USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 871 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 13 SER OG : rot -170:sc= -0.645 USER MOD Set 1.2: A 66 GLN : amide:sc= -0.134 K(o=-0.78,f=-5.7!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0508 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 21:sc= -0.816 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.047 X(o=-0.047,f=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 163:sc= -0.035 (180deg=-0.337) USER MOD Single : A 43 HIS : no HD1:sc= -1.27 X(o=-1.3,f=-1.2) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.214 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 100:sc= -0.84 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.295 X(o=-0.3,f=-0.019) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 65:sc= 1.12 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -179:sc= -0.621 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.331 X(o=-0.33,f=-0.33) USER MOD Single : A 101 LYS NZ :NH3+ 153:sc= 0.478 (180deg=-0.104) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot 131:sc= -1.69 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N LEU A 2 3.746 0.585 -2.111 1.00 0.00 N ATOM 19 CA LEU A 2 5.161 0.417 -1.796 1.00 0.00 C ATOM 20 C LEU A 2 5.819 1.764 -1.514 1.00 0.00 C ATOM 21 O LEU A 2 5.156 2.802 -1.507 1.00 0.00 O ATOM 22 CB LEU A 2 5.880 -0.283 -2.950 1.00 0.00 C ATOM 23 CG LEU A 2 6.408 -1.688 -2.657 1.00 0.00 C ATOM 24 CD1 LEU A 2 6.705 -2.428 -3.952 1.00 0.00 C ATOM 25 CD2 LEU A 2 7.653 -1.619 -1.784 1.00 0.00 C ATOM 0 HA LEU A 2 5.239 -0.199 -0.900 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.195 -0.343 -3.796 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.718 0.341 -3.262 1.00 0.00 H new ATOM 0 HG LEU A 2 5.638 -2.238 -2.116 1.00 0.00 H new ATOM 0 HD11 LEU A 2 7.080 -3.426 -3.723 1.00 0.00 H new ATOM 0 HD12 LEU A 2 5.792 -2.510 -4.542 1.00 0.00 H new ATOM 0 HD13 LEU A 2 7.456 -1.880 -4.520 1.00 0.00 H new ATOM 0 HD21 LEU A 2 8.015 -2.628 -1.586 1.00 0.00 H new ATOM 0 HD22 LEU A 2 8.427 -1.051 -2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 2 7.410 -1.129 -0.841 1.00 0.00 H new ATOM 37 N LEU A 3 7.127 1.740 -1.284 1.00 0.00 N ATOM 38 CA LEU A 3 7.877 2.960 -1.004 1.00 0.00 C ATOM 39 C LEU A 3 9.166 3.006 -1.817 1.00 0.00 C ATOM 40 O LEU A 3 10.133 3.663 -1.430 1.00 0.00 O ATOM 41 CB LEU A 3 8.198 3.053 0.489 1.00 0.00 C ATOM 42 CG LEU A 3 7.710 4.314 1.203 1.00 0.00 C ATOM 43 CD1 LEU A 3 6.228 4.206 1.524 1.00 0.00 C ATOM 44 CD2 LEU A 3 8.516 4.554 2.471 1.00 0.00 C ATOM 0 H LEU A 3 7.690 0.890 -1.286 1.00 0.00 H new ATOM 0 HA LEU A 3 7.259 3.811 -1.290 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.765 2.186 0.988 1.00 0.00 H new ATOM 0 HB3 LEU A 3 9.279 2.985 0.613 1.00 0.00 H new ATOM 0 HG LEU A 3 7.855 5.165 0.537 1.00 0.00 H new ATOM 0 HD11 LEU A 3 5.899 5.112 2.032 1.00 0.00 H new ATOM 0 HD12 LEU A 3 5.664 4.082 0.600 1.00 0.00 H new ATOM 0 HD13 LEU A 3 6.058 3.345 2.171 1.00 0.00 H new ATOM 0 HD21 LEU A 3 8.155 5.455 2.966 1.00 0.00 H new ATOM 0 HD22 LEU A 3 8.403 3.702 3.141 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.568 4.677 2.215 1.00 0.00 H new ATOM 56 N ILE A 4 9.172 2.305 -2.946 1.00 0.00 N ATOM 57 CA ILE A 4 10.342 2.269 -3.816 1.00 0.00 C ATOM 58 C ILE A 4 10.026 2.857 -5.187 1.00 0.00 C ATOM 59 O ILE A 4 8.902 2.747 -5.679 1.00 0.00 O ATOM 60 CB ILE A 4 10.865 0.832 -3.995 1.00 0.00 C ATOM 61 CG1 ILE A 4 9.784 -0.055 -4.616 1.00 0.00 C ATOM 62 CG2 ILE A 4 11.321 0.264 -2.659 1.00 0.00 C ATOM 63 CD1 ILE A 4 10.324 -1.331 -5.223 1.00 0.00 C ATOM 0 H ILE A 4 8.381 1.755 -3.280 1.00 0.00 H new ATOM 0 HA ILE A 4 11.113 2.871 -3.334 1.00 0.00 H new ATOM 0 HB ILE A 4 11.721 0.855 -4.670 1.00 0.00 H new ATOM 0 HG12 ILE A 4 9.050 -0.308 -3.851 1.00 0.00 H new ATOM 0 HG13 ILE A 4 9.260 0.511 -5.386 1.00 0.00 H new ATOM 0 HG21 ILE A 4 11.688 -0.752 -2.802 1.00 0.00 H new ATOM 0 HG22 ILE A 4 12.120 0.885 -2.253 1.00 0.00 H new ATOM 0 HG23 ILE A 4 10.482 0.252 -1.963 1.00 0.00 H new ATOM 0 HD11 ILE A 4 9.502 -1.910 -5.644 1.00 0.00 H new ATOM 0 HD12 ILE A 4 11.036 -1.086 -6.011 1.00 0.00 H new ATOM 0 HD13 ILE A 4 10.823 -1.918 -4.452 1.00 0.00 H new ATOM 75 N THR A 5 11.026 3.482 -5.801 1.00 0.00 N ATOM 76 CA THR A 5 10.856 4.088 -7.116 1.00 0.00 C ATOM 77 C THR A 5 11.266 3.123 -8.223 1.00 0.00 C ATOM 78 O THR A 5 11.998 2.159 -7.999 1.00 0.00 O ATOM 79 CB THR A 5 11.679 5.383 -7.249 1.00 0.00 C ATOM 80 OG1 THR A 5 12.781 5.359 -6.335 1.00 0.00 O ATOM 81 CG2 THR A 5 10.814 6.604 -6.975 1.00 0.00 C ATOM 0 H THR A 5 11.962 3.582 -5.409 1.00 0.00 H new ATOM 0 HA THR A 5 9.798 4.327 -7.219 1.00 0.00 H new ATOM 0 HB THR A 5 12.055 5.445 -8.270 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.300 6.185 -6.427 1.00 0.00 H new ATOM 0 HG21 THR A 5 11.417 7.507 -7.075 1.00 0.00 H new ATOM 0 HG22 THR A 5 9.992 6.636 -7.690 1.00 0.00 H new ATOM 0 HG23 THR A 5 10.412 6.546 -5.963 1.00 0.00 H new ATOM 89 N PRO A 6 10.784 3.386 -9.446 1.00 0.00 N ATOM 90 CA PRO A 6 11.089 2.552 -10.613 1.00 0.00 C ATOM 91 C PRO A 6 12.544 2.679 -11.052 1.00 0.00 C ATOM 92 O PRO A 6 13.114 1.747 -11.621 1.00 0.00 O ATOM 93 CB PRO A 6 10.155 3.100 -11.695 1.00 0.00 C ATOM 94 CG PRO A 6 9.892 4.510 -11.289 1.00 0.00 C ATOM 95 CD PRO A 6 9.905 4.517 -9.786 1.00 0.00 C ATOM 0 HA PRO A 6 10.946 1.492 -10.404 1.00 0.00 H new ATOM 0 HB2 PRO A 6 10.619 3.052 -12.680 1.00 0.00 H new ATOM 0 HB3 PRO A 6 9.231 2.525 -11.749 1.00 0.00 H new ATOM 0 HG2 PRO A 6 10.653 5.180 -11.689 1.00 0.00 H new ATOM 0 HG3 PRO A 6 8.931 4.854 -11.673 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.290 5.458 -9.392 1.00 0.00 H new ATOM 0 HD3 PRO A 6 8.904 4.385 -9.375 1.00 0.00 H new ATOM 103 N ASP A 7 13.139 3.835 -10.783 1.00 0.00 N ATOM 104 CA ASP A 7 14.529 4.083 -11.148 1.00 0.00 C ATOM 105 C ASP A 7 15.474 3.249 -10.289 1.00 0.00 C ATOM 106 O ASP A 7 16.545 2.845 -10.740 1.00 0.00 O ATOM 107 CB ASP A 7 14.861 5.568 -10.999 1.00 0.00 C ATOM 108 CG ASP A 7 14.771 6.316 -12.315 1.00 0.00 C ATOM 109 OD1 ASP A 7 13.896 7.199 -12.437 1.00 0.00 O ATOM 110 OD2 ASP A 7 15.577 6.020 -13.222 1.00 0.00 O ATOM 0 H ASP A 7 12.681 4.616 -10.313 1.00 0.00 H new ATOM 0 HA ASP A 7 14.662 3.792 -12.190 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.178 6.020 -10.280 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.867 5.674 -10.592 1.00 0.00 H new ATOM 115 N GLU A 8 15.069 2.995 -9.048 1.00 0.00 N ATOM 116 CA GLU A 8 15.881 2.211 -8.125 1.00 0.00 C ATOM 117 C GLU A 8 15.914 0.743 -8.542 1.00 0.00 C ATOM 118 O GLU A 8 16.941 0.074 -8.421 1.00 0.00 O ATOM 119 CB GLU A 8 15.338 2.336 -6.700 1.00 0.00 C ATOM 120 CG GLU A 8 16.383 2.774 -5.687 1.00 0.00 C ATOM 121 CD GLU A 8 17.499 1.760 -5.524 1.00 0.00 C ATOM 122 OE1 GLU A 8 17.223 0.652 -5.020 1.00 0.00 O ATOM 123 OE2 GLU A 8 18.647 2.075 -5.901 1.00 0.00 O ATOM 0 H GLU A 8 14.184 3.321 -8.659 1.00 0.00 H new ATOM 0 HA GLU A 8 16.898 2.602 -8.154 1.00 0.00 H new ATOM 0 HB2 GLU A 8 14.516 3.052 -6.695 1.00 0.00 H new ATOM 0 HB3 GLU A 8 14.925 1.375 -6.392 1.00 0.00 H new ATOM 0 HG2 GLU A 8 16.807 3.729 -5.998 1.00 0.00 H new ATOM 0 HG3 GLU A 8 15.902 2.938 -4.723 1.00 0.00 H new ATOM 130 N LEU A 9 14.782 0.248 -9.032 1.00 0.00 N ATOM 131 CA LEU A 9 14.680 -1.140 -9.467 1.00 0.00 C ATOM 132 C LEU A 9 15.784 -1.483 -10.461 1.00 0.00 C ATOM 133 O LEU A 9 16.498 -2.473 -10.297 1.00 0.00 O ATOM 134 CB LEU A 9 13.311 -1.398 -10.099 1.00 0.00 C ATOM 135 CG LEU A 9 13.226 -2.588 -11.054 1.00 0.00 C ATOM 136 CD1 LEU A 9 13.687 -3.862 -10.363 1.00 0.00 C ATOM 137 CD2 LEU A 9 11.807 -2.749 -11.581 1.00 0.00 C ATOM 0 H LEU A 9 13.923 0.787 -9.138 1.00 0.00 H new ATOM 0 HA LEU A 9 14.795 -1.778 -8.591 1.00 0.00 H new ATOM 0 HB2 LEU A 9 12.586 -1.548 -9.299 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.008 -0.501 -10.640 1.00 0.00 H new ATOM 0 HG LEU A 9 13.887 -2.398 -11.899 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.619 -4.698 -11.059 1.00 0.00 H new ATOM 0 HD12 LEU A 9 14.720 -3.745 -10.036 1.00 0.00 H new ATOM 0 HD13 LEU A 9 13.052 -4.057 -9.498 1.00 0.00 H new ATOM 0 HD21 LEU A 9 11.765 -3.601 -12.259 1.00 0.00 H new ATOM 0 HD22 LEU A 9 11.126 -2.916 -10.747 1.00 0.00 H new ATOM 0 HD23 LEU A 9 11.512 -1.845 -12.115 1.00 0.00 H new ATOM 149 N LYS A 10 15.921 -0.657 -11.493 1.00 0.00 N ATOM 150 CA LYS A 10 16.940 -0.869 -12.514 1.00 0.00 C ATOM 151 C LYS A 10 18.336 -0.632 -11.946 1.00 0.00 C ATOM 152 O LYS A 10 19.307 -1.249 -12.383 1.00 0.00 O ATOM 153 CB LYS A 10 16.699 0.059 -13.706 1.00 0.00 C ATOM 154 CG LYS A 10 16.536 1.518 -13.318 1.00 0.00 C ATOM 155 CD LYS A 10 16.491 2.419 -14.540 1.00 0.00 C ATOM 156 CE LYS A 10 17.889 2.776 -15.021 1.00 0.00 C ATOM 157 NZ LYS A 10 18.290 4.146 -14.594 1.00 0.00 N ATOM 0 H LYS A 10 15.338 0.166 -11.644 1.00 0.00 H new ATOM 0 HA LYS A 10 16.873 -1.904 -12.849 1.00 0.00 H new ATOM 0 HB2 LYS A 10 17.534 -0.032 -14.401 1.00 0.00 H new ATOM 0 HB3 LYS A 10 15.805 -0.269 -14.236 1.00 0.00 H new ATOM 0 HG2 LYS A 10 15.620 1.641 -12.740 1.00 0.00 H new ATOM 0 HG3 LYS A 10 17.362 1.818 -12.674 1.00 0.00 H new ATOM 0 HD2 LYS A 10 15.946 1.920 -15.341 1.00 0.00 H new ATOM 0 HD3 LYS A 10 15.943 3.331 -14.301 1.00 0.00 H new ATOM 0 HE2 LYS A 10 18.603 2.051 -14.632 1.00 0.00 H new ATOM 0 HE3 LYS A 10 17.927 2.709 -16.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 19.249 4.351 -14.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 17.623 4.841 -14.