 1.215 2.239 -4.279 1.00 0.00 C ATOM 312 CG1 ILE A 21 0.456 3.499 -3.825 1.00 0.00 C ATOM 313 CG2 ILE A 21 0.239 1.110 -4.620 1.00 0.00 C ATOM 314 CD1 ILE A 21 -0.522 4.040 -4.851 1.00 0.00 C ATOM 0 H ILE A 21 3.451 3.431 -3.627 1.00 0.00 H new ATOM 0 HA ILE A 21 1.669 1.542 -2.273 1.00 0.00 H new ATOM 0 HB ILE A 21 1.777 2.482 -5.181 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.086 3.272 -2.907 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.179 4.278 -3.583 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.453 1.448 -5.391 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.795 0.246 -4.985 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.320 0.831 -3.727 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.014 4.927 -4.452 1.00 0.00 H new ATOM 0 HD12 ILE A 21 0.015 4.302 -5.763 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.270 3.280 -5.076 1.00 0.00 H new ATOM 326 N CYS A 22 2.943 -0.513 -2.831 1.00 0.00 N ATOM 327 CA CYS A 22 3.524 -1.813 -3.194 1.00 0.00 C ATOM 328 C CYS A 22 2.422 -2.796 -3.608 1.00 0.00 C ATOM 329 O CYS A 22 1.578 -3.178 -2.793 1.00 0.00 O ATOM 330 CB CYS A 22 4.319 -2.401 -2.021 1.00 0.00 C ATOM 331 SG CYS A 22 5.103 -3.990 -2.385 1.00 0.00 S ATOM 0 H CYS A 22 2.534 -0.485 -1.897 1.00 0.00 H new ATOM 0 HA CYS A 22 4.199 -1.655 -4.035 1.00 0.00 H new ATOM 0 HB2 CYS A 22 5.088 -1.688 -1.723 1.00 0.00 H new ATOM 0 HB3 CYS A 22 3.651 -2.524 -1.168 1.00 0.00 H new ATOM 0 HG CYS A 22 5.931 -3.848 -3.377 1.00 0.00 H new ATOM 337 N TYR A 23 2.431 -3.201 -4.875 1.00 0.00 N ATOM 338 CA TYR A 23 1.373 -4.060 -5.414 1.00 0.00 C ATOM 339 C TYR A 23 1.931 -5.127 -6.364 1.00 0.00 C ATOM 340 O TYR A 23 3.026 -4.982 -6.916 1.00 0.00 O ATOM 341 CB TYR A 23 0.340 -3.206 -6.161 1.00 0.00 C ATOM 342 CG TYR A 23 0.897 -2.513 -7.394 1.00 0.00 C ATOM 343 CD1 TYR A 23 1.557 -1.292 -7.293 1.00 0.00 C ATOM 344 CD2 TYR A 23 0.770 -3.086 -8.657 1.00 0.00 C ATOM 345 CE1 TYR A 23 2.071 -0.665 -8.412 1.00 0.00 C ATOM 346 CE2 TYR A 23 1.281 -2.464 -9.776 1.00 0.00 C ATOM 347 CZ TYR A 23 1.930 -1.256 -9.648 1.00 0.00 C ATOM 348 OH TYR A 23 2.445 -0.640 -10.763 1.00 0.00 O ATOM 0 H TYR A 23 3.155 -2.951 -5.548 1.00 0.00 H new ATOM 0 HA TYR A 23 0.903 -4.569 -4.573 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.496 -3.840 -6.458 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -0.057 -2.453 -5.480 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.669 -0.827 -6.325 1.00 0.00 H new ATOM 0 HD2 TYR A 23 0.263 -4.034 -8.761 1.00 0.00 H new ATOM 0 HE1 TYR A 23 2.580 0.283 -8.318 1.00 0.00 H new ATOM 0 HE2 TYR A 23 1.173 -2.922 -10.748 1.00 0.00 H new ATOM 0 HH TYR A 23 3.214 -1.150 -11.093 1.00 0.00 H new ATOM 358 N CYS A 24 1.159 -6.194 -6.555 1.00 0.00 N ATOM 359 CA CYS A 24 1.484 -7.235 -7.535 1.00 0.00 C ATOM 360 C CYS A 24 0.845 -6.916 -8.898 1.00 0.00 C ATOM 361 O CYS A 24 -0.342 -6.592 -8.971 1.00 0.00 O ATOM 362 CB CYS A 24 0.997 -8.599 -7.034 1.00 0.00 C ATOM 363 SG CYS A 24 -0.733 -8.612 -6.510 1.00 0.00 S ATOM 0 H CYS A 24 0.295 -6.364 -6.040 1.00 0.00 H new ATOM 0 HA CYS A 24 2.566 -7.266 -7.659 1.00 0.00 H new ATOM 0 HB2 CYS A 24 1.132 -9.335 -7.826 1.00 0.00 H new ATOM 0 HB3 CYS A 24 1.622 -8.912 -6.198 1.00 0.00 H new ATOM 0 HG CYS A 24 -1.007 -9.750 -5.945 1.00 0.00 H new ATOM 369 N PRO A 25 1.622 -7.007 -9.999 1.00 0.00 N ATOM 370 CA PRO A 25 1.138 -6.671 -11.357 1.00 0.00 C ATOM 371 C PRO A 25 -0.171 -7.383 -11.746 1.00 0.00 C ATOM 372 O PRO A 25 -0.934 -6.887 -12.574 1.00 0.00 O ATOM 373 CB PRO A 25 2.290 -7.130 -12.261 1.00 0.00 C ATOM 374 CG PRO A 25 3.500 -7.056 -11.394 1.00 0.00 C ATOM 375 CD PRO A 25 3.035 -7.436 -10.012 1.00 0.00 C ATOM 0 HA PRO A 25 0.894 -5.612 -11.438 1.00 0.00 H new ATOM 0 HB2 PRO A 25 2.127 -8.143 -12.628 1.00 0.00 H new ATOM 0 HB3 PRO A 25 2.389 -6.486 -13.135 1.00 0.00 H new ATOM 0 HG2 PRO A 25 4.276 -7.735 -11.746 1.00 0.00 H new ATOM 0 HG3 PRO A 25 3.926 -6.053 -11.402 1.00 0.00 H new ATOM 0 HD2 PRO A 25 3.132 -8.507 -9.835 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.616 -6.932 -9.239 1.00 0.00 H new ATOM 383 N SER A 26 -0.424 -8.547 -11.150 1.00 0.00 N ATOM 384 CA SER A 26 -1.654 -9.313 -11.422 1.00 0.00 C ATOM 385 C SER A 26 -2.921 -8.507 -11.086 1.00 0.00 C ATOM 386 O SER A 26 -3.939 -8.623 -11.768 1.00 0.00 O ATOM 387 CB SER A 26 -1.653 -10.625 -10.626 1.00 0.00 C ATOM 388 OG SER A 26 -2.795 -11.415 -10.921 1.00 0.00 O ATOM 0 H SER A 26 0.202 -8.986 -10.475 1.00 0.00 H new ATOM 0 HA SER A 26 -1.667 -9.531 -12.490 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.750 -11.190 -10.856 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.628 -10.404 -9.559 1.00 0.00 H new ATOM 0 HG SER A 26 -2.763 -12.244 -10.399 1.00 0.00 H new ATOM 394 N ASP A 27 -2.851 -7.681 -10.044 1.00 0.00 N ATOM 395 CA ASP A 27 -3.995 -6.863 -9.613 1.00 0.00 C ATOM 396 C ASP A 27 -3.853 -5.401 -10.075 1.00 0.00 C ATOM 397 O ASP A 27 -4.438 -4.488 -9.485 1.00 0.00 O ATOM 398 CB ASP A 27 -4.133 -6.936 -8.088 1.00 0.00 C ATOM 399 CG ASP A 27 -4.454 -8.343 -7.617 1.00 0.00 C ATOM 400 OD1 ASP A 27 -3.515 -9.155 -7.471 1.00 0.00 O ATOM 401 OD2 ASP A 27 -5.649 -8.655 -7.420 1.00 0.00 O ATOM 0 H ASP A 27 -2.012 -7.557 -9.477 1.00 0.00 H new ATOM 0 HA ASP A 27 -4.897 -7.263 -10.077 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.206 -6.600 -7.623 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -4.919 -6.255 -7.761 1.00 0.00 H new ATOM 406 N ILE A 28 -3.109 -5.193 -11.165 1.00 0.00 N ATOM 407 CA ILE A 28 -2.864 -3.848 -11.703 1.00 0.00 C ATOM 408 C ILE A 28 -4.181 -3.116 -12.023 1.00 0.00 C ATOM 409 O ILE A 28 -4.276 -1.897 -11.891 1.00 0.00 O ATOM 410 CB ILE A 28 -1.986 -3.914 -12.984 1.00 0.00 C ATOM 411 CG1 ILE A 28 -1.644 -2.506 -13.500 1.00 0.00 C ATOM 412 CG2 ILE A 28 -2.679 -4.729 -14.076 1.00 0.00 C ATOM 413 CD1 ILE A 28 -0.810 -1.687 -12.541 1.00 0.00 C ATOM 0 H ILE A 28 -2.663 -5.941 -11.696 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.335 -3.289 -10.932 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.053 -4.412 -12.719 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -1.109 -2.596 -14.445 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -2.571 -1.971 -13.708 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.046 -4.761 -14.963 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.854 -5.743 -13.717 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.632 -4.264 -14.327 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -0.611 -0.708 -12.977 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.351 -1.563 -11.603 1.00 0.00 H new ATOM 0 HD13 ILE A 28 0.134 -2.198 -12.351 1.00 0.00 H new ATOM 425 N GLN A 29 -5.199 -3.883 -12.415 1.00 0.00 N ATOM 426 CA GLN A 29 -6.501 -3.327 -12.802 1.00 0.00 C ATOM 427 C GLN A 29 -7.108 -2.467 -11.683 1.00 0.00 C ATOM 428 O GLN A 29 -7.613 -1.368 -11.928 1.00 0.00 O ATOM 429 CB GLN A 29 -7.465 -4.467 -13.165 1.00 0.00 C ATOM 430 CG GLN A 29 -6.878 -5.477 -14.147 1.00 0.00 C ATOM 431 CD GLN A 29 -7.893 -6.506 -14.623 1.00 0.00 C ATOM 432 OE1 GLN A 29 -9.084 -6.232 -14.706 1.00 0.00 O ATOM 433 NE2 GLN A 29 -7.430 -7.696 -14.945 1.00 0.00 N ATOM 0 H GLN A 29 -5.148 -4.900 -12.474 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.346 -2.684 -13.668 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.758 -4.988 -12.253 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.372 -4.041 -13.594 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.477 -4.945 -15.010 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.042 -5.992 -13.673 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.433 -7.894 -14.865 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -8.069 -8.420 -15.274 1.00 0.00 H new ATOM 442 N PHE A 30 -7.047 -2.972 -10.453 1.00 0.00 N ATOM 443 CA PHE A 30 -7.587 -2.257 -9.291 1.00 0.00 C ATOM 444 C PHE A 30 -6.668 -1.104 -8.864 1.00 0.00 C ATOM 445 O PHE A 30 -7.139 -0.055 -8.426 1.00 0.00 O ATOM 446 CB PHE A 30 -7.796 -3.224 -8.122 1.00 0.00 C ATOM 447 CG PHE A 30 -8.858 -4.264 -8.381 1.00 0.00 C ATOM 448 CD1 PHE A 30 -10.188 -4.007 -8.076 1.00 0.00 C ATOM 449 CD2 PHE A 30 -8.528 -5.496 -8.927 1.00 0.00 C ATOM 450 CE1 PHE A 30 -11.164 -4.956 -8.311 1.00 0.00 C ATOM 451 CE2 PHE A 30 -9.502 -6.447 -9.164 1.00 0.00 C ATOM 452 CZ PHE A 30 -10.821 -6.177 -8.855 1.00 0.00 C ATOM 0 H PHE A 30 -6.629 -3.875 -10.231 1.00 0.00 H new ATOM 0 HA PHE A 30 -8.548 -1.832 -9.580 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -6.853 -3.726 -7.904 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -8.067 -2.654 -7.233 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -10.463 -3.053 -7.650 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -7.498 -5.714 -9.169 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -12.195 -4.743 -8.069 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -9.232 -7.402 -9.591 1.00 0.00 H new ATOM 0 HZ PHE A 30 -11.583 -6.920 -9.039 1.00 0.00 H new ATOM 462 N VAL A 31 -5.359 -1.305 -8.997 1.00 0.00 N ATOM 463 CA VAL A 31 -4.377 -0.266 -8.661 1.00 0.00 C ATOM 464 C VAL A 31 -4.563 0.981 -9.543 1.00 0.00 C ATOM 465 O VAL A 31 -4.508 2.115 -9.059 1.00 0.00 O ATOM 466 CB VAL A 31 -2.928 -0.796 -8.807 1.00 0.00 C ATOM 467 CG1 VAL A 31 -1.906 0.276 -8.423 1.00 0.00 C ATOM 468 CG2 VAL A 31 -2.735 -2.060 -7.969 1.00 0.00 C ATOM 0 H VAL A 31 -4.950 -2.176 -9.335 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.546 0.012 -7.621 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.763 -1.049 -9.854 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -0.899 -0.125 -8.535 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.026 1.143 -9.073 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.064 0.575 -7.387 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.712 -2.419 -8.083 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.926 -1.834 -6.920 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.429 -2.830 -8.306 1.00 0.00 H new ATOM 478 N GLN A 32 -4.792 0.762 -10.841 1.00 0.00 N ATOM 479 CA GLN A 32 -5.084 1.857 -11.776 1.00 0.00 C ATOM 480 C GLN A 32 -6.311 2.657 -11.317 1.00 0.00 C ATOM 481 O GLN A 32 -6.297 3.891 -11.304 1.00 0.00 O ATOM 482 CB GLN A 32 -5.317 1.302 -13.189 1.00 0.00 C ATOM 483 CG GLN A 32 -4.107 0.567 -13.758 1.00 0.00 C ATOM 484 CD GLN A 32 -4.358 -0.053 -15.119 1.00 0.00 C ATOM 485 OE1 GLN A 32 -5.477 -0.424 -15.458 1.00 0.00 O ATOM 486 NE2 GLN A 32 -3.311 -0.193 -15.904 1.00 0.00 N ATOM 0 H GLN A 32 -4.781 -0.163 -11.270 1.00 0.00 H new ATOM 0 HA GLN A 32 -4.224 2.526 -11.794 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -6.169 0.623 -13.169 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -5.580 2.124 -13.855 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -3.272 1.263 -13.834 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -3.807 -0.216 -13.061 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -2.394 0.126 -15.592 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -3.417 -0.621 -16.824 1.00 0.00 H new ATOM 495 N GLU A 33 -7.366 1.937 -10.936 1.00 0.00 N ATOM 496 CA GLU A 33 -8.581 2.556 -10.395 1.00 0.00 C ATOM 497 C GLU A 33 -8.266 3.356 -9.121 1.00 0.00 C ATOM 498 O GLU A 33 -8.652 4.516 -8.989 1.00 0.00 O ATOM 499 CB GLU A 33 -9.628 1.469 -10.088 1.00 0.00 C ATOM 500 CG GLU A 33 -10.971 2.004 -9.590 1.00 0.00 C ATOM 501 CD GLU A 33 -11.723 2.795 -10.650 1.00 0.00 C ATOM 502 OE1 GLU A 33 -12.448 2.180 -11.458 1.00 0.00 O ATOM 503 OE2 GLU A 33 -11.585 4.033 -10.694 1.00 0.00 O ATOM 0 H GLU A 33 -7.406 0.919 -10.992 1.00 0.00 H new ATOM 0 HA GLU A 33 -8.981 3.243 -11.141 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -9.798 0.881 -10.990 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -9.220 0.792 -9.338 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -11.589 1.169 -9.260 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -10.803 2.639 -8.720 1.00 0.00 H new ATOM 510 N MET A 34 -7.534 2.726 -8.202 1.00 0.00 N ATOM 511 CA MET A 34 -7.180 3.340 -6.917 1.00 0.00 C ATOM 512 C MET A 34 -6.505 4.707 -7.097 1.00 0.00 C ATOM 513 O MET A 34 -6.980 5.716 -6.574 1.00 0.00 O ATOM 514 CB MET A 34 -6.256 2.402 -6.124 1.00 0.00 C ATOM 515 CG MET A 34 -5.800 2.972 -4.784 1.00 0.00 C ATOM 516 SD MET A 34 -4.778 1.822 -3.843 1.00 0.00 S ATOM 517 CE MET A 34 -3.411 1.570 -4.972 1.00 0.00 C ATOM 0 H MET A 34 -7.170 1.781 -8.324 1.00 0.00 H new ATOM 0 HA MET A 34 -8.106 3.500 -6.365 1.00 0.00 H new ATOM 0 HB2 MET A 34 -6.775 1.459 -5.949 1.00 0.00 H new ATOM 0 HB3 MET A 34 -5.378 2.176 -6.729 1.00 0.00 H new ATOM 0 HG2 MET A 34 -5.239 3.890 -4.958 1.00 0.00 H new ATOM 0 HG3 MET A 34 -6.675 3.240 -4.192 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.491 1.431 -4.404 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.599 0.685 -5.580 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.309 2.440 -5.620 1.00 0.00 H new ATOM 527 N ILE A 35 -5.407 4.737 -7.844 1.00 0.00 N ATOM 528 CA ILE A 35 -4.626 5.964 -8.026 1.00 0.00 C ATOM 529 C ILE A 35 -5.472 7.110 -8.612 1.00 0.00 C ATOM 530 O ILE A 35 -5.496 8.213 -8.064 1.00 0.00 O ATOM 531 CB ILE A 35 -3.395 5.715 -8.930 1.00 0.00 C ATOM 532 CG1 ILE A 35 -2.513 4.608 -8.327 1.00 0.00 C ATOM 533 CG2 ILE A 35 -2.595 7.005 -9.117 1.00 0.00 C ATOM 534 CD1 ILE A 35 -1.313 4.250 -9.178 1.00 0.00 C ATOM 0 H ILE A 35 -5.033 3.925 -8.336 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.288 6.264 -7.034 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.741 5.388 -9.911 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -2.167 4.927 -7.344 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.119 3.715 -8.177 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -1.733 6.810 -9.755 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.227 7.761 -9.582 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.253 7.365 -8.147 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.740 3.463 -8.687 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.650 3.899 -10.153 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.683 5.130 -9.307 1.00 0.00 H new ATOM 546 N ARG A 36 -6.181 6.845 -9.710 1.00 0.00 N ATOM 547 CA ARG A 36 -6.995 7.885 -10.354 1.00 0.00 C ATOM 548 C ARG A 36 -8.138 8.357 -9.434 1.00 0.00 C ATOM 549 O ARG A 36 -8.577 9.506 -9.514 1.00 0.00 O ATOM 550 CB ARG A 36 -7.541 7.400 -11.705 1.00 0.00 C ATOM 551 CG ARG A 36 -8.521 6.238 -11.616 1.00 0.00 C ATOM 552 CD ARG A 36 -8.953 5.768 -13.000 1.00 0.00 C ATOM 553 NE ARG A 36 -9.939 4.695 -12.937 1.00 0.00 N ATOM 554 CZ ARG A 36 -10.299 3.969 -13.961 1.00 0.00 C ATOM 555 NH1 ARG A 36 -9.748 4.146 -15.120 1.00 0.00 N ATOM 556 NH2 ARG A 36 -11.206 3.059 -13.823 1.00 0.00 N ATOM 0 H ARG A 36 -6.211 5.935 -10.169 1.00 0.00 H new ATOM 0 HA ARG A 36 -6.347 8.741 -10.540 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -8.033 8.235 -12.203 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.702 7.103 -12.335 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -8.059 5.411 -11.077 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.397 6.542 -11.043 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -9.370 6.609 -13.553 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -8.079 5.424 -13.554 1.00 0.00 H new ATOM 0 HE ARG A 36 -10.375 4.499 -12.036 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -9.026 4.857 -15.238 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -10.036 3.574 -15.914 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -11.642 2.907 -12.913 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -11.486 2.493 -14.624 1.00 0.00 H new ATOM 570 N GLN A 37 -8.614 7.470 -8.559 1.00 0.00 N ATOM 571 CA GLN A 37 -9.579 7.854 -7.521 1.00 0.00 C ATOM 572 C GLN A 37 -8.917 8.771 -6.480 1.00 0.00 C ATOM 573 O GLN A 37 -9.498 9.772 -6.053 1.00 0.00 O ATOM 574 CB GLN A 37 -10.152 6.608 -6.832 1.00 0.00 C ATOM 575 CG GLN A 37 -11.089 5.783 -7.709 1.00 0.00 C ATOM 576 CD GLN A 37 -12.347 6.537 -8.106 1.00 0.00 C ATOM 577 OE1 GLN A 37 -12.821 7.408 -7.386 1.00 0.00 O ATOM 578 NE2 GLN A 37 -12.904 6.204 -9.252 1.00 0.00 N ATOM 0 H GLN A 37 -8.350 6.485 -8.546 1.00 0.00 H new ATOM 0 HA GLN A 37 -10.394 8.398 -7.999 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -9.327 5.975 -6.506 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -10.690 6.917 -5.936 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -10.558 5.474 -8.609 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -11.369 4.874 -7.177 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -12.486 5.475 -9.830 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -13.754 6.675 -9.562 1.00 0.00 H new ATOM 587 N LEU A 38 -7.689 8.430 -6.092 1.00 0.00 N ATOM 588 CA LEU A 38 -6.909 9.253 -5.160 1.00 0.00 C ATOM 589 C LEU A 38 -6.608 10.635 -5.764 1.00 0.00 C ATOM 590 O LEU A 38 -6.374 11.602 -5.040 1.00 0.00 O ATOM 591 CB LEU A 38 -5.604 8.535 -4.780 1.00 0.00 C ATOM 592 CG LEU A 38 -5.783 7.181 -4.068 1.00 0.00 C ATOM 593 CD1 LEU A 38 -4.430 6.545 -3.755 1.00 0.00 C ATOM 594 CD2 LEU A 38 -6.613 7.343 -2.796 1.00 0.00 C ATOM 0 H LEU A 38 -7.209 7.587 -6.408 