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 18.278 4.203 -13.556 1.00 0.00 H new ATOM 171 N SER A 11 18.428 0.265 -10.969 1.00 0.00 N ATOM 172 CA SER A 11 19.706 0.585 -10.343 1.00 0.00 C ATOM 173 C SER A 11 20.347 -0.665 -9.748 1.00 0.00 C ATOM 174 O SER A 11 21.563 -0.723 -9.562 1.00 0.00 O ATOM 175 CB SER A 11 19.513 1.642 -9.254 1.00 0.00 C ATOM 176 OG SER A 11 20.752 2.219 -8.879 1.00 0.00 O ATOM 0 H SER A 11 17.633 0.783 -10.594 1.00 0.00 H new ATOM 0 HA SER A 11 20.370 0.982 -11.111 1.00 0.00 H new ATOM 0 HB2 SER A 11 18.840 2.420 -9.613 1.00 0.00 H new ATOM 0 HB3 SER A 11 19.040 1.189 -8.382 1.00 0.00 H new ATOM 0 HG SER A 11 20.602 2.892 -8.183 1.00 0.00 H new ATOM 182 N TYR A 12 19.521 -1.662 -9.452 1.00 0.00 N ATOM 183 CA TYR A 12 20.006 -2.910 -8.875 1.00 0.00 C ATOM 184 C TYR A 12 19.839 -4.065 -9.858 1.00 0.00 C ATOM 185 O TYR A 12 20.710 -4.927 -9.974 1.00 0.00 O ATOM 186 CB TYR A 12 19.261 -3.219 -7.575 1.00 0.00 C ATOM 187 CG TYR A 12 19.563 -4.592 -7.017 1.00 0.00 C ATOM 188 CD1 TYR A 12 18.664 -5.640 -7.174 1.00 0.00 C ATOM 189 CD2 TYR A 12 20.745 -4.840 -6.330 1.00 0.00 C ATOM 190 CE1 TYR A 12 18.934 -6.895 -6.665 1.00 0.00 C ATOM 191 CE2 TYR A 12 21.024 -6.092 -5.819 1.00 0.00 C ATOM 192 CZ TYR A 12 20.116 -7.117 -5.989 1.00 0.00 C ATOM 193 OH TYR A 12 20.390 -8.365 -5.479 1.00 0.00 O ATOM 0 H TYR A 12 18.513 -1.630 -9.602 1.00 0.00 H new ATOM 0 HA TYR A 12 21.068 -2.792 -8.658 1.00 0.00 H new ATOM 0 HB2 TYR A 12 19.521 -2.468 -6.829 1.00 0.00 H new ATOM 0 HB3 TYR A 12 18.189 -3.135 -7.752 1.00 0.00 H new ATOM 0 HD1 TYR A 12 17.738 -5.470 -7.703 1.00 0.00 H new ATOM 0 HD2 TYR A 12 21.458 -4.040 -6.193 1.00 0.00 H new ATOM 0 HE1 TYR A 12 18.224 -7.698 -6.795 1.00 0.00 H new ATOM 0 HE2 TYR A 12 21.948 -6.268 -5.289 1.00 0.00 H new ATOM 0 HH TYR A 12 21.263 -8.352 -5.033 1.00 0.00 H new ATOM 203 N SER A 13 18.713 -4.074 -10.564 1.00 0.00 N ATOM 204 CA SER A 13 18.428 -5.124 -11.535 1.00 0.00 C ATOM 205 C SER A 13 19.589 -5.292 -12.510 1.00 0.00 C ATOM 206 O SER A 13 20.303 -4.336 -12.814 1.00 0.00 O ATOM 207 CB SER A 13 17.144 -4.803 -12.303 1.00 0.00 C ATOM 208 OG SER A 13 16.069 -5.612 -11.860 1.00 0.00 O ATOM 0 H SER A 13 17.983 -3.366 -10.482 1.00 0.00 H new ATOM 0 HA SER A 13 18.294 -6.060 -10.992 1.00 0.00 H new ATOM 0 HB2 SER A 13 16.890 -3.751 -12.170 1.00 0.00 H new ATOM 0 HB3 SER A 13 17.306 -4.960 -13.369 1.00 0.00 H new ATOM 0 HG SER A 13 15.306 -5.503 -12.466 1.00 0.00 H new ATOM 214 N VAL A 14 19.772 -6.515 -12.997 1.00 0.00 N ATOM 215 CA VAL A 14 20.845 -6.810 -13.939 1.00 0.00 C ATOM 216 C VAL A 14 20.309 -6.937 -15.361 1.00 0.00 C ATOM 217 O VAL A 14 21.047 -6.766 -16.331 1.00 0.00 O ATOM 218 CB VAL A 14 21.583 -8.108 -13.562 1.00 0.00 C ATOM 219 CG1 VAL A 14 22.210 -7.984 -12.181 1.00 0.00 C ATOM 220 CG2 VAL A 14 20.633 -9.295 -13.620 1.00 0.00 C ATOM 0 H VAL A 14 19.191 -7.318 -12.755 1.00 0.00 H new ATOM 0 HA VAL A 14 21.546 -5.976 -13.891 1.00 0.00 H new ATOM 0 HB VAL A 14 22.382 -8.275 -14.284 1.00 0.00 H new ATOM 0 HG11 VAL A 14 22.727 -8.911 -11.932 1.00 0.00 H new ATOM 0 HG12 VAL A 14 22.922 -7.159 -12.177 1.00 0.00 H new ATOM 0 HG13 VAL A 14 21.431 -7.794 -11.443 1.00 0.00 H new ATOM 0 HG21 VAL A 14 21.170 -10.204 -13.351 1.00 0.00 H new ATOM 0 HG22 VAL A 14 19.812 -9.138 -12.921 1.00 0.00 H new ATOM 0 HG23 VAL A 14 20.235 -9.394 -14.630 1.00 0.00 H new ATOM 230 N PHE A 15 19.020 -7.239 -15.476 1.00 0.00 N ATOM 231 CA PHE A 15 18.384 -7.391 -16.780 1.00 0.00 C ATOM 232 C PHE A 15 18.223 -6.038 -17.466 1.00 0.00 C ATOM 233 O PHE A 15 17.576 -5.135 -16.936 1.00 0.00 O ATOM 234 CB PHE A 15 17.020 -8.065 -16.630 1.00 0.00 C ATOM 235 CG PHE A 15 17.084 -9.565 -16.676 1.00 0.00 C ATOM 236 CD1 PHE A 15 17.301 -10.226 -17.874 1.00 0.00 C ATOM 237 CD2 PHE A 15 16.927 -10.315 -15.521 1.00 0.00 C ATOM 238 CE1 PHE A 15 17.361 -11.606 -17.920 1.00 0.00 C ATOM 239 CE2 PHE A 15 16.987 -11.695 -15.561 1.00 0.00 C ATOM 240 CZ PHE A 15 17.203 -12.341 -16.762 1.00 0.00 C ATOM 0 H PHE A 15 18.395 -7.383 -14.683 1.00 0.00 H new ATOM 0 HA PHE A 15 19.025 -8.019 -17.399 1.00 0.00 H new ATOM 0 HB2 PHE A 15 16.574 -7.757 -15.684 1.00 0.00 H new ATOM 0 HB3 PHE A 15 16.361 -7.713 -17.423 1.00 0.00 H new ATOM 0 HD1 PHE A 15 17.425 -9.656 -18.783 1.00 0.00 H new ATOM 0 HD2 PHE A 15 16.756 -9.815 -14.579 1.00 0.00 H new ATOM 0 HE1 PHE A 15 17.531 -12.109 -18.861 1.00 0.00 H new ATOM 0 HE2 PHE A 15 16.865 -12.268 -14.654 1.00 0.00 H new ATOM 0 HZ PHE A 15 17.248 -13.420 -16.796 1.00 0.00 H new ATOM 250 N GLU A 16 18.816 -5.906 -18.649 1.00 0.00 N ATOM 251 CA GLU A 16 18.739 -4.663 -19.407 1.00 0.00 C ATOM 252 C GLU A 16 17.294 -4.339 -19.776 1.00 0.00 C ATOM 253 O GLU A 16 16.958 -3.191 -20.065 1.00 0.00 O ATOM 254 CB GLU A 16 19.591 -4.759 -20.675 1.00 0.00 C ATOM 255 CG GLU A 16 19.810 -3.423 -21.364 1.00 0.00 C ATOM 256 CD GLU A 16 20.936 -3.467 -22.378 1.00 0.00 C ATOM 257 OE1 GLU A 16 20.642 -3.441 -23.592 1.00 0.00 O ATOM 258 OE2 GLU A 16 22.111 -3.528 -21.959 1.00 0.00 O ATOM 0 H GLU A 16 19.354 -6.644 -19.102 1.00 0.00 H new ATOM 0 HA GLU A 16 19.124 -3.860 -18.779 1.00 0.00 H new ATOM 0 HB2 GLU A 16 20.559 -5.190 -20.420 1.00 0.00 H new ATOM 0 HB3 GLU A 16 19.111 -5.444 -21.374 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.889 -3.120 -21.862 1.00 0.00 H new ATOM 0 HG3 GLU A 16 20.031 -2.664 -20.614 1.00 0.00 H new ATOM 265 N SER A 17 16.443 -5.360 -19.763 1.00 0.00 N ATOM 266 CA SER A 17 15.035 -5.187 -20.101 1.00 0.00 C ATOM 267 C SER A 17 14.335 -4.305 -19.071 1.00 0.00 C ATOM 268 O SER A 17 13.491 -3.477 -19.417 1.00 0.00 O ATOM 269 CB SER A 17 14.337 -6.545 -20.183 1.00 0.00 C ATOM 270 OG SER A 17 13.311 -6.533 -21.161 1.00 0.00 O ATOM 0 H SER A 17 16.704 -6.316 -19.522 1.00 0.00 H new ATOM 0 HA SER A 17 14.978 -4.698 -21.074 1.00 0.00 H new ATOM 0 HB2 SER A 17 15.066 -7.318 -20.426 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.914 -6.799 -19.211 1.00 0.00 H new ATOM 0 HG SER A 17 12.881 -7.413 -21.195 1.00 0.00 H new ATOM 276 N VAL A 18 14.691 -4.488 -17.804 1.00 0.00 N ATOM 277 CA VAL A 18 14.099 -3.709 -16.723 1.00 0.00 C ATOM 278 C VAL A 18 14.655 -2.290 -16.700 1.00 0.00 C ATOM 279 O VAL A 18 13.954 -1.342 -16.344 1.00 0.00 O ATOM 280 CB VAL A 18 14.349 -4.369 -15.354 1.00 0.00 C ATOM 281 CG1 VAL A 18 13.705 -3.554 -14.242 1.00 0.00 C ATOM 282 CG2 VAL A 18 13.828 -5.798 -15.348 1.00 0.00 C ATOM 0 H VAL A 18 15.387 -5.169 -17.501 1.00 0.00 H new ATOM 0 HA VAL A 18 13.026 -3.672 -16.910 1.00 0.00 H new ATOM 0 HB VAL A 18 15.424 -4.398 -15.175 1.00 0.00 H new ATOM 0 HG11 VAL A 18 13.892 -4.036 -13.282 1.00 0.00 H new ATOM 0 HG12 VAL A 18 14.130 -2.550 -14.233 1.00 0.00 H new ATOM 0 HG13 VAL A 18 12.630 -3.491 -14.413 1.00 0.00 H new ATOM 0 HG21 VAL A 18 14.013 -6.249 -14.373 1.00 0.00 H new ATOM 0 HG22 VAL A 18 12.757 -5.796 -15.549 1.00 0.00 H new ATOM 0 HG23 VAL A 18 14.340 -6.375 -16.118 1.00 0.00 H new ATOM 292 N LYS A 19 15.920 -2.149 -17.082 1.00 0.00 N ATOM 293 CA LYS A 19 16.571 -0.845 -17.108 1.00 0.00 C ATOM 294 C LYS A 19 16.182 -0.067 -18.361 1.00 0.00 C ATOM 295 O LYS A 19 16.226 1.164 -18.379 1.00 0.00 O ATOM 296 CB LYS A 19 18.091 -1.010 -17.049 1.00 0.00 C ATOM 297 CG LYS A 19 18.553 -2.030 -16.023 1.00 0.00 C ATOM 298 CD LYS A 19 20.062 -1.997 -15.843 1.00 0.00 C ATOM 299 CE LYS A 19 20.677 -3.373 -16.041 1.00 0.00 C ATOM 300 NZ LYS A 19 22.139 -3.373 -15.759 1.00 0.00 N ATOM 0 H LYS A 19 16.515 -2.923 -17.378 1.00 0.00 H new ATOM 0 HA LYS A 19 16.238 -0.283 -16.235 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.454 -1.307 -18.033 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.544 -0.046 -16.820 1.00 0.00 H new ATOM 0 HG2 LYS A 19 18.067 -1.832 -15.068 1.00 0.00 H new ATOM 0 HG3 LYS A 19 18.245 -3.028 -16.336 1.00 0.00 H new ATOM 0 HD2 LYS A 19 20.499 -1.296 -16.554 1.00 0.00 H new ATOM 0 HD3 LYS A 19 20.303 -1.630 -14.845 1.00 0.00 H new ATOM 0 HE2 LYS A 19 20.181 -4.090 -15.387 1.00 0.00 H new ATOM 0 HE3 LYS A 19 20.505 -3.704 -17.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 22.521 -4.329 -15.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 22.616 -2.708 -16.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 22.303 -3.082 -14.774 1.00 0.00 H new ATOM 314 N THR A 20 15.799 -0.792 -19.407 1.00 0.00 N ATOM 315 CA THR A 20 15.401 -0.169 -20.664 1.00 0.00 C ATOM 316 C THR A 20 14.017 0.460 -20.552 1.00 0.00 C ATOM 317 O THR A 20 13.806 1.597 -20.974 1.00 0.00 O ATOM 318 CB THR A 20 15.398 -1.188 -21.819 1.00 0.00 C ATOM 319 OG1 THR A 20 14.846 -2.432 -21.373 1.00 0.00 O ATOM 320 CG2 THR A 20 16.807 -1.413 -22.347 1.00 0.00 C ATOM 0 H THR A 20 15.756 -1.811 -19.409 1.00 0.00 H new ATOM 0 HA THR A 20 16.134 0.609 -20.878 1.00 0.00 H new ATOM 0 HB THR A 20 14.785 -0.787 -22.626 1.00 0.00 H new ATOM 0 HG1 THR A 20 14.301 -2.280 -20.573 1.00 0.00 H new ATOM 0 HG21 THR A 20 16.779 -2.136 -23.162 1.00 0.00 H new ATOM 0 HG22 THR A 20 17.213 -0.470 -22.713 1.00 0.00 H new ATOM 0 HG23 THR A 20 17.439 -1.794 -21.545 1.00 0.00 H new ATOM 328 N ARG A 21 13.078 -0.286 -19.981 1.00 0.00 N ATOM 329 CA ARG A 21 11.713 0.199 -19.814 1.00 0.00 C ATOM 330 C ARG A 21 11.701 1.564 -19.131 1.00 0.00 C ATOM 331 O ARG A 21 12.642 1.945 -18.435 1.00 0.00 O ATOM 332 CB ARG A 21 10.890 -0.799 -18.998 1.00 0.00 C ATOM 333 CG ARG A 21 9.845 -1.539 -19.816 1.00 0.00 C ATOM 334 CD ARG A 21 9.684 -2.976 -19.344 1.00 0.00 C ATOM 335 NE ARG A 21 8.554 -3.641 -19.989 1.00 0.00 N ATOM 336 CZ ARG A 21 8.543 -3.996 -21.269 1.00 0.00 C ATOM 337 NH1 ARG A 21 9.596 -3.752 -22.037 1.00 0.00 N ATOM 338 NH2 ARG A 21 7.477 -4.597 -21.782 1.00 0.00 N ATOM 0 H ARG A 21 13.237 -1.229 -19.626 1.00 0.00 H new ATOM 0 HA ARG A 21 11.268 0.303 -20.803 1.00 0.00 H new ATOM 0 HB2 ARG A 21 11.563 -1.525 -18.542 1.00 0.00 H new ATOM 0 HB3 ARG A 21 10.394 -0.269 -18.185 1.00 0.00 H new ATOM 0 HG2 ARG A 21 8.889 -1.021 -19.741 1.00 0.00 H new ATOM 0 HG3 ARG A 21 10.131 -1.530 -20.868 1.00 0.00 H new ATOM 0 HD2 ARG A 21 10.599 -3.531 -19.553 1.00 0.00 H new ATOM 0 HD3 ARG A 21 9.543 -2.989 -18.263 1.00 0.00 H new ATOM 0 HE ARG A 21 7.728 -3.844 -19.425 1.00 0.00 H new ATOM 0 HH11 ARG A 21 10.417 -3.291 -21.645 1.00 0.00 H new ATOM 0 HH12 ARG A 21 9.585 -4.026 -23.020 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.666 -4.786 -21.193 1.00 0.00 H new ATOM 0 HH22 ARG A 21 7.469 -4.869 -22.765 1.00 0.00 H new ATOM 352 N PRO A 22 10.611 2.318 -19.334 1.00 0.00 N ATOM 353 CA PRO A 22 10.450 3.651 -18.747 1.00 0.00 C ATOM 354 C PRO A 22 10.252 3.599 -17.236 1.00 0.00 C ATOM 355 O PRO A 22 10.415 2.548 -16.615 1.00 0.00 O ATOM 356 CB PRO A 22 9.192 4.191 -19.432 1.00 0.00 C ATOM 357 CG PRO A 22 8.425 2.977 -19.828 1.00 0.00 C ATOM 358 CD PRO A 22 9.451 1.927 -20.153 1.00 0.00 C ATOM 0 HA PRO A 22 11.334 4.271 -18.897 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.614 4.822 -18.757 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.444 4.800 -20.300 1.00 0.00 H new ATOM 0 HG2 PRO A 22 7.772 2.647 -19.020 1.00 0.00 H new ATOM 0 HG3 PRO A 22 7.789 3.181 -20.689 1.00 0.00 H new ATOM 0 HD2 PRO A 22 9.098 0.928 -19.898 1.00 0.00 H new ATOM 0 HD3 PRO A 22 9.694 1.918 -21.216 1.00 0.00 H new ATOM 366 N ASP A 23 9.899 4.738 -16.650 1.00 0.00 N ATOM 367 CA ASP A 23 9.677 4.821 -15.211 1.00 0.00 C ATOM 368 C ASP A 23 8.195 4.676 -14.881 1.00 0.00 C ATOM 369 O ASP A 23 7.833 4.283 -13.772 1.00 0.00 O ATOM 370 CB ASP A 23 10.206 6.150 -14.668 1.00 0.00 C ATOM 371 CG ASP A 23 11.662 6.382 -15.022 1.00 0.00 C ATOM 372 OD1 ASP A 23 12.006 7.520 -15.403 1.00 0.00 O ATOM 373 OD2 ASP A 23 12.457 5.425 -14.917 1.00 0.00 O ATOM 0 H ASP A 23 9.760 5.617 -17.149 1.00 0.00 H new ATOM 0 HA ASP A 23 10.218 4.002 -14.736 1.00 0.00 H new ATOM 0 HB2 ASP A 23 9.604 6.967 -15.066 1.00 0.00 H new ATOM 0 HB3 ASP A 23 10.091 6.168 -13.584 1.00 0.00 H new ATOM 378 N GLU A 24 7.343 4.996 -15.850 1.00 0.00 N ATOM 379 CA GLU A 24 5.901 4.903 -15.660 1.00 0.00 C ATOM 380 C GLU A 24 5.447 3.446 -15.648 1.00 0.00 C ATOM 381 O GLU A 24 4.500 3.085 -14.948 1.00 0.00 O ATOM 382 CB GLU A 24 5.168 5.668 -16.765 1.00 0.00 C ATOM 383 CG GLU A 24 5.413 5.110 -18.156 1.00 0.00 C ATOM 384 CD GLU A 24 5.546 6.197 -19.206 1.00 0.00 C ATOM 385 OE1 GLU A 24 4.604 7.005 -19.343 1.00 0.00 O ATOM 386 OE2 GLU A 24 6.590 6.239 -19.889 1.00 0.00 O ATOM 0 H GLU A 24 7.627 5.322 -16.774 1.00 0.00 H new ATOM 0 HA GLU A 24 5.658 5.350 -14.696 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.098 5.651 -16.559 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.480 6.712 -16.741 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.320 4.506 -18.147 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.592 4.447 -18.427 1.00 0.00 H new ATOM 393 N LEU A 25 6.128 2.614 -16.427 1.00 0.00 N ATOM 394 CA LEU A 25 5.796 1.196 -16.507 1.00 0.00 C ATOM 395 C LEU A 25 6.563 0.396 -15.459 1.00 0.00 C ATOM 396 O LEU A 25 6.049 -0.575 -14.904 1.00 0.00 O ATOM 397 CB LEU A 25 6.107 0.657 -17.905 1.00 0.00 C ATOM 398 CG LEU A 25 5.150 1.085 -19.018 1.00 0.00 C ATOM 399 CD1 LEU A 25 5.795 0.888 -20.381 1.00 0.00 C ATOM 400 CD2 LEU A 25 3.844 0.309 -18.926 1.00 0.00 C ATOM 0 H LEU A 25 6.914 2.897 -17.013 1.00 0.00 H new ATOM 0 HA LEU A 25 4.729 1.087 -16.311 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.114 0.972 -18.178 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.115 -0.432 -17.859 1.00 0.00 H new ATOM 0 HG LEU A 25 4.929 2.145 -18.894 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.099 1.198 -21.161 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.702 1.489 -20.444 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.046 -0.164 -20.516 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.175 0.627 -19.726 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.047 -0.757 -19.024 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.374 0.501 -17.962 1.00 0.00 H new ATOM 412 N LEU A 26 7.796 0.813 -15.191 1.00 0.00 N ATOM 413 CA LEU A 26 8.635 0.137 -14.207 1.00 0.00 C ATOM 414 C LEU A 26 7.954 0.104 -12.842 1.00 0.00 C ATOM 415 O LEU A 26 8.082 -0.866 -12.096 1.00 0.00 O ATOM 416 CB LEU A 26 9.991 0.837 -14.097 1.00 0.00 C ATOM 417 CG LEU A 26 11.149 0.176 -14.844 1.00 0.00 C ATOM 418 CD1 LEU A 26 12.431 0.971 -14.652 1.00 0.00 C ATOM 419 CD2 LEU A 26 11.335 -1.261 -14.377 1.00 0.00 C ATOM 0 H LEU A 26 8.237 1.615 -15.641 1.00 0.00 H new ATOM 0 HA LEU A 26 8.789 -0.889 -14.540 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.882 1.857 -14.466 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.257 0.906 -13.042 1.00 0.00 H new ATOM 0 HG LEU A 26 10.910 0.163 -15.907 1.00 0.00 H new ATOM 0 HD11 LEU A 26 13.244 0.485 -15.191 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.293 1.982 -15.036 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.675 1.017 -13.591 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.164 -1.716 -14.920 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.552 -1.271 -13.309 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.423 -1.826 -14.568 1.00 0.00 H new ATOM 431 N LYS A 27 7.229 1.171 -12.523 1.00 0.00 N ATOM 432 CA LYS A 27 6.525 1.265 -11.249 1.00 0.00 C ATOM 433 C LYS A 27 5.287 0.374 -11.246 1.00 0.00 C ATOM 434 O LYS A 27 4.917 -0.184 -10.213 1.00 0.00 O ATOM 435 CB LYS A 27 6.124 2.715 -10.971 1.00 0.00 C ATOM 436 CG LYS A 27 4.940 3.188 -11.797 1.00 0.00 C ATOM 437 CD LYS A 27 5.024 4.676 -12.091 1.00 0.00 C ATOM 438 CE LYS A 27 3.736 5.196 -12.710 1.00 0.00 C ATOM 439 NZ LYS A 27 2.819 5.768 -11.685 1.00 0.00 N ATOM 0 H LYS A 27 7.113 1.983 -13.129 1.00 0.00 H new ATOM 0 HA LYS A 27 7.199 0.924 -10.463 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.883 2.820 -9.913 1.00 0.00 H new ATOM 0 HB3 LYS A 27 6.977 3.364 -11.170 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.904 2.633 -12.734 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.014 2.973 -11.263 1.00 0.00 H new ATOM 0 HD2 LYS A 27 5.231 5.219 -11.169 1.00 0.00 H new ATOM 0 HD3 LYS A 27 5.857 4.868 -12.767 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.972 5.959 -13.452 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.232 4.385 -13.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.953 6.111 -12.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.573 5.034 -10.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 3.290 6.559 -11.201 1.00 0.00 H new ATOM 453 N GLN A 28 4.653 0.244 -12.407 1.00 0.00 N ATOM 454 CA GLN A 28 3.457 -0.580 -12.536 1.00 0.00 C ATOM 455 C GLN A 28 3.733 -2.012 -12.091 1.00 0.00 C ATOM 456 O GLN A 28 2.940 -2.609 -11.362 1.00 0.00 O ATOM 457 CB GLN A 28 2.959 -0.569 -13.982 1.00 0.00 C ATOM 458 CG GLN A 28 1.862 0.451 -14.241 1.00 0.00 C ATOM 459 CD GLN A 28 0.832 -0.040 -15.239 1.00 0.00 C ATOM 460 OE1 GLN A 28 -0.373 0.092 -15.021 1.00 0.00 O ATOM 461 NE2 GLN A 28 1.301 -0.610 -16.342 1.00 0.00 N ATOM 0 H GLN A 28 4.948 0.699 -13.271 1.00 0.00 H new ATOM 0 HA GLN A 28 2.685 -0.161 -11.890 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.799 -0.363 -14.645 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.588 -1.562 -14.237 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.366 0.691 -13.301 1.00 0.00 H new ATOM 0 HG3 GLN A 28 2.309 1.374 -14.610 1.00 0.00 H new ATOM 0 HE21 GLN A 28 2.307 -0.699 -16.482 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.655 -0.959 -17.050 1.00 0.00 H new ATOM 470 N ASP A 29 4.860 -2.558 -12.534 1.00 0.00 N ATOM 471 CA ASP A 29 5.240 -3.920 -12.181 1.00 0.00 C ATOM 472 C ASP A 29 5.577 -4.023 -10.697 1.00 0.00 C ATOM 473 O ASP A 29 5.330 -5.050 -10.064 1.00 0.00 O ATOM 474 CB ASP A 29 6.436 -4.373 -13.021 1.00 0.00 C ATOM 475 CG ASP A 29 6.916 -5.761 -12.644 1.00 0.00 C ATOM 476 OD1 ASP A 29 6.115 -6.532 -12.075 1.00 0.00 O ATOM 477 OD2 ASP A 29 8.093 -6.076 -12.919 1.00 0.00 O ATOM 0 H ASP A 29 5.526 -2.078 -13.139 1.00 0.00 H new ATOM 0 HA ASP A 29 4.392 -4.573 -12.389 1.00 0.00 H new ATOM 0 HB2 ASP A 29 6.161 -4.361 -14.076 1.00 0.00 H new ATOM 0 HB3 ASP A 29 7.253 -3.663 -12.897 1.00 0.00 H new ATOM 482 N ILE A 30 6.143 -2.953 -10.148 1.00 0.00 N ATOM 483 CA ILE A 30 6.514 -2.923 -8.739 1.00 0.00 C ATOM 484 C ILE A 30 5.280 -2.971 -7.845 1.00 0.00 C ATOM 485 O ILE A 30 5.259 -3.673 -6.833 1.00 0.00 O ATOM 486 CB ILE A 30 7.333 -1.664 -8.399 1.00 0.00 C ATOM 487 CG1 ILE A 30 8.640 -1.649 -9.193 1.00 0.00 C ATOM 488 CG2 ILE A 30 7.613 -1.602 -6.905 1.00 0.00 C ATOM 489 CD1 ILE A 30 9.223 -0.265 -9.371 1.00 0.00 C ATOM 0 H ILE A 30 6.355 -2.095 -10.658 1.00 0.00 H new ATOM 0 HA ILE A 30 7.127 -3.805 -8.555 1.00 0.00 H new ATOM 0 HB ILE A 30 6.752 -0.785 -8.677 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.371 -2.280 -8.687 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.465 -2.089 -10.174 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.193 -0.707 -6.680 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.670 -1.570 -6.359 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.177 -2.485 -6.604 1.00 0.00 H new ATOM 0 HD11 ILE A 30 10.149 -0.331 -9.943 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.511 0.364 -9.905 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.431 0.171 -8.394 1.00 0.00 H new ATOM 501 N LEU A 31 4.251 -2.221 -8.225 1.00 0.00 N ATOM 502 CA LEU A 31 3.011 -2.179 -7.459 1.00 0.00 C ATOM 503 C LEU A 31 2.293 -3.524 -7.510 1.00 0.00 C ATOM 504 O LEU A 31 1.573 -3.889 -6.581 1.00 0.00 O ATOM 505 CB LEU A 31 2.094 -1.078 -7.996 1.00 0.00 C ATOM 506 CG LEU A 31 2.629 0.351 -7.892 1.00 0.00 C ATOM 507 CD1 LEU A 31 1.547 1.354 -8.264 1.00 0.00 C ATOM 508 CD2 LEU A 31 3.153 0.624 -6.490 1.00 0.00 C ATOM 0 H LEU A 31 4.251 -1.634 -9.059 1.00 0.00 H new ATOM 0 HA LEU A 31 3.262 -1.961 -6.421 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.881 -1.289 -9.044 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.146 -1.129 -7.461 1.00 0.00 H new ATOM 0 HG LEU A 31 3.455 0.461 -8.594 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.946 2.365 -8.184 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.219 1.173 -9.288 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.700 1.243 -7.587 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.530 1.645 -6.435 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.346 0.495 -5.769 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.959 -0.073 -6.261 1.00 0.00 H new ATOM 520 N GLU A 32 2.497 -4.257 -8.600 1.00 0.00 N ATOM 521 CA GLU A 32 1.870 -5.562 -8.770 1.00 0.00 C ATOM 522 C GLU A 32 2.632 -6.636 -7.998 1.00 0.00 C ATOM 523 O GLU A 32 2.070 -7.667 -7.631 1.00 0.00 O ATOM 524 CB GLU A 32 1.807 -5.933 -10.253 1.00 0.00 C ATOM 525 CG GLU A 32 0.558 -6.710 -10.634 1.00 0.00 C ATOM 526 CD GLU A 32 0.872 -8.087 -11.185 1.00 0.00 C ATOM 527 OE1 GLU A 32 0.428 -9.084 -10.578 1.00 0.00 O ATOM 528 OE2 GLU A 32 1.562 -8.168 -12.222 1.00 0.00 O ATOM 0 H GLU A 32 3.091 -3.969 -9.378 1.00 0.00 H new ATOM 0 HA GLU A 32 0.856 -5.504 -8.374 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.854 -5.022 -10.849 1.00 0.00 H new ATOM 0 HB3 GLU A 32 2.685 -6.526 -10.508 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.084 -6.811 -9.759 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -0.004 -6.145 -11.378 1.00 0.00 H new ATOM 535 N ALA A 33 3.914 -6.385 -7.756 1.00 0.00 N ATOM 536 CA ALA A 33 4.753 -7.329 -7.027 1.00 0.00 C ATOM 537 C ALA A 33 4.437 -7.305 -5.536 1.00 0.00 C ATOM 538 O ALA A 33 4.349 -8.351 -4.892 1.00 0.00 O ATOM 539 CB ALA A 33 6.224 -7.018 -7.262 1.00 0.00 C ATOM 0 H ALA A 33 4.395 -5.536 -8.054 1.00 0.00 H new ATOM 0 HA ALA A 33 4.541 -8.331 -7.401 1.00 0.00 H new ATOM 0 HB1 ALA A 33 6.839 -7.730 -6.712 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.446 -7.093 -8.326 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.442 -6.008 -6.916 1.00 0.00 H new ATOM 545 N THR A 34 4.267 -6.105 -4.990 1.00 0.00 N ATOM 546 CA THR A 34 3.962 -5.945 -3.574 1.00 0.00 C ATOM 547 C THR A 34 2.708 -6.721 -3.190 1.00 0.00 C ATOM 548 O THR A 34 2.512 -7.065 -2.025 1.00 0.00 O ATOM 549 CB THR A 34 3.767 -4.462 -3.205 1.00 0.00 C ATOM 550 OG1 THR A 34 3.759 -4.308 -1.781 1.00 0.00 O ATOM 551 CG2 THR A 34 2.467 -3.926 -3.786 1.00 0.00 C ATOM 0 H THR A 34 4.336 -5.229 -5.508 1.00 0.00 H new ATOM 0 HA THR A 34 4.814 -6.341 -3.021 1.00 0.00 H new ATOM 0 HB THR A 34 4.596 -3.894 -3.626 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.636 -3.362 -1.555 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.351 -2.877 -3.512 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.489 -4.017 -4.872 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.628 -4.499 -3.391 1.00 0.00 H new ATOM 559 N ALA A 35 1.862 -6.996 -4.178 1.00 0.00 N ATOM 560 CA ALA A 35 0.628 -7.734 -3.943 1.00 0.00 C ATOM 561 C ALA A 35 0.911 -9.211 -3.690 1.00 0.00 C ATOM 562 O ALA A 35 0.161 -9.886 -2.985 1.00 0.00 O ATOM 563 CB ALA A 35 -0.318 -7.571 -5.124 1.00 0.00 C ATOM 0 H ALA A 35 2.009 -6.718 -5.148 1.00 0.00 H new ATOM 0 HA ALA A 35 0.153 -7.324 -3.052 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.236 -8.128 -4.935 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.555 -6.515 -5.257 1.00 0.00 H new ATOM 0 HB3 ALA A 35 