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.502 9.402 -4.258 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.019 8.376 -5.686 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.021 9.192 -4.135 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.321 6.514 -4.742 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.584 5.590 -3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.881 6.382 -4.683 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -3.858 7.208 -3.106 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.727 6.374 -2.310 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -6.109 8.032 -2.118 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.596 7.738 -3.051 1.00 0.00 H new ATOM 606 N GLU A 39 -6.603 10.716 -7.095 1.00 0.00 N ATOM 607 CA GLU A 39 -6.486 12.002 -7.796 1.00 0.00 C ATOM 608 C GLU A 39 -7.780 12.828 -7.666 1.00 0.00 C ATOM 609 O GLU A 39 -7.751 14.057 -7.699 1.00 0.00 O ATOM 610 CB GLU A 39 -6.160 11.777 -9.282 1.00 0.00 C ATOM 611 CG GLU A 39 -4.828 11.071 -9.536 1.00 0.00 C ATOM 612 CD GLU A 39 -3.626 11.862 -9.037 1.00 0.00 C ATOM 613 OE1 GLU A 39 -3.271 12.880 -9.671 1.00 0.00 O ATOM 614 OE2 GLU A 39 -3.028 11.470 -8.013 1.00 0.00 O ATOM 0 H GLU A 39 -6.678 9.908 -7.713 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.673 12.560 -7.331 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -6.960 11.190 -9.732 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -6.149 12.742 -9.789 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.842 10.096 -9.048 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.718 10.891 -10.605 1.00 0.00 H new ATOM 621 N GLN A 40 -8.915 12.145 -7.521 1.00 0.00 N ATOM 622 CA GLN A 40 -10.215 12.816 -7.358 1.00 0.00 C ATOM 623 C GLN A 40 -10.394 13.341 -5.924 1.00 0.00 C ATOM 624 O GLN A 40 -10.790 14.488 -5.706 1.00 0.00 O ATOM 625 CB GLN A 40 -11.357 11.847 -7.686 1.00 0.00 C ATOM 626 CG GLN A 40 -11.296 11.264 -9.092 1.00 0.00 C ATOM 627 CD GLN A 40 -12.382 10.231 -9.338 1.00 0.00 C ATOM 628 OE1 GLN A 40 -13.466 10.304 -8.766 1.00 0.00 O ATOM 629 NE2 GLN A 40 -12.102 9.261 -10.183 1.00 0.00 N ATOM 0 H GLN A 40 -8.966 11.126 -7.512 1.00 0.00 H new ATOM 0 HA GLN A 40 -10.240 13.661 -8.046 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -11.344 11.030 -6.965 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -12.307 12.367 -7.561 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -11.392 12.069 -9.821 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -10.320 10.806 -9.250 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -11.191 9.231 -10.641 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -12.796 8.540 -10.380 1.00 0.00 H new ATOM 638 N THR A 41 -10.097 12.486 -4.950 1.00 0.00 N ATOM 639 CA THR A 41 -10.229 12.836 -3.526 1.00 0.00 C ATOM 640 C THR A 41 -8.869 13.244 -2.942 1.00 0.00 C ATOM 641 O THR A 41 -8.535 12.938 -1.794 1.00 0.00 O ATOM 642 CB THR A 41 -10.821 11.653 -2.713 1.00 0.00 C ATOM 643 OG1 THR A 41 -10.929 12.002 -1.321 1.00 0.00 O ATOM 644 CG2 THR A 41 -9.969 10.396 -2.867 1.00 0.00 C ATOM 0 H THR A 41 -9.760 11.537 -5.116 1.00 0.00 H new ATOM 0 HA THR A 41 -10.913 13.681 -3.453 1.00 0.00 H new ATOM 0 HB THR A 41 -11.816 11.445 -3.107 1.00 0.00 H new ATOM 0 HG1 THR A 41 -10.074 12.363 -1.007 1.00 0.00 H new ATOM 0 HG21 THR A 41 -10.409 9.585 -2.286 1.00 0.00 H new ATOM 0 HG22 THR A 41 -9.929 10.110 -3.918 1.00 0.00 H new ATOM 0 HG23 THR A 41 -8.960 10.594 -2.507 1.00 0.00 H new ATOM 652 N ASN A 42 -8.103 13.971 -3.743 1.00 0.00 N ATOM 653 CA ASN A 42 -6.736 14.346 -3.393 1.00 0.00 C ATOM 654 C ASN A 42 -6.685 15.526 -2.411 1.00 0.00 C ATOM 655 O ASN A 42 -7.290 16.575 -2.637 1.00 0.00 O ATOM 656 CB ASN A 42 -5.957 14.692 -4.666 1.00 0.00 C ATOM 657 CG ASN A 42 -6.566 15.850 -5.438 1.00 0.00 C ATOM 658 OD1 ASN A 42 -7.775 16.057 -5.428 1.00 0.00 O ATOM 659 ND2 ASN A 42 -5.736 16.618 -6.116 1.00 0.00 N ATOM 0 H ASN A 42 -8.409 14.318 -4.652 1.00 0.00 H new ATOM 0 HA ASN A 42 -6.279 13.492 -2.893 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -4.929 14.940 -4.400 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -5.917 13.814 -5.311 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.095 17.409 -6.651 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.735 16.421 -6.106 1.00 0.00 H new ATOM 666 N TYR A 43 -5.974 15.338 -1.308 1.00 0.00 N ATOM 667 CA TYR A 43 -5.682 16.434 -0.381 1.00 0.00 C ATOM 668 C TYR A 43 -4.389 17.143 -0.811 1.00 0.00 C ATOM 669 O TYR A 43 -4.397 18.319 -1.177 1.00 0.00 O ATOM 670 CB TYR A 43 -5.569 15.891 1.050 1.00 0.00 C ATOM 671 CG TYR A 43 -6.834 15.193 1.520 1.00 0.00 C ATOM 672 CD1 TYR A 43 -7.873 15.912 2.102 1.00 0.00 C ATOM 673 CD2 TYR A 43 -6.997 13.819 1.366 1.00 0.00 C ATOM 674 CE1 TYR A 43 -9.030 15.285 2.519 1.00 0.00 C ATOM 675 CE2 TYR A 43 -8.156 13.188 1.777 1.00 0.00 C ATOM 676 CZ TYR A 43 -9.168 13.924 2.354 1.00 0.00 C ATOM 677 OH TYR A 43 -10.325 13.298 2.758 1.00 0.00 O ATOM 0 H TYR A 43 -5.586 14.437 -1.029 1.00 0.00 H new ATOM 0 HA TYR A 43 -6.494 17.160 -0.403 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -4.734 15.193 1.103 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -5.341 16.713 1.728 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -7.773 16.980 2.230 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -6.205 13.237 0.918 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -9.824 15.859 2.973 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -8.268 12.122 1.646 1.00 0.00 H new ATOM 0 HH TYR A 43 -11.078 13.921 2.682 1.00 0.00 H new ATOM 687 N ARG A 44 -3.283 16.405 -0.777 1.00 0.00 N ATOM 688 CA ARG A 44 -2.003 16.876 -1.327 1.00 0.00 C ATOM 689 C ARG A 44 -1.244 15.706 -1.978 1.00 0.00 C ATOM 690 O ARG A 44 -0.051 15.806 -2.261 1.00 0.00 O ATOM 691 CB ARG A 44 -1.132 17.479 -0.217 1.00 0.00 C ATOM 692 CG ARG A 44 -0.583 16.431 0.746 1.00 0.00 C ATOM 693 CD ARG A 44 0.515 16.986 1.642 1.00 0.00 C ATOM 694 NE ARG A 44 1.254 15.912 2.298 1.00 0.00 N ATOM 695 CZ ARG A 44 2.122 16.088 3.252 1.00 0.00 C ATOM 696 NH1 ARG A 44 2.363 17.271 3.722 1.00 0.00 N ATOM 697 NH2 ARG A 44 2.745 15.070 3.745 1.00 0.00 N ATOM 0 H ARG A 44 -3.242 15.470 -0.372 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.214 17.639 -2.076 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -0.301 18.020 -0.669 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -1.719 18.207 0.343 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -1.395 16.049 1.365 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -0.192 15.588 0.177 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.200 17.593 1.049 1.00 0.00 H new ATOM 0 HD3 ARG A 44 0.077 17.642 2.394 1.00 0.00 H new ATOM 0 HE ARG A 44 1.078 14.957 1.987 1.00 0.00 H new ATOM 0 HH11 ARG A 44 1.870 18.080 3.344 1.00 0.00 H new ATOM 0 HH12 ARG A 44 3.046 17.393 4.470 1.00 0.00 H new ATOM 0 HH21 ARG A 44 2.556 14.134 3.387 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.426 15.202 4.493 1.00 0.00 H new ATOM 711 N LEU A 45 -1.966 14.612 -2.229 1.00 0.00 N ATOM 712 CA LEU A 45 -1.360 13.326 -2.600 1.00 0.00 C ATOM 713 C LEU A 45 -0.364 13.438 -3.762 1.00 0.00 C ATOM 714 O LEU A 45 -0.742 13.558 -4.929 1.00 0.00 O ATOM 715 CB LEU A 45 -2.451 12.303 -2.938 1.00 0.00 C ATOM 716 CG LEU A 45 -3.426 11.983 -1.795 1.00 0.00 C ATOM 717 CD1 LEU A 45 -4.464 10.963 -2.249 1.00 0.00 C ATOM 718 CD2 LEU A 45 -2.674 11.480 -0.561 1.00 0.00 C ATOM 0 H LEU A 45 -2.985 14.590 -2.182 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.792 12.990 -1.733 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.023 12.674 -3.789 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.972 11.377 -3.255 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.944 12.902 -1.521 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.147 10.748 -1.427 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.026 11.366 -3.091 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -3.962 10.045 -2.554 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.386 11.260 0.234 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.123 10.575 -0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.977 12.246 -0.222 1.00 0.00 H new ATOM 730 N LYS A 46 0.913 13.409 -3.416 1.00 0.00 N ATOM 731 CA LYS A 46 2.007 13.387 -4.388 1.00 0.00 C ATOM 732 C LYS A 46 2.840 12.110 -4.196 1.00 0.00 C ATOM 733 O LYS A 46 4.055 12.094 -4.397 1.00 0.00 O ATOM 734 CB LYS A 46 2.865 14.648 -4.205 1.00 0.00 C ATOM 735 CG LYS A 46 3.364 14.852 -2.774 1.00 0.00 C ATOM 736 CD LYS A 46 3.920 16.259 -2.559 1.00 0.00 C ATOM 737 CE LYS A 46 2.845 17.325 -2.753 1.00 0.00 C ATOM 738 NZ LYS A 46 3.367 18.698 -2.525 1.00 0.00 N ATOM 0 H LYS A 46 1.228 13.400 -2.446 1.00 0.00 H new ATOM 0 HA LYS A 46 1.612 13.382 -5.404 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.723 14.593 -4.875 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.282 15.519 -4.505 1.00 0.00 H new ATOM 0 HG2 LYS A 46 2.546 14.674 -2.076 1.00 0.00 H new ATOM 0 HG3 LYS A 46 4.138 14.118 -2.552 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.333 16.337 -1.554 1.00 0.00 H new ATOM 0 HD3 LYS A 46 4.739 16.437 -3.255 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.444 17.254 -3.764 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.019 17.134 -2.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 2.602 19.388 -2.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.726 18.776 -1.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 4.138 18.892 -3.195 1.00 0.00 H new ATOM 752 N LEU A 47 2.141 11.036 -3.828 1.00 0.00 N ATOM 753 CA LEU A 47 2.762 9.754 -3.477 1.00 0.00 C ATOM 754 C LEU A 47 3.283 8.973 -4.704 1.00 0.00 C ATOM 755 O LEU A 47 3.242 9.458 -5.836 1.00 0.00 O ATOM 756 CB LEU A 47 1.760 8.915 -2.658 1.00 0.00 C ATOM 757 CG LEU A 47 0.338 8.775 -3.242 1.00 0.00 C ATOM 758 CD1 LEU A 47 0.282 7.728 -4.353 1.00 0.00 C ATOM 759 CD2 LEU A 47 -0.663 8.445 -2.138 1.00 0.00 C ATOM 0 H LEU A 47 1.123 11.029 -3.764 1.00 0.00 H new ATOM 0 HA LEU A 47 3.645 9.965 -2.874 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.176 7.916 -2.531 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.679 9.355 -1.664 1.00 0.00 H new ATOM 0 HG LEU A 47 0.068 9.734 -3.685 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.736 7.660 -4.738 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.956 8.017 -5.159 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.586 6.759 -3.956 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.660 8.350 -2.568 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -0.382 7.506 -1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -0.662 9.243 -1.396 1.00 0.00 H new ATOM 771 N CYS A 48 3.768 7.751 -4.465 1.00 0.00 N ATOM 772 CA CYS A 48 4.453 6.966 -5.506 1.00 0.00 C ATOM 773 C CYS A 48 4.051 5.482 -5.489 1.00 0.00 C ATOM 774 O CYS A 48 3.387 5.014 -4.565 1.00 0.00 O ATOM 775 CB CYS A 48 5.969 7.085 -5.317 1.00 0.00 C ATOM 776 SG CYS A 48 6.547 6.592 -3.674 1.00 0.00 S ATOM 0 H CYS A 48 3.701 7.281 -3.562 1.00 0.00 H new ATOM 0 HA CYS A 48 4.151 7.373 -6.471 1.00 0.00 H new ATOM 0 HB2 CYS A 48 6.468 6.470 -6.066 1.00 0.00 H new ATOM 0 HB3 CYS A 48 6.268 8.117 -5.502 1.00 0.00 H new ATOM 0 HG CYS A 48 6.368 5.314 -3.516 1.00 0.00 H new ATOM 782 N VAL A 49 4.473 4.746 -6.524 1.00 0.00 N ATOM 783 CA VAL A 49 4.197 3.303 -6.639 1.00 0.00 C ATOM 784 C VAL A 49 5.490 2.491 -6.823 1.00 0.00 C ATOM 785 O VAL A 49 6.571 3.059 -6.986 1.00 0.00 O ATOM 786 CB VAL A 49 3.254 2.994 -7.831 1.00 0.00 C ATOM 787 CG1 VAL A 49 1.891 3.646 -7.636 1.00 0.00 C ATOM 788 CG2 VAL A 49 3.887 3.436 -9.152 1.00 0.00 C ATOM 0 H VAL A 49 5.012 5.127 -7.302 1.00 0.00 H new ATOM 0 HA VAL A 49 3.713 3.013 -5.706 1.00 0.00 H new ATOM 0 HB VAL A 49 3.104 1.915 -7.870 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.251 3.412 -8.487 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.433 3.266 -6.723 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.012 4.727 -7.559 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.208 3.210 -9.974 1.00 0.00 H new ATOM 0 HG22 VAL A 49 4.077 4.509 -9.123 1.00 0.00 H new ATOM 0 HG23 VAL A 49 4.827 2.905 -9.301 1.00 0.00 H new ATOM 798 N SER A 50 5.363 1.161 -6.809 1.00 0.00 N ATOM 799 CA SER A 50 6.506 0.248 -7.009 1.00 0.00 C ATOM 800 C SER A 50 7.298 0.585 -8.282 1.00 0.00 C ATOM 801 O SER A 50 8.499 0.864 -8.225 1.00 0.00 O ATOM 802 CB SER A 50 6.015 -1.205 -7.082 1.00 0.00 C ATOM 803 OG SER A 50 5.094 -1.380 -8.150 1.00 0.00 O ATOM 0 H SER A 50 4.474 0.684 -6.660 1.00 0.00 H new ATOM 0 HA SER A 50 7.173 0.373 -6.156 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.865 -1.873 -7.218 1.00 0.00 H new ATOM 0 HB3 SER A 50 5.541 -1.480 -6.140 1.00 0.00 H new ATOM 0 HG SER A 50 4.219 -1.023 -7.889 1.00 0.00 H new ATOM 809 N ASP A 51 6.626 0.540 -9.429 1.00 0.00 N ATOM 810 CA ASP A 51 7.246 0.898 -10.710 1.00 0.00 C ATOM 811 C ASP A 51 6.290 1.722 -11.586 1.00 0.00 C ATOM 812 O ASP A 51 5.122 1.372 -11.759 1.00 0.00 O ATOM 813 CB ASP A 51 7.722 -0.359 -11.456 1.00 0.00 C ATOM 814 CG ASP A 51 6.650 -1.433 -11.558 1.00 0.00 C ATOM 815 OD1 ASP A 51 6.451 -2.167 -10.566 1.00 0.00 O ATOM 816 OD2 ASP A 51 6.019 -1.563 -12.629 1.00 0.00 O ATOM 0 H ASP A 51 5.648 0.259 -9.502 1.00 0.00 H new ATOM 0 HA ASP A 51 8.115 1.519 -10.494 1.00 0.00 H new ATOM 0 HB2 ASP A 51 8.044 -0.079 -12.459 1.00 0.00 H new ATOM 0 HB3 ASP A 51 8.592 -0.770 -10.945 1.00 0.00 H new ATOM 821 N ARG A 52 6.803 2.826 -12.124 1.00 0.00 N ATOM 822 CA ARG A 52 6.028 3.719 -12.994 1.00 0.00 C ATOM 823 C ARG A 52 6.039 3.219 -14.455 1.00 0.00 C ATOM 824 O ARG A 52 5.493 3.859 -15.358 1.00 0.00 O ATOM 825 CB ARG A 52 6.599 5.145 -12.883 1.00 0.00 C ATOM 826 CG ARG A 52 5.867 6.200 -13.709 1.00 0.00 C ATOM 827 CD ARG A 52 6.412 7.598 -13.442 1.00 0.00 C ATOM 828 NE ARG A 52 5.867 8.593 -14.363 1.00 0.00 N ATOM 829 CZ ARG A 52 5.497 9.795 -14.010 1.00 0.00 C ATOM 830 NH1 ARG A 52 5.488 10.142 -12.764 1.00 0.00 N ATOM 831 NH2 ARG A 52 5.106 10.644 -14.903 1.00 0.00 N ATOM 0 H ARG A 52 7.765 3.130 -11.972 1.00 0.00 H new ATOM 0 HA ARG A 52 4.987 3.726 -12.671 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.580 5.447 -11.836 1.00 0.00 H new ATOM 0 HB3 ARG A 52 7.645 5.126 -13.190 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.966 5.966 -14.769 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.803 6.173 -13.475 1.00 0.00 H new ATOM 0 HD2 ARG A 52 6.177 7.887 -12.418 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.499 7.584 -13.528 1.00 0.00 H new ATOM 0 HE ARG A 52 5.769 8.332 -15.344 1.00 0.00 H new ATOM 0 HH11 ARG A 52 5.772 9.475 -12.047 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.197 11.083 -12.499 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.086 10.376 -15.887 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.818 11.582 -14.624 1.00 0.00 H new ATOM 845 N ASP A 53 6.677 2.070 -14.677 1.00 0.00 N ATOM 846 CA ASP A 53 6.674 1.407 -15.985 1.00 0.00 C ATOM 847 C ASP A 53 5.237 1.180 -16.486 1.00 0.00 C ATOM 848 O ASP A 53 4.912 1.458 -17.643 1.00 0.00 O ATOM 849 CB ASP A 53 7.424 0.073 -15.880 1.00 0.00 C ATOM 850 CG ASP A 53 7.392 -0.722 -17.172 1.00 0.00 C ATOM 851 OD1 ASP A 53 8.083 -0.331 -18.132 1.00 0.00 O ATOM 852 OD2 ASP A 53 6.669 -1.739 -17.231 1.00 0.00 O ATOM 0 H ASP A 53 7.208 1.573 -13.961 1.00 0.00 H new ATOM 0 HA ASP A 53 7.178 2.050 -16.707 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.460 0.265 -15.602 1.00 0.00 H new ATOM 0 HB3 ASP A 53 6.985 -0.524 -15.080 1.00 0.00 H new ATOM 857 N VAL A 54 4.386 0.681 -15.598 1.00 0.00 N ATOM 858 CA VAL A 54 2.966 0.476 -15.899 1.00 0.00 C ATOM 859 C VAL A 54 2.125 1.684 -15.437 1.00 0.00 C ATOM 860 O VAL A 54 2.670 2.762 -15.190 1.00 0.00 O ATOM 861 CB VAL A 54 2.448 -0.816 -15.221 1.00 0.00 C ATOM 862 CG1 VAL A 54 3.202 -2.037 -15.741 1.00 0.00 C ATOM 863 CG2 VAL A 54 2.571 -0.715 -13.703 1.00 0.00 C ATOM 0 H VAL A 54 4.654 0.407 -14.653 1.00 0.00 H new ATOM 0 HA VAL A 54 2.864 0.375 -16.979 1.00 0.00 H new ATOM 0 HB VAL A 54 1.394 -0.933 -15.471 1.00 0.00 H new ATOM 0 HG11 VAL A 54 2.823 -2.934 -15.252 1.00 0.00 H new ATOM 0 HG12 VAL A 54 3.058 -2.122 -16.818 1.00 0.00 H new ATOM 0 HG13 VAL A 54 4.265 -1.928 -15.525 1.00 0.00 H new ATOM 0 HG21 VAL A 54 2.202 -1.633 -13.246 1.00 0.00 H new ATOM 0 HG22 VAL A 54 3.617 -0.570 -13.432 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.983 0.130 -13.346 1.00 0.00 H new ATOM 873 N LEU A 55 0.801 1.509 -15.345 1.00 0.00 N ATOM 874 CA LEU A 55 -0.102 2.571 -14.868 1.00 0.00 C ATOM 875 C LEU A 55 -0.125 3.782 -15.823 1.00 0.00 C ATOM 876 O LEU A 55 0.555 4.784 -15.593 1.00 0.00 O ATOM 877 CB LEU A 55 0.301 3.016 -13.451 1.00 0.00 C ATOM 878 CG LEU A 55 0.163 1.942 -12.360 1.00 0.00 C ATOM 879 CD1 LEU A 55 1.008 2.295 -11.140 1.00 0.00 C ATOM 880 CD2 LEU A 55 -1.297 1.768 -11.959 1.00 0.00 C ATOM 0 H LEU A 55 0.328 0.641 -15.595 1.00 0.00 H new ATOM 0 HA LEU A 55 -1.110 2.157 -14.842 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.337 3.354 -13.475 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.309 3.875 -13.171 1.00 0.00 H new ATOM 0 HG LEU A 55 0.526 0.999 -12.768 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.894 1.520 -10.382 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.056 2.366 -11.431 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.679 3.251 -10.734 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -1.373 1.003 -11.186 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.684 2.712 -11.575 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -1.879 1.464 -12.829 1.00 0.00 H new ATOM 892 N PRO A 56 -0.904 3.703 -16.918 1.00 0.00 N ATOM 893 CA PRO A 56 -0.974 4.782 -17.923 1.00 0.00 C ATOM 894 C PRO A 56 -1.593 6.088 -17.379 1.00 0.00 C ATOM 895 O PRO A 56 -0.911 7.112 -17.283 1.00 0.00 O ATOM 896 CB PRO A 56 -1.846 4.177 -19.036 1.00 0.00 C ATOM 897 CG PRO A 56 -2.640 3.105 -18.366 1.00 0.00 C ATOM 898 CD PRO A 56 -1.761 2.555 -17.276 1.00 0.00 C ATOM 0 HA PRO A 56 0.019 5.083 -18.257 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.496 4.930 -19.481 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -1.233 3.770 -19.840 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -3.567 3.506 -17.955 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -2.917 2.324 -19.075 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -2.346 2.209 -16.424 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -1.172 1.707 -17.624 1.00 0.00 H new ATOM 906 N GLY A 57 -2.876 6.051 -17.014 1.00 0.00 N ATOM 907 CA GLY A 57 -3.557 7.247 -16.521 1.00 0.00 C ATOM 908 C GLY A 57 -3.278 7.543 -15.049 1.00 0.00 C ATOM 909 O GLY A 57 -4.194 7.548 -14.224 1.00 0.00 O ATOM 0 H GLY A 57 -3.458 5.214 -17.050 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -3.249 8.104 -17.120 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -4.631 7.128 -16.662 1.00 0.00 H new ATOM 913 N THR A 58 -2.009 7.787 -14.721 1.00 0.00 N ATOM 914 CA THR A 58 -1.588 8.075 -13.335 1.00 0.00 C ATOM 915 C THR A 58 -0.439 9.092 -13.306 1.00 0.00 C ATOM 916 O THR A 58 0.135 9.422 -14.347 1.00 0.00 O ATOM 917 CB THR A 58 -1.103 6.797 -12.601 1.00 0.00 C ATOM 918 OG1 THR A 58 0.071 6.276 -13.245 1.00 0.00 O ATOM 919 CG2 THR A 58 -2.184 5.719 -12.563 1.00 0.00 C ATOM 0 H THR A 58 -1.244 7.793 -15.396 1.00 0.00 H new ATOM 0 HA THR A 58 -2.466 8.478 -12.830 1.00 0.00 H new ATOM 0 HB THR A 58 -0.870 7.078 -11.574 1.00 0.00 H new ATOM 0 HG1 THR A 58 -0.185 5.828 -14.079 1.00 0.00 H new ATOM 0 HG21 THR A 58 -1.804 4.841 -12.041 1.00 0.00 H new ATOM 0 HG22 THR A 58 -3.061 6.101 -12.040 1.00 0.00 H new ATOM 0 HG23 THR A 58 -2.460 5.444 -13.581 1.00 0.00 H new ATOM 927 N CYS A 59 -0.108 9.591 -12.114 1.00 0.00 N ATOM 928 CA CYS A 59 1.079 10.441 -11.932 1.00 0.00 C ATOM 929 C CYS A 59 2.193 9.655 -11.225 1.00 0.00 C ATOM 930 O CYS A 59 3.173 9.270 -11.854 1.00 0.00 O ATOM 931 CB CYS A 59 0.731 11.704 -11.131 1.00 0.00 C ATOM 932 SG CYS A 59 2.131 12.815 -10.850 1.00 0.00 S ATOM 0 H CYS A 59 -0.641 9.424 -11.260 1.00 0.00 H new ATOM 0 HA CYS A 59 1.432 10.747 -12.917 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -0.052 12.250 -11.658 1.00 0.00 H new ATOM 0 HB3 CYS A 59 0.319 11.407 -10.167 1.00 0.00 H new ATOM 0 HG CYS A 59 3.145 12.132 -10.407 1.00 0.00 H new ATOM 938 N VAL A 60 2.010 9.421 -9.917 1.00 0.00 N ATOM 939 CA VAL A 60 2.900 8.578 -9.082 1.00 0.00 C ATOM 940 C VAL A 60 4.390 8.561 -9.512 1.00 0.00 C ATOM 941 O VAL A 60 4.795 7.844 -10.428 1.00 0.00 O ATOM 942 CB VAL A 60 2.363 7.124 -8.980 1.00 0.00 C ATOM 943 CG1 VAL A 60 1.035 7.099 -8.225 1.00 0.00 C ATOM 944 CG2 VAL A 60 2.209 6.484 -10.364 1.00 0.00 C ATOM 0 H VAL A 60 1.228 9.816 -9.394 1.00 0.00 H new ATOM 0 HA VAL A 60 2.881 9.057 -8.103 1.00 0.00 H new ATOM 0 HB VAL A 60 3.094 6.536 -8.424 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.672 6.073 -8.162 1.00 0.00 H new ATOM 0 HG12 VAL A 60 1.180 7.495 -7.220 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.304 7.711 -8.754 1.00 0.00 H new ATOM 0 HG21 VAL A 60 1.831 5.467 -10.255 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.508 7.069 -10.960 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.178 6.460 -10.863 1.00 0.00 H new ATOM 954 N TRP A 61 5.212 9.342 -8.821 1.00 0.00 N ATOM 955 CA TRP A 61 6.651 9.394 -9.108 1.00 0.00 C ATOM 956 C TRP A 61 7.415 8.316 -8.315 1.00 0.00 C ATOM 957 O TRP A 61 7.897 8.568 -7.212 1.00 0.00 O ATOM 958 CB TRP A 61 7.201 10.791 -8.786 1.00 0.00 C ATOM 959 CG TRP A 61 6.572 11.884 -9.602 1.00 0.00 C ATOM 960 CD1 TRP A 61 5.276 12.317 -9.537 1.00 0.00 C ATOM 961 CD2 TRP A 61 7.213 12.688 -10.600 1.00 0.00 C ATOM 962 NE1 TRP A 61 5.075 13.336 -10.436 1.00 0.00 N ATOM 963 CE2 TRP A 61 6.249 13.583 -11.099 1.00 0.00 C ATOM 964 CE3 TRP A 61 8.511 12.737 -11.120 1.00 0.00 C ATOM 965 CZ2 TRP A 61 6.541 14.517 -12.091 1.00 0.00 C ATOM 966 CZ3 TRP A 61 8.800 13.662 -12.105 1.00 0.00 C ATOM 967 CH2 TRP A 61 7.819 14.542 -12.581 1.00 0.00 C ATOM 0 H TRP A 61 4.913 9.949 -8.058 1.00 0.00 H new ATOM 0 HA TRP A 61 6.796 9.192 -10.169 1.00 0.00 H new ATOM 0 HB2 TRP A 61 7.042 11.001 -7.728 1.00 0.00 H new ATOM 0 HB3 TRP A 61 8.278 10.797 -8.954 1.00 0.00 H new ATOM 0 HD1 TRP A 61 4.522 11.917 -8.876 1.00 0.00 H new ATOM 0 HE1 TRP A 61 4.195 13.829 -10.586 1.00 0.00 H new ATOM 0 HE3 TRP A 61 9.274 12.064 -10.758 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 5.787 15.196 -12.460 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 9.798 13.707 -12.515 1.00 0.00 H new ATOM 0 HH2 TRP A 61 8.076 15.255 -13.350 1.00 0.00 H new ATOM 978 N SER A 62 7.508 7.113 -8.889 1.00 0.00 N ATOM 979 CA SER A 62 8.140 5.955 -8.222 1.00 0.00 C ATOM 980 C SER A 62 9.550 6.260 -7.690 1.00 0.00 C ATOM 981 O SER A 62 10.330 6.977 -8.324 1.00 0.00 O ATOM 982 CB SER A 62 8.206 4.762 -9.182 1.00 0.00 C ATOM 983 OG SER A 62 6.908 4.354 -9.575 1.00 0.00 O ATOM 0 H SER A 62 7.152 6.908 -9.823 1.00 0.00 H new ATOM 0 HA SER A 62 7.514 5.716 -7.362 1.00 0.00 H new ATOM 0 HB2 SER A 62 8.789 5.031 -10.063 1.00 0.00 H new ATOM 0 HB3 SER A 62 8.722 3.931 -8.700 1.00 0.00 H new ATOM 0 HG SER A 62 6.432 3.987 -8.801 1.00 0.00 H new ATOM 989 N ILE A 63 9.876 5.688 -6.530 1.00 0.00 N ATOM 990 CA ILE A 63 11.165 5.933 -5.863 1.00 0.00 C ATOM 991 C ILE A 63 12.006 4.648 -5.731 1.00 0.00 C ATOM 992 O ILE A 63 11.567 3.556 -6.107 1.00 0.00 O ATOM 993 CB ILE A 63 10.949 6.550 -4.457 1.00 0.00 C ATOM 994 CG1 ILE A 63 10.075 5.623 -3.594 1.00 0.00 C ATOM 995 CG2 ILE A 63 10.324 7.940 -4.575 1.00 0.00 C ATOM 996 CD1 ILE A 63 9.798 6.153 -2.203 1.00 0.00 C ATOM 0 H ILE A 63 9.263 5.047 -6.026 1.00 0.00 H new ATOM 0 HA ILE A 63 11.712 6.635 -6.492 1.00 0.00 H new ATOM 0 HB ILE A 63 11.917 6.655 -3.968 1.00 0.00 H new ATOM 0 HG12 ILE A 63 9.126 5.458 -4.104 1.00 0.00 H new ATOM 0 HG13 ILE A 63 10.565 4.653 -3.511 1.00 0.00 H new ATOM 0 HG21 ILE A 63 10.179 8.359 -3.579 1.00 0.00 H new ATOM 0 HG22 ILE A 63 10.985 8.589 -5.149 1.00 0.00 H new ATOM 0 HG23 ILE A 63 9.361 7.864 -5.081 1.00 0.00 H new ATOM 0 HD11 ILE A 63 9.176 5.441 -1.660 1.00 0.00 H new ATOM 0 HD12 ILE A 63 10.740 6.291 -1.672 1.00 0.00 H new ATOM 0 HD13 ILE A 63 9.278 7.108 -2.274 1.00 0.00 H new ATOM 1008 N ALA A 64 13.219 4.795 -5.191 1.00 0.00 N ATOM 1009 CA ALA A 64 14.158 3.675 -5.044 1.00 0.00 C ATOM 1010 C ALA A 64 13.794 2.744 -3.871 1.00 0.00 C ATOM 1011 O ALA A 64 13.329 3.194 -2.820 1.00 0.00 O ATOM 1012 CB ALA A 64 15.575 4.211 -4.874 1.00 0.00 C ATOM 0 H ALA A 64 13.577 5.685 -4.845 1.00 0.00 H new ATOM 0 HA ALA A 64 14.094 3.076 -5.952 1.00 0.00 H new ATOM 0 HB1 ALA A 64 16.269 3.377 -4.765 1.00 0.00 H new ATOM 0 HB2 ALA A 64 15.849 4.799 -5.750 1.00 0.00 H new ATOM 0 HB3 ALA A 64 15.622 4.840 -3.985 1.00 0.00 H new ATOM 1018 N SER A 65 14.048 1.446 -4.059 1.00 0.00 N ATOM 1019 CA SER A 65 13.700 0.397 -3.078 1.00 0.00 C ATOM 1020 C SER A 65 14.236 0.684 -1.663 1.00 0.00 C ATOM 1021 O SER A 65 13.547 0.453 -0.671 1.00 0.00 O ATOM 1022 CB SER A 65 14.238 -0.960 -3.560 1.00 0.00 C ATOM 1023 OG SER A 65 13.978 -1.996 -2.624 1.00 0.00 O ATOM 0 H SER A 65 14.503 1.085 -4.898 1.00 0.00 H new ATOM 0 HA SER A 65 12.612 0.381 -3.010 1.00 0.00 H new ATOM 0 HB2 SER A 65 13.781 -1.212 -4.517 1.00 0.00 H new ATOM 0 HB3 SER A 65 15.312 -0.885 -3.729 1.00 0.00 H new ATOM 0 HG SER A 65 14.333 -2.843 -2.966 1.00 0.00 H new ATOM 1029 N GLU A 66 15.459 1.195 -1.571 1.00 0.00 N ATOM 1030 CA GLU A 66 16.097 1.444 -0.267 1.00 0.00 C ATOM 1031 C GLU A 66 15.825 2.867 0.258 1.00 0.00 C ATOM 1032 O GLU A 66 16.319 3.250 1.319 1.00 0.00 O ATOM 1033 CB GLU A 66 17.615 1.192 -0.340 1.00 0.00 C ATOM 1034 CG GLU A 66 18.351 1.996 -1.414 1.00 0.00 C ATOM 1035 CD GLU A 66 18.215 1.398 -2.807 1.00 0.00 C ATOM 1036 OE1 GLU A 66 18.932 0.424 -3.116 1.00 0.00 O ATOM 1037 OE2 GLU A 66 17.392 1.895 -3.601 1.00 0.00 O ATOM 0 H GLU A 66 16.033 1.447 -2.376 1.00 0.00 H new ATOM 0 HA GLU A 66 15.650 0.742 0.437 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.054 1.423 0.631 1.00 0.00 H new ATOM 0 HB3 GLU A 66 17.784 0.131 -0.522 1.00 0.00 H new ATOM 0 HG2 GLU A 66 17.966 3.016 -1.424 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.408 2.057 -1.153 1.00 0.00 H new ATOM 1044 N LEU A 67 15.037 3.648 -0.479 1.00 0.00 N ATOM 1045 CA LEU A 67 14.693 5.017 -0.059 1.00 0.00 C ATOM 1046 C LEU A 67 13.197 5.167 0.271 1.00 0.00 C ATOM 1047 O LEU A 67 12.707 6.284 0.468 1.00 0.00 O ATOM 1048 CB LEU A 67 15.094 6.023 -1.148 1.00 0.00 C ATOM 1049 CG LEU A 67 16.605 6.140 -1.409 1.00 0.00 C ATOM 1050 CD1 LEU A 67 16.886 7.178 -2.490 1.00 0.00 C ATOM 1051 CD2 LEU A 67 17.351 6.488 -0.121 1.00 0.00 C ATOM 0 H LEU A 67 14.623 3.363 -1.367 1.00 0.00 H new ATOM 0 HA LEU A 67 15.252 5.224 0.854 1.00 0.00 H new ATOM 0 HB2 LEU A 67 14.602 5.741 -2.079 1.00 0.00 H new ATOM 0 HB3 LEU A 67 14.713 7.006 -0.870 1.00 0.00 H new ATOM 0 HG LEU A 67 16.965 5.173 -1.761 1.00 0.00 H new ATOM 0 HD11 LEU A 67 17.961 7.245 -2.659 1.00 0.00 H new ATOM 0 HD12 LEU A 67 16.391 6.883 -3.415 1.00 0.00 H new ATOM 0 HD13 LEU A 67 16.508 8.149 -2.169 1.00 0.00 H new ATOM 0 HD21 LEU A 67 18.418 6.566 -0.328 1.00 0.00 H new ATOM 0 HD22 LEU A 67 16.986 7.440 0.265 1.00 0.00 H new ATOM 0 HD23 LEU A 67 17.181 5.707 0.620 1.00 0.00 H new ATOM 1063 N ILE A 68 12.484 4.042 0.350 1.00 0.00 N ATOM 1064 CA ILE A 68 11.047 4.049 0.669 1.00 0.00 C ATOM 1065 C ILE A 68 10.769 4.763 2.003 1.00 0.00 C ATOM 1066 O ILE A 68 9.937 5.668 2.080 1.00 0.00 O ATOM 1067 CB ILE A 68 10.476 2.607 0.747 1.00 0.00 C ATOM 1068 CG1 ILE A 68 10.833 1.807 -0.517 1.00 0.00 C ATOM 1069 CG2 ILE A 68 8.961 2.633 0.955 1.00 0.00 C ATOM 1070 CD1 ILE A 68 10.329 2.422 -1.804 1.00 0.00 C ATOM 0 H ILE A 68 12.874 3.112 0.198 1.00 0.00 H new ATOM 0 HA ILE A 68 10.554 4.590 -0.139 1.00 0.00 H new ATOM 0 HB ILE A 68 10.931 2.111 1.605 1.00 0.00 H new ATOM 0 HG12 ILE A 68 11.917 1.707 -0.576 1.00 0.00 H new ATOM 0 HG13 ILE A 68 10.424 0.801 -0.424 1.00 0.00 H new ATOM 0 HG21 ILE A 68 8.583 1.612 1.007 1.00 0.00 H new ATOM 0 HG22 ILE A 68 8.730 3.153 1.885 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.488 3.153 0.122 1.00 0.00 H new ATOM 0 HD11 ILE A 68 10.623 1.796 -2.646 1.00 0.00 H new ATOM 0 HD12 ILE A 68 9.242 2.497 -1.770 1.00 0.00 H new ATOM 0 HD13 ILE A 68 10.758 3.417 -1.924 1.00 0.00 H new ATOM 1082 N GLU A 69 11.489 4.347 3.043 1.00 0.00 N ATOM 1083 CA GLU A 69 11.348 4.914 4.390 1.00 0.00 C ATOM 1084 C GLU A 69 11.522 6.439 4.393 1.00 0.00 C ATOM 1085 O GLU A 69 10.724 7.170 4.983 1.00 0.00 O ATOM 1086 CB GLU A 69 12.401 4.286 5.316 1.00 0.00 C ATOM 1087 CG GLU A 69 12.356 4.787 6.755 1.00 0.00 C ATOM 1088 CD GLU A 69 13.555 4.325 7.566 1.00 0.00 C ATOM 1089 OE1 GLU A 69 13.594 3.143 7.968 1.00 0.00 O ATOM 1090 OE2 GLU A 69 14.474 5.143 7.796 1.00 0.00 O ATOM 0 H GLU A 69 12.188 3.607 2.979 1.00 0.00 H new ATOM 0 HA GLU A 69 10.341 4.690 4.742 1.00 0.00 H new ATOM 0 HB2 GLU A 69 12.267 3.204 5.317 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.391 4.484 4.906 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.317 5.876 6.757 1.00 0.00 H new ATOM 0 HG3 GLU A 69 11.441 4.435 7.231 1.00 0.00 H new ATOM 1097 N LYS A 70 12.569 6.901 3.719 1.00 0.00 N ATOM 1098 CA LYS A 70 12.953 8.314 3.741 1.00 0.00 C ATOM 1099 C LYS A 70 11.979 9.210 2.953 1.00 0.00 C ATOM 1100 O LYS A 70 11.566 10.260 3.441 1.00 0.00 O ATOM 1101 CB LYS A 70 14.374 8.475 3.183 1.00 0.00 C ATOM 1102 CG LYS A 70 15.432 7.656 3.918 1.00 0.00 C ATOM 1103 CD LYS A 70 15.452 7.948 5.417 1.00 0.00 C ATOM 1104 CE LYS A 70 16.561 7.178 6.126 1.00 0.00 C ATOM 1105 NZ LYS A 70 16.449 5.709 5.917 1.00 0.00 N ATOM 0 H LYS A 70 13.174 6.314 3.145 1.00 0.00 H new ATOM 0 HA LYS A 70 12.917 8.639 4.781 1.00 0.00 H new ATOM 0 HB2 LYS A 70 14.374 8.188 2.132 1.00 0.00 H new ATOM 0 HB3 LYS A 70 14.652 9.528 3.226 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.242 6.595 3.759 1.00 0.00 H new ATOM 0 HG3 LYS A 70 16.413 7.871 3.495 1.00 0.00 H new ATOM 0 HD2 LYS A 70 15.591 9.017 5.578 1.00 0.00 H new ATOM 0 HD3 LYS A 70 14.489 7.683 5.853 1.00 0.00 H new ATOM 0 HE2 LYS A 70 17.529 7.522 5.762 1.00 0.00 H new ATOM 0 HE3 LYS A 70 16.526 7.395 7.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 17.242 5.230 6.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 15.552 5.369 6.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 16.475 5.500 4.898 1.00 0.00 H new ATOM 1119 N ARG A 71 11.625 8.803 1.735 1.00 0.00 N ATOM 1120 CA ARG A 71 10.774 9.627 0.858 1.00 0.00 C ATOM 1121 C ARG A 71 9.298 9.663 1.303 1.00 0.00 C ATOM 1122 O ARG A 71 8.678 10.730 1.315 1.00 0.00 O ATOM 1123 CB ARG A 71 10.860 9.132 -0.596 1.00 0.00 C ATOM 1124 CG ARG A 71 11.990 9.745 -1.429 1.00 0.00 C ATOM 1125 CD ARG A 71 13.385 9.356 -0.939 1.00 0.00 C ATOM 1126 NE ARG A 71 13.792 10.090 0.259 1.00 0.00 N ATOM 1127 CZ ARG A 71 15.005 10.527 0.468 1.00 0.00 C ATOM 1128 NH1 ARG A 71 15.915 10.403 -0.442 1.00 0.00 N ATOM 1129 NH2 ARG A 71 15.301 11.115 1.577 1.00 0.00 N ATOM 0 H ARG A 71 11.910 7.912 1.328 1.00 0.00 H new ATOM 0 HA ARG A 71 11.158 10.644 0.931 1.00 0.00 H new ATOM 0 HB2 ARG A 71 10.983 8.049 -0.587 1.00 0.00 H new ATOM 0 HB3 ARG A 71 9.911 9.341 -1.091 1.00 0.00 H new ATOM 0 HG2 ARG A 71 11.877 9.432 -2.467 1.00 0.00 H new ATOM 0 HG3 ARG A 71 11.896 10.831 -1.411 1.00 0.00 H new ATOM 0 HD2 ARG A 71 13.406 8.287 -0.729 1.00 0.00 H new ATOM 0 HD3 ARG A 71 14.108 9.538 -1.734 1.00 0.00 H new ATOM 0 HE ARG A 71 13.087 10.271 0.973 1.00 0.00 H new ATOM 0 HH11 ARG A 71 15.689 9.961 -1.333 1.00 0.00 H new ATOM 0 HH12 ARG A 71 16.859 10.748 -0.269 1.00 0.00 H new ATOM 0 HH21 ARG A 71 14.587 11.240 2.294 1.00 0.00 H new ATOM 0 HH22 ARG A 71 16.249 11.455 1.737 1.00 0.00 H new ATOM 1143 N CYS A 72 8.737 8.503 1.648 1.00 0.00 N ATOM 1144 CA CYS A 72 7.299 8.406 1.956 1.00 0.00 C ATOM 1145 C CYS A 72 7.033 8.178 3.448 1.00 0.00 C ATOM 1146 O CYS A 72 7.892 7.683 4.180 1.00 0.00 O ATOM 1147 CB CYS A 72 6.654 7.276 1.144 1.00 0.00 C ATOM 1148 SG CYS A 72 7.246 5.619 1.563 1.00 0.00 S ATOM 0 H CYS A 72 9.246 7.622 1.722 1.00 0.00 H new ATOM 0 HA CYS A 72 6.854 9.362 1.682 1.00 0.00 H new ATOM 0 HB2 CYS A 72 5.575 7.310 1.291 1.00 0.00 H new ATOM 0 HB3 CYS A 72 6.837 7.456 0.085 1.00 0.00 H new ATOM 0 HG CYS A 72 8.450 5.698 2.046 1.00 0.00 H new ATOM 1154 N ARG A 73 5.829 8.545 3.892 1.00 0.00 N ATOM 1155 CA ARG A 73 5.412 8.336 5.284 1.00 0.00 C ATOM 1156 C ARG A 73 4.598 7.039 5.444 1.00 0.00 C ATOM 1157 O ARG A 73 4.880 6.226 6.318 1.00 0.00 O ATOM 1158 CB ARG A 73 4.590 9.533 5.779 1.00 0.00 C ATOM 1159 CG ARG A 73 5.365 10.851 5.817 1.00 0.00 C ATOM 1160 CD ARG A 73 6.616 10.749 6.687 1.00 0.00 C ATOM 1161 NE ARG A 73 7.210 12.057 6.957 1.00 0.00 N ATOM 1162 CZ ARG A 73 8.421 12.235 7.414 1.00 0.00 C ATOM 1163 NH1 ARG A 73 9.217 11.227 7.580 1.00 0.00 N ATOM 1164 NH2 ARG A 73 8.839 13.430 7.688 1.00 0.00 N ATOM 0 H ARG A 73 5.122 8.990 3.307 1.00 0.00 H new ATOM 0 HA ARG A 73 6.315 8.243 5.887 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.720 9.654 5.134 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.217 9.315 6.780 1.00 0.00 H new ATOM 0 HG2 ARG A 73 5.649 11.135 4.804 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.719 11.641 6.200 1.00 0.00 H new ATOM 0 HD2 ARG A 73 6.362 10.266 7.630 1.00 0.00 H new ATOM 0 HD3 ARG A 73 7.350 10.114 6.191 1.00 0.00 H new ATOM 0 HE ARG A 73 6.642 12.885 6.777 1.00 0.00 H new ATOM 0 HH11 ARG A 73 8.900 10.284 7.353 1.00 0.00 H new ATOM 0 HH12 ARG A 73 10.161 11.376 7.937 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.223 14.231 7.547 1.00 0.00 H new ATOM 0 HH22 ARG A 73 9.784 13.570 8.045 1.00 0.00 H new ATOM 1178 N ARG A 74 3.575 6.862 4.612 1.00 0.00 N ATOM 1179 CA ARG A 74 2.760 5.639 4.636 1.00 0.00 C ATOM 1180 C ARG A 74 3.192 4.665 3.530 1.00 0.00 C ATOM 1181 O ARG A 74 4.049 4.982 2.702 1.00 0.00 O ATOM 1182 CB ARG A 74 1.273 5.990 4.470 1.00 0.00 C ATOM 1183 CG ARG A 74 0.703 6.843 5.599 1.00 0.00 C ATOM 1184 CD ARG A 74 0.668 6.091 6.927 1.00 0.00 C ATOM 1185 NE ARG A 74 0.097 6.909 7.993 1.00 0.00 N ATOM 1186 CZ ARG A 74 -0.229 6.459 9.177 1.00 0.00 C ATOM 1187 NH1 ARG A 74 -0.076 5.207 9.479 1.00 0.00 N ATOM 1188 NH2 ARG