0.158 -7.953 -6.027 1.00 0.00 H new ATOM 569 N ASP A 36 1.998 -9.708 -4.270 1.00 0.00 N ATOM 570 CA ASP A 36 2.382 -11.105 -4.107 1.00 0.00 C ATOM 571 C ASP A 36 3.020 -11.338 -2.742 1.00 0.00 C ATOM 572 O ASP A 36 2.634 -12.253 -2.013 1.00 0.00 O ATOM 573 CB ASP A 36 3.350 -11.523 -5.215 1.00 0.00 C ATOM 574 CG ASP A 36 3.243 -12.997 -5.552 1.00 0.00 C ATOM 575 OD1 ASP A 36 4.233 -13.729 -5.336 1.00 0.00 O ATOM 576 OD2 ASP A 36 2.170 -13.420 -6.030 1.00 0.00 O ATOM 0 H ASP A 36 2.629 -9.163 -4.858 1.00 0.00 H new ATOM 0 HA ASP A 36 1.480 -11.714 -4.175 1.00 0.00 H new ATOM 0 HB2 ASP A 36 3.150 -10.933 -6.110 1.00 0.00 H new ATOM 0 HB3 ASP A 36 4.371 -11.297 -4.906 1.00 0.00 H new ATOM 581 N ILE A 37 3.998 -10.506 -2.402 1.00 0.00 N ATOM 582 CA ILE A 37 4.689 -10.621 -1.124 1.00 0.00 C ATOM 583 C ILE A 37 3.714 -10.492 0.042 1.00 0.00 C ATOM 584 O ILE A 37 3.647 -11.365 0.908 1.00 0.00 O ATOM 585 CB ILE A 37 5.789 -9.553 -0.979 1.00 0.00 C ATOM 586 CG1 ILE A 37 6.820 -9.697 -2.101 1.00 0.00 C ATOM 587 CG2 ILE A 37 6.459 -9.663 0.382 1.00 0.00 C ATOM 588 CD1 ILE A 37 7.966 -8.715 -1.997 1.00 0.00 C ATOM 0 H ILE A 37 4.330 -9.745 -2.994 1.00 0.00 H new ATOM 0 HA ILE A 37 5.149 -11.609 -1.103 1.00 0.00 H new ATOM 0 HB ILE A 37 5.331 -8.567 -1.057 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.219 -10.711 -2.089 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.322 -9.562 -3.061 1.00 0.00 H new ATOM 0 HG21 ILE A 37 7.234 -8.901 0.469 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.716 -9.516 1.166 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.908 -10.651 0.488 1.00 0.00 H new ATOM 0 HD11 ILE A 37 8.658 -8.874 -2.824 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.578 -7.697 -2.039 1.00 0.00 H new ATOM 0 HD13 ILE A 37 8.489 -8.865 -1.052 1.00 0.00 H new ATOM 600 N ILE A 38 2.959 -9.399 0.056 1.00 0.00 N ATOM 601 CA ILE A 38 1.986 -9.157 1.114 1.00 0.00 C ATOM 602 C ILE A 38 1.014 -10.324 1.243 1.00 0.00 C ATOM 603 O ILE A 38 0.567 -10.656 2.343 1.00 0.00 O ATOM 604 CB ILE A 38 1.188 -7.864 0.859 1.00 0.00 C ATOM 605 CG1 ILE A 38 2.117 -6.649 0.897 1.00 0.00 C ATOM 606 CG2 ILE A 38 0.074 -7.719 1.886 1.00 0.00 C ATOM 607 CD1 ILE A 38 1.435 -5.355 0.513 1.00 0.00 C ATOM 0 H ILE A 38 3.002 -8.667 -0.653 1.00 0.00 H new ATOM 0 HA ILE A 38 2.548 -9.051 2.042 1.00 0.00 H new ATOM 0 HB ILE A 38 0.738 -7.921 -0.132 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.530 -6.549 1.901 1.00 0.00 H new ATOM 0 HG13 ILE A 38 2.956 -6.822 0.223 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.481 -6.801 1.693 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.600 -8.573 1.815 1.00 0.00 H new ATOM 0 HG23 ILE A 38 0.504 -7.679 2.887 1.00 0.00 H new ATOM 0 HD11 ILE A 38 2.153 -4.537 0.562 1.00 0.00 H new ATOM 0 HD12 ILE A 38 1.046 -5.436 -0.502 1.00 0.00 H new ATOM 0 HD13 ILE A 38 0.613 -5.158 1.202 1.00 0.00 H new ATOM 619 N LEU A 39 0.690 -10.946 0.115 1.00 0.00 N ATOM 620 CA LEU A 39 -0.228 -12.079 0.101 1.00 0.00 C ATOM 621 C LEU A 39 0.368 -13.272 0.842 1.00 0.00 C ATOM 622 O LEU A 39 -0.356 -14.152 1.309 1.00 0.00 O ATOM 623 CB LEU A 39 -0.562 -12.473 -1.338 1.00 0.00 C ATOM 624 CG LEU A 39 -1.967 -12.114 -1.824 1.00 0.00 C ATOM 625 CD1 LEU A 39 -2.095 -12.361 -3.319 1.00 0.00 C ATOM 626 CD2 LEU A 39 -3.015 -12.909 -1.058 1.00 0.00 C ATOM 0 H LEU A 39 1.050 -10.684 -0.803 1.00 0.00 H new ATOM 0 HA LEU A 39 -1.144 -11.779 0.610 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.162 -11.999 -2.001 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.429 -13.550 -1.439 1.00 0.00 H new ATOM 0 HG LEU A 39 -2.135 -11.053 -1.637 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.101 -12.100 -3.646 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.369 -11.747 -3.853 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.906 -13.413 -3.531 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.009 -12.641 -1.417 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -2.848 -13.975 -1.213 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.939 -12.681 0.005 1.00 0.00 H new ATOM 638 N LYS A 40 1.692 -13.295 0.947 1.00 0.00 N ATOM 639 CA LYS A 40 2.387 -14.377 1.633 1.00 0.00 C ATOM 640 C LYS A 40 2.438 -14.124 3.137 1.00 0.00 C ATOM 641 O LYS A 40 2.141 -15.013 3.936 1.00 0.00 O ATOM 642 CB LYS A 40 3.807 -14.529 1.083 1.00 0.00 C ATOM 643 CG LYS A 40 3.946 -15.641 0.057 1.00 0.00 C ATOM 644 CD LYS A 40 5.301 -15.599 -0.630 1.00 0.00 C ATOM 645 CE LYS A 40 5.375 -16.597 -1.775 1.00 0.00 C ATOM 646 NZ LYS A 40 4.409 -16.270 -2.860 1.00 0.00 N ATOM 0 H LYS A 40 2.306 -12.575 0.565 1.00 0.00 H new ATOM 0 HA LYS A 40 1.834 -15.300 1.456 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.115 -13.587 0.629 1.00 0.00 H new ATOM 0 HB3 LYS A 40 4.490 -14.722 1.911 1.00 0.00 H new ATOM 0 HG2 LYS A 40 3.814 -16.607 0.545 1.00 0.00 H new ATOM 0 HG3 LYS A 40 3.156 -15.550 -0.688 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.487 -14.594 -1.009 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.085 -15.817 0.095 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.386 -16.609 -2.181 1.00 0.00 H new ATOM 0 HE3 LYS A 40 5.171 -17.599 -1.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.676 -16.778 -3.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.452 -16.558 -2.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.423 -15.246 -3.040 1.00 0.00 H new ATOM 660 N VAL A 41 2.814 -12.907 3.515 1.00 0.00 N ATOM 661 CA VAL A 41 2.900 -12.536 4.923 1.00 0.00 C ATOM 662 C VAL A 41 1.515 -12.303 5.516 1.00 0.00 C ATOM 663 O VAL A 41 1.346 -12.276 6.734 1.00 0.00 O ATOM 664 CB VAL A 41 3.751 -11.267 5.118 1.00 0.00 C ATOM 665 CG1 VAL A 41 5.197 -11.529 4.727 1.00 0.00 C ATOM 666 CG2 VAL A 41 3.174 -10.111 4.316 1.00 0.00 C ATOM 0 H VAL A 41 3.064 -12.161 2.866 1.00 0.00 H new ATOM 0 HA VAL A 41 3.378 -13.368 5.441 1.00 0.00 H new ATOM 0 HB VAL A 41 3.729 -10.994 6.173 1.00 0.00 H new ATOM 0 HG11 VAL A 41 5.783 -10.621 4.871 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.603 -12.326 5.349 1.00 0.00 H new ATOM 0 HG13 VAL A 41 5.242 -11.827 3.680 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.788 -9.223 4.465 1.00 0.00 H new ATOM 0 HG22 VAL A 41 3.164 -10.372 3.258 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.156 -9.909 4.649 1.00 0.00 H new ATOM 676 N GLY A 42 0.525 -12.135 4.644 1.00 0.00 N ATOM 677 CA GLY A 42 -0.834 -11.906 5.101 1.00 0.00 C ATOM 678 C GLY A 42 -0.990 -10.577 5.813 1.00 0.00 C ATOM 679 O GLY A 42 -1.891 -10.407 6.635 1.00 0.00 O ATOM 0 H GLY A 42 0.639 -12.153 3.631 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.511 -11.939 4.248 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.129 -12.712 5.773 1.00 0.00 H new ATOM 683 N HIS A 43 -0.110 -9.632 5.499 1.00 0.00 N ATOM 684 CA HIS A 43 -0.154 -8.311 6.116 1.00 0.00 C ATOM 685 C HIS A 43 0.427 -7.255 5.180 1.00 0.00 C ATOM 686 O HIS A 43 1.465 -7.470 4.553 1.00 0.00 O ATOM 687 CB HIS A 43 0.615 -8.317 7.437 1.00 0.00 C ATOM 688 CG HIS A 43 0.057 -9.267 8.451 1.00 0.00 C ATOM 689 ND1 HIS A 43 -1.129 -9.045 9.119 1.00 0.00 N ATOM 690 CD2 HIS A 43 0.529 -10.451 8.909 1.00 0.00 C ATOM 691 CE1 HIS A 43 -1.361 -10.049 9.944 1.00 0.00 C ATOM 692 NE2 HIS A 43 -0.371 -10.916 9.836 1.00 0.00 N ATOM 0 H HIS A 43 0.642 -9.756 4.821 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.197 -8.063 6.312 1.00 0.00 H new ATOM 0 HB2 HIS A 43 1.655 -8.577 7.241 1.00 0.00 H new ATOM 0 HB3 HIS A 43 0.612 -7.310 7.854 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.443 -10.938 8.602 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -2.216 -10.145 10.597 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -0.288 -11.789 10.357 1.00 0.00 H new ATOM 700 N ASP A 44 -0.249 -6.115 5.090 1.00 0.00 N ATOM 701 CA ASP A 44 0.199 -5.026 4.231 1.00 0.00 C ATOM 702 C ASP A 44 0.766 -3.878 5.061 1.00 0.00 C ATOM 703 O ASP A 44 0.980 -4.015 6.265 1.00 0.00 O ATOM 704 CB ASP A 44 -0.956 -4.523 3.364 1.00 0.00 C ATOM 705 CG ASP A 44 -1.910 -3.629 4.132 1.00 0.00 C ATOM 706 OD1 ASP A 44 -1.989 -2.426 3.806 1.00 0.00 O ATOM 707 OD2 ASP A 44 -2.578 -4.133 5.059 1.00 0.00 O ATOM 0 H ASP A 44 -1.110 -5.921 5.602 1.00 0.00 H new ATOM 0 HA ASP A 44 0.989 -5.408 3.584 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.555 -3.974 2.512 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.504 -5.376 2.964 1.00 0.00 H new ATOM 712 N PHE A 45 1.008 -2.746 4.408 1.00 0.00 N ATOM 713 CA PHE A 45 1.553 -1.574 5.085 1.00 0.00 C ATOM 714 C PHE A 45 0.886 -0.297 4.582 1.00 0.00 C ATOM 715 O PHE A 45 1.527 0.546 3.956 1.00 0.00 O ATOM 716 CB PHE A 45 3.065 -1.492 4.869 1.00 0.00 C ATOM 717 CG PHE A 45 3.769 -2.807 5.048 1.00 0.00 C ATOM 718 CD1 PHE A 45 4.142 -3.563 3.948 1.00 0.00 C ATOM 719 CD2 PHE A 45 4.057 -3.287 6.315 1.00 0.00 C ATOM 720 CE1 PHE A 45 4.790 -4.773 4.109 1.00 0.00 C ATOM 721 CE2 PHE A 45 4.705 -4.496 6.482 1.00 0.00 C ATOM 722 CZ PHE A 45 5.071 -5.241 5.378 1.00 0.00 C ATOM 0 H PHE A 45 0.836 -2.615 3.411 1.00 0.00 H new ATOM 0 HA PHE A 45 1.350 -1.673 6.151 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.261 -1.118 3.864 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.485 -0.767 5.566 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.924 -3.202 2.954 1.00 0.00 H new ATOM 0 HD2 PHE A 45 3.772 -2.710 7.182 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.076 -5.352 3.244 1.00 0.00 H new ATOM 0 HE2 PHE A 45 4.925 -4.858 7.475 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.576 -6.187 5.507 1.00 0.00 H new ATOM 732 N SER A 46 -0.407 -0.163 4.861 1.00 0.00 N ATOM 733 CA SER A 46 -1.163 1.008 4.434 1.00 0.00 C ATOM 734 C SER A 46 -0.793 2.229 5.271 1.00 0.00 C ATOM 735 O SER A 46 -0.510 3.300 4.735 1.00 0.00 O ATOM 736 CB SER A 46 -2.666 0.739 4.541 1.00 0.00 C ATOM 737 OG SER A 46 -3.379 1.930 4.823 1.00 0.00 O ATOM 0 H SER A 46 -0.952 -0.851 5.381 1.00 0.00 H new ATOM 0 HA SER A 46 -0.911 1.212 3.393 1.00 0.00 H new ATOM 0 HB2 SER A 46 -3.028 0.307 3.608 1.00 0.00 H new ATOM 0 HB3 SER A 46 -2.852 0.006 5.326 1.00 0.00 H new ATOM 0 HG SER A 46 -4.337 1.731 4.885 1.00 0.00 H new ATOM 743 N ASP A 47 -0.799 2.058 6.588 1.00 0.00 N ATOM 744 CA ASP A 47 -0.463 3.144 7.502 1.00 0.00 C ATOM 745 C ASP A 47 0.870 3.780 7.122 1.00 0.00 C ATOM 746 O ASP A 47 1.919 3.142 7.204 1.00 0.00 O ATOM 747 CB ASP A 47 -0.406 2.630 8.941 1.00 0.00 C ATOM 748 CG ASP A 47 -1.707 2.850 9.687 1.00 0.00 C ATOM 749 OD1 ASP A 47 -1.688 2.820 10.935 1.00 0.00 O ATOM 750 OD2 ASP A 47 -2.744 3.053 9.022 1.00 0.00 O ATOM 0 H ASP A 47 -1.033 1.178 7.047 1.00 0.00 H new ATOM 0 HA ASP A 47 -1.242 3.903 7.427 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -0.170 1.566 8.934 1.00 0.00 H new ATOM 0 HB3 ASP A 47 0.403 3.133 9.471 1.00 0.00 H new ATOM 755 N ALA A 48 0.822 5.042 6.706 1.00 0.00 N ATOM 756 CA ALA A 48 2.025 5.764 6.315 1.00 