A 74 -0.716 7.269 10.060 1.00 0.00 N ATOM 0 H ARG A 74 3.287 7.546 3.912 1.00 0.00 H new ATOM 0 HA ARG A 74 2.910 5.153 5.600 1.00 0.00 H new ATOM 0 HB2 ARG A 74 1.139 6.519 3.527 1.00 0.00 H new ATOM 0 HB3 ARG A 74 0.698 5.066 4.402 1.00 0.00 H new ATOM 0 HG2 ARG A 74 1.304 7.745 5.710 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -0.306 7.162 5.337 1.00 0.00 H new ATOM 0 HD2 ARG A 74 0.082 5.179 6.814 1.00 0.00 H new ATOM 0 HD3 ARG A 74 1.679 5.789 7.201 1.00 0.00 H new ATOM 0 HE ARG A 74 -0.058 7.899 7.801 1.00 0.00 H new ATOM 0 HH11 ARG A 74 0.303 4.559 8.789 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -0.335 4.871 10.407 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -0.845 8.255 9.832 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -0.971 6.922 10.984 1.00 0.00 H new ATOM 1202 N MET A 75 2.598 3.475 3.512 1.00 0.00 N ATOM 1203 CA MET A 75 2.894 2.490 2.470 1.00 0.00 C ATOM 1204 C MET A 75 1.668 1.612 2.166 1.00 0.00 C ATOM 1205 O MET A 75 1.230 0.828 3.007 1.00 0.00 O ATOM 1206 CB MET A 75 4.087 1.620 2.888 1.00 0.00 C ATOM 1207 CG MET A 75 4.554 0.648 1.812 1.00 0.00 C ATOM 1208 SD MET A 75 6.019 -0.277 2.311 1.00 0.00 S ATOM 1209 CE MET A 75 6.311 -1.285 0.862 1.00 0.00 C ATOM 0 H MET A 75 1.912 3.168 4.202 1.00 0.00 H new ATOM 0 HA MET A 75 3.151 3.029 1.558 1.00 0.00 H new ATOM 0 HB2 MET A 75 4.919 2.269 3.162 1.00 0.00 H new ATOM 0 HB3 MET A 75 3.816 1.055 3.780 1.00 0.00 H new ATOM 0 HG2 MET A 75 3.748 -0.049 1.581 1.00 0.00 H new ATOM 0 HG3 MET A 75 4.770 1.199 0.897 1.00 0.00 H new ATOM 0 HE1 MET A 75 7.237 -1.845 0.989 1.00 0.00 H new ATOM 0 HE2 MET A 75 5.482 -1.980 0.729 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.392 -0.645 -0.016 1.00 0.00 H new ATOM 1219 N VAL A 76 1.120 1.757 0.963 1.00 0.00 N ATOM 1220 CA VAL A 76 -0.035 0.964 0.532 1.00 0.00 C ATOM 1221 C VAL A 76 0.373 -0.485 0.236 1.00 0.00 C ATOM 1222 O VAL A 76 1.253 -0.737 -0.590 1.00 0.00 O ATOM 1223 CB VAL A 76 -0.702 1.569 -0.728 1.00 0.00 C ATOM 1224 CG1 VAL A 76 -1.896 0.726 -1.179 1.00 0.00 C ATOM 1225 CG2 VAL A 76 -1.122 3.014 -0.475 1.00 0.00 C ATOM 0 H VAL A 76 1.457 2.419 0.264 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.753 0.979 1.352 1.00 0.00 H new ATOM 0 HB VAL A 76 0.033 1.563 -1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.344 1.175 -2.065 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.560 -0.284 -1.414 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.636 0.686 -0.379 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.588 3.420 -1.373 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.834 3.047 0.350 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.245 3.609 -0.221 1.00 0.00 H new ATOM 1235 N VAL A 77 -0.266 -1.428 0.913 1.00 0.00 N ATOM 1236 CA VAL A 77 0.033 -2.849 0.734 1.00 0.00 C ATOM 1237 C VAL A 77 -1.148 -3.589 0.093 1.00 0.00 C ATOM 1238 O VAL A 77 -2.098 -3.968 0.774 1.00 0.00 O ATOM 1239 CB VAL A 77 0.386 -3.515 2.089 1.00 0.00 C ATOM 1240 CG1 VAL A 77 0.658 -5.007 1.914 1.00 0.00 C ATOM 1241 CG2 VAL A 77 1.583 -2.819 2.733 1.00 0.00 C ATOM 0 H VAL A 77 -0.999 -1.237 1.596 1.00 0.00 H new ATOM 0 HA VAL A 77 0.893 -2.917 0.068 1.00 0.00 H new ATOM 0 HB VAL A 77 -0.473 -3.407 2.752 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.903 -5.448 2.880 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.229 -5.493 1.507 1.00 0.00 H new ATOM 0 HG13 VAL A 77 1.494 -5.146 1.229 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.816 -3.300 3.683 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.445 -2.889 2.070 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.344 -1.770 2.907 1.00 0.00 H new ATOM 1251 N VAL A 78 -1.096 -3.770 -1.224 1.00 0.00 N ATOM 1252 CA VAL A 78 -2.135 -4.519 -1.936 1.00 0.00 C ATOM 1253 C VAL A 78 -2.022 -6.020 -1.634 1.00 0.00 C ATOM 1254 O VAL A 78 -1.150 -6.708 -2.163 1.00 0.00 O ATOM 1255 CB VAL A 78 -2.055 -4.279 -3.467 1.00 0.00 C ATOM 1256 CG1 VAL A 78 -3.073 -5.142 -4.215 1.00 0.00 C ATOM 1257 CG2 VAL A 78 -2.261 -2.797 -3.782 1.00 0.00 C ATOM 0 H VAL A 78 -0.350 -3.411 -1.820 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.101 -4.158 -1.584 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.062 -4.571 -3.807 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.994 -4.953 -5.285 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.873 -6.195 -4.017 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.079 -4.894 -3.876 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -2.202 -2.642 -4.859 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.241 -2.481 -3.423 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.487 -2.209 -3.289 1.00 0.00 H new ATOM 1267 N VAL A 79 -2.897 -6.519 -0.762 1.00 0.00 N ATOM 1268 CA VAL A 79 -2.828 -7.912 -0.314 1.00 0.00 C ATOM 1269 C VAL A 79 -3.694 -8.837 -1.189 1.00 0.00 C ATOM 1270 O VAL A 79 -4.925 -8.769 -1.170 1.00 0.00 O ATOM 1271 CB VAL A 79 -3.262 -8.054 1.170 1.00 0.00 C ATOM 1272 CG1 VAL A 79 -2.922 -9.444 1.702 1.00 0.00 C ATOM 1273 CG2 VAL A 79 -2.609 -6.973 2.029 1.00 0.00 C ATOM 0 H VAL A 79 -3.661 -5.982 -0.352 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.785 -8.215 -0.410 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.343 -7.925 1.222 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -3.235 -9.522 2.743 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.442 -10.197 1.110 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.846 -9.607 1.633 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -2.926 -7.091 3.065 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -1.525 -7.066 1.969 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -2.909 -5.990 1.667 1.00 0.00 H new ATOM 1283 N SER A 80 -3.032 -9.700 -1.955 1.00 0.00 N ATOM 1284 CA SER A 80 -3.712 -10.660 -2.839 1.00 0.00 C ATOM 1285 C SER A 80 -2.967 -11.999 -2.857 1.00 0.00 C ATOM 1286 O SER A 80 -1.896 -12.127 -2.259 1.00 0.00 O ATOM 1287 CB SER A 80 -3.790 -10.107 -4.267 1.00 0.00 C ATOM 1288 OG SER A 80 -2.502 -10.032 -4.860 1.00 0.00 O ATOM 0 H SER A 80 -2.014 -9.759 -1.985 1.00 0.00 H new ATOM 0 HA SER A 80 -4.720 -10.816 -2.455 1.00 0.00 H new ATOM 0 HB2 SER A 80 -4.435 -10.744 -4.872 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.244 -9.116 -4.252 1.00 0.00 H new ATOM 0 HG SER A 80 -2.422 -9.196 -5.365 1.00 0.00 H new ATOM 1294 N ASP A 81 -3.527 -12.995 -3.550 1.00 0.00 N ATOM 1295 CA ASP A 81 -2.876 -14.305 -3.675 1.00 0.00 C ATOM 1296 C ASP A 81 -1.464 -14.148 -4.265 1.00 0.00 C ATOM 1297 O ASP A 81 -0.477 -14.643 -3.716 1.00 0.00 O ATOM 1298 CB ASP A 81 -3.690 -15.242 -4.585 1.00 0.00 C ATOM 1299 CG ASP A 81 -5.161 -15.311 -4.217 1.00 0.00 C ATOM 1300 OD1 ASP A 81 -5.933 -14.450 -4.689 1.00 0.00 O ATOM 1301 OD2 ASP A 81 -5.556 -16.228 -3.474 1.00 0.00 O ATOM 0 H ASP A 81 -4.424 -12.922 -4.031 1.00 0.00 H new ATOM 0 HA ASP A 81 -2.815 -14.738 -2.676 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -3.597 -14.905 -5.617 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.264 -16.244 -4.537 1.00 0.00 H new ATOM 1306 N ASP A 82 -1.392 -13.433 -5.385 1.00 0.00 N ATOM 1307 CA ASP A 82 -0.139 -13.230 -6.113 1.00 0.00 C ATOM 1308 C ASP A 82 0.873 -12.421 -5.286 1.00 0.00 C ATOM 1309 O ASP A 82 2.054 -12.763 -5.233 1.00 0.00 O ATOM 1310 CB ASP A 82 -0.430 -12.523 -7.439 1.00 0.00 C ATOM 1311 CG ASP A 82 -1.470 -13.266 -8.259 1.00 0.00 C ATOM 1312 OD1 ASP A 82 -2.680 -13.063 -8.017 1.00 0.00 O ATOM 1313 OD2 ASP A 82 -1.088 -14.058 -9.146 1.00 0.00 O ATOM 0 H ASP A 82 -2.198 -12.978 -5.814 1.00 0.00 H new ATOM 0 HA ASP A 82 0.307 -14.206 -6.307 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -0.779 -11.510 -7.241 1.00 0.00 H new ATOM 0 HB3 ASP A 82 0.492 -12.436 -8.014 1.00 0.00 H new ATOM 1318 N TYR A 83 0.400 -11.362 -4.627 1.00 0.00 N ATOM 1319 CA TYR A 83 1.262 -10.524 -3.782 1.00 0.00 C ATOM 1320 C TYR A 83 1.997 -11.365 -2.727 1.00 0.00 C ATOM 1321 O TYR A 83 3.218 -11.280 -2.585 1.00 0.00 O ATOM 1322 CB TYR A 83 0.425 -9.434 -3.095 1.00 0.00 C ATOM 1323 CG TYR A 83 1.152 -8.701 -1.976 1.00 0.00 C ATOM 1324 CD1 TYR A 83 2.030 -7.658 -2.248 1.00 0.00 C ATOM 1325 CD2 TYR A 83 0.957 -9.060 -0.643 1.00 0.00 C ATOM 1326 CE1 TYR A 83 2.693 -6.999 -1.229 1.00 0.00 C ATOM 1327 CE2 TYR A 83 1.614 -8.404 0.377 1.00 0.00 C ATOM 1328 CZ TYR A 83 2.481 -7.377 0.080 1.00 0.00 C ATOM 1329 OH TYR A 83 3.140 -6.723 1.097 1.00 0.00 O ATOM 0 H TYR A 83 -0.574 -11.062 -4.660 1.00 0.00 H new ATOM 0 HA TYR A 83 2.010 -10.056 -4.422 1.00 0.00 H new ATOM 0 HB2 TYR A 83 0.109 -8.708 -3.844 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -0.479 -9.888 -2.689 1.00 0.00 H new ATOM 0 HD1 TYR A 83 2.197 -7.358 -3.272 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.279 -9.866 -0.405 1.00 0.00 H new ATOM 0 HE1 TYR A 83 3.374 -6.192 -1.457 1.00 0.00 H new ATOM 0 HE2 TYR A 83 1.449 -8.695 1.404 1.00 0.00 H new ATOM 0 HH TYR A 83 3.944 -7.226 1.343 1.00 0.00 H new ATOM 1339 N LEU A 84 1.237 -12.183 -2.004 1.00 0.00 N ATOM 1340 CA LEU A 84 1.784 -13.018 -0.928 1.00 0.00 C ATOM 1341 C LEU A 84 2.724 -14.108 -1.468 1.00 0.00 C ATOM 1342 O LEU A 84 3.626 -14.569 -0.766 1.00 0.00 O ATOM 1343 CB LEU A 84 0.631 -13.663 -0.147 1.00 0.00 C ATOM 1344 CG LEU A 84 -0.366 -12.675 0.482 1.00 0.00 C ATOM 1345 CD1 LEU A 84 -1.572 -13.410 1.056 1.00 0.00 C ATOM 1346 CD2 LEU A 84 0.314 -11.833 1.559 1.00 0.00 C ATOM 0 H LEU A 84 0.232 -12.289 -2.142 1.00 0.00 H new ATOM 0 HA LEU A 84 2.370 -12.377 -0.270 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.086 -14.327 -0.817 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.051 -14.284 0.644 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.719 -12.006 -0.303 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.262 -12.689 1.495 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.077 -13.958 0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.240 -14.109 1.824 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.409 -11.141 1.991 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.702 -12.486 2.340 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.135 -11.270 1.116 1.00 0.00 H new ATOM 1358 N GLN A 85 2.506 -14.519 -2.716 1.00 0.00 N ATOM 1359 CA GLN A 85 3.301 -15.591 -3.332 1.00 0.00 C ATOM 1360 C GLN A 85 4.424 -15.048 -4.238 1.00 0.00 C ATOM 1361 O GLN A 85 5.209 -15.823 -4.790 1.00 0.00 O ATOM 1362 CB GLN A 85 2.381 -16.520 -4.139 1.00 0.00 C ATOM 1363 CG GLN A 85 1.296 -17.188 -3.297 1.00 0.00 C ATOM 1364 CD GLN A 85 0.368 -18.086 -4.105 1.00 0.00 C ATOM 1365 OE1 GLN A 85 -0.149 -19.077 -3.600 1.00 0.00 O ATOM 1366 NE2 GLN A 85 0.136 -17.744 -5.356 1.00 0.00 N ATOM 0 H GLN A 85 1.786 -14.129 -3.324 1.00 0.00 H new ATOM 0 HA GLN A 85 3.779 -16.146 -2.525 1.00 0.00 H new ATOM 0 HB2 GLN A 85 1.909 -15.947 -4.937 1.00 0.00 H new ATOM 0 HB3 GLN A 85 2.986 -17.291 -4.616 1.00 0.00 H new ATOM 0 HG2 GLN A 85 1.768 -17.779 -2.512 1.00 0.00 H new ATOM 0 HG3 GLN A 85 0.704 -16.417 -2.803 1.00 0.00 H new ATOM 0 HE21 GLN A 85 0.580 -16.914 -5.749 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -0.488 -18.309 -5.932 1.00 0.00 H new ATOM 1375 N SER A 86 4.506 -13.725 -4.393 1.00 0.00 N ATOM 1376 CA SER A 86 5.529 -13.107 -5.261 1.00 0.00 C ATOM 1377 C SER A 86 6.506 -12.224 -4.469 1.00 0.00 C ATOM 1378 O SER A 86 6.335 -12.006 -3.266 1.00 0.00 O ATOM 1379 CB SER A 86 4.868 -12.275 -6.367 1.00 0.00 C ATOM 1380 OG SER A 86 5.840 -11.671 -7.211 1.00 0.00 O ATOM 0 H SER A 86 3.884 -13.059 -3.935 1.00 0.00 H new ATOM 0 HA SER A 86 6.098 -13.923 -5.707 1.00 0.00 H new ATOM 0 HB2 SER A 86 4.213 -12.912 -6.961 1.00 0.00 H new ATOM 0 HB3 SER A 86 4.242 -11.503 -5.919 1.00 0.00 H new ATOM 0 HG SER A 86 5.532 -10.780 -7.479 1.00 0.00 H new ATOM 1386 N LYS A 87 7.522 -11.702 -5.164 1.00 0.00 N ATOM 1387 CA LYS A 87 8.581 -10.902 -4.529 1.00 0.00 C ATOM 1388 C LYS A 87 8.045 -9.613 -3.886 1.00 0.00 C ATOM 1389 O LYS A 87 8.705 -9.029 -3.028 1.00 0.00 O ATOM 1390 CB LYS A 87 9.679 -10.550 -5.545 1.00 0.00 C ATOM 1391 CG LYS A 87 10.390 -11.766 -6.134 1.00 0.00 C ATOM 1392 CD LYS A 87 11.571 -11.367 -7.018 1.00 0.00 C ATOM 1393 CE LYS A 87 12.657 -10.640 -6.230 1.00 0.00 C ATOM 1394 NZ LYS A 87 13.269 -11.502 -5.182 1.00 0.00 N ATOM 0 H LYS A 87 7.636 -11.819 -6.171 1.00 0.00 H new ATOM 0 HA LYS A 87 8.998 -11.520 -3.734 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.238 -9.971 -6.356 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.416 -9.909 -5.061 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.743 -12.406 -5.326 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.681 -12.352 -6.719 1.00 0.00 H new ATOM 0 HD2 LYS A 87 11.995 -12.258 -7.481 1.00 0.00 H new ATOM 0 HD3 LYS A 87 11.218 -10.725 -7.826 1.00 0.00 H new ATOM 0 HE2 LYS A 87 13.433 -10.299 -6.915 1.00 0.00 H new ATOM 0 HE3 LYS A 87 12.231 -9.752 -5.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 14.098 -11.022 -4.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 12.573 -11.682 -4.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 13.564 -12.405 -5.604 1.00 0.00 H new ATOM 1408 N GLU A 88 6.861 -9.170 -4.305 1.00 0.00 N ATOM 1409 CA GLU A 88 6.229 -7.976 -3.721 1.00 0.00 C ATOM 1410 C GLU A 88 6.134 -8.081 -2.189 1.00 0.00 C ATOM 1411 O GLU A 88 6.416 -7.118 -1.469 1.00 0.00 O ATOM 1412 CB GLU A 88 4.827 -7.752 -4.310 1.00 0.00 C ATOM 1413 CG GLU A 88 4.815 -7.286 -5.766 1.00 0.00 C ATOM 1414 CD GLU A 88 5.279 -8.346 -6.749 1.00 0.00 C ATOM 1415 OE1 GLU A 88 4.451 -9.179 -7.165 1.00 0.00 O ATOM 1416 OE2 GLU A 88 6.476 -8.348 -7.113 1.00 0.00 O ATOM 0 H GLU A 88 6.317 -9.615 -5.044 1.00 0.00 H new ATOM 0 HA GLU A 88 6.861 -7.124 -3.972 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.263 -8.682 -4.235 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.305 -7.013 -3.702 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.804 -6.975 -6.031 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.454 -6.408 -5.863 1.00 0.00 H new ATOM 1423 N CYS A 89 5.735 -9.256 -1.698 1.00 0.00 N ATOM 1424 CA CYS A 89 5.657 -9.501 -0.253 1.00 0.00 C ATOM 1425 C CYS A 89 7.048 -9.440 0.395 1.00 0.00 C ATOM 1426 O CYS A 89 7.214 -8.879 1.478 1.00 0.00 O ATOM 1427 CB CYS A 89 5.009 -10.860 0.035 1.00 0.00 C ATOM 1428 SG CYS A 89 4.796 -11.215 1.797 1.00 0.00 S ATOM 0 H CYS A 89 5.461 -10.051 -2.275 1.00 0.00 H new ATOM 0 HA CYS A 89 5.038 -8.715 0.180 1.00 0.00 H new ATOM 0 HB2 CYS A 89 4.035 -10.897 -0.453 1.00 0.00 H new ATOM 0 HB3 CYS A 89 5.620 -11.644 -0.412 1.00 0.00 H new ATOM 0 HG CYS A 89 4.240 -12.381 1.941 1.00 0.00 H new ATOM 1434 N ASP A 90 8.048 -10.009 -0.283 1.00 0.00 N ATOM 1435 CA ASP A 90 9.431 -9.986 0.209 1.00 0.00 C ATOM 1436 C ASP A 90 9.953 -8.546 0.326 1.00 0.00 C ATOM 1437 O ASP A 90 10.456 -8.146 1.374 1.00 0.00 O ATOM 1438 CB ASP A 90 10.339 -10.798 -0.718 1.00 0.00 C ATOM 1439 CG ASP A 90 9.950 -12.264 -0.763 1.00 0.00 C ATOM 1440 OD1 ASP A 90 10.214 -12.980 0.223 1.00 0.00 O ATOM 1441 OD2 ASP A 90 9.386 -12.707 -1.784 1.00 0.00 O ATOM 0 H ASP A 90 7.928 -10.491 -1.174 1.00 0.00 H new ATOM 0 HA ASP A 90 9.441 -10.435 1.202 1.00 0.00 H new ATOM 0 HB2 ASP A 90 10.294 -10.381 -1.724 1.00 0.00 H new ATOM 0 HB3 ASP A 90 11.372 -10.708 -0.382 1.00 0.00 H new ATOM 1446 N PHE A 91 9.821 -7.779 -0.755 1.00 0.00 N ATOM 1447 CA PHE A 91 10.201 -6.360 -0.766 1.00 0.00 C ATOM 1448 C PHE A 91 9.604 -5.610 0.437 1.00 0.00 C ATOM 1449 O PHE A 91 10.322 -4.965 1.206 1.00 0.00 O ATOM 1450 CB PHE A 91 9.736 -5.714 -2.084 1.00 0.00 C ATOM 1451 CG PHE A 91 9.711 -4.203 -2.061 1.00 0.00 C ATOM 1452 CD1 PHE A 91 10.887 -3.467 -2.077 1.00 0.00 C ATOM 1453 CD2 PHE A 91 8.503 -3.520 -2.026 1.00 0.00 C ATOM 1454 CE1 PHE A 91 10.858 -2.087 -2.056 1.00 0.00 C ATOM 1455 CE2 PHE A 91 8.471 -2.140 -2.005 1.00 0.00 C ATOM 1456 CZ PHE A 91 9.649 -1.423 -2.020 1.00 0.00 C ATOM 0 H PHE A 91 9.451 -8.117 -1.644 1.00 0.00 H new ATOM 0 HA PHE A 91 11.286 -6.293 -0.690 1.00 0.00 H new ATOM 0 HB2 PHE A 91 10.394 -6.043 -2.888 1.00 0.00 H new ATOM 0 HB3 PHE A 91 8.737 -6.079 -2.321 1.00 0.00 H new ATOM 0 HD1 PHE A 91 11.837 -3.980 -2.106 1.00 0.00 H new ATOM 0 HD2 PHE A 91 7.577 -4.075 -2.015 1.00 0.00 H new ATOM 0 HE1 PHE A 91 11.781 -1.527 -2.068 1.00 0.00 H new ATOM 0 HE2 PHE A 91 7.524 -1.622 -1.977 1.00 0.00 H new ATOM 0 HZ PHE A 91 9.625 -0.343 -2.004 1.00 0.00 H new ATOM 1466 N GLN A 92 8.286 -5.713 0.591 1.00 0.00 N ATOM 1467 CA GLN A 92 7.578 -5.083 1.708 1.00 0.00 C ATOM 1468 C GLN A 92 8.132 -5.569 3.056 1.00 0.00 C ATOM 1469 O GLN A 92 8.483 -4.762 3.914 1.00 0.00 O ATOM 1470 CB GLN A 92 6.069 -5.380 1.587 1.00 0.00 C ATOM 1471 CG GLN A 92 5.182 -4.769 2.679 1.00 0.00 C ATOM 1472 CD GLN A 92 5.193 -5.558 3.984 1.00 0.00 C ATOM 1473 OE1 GLN A 92 5.944 -5.266 4.901 1.00 0.00 O ATOM 1474 NE2 GLN A 92 4.380 -6.585 4.061 1.00 0.00 N ATOM 0 H GLN A 92 7.681 -6.230 -0.047 1.00 0.00 H new ATOM 0 HA GLN A 92 7.732 -4.005 1.666 1.00 0.00 H new ATOM 0 HB2 GLN A 92 5.723 -5.019 0.619 1.00 0.00 H new ATOM 0 HB3 GLN A 92 5.928 -6.461 1.593 1.00 0.00 H new ATOM 0 HG2 GLN A 92 5.514 -3.750 2.877 1.00 0.00 H new ATOM 0 HG3 GLN A 92 4.158 -4.705 2.311 1.00 0.00 H new ATOM 0 HE21 GLN A 92 3.763 -6.807 3.280 1.00 0.00 H new ATOM 0 HE22 GLN A 92 4.365 -7.162 4.902 1.00 0.00 H new ATOM 1483 N THR A 93 8.223 -6.888 3.225 1.00 0.00 N ATOM 1484 CA THR A 93 8.694 -7.479 4.489 1.00 0.00 C ATOM 1485 C THR A 93 10.097 -6.976 4.860 1.00 0.00 C ATOM 1486 O THR A 93 10.334 -6.562 5.994 1.00 0.00 O ATOM 1487 CB THR A 93 8.704 -9.031 4.431 1.00 0.00 C ATOM 1488 OG1 THR A 93 7.380 -9.529 4.173 1.00 0.00 O ATOM 1489 CG2 THR A 93 9.216 -9.633 5.737 1.00 0.00 C ATOM 0 H THR A 93 7.979 -7.571 2.508 1.00 0.00 H new ATOM 0 HA THR A 93 7.989 -7.161 5.257 1.00 0.00 H new ATOM 0 HB THR A 93 9.374 -9.324 3.623 1.00 0.00 H new ATOM 0 HG1 THR A 93 7.150 -9.374 3.233 1.00 0.00 H new ATOM 0 HG21 THR A 93 9.210 -10.720 5.663 1.00 0.00 H new ATOM 0 HG22 THR A 93 10.233 -9.287 5.923 1.00 0.00 H new ATOM 0 HG23 THR A 93 8.571 -9.322 6.559 1.00 0.00 H new ATOM 1497 N LYS A 94 11.017 -7.000 3.895 1.00 0.00 N ATOM 1498 CA LYS A 94 12.386 -6.502 4.103 1.00 0.00 C ATOM 1499 C LYS A 94 12.380 -5.046 4.598 1.00 0.00 C ATOM 1500 O LYS A 94 13.094 -4.687 5.540 1.00 0.00 O ATOM 1501 CB LYS A 94 13.187 -6.600 2.796 1.00 0.00 C ATOM 1502 CG LYS A 94 13.375 -8.029 2.289 1.00 0.00 C ATOM 1503 CD LYS A 94 14.137 -8.069 0.966 1.00 0.00 C ATOM 1504 CE LYS A 94 15.533 -7.474 1.099 1.00 0.00 C ATOM 1505 NZ LYS A 94 16.262 -7.457 -0.196 1.00 0.00 N ATOM 0 H LYS A 94 10.842 -7.360 2.957 1.00 0.00 H new ATOM 0 HA LYS A 94 12.856 -7.122 4.866 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.681 -6.016 2.027 1.00 0.00 H new ATOM 0 HB3 LYS A 94 14.167 -6.147 2.947 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.914 -8.611 3.036 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.400 -8.500 2.161 1.00 0.00 H new ATOM 0 HD2 LYS A 94 14.213 -9.100 0.621 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.578 -7.520 0.208 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.457 -6.457 1.485 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.104 -8.050 1.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 17.206 -7.044 -0.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 16.358 -8.429 -0.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 15.732 -6.886 -0.885 1.00 0.00 H new ATOM 1519 N PHE A 95 11.564 -4.221 3.950 1.00 0.00 N ATOM 1520 CA PHE A 95 11.390 -2.819 4.338 1.00 0.00 C ATOM 1521 C PHE A 95 10.812 -2.691 5.759 1.00 0.00 C ATOM 1522 O PHE A 95 11.377 -2.012 6.620 1.00 0.00 O ATOM 1523 CB PHE A 95 10.469 -2.123 3.323 1.00 0.00 C ATOM 1524 CG PHE A 95 9.969 -0.774 3.772 1.00 0.00 C ATOM 1525 CD1 PHE A 95 10.824 0.312 3.830 1.00 0.00 C ATOM 1526 CD2 PHE A 95 8.641 -0.596 4.135 1.00 0.00 C ATOM 1527 CE1 PHE A 95 10.369 1.546 4.243 1.00 0.00 C ATOM 1528 CE2 PHE A 95 8.180 0.639 4.548 1.00 0.00 C ATOM 1529 CZ PHE A 95 9.047 1.711 4.602 1.00 0.00 C ATOM 0 H PHE A 95 11.005 -4.500 3.144 1.00 0.00 H new ATOM 0 HA PHE A 95 12.368 -2.338 4.340 1.00 0.00 H new ATOM 0 HB2 PHE A 95 11.006 -2.005 2.382 1.00 0.00 H new ATOM 0 HB3 PHE A 95 9.613 -2.768 3.123 1.00 0.00 H new ATOM 0 HD1 PHE A 95 11.860 0.192 3.549 1.00 0.00 H new ATOM 0 HD2 PHE A 95 7.960 -1.433 4.094 1.00 0.00 H new ATOM 0 HE1 PHE A 95 11.048 2.385 4.286 1.00 0.00 H new ATOM 0 HE2 PHE A 95 7.144 0.765 4.828 1.00 0.00 H new ATOM 0 HZ PHE A 95 8.691 2.678 4.925 1.00 0.00 H new ATOM 1539 N ALA A 96 9.687 -3.355 5.994 1.00 0.00 N ATOM 1540 CA ALA A 96 8.979 -3.269 7.272 1.00 0.00 C ATOM 1541 C ALA A 96 9.816 -3.811 8.447 1.00 0.00 C ATOM 1542 O ALA A 96 9.750 -3.281 9.559 1.00 0.00 O ATOM 1543 CB ALA A 96 7.647 -3.996 7.171 1.00 0.00 C ATOM 0 H ALA A 96 9.239 -3.966 5.311 1.00 0.00 H new ATOM 0 HA ALA A 96 8.800 -2.215 7.482 1.00 0.00 H new ATOM 0 HB1 ALA A 96 7.123 -3.930 8.125 1.00 0.00 H new ATOM 0 HB2 ALA A 96 7.040 -3.537 6.391 1.00 0.00 H new ATOM 0 HB3 ALA A 96 7.822 -5.043 6.925 1.00 0.00 H new ATOM 1549 N LEU A 97 10.604 -4.858 8.202 1.00 0.00 N ATOM 1550 CA LEU A 97 11.504 -5.409 9.231 1.00 0.00 C ATOM 1551 C LEU A 97 12.575 -4.387 9.649 1.00 0.00 C ATOM 1552 O LEU A 97 13.113 -4.448 10.754 1.00 0.00 O ATOM 1553 CB LEU A 97 12.185 -6.697 8.731 1.00 0.00 C ATOM 1554 CG LEU A 97 11.276 -7.932 8.613 1.00 0.00 C ATOM 1555 CD1 LEU A 97 12.047 -9.113 8.025 1.00 0.00 C ATOM 1556 CD2 LEU A 97 10.684 -8.301 9.973 1.00 0.00 C ATOM 0 H LEU A 97 10.642 -5.344 7.306 1.00 0.00 H new ATOM 0 HA LEU A 97 10.892 -5.643 10.102 1.00 0.00 H new ATOM 0 HB2 LEU A 97 12.624 -6.498 7.753 1.00 0.00 H new ATOM 0 HB3 LEU A 97 13.006 -6.937 9.406 1.00 0.00 H new ATOM 0 HG LEU A 97 10.455 -7.687 7.939 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.387 -9.977 7.949 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.415 -8.850 7.033 1.00 0.00 H new ATOM 0 HD13 LEU A 97 12.890 -9.356 8.672 1.00 0.00 H new ATOM 0 HD21 LEU A 97 10.044 -9.177 9.866 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.490 -8.523 10.672 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.095 -7.466 10.352 1.00 0.00 H new ATOM 1568 N SER A 98 12.870 -3.442 8.760 1.00 0.00 N ATOM 1569 CA SER A 98 13.878 -2.406 9.031 1.00 0.00 C ATOM 1570 C SER A 98 13.306 -1.245 9.859 1.00 0.00 C ATOM 1571 O SER A 98 14.055 -0.404 10.352 1.00 0.00 O ATOM 1572 CB SER A 98 14.445 -1.855 7.713 1.00 0.00 C ATOM 1573 OG SER A 98 15.060 -2.876 6.937 1.00 0.00 O ATOM 0 H SER A 98 12.428 -3.367 7.844 1.00 0.00 H new ATOM 0 HA SER A 98 14.672 -2.878 9.610 1.00 0.00 H new ATOM 0 HB2 SER A 98 13.643 -1.393 7.137 1.00 0.00 H new ATOM 0 HB3 SER A 98 15.173 -1.073 7.929 1.00 0.00 H new ATOM 0 HG SER A 98 14.369 -3.436 6.527 1.00 0.00 H new ATOM 1579 N LEU A 99 11.980 -1.200 10.010 1.00 0.00 N ATOM 1580 CA LEU A 99 11.316 -0.087 10.707 1.00 0.00 C ATOM 1581 C LEU A 99 11.252 -0.301 12.235 1.00 0.00 C ATOM 1582 O LEU A 99 12.188 0.045 12.959 1.00 0.00 O ATOM 1583 CB LEU A 99 9.901 0.123 10.142 1.00 0.00 C ATOM 1584 CG LEU A 99 9.834 0.509 8.655 1.00 0.00 C ATOM 1585 CD1 LEU A 99 8.388 0.530 8.167 1.00 0.00 C ATOM 1586 CD2 LEU A 99 10.499 1.864 8.416 1.00 0.00 C ATOM 0 H LEU A 99 11.344 -1.917 9.662 1.00 0.00 H new ATOM 0 HA LEU A 99 11.917 0.806 10.532 1.00 0.00 H new ATOM 0 HB2 LEU A 99 9.330 -0.794 10.288 1.00 0.00 H new ATOM 0 HB3 LEU A 99 9.408 0.901 10.724 1.00 0.00 H new ATOM 0 HG LEU A 99 10.378 -0.245 8.085 1.00 0.00 H new ATOM 0 HD11 LEU A 99 8.364 0.805 7.113 1.00 0.00 H new ATOM 0 HD12 LEU A 99 7.947 -0.459 8.294 1.00 0.00 H new ATOM 0 HD13 LEU A 99 7.819 1.258 8.745 1.00 0.00 H new ATOM 0 HD21 LEU A 99 10.440 2.117 7.357 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.987 2.629 9.001 1.00 0.00 H new ATOM 0 HD23 LEU A 99 11.545 1.815 8.719 1.00 0.00 H new ATOM 1598 N SER A 100 10.156 -0.893 12.714 1.00 0.00 N ATOM 1599 CA SER A 100 9.906 -1.037 14.160 1.00 0.00 C ATOM 1600 C SER A 100 8.675 -1.915 14.427 1.00 0.00 C ATOM 1601 O SER A 100 7.686 -1.843 13.688 1.00 0.00 O ATOM 1602 CB SER A 100 9.680 0.341 14.805 1.00 0.00 C ATOM 1603 OG SER A 100 9.384 0.222 16.187 1.00 0.00 O ATOM 0 H SER A 100 9.422 -1.284 12.124 1.00 0.00 H new ATOM 0 HA SER A 100 10.784 -1.512 14.597 1.00 0.00 H new ATOM 0 HB2 SER A 100 10.570 0.957 14.673 1.00 0.00 H new ATOM 0 HB3 SER A 100 8.861 0.852 14.298 1.00 0.00 H new ATOM 0 HG SER A 100 9.247 1.114 16.570 1.00 0.00 H new ATOM 1609 N PRO A 101 8.714 -2.769 15.474 1.00 0.00 N ATOM 1610 CA PRO A 101 7.565 -3.607 15.865 1.00 0.00 C ATOM 1611 C PRO A 101 6.277 -2.785 16.037 1.00 0.00 C ATOM 1612 O PRO A 101 6.280 -1.733 16.686 1.00 0.00 O ATOM 1613 CB PRO A 101 8.007 -4.215 17.206 1.00 0.00 C ATOM 1614 CG PRO A 101 9.496 -4.224 17.136 1.00 0.00 C ATOM 1615 CD PRO A 101 9.879 -2.991 16.356 1.00 0.00 C ATOM 0 HA PRO A 101 7.324 -4.352 15.107 1.00 0.00 H new ATOM 0 HB2 PRO A 101 7.652 -3.621 18.048 1.00 0.00 H new ATOM 0 HB3 PRO A 101 7.609 -5.221 17.336 1.00 0.00 H new ATOM 0 HG2 PRO A 101 9.934 -4.207 18.134 1.00 0.00 H new ATOM 0 HG3 PRO A 101 9.859 -5.126 16.644 1.00 0.00 H new ATOM 0 HD2 PRO A 101 10.054 -2.139 17.012 1.00 0.00 H new ATOM 0 HD3 PRO A 101 10.793 -3.146 15.783 1.00 0.00 H new ATOM 1623 N GLY A 102 5.179 -3.262 15.457 1.00 0.00 N ATOM 1624 CA GLY A 102 3.933 -2.502 15.470 1.00 0.00 C ATOM 1625 C GLY A 102 3.941 -1.328 14.489 1.00 0.00 C ATOM 1626 O GLY A 102 3.141 -1.290 13.548 1.00 0.00 O ATOM 0 H GLY A 102 5.126 -4.161 14.977 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.105 -3.167 15.226 1.00 0.00 H new ATOM 0 HA3 GLY A 102 3.753 -2.126 16.477 1.00 0.00 H new ATOM 1630 N ALA A 103 4.866 -0.385 14.690 1.00 0.00 N ATOM 1631 CA ALA A 103 4.954 0.826 13.862 1.00 0.00 C ATOM 1632 C ALA A 103 5.015 0.508 12.359 1.00 0.00 C ATOM 1633 O ALA A 103 4.404 1.202 11.545 1.00 0.00 O ATOM 1634 CB ALA A 103 6.166 1.655 14.271 1.00 0.00 C ATOM 0 H ALA A 103 5.571 -0.436 15.425 1.00 0.00 H new ATOM 0 HA ALA A 103 4.043 1.399 14.034 1.00 0.00 H new ATOM 0 HB1 ALA A 103 6.221 2.550 13.651 1.00 0.00 H new ATOM 0 HB2 ALA A 103 6.072 1.944 15.318 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.072 1.065 14.137 1.00 0.00 H new ATOM 1640 N HIS A 104 5.748 -0.545 11.989 1.00 0.00 N ATOM 1641 CA HIS A 104 5.855 -0.933 10.577 1.00 0.00 C ATOM 1642 C HIS A 104 4.485 -1.311 9.994 1.00 0.00 C ATOM 1643 O HIS A 104 4.122 -0.859 8.916 1.00 0.00 O ATOM 1644 CB HIS A 104 6.871 -2.081 10.381 1.00 0.00 C ATOM 1645 CG HIS A 104 6.496 -3.404 10.997 1.00 0.00 C ATOM 1646 ND1 HIS A 104 7.089 -3.899 12.138 1.00 0.00 N ATOM 1647 CD2 HIS A 104 5.608 -4.352 10.605 1.00 0.00 C ATOM 1648 CE1 HIS A 104 6.585 -5.082 12.422 1.00 0.00 C ATOM 1649 NE2 HIS A 104 5.687 -5.380 11.510 1.00 0.00 N ATOM 0 H HIS A 104 6.270 -1.138 12.635 1.00 0.00 H new ATOM 0 HA HIS A 104 6.223 -0.064 10.031 1.00 0.00 H new ATOM 0 HB2 HIS A 104 7.020 -2.229 9.312 1.00 0.00 H new ATOM 0 HB3 HIS A 104 7.829 -1.767 10.796 1.00 0.00 H new ATOM 0 HD1 HIS A 104 7.809 -3.422 12.680 1.00 0.00 H new ATOM 0 HD2 HIS A 104 4.960 -4.306 9.742 1.00 0.00 H new ATOM 0 HE1 HIS A 104 6.862 -5.702 13.262 1.00 0.00 H new ATOM 0 HE2 HIS A 104 5.137 -6.238 11.480 1.00 0.00 H new ATOM 1658 N GLN A 105 3.708 -2.101 10.735 1.00 0.00 N ATOM 1659 CA GLN A 105 2.410 -2.592 10.244 1.00 0.00 C ATOM 1660 C GLN A 105 1.280 -1.572 10.482 1.00 0.00 C ATOM 1661 O GLN A 105 0.153 -1.763 10.028 1.00 0.00 O ATOM 1662 CB GLN A 105 2.080 -3.962 10.869 1.00 0.00 C ATOM 1663 CG GLN A 105 2.392 -4.066 12.358 1.00 0.00 C ATOM 1664 CD GLN A 105 2.100 -5.440 12.943 1.00 0.00 C ATOM 1665 OE1 GLN A 105 1.768 -5.566 14.115 1.00 0.00 O ATOM 1666 NE2 GLN A 105 2.227 -6.482 12.141 1.00 0.00 N ATOM 0 H GLN A 105 3.949 -2.416 11.675 1.00 0.00 H new ATOM 0 HA GLN A 105 2.489 -2.721 9.165 1.00 0.00 H new ATOM 0 HB2 GLN A 105 1.021 -4.172 10.716 1.00 0.00 H new ATOM 0 HB3 GLN A 105 2.638 -4.734 10.338 1.00 0.00 H new ATOM 0 HG2 GLN A 105 3.443 -3.827 12.519 1.00 0.00 H new ATOM 0 HG3 GLN A 105 1.809 -3.319 12.897 1.00 0.00 H new ATOM 0 HE21 GLN A 105 2.505 -6.347 11.169 1.00 0.00 H new ATOM 0 HE22 GLN A 105 2.047 -7.422 12.494 1.00 0.00 H new ATOM 1675 N LYS A 106 1.584 -0.500 11.212 1.00 0.00 N ATOM 1676 CA LYS A 106 0.701 0.673 11.272 1.00 0.00 C ATOM 1677 C LYS A 106 1.015 1.655 10.128 1.00 0.00 C ATOM 1678 O LYS A 106 0.135 2.374 9.648 1.00 0.00 O ATOM 1679 CB LYS A 106 0.819 1.375 12.633 1.00 0.00 C ATOM 1680 CG LYS A 106 0.221 0.574 13.787 1.00 0.00 C ATOM 1681 CD LYS A 106 -1.245 0.227 13.524 1.00 0.00 C ATOM 1682 CE LYS A 106 -1.893 -0.478 14.711 1.00 0.00 C ATOM 1683 NZ LYS A 106 -1.937 0.385 15.919 1.00 0.00 N ATOM 0 H LYS A 106 2.433 -0.416 11.771 1.00 0.00 H new ATOM 0 HA LYS A 106 -0.326 0.328 11.153 1.00 0.00 H new ATOM 0 HB2 LYS A 106 1.871 1.569 12.843 1.00 0.00 H new ATOM 0 HB3 LYS A 106 0.322 2.343 12.577 1.00 0.00 H new ATOM 0 HG2 LYS A 106 0.793 -0.342 13.931 1.00 0.00 H new ATOM 0 HG3 LYS A 106 0.301 1.148 14.710 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -1.798 1.139 13.300 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -1.313 -0.412 12.643 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -2.906 -0.779 14.444 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -1.339 -1.389 14.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.571 -0.039 16.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -0.981 0.471 16.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -2.290 1.328 15.659 1.00 0.00 H new ATOM 1697 N ARG A 107 2.279 1.688 9.703 1.00 0.00 N ATOM 1698 CA ARG A 107 2.681 2.443 8.510 1.00 0.00 C ATOM 1699 C ARG A 107 2.144 1.764 7.239 1.00 0.00 C ATOM 1700 O ARG A 107 1.711 2.429 6.292 1.00 0.00 O ATOM 1701 CB ARG A 107 4.214 2.561 8.437 1.00 0.00 C ATOM 1702 CG ARG A 107 4.720 3.155 7.124 1.00 0.00 C ATOM 1703 CD ARG A 107 6.240 3.285 7.084 1.00 0.00 C ATOM 1704 NE ARG A 107 6.700 3.707 5.762 1.00 0.00 N ATOM 1705 CZ ARG A 107 7.458 4.750 5.532 1.00 0.00 C ATOM 1706 NH1 ARG A 107 7.943 5.450 6.509 1.00 0.00 N ATOM 1707 NH2 ARG A 107 7.746 5.084 4.316 1.00 0.00 N ATOM 0 H ARG A 107 3.045 1.200 10.167 1.00 0.00 H new ATOM 0 HA ARG A 107 2.256 3.444 8.580 1.00 0.00 H new ATOM 0 HB2 ARG A 107 4.562 3.180 9.264 1.00 0.00 H new ATOM 0 HB3 ARG A 107 4.653 1.572 8.572 1.00 0.00 H new ATOM 0 HG2 ARG A 107 4.391 2.528 6.295 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.271 4.138 6.978 1.00 0.00 H new ATOM 0 HD2 ARG A 107 6.566 4.007 7.833 1.00 0.00 H new ATOM 0 HD3 ARG A 107 6.696 2.330 7.343 1.00 0.00 H new ATOM 0 HE ARG A 107 6.409 3.148 4.960 1.00 0.00 H new ATOM 0 HH11 ARG A 107 7.736 5.191 7.474 1.00 0.00 H new ATOM 0 HH12 ARG A 107 8.532 6.260 6.313 1.00 0.00 H new ATOM 0 HH21 ARG A 107 7.383 4.535 3.537 1.00 0.00 H new ATOM 0 HH22 ARG A 107 8.336 5.896 4.136 1.00 0.00 H new ATOM 1721 N LEU A 108 2.199 0.435 7.231 1.00 0.00 N ATOM 1722 CA LEU A 108 1.642 -0.369 6.140 1.00 0.00 C ATOM 1723 C LEU A 108 0.109 -0.355 6.179 1.00 0.00 C ATOM 1724 O LEU A 108 -0.495 -0.671 7.205 1.00 0.00 O ATOM 1725 CB LEU A 108 2.133 -1.820 6.250 1.00 0.00 C ATOM 1726 CG LEU A 108 3.656 -2.016 6.224 1.00 0.00 C ATOM 1727 CD1 LEU A 108 4.013 -3.468 6.527 1.00 0.00 C ATOM 1728 CD2 LEU A 108 4.239 -1.582 4.881 1.00 0.00 C ATOM 0 H LEU A 108 2.628 -0.115 7.975 1.00 0.00 H new ATOM 0 HA LEU A 108 1.978 0.064 5.198 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.747 -2.245 7.177 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.698 -2.393 5.431 1.00 0.00 H new ATOM 0 HG LEU A 108 4.094 -1.386 6.998 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.096 -3.589 6.504 1.00 0.00 H new ATOM 0 HD12 LEU A 108 3.639 -3.736 7.515 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.560 -4.118 5.778 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.319 -1.731 4.888 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.796 -2.177 4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.019 -0.528 4.712 1.00 0.00 H new ATOM 1740 N ILE A 109 -0.517 0.011 5.071 1.00 0.00 N ATOM 1741 CA ILE A 109 -1.977 -0.030 4.959 1.00 0.00 C ATOM 1742 C ILE A 109 -2.413 -1.159 4.009 1.00 0.00 C ATOM 1743 O ILE A 109 -2.409 -0.994 2.785 1.00 0.00 O ATOM 1744 CB ILE A 109 -2.547 1.329 4.473 1.00 0.00 C ATOM 1745 CG1 ILE A 109 -2.155 2.447 5.459 1.00 0.00 C ATOM 1746 CG2 ILE A 109 -4.068 1.257 4.313 1.00 0.00 C ATOM 1747 CD1 ILE A 109 -2.691 3.815 5.090 1.00 0.00 C ATOM 0 H ILE A 109 -0.040 0.341 4.232 1.00 0.00 H new ATOM 0 HA ILE A 109 -2.379 -0.228 5.953 1.00 0.00 H new ATOM 0 HB ILE A 109 -2.119 1.556 3.497 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -2.517 2.183 6.453 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -1.068 2.499 5.519 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -4.444 2.221 3.972 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -4.321 0.489 3.582 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -4.523 1.009 5.272 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -2.370 4.544 5.834 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -2.309 4.104 4.111 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -3.780 3.783 5.059 1.00 0.00 H new ATOM 1759 N PRO A 110 -2.755 -2.342 4.563 1.00 0.00 N ATOM 1760 CA PRO A 110 -3.167 -3.505 3.762 1.00 0.00 C ATOM 1761 C PRO A 110 -4.484 -3.277 3.007 1.00 0.00 C ATOM 1762 O PRO A 110 -5.567 -3.356 3.587 1.00 0.00 O ATOM 1763 CB PRO A 110 -3.328 -4.633 4.803 1.00 0.00 C ATOM 1764 CG PRO A 110 -2.639 -4.142 6.034 1.00 0.00 C ATOM 1765 CD PRO A 110 -2.757 -2.643 6.004 1.00 0.00 C ATOM 0 HA PRO A 110 -2.437 -3.728 2.984 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -4.380 -4.839 4.998 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -2.882 -5.562 4.447 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.103 -4.552 6.931 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.594 -4.451 6.046 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -3.672 -2.300 6.487 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.925 -2.162 6.518 1.00 0.00 H new ATOM 1773 N ILE A 111 -4.386 -2.969 1.718 1.00 0.00 N ATOM 1774 CA ILE A 111 -5.563 -2.789 0.870 1.00 0.00 C ATOM 1775 C ILE A 111 -5.967 -4.112 0.208 1.00 0.00 C ATOM 1776 O ILE A 111 -5.187 -4.722 -0.526 1.00 0.00 O ATOM 1777 CB ILE A 111 -5.315 -1.717 -0.221 1.00 0.00 C ATOM 1778 CG1 ILE A 111 -4.976 -0.365 0.430 1.00 0.00 C ATOM 1779 CG2 ILE A 111 -6.530 -1.584 -1.142 1.00 0.00 C ATOM 1780 CD1 ILE A 111 -6.069 0.176 1.330 1.00 0.00 C ATOM 0 H ILE A 111 -3.498 -2.838 1.234 1.00 0.00 H new ATOM 0 HA ILE A 111 -6.375 -2.449 1.513 1.00 0.00 H new ATOM 0 HB ILE A 111 -4.467 -2.034 -0.828 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -4.060 -0.473 1.012 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -4.771 0.364 -0.355 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -6.331 -0.826 -1.899 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -6.724 -2.540 -1.628 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -7.401 -1.292 -0.555 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -5.754 1.131 1.751 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -6.981 0.318 0.750 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -6.259 -0.531 2.137 1.00 0.00 H new ATOM 1792 N LYS A 112 -7.191 -4.550 0.473 1.00 0.00 N ATOM 1793 CA LYS A 112 -7.691 -5.823 -0.043 1.00 0.00 C ATOM 1794 C LYS A 112 -8.926 -5.609 -0.933 1.00 0.00 C ATOM 1795 O LYS A 112 -10.041 -5.422 -0.444 1.00 0.00 O ATOM 1796 CB LYS A 112 -8.003 -6.756 1.135 1.00 0.00 C ATOM 1797 CG LYS A 112 -8.632 -8.089 0.750 1.00 0.00 C ATOM 1798 CD LYS A 112 -8.733 -9.020 1.957 1.00 0.00 C ATOM 1799 CE LYS A 112 -9.700 -10.168 1.713 1.00 0.00 C ATOM 1800 NZ LYS A 112 -11.076 -9.671 1.461 1.00 0.00 N ATOM 0 H LYS A 112 -7.862 -4.040 1.047 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.926 -6.286 -0.666 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -7.079 -6.951 1.679 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -8.674 -6.239 1.821 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -9.625 -7.919 0.334 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -8.037 -8.563 -0.030 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -7.746 -9.421 2.189 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.059 -8.451 2.828 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.362 -10.756 0.860 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.704 -10.833 2.