0.00 C ATOM 757 C ALA A 48 3.036 5.807 7.457 1.00 0.00 C ATOM 758 O ALA A 48 4.231 5.990 7.232 1.00 0.00 O ATOM 759 CB ALA A 48 1.672 7.175 5.868 1.00 0.00 C ATOM 0 H ALA A 48 -0.038 5.585 6.631 1.00 0.00 H new ATOM 0 HA ALA A 48 2.482 5.233 5.480 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.581 7.703 5.579 1.00 0.00 H new ATOM 0 HB2 ALA A 48 0.993 7.128 5.017 1.00 0.00 H new ATOM 0 HB3 ALA A 48 1.189 7.706 6.688 1.00 0.00 H new ATOM 765 N GLU A 49 2.546 5.636 8.681 1.00 0.00 N ATOM 766 CA GLU A 49 3.407 5.657 9.857 1.00 0.00 C ATOM 767 C GLU A 49 3.816 4.242 10.258 1.00 0.00 C ATOM 768 O GLU A 49 4.127 3.980 11.420 1.00 0.00 O ATOM 769 CB GLU A 49 2.697 6.345 11.025 1.00 0.00 C ATOM 770 CG GLU A 49 1.330 5.758 11.337 1.00 0.00 C ATOM 771 CD GLU A 49 0.964 5.880 12.803 1.00 0.00 C ATOM 772 OE1 GLU A 49 -0.228 6.111 13.099 1.00 0.00 O ATOM 773 OE2 GLU A 49 1.867 5.744 13.654 1.00 0.00 O ATOM 0 H GLU A 49 1.558 5.482 8.884 1.00 0.00 H new ATOM 0 HA GLU A 49 4.307 6.219 9.606 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.325 6.274 11.913 1.00 0.00 H new ATOM 0 HB3 GLU A 49 2.585 7.405 10.797 1.00 0.00 H new ATOM 0 HG2 GLU A 49 0.575 6.264 10.735 1.00 0.00 H new ATOM 0 HG3 GLU A 49 1.316 4.707 11.049 1.00 0.00 H new ATOM 780 N TYR A 50 3.811 3.335 9.288 1.00 0.00 N ATOM 781 CA TYR A 50 4.178 1.946 9.538 1.00 0.00 C ATOM 782 C TYR A 50 4.561 1.241 8.241 1.00 0.00 C ATOM 783 O TYR A 50 4.046 0.167 7.930 1.00 0.00 O ATOM 784 CB TYR A 50 3.022 1.206 10.213 1.00 0.00 C ATOM 785 CG TYR A 50 3.399 -0.166 10.725 1.00 0.00 C ATOM 786 CD1 TYR A 50 4.388 -0.321 11.688 1.00 0.00 C ATOM 787 CD2 TYR A 50 2.766 -1.307 10.246 1.00 0.00 C ATOM 788 CE1 TYR A 50 4.737 -1.573 12.159 1.00 0.00 C ATOM 789 CE2 TYR A 50 3.107 -2.562 10.712 1.00 0.00 C ATOM 790 CZ TYR A 50 4.093 -2.689 11.669 1.00 0.00 C ATOM 791 OH TYR A 50 4.436 -3.938 12.135 1.00 0.00 O ATOM 0 H TYR A 50 3.557 3.536 8.321 1.00 0.00 H new ATOM 0 HA TYR A 50 5.043 1.939 10.202 1.00 0.00 H new ATOM 0 HB2 TYR A 50 2.653 1.806 11.045 1.00 0.00 H new ATOM 0 HB3 TYR A 50 2.201 1.107 9.503 1.00 0.00 H new ATOM 0 HD1 TYR A 50 4.893 0.552 12.075 1.00 0.00 H new ATOM 0 HD2 TYR A 50 1.994 -1.211 9.497 1.00 0.00 H new ATOM 0 HE1 TYR A 50 5.510 -1.676 12.906 1.00 0.00 H new ATOM 0 HE2 TYR A 50 2.605 -3.438 10.330 1.00 0.00 H new ATOM 0 HH TYR A 50 3.887 -4.616 11.688 1.00 0.00 H new ATOM 801 N ILE A 51 5.469 1.853 7.488 1.00 0.00 N ATOM 802 CA ILE A 51 5.923 1.284 6.226 1.00 0.00 C ATOM 803 C ILE A 51 7.424 1.018 6.251 1.00 0.00 C ATOM 804 O ILE A 51 8.210 1.690 5.582 1.00 0.00 O ATOM 805 CB ILE A 51 5.597 2.213 5.041 1.00 0.00 C ATOM 806 CG1 ILE A 51 4.106 2.556 5.028 1.00 0.00 C ATOM 807 CG2 ILE A 51 6.007 1.561 3.729 1.00 0.00 C ATOM 808 CD1 ILE A 51 3.708 3.477 3.896 1.00 0.00 C ATOM 0 H ILE A 51 5.904 2.743 7.730 1.00 0.00 H new ATOM 0 HA ILE A 51 5.392 0.341 6.095 1.00 0.00 H new ATOM 0 HB ILE A 51 6.162 3.138 5.158 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.530 1.634 4.955 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.841 3.023 5.976 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.770 2.229 2.901 1.00 0.00 H new ATOM 0 HG22 ILE A 51 7.079 1.363 3.740 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.466 0.623 3.604 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.638 3.677 3.949 1.00 0.00 H new ATOM 0 HD12 ILE A 51 4.257 4.415 3.980 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.942 3.003 2.942 1.00 0.00 H new ATOM 820 N PRO A 52 7.834 0.013 7.039 1.00 0.00 N ATOM 821 CA PRO A 52 9.243 -0.367 7.168 1.00 0.00 C ATOM 822 C PRO A 52 9.790 -1.010 5.898 1.00 0.00 C ATOM 823 O PRO A 52 9.110 -1.809 5.253 1.00 0.00 O ATOM 824 CB PRO A 52 9.234 -1.378 8.318 1.00 0.00 C ATOM 825 CG PRO A 52 7.856 -1.945 8.313 1.00 0.00 C ATOM 826 CD PRO A 52 6.952 -0.830 7.863 1.00 0.00 C ATOM 0 HA PRO A 52 9.883 0.497 7.346 1.00 0.00 H new ATOM 0 HB2 PRO A 52 9.983 -2.156 8.167 1.00 0.00 H new ATOM 0 HB3 PRO A 52 9.461 -0.897 9.270 1.00 0.00 H new ATOM 0 HG2 PRO A 52 7.788 -2.799 7.639 1.00 0.00 H new ATOM 0 HG3 PRO A 52 7.576 -2.299 9.305 1.00 0.00 H new ATOM 0 HD2 PRO A 52 6.105 -1.206 7.289 1.00 0.00 H new ATOM 0 HD3 PRO A 52 6.544 -0.277 8.709 1.00 0.00 H new ATOM 834 N LEU A 53 11.021 -0.658 5.545 1.00 0.00 N ATOM 835 CA LEU A 53 11.659 -1.201 4.351 1.00 0.00 C ATOM 836 C LEU A 53 13.063 -1.708 4.667 1.00 0.00 C ATOM 837 O LEU A 53 14.066 -1.070 4.346 1.00 0.00 O ATOM 838 CB LEU A 53 11.723 -0.138 3.254 1.00 0.00 C ATOM 839 CG LEU A 53 10.747 -0.314 2.090 1.00 0.00 C ATOM 840 CD1 LEU A 53 9.355 -0.644 2.606 1.00 0.00 C ATOM 841 CD2 LEU A 53 10.715 0.938 1.226 1.00 0.00 C ATOM 0 H LEU A 53 11.597 0.001 6.068 1.00 0.00 H new ATOM 0 HA LEU A 53 11.060 -2.041 3.999 1.00 0.00 H new ATOM 0 HB2 LEU A 53 11.543 0.836 3.709 1.00 0.00 H new ATOM 0 HB3 LEU A 53 12.736 -0.120 2.853 1.00 0.00 H new ATOM 0 HG LEU A 53 11.091 -1.146 1.475 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.674 -0.766 1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.390 -1.569 3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 53 9.002 0.166 3.244 1.00 0.00 H new ATOM 0 HD21 LEU A 53 10.015 0.794 0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 53 10.396 1.788 1.829 1.00 0.00 H new ATOM 0 HD23 LEU A 53 11.711 1.130 0.826 1.00 0.00 H new ATOM 853 N PRO A 54 13.138 -2.883 5.308 1.00 0.00 N ATOM 854 CA PRO A 54 14.413 -3.503 5.679 1.00 0.00 C ATOM 855 C PRO A 54 15.188 -4.005 4.465 1.00 0.00 C ATOM 856 O PRO A 54 14.828 -3.715 3.324 1.00 0.00 O ATOM 857 CB PRO A 54 13.993 -4.677 6.567 1.00 0.00 C ATOM 858 CG PRO A 54 12.606 -5.004 6.131 1.00 0.00 C ATOM 859 CD PRO A 54 11.983 -3.698 5.720 1.00 0.00 C ATOM 0 HA PRO A 54 15.081 -2.796 6.171 1.00 0.00 H new ATOM 0 HB2 PRO A 54 14.660 -5.529 6.438 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.023 -4.406 7.622 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.614 -5.711 5.301 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.042 -5.468 6.940 1.00 0.00 H new ATOM 0 HD2 PRO A 54 11.273 -3.831 4.903 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.439 -3.236 6.543 1.00 0.00 H new ATOM 867 N GLU A 55 16.254 -4.757 4.719 1.00 0.00 N ATOM 868 CA GLU A 55 17.080 -5.298 3.645 1.00 0.00 C ATOM 869 C GLU A 55 16.412 -6.512 3.004 1.00 0.00 C ATOM 870 O GLU A 55 16.662 -6.831 1.841 1.00 0.00 O ATOM 871 CB GLU A 55 18.461 -5.685 4.179 1.00 0.00 C ATOM 872 CG GLU A 55 19.391 -6.241 3.114 1.00 0.00 C ATOM 873 CD GLU A 55 20.719 -5.510 3.060 1.00 0.00 C ATOM 874 OE1 GLU A 55 20.709 -4.276 2.872 1.00 0.00 O ATOM 875 OE2 GLU A 55 21.767 -6.173 3.206 1.00 0.00 O ATOM 0 H GLU A 55 16.566 -5.006 5.658 1.00 0.00 H new ATOM 0 HA GLU A 55 17.196 -4.525 2.885 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.924 -4.809 4.633 1.00 0.00 H new ATOM 0 HB3 GLU A 55 18.341 -6.427 4.968 1.00 0.00 H new ATOM 0 HG2 GLU A 55 19.570 -7.298 3.309 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.904 -6.175 2.141 1.00 0.00 H new ATOM 882 N THR A 56 15.562 -7.186 3.772 1.00 0.00 N ATOM 883 CA THR A 56 14.859 -8.365 3.281 1.00 0.00 C ATOM 884 C THR A 56 13.725 -7.977 2.339 1.00 0.00 C ATOM 885 O THR A 56 13.576 -8.553 1.261 1.00 0.00 O ATOM 886 CB THR A 56 14.285 -9.200 4.441 1.00 0.00 C ATOM 887 OG1 THR A 56 13.156 -8.532 5.014 1.00 0.00 O ATOM 888 CG2 THR A 56 15.340 -9.436 5.512 1.00 0.00 C ATOM 0 H THR A 56 15.344 -6.936 4.736 1.00 0.00 H new ATOM 0 HA THR A 56 15.589 -8.965 2.738 1.00 0.00 H new ATOM 0 HB THR A 56 13.971 -10.166 4.044 1.00 0.00 H new ATOM 0 HG1 THR A 56 12.796 -9.070 5.750 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.911 -10.028 6.321 1.00 0.00 H new ATOM 0 HG22 THR A 56 16.185 -9.972 5.079 1.00 0.00 H new ATOM 0 HG23 THR A 56 15.681 -8.478 5.905 1.00 0.00 H new ATOM 896 N VAL A 57 12.928 -6.997 2.753 1.00 0.00 N ATOM 897 CA VAL A 57 11.808 -6.531 1.944 1.00 0.00 C ATOM 898 C VAL A 57 12.293 -5.902 0.643 1.00 0.00 C ATOM 899 O VAL A 57 11.886 -6.311 -0.445 1.00 0.00 O ATOM 900 CB VAL A 57 10.953 -5.503 2.710 1.00 0.00 C ATOM 901 CG1 VAL A 57 9.850 -4.955 1.817 1.00 0.00 C ATOM 902 CG2 VAL A 57 10.370 -6.128 3.969 1.00 0.00 C ATOM 0 H VAL A 57 13.037 -6.511 3.643 1.00 0.00 H new ATOM 0 HA VAL A 57 11.197 -7.405 1.716 1.00 0.00 H new ATOM 0 HB VAL A 57 11.593 -4.672 3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.256 -4.231 2.375 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.293 -4.469 0.948 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.209 -5.773 1.487 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.769 -5.388 4.498 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.743 -6.977 3.697 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.180 -6.467 4.615 1.00 0.00 H new ATOM 912 N ARG A 58 13.166 -4.907 0.762 1.00 0.00 N ATOM 913 CA ARG A 58 13.707 -4.221 -0.405 1.00 0.00 C ATOM 914 C ARG A 58 14.271 -5.221 -1.410 1.00 0.00 C ATOM 915 O ARG A 58 14.100 -5.066 -2.620 1.00 0.00 O ATOM 916 CB ARG A 58 14.797 -3.235 0.016 1.00 0.00 C ATOM 917 CG ARG A 58 14.445 -1.783 -0.261 1.00 0.00 C ATOM 918 CD ARG A 58 15.528 -0.841 0.242 1.00 0.00 C ATOM 919 NE ARG A 58 16.857 -1.240 -0.215 1.00 0.00 N ATOM 920 CZ ARG A 58 17.328 -0.972 -1.427 1.00 0.00 C ATOM 921 NH1 ARG A 58 16.584 -0.306 -2.299 1.00 0.00 N ATOM 922 NH2 ARG A 58 18.548 -1.368 -1.769 1.00 0.00 N ATOM 0 H ARG A 58 13.514 -4.558 1.655 1.00 0.00 H new ATOM 0 HA ARG A 58 12.895 -3.672 -0.881 1.00 0.00 H new ATOM 0 HB2 ARG A 58 14.992 -3.356 1.082 1.00 0.00 H new ATOM 0 HB3 ARG A 58 15.721 -3.482 -0.507 1.00 0.00 H new ATOM 0 HG2 ARG A 58 14.305 -1.639 -1.332 1.00 0.00 H new ATOM 0 HG3 ARG A 58 13.497 -1.539 0.219 1.00 0.00 H new ATOM 0 HD2 ARG A 58 15.316 0.172 -0.101 1.00 0.00 H new ATOM 0 HD3 ARG A 58 15.511 -0.818 1.332 1.00 0.00 H new ATOM 0 HE ARG A 58 17.456 -1.752 0.432 1.00 0.00 H new ATOM 0 HH11 ARG A 58 15.647 0.002 -2.040 1.00 0.00 H new ATOM 0 HH12 ARG A 58 16.949 -0.102 -3.229 1.00 0.00 H new ATOM 0 HH21 ARG A 58 19.125 -1.879 -1.100 1.00 0.00 H new ATOM 0 HH22 ARG A 58 18.909 -1.162 -2.700 1.00 0.00 H new ATOM 936 N LEU A 59 14.944 -6.247 -0.901 1.00 0.00 N ATOM 937 CA LEU A 59 15.535 -7.273 -1.754 1.00 0.00 C ATOM 938 C LEU A 59 14.457 -8.177 -2.345 1.00 0.00 C ATOM 939 O LEU A 59 14.412 -8.396 -3.555 1.00 0.00 O ATOM 940 CB LEU A 59 16.537 -8.111 -0.958 1.00 0.00 C ATOM 941 CG LEU A 59 17.399 -9.077 -1.771 1.00 0.00 C ATOM 942 CD1 LEU A 59 18.087 -8.347 -2.915 1.00 0.00 C ATOM 943 CD2 LEU A 59 18.426 -9.758 -0.877 1.00 0.00 C ATOM 0 H LEU A 59 15.094 -6.391 0.098 1.00 0.00 H new ATOM 0 HA LEU A 59 16.055 -6.775 -2.572 1.00 0.00 H new ATOM 0 HB2 LEU A 59 17.198 -7.434 -0.417 1.00 0.00 H new ATOM 0 HB3 LEU A 59 15.988 -8.685 -0.212 1.00 0.00 H new ATOM 0 HG LEU A 59 16.750 -9.843 -2.194 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.696 -9.051 -3.482 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.335 -7.907 -3.571 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.723 -7.559 -2.513 1.00 0.00 H new ATOM 0 HD21 LEU A 59 19.030 -10.442 -1.473 1.00 0.00 H new ATOM 0 HD22 LEU A 59 19.070 -9.005 -0.424 1.00 0.00 H new ATOM 0 HD23 LEU A 59 17.913 -10.316 -0.093 1.00 0.00 H new ATOM 955 N ALA A 60 13.589 -8.696 -1.483 1.00 0.00 N ATOM 956 CA ALA A 60 12.509 -9.571 -1.921 1.00 0.00 C ATOM 957 C ALA A 60 11.705 -8.931 -3.048 1.00 0.00 C ATOM 958 O ALA A 60 11.364 -9.589 -4.032 1.00 0.00 O ATOM 959 CB ALA A 60 11.599 -9.913 -0.750 1.00 0.00 C ATOM 0 H ALA A 60 13.613 -8.526 -0.478 1.00 0.00 H new ATOM 0 HA ALA A 60 12.953 -10.490 -2.304 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.797 -10.567 -1.092 1.00 0.00 H new ATOM 0 HB2 ALA A 60 12.176 -10.420 0.023 1.00 0.00 H new ATOM 0 HB3 ALA A 60 11.171 -8.997 -0.342 1.00 0.00 H new ATOM 965 N LEU A 61 11.405 -7.646 -2.898 1.00 0.00 N ATOM 966 CA LEU A 61 10.641 -6.916 -3.903 1.00 0.00 C ATOM 967 C LEU A 61 11.473 -6.689 -5.161 1.00 0.00 C ATOM 968 O LEU A 61 10.986 -6.859 -6.280 1.00 0.00 O ATOM 969 CB LEU A 61 10.170 -5.574 -3.340 1.00 0.00 C ATOM 970 CG LEU A 61 8.863 -5.027 -3.915 1.00 0.00 C ATOM 971 CD1 LEU A 61 8.950 -4.917 -5.429 1.00 0.00 C ATOM 972 CD2 LEU A 61 7.691 -5.908 -3.508 1.00 0.00 C ATOM 0 H LEU A 61 11.679 -7.088 -2.090 1.00 0.00 H new ATOM 0 HA LEU A 61 9.771 -7.517 -4.169 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.055 -5.676 -2.261 1.00 0.00 H new ATOM 0 HB3 LEU A 61 10.955 -4.836 -3.508 1.00 0.00 H new ATOM 0 HG LEU A 61 8.699 -4.029 -3.508 1.00 0.00 H new ATOM 0 HD11 LEU A 61 8.011 -4.526 -5.820 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.764 -4.244 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.138 -5.902 -5.855 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.769 -5.503 -3.926 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.847 -6.919 -3.885 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.616 -5.934 -2.421 1.00 0.00 H new ATOM 984 N LEU A 62 12.731 -6.306 -4.971 1.00 0.00 N ATOM 985 CA LEU A 62 13.633 -6.058 -6.090 1.00 0.00 C ATOM 986 C LEU A 62 13.744 -7.289 -6.983 1.00 0.00 C ATOM 987 O LEU A 62 13.768 -7.181 -8.210 1.00 0.00 O ATOM 988 CB LEU A 62 15.017 -5.659 -5.577 1.00 0.00 C ATOM 989 CG LEU A 62 15.184 -4.196 -5.164 1.00 0.00 C ATOM 990 CD1 LEU A 62 16.326 -4.049 -4.170 1.00 0.00 C ATOM 991 CD2 LEU A 62 15.423 -3.322 -6.386 1.00 0.00 C ATOM 0 H LEU A 62 13.149 -6.160 -4.052 1.00 0.00 H new ATOM 0 HA LEU A 62 13.222 -5.239 -6.681 1.00 0.00 H new ATOM 0 HB2 LEU A 62 15.260 -6.287 -4.720 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.749 -5.882 -6.354 1.00 0.00 H new ATOM 0 HG LEU A 62 14.264 -3.867 -4.680 1.00 0.00 H new ATOM 0 HD11 LEU A 62 16.430 -3.001 -3.888 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.115 -4.645 -3.282 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.253 -4.395 -4.627 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.540 -2.284 -6.074 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.328 -3.651 -6.897 1.00 0.00 H new ATOM 0 HD23 LEU A 62 14.573 -3.404 -7.064 1.00 0.00 H new ATOM 1003 N LYS A 63 13.811 -8.461 -6.361 1.00 0.00 N ATOM 1004 CA LYS A 63 13.916 -9.715 -7.098 1.00 0.00 C ATOM 1005 C LYS A 63 12.634 -9.999 -7.874 1.00 0.00 C ATOM 1006 O LYS A 63 12.678 -10.409 -9.035 1.00 0.00 O ATOM 1007 CB LYS A 63 14.210 -10.871 -6.139 1.00 0.00 C ATOM 1008 CG LYS A 63 15.641 -10.888 -5.628 1.00 0.00 C ATOM 1009 CD LYS A 63 16.119 -12.305 -5.356 1.00 0.00 C ATOM 1010 CE LYS A 63 17.588 -12.332 -4.963 1.00 0.00 C ATOM 1011 NZ LYS A 63 18.185 -13.684 -5.141 1.00 0.00 N ATOM 0 H LYS A 63 13.794 -8.569 -5.347 1.00 0.00 H new ATOM 0 HA LYS A 63 14.737 -9.622 -7.808 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.530 -10.809 -5.289 1.00 0.00 H new ATOM 0 HB3 LYS A 63 14.002 -11.814 -6.645 1.00 0.00 H new ATOM 0 HG2 LYS A 63 16.296 -10.417 -6.361 1.00 0.00 H new ATOM 0 HG3 LYS A 63 15.709 -10.298 -4.714 1.00 0.00 H new ATOM 0 HD2 LYS A 63 15.520 -12.745 -4.559 1.00 0.00 H new ATOM 0 HD3 LYS A 63 15.968 -12.918 -6.244 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.138 -11.610 -5.566 1.00 0.00 H new ATOM 0 HE3 LYS A 63 17.691 -12.024 -3.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.187 -13.661 -4.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 17.676 -14.369 -4.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 18.110 -13.968 -6.139 1.00 0.00 H new ATOM 1025 N LEU A 64 11.495 -9.777 -7.228 1.00 0.00 N ATOM 1026 CA LEU A 64 10.200 -10.008 -7.859 1.00 0.00 C ATOM 1027 C LEU A 64 9.983 -9.046 -9.023 1.00 0.00 C ATOM 1028 O LEU A 64 9.527 -9.446 -10.095 1.00 0.00 O ATOM 1029 CB LEU A 64 9.076 -9.848 -6.834 1.00 0.00 C ATOM 1030 CG LEU A 64 8.414 -11.141 -6.357 1.00 0.00 C ATOM 1031 CD1 LEU A 64 7.644 -10.903 -5.068 1.00 0.00 C ATOM 1032 CD2 LEU A 64 7.494 -11.699 -7.434 1.00 0.00 C ATOM 0 H LEU A 64 11.442 -9.437 -6.268 1.00 0.00 H new ATOM 0 HA LEU A 64 10.188 -11.027 -8.246 1.00 0.00 H new ATOM 0 HB2 LEU A 64 9.476 -9.326 -5.965 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.307 -9.207 -7.265 1.00 0.00 H new ATOM 0 HG LEU A 64 9.196 -11.874 -6.159 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.180 -11.835 -4.744 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.328 -10.550 -4.296 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.872 -10.153 -5.239 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.032 -12.619 -7.077 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.718 -10.969 -7.664 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.073 -11.909 -8.334 1.00 0.00 H new ATOM 1044 N SER A 65 10.314 -7.778 -8.806 1.00 0.00 N ATOM 1045 CA SER A 65 10.154 -6.759 -9.837 1.00 0.00 C ATOM 1046 C SER A 65 10.927 -7.134 -11.097 1.00 0.00 C ATOM 1047 O SER A 65 10.423 -6.995 -12.211 1.00 0.00 O ATOM 1048 CB SER A 65 10.630 -5.400 -9.319 1.00 0.00 C ATOM 1049 OG SER A 65 9.560 -4.472 -9.263 1.00 0.00 O ATOM 0 H SER A 65 10.695 -7.431 -7.926 1.00 0.00 H new ATOM 0 HA SER A 65 9.095 -6.694 -10.087 1.00 0.00 H new ATOM 0 HB2 SER A 65 11.066 -5.518 -8.327 1.00 0.00 H new ATOM 0 HB3 SER A 65 11.416 -5.015 -9.969 1.00 0.00 H new ATOM 0 HG SER A 65 9.230 -4.408 -8.342 1.00 0.00 H new ATOM 1055 N GLN A 66 12.154 -7.611 -10.911 1.00 0.00 N ATOM 1056 CA GLN A 66 12.998 -8.006 -12.033 1.00 0.00 C ATOM 1057 C GLN A 66 12.406 -9.207 -12.762 1.00 0.00 C ATOM 1058 O GLN A 66 12.445 -9.281 -13.991 1.00 0.00 O ATOM 1059 CB GLN A 66 14.410 -8.335 -11.545 1.00 0.00 C ATOM 1060 CG GLN A 66 15.315 -8.891 -12.632 1.00 0.00 C ATOM 1061 CD GLN A 66 16.707 -9.213 -12.125 1.00 0.00 C ATOM 1062 OE1 GLN A 66 17.648 -8.447 -12.332 1.00 0.00 O ATOM 1063 NE2 GLN A 66 16.844 -10.351 -11.455 1.00 0.00 N ATOM 0 H GLN A 66 12.585 -7.733 -9.995 1.00 0.00 H new ATOM 0 HA GLN A 66 13.048 -7.170 -12.730 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.863 -7.433 -11.133 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.345 -9.059 -10.732 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.866 -9.793 -13.047 1.00 0.00 H new ATOM 0 HG3 GLN A 66 15.387 -8.168 -13.445 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.036 -10.956 -11.307 1.00 0.00 H new ATOM 0 HE22 GLN A 66 17.757 -10.620 -11.088 1.00 0.00 H new ATOM 1072 N PHE A 67 11.859 -10.146 -11.998 1.00 0.00 N ATOM 1073 CA PHE A 67 11.260 -11.346 -12.572 1.00 0.00 C ATOM 1074 C PHE A 67 10.154 -10.983 -13.559 1.00 0.00 C ATOM 1075 O PHE A 67 10.195 -11.372 -14.726 1.00 0.00 O ATOM 1076 CB PHE A 67 10.699 -12.241 -11.466 1.00 0.00 C ATOM 1077 CG PHE A 67 9.871 -13.384 -11.981 1.00 0.00 C ATOM 1078 CD1 PHE A 67 8.494 -13.270 -12.079 1.00 0.00 C ATOM 1079 CD2 PHE A 67 10.471 -14.572 -12.366 1.00 0.00 C ATOM 1080 CE1 PHE A 67 7.730 -14.320 -12.553 1.00 0.00 C ATOM 1081 CE2 PHE A 67 9.712 -15.625 -12.841 1.00 0.00 C ATOM 1082 CZ PHE A 67 8.340 -15.499 -12.934 1.00 0.00 C ATOM 0 H PHE A 67 11.818 -10.100 -10.980 1.00 0.00 H new ATOM 0 HA PHE A 67 12.038 -11.889 -13.109 1.00 0.00 H new ATOM 0 HB2 PHE A 67 11.526 -12.638 -10.877 1.00 0.00 H new ATOM 0 HB3 PHE A 67 10.090 -11.636 -10.794 1.00 0.00 H new ATOM 0 HD1 PHE A 67 8.012 -12.350 -11.782 1.00 0.00 H new ATOM 0 HD2 PHE A 67 11.544 -14.676 -12.294 1.00 0.00 H new ATOM 0 HE1 PHE A 67 6.657 -14.218 -12.625 1.00 0.00 H new ATOM 0 HE2 PHE A 67 10.192 -16.546 -13.139 1.00 0.00 H new ATOM 0 HZ PHE A 67 7.745 -16.321 -13.304 1.00 0.00 H new ATOM 1092 N TYR A 68 9.165 -10.235 -13.080 1.00 0.00 N ATOM 1093 CA TYR A 68 8.046 -9.822 -13.918 1.00 0.00 C ATOM 1094 C TYR A 68 8.516 -8.900 -15.039 1.00 0.00 C ATOM 1095 O TYR A 68 8.217 -9.127 -16.211 1.00 0.00 O ATOM 1096 CB TYR A 68 6.983 -9.116 -13.074 1.00 0.00 C ATOM 1097 CG TYR A 68 5.794 -9.989 -12.743 1.00 0.00 C ATOM 1098 CD1 TYR A 68 5.784 -10.779 -11.600 1.00 0.00 C ATOM 1099 CD2 TYR A 68 4.681 -10.025 -13.574 1.00 0.00 C ATOM 1100 CE1 TYR A 68 4.701 -11.579 -11.294 1.00 0.00 C ATOM 1101 CE2 TYR A 68 3.593 -10.821 -13.275 1.00 0.00 C ATOM 1102 CZ TYR A 68 3.607 -11.596 -12.134 1.00 0.00 C ATOM 1103 OH TYR A 68 2.525 -12.392 -11.833 1.00 0.00 O ATOM 0 H TYR A 68 9.116 -9.903 -12.117 1.00 0.00 H new ATOM 0 HA TYR A 68 7.611 -10.716 -14.365 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.439 -8.770 -12.146 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.636 -8.231 -13.608 1.00 0.00 H new ATOM 0 HD1 TYR A 68 6.638 -10.767 -10.939 1.00 0.00 H new ATOM 0 HD2 TYR A 68 4.667 -9.420 -14.469 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.710 -12.188 -10.402 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.735 -10.837 -13.931 1.00 0.00 H new ATOM 0 HH TYR A 68 1.839 -12.287 -12.525 1.00 0.00 H new ATOM 1113 N ALA A 69 9.253 -7.858 -14.669 1.00 0.00 N ATOM 1114 CA ALA A 69 9.768 -6.902 -15.642 1.00 0.00 C ATOM 1115 C ALA A 69 10.531 -7.610 -16.757 1.00 0.00 C ATOM 1116 O ALA A 69 10.592 -7.124 -17.887 1.00 0.00 O ATOM 1117 CB ALA A 69 10.661 -5.879 -14.956 1.00 0.00 C ATOM 0 H ALA A 69 9.507 -7.654 -13.702 1.00 0.00 H new ATOM 0 HA ALA A 69 8.919 -6.385 -16.090 1.00 0.00 H new ATOM 0 HB1 ALA A 69 11.038 -5.172 -15.695 1.00 0.00 H new ATOM 0 HB2 ALA A 69 10.086 -5.343 -14.201 1.00 0.00 H new ATOM 0 HB3 ALA A 69 11.499 -6.388 -14.480 1.00 0.00 H new ATOM 1123 N LEU A 70 11.112 -8.760 -16.432 1.00 0.00 N ATOM 1124 CA LEU A 70 11.872 -9.535 -17.406 1.00 0.00 C ATOM 1125 C LEU A 70 10.942 -10.220 -18.402 1.00 0.00 C ATOM 1126 O LEU A 70 11.161 -10.159 -19.613 1.00 0.00 O ATOM 1127 CB LEU A 70 12.734 -10.580 -16.695 1.00 0.00 C ATOM 1128 CG LEU A 70 13.296 -11.697 -17.574 1.00 0.00 C ATOM 1129 CD1 LEU A 70 14.228 -11.126 -18.631 1.00 0.00 C ATOM 1130 CD2 LEU A 70 14.021 -12.731 -16.724 1.00 0.00 C ATOM 0 H LEU A 70 11.071 -9.176 -15.502 1.00 0.00 H new ATOM 0 HA LEU A 70 12.519 -8.850 -17.953 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.568 -10.068 -16.215 1.00 0.00 H new ATOM 0 HB3 