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.757 -10.441 1.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -11.286 -8.886 2.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -11.150 -9.337 0.479 1.00 0.00 H new ATOM 1814 N TYR A 113 -8.709 -5.606 -2.248 1.00 0.00 N ATOM 1815 CA TYR A 113 -9.793 -5.384 -3.212 1.00 0.00 C ATOM 1816 C TYR A 113 -10.698 -6.618 -3.347 1.00 0.00 C ATOM 1817 O TYR A 113 -11.905 -6.499 -3.554 1.00 0.00 O ATOM 1818 CB TYR A 113 -9.223 -5.042 -4.595 1.00 0.00 C ATOM 1819 CG TYR A 113 -8.234 -3.892 -4.611 1.00 0.00 C ATOM 1820 CD1 TYR A 113 -8.666 -2.568 -4.595 1.00 0.00 C ATOM 1821 CD2 TYR A 113 -6.865 -4.132 -4.664 1.00 0.00 C ATOM 1822 CE1 TYR A 113 -7.762 -1.523 -4.630 1.00 0.00 C ATOM 1823 CE2 TYR A 113 -5.958 -3.093 -4.703 1.00 0.00 C ATOM 1824 CZ TYR A 113 -6.409 -1.792 -4.686 1.00 0.00 C ATOM 1825 OH TYR A 113 -5.502 -0.761 -4.732 1.00 0.00 O ATOM 0 H TYR A 113 -7.794 -5.755 -2.673 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.386 -4.551 -2.834 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.734 -5.928 -5.000 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -10.050 -4.801 -5.263 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -9.724 -2.355 -4.555 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -6.505 -5.150 -4.675 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -8.112 -0.501 -4.614 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -4.899 -3.299 -4.747 1.00 0.00 H new ATOM 0 HH TYR A 113 -5.790 -0.045 -4.128 1.00 0.00 H new ATOM 1835 N LYS A 114 -10.096 -7.796 -3.219 1.00 0.00 N ATOM 1836 CA LYS A 114 -10.768 -9.060 -3.540 1.00 0.00 C ATOM 1837 C LYS A 114 -11.074 -9.891 -2.283 1.00 0.00 C ATOM 1838 O LYS A 114 -10.791 -9.469 -1.161 1.00 0.00 O ATOM 1839 CB LYS A 114 -9.881 -9.847 -4.513 1.00 0.00 C ATOM 1840 CG LYS A 114 -8.494 -10.175 -3.953 1.00 0.00 C ATOM 1841 CD LYS A 114 -7.432 -10.226 -5.050 1.00 0.00 C ATOM 1842 CE LYS A 114 -7.800 -11.187 -6.174 1.00 0.00 C ATOM 1843 NZ LYS A 114 -6.821 -11.120 -7.290 1.00 0.00 N ATOM 0 H LYS A 114 -9.136 -7.906 -2.893 1.00 0.00 H new ATOM 0 HA LYS A 114 -11.730 -8.839 -4.002 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -10.385 -10.776 -4.780 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.766 -9.272 -5.432 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -8.215 -9.425 -3.213 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -8.529 -11.135 -3.437 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -7.292 -9.227 -5.462 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -6.479 -10.528 -4.615 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -7.841 -12.205 -5.785 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -8.796 -10.948 -6.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.247 -11.520 -8.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -6.559 -10.129 -7.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.971 -11.664 -7.039 1.00 0.00 H new ATOM 1857 N ALA A 115 -11.641 -11.080 -2.479 1.00 0.00 N ATOM 1858 CA ALA A 115 -12.064 -11.936 -1.361 1.00 0.00 C ATOM 1859 C ALA A 115 -11.018 -13.010 -1.012 1.00 0.00 C ATOM 1860 O ALA A 115 -11.348 -14.027 -0.400 1.00 0.00 O ATOM 1861 CB ALA A 115 -13.403 -12.589 -1.693 1.00 0.00 C ATOM 0 H ALA A 115 -11.820 -11.477 -3.401 1.00 0.00 H new ATOM 0 HA ALA A 115 -12.169 -11.300 -0.482 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -13.714 -13.223 -0.863 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -14.153 -11.816 -1.861 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -13.299 -13.195 -2.593 1.00 0.00 H new ATOM 1867 N MET A 116 -9.761 -12.774 -1.389 1.00 0.00 N ATOM 1868 CA MET A 116 -8.665 -13.708 -1.084 1.00 0.00 C ATOM 1869 C MET A 116 -8.578 -14.032 0.416 1.00 0.00 C ATOM 1870 O MET A 116 -8.691 -13.146 1.267 1.00 0.00 O ATOM 1871 CB MET A 116 -7.326 -13.138 -1.588 1.00 0.00 C ATOM 1872 CG MET A 116 -6.095 -13.923 -1.158 1.00 0.00 C ATOM 1873 SD MET A 116 -5.633 -13.621 0.556 1.00 0.00 S ATOM 1874 CE MET A 116 -5.062 -11.933 0.446 1.00 0.00 C ATOM 0 H MET A 116 -9.471 -11.944 -1.907 1.00 0.00 H new ATOM 0 HA MET A 116 -8.879 -14.642 -1.603 1.00 0.00 H new ATOM 0 HB2 MET A 116 -7.352 -13.098 -2.677 1.00 0.00 H new ATOM 0 HB3 MET A 116 -7.228 -12.112 -1.233 1.00 0.00 H new ATOM 0 HG2 MET A 116 -6.283 -14.988 -1.296 1.00 0.00 H new ATOM 0 HG3 MET A 116 -5.259 -13.661 -1.806 1.00 0.00 H new ATOM 0 HE1 MET A 116 -4.640 -11.629 1.404 1.00 0.00 H new ATOM 0 HE2 MET A 116 -4.298 -11.857 -0.328 1.00 0.00 H new ATOM 0 HE3 MET A 116 -5.899 -11.281 0.195 1.00 0.00 H new ATOM 1884 N LYS A 117 -8.388 -15.315 0.724 1.00 0.00 N ATOM 1885 CA LYS A 117 -8.244 -15.783 2.107 1.00 0.00 C ATOM 1886 C LYS A 117 -6.921 -16.546 2.302 1.00 0.00 C ATOM 1887 O LYS A 117 -6.807 -17.394 3.191 1.00 0.00 O ATOM 1888 CB LYS A 117 -9.439 -16.673 2.492 1.00 0.00 C ATOM 1889 CG LYS A 117 -10.780 -15.940 2.475 1.00 0.00 C ATOM 1890 CD LYS A 117 -10.808 -14.782 3.471 1.00 0.00 C ATOM 1891 CE LYS A 117 -12.080 -13.947 3.344 1.00 0.00 C ATOM 1892 NZ LYS A 117 -13.310 -14.737 3.620 1.00 0.00 N ATOM 0 H LYS A 117 -8.329 -16.058 0.027 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.226 -14.911 2.761 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.488 -17.518 1.805 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.271 -17.082 3.488 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -10.974 -15.561 1.472 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -11.580 -16.641 2.711 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.732 -15.174 4.485 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.939 -14.145 3.310 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -12.029 -13.106 4.036 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -12.138 -13.530 2.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.141 -14.114 3.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.402 -15.494 2.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -13.248 -15.156 4.570 1.00 0.00 H new ATOM 1906 N LYS A 118 -5.923 -16.229 1.469 1.00 0.00 N ATOM 1907 CA LYS A 118 -4.568 -16.806 1.609 1.00 0.00 C ATOM 1908 C LYS A 118 -3.977 -16.568 3.014 1.00 0.00 C ATOM 1909 O LYS A 118 -4.487 -15.758 3.791 1.00 0.00 O ATOM 1910 CB LYS A 118 -3.621 -16.198 0.562 1.00 0.00 C ATOM 1911 CG LYS A 118 -3.780 -16.759 -0.847 1.00 0.00 C ATOM 1912 CD LYS A 118 -3.170 -18.152 -0.974 1.00 0.00 C ATOM 1913 CE LYS A 118 -3.207 -18.663 -2.411 1.00 0.00 C ATOM 1914 NZ LYS A 118 -2.479 -19.951 -2.560 1.00 0.00 N ATOM 0 H LYS A 118 -6.021 -15.578 0.690 1.00 0.00 H new ATOM 0 HA LYS A 118 -4.663 -17.881 1.455 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -3.782 -15.120 0.529 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -2.593 -16.357 0.887 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -4.838 -16.801 -1.104 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -3.304 -16.087 -1.562 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -2.138 -18.129 -0.624 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -3.710 -18.845 -0.329 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -4.243 -18.793 -2.723 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -2.766 -17.918 -3.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -3.111 -20.660 -2.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -1.652 -19.813 -3.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -2.164 -20.282 -1.626 1.00 0.00 H new ATOM 1928 N GLU A 119 -2.892 -17.274 3.336 1.00 0.00 N ATOM 1929 CA GLU A 119 -2.212 -17.085 4.623 1.00 0.00 C ATOM 1930 C GLU A 119 -1.370 -15.802 4.625 1.00 0.00 C ATOM 1931 O GLU A 119 -0.804 -15.412 3.603 1.00 0.00 O ATOM 1932 CB GLU A 119 -1.331 -18.291 4.964 1.00 0.00 C ATOM 1933 CG GLU A 119 -2.105 -19.595 5.116 1.00 0.00 C ATOM 1934 CD GLU A 119 -1.277 -20.689 5.767 1.00 0.00 C ATOM 1935 OE1 GLU A 119 -0.461 -21.325 5.071 1.00 0.00 O ATOM 1936 OE2 GLU A 119 -1.439 -20.915 6.988 1.00 0.00 O ATOM 0 H GLU A 119 -2.466 -17.976 2.731 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.984 -16.992 5.386 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -0.581 -18.414 4.183 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.795 -18.087 5.891 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.999 -19.416 5.713 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -2.440 -19.932 4.135 1.00 0.00 H new ATOM 1943 N PHE A 120 -1.274 -15.162 5.783 1.00 0.00 N ATOM 1944 CA PHE A 120 -0.615 -13.858 5.896 1.00 0.00 C ATOM 1945 C PHE A 120 0.762 -13.959 6.571 1.00 0.00 C ATOM 1946 O PHE A 120 0.942 -14.708 7.534 1.00 0.00 O ATOM 1947 CB PHE A 120 -1.506 -12.895 6.688 1.00 0.00 C ATOM 1948 CG PHE A 120 -2.823 -12.606 6.017 1.00 0.00 C ATOM 1949 CD1 PHE A 120 -3.906 -13.456 6.181 1.00 0.00 C ATOM 1950 CD2 PHE A 120 -2.973 -11.484 5.216 1.00 0.00 C ATOM 1951 CE1 PHE A 120 -5.111 -13.194 5.560 1.00 0.00 C ATOM 1952 CE2 PHE A 120 -4.175 -11.217 4.595 1.00 0.00 C ATOM 1953 CZ PHE A 120 -5.247 -12.074 4.765 1.00 0.00 C ATOM 0 H PHE A 120 -1.644 -15.522 6.663 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.460 -13.482 4.885 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -1.695 -13.316 7.675 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -0.970 -11.958 6.839 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -3.806 -14.334 6.802 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.139 -10.812 5.077 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -5.946 -13.865 5.696 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -4.279 -10.338 3.976 1.00 0.00 H new ATOM 0 HZ PHE A 120 -6.188 -11.867 4.277 1.00 0.00 H new ATOM 1963 N PRO A 121 1.756 -13.200 6.070 1.00 0.00 N ATOM 1964 CA PRO A 121 3.074 -13.098 6.715 1.00 0.00 C ATOM 1965 C PRO A 121 3.002 -12.300 8.027 1.00 0.00 C ATOM 1966 O PRO A 121 2.332 -11.264 8.095 1.00 0.00 O ATOM 1967 CB PRO A 121 3.922 -12.360 5.669 1.00 0.00 C ATOM 1968 CG PRO A 121 2.938 -11.559 4.886 1.00 0.00 C ATOM 1969 CD PRO A 121 1.681 -12.389 4.837 1.00 0.00 C ATOM 0 HA PRO A 121 3.482 -14.070 6.993 1.00 0.00 H new ATOM 0 HB2 PRO A 121 4.667 -11.720 6.142 1.00 0.00 H new ATOM 0 HB3 PRO A 121 4.462 -13.060 5.031 1.00 0.00 H new ATOM 0 HG2 PRO A 121 2.752 -10.595 5.360 1.00 0.00 H new ATOM 0 HG3 PRO A 121 3.311 -11.354 3.882 1.00 0.00 H new ATOM 0 HD2 PRO A 121 0.788 -11.764 4.821 1.00 0.00 H new ATOM 0 HD3 PRO A 121 1.648 -13.016 3.946 1.00 0.00 H new ATOM 1977 N SER A 122 3.705 -12.772 9.057 1.00 0.00 N ATOM 1978 CA SER A 122 3.659 -12.154 10.397 1.00 0.00 C ATOM 1979 C SER A 122 4.008 -10.655 10.376 1.00 0.00 C ATOM 1980 O SER A 122 3.730 -9.933 11.335 1.00 0.00 O ATOM 1981 CB SER A 122 4.615 -12.877 11.355 1.00 0.00 C ATOM 1982 OG SER A 122 4.268 -14.247 11.504 1.00 0.00 O ATOM 0 H SER A 122 4.318 -13.585 8.995 1.00 0.00 H new ATOM 0 HA SER A 122 2.630 -12.252 10.744 1.00 0.00 H new ATOM 0 HB2 SER A 122 5.635 -12.798 10.980 1.00 0.00 H new ATOM 0 HB3 SER A 122 4.594 -12.388 12.329 1.00 0.00 H new ATOM 0 HG SER A 122 4.897 -14.679 12.119 1.00 0.00 H new ATOM 1988 N ILE A 123 4.611 -10.194 9.285 1.00 0.00 N ATOM 1989 CA ILE A 123 5.026 -8.795 9.149 1.00 0.00 C ATOM 1990 C ILE A 123 3.816 -7.833 9.149 1.00 0.00 C ATOM 1991 O ILE A 123 3.857 -6.766 9.770 1.00 0.00 O ATOM 1992 CB ILE A 123 5.874 -8.593 7.864 1.00 0.00 C ATOM 1993 CG1 ILE A 123 6.495 -7.189 7.842 1.00 0.00 C ATOM 1994 CG2 ILE A 123 5.043 -8.839 6.604 1.00 0.00 C ATOM 1995 CD1 ILE A 123 7.453 -6.935 8.987 1.00 0.00 C ATOM 0 H ILE A 123 4.826 -10.772 8.473 1.00 0.00 H new ATOM 0 HA ILE A 123 5.640 -8.556 10.017 1.00 0.00 H new ATOM 0 HB ILE A 123 6.680 -9.327 7.877 1.00 0.00 H new ATOM 0 HG12 ILE A 123 7.023 -7.048 6.899 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.697 -6.447 7.874 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.666 -8.689 5.722 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.664 -9.861 6.612 1.00 0.00 H new ATOM 0 HG23 ILE A 123 4.205 -8.142 6.579 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.854 -5.924 8.909 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.925 -7.043 9.934 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.271 -7.654 8.943 1.00 0.00 H new ATOM 2007 N LEU A 124 2.741 -8.222 8.463 1.00 0.00 N ATOM 2008 CA LEU A 124 1.497 -7.435 8.440 1.00 0.00 C ATOM 2009 C LEU A 124 0.330 -8.246 9.025 1.00 0.00 C ATOM 2010 O LEU A 124 -0.540 -7.701 9.698 1.00 0.00 O ATOM 2011 CB LEU A 124 1.185 -6.953 7.004 1.00 0.00 C ATOM 2012 CG LEU A 124 1.052 -8.045 5.914 1.00 0.00 C ATOM 2013 CD1 LEU A 124 -0.346 -8.664 5.897 1.00 0.00 C ATOM 2014 CD2 LEU A 124 1.393 -7.477 4.538 1.00 0.00 C ATOM 0 H LEU A 124 2.702 -9.080 7.912 1.00 0.00 H new ATOM 0 HA LEU A 124 1.633 -6.553 9.066 1.00 0.00 H new ATOM 0 HB2 LEU A 124 0.255 -6.385 7.031 1.00 0.00 H new ATOM 0 HB3 LEU A 124 1.971 -6.263 6.699 1.00 0.00 H new ATOM 0 HG LEU A 124 1.763 -8.834 6.159 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.397 -9.425 5.118 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -0.554 -9.120 6.865 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -1.085 -7.888 5.696 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.293 -8.260 3.786 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.712 -6.659 4.303 1.00 0.00 H new ATOM 0 HD23 LEU A 124 2.418 -7.106 4.541 1.00 0.00 H new ATOM 2026 N ARG A 125 0.336 -9.551 8.738 1.00 0.00 N ATOM 2027 CA ARG A 125 -0.619 -10.536 9.286 1.00 0.00 C ATOM 2028 C ARG A 125 -2.028 -9.980 9.591 1.00 0.00 C ATOM 2029 O ARG A 125 -2.575 -10.214 10.672 1.00 0.00 O ATOM 2030 CB ARG A 125 -0.014 -11.214 10.528 1.00 0.00 C ATOM 2031 CG ARG A 125 0.331 -10.262 11.672 1.00 0.00 C ATOM 2032 CD ARG A 125 0.970 -11.001 12.844 1.00 0.00 C ATOM 2033 NE ARG A 125 0.272 -12.248 13.155 1.00 0.00 N ATOM 2034 CZ ARG A 125 0.708 -13.141 13.998 1.00 0.00 C ATOM 2035 NH1 ARG A 125 1.782 -12.931 14.690 1.00 0.00 N ATOM 2036 NH2 ARG A 125 0.057 -14.244 14.151 1.00 0.00 N ATOM 0 H ARG A 125 1.018 -9.968 8.104 1.00 0.00 H new ATOM 0 HA ARG A 125 -0.779 -11.268 8.494 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -0.717 -11.962 10.895 1.00 0.00 H new ATOM 0 HB3 ARG A 125 0.890 -11.745 10.231 1.00 0.00 H new ATOM 0 HG2 ARG A 125 1.013 -9.491 11.312 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -0.573 -9.755 12.010 1.00 0.00 H new ATOM 0 HD2 ARG A 125 2.012 -11.218 12.610 1.00 0.00 H new ATOM 0 HD3 ARG A 125 0.968 -10.356 13.723 1.00 0.00 H new ATOM 0 HE ARG A 125 -0.613 -12.430 12.682 1.00 0.00 H new ATOM 0 HH11 ARG A 125 2.298 -12.058 14.579 1.00 0.00 H new ATOM 0 HH12 ARG A 125 2.112 -13.638 15.346 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -0.793 -14.413 13.614 1.00 0.00 H new ATOM 0 HH22 ARG A 125 0.393 -14.947 14.809 1.00 0.00 H new ATOM 2050 N PHE A 126 -2.622 -9.268 8.626 1.00 0.00 N ATOM 2051 CA PHE A 126 -4.023 -8.823 8.728 1.00 0.00 C ATOM 2052 C PHE A 126 -4.264 -7.905 9.953 1.00 0.00 C ATOM 2053 O PHE A 126 -5.360 -7.889 10.517 1.00 0.00 O ATOM 2054 CB PHE A 126 -4.931 -10.070 8.794 1.00 0.00 C ATOM 2055 CG PHE A 126 -6.247 -9.937 8.067 1.00 0.00 C ATOM 2056 CD1 PHE A 126 -6.274 -9.655 6.709 1.00 0.00 C ATOM 2057 CD2 PHE A 126 -7.451 -10.117 8.731 1.00 0.00 C ATOM 2058 CE1 PHE A 126 -7.470 -9.554 6.029 1.00 0.00 C ATOM 2059 CE2 PHE A 126 -8.651 -10.021 8.054 1.00 0.00 C ATOM 2060 CZ PHE A 126 -8.661 -9.740 6.703 1.00 0.00 C ATOM 0 H PHE A 126 -2.156 -8.986 7.763 1.00 0.00 H new ATOM 0 HA PHE A 126 -4.262 -8.227 7.847 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -4.388 -10.919 8.380 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -5.132 -10.300 9.840 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -5.345 -9.512 6.176 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -7.450 -10.335 9.789 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -7.475 -9.330 4.972 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -9.582 -10.166 8.582 1.00 0.00 H new ATOM 0 HZ PHE A 126 -9.599 -9.666 6.173 1.00 0.00 H new ATOM 2070 N ILE A 127 -3.242 -7.134 10.345 1.00 0.00 N ATOM 2071 CA ILE A 127 -3.344 -6.215 11.498 1.00 0.00 C ATOM 2072 C ILE A 127 -4.521 -5.227 11.364 1.00 0.00 C ATOM 2073 O ILE A 127 -5.370 -5.132 12.254 1.00 0.00 O ATOM 2074 CB ILE A 127 -2.022 -5.419 11.714 1.00 0.00 C ATOM 2075 CG1 ILE A 127 -2.201 -4.358 12.820 1.00 0.00 C ATOM 2076 CG2 ILE A 127 -1.546 -4.773 10.412 1.00 0.00 C ATOM 2077 CD1 ILE A 127 -0.934 -3.616 13.178 1.00 0.00 C ATOM 0 H ILE A 127 -2.332 -7.125 9.884 1.00 0.00 H new ATOM 0 HA ILE A 127 -3.528 -6.847 12.367 1.00 0.00 H new ATOM 0 HB ILE A 127 -1.254 -6.123 12.035 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -2.952 -3.637 12.498 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -2.589 -4.844 13.715 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.622 -4.225 10.595 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -1.367 -5.547 9.666 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -2.309 -4.086 10.046 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -1.147 -2.890 13.962 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -0.186 -4.324 13.533 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.554 -3.098 12.297 1.00 0.00 H new ATOM 2089 N THR A 128 -4.560 -4.484 10.263 1.00 0.00 N ATOM 2090 CA THR A 128 -5.640 -3.521 10.004 1.00 0.00 C ATOM 2091 C THR A 128 -5.882 -3.393 8.495 1.00 0.00 C ATOM 2092 O THR A 128 -5.320 -2.522 7.832 1.00 0.00 O ATOM 2093 CB THR A 128 -5.333 -2.119 10.606 1.00 0.00 C ATOM 2094 OG1 THR A 128 -5.108 -2.224 12.023 1.00 0.00 O ATOM 2095 CG2 THR A 128 -6.477 -1.139 10.356 1.00 0.00 C ATOM 0 H THR A 128 -3.854 -4.526 9.528 1.00 0.00 H new ATOM 0 HA THR A 128 -6.537 -3.902 10.492 1.00 0.00 H new ATOM 0 HB THR A 128 -4.437 -1.742 10.113 1.00 0.00 H new ATOM 0 HG1 THR A 128 -4.914 -1.336 12.390 1.00 0.00 H new ATOM 0 HG21 THR A 128 -6.228 -0.171 10.790 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.632 -1.027 9.283 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.389 -1.519 10.816 1.00 0.00 H new ATOM 2103 N VAL A 129 -6.697 -4.291 7.956 1.00 0.00 N ATOM 2104 CA VAL A 129 -6.943 -4.350 6.511 1.00 0.00 C ATOM 2105 C VAL A 129 -8.114 -3.447 6.088 1.00 0.00 C ATOM 2106 O VAL A 129 -9.085 -3.273 6.829 1.00 0.00 O ATOM 2107 CB VAL A 129 -7.233 -5.804 6.064 1.00 0.00 C ATOM 2108 CG1 VAL A 129 -8.507 -6.326 6.718 1.00 0.00 C ATOM 2109 CG2 VAL A 129 -7.317 -5.907 4.541 1.00 0.00 C ATOM 0 H VAL A 129 -7.203 -4.993 8.496 1.00 0.00 H new ATOM 0 HA VAL A 129 -6.038 -3.989 6.023 1.00 0.00 H new ATOM 0 HB VAL A 129 -6.402 -6.429 6.393 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -8.692 -7.349 6.390 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -8.393 -6.307 7.802 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -9.348 -5.695 6.430 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -7.521 -6.939 4.257 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -8.119 -5.265 4.177 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -6.371 -5.591 4.102 1.00 0.00 H new ATOM 2119 N CYS A 130 -8.008 -2.871 4.896 1.00 0.00 N ATOM 2120 CA CYS A 130 -9.081 -2.057 4.319 1.00 0.00 C ATOM 2121 C CYS A 130 -9.654 -2.738 3.066 1.00 0.00 C ATOM 2122 O CYS A 130 -9.016 -2.759 2.011 1.00 0.00 O ATOM 2123 CB CYS A 130 -8.556 -0.657 3.971 1.00 0.00 C ATOM 2124 SG CYS A 130 -7.870 0.247 5.381 1.00 0.00 S ATOM 0 H CYS A 130 -7.183 -2.952 4.302 1.00 0.00 H new ATOM 0 HA CYS A 130 -9.878 -1.958 5.056 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -7.787 -0.749 3.204 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -9.369 -0.073 3.539 1.00 0.00 H new ATOM 0 HG CYS A 130 -7.452 1.413 4.987 1.00 0.00 H new ATOM 2130 N ASP A 131 -10.849 -3.311 3.196 1.00 0.00 N ATOM 2131 CA ASP A 131 -11.497 -4.018 2.086 1.00 0.00 C ATOM 2132 C ASP A 131 -12.219 -3.051 1.132 1.00 0.00 C ATOM 2133 O ASP A 131 -12.892 -2.115 1.568 1.00 0.00 O ATOM 2134 CB ASP A 131 -12.505 -5.044 2.621 1.00 0.00 C ATOM 2135 CG ASP A 131 -11.842 -6.200 3.348 1.00 0.00 C ATOM 2136 OD1 ASP A 131 -11.540 -6.063 4.552 1.00 0.00 O ATOM 2137 OD2 ASP A 131 -11.637 -7.265 2.721 1.00 0.00 O ATOM 0 H ASP A 131 -11.392 -3.301 4.060 1.00 0.00 H new ATOM 0 HA ASP A 131 -10.710 -4.526 1.528 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -13.199 -4.545 3.298 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -13.094 -5.434 1.791 1.00 0.00 H new ATOM 2142 N TYR A 132 -12.075 -3.292 -0.169 1.00 0.00 N ATOM 2143 CA TYR A 132 -12.818 -2.537 -1.188 1.00 0.00 C ATOM 2144 C TYR A 132 -14.249 -3.091 -1.338 1.00 0.00 C ATOM 2145 O TYR A 132 -15.088 -2.515 -2.032 1.00 0.00 O ATOM 2146 CB TYR A 132 -12.067 -2.596 -2.530 1.00 0.00 C ATOM 2147 CG TYR A 132 -12.779 -1.911 -3.686 1.00 0.00 C ATOM 2148 CD1 TYR A 132 -13.180 -0.581 -3.596 1.00 0.00 C ATOM 2149 CD2 TYR A 132 -13.048 -2.598 -4.867 1.00 0.00 C ATOM 2150 CE1 TYR A 132 -13.829 0.039 -4.647 1.00 0.00 C ATOM 2151 CE2 TYR A 132 -13.694 -1.980 -5.921 1.00 0.00 C ATOM 2152 CZ TYR A 132 -14.082 -0.663 -5.806 1.00 0.00 C ATOM 2153 OH TYR A 132 -14.731 -0.049 -6.852 1.00 0.00 O ATOM 0 H TYR A 132 -11.451 -4.004 -0.548 1.00 0.00 H new ATOM 0 HA TYR A 132 -12.893 -1.496 -0.873 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -11.086 -2.138 -2.403 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -11.900 -3.641 -2.792 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -12.981 -0.025 -2.692 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -12.747 -3.631 -4.961 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -14.137 1.071 -4.560 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -13.894 -2.527 -6.831 1.00 0.00 H new ATOM 0 HH TYR A 132 -14.829 -0.683 -7.593 1.00 0.00 H new ATOM 2163 N THR A 133 -14.514 -4.215 -0.676 1.00 0.00 N ATOM 2164 CA THR A 133 -15.842 -4.839 -0.691 1.00 0.00 C ATOM 2165 C THR A 133 -16.826 -4.084 0.216 1.00 0.00 C ATOM 2166 O THR A 133 -16.475 -3.069 0.819 1.00 0.00 O ATOM 2167 CB THR A 133 -15.778 -6.321 -0.240 1.00 0.00 C ATOM 2168 OG1 THR A 133 -15.368 -6.408 1.135 1.00 0.00 O ATOM 2169 CG2 THR A 133 -14.809 -7.117 -1.110 1.00 0.00 C ATOM 0 H THR A 133 -13.824 -4.718 -0.118 1.00 0.00 H new ATOM 0 HA THR A 133 -16.195 -4.794 -1.721 1.00 0.00 H new ATOM 0 HB THR A 133 -16.776 -6.746 -0.349 1.00 0.00 H new ATOM 0 HG1 THR A 133 -16.130 -6.205 1.717 1.00 0.00 H new ATOM 0 HG21 THR A 133 -14.783 -8.153 -0.772 1.00 0.00 H new ATOM 0 HG22 THR A 133 -15.139 -7.082 -2.148 1.00 0.00 H new ATOM 0 HG23 THR A 133 -13.811 -6.685 -1.032 1.00 0.00 H new ATOM 2177 N ASN A 134 -18.051 -4.609 0.318 1.00 0.00 N ATOM 2178 CA ASN A 134 -19.137 -3.976 1.084 1.00 0.00 C ATOM 2179 C ASN A 134 -19.673 -2.727 0.358 1.00 0.00 C ATOM 2180 O ASN A 134 -19.052 -1.664 0.385 1.00 0.00 O ATOM 2181 CB ASN A 134 -18.695 -3.615 2.514 1.00 0.00 C ATOM 2182 CG ASN A 134 -18.258 -4.823 3.327 1.00 0.00 C ATOM 2183 OD1 ASN A 134 -17.710 -5.790 2.803 1.00 0.00 O ATOM 2184 ND2 ASN A 134 -18.501 -4.782 4.620 1.00 0.00 N ATOM 0 H ASN A 134 -18.321 -5.486 -0.128 1.00 0.00 H new ATOM 0 HA ASN A 134 -19.942 -4.707 1.159 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -17.873 -2.901 2.464 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -19.518 -3.118 3.027 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -18.233 -5.566 5.214 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -18.957 -3.966 5.028 1.00 0.00 H new ATOM 2191 N PRO A 135 -20.839 -2.848 -0.313 1.00 0.00 N ATOM 2192 CA PRO A 135 -21.454 -1.746 -1.084 1.00 0.00 C ATOM 2193 C PRO A 135 -21.534 -0.398 -0.333 1.00 0.00 C ATOM 2194 O PRO A 135 -21.630 0.659 -0.961 1.00 0.00 O ATOM 2195 CB PRO A 135 -22.860 -2.280 -1.381 1.00 0.00 C ATOM 2196 CG PRO A 135 -22.690 -3.759 -1.431 1.00 0.00 C ATOM 2197 CD PRO A 135 -21.645 -4.087 -0.398 1.00 0.00 C ATOM 0 HA PRO A 135 -20.856 -1.507 -1.964 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -23.568 -1.987 -0.606 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -23.242 -1.891 -2.325 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -23.629 -4.268 -1.213 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -22.375 -4.083 -2.423 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -22.095 -4.339 0.562 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -21.038 -4.941 -0.699 1.00 0.00 H new ATOM 2205 N CYS A 136 -21.490 -0.430 0.998 1.00 0.00 N ATOM 2206 CA CYS A 136 -21.570 0.799 1.808 1.00 0.00 C ATOM 2207 C CYS A 136 -20.229 1.557 1.881 1.00 0.00 C ATOM 2208 O CYS A 136 -20.147 2.620 2.498 1.00 0.00 O ATOM 2209 CB CYS A 136 -22.056 0.471 3.226 1.00 0.00 C ATOM 2210 SG CYS A 136 -23.738 -0.196 3.295 1.00 0.00 S ATOM 0 H CYS A 136 -21.400 -1.287 1.543 1.00 0.00 H new ATOM 0 HA CYS A 136 -22.285 1.454 1.311 1.00 0.00 H new ATOM 0 HB2 CYS A 136 -21.372 -0.249 3.675 1.00 0.00 H new ATOM 0 HB3 CYS A 136 -22.010 1.375 3.833 1.00 0.00 H new ATOM 0 HG CYS A 136 -24.056 -0.443 4.531 1.00 0.00 H new ATOM 2216 N THR A 137 -19.182 1.018 1.258 1.00 0.00 N ATOM 2217 CA THR A 137 -17.858 1.673 1.260 1.00 0.00 C ATOM 2218 C THR A 137 -17.108 1.453 -0.067 1.00 0.00 C ATOM 2219 O THR A 137 -15.911 1.176 -0.083 1.00 0.00 O ATOM 2220 CB THR A 137 -16.982 1.180 2.448 1.00 0.00 C ATOM 2221 OG1 THR A 137 -15.679 1.793 2.408 1.00 0.00 O ATOM 2222 CG2 THR A 137 -16.833 -0.339 2.438 1.00 0.00 C ATOM 0 H THR A 137 -19.215 0.136 0.747 1.00 0.00 H new ATOM 0 HA THR A 137 -18.040 2.741 1.378 1.00 0.00 H new ATOM 0 HB THR A 137 -17.489 1.472 3.368 1.00 0.00 H new ATOM 0 HG1 THR A 137 -15.180 1.450 1.638 1.00 0.00 H new ATOM 0 HG21 THR A 137 -16.216 -0.650 3.281 1.00 0.00 H new ATOM 0 HG22 THR A 137 -17.817 -0.802 2.519 1.00 0.00 H new ATOM 0 HG23 THR A 137 -16.360 -0.652 1.507 1.00 0.00 H new ATOM 2230 N LYS A 138 -17.814 1.607 -1.184 1.00 0.00 N ATOM 2231 CA LYS A 138 -17.202 1.449 -2.513 1.00 0.00 C ATOM 2232 C LYS A 138 -16.553 2.758 -3.001 1.00 0.00 C ATOM 2233 O LYS A 138 -15.538 2.737 -3.697 1.00 0.00 O ATOM 2234 CB LYS A 138 -18.255 0.985 -3.533 1.00 0.00 C ATOM 2235 CG LYS A 138 -18.927 -0.341 -3.181 1.00 0.00 C ATOM 2236 CD LYS A 138 -17.928 -1.493 -3.082 1.00 0.00 C ATOM 2237 CE LYS A 138 -17.177 -1.720 -4.391 1.00 0.00 C ATOM 2238 NZ LYS A 138 -18.087 -2.075 -5.512 1.00 0.00 N ATOM 0 H LYS A 138 -18.807 1.840 -1.202 1.00 0.00 H new ATOM 0 HA LYS A 138 -16.420 0.695 -2.424 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -19.021 1.755 -3.623 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -17.781 0.891 -4.510 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -19.453 -0.238 -2.232 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.676 -0.577 -3.937 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -17.213 -1.284 -2.287 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -18.455 -2.406 -2.805 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.621 -0.818 -4.649 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.446 -2.517 -4.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -17.524 -2.335 -6.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -18.684 -2.880 -5.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -18.690 -1.259 -5.741 1.00 0.00 H new ATOM 2252 N SER A 139 -17.150 3.893 -2.637 1.00 0.00 N ATOM 2253 CA SER A 139 -16.647 5.212 -3.063 1.00 0.00 C ATOM 2254 C SER A 139 -15.818 5.880 -1.961 1.00 0.00 C ATOM 2255 O SER A 139 -14.661 6.255 -2.170 1.00 0.00 O ATOM 2256 CB SER A 139 -17.814 6.135 -3.444 1.00 0.00 C ATOM 2257 OG SER A 139 -17.346 7.372 -3.963 1.00 0.00 O ATOM 0 H SER A 139 -17.982 3.932 -2.049 1.00 0.00 H new ATOM 0 HA SER A 139 -16.008 5.049 -3.931 1.00 0.00 H new ATOM 0 HB2 SER A 139 -18.443 5.642 -4.185 1.00 0.00 H new ATOM 0 HB3 SER A 139 -18.437 6.318 -2.568 1.00 0.00 H new ATOM 0 HG SER A 139 -18.110 7.938 -4.198 1.00 0.00 H new ATOM 2263 N TRP A 140 -16.416 6.011 -0.777 1.00 0.00 N ATOM 2264 CA TRP A 140 -15.774 6.688 0.356 1.00 0.00 C ATOM 2265 C TRP A 140 -14.465 5.986 0.760 1.00 0.00 C ATOM 2266 O TRP A 140 -13.600 6.582 1.401 1.00 0.00 O ATOM 2267 CB TRP A 140 -16.740 6.741 1.550 1.00 0.00 C ATOM 2268 CG TRP A 140 -16.495 7.904 2.468 1.00 0.00 C ATOM 2269 CD1 TRP A 140 -17.002 9.164 2.331 1.00 0.00 C ATOM 2270 CD2 TRP A 140 -15.689 7.923 3.655 1.00 0.00 C ATOM 2271 NE1 TRP A 140 -16.570 9.960 3.365 1.00 0.00 N ATOM 2272 CE2 TRP A 140 -15.761 9.223 4.187 1.00 0.00 C ATOM 2273 CE3 TRP A 140 -14.918 6.967 4.319 1.00 0.00 C ATOM 2274 CZ2 TRP A 140 -15.092 9.590 5.352 1.00 0.00 C ATOM 2275 CZ3 TRP A 140 -14.253 7.332 5.475 1.00 0.00 C ATOM 2276 CH2 TRP A 140 -14.343 8.634 5.981 1.00 0.00 C ATOM 0 H TRP A 140 -17.350 5.655 -0.574 1.00 0.00 H new ATOM 0 HA TRP A 140 -15.526 7.704 0.048 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -17.763 6.792 1.177 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -16.653 5.815 2.119 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -17.648 9.488 1.528 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -16.813 10.942 3.498 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -14.842 5.960 3.936 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -15.162 10.594 5.745 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -13.654 6.600 5.996 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -13.811 8.889 6.886 1.00 0.00 H new ATOM 2287 N PHE A 141 -14.337 4.716 0.375 1.00 0.00 N ATOM 2288 CA PHE A 141 -13.106 3.944 0.588 1.00 0.00 C ATOM 2289 C PHE A 141 -11.876 4.702 0.063 1.00 0.00 C ATOM 2290 O PHE A 141 -10.835 4.761 0.722 1.00 0.00 O ATOM 2291 CB PHE A 141 -13.229 2.587 -0.122 1.00 0.00 C ATOM 2292 CG PHE A 141 -11.994 1.722 -0.043 1.00 0.00 C ATOM 2293 CD1 PHE A 141 -11.704 1.007 1.109 1.00 0.00 C ATOM 2294 CD2 PHE A 141 -11.129 1.618 -1.126 1.00 0.00 C ATOM 2295 CE1 PHE A 141 -10.579 0.209 1.181 1.00 0.00 C ATOM 2296 CE2 PHE A 141 -10.003 0.821 -1.056 1.00 0.00 C ATOM 2297 CZ PHE A 141 -9.728 0.116 0.098 1.00 0.00 C ATOM 0 H PHE A 141 -15.078 4.193 -0.091 1.00 0.00 H new ATOM 0 HA PHE A 141 -12.973 3.791 1.659 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -14.068 2.041 0.310 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -13.468 2.761 -1.171 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -12.366 1.075 1.960 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.340 2.166 -2.032 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.365 -0.342 2.085 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.338 0.750 -1.904 1.00 0.00 H new ATOM 0 HZ PHE A 141 -8.848 -0.508 0.154 1.00 0.00 H new ATOM 2307 N TRP A 142 -12.014 5.292 -1.123 1.00 0.00 N ATOM 2308 CA TRP A 142 -10.926 6.045 -1.750 1.00 0.00 C ATOM 2309 C TRP A 142 -10.580 7.302 -0.938 1.00 0.00 C ATOM 2310 O TRP A 142 -9.410 7.614 -0.723 1.00 0.00 O ATOM 2311 CB TRP A 142 -11.313 6.421 -3.184 1.00 0.00 C ATOM 2312 CG TRP A 142 -11.740 5.237 -4.007 1.00 0.00 C ATOM 2313 CD1 TRP A 142 -12.937 5.065 -4.646 1.00 0.00 C ATOM 2314 CD2 TRP A 142 -10.977 4.051 -4.262 1.00 0.00 C ATOM 2315 NE1 TRP A 142 -12.956 3.855 -5.293 1.00 0.00 N ATOM 2316 CE2 TRP A 142 -11.766 3.212 -5.071 1.00 0.00 C ATOM 2317 CE3 TRP A 142 -9.701 3.619 -3.888 1.00 0.00 C ATOM 2318 CZ2 TRP A 142 -11.322 1.970 -5.512 1.00 0.00 C ATOM 2319 CZ3 TRP A 142 -9.263 2.384 -4.325 1.00 0.00 C ATOM 2320 CH2 TRP A 142 -10.070 1.573 -5.131 1.00 0.00 C ATOM 0 H TRP A 142 -12.873 5.263 -1.673 1.00 0.00 H new ATOM 0 HA TRP A 142 -10.039 5.412 -1.774 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -12.124 7.149 -3.157 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -10.465 6.906 -3.668 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -13.749 5.777 -4.642 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -13.730 3.493 -5.849 1.00 0.00 H new ATOM 0 HE3 TRP A 142 -9.070 4.239 -3.