LEU A 70 12.140 -11.033 -15.902 1.00 0.00 H new ATOM 0 HG LEU A 70 12.465 -12.189 -18.079 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.619 -11.936 -19.247 1.00 0.00 H new ATOM 0 HD12 LEU A 70 13.679 -10.424 -19.259 1.00 0.00 H new ATOM 0 HD13 LEU A 70 15.055 -10.608 -18.145 1.00 0.00 H new ATOM 0 HD21 LEU A 70 14.415 -13.519 -17.366 1.00 0.00 H new ATOM 0 HD22 LEU A 70 14.843 -12.253 -16.191 1.00 0.00 H new ATOM 0 HD23 LEU A 70 13.325 -13.163 -16.005 1.00 0.00 H new ATOM 1142 N ILE A 71 9.904 -10.868 -17.886 1.00 0.00 N ATOM 1143 CA ILE A 71 8.939 -11.561 -18.731 1.00 0.00 C ATOM 1144 C ILE A 71 7.734 -10.675 -19.029 1.00 0.00 C ATOM 1145 O ILE A 71 6.646 -11.169 -19.322 1.00 0.00 O ATOM 1146 CB ILE A 71 8.453 -12.867 -18.076 1.00 0.00 C ATOM 1147 CG1 ILE A 71 7.775 -12.570 -16.737 1.00 0.00 C ATOM 1148 CG2 ILE A 71 9.616 -13.829 -17.885 1.00 0.00 C ATOM 1149 CD1 ILE A 71 7.260 -13.806 -16.033 1.00 0.00 C ATOM 0 H ILE A 71 9.709 -10.928 -16.887 1.00 0.00 H new ATOM 0 HA ILE A 71 9.450 -11.801 -19.663 1.00 0.00 H new ATOM 0 HB ILE A 71 7.723 -13.337 -18.735 1.00 0.00 H new ATOM 0 HG12 ILE A 71 8.484 -12.059 -16.085 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.944 -11.884 -16.904 1.00 0.00 H new ATOM 0 HG21 ILE A 71 9.256 -14.747 -17.421 1.00 0.00 H new ATOM 0 HG22 ILE A 71 10.059 -14.061 -18.854 1.00 0.00 H new ATOM 0 HG23 ILE A 71 10.367 -13.369 -17.243 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.792 -13.520 -15.091 1.00 0.00 H new ATOM 0 HD12 ILE A 71 6.527 -14.306 -16.666 1.00 0.00 H new ATOM 0 HD13 ILE A 71 8.090 -14.484 -15.834 1.00 0.00 H new ATOM 1161 N ASN A 72 7.936 -9.364 -18.954 1.00 0.00 N ATOM 1162 CA ASN A 72 6.866 -8.409 -19.216 1.00 0.00 C ATOM 1163 C ASN A 72 6.776 -8.089 -20.706 1.00 0.00 C ATOM 1164 O ASN A 72 5.697 -7.810 -21.227 1.00 0.00 O ATOM 1165 CB ASN A 72 7.096 -7.122 -18.421 1.00 0.00 C ATOM 1166 CG ASN A 72 5.862 -6.689 -17.653 1.00 0.00 C ATOM 1167 OD1 ASN A 72 4.769 -6.596 -18.214 1.00 0.00 O ATOM 1168 ND2 ASN A 72 6.031 -6.421 -16.364 1.00 0.00 N ATOM 0 H ASN A 72 8.831 -8.938 -18.714 1.00 0.00 H new ATOM 0 HA ASN A 72 5.925 -8.860 -18.901 1.00 0.00 H new ATOM 0 HB2 ASN A 72 7.921 -7.271 -17.724 1.00 0.00 H new ATOM 0 HB3 ASN A 72 7.395 -6.326 -19.103 1.00 0.00 H new ATOM 0 HD21 ASN A 72 5.237 -6.124 -15.796 1.00 0.00 H new ATOM 0 HD22 ASN A 72 6.955 -6.512 -15.941 1.00 0.00 H new ATOM 1175 N GLY A 73 7.918 -8.134 -21.385 1.00 0.00 N ATOM 1176 CA GLY A 73 7.945 -7.848 -22.808 1.00 0.00 C ATOM 1177 C GLY A 73 9.265 -8.229 -23.450 1.00 0.00 C ATOM 1178 O GLY A 73 9.818 -7.469 -24.245 1.00 0.00 O ATOM 0 H GLY A 73 8.824 -8.363 -20.976 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.136 -8.388 -23.300 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.761 -6.785 -22.966 1.00 0.00 H new ATOM 1182 N ASP A 74 9.770 -9.407 -23.105 1.00 0.00 N ATOM 1183 CA ASP A 74 11.033 -9.888 -23.653 1.00 0.00 C ATOM 1184 C ASP A 74 11.027 -9.815 -25.176 1.00 0.00 C ATOM 1185 O ASP A 74 11.658 -8.940 -25.768 1.00 0.00 O ATOM 1186 CB ASP A 74 11.297 -11.324 -23.199 1.00 0.00 C ATOM 1187 CG ASP A 74 12.555 -11.904 -23.815 1.00 0.00 C ATOM 1188 OD1 ASP A 74 12.441 -12.864 -24.606 1.00 0.00 O ATOM 1189 OD2 ASP A 74 13.654 -11.398 -23.506 1.00 0.00 O ATOM 0 H ASP A 74 9.324 -10.047 -22.448 1.00 0.00 H new ATOM 0 HA ASP A 74 11.831 -9.246 -23.280 1.00 0.00 H new ATOM 0 HB2 ASP A 74 11.383 -11.348 -22.113 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.444 -11.949 -23.465 1.00 0.00 H new ATOM 1194 N GLU A 75 10.311 -10.743 -25.805 1.00 0.00 N ATOM 1195 CA GLU A 75 10.226 -10.784 -27.260 1.00 0.00 C ATOM 1196 C GLU A 75 8.883 -11.354 -27.710 1.00 0.00 C ATOM 1197 O GLU A 75 8.049 -10.640 -28.266 1.00 0.00 O ATOM 1198 CB GLU A 75 11.368 -11.624 -27.837 1.00 0.00 C ATOM 1199 CG GLU A 75 12.369 -10.816 -28.645 1.00 0.00 C ATOM 1200 CD GLU A 75 13.240 -11.685 -29.531 1.00 0.00 C ATOM 1201 OE1 GLU A 75 14.158 -11.139 -30.178 1.00 0.00 O ATOM 1202 OE2 GLU A 75 13.003 -12.910 -29.578 1.00 0.00 O ATOM 0 H GLU A 75 9.783 -11.475 -25.330 1.00 0.00 H new ATOM 0 HA GLU A 75 10.312 -9.763 -27.632 1.00 0.00 H new ATOM 0 HB2 GLU A 75 11.890 -12.122 -27.020 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.949 -12.406 -28.471 1.00 0.00 H new ATOM 0 HG2 GLU A 75 11.834 -10.095 -29.263 1.00 0.00 H new ATOM 0 HG3 GLU A 75 13.003 -10.246 -27.966 1.00 0.00 H new ATOM 1209 N SER A 76 8.684 -12.645 -27.465 1.00 0.00 N ATOM 1210 CA SER A 76 7.445 -13.313 -27.849 1.00 0.00 C ATOM 1211 C SER A 76 6.970 -14.253 -26.744 1.00 0.00 C ATOM 1212 O SER A 76 6.914 -15.468 -26.930 1.00 0.00 O ATOM 1213 CB SER A 76 7.644 -14.095 -29.148 1.00 0.00 C ATOM 1214 OG SER A 76 6.427 -14.210 -29.866 1.00 0.00 O ATOM 0 H SER A 76 9.364 -13.249 -27.003 1.00 0.00 H new ATOM 0 HA SER A 76 6.683 -12.550 -28.006 1.00 0.00 H new ATOM 0 HB2 SER A 76 8.389 -13.595 -29.767 1.00 0.00 H new ATOM 0 HB3 SER A 76 8.032 -15.088 -28.922 1.00 0.00 H new ATOM 0 HG SER A 76 6.581 -14.713 -30.693 1.00 0.00 H new ATOM 1220 N ILE A 77 6.630 -13.680 -25.595 1.00 0.00 N ATOM 1221 CA ILE A 77 6.159 -14.464 -24.461 1.00 0.00 C ATOM 1222 C ILE A 77 4.638 -14.568 -24.458 1.00 0.00 C ATOM 1223 O ILE A 77 3.936 -13.556 -24.480 1.00 0.00 O ATOM 1224 CB ILE A 77 6.623 -13.857 -23.124 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.120 -13.544 -23.173 1.00 0.00 C ATOM 1226 CG2 ILE A 77 6.312 -14.804 -21.975 1.00 0.00 C ATOM 1227 CD1 ILE A 77 8.651 -12.929 -21.897 1.00 0.00 C ATOM 0 H ILE A 77 6.672 -12.675 -25.425 1.00 0.00 H new ATOM 0 HA ILE A 77 6.589 -15.460 -24.567 1.00 0.00 H new ATOM 0 HB ILE A 77 6.081 -12.926 -22.958 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.668 -14.463 -23.379 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.314 -12.864 -24.003 1.00 0.00 H new ATOM 0 HG21 ILE A 77 6.646 -14.360 -21.037 1.00 0.00 H new ATOM 0 HG22 ILE A 77 5.237 -14.981 -21.930 1.00 0.00 H new ATOM 0 HG23 ILE A 77 6.829 -15.750 -22.133 1.00 0.00 H new ATOM 0 HD11 ILE A 77 9.718 -12.734 -22.004 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.129 -11.993 -21.700 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.489 -13.617 -21.067 1.00 0.00 H new ATOM 1443 N TYR A 91 3.904 -18.150 -17.363 1.00 0.00 N ATOM 1444 CA TYR A 91 4.688 -17.701 -18.507 1.00 0.00 C ATOM 1445 C TYR A 91 5.505 -18.849 -19.092 1.00 0.00 C ATOM 1446 O TYR A 91 5.748 -19.857 -18.427 1.00 0.00 O ATOM 1447 CB TYR A 91 5.617 -16.557 -18.097 1.00 0.00 C ATOM 1448 CG TYR A 91 4.889 -15.360 -17.529 1.00 0.00 C ATOM 1449 CD1 TYR A 91 4.408 -15.369 -16.226 1.00 0.00 C ATOM 1450 CD2 TYR A 91 4.681 -14.220 -18.296 1.00 0.00 C ATOM 1451 CE1 TYR A 91 3.741 -14.278 -15.703 1.00 0.00 C ATOM 1452 CE2 TYR A 91 4.017 -13.124 -17.781 1.00 0.00 C ATOM 1453 CZ TYR A 91 3.548 -13.158 -16.484 1.00 0.00 C ATOM 1454 OH TYR A 91 2.885 -12.068 -15.967 1.00 0.00 O ATOM 0 HA TYR A 91 3.997 -17.344 -19.271 1.00 0.00 H new ATOM 0 HB2 TYR A 91 6.327 -16.925 -17.357 1.00 0.00 H new ATOM 0 HB3 TYR A 91 6.196 -16.241 -18.965 1.00 0.00 H new ATOM 0 HD1 TYR A 91 4.558 -16.244 -15.611 1.00 0.00 H new ATOM 0 HD2 TYR A 91 5.045 -14.191 -19.312 1.00 0.00 H new ATOM 0 HE1 TYR A 91 3.373 -14.302 -14.688 1.00 0.00 H new ATOM 0 HE2 TYR A 91 3.866 -12.245 -18.390 1.00 0.00 H new ATOM 0 HH TYR A 91 3.410 -11.683 -15.234 1.00 0.00 H new ATOM 1464 N THR A 92 5.927 -18.689 -20.342 1.00 0.00 N ATOM 1465 CA THR A 92 6.716 -19.711 -21.019 1.00 0.00 C ATOM 1466 C THR A 92 7.753 -19.083 -21.944 1.00 0.00 C ATOM 1467 O THR A 92 7.407 -18.462 -22.950 1.00 0.00 O ATOM 1468 CB THR A 92 5.822 -20.660 -21.839 1.00 0.00 C ATOM 1469 OG1 THR A 92 4.855 -21.281 -20.985 1.00 0.00 O ATOM 1470 CG2 THR A 92 6.656 -21.728 -22.530 1.00 0.00 C ATOM 0 H THR A 92 5.736 -17.861 -20.906 1.00 0.00 H new ATOM 0 HA THR A 92 7.224 -20.283 -20.243 1.00 0.00 H new ATOM 0 HB THR A 92 5.310 -20.073 -22.601 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.289 -21.882 -21.514 1.00 0.00 H new ATOM 0 HG21 THR A 92 6.002 -22.386 -23.103 1.00 0.00 H new ATOM 0 HG22 THR A 92 7.371 -21.253 -23.201 1.00 0.00 H new ATOM 0 HG23 THR A 92 7.193 -22.311 -21.782 1.00 0.00 H new ATOM 1478 N LEU A 93 9.025 -19.248 -21.598 1.00 0.00 N ATOM 1479 CA LEU A 93 10.113 -18.697 -22.398 1.00 0.00 C ATOM 1480 C LEU A 93 10.299 -19.493 -23.686 1.00 0.00 C ATOM 1481 O LEU A 93 9.911 -20.657 -23.769 1.00 0.00 O ATOM 1482 CB LEU A 93 11.414 -18.695 -21.593 1.00 0.00 C ATOM 1483 CG LEU A 93 11.283 -18.364 -20.106 1.00 0.00 C ATOM 1484 CD1 LEU A 93 12.655 -18.273 -19.457 1.00 0.00 C ATOM 1485 CD2 LEU A 93 10.513 -17.066 -19.915 1.00 0.00 C ATOM 0 H LEU A 93 9.328 -19.759 -20.769 1.00 0.00 H new ATOM 0 HA LEU A 93 9.855 -17.671 -22.661 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.877 -19.677 -21.687 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.097 -17.976 -22.046 1.00 0.00 H new ATOM 0 HG LEU A 93 10.728 -19.167 -19.622 1.00 0.00 H new ATOM 0 HD11 LEU A 93 12.542 -18.037 -18.399 1.00 0.00 H new ATOM 0 HD12 LEU A 93 13.171 -19.227 -19.563 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.236 -17.490 -19.944 1.00 0.00 H new ATOM 0 HD21 LEU A 93 10.429 -16.846 -18.851 1.00 0.00 H new ATOM 0 HD22 LEU A 93 11.041 -16.253 -20.413 1.00 0.00 H new ATOM 0 HD23 LEU A 93 9.516 -17.168 -20.344 1.00 0.00 H new ATOM 1497 N GLY A 94 10.897 -18.856 -24.688 1.00 0.00 N ATOM 1498 CA GLY A 94 11.126 -19.521 -25.957 1.00 0.00 C ATOM 1499 C GLY A 94 11.832 -20.852 -25.796 1.00 0.00 C ATOM 1500 O GLY A 94 11.404 -21.862 -26.355 1.00 0.00 O ATOM 0 H GLY A 94 11.227 -17.892 -24.644 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.171 -19.678 -26.458 1.00 0.00 H new ATOM 0 HA3 GLY A 94 11.721 -18.873 -26.601 1.00 0.00 H new ATOM 1504 N ASP A 95 12.918 -20.855 -25.030 1.00 0.00 N ATOM 1505 CA ASP A 95 13.686 -22.073 -24.797 1.00 0.00 C ATOM 1506 C ASP A 95 12.797 -23.176 -24.233 1.00 0.00 C ATOM 1507 O ASP A 95 13.080 -24.362 -24.399 1.00 0.00 O ATOM 1508 CB ASP A 95 14.845 -21.795 -23.839 1.00 0.00 C ATOM 1509 CG ASP A 95 15.999 -21.082 -24.517 1.00 0.00 C ATOM 1510 OD1 ASP A 95 17.015 -21.745 -24.811 1.00 0.00 O ATOM 1511 OD2 ASP A 95 15.884 -19.861 -24.754 1.00 0.00 O ATOM 0 H ASP A 95 13.286 -20.028 -24.560 1.00 0.00 H new ATOM 0 HA ASP A 95 14.088 -22.408 -25.753 1.00 0.00 H new ATOM 0 HB2 ASP A 95 14.487 -21.190 -23.006 1.00 0.00 H new ATOM 0 HB3 ASP A 95 15.200 -22.737 -23.420 1.00 0.00 H new ATOM 1516 N GLY A 96 11.719 -22.777 -23.564 1.00 0.00 N ATOM 1517 CA GLY A 96 10.805 -23.744 -22.984 1.00 0.00 C ATOM 1518 C GLY A 96 10.964 -23.863 -21.481 1.00 0.00 C ATOM 1519 O GLY A 96 10.545 -24.854 -20.883 1.00 0.00 O ATOM 0 H GLY A 96 11.463 -21.801 -23.413 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.780 -23.455 -23.216 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.973 -24.719 -23.442 1.00 0.00 H new ATOM 1523 N SER A 97 11.573 -22.852 -20.870 1.00 0.00 