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 -11.943 1.342 -6.133 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 -8.280 2.038 -4.040 1.00 0.00 H new ATOM 0 HH2 TRP A 142 -9.696 0.614 -5.459 1.00 0.00 H new ATOM 2331 N THR A 143 -11.610 8.020 -0.492 1.00 0.00 N ATOM 2332 CA THR A 143 -11.430 9.189 0.383 1.00 0.00 C ATOM 2333 C THR A 143 -10.720 8.800 1.690 1.00 0.00 C ATOM 2334 O THR A 143 -9.776 9.463 2.123 1.00 0.00 O ATOM 2335 CB THR A 143 -12.792 9.854 0.713 1.00 0.00 C ATOM 2336 OG1 THR A 143 -13.331 10.475 -0.465 1.00 0.00 O ATOM 2337 CG2 THR A 143 -12.662 10.891 1.825 1.00 0.00 C ATOM 0 H THR A 143 -12.583 7.816 -0.720 1.00 0.00 H new ATOM 0 HA THR A 143 -10.809 9.903 -0.157 1.00 0.00 H new ATOM 0 HB THR A 143 -13.466 9.071 1.061 1.00 0.00 H new ATOM 0 HG1 THR A 143 -12.649 11.048 -0.874 1.00 0.00 H new ATOM 0 HG21 THR A 143 -13.638 11.333 2.026 1.00 0.00 H new ATOM 0 HG22 THR A 143 -12.288 10.410 2.729 1.00 0.00 H new ATOM 0 HG23 THR A 143 -11.967 11.671 1.515 1.00 0.00 H new ATOM 2345 N ARG A 144 -11.181 7.711 2.298 1.00 0.00 N ATOM 2346 CA ARG A 144 -10.579 7.176 3.524 1.00 0.00 C ATOM 2347 C ARG A 144 -9.080 6.893 3.330 1.00 0.00 C ATOM 2348 O ARG A 144 -8.242 7.327 4.126 1.00 0.00 O ATOM 2349 CB ARG A 144 -11.309 5.888 3.928 1.00 0.00 C ATOM 2350 CG ARG A 144 -10.750 5.214 5.175 1.00 0.00 C ATOM 2351 CD ARG A 144 -11.481 3.913 5.482 1.00 0.00 C ATOM 2352 NE ARG A 144 -10.900 3.218 6.625 1.00 0.00 N ATOM 2353 CZ ARG A 144 -11.049 1.946 6.863 1.00 0.00 C ATOM 2354 NH1 ARG A 144 -11.759 1.201 6.074 1.00 0.00 N ATOM 2355 NH2 ARG A 144 -10.481 1.417 7.894 1.00 0.00 N ATOM 0 H ARG A 144 -11.979 7.173 1.960 1.00 0.00 H new ATOM 0 HA ARG A 144 -10.679 7.920 4.314 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -12.361 6.118 4.095 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -11.264 5.183 3.098 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -9.688 5.012 5.035 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -10.836 5.891 6.025 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -12.531 4.125 5.682 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -11.448 3.263 4.607 1.00 0.00 H new ATOM 0 HE ARG A 144 -10.341 3.763 7.281 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -12.209 1.610 5.255 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -11.867 0.206 6.272 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -9.918 1.994 8.519 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -10.595 0.421 8.084 1.00 0.00 H new ATOM 2369 N LEU A 145 -8.754 6.162 2.264 1.00 0.00 N ATOM 2370 CA LEU A 145 -7.363 5.843 1.931 1.00 0.00 C ATOM 2371 C LEU A 145 -6.541 7.121 1.685 1.00 0.00 C ATOM 2372 O LEU A 145 -5.449 7.284 2.231 1.00 0.00 O ATOM 2373 CB LEU A 145 -7.316 4.935 0.692 1.00 0.00 C ATOM 2374 CG LEU A 145 -5.912 4.504 0.237 1.00 0.00 C ATOM 2375 CD1 LEU A 145 -5.180 3.765 1.355 1.00 0.00 C ATOM 2376 CD2 LEU A 145 -5.998 3.639 -1.020 1.00 0.00 C ATOM 0 H LEU A 145 -9.438 5.777 1.612 1.00 0.00 H new ATOM 0 HA LEU A 145 -6.922 5.319 2.779 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -7.903 4.040 0.897 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -7.803 5.453 -0.134 1.00 0.00 H new ATOM 0 HG LEU A 145 -5.341 5.401 -0.003 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -4.189 3.470 1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -5.082 4.420 2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -5.746 2.876 1.635 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -4.995 3.343 -1.328 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -6.590 2.749 -0.809 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -6.470 4.207 -1.821 1.00 0.00 H new ATOM 2388 N ALA A 146 -7.086 8.023 0.870 1.00 0.00 N ATOM 2389 CA ALA A 146 -6.426 9.296 0.547 1.00 0.00 C ATOM 2390 C ALA A 146 -6.026 10.076 1.808 1.00 0.00 C ATOM 2391 O ALA A 146 -4.916 10.606 1.903 1.00 0.00 O ATOM 2392 CB ALA A 146 -7.341 10.147 -0.327 1.00 0.00 C ATOM 0 H ALA A 146 -7.991 7.898 0.416 1.00 0.00 H new ATOM 0 HA ALA A 146 -5.510 9.064 0.004 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -6.846 11.089 -0.563 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -7.562 9.612 -1.251 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -8.270 10.349 0.207 1.00 0.00 H new ATOM 2398 N LYS A 147 -6.942 10.149 2.772 1.00 0.00 N ATOM 2399 CA LYS A 147 -6.683 10.849 4.032 1.00 0.00 C ATOM 2400 C LYS A 147 -5.613 10.122 4.863 1.00 0.00 C ATOM 2401 O LYS A 147 -4.678 10.744 5.369 1.00 0.00 O ATOM 2402 CB LYS A 147 -7.986 10.988 4.837 1.00 0.00 C ATOM 2403 CG LYS A 147 -7.837 11.787 6.131 1.00 0.00 C ATOM 2404 CD LYS A 147 -7.286 13.189 5.872 1.00 0.00 C ATOM 2405 CE LYS A 147 -7.159 13.998 7.159 1.00 0.00 C ATOM 2406 NZ LYS A 147 -8.483 14.334 7.747 1.00 0.00 N ATOM 0 H LYS A 147 -7.871 9.732 2.706 1.00 0.00 H new ATOM 0 HA LYS A 147 -6.304 11.843 3.797 1.00 0.00 H new ATOM 0 HB2 LYS A 147 -8.738 11.468 4.211 1.00 0.00 H new ATOM 0 HB3 LYS A 147 -8.360 9.993 5.078 1.00 0.00 H new ATOM 0 HG2 LYS A 147 -8.806 11.863 6.625 1.00 0.00 H new ATOM 0 HG3 LYS A 147 -7.172 11.255 6.812 1.00 0.00 H new ATOM 0 HD2 LYS A 147 -6.310 13.112 5.394 1.00 0.00 H new ATOM 0 HD3 LYS A 147 -7.941 13.714 5.177 1.00 0.00 H new ATOM 0 HE2 LYS A 147 -6.574 13.433 7.885 1.00 0.00 H new ATOM 0 HE3 LYS A 147 -6.611 14.918 6.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 -8.352 14.981 8.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 -9.077 14.792 7.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 -8.948 13.464 8.076 1.00 0.00 H new ATOM 2420 N ALA A 148 -5.750 8.802 4.977 1.00 0.00 N ATOM 2421 CA ALA A 148 -4.812 7.981 5.755 1.00 0.00 C ATOM 2422 C ALA A 148 -3.374 8.070 5.213 1.00 0.00 C ATOM 2423 O ALA A 148 -2.414 8.159 5.982 1.00 0.00 O ATOM 2424 CB ALA A 148 -5.279 6.528 5.768 1.00 0.00 C ATOM 0 H ALA A 148 -6.504 8.272 4.540 1.00 0.00 H new ATOM 0 HA ALA A 148 -4.800 8.372 6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -4.578 5.926 6.347 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -6.269 6.468 6.220 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -5.324 6.151 4.746 1.00 0.00 H new ATOM 2430 N LEU A 149 -3.232 8.053 3.889 1.00 0.00 N ATOM 2431 CA LEU A 149 -1.912 8.115 3.247 1.00 0.00 C ATOM 2432 C LEU A 149 -1.219 9.463 3.483 1.00 0.00 C ATOM 2433 O LEU A 149 0.007 9.534 3.560 1.00 0.00 O ATOM 2434 CB LEU A 149 -2.035 7.854 1.739 1.00 0.00 C ATOM 2435 CG LEU A 149 -2.558 6.460 1.363 1.00 0.00 C ATOM 2436 CD1 LEU A 149 -2.575 6.279 -0.153 1.00 0.00 C ATOM 2437 CD2 LEU A 149 -1.723 5.372 2.038 1.00 0.00 C ATOM 0 H LEU A 149 -4.013 7.997 3.236 1.00 0.00 H new ATOM 0 HA LEU A 149 -1.298 7.338 3.703 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -2.699 8.603 1.309 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.056 7.995 1.280 1.00 0.00 H new ATOM 0 HG LEU A 149 -3.583 6.369 1.722 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -2.949 5.285 -0.397 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -3.224 7.031 -0.602 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.564 6.392 -0.544 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -2.109 4.392 1.759 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.685 5.458 1.717 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -1.779 5.490 3.120 1.00 0.00 H new ATOM 2449 N SER A 150 -2.010 10.524 3.605 1.00 0.00 N ATOM 2450 CA SER A 150 -1.462 11.875 3.790 1.00 0.00 C ATOM 2451 C SER A 150 -1.103 12.151 5.261 1.00 0.00 C ATOM 2452 O SER A 150 -0.568 13.213 5.590 1.00 0.00 O ATOM 2453 CB SER A 150 -2.461 12.929 3.286 1.00 0.00 C ATOM 2454 OG SER A 150 -1.872 14.222 3.239 1.00 0.00 O ATOM 0 H SER A 150 -3.029 10.482 3.580 1.00 0.00 H new ATOM 0 HA SER A 150 -0.544 11.938 3.206 1.00 0.00 H new ATOM 0 HB2 SER A 150 -2.814 12.652 2.293 1.00 0.00 H new ATOM 0 HB3 SER A 150 -3.333 12.948 3.940 1.00 0.00 H new ATOM 0 HG SER A 150 -1.205 14.304 3.952 1.00 0.00 H new ATOM 2460 N LEU A 151 -1.403 11.199 6.146 1.00 0.00 N ATOM 2461 CA LEU A 151 -1.063 11.324 7.571 1.00 0.00 C ATOM 2462 C LEU A 151 0.392 10.891 7.841 1.00 0.00 C ATOM 2463 O LEU A 151 0.742 9.721 7.656 1.00 0.00 O ATOM 2464 CB LEU A 151 -2.023 10.482 8.426 1.00 0.00 C ATOM 2465 CG LEU A 151 -3.504 10.892 8.356 1.00 0.00 C ATOM 2466 CD1 LEU A 151 -4.360 9.974 9.225 1.00 0.00 C ATOM 2467 CD2 LEU A 151 -3.685 12.354 8.769 1.00 0.00 C ATOM 0 H LEU A 151 -1.881 10.331 5.904 1.00 0.00 H new ATOM 0 HA LEU A 151 -1.164 12.374 7.844 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -1.937 9.440 8.118 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -1.698 10.535 9.465 1.00 0.00 H new ATOM 0 HG LEU A 151 -3.835 10.790 7.323 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -5.404 10.282 9.161 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -4.262 8.946 8.875 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -4.026 10.038 10.261 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -4.740 12.620 8.711 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -3.332 12.490 9.791 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -3.112 12.995 8.099 1.00 0.00 H new ATOM 2479 N PRO A 152 1.256 11.823 8.299 1.00 0.00 N ATOM 2480 CA PRO A 152 2.680 11.533 8.552 1.00 0.00 C ATOM 2481 C PRO A 152 2.913 10.683 9.814 1.00 0.00 C ATOM 2482 O PRO A 152 2.044 10.571 10.676 1.00 0.00 O ATOM 2483 CB PRO A 152 3.289 12.930 8.723 1.00 0.00 C ATOM 2484 CG PRO A 152 2.172 13.763 9.255 1.00 0.00 C ATOM 2485 CD PRO A 152 0.914 13.228 8.616 1.00 0.00 C ATOM 0 HA PRO A 152 3.121 10.945 7.747 1.00 0.00 H new ATOM 0 HB2 PRO A 152 4.134 12.913 9.411 1.00 0.00 H new ATOM 0 HB3 PRO A 152 3.658 13.321 7.775 1.00 0.00 H new ATOM 0 HG2 PRO A 152 2.117 13.695 10.341 1.00 0.00 H new ATOM 0 HG3 PRO A 152 2.318 14.815 9.009 1.00 0.00 H new ATOM 0 HD2 PRO A 152 0.062 13.290 9.293 1.00 0.00 H new ATOM 0 HD3 PRO A 152 0.650 13.789 7.719 1.00 0.00 H new ATOM 2493 N LEU A 153 4.105 10.094 9.923 1.00 0.00 N ATOM 2494 CA LEU A 153 4.455 9.248 11.075 1.00 0.00 C ATOM 2495 C LEU A 153 5.016 10.077 12.241 1.00 0.00 C ATOM 2496 O LEU A 153 5.284 9.548 13.323 1.00 0.00 O ATOM 2497 CB LEU A 153 5.485 8.192 10.655 1.00 0.00 C ATOM 2498 CG LEU A 153 5.076 7.308 9.468 1.00 0.00 C ATOM 2499 CD1 LEU A 153 6.186 6.319 9.136 1.00 0.00 C ATOM 2500 CD2 LEU A 153 3.765 6.575 9.755 1.00 0.00 C ATOM 0 H LEU A 153 4.847 10.185 9.229 1.00 0.00 H new ATOM 0 HA LEU A 153 3.541 8.761 11.416 1.00 0.00 H new ATOM 0 HB2 LEU A 153 6.417 8.698 10.405 1.00 0.00 H new ATOM 0 HB3 LEU A 153 5.691 7.549 11.511 1.00 0.00 H new ATOM 0 HG LEU A 153 4.916 7.952 8.603 1.00 0.00 H new ATOM 0 HD11 LEU A 153 5.881 5.700 8.293 1.00 0.00 H new ATOM 0 HD12 LEU A 153 7.093 6.864 8.876 1.00 0.00 H new ATOM 0 HD13 LEU A 153 6.379 5.685 10.001 1.00 0.00 H new ATOM 0 HD21 LEU A 153 3.499 5.956 8.898 1.00 0.00 H new ATOM 0 HD22 LEU A 153 3.886 5.943 10.635 1.00 0.00 H new ATOM 0 HD23 LEU A 153 2.974 7.302 9.937 1.00 0.00 H new ATOM 2512 N GLU A 154 5.199 11.375 12.014 1.00 0.00 N ATOM 2513 CA GLU A 154 5.768 12.266 13.029 1.00 0.00 C ATOM 2514 C GLU A 154 4.775 12.517 14.176 1.00 0.00 C ATOM 2515 O GLU A 154 4.055 13.517 14.183 1.00 0.00 O ATOM 2516 CB GLU A 154 6.198 13.595 12.387 1.00 0.00 C ATOM 2517 CG GLU A 154 7.185 13.432 11.235 1.00 0.00 C ATOM 2518 CD GLU A 154 7.685 14.763 10.690 1.00 0.00 C ATOM 2519 OE1 GLU A 154 8.638 15.323 11.270 1.00 0.00 O ATOM 2520 OE2 GLU A 154 7.131 15.254 9.681 1.00 0.00 O ATOM 0 H GLU A 154 4.962 11.837 11.136 1.00 0.00 H new ATOM 0 HA GLU A 154 6.646 11.778 13.453 1.00 0.00 H new ATOM 0 HB2 GLU A 154 5.312 14.115 12.023 1.00 0.00 H new ATOM 0 HB3 GLU A 154 6.648 14.228 13.152 1.00 0.00 H new ATOM 0 HG2 GLU A 154 8.036 12.841 11.573 1.00 0.00 H new ATOM 0 HG3 GLU A 154 6.708 12.872 10.431 1.00 0.00 H new ATOM 2527 N HIS A 155 4.725 11.586 15.132 1.00 0.00 N ATOM 2528 CA HIS A 155 3.817 11.696 16.284 1.00 0.00 C ATOM 2529 C HIS A 155 4.335 12.716 17.308 1.00 0.00 C ATOM 2530 O HIS A 155 5.276 12.433 18.050 1.00 0.00 O ATOM 2531 CB HIS A 155 3.641 10.331 16.961 1.00 0.00 C ATOM 2532 CG HIS A 155 3.047 9.281 16.072 1.00 0.00 C ATOM 2533 ND1 HIS A 155 1.728 9.293 15.674 1.00 0.00 N ATOM 2534 CD2 HIS A 155 3.593 8.175 15.510 1.00 0.00 C ATOM 2535 CE1 HIS A 155 1.491 8.247 14.910 1.00 0.00 C ATOM 2536 NE2 HIS A 155 2.602 7.554 14.795 1.00 0.00 N ATOM 0 H HIS A 155 5.302 10.745 15.134 1.00 0.00 H new ATOM 0 HA HIS A 155 2.853 12.041 15.911 1.00 0.00 H new ATOM 0 HB2 HIS A 155 4.612 9.985 17.316 1.00 0.00 H new ATOM 0 HB3 HIS A 155 3.006 10.451 17.838 1.00 0.00 H new ATOM 0 HD2 HIS A 155 4.617 7.845 15.607 1.00 0.00 H new ATOM 0 HE1 HIS A 155 0.543 8.000 14.455 1.00 0.00 H new ATOM 0 HE2 HIS A 155 2.709 6.692 14.260 1.00 0.00 H new ATOM 2545 N HIS A 156 3.708 13.894 17.340 1.00 0.00 N ATOM 2546 CA HIS A 156 4.137 15.003 18.208 1.00 0.00 C ATOM 2547 C HIS A 156 5.586 15.420 17.914 1.00 0.00 C ATOM 2548 O HIS A 156 6.536 14.859 18.463 1.00 0.00 O ATOM 2549 CB HIS A 156 3.969 14.645 19.693 1.00 0.00 C ATOM 2550 CG HIS A 156 4.436 15.722 20.627 1.00 0.00 C ATOM 2551 ND1 HIS A 156 3.970 17.018 20.575 1.00 0.00 N ATOM 2552 CD2 HIS A 156 5.339 15.695 21.637 1.00 0.00 C ATOM 2553 CE1 HIS A 156 4.564 17.738 21.504 1.00 0.00 C ATOM 2554 NE2 HIS A 156 5.397 16.961 22.163 1.00 0.00 N ATOM 0 H HIS A 156 2.891 14.110 16.769 1.00 0.00 H new ATOM 0 HA HIS A 156 3.492 15.853 17.988 1.00 0.00 H new ATOM 0 HB2 HIS A 156 2.918 14.435 19.891 1.00 0.00 H new ATOM 0 HB3 HIS A 156 4.522 13.729 19.902 1.00 0.00 H new ATOM 0 HD2 HIS A 156 5.907 14.837 21.966 1.00 0.00 H new ATOM 0 HE1 HIS A 156 4.396 18.788 21.693 1.00 0.00 H new ATOM 0 HE2 HIS A 156 5.990 17.253 22.940 1.00 0.00 H new ATOM 2563 N HIS A 157 5.747 16.412 17.047 1.00 0.00 N ATOM 2564 CA HIS A 157 7.077 16.872 16.646 1.00 0.00 C ATOM 2565 C HIS A 157 7.163 18.404 16.672 1.00 0.00 C ATOM 2566 O HIS A 157 6.157 19.094 16.485 1.00 0.00 O ATOM 2567 CB HIS A 157 7.422 16.335 15.251 1.00 0.00 C ATOM 2568 CG HIS A 157 6.543 16.864 14.156 1.00 0.00 C ATOM 2569 ND1 HIS A 157 5.245 16.438 13.947 1.00 0.00 N ATOM 2570 CD2 HIS A 157 6.784 17.794 13.199 1.00 0.00 C ATOM 2571 CE1 HIS A 157 4.733 17.078 12.916 1.00 0.00 C ATOM 2572 NE2 HIS A 157 5.643 17.905 12.447 1.00 0.00 N ATOM 0 H HIS A 157 4.976 16.915 16.607 1.00 0.00 H new ATOM 0 HA HIS A 157 7.803 16.486 17.361 1.00 0.00 H new ATOM 0 HB2 HIS A 157 8.458 16.585 15.023 1.00 0.00 H new ATOM 0 HB3 HIS A 157 7.352 15.247 15.265 1.00 0.00 H new ATOM 0 HD1 HIS A 157 4.759 15.736 14.505 1.00 0.00 H new ATOM 0 HD2 HIS A 157 7.702 18.344 13.056 1.00 0.00 H new ATOM 0 HE1 HIS A 157 3.736 16.946 12.522 1.00 0.00 H new ATOM 2581 N HIS A 158 8.363 18.930 16.900 1.00 0.00 N ATOM 2582 CA HIS A 158 8.567 20.379 16.946 1.00 0.00 C ATOM 2583 C HIS A 158 8.387 21.015 15.560 1.00 0.00 C ATOM 2584 O HIS A 158 9.331 21.109 14.775 1.00 0.00 O ATOM 2585 CB HIS A 158 9.954 20.717 17.510 1.00 0.00 C ATOM 2586 CG HIS A 158 10.136 20.304 18.941 1.00 0.00 C ATOM 2587 ND1 HIS A 158 9.526 20.954 19.988 1.00 0.00 N ATOM 2588 CD2 HIS A 158 10.855 19.299 19.498 1.00 0.00 C ATOM 2589 CE1 HIS A 158 9.859 20.376 21.121 1.00 0.00 C ATOM 2590 NE2 HIS A 158 10.661 19.366 20.857 1.00 0.00 N ATOM 0 H HIS A 158 9.207 18.379 17.056 1.00 0.00 H new ATOM 0 HA HIS A 158 7.809 20.795 17.610 1.00 0.00 H new ATOM 0 HB2 HIS A 158 10.714 20.229 16.900 1.00 0.00 H new ATOM 0 HB3 HIS A 158 10.119 21.791 17.426 1.00 0.00 H new ATOM 0 HD2 HIS A 158 11.466 18.580 18.972 1.00 0.00 H new ATOM 0 HE1 HIS A 158 9.530 20.679 22.104 1.00 0.00 H new ATOM 0 HE2 HIS A 158 11.071 18.737 21.547 1.00 0.00 H new ATOM 2599 N HIS A 159 7.154 21.411 15.253 1.00 0.00 N ATOM 2600 CA HIS A 159 6.848 22.121 14.006 1.00 0.00 C ATOM 2601 C HIS A 159 7.033 23.637 14.186 1.00 0.00 C ATOM 2602 O HIS A 159 7.264 24.366 13.220 1.00 0.00 O ATOM 2603 CB HIS A 159 5.412 21.800 13.557 1.00 0.00 C ATOM 2604 CG HIS A 159 5.010 22.461 12.270 1.00 0.00 C ATOM 2605 ND1 HIS A 159 5.345 21.966 11.029 1.00 0.00 N ATOM 2606 CD2 HIS A 159 4.292 23.587 12.037 1.00 0.00 C ATOM 2607 CE1 HIS A 159 4.857 22.753 10.092 1.00 0.00 C ATOM 2608 NE2 HIS A 159 4.214 23.741 10.677 1.00 0.00 N ATOM 0 H HIS A 159 6.344 21.253 15.852 1.00 0.00 H new ATOM 0 HA HIS A 159 7.540 21.785 13.233 1.00 0.00 H new ATOM 0 HB2 HIS A 159 5.310 20.720 13.446 1.00 0.00 H new ATOM 0 HB3 HIS A 159 4.720 22.106 14.342 1.00 0.00 H new ATOM 0 HD2 HIS A 159 3.862 24.240 12.782 1.00 0.00 H new ATOM 0 HE1 HIS A 159 4.966 22.612 9.027 1.00 0.00 H new ATOM 0 HE2 HIS A 159 3.734 24.501 10.195 1.00 0.00 H new ATOM 2617 N HIS A 160 6.922 24.099 15.431 1.00 0.00 N ATOM 2618 CA HIS A 160 7.139 25.516 15.768 1.00 0.00 C ATOM 2619 C HIS A 160 8.465 25.711 16.539 1.00 0.00 C ATOM 2620 O HIS A 160 8.532 25.366 17.740 1.00 0.00 O ATOM 2621 CB HIS A 160 5.941 26.075 16.562 1.00 0.00 C ATOM 2622 CG HIS A 160 5.566 25.275 17.776 1.00 0.00 C ATOM 2623 ND1 HIS A 160 4.838 24.107 17.714 1.00 0.00 N ATOM 2624 CD2 HIS A 160 5.807 25.490 19.093 1.00 0.00 C ATOM 2625 CE1 HIS A 160 4.648 23.641 18.930 1.00 0.00 C ATOM 2626 NE2 HIS A 160 5.224 24.458 19.786 1.00 0.00 N ATOM 2627 OXT HIS A 160 9.443 26.195 15.928 1.00 0.00 O ATOM 0 H HIS A 160 6.682 23.513 16.231 1.00 0.00 H new ATOM 0 HA HIS A 160 7.218 26.078 14.837 1.00 0.00 H new ATOM 0 HB2 HIS A 160 6.172 27.094 16.872 1.00 0.00 H new ATOM 0 HB3 HIS A 160 5.077 26.131 15.899 1.00 0.00 H new ATOM 0 HD2 HIS A 160 6.355 26.318 19.517 1.00 0.00 H new ATOM 0 HE1 HIS A 160 4.110 22.739 19.183 1.00 0.00 H new ATOM 0 HE2 HIS A 160 5.235 24.343 20.799 1.00 0.00 H new TER 2636 HIS A 160