N ATOM 1524 CA SER A 97 11.791 -22.850 -19.428 1.00 0.00 C ATOM 1525 C SER A 97 10.606 -22.225 -18.700 1.00 0.00 C ATOM 1526 O SER A 97 9.980 -21.289 -19.198 1.00 0.00 O ATOM 1527 CB SER A 97 13.074 -22.089 -19.087 1.00 0.00 C ATOM 1528 OG SER A 97 13.565 -21.385 -20.214 1.00 0.00 O ATOM 0 H SER A 97 11.924 -22.024 -21.351 1.00 0.00 H new ATOM 0 HA SER A 97 11.892 -23.884 -19.099 1.00 0.00 H new ATOM 0 HB2 SER A 97 12.880 -21.390 -18.274 1.00 0.00 H new ATOM 0 HB3 SER A 97 13.832 -22.788 -18.733 1.00 0.00 H new ATOM 0 HG SER A 97 14.393 -20.919 -19.973 1.00 0.00 H new ATOM 1534 N SER A 98 10.303 -22.749 -17.517 1.00 0.00 N ATOM 1535 CA SER A 98 9.190 -22.246 -16.720 1.00 0.00 C ATOM 1536 C SER A 98 9.678 -21.249 -15.673 1.00 0.00 C ATOM 1537 O SER A 98 9.790 -21.577 -14.491 1.00 0.00 O ATOM 1538 CB SER A 98 8.460 -23.403 -16.037 1.00 0.00 C ATOM 1539 OG SER A 98 7.886 -24.279 -16.992 1.00 0.00 O ATOM 0 H SER A 98 10.813 -23.522 -17.089 1.00 0.00 H new ATOM 0 HA SER A 98 8.499 -21.734 -17.389 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.157 -23.954 -15.406 1.00 0.00 H new ATOM 0 HB3 SER A 98 7.680 -23.010 -15.384 1.00 0.00 H new ATOM 0 HG SER A 98 7.427 -25.011 -16.530 1.00 0.00 H new ATOM 1545 N LEU A 99 9.968 -20.031 -16.116 1.00 0.00 N ATOM 1546 CA LEU A 99 10.445 -18.984 -15.219 1.00 0.00 C ATOM 1547 C LEU A 99 9.516 -18.831 -14.018 1.00 0.00 C ATOM 1548 O LEU A 99 8.387 -18.361 -14.152 1.00 0.00 O ATOM 1549 CB LEU A 99 10.553 -17.654 -15.967 1.00 0.00 C ATOM 1550 CG LEU A 99 11.727 -16.756 -15.573 1.00 0.00 C ATOM 1551 CD1 LEU A 99 12.908 -16.982 -16.505 1.00 0.00 C ATOM 1552 CD2 LEU A 99 11.308 -15.294 -15.586 1.00 0.00 C ATOM 0 H LEU A 99 9.881 -19.744 -17.091 1.00 0.00 H new ATOM 0 HA LEU A 99 11.432 -19.272 -14.857 1.00 0.00 H new ATOM 0 HB2 LEU A 99 10.625 -17.865 -17.034 1.00 0.00 H new ATOM 0 HB3 LEU A 99 9.628 -17.098 -15.814 1.00 0.00 H new ATOM 0 HG LEU A 99 12.034 -17.016 -14.560 1.00 0.00 H new ATOM 0 HD11 LEU A 99 13.734 -16.335 -16.210 1.00 0.00 H new ATOM 0 HD12 LEU A 99 13.224 -18.023 -16.446 1.00 0.00 H new ATOM 0 HD13 LEU A 99 12.613 -16.750 -17.528 1.00 0.00 H new ATOM 0 HD21 LEU A 99 12.156 -14.670 -15.303 1.00 0.00 H new ATOM 0 HD22 LEU A 99 10.974 -15.020 -16.587 1.00 0.00 H new ATOM 0 HD23 LEU A 99 10.494 -15.143 -14.877 1.00 0.00 H new ATOM 1564 N GLN A 100 10.002 -19.229 -12.847 1.00 0.00 N ATOM 1565 CA GLN A 100 9.215 -19.135 -11.623 1.00 0.00 C ATOM 1566 C GLN A 100 9.664 -17.947 -10.778 1.00 0.00 C ATOM 1567 O GLN A 100 10.834 -17.565 -10.796 1.00 0.00 O ATOM 1568 CB GLN A 100 9.336 -20.427 -10.813 1.00 0.00 C ATOM 1569 CG GLN A 100 8.558 -21.591 -11.405 1.00 0.00 C ATOM 1570 CD GLN A 100 7.107 -21.245 -11.678 1.00 0.00 C ATOM 1571 OE1 GLN A 100 6.668 -21.218 -12.828 1.00 0.00 O ATOM 1572 NE2 GLN A 100 6.353 -20.976 -10.618 1.00 0.00 N ATOM 0 H GLN A 100 10.936 -19.619 -12.720 1.00 0.00 H new ATOM 0 HA GLN A 100 8.172 -18.986 -11.902 1.00 0.00 H new ATOM 0 HB2 GLN A 100 10.388 -20.703 -10.740 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.984 -20.244 -9.798 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.033 -21.906 -12.334 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.603 -22.438 -10.721 1.00 0.00 H new ATOM 0 HE21 GLN A 100 6.758 -21.010 -9.682 1.00 0.00 H new ATOM 0 HE22 GLN A 100 5.369 -20.735 -10.740 1.00 0.00 H new ATOM 1581 N LYS A 101 8.726 -17.367 -10.037 1.00 0.00 N ATOM 1582 CA LYS A 101 9.023 -16.223 -9.183 1.00 0.00 C ATOM 1583 C LYS A 101 10.216 -16.515 -8.278 1.00 0.00 C ATOM 1584 O LYS A 101 10.581 -17.668 -8.044 1.00 0.00 O ATOM 1585 CB LYS A 101 7.802 -15.861 -8.335 1.00 0.00 C ATOM 1586 CG LYS A 101 6.843 -14.907 -9.026 1.00 0.00 C ATOM 1587 CD LYS A 101 5.449 -15.501 -9.138 1.00 0.00 C ATOM 1588 CE LYS A 101 4.376 -14.426 -9.051 1.00 0.00 C ATOM 1589 NZ LYS A 101 3.211 -14.870 -8.237 1.00 0.00 N ATOM 0 H LYS A 101 7.753 -17.671 -10.011 1.00 0.00 H new ATOM 0 HA LYS A 101 9.274 -15.378 -9.825 1.00 0.00 H new ATOM 0 HB2 LYS A 101 7.268 -16.774 -8.074 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.139 -15.411 -7.401 1.00 0.00 H new ATOM 0 HG2 LYS A 101 6.797 -13.970 -8.470 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.219 -14.669 -10.021 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.355 -16.035 -10.084 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.299 -16.232 -8.343 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.801 -13.523 -8.614 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.040 -14.166 -10.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.743 -14.040 -7.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 2.537 -15.378 -8.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.538 -15.502 -7.478 1.00 0.00 H new ATOM 1603 N PRO A 102 10.837 -15.448 -7.753 1.00 0.00 N ATOM 1604 CA PRO A 102 11.996 -15.566 -6.863 1.00 0.00 C ATOM 1605 C PRO A 102 11.624 -16.142 -5.501 1.00 0.00 C ATOM 1606 O PRO A 102 10.569 -15.828 -4.950 1.00 0.00 O ATOM 1607 CB PRO A 102 12.480 -14.121 -6.718 1.00 0.00 C ATOM 1608 CG PRO A 102 11.271 -13.289 -6.976 1.00 0.00 C ATOM 1609 CD PRO A 102 10.456 -14.046 -7.988 1.00 0.00 C ATOM 0 HA PRO A 102 12.750 -16.245 -7.263 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.882 -13.936 -5.722 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.275 -13.896 -7.430 1.00 0.00 H new ATOM 0 HG2 PRO A 102 10.704 -13.129 -6.059 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.548 -12.305 -7.355 1.00 0.00 H new ATOM 0 HD2 PRO A 102 9.387 -13.890 -7.841 1.00 0.00 H new ATOM 0 HD3 PRO A 102 10.687 -13.732 -9.006 1.00 0.00 H new ATOM 1617 N ASP A 103 12.498 -16.985 -4.962 1.00 0.00 N ATOM 1618 CA ASP A 103 12.263 -17.604 -3.663 1.00 0.00 C ATOM 1619 C ASP A 103 12.505 -16.607 -2.534 1.00 0.00 C ATOM 1620 O ASP A 103 13.478 -16.721 -1.789 1.00 0.00 O ATOM 1621 CB ASP A 103 13.166 -18.825 -3.484 1.00 0.00 C ATOM 1622 CG ASP A 103 12.619 -20.057 -4.178 1.00 0.00 C ATOM 1623 OD1 ASP A 103 11.473 -20.000 -4.672 1.00 0.00 O ATOM 1624 OD2 ASP A 103 13.337 -21.077 -4.229 1.00 0.00 O ATOM 0 H ASP A 103 13.376 -17.255 -5.405 1.00 0.00 H new ATOM 0 HA ASP A 103 11.222 -17.924 -3.624 1.00 0.00 H new ATOM 0 HB2 ASP A 103 14.158 -18.601 -3.877 1.00 0.00 H new ATOM 0 HB3 ASP A 103 13.284 -19.033 -2.421 1.00 0.00 H new ATOM 1629 N VAL A 104 11.614 -15.628 -2.415 1.00 0.00 N ATOM 1630 CA VAL A 104 11.731 -14.610 -1.377 1.00 0.00 C ATOM 1631 C VAL A 104 10.893 -14.971 -0.156 1.00 0.00 C ATOM 1632 O VAL A 104 10.476 -14.098 0.604 1.00 0.00 O ATOM 1633 CB VAL A 104 11.293 -13.227 -1.896 1.00 0.00 C ATOM 1634 CG1 VAL A 104 12.065 -12.859 -3.153 1.00 0.00 C ATOM 1635 CG2 VAL A 104 9.794 -13.207 -2.156 1.00 0.00 C ATOM 0 H VAL A 104 10.803 -15.518 -3.024 1.00 0.00 H new ATOM 0 HA VAL A 104 12.782 -14.567 -1.092 1.00 0.00 H new ATOM 0 HB VAL A 104 11.517 -12.483 -1.131 1.00 0.00 H new ATOM 0 HG11 VAL A 104 11.742 -11.879 -3.505 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.132 -12.831 -2.930 1.00 0.00 H new ATOM 0 HG13 VAL A 104 11.876 -13.603 -3.927 1.00 0.00 H new ATOM 0 HG21 VAL A 104 9.501 -12.223 -2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 104 9.544 -13.961 -2.902 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.261 -13.423 -1.230 1.00 0.00 H new ATOM 1645 N TYR A 105 10.652 -16.265 0.027 1.00 0.00 N ATOM 1646 CA TYR A 105 9.862 -16.743 1.155 1.00 0.00 C ATOM 1647 C TYR A 105 10.612 -16.543 2.469 1.00 0.00 C ATOM 1648 O TYR A 105 10.089 -15.950 3.411 1.00 0.00 O ATOM 1649 CB TYR A 105 9.516 -18.221 0.973 1.00 0.00 C ATOM 1650 CG TYR A 105 8.708 -18.799 2.113 1.00 0.00 C ATOM 1651 CD1 TYR A 105 9.308 -19.593 3.083 1.00 0.00 C ATOM 1652 CD2 TYR A 105 7.344 -18.553 2.219 1.00 0.00 C ATOM 1653 CE1 TYR A 105 8.573 -20.124 4.126 1.00 0.00 C ATOM 1654 CE2 TYR A 105 6.603 -19.078 3.259 1.00 0.00 C ATOM 1655 CZ TYR A 105 7.221 -19.863 4.210 1.00 0.00 C ATOM 1656 OH TYR A 105 6.486 -20.390 5.247 1.00 0.00 O ATOM 0 H TYR A 105 10.993 -17.001 -0.591 1.00 0.00 H new ATOM 0 HA TYR A 105 8.940 -16.163 1.191 1.00 0.00 H new ATOM 0 HB2 TYR A 105 8.958 -18.343 0.045 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.439 -18.791 0.867 1.00 0.00 H new ATOM 0 HD1 TYR A 105 10.366 -19.799 3.021 1.00 0.00 H new ATOM 0 HD2 TYR A 105 6.856 -17.941 1.475 1.00 0.00 H new ATOM 0 HE1 TYR A 105 9.054 -20.740 4.871 1.00 0.00 H new ATOM 0 HE2 TYR A 105 5.544 -18.875 3.328 1.00 0.00 H new ATOM 0 HH TYR A 105 5.551 -20.110 5.160 1.00 0.00 H new ATOM 1666 N ALA A 106 11.842 -17.043 2.522 1.00 0.00 N ATOM 1667 CA ALA A 106 12.667 -16.918 3.717 1.00 0.00 C ATOM 1668 C ALA A 106 12.992 -15.457 4.010 1.00 0.00 C ATOM 1669 O ALA A 106 13.263 -15.088 5.153 1.00 0.00 O ATOM 1670 CB ALA A 106 13.948 -17.725 3.562 1.00 0.00 C ATOM 0 H ALA A 106 12.289 -17.539 1.751 1.00 0.00 H new ATOM 0 HA ALA A 106 12.102 -17.313 4.561 1.00 0.00 H new ATOM 0 HB1 ALA A 106 14.554 -17.622 4.462 1.00 0.00 H new ATOM 0 HB2 ALA A 106 13.700 -18.775 3.410 1.00 0.00 H new ATOM 0 HB3 ALA A 106 14.509 -17.356 2.703 1.00 0.00 H new ATOM 1676 N LEU A 107 12.963 -14.630 2.971 1.00 0.00 N ATOM 1677 CA LEU A 107 13.256 -13.208 3.116 1.00 0.00 C ATOM 1678 C LEU A 107 12.179 -12.513 3.943 1.00 0.00 C ATOM 1679 O LEU A 107 12.483 -11.738 4.851 1.00 0.00 O ATOM 1680 CB LEU A 107 13.366 -12.547 1.741 1.00 0.00 C ATOM 1681 CG LEU A 107 14.624 -12.876 0.937 1.00 0.00 C ATOM 1682 CD1 LEU A 107 14.615 -12.139 -0.393 1.00 0.00 C ATOM 1683 CD2 LEU A 107 15.873 -12.528 1.733 1.00 0.00 C ATOM 0 H LEU A 107 12.740 -14.919 2.019 1.00 0.00 H new ATOM 0 HA LEU A 107 14.209 -13.109 3.636 1.00 0.00 H new ATOM 0 HB2 LEU A 107 12.496 -12.835 1.151 1.00 0.00 H new ATOM 0 HB3 LEU A 107 13.317 -11.466 1.875 1.00 0.00 H new ATOM 0 HG LEU A 107 14.633 -13.947 0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 107 15.518 -12.385 -0.952 1.00 0.00 H new ATOM 0 HD12 LEU A 107 13.739 -12.438 -0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 107 14.581 -11.064 -0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 107 16.758 -12.769 1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 107 15.871 -11.463 1.966 1.00 0.00 H new ATOM 0 HD23 LEU A 107 15.886 -13.102 2.659 1.00 0.00 H new ATOM 1695 N ILE A 108 10.920 -12.796 3.624 1.00 0.00 N ATOM 1696 CA ILE A 108 9.799 -12.201 4.340 1.00 0.00 C ATOM 1697 C ILE A 108 9.553 -12.912 5.666 1.00 0.00 C ATOM 1698 O ILE A 108 8.811 -12.423 6.518 1.00 0.00 O ATOM 1699 CB ILE A 108 8.509 -12.243 3.501 1.00 0.00 C ATOM 1700 CG1 ILE A 108 8.218 -13.675 3.045 1.00 0.00 C ATOM 1701 CG2 ILE A 108 8.625 -11.313 2.302 1.00 0.00 C ATOM 1702 CD1 ILE A 108 6.860 -13.840 2.400 1.00 0.00 C ATOM 0 H ILE A 108 10.651 -13.434 2.874 1.00 0.00 H new ATOM 0 HA ILE A 108 10.064 -11.161 4.532 1.00 0.00 H new ATOM 0 HB ILE A 108 7.679 -11.903 4.121 1.00 0.00 H new ATOM 0 HG12 ILE A 108 8.987 -13.986 2.338 1.00 0.00 H new ATOM 0 HG13 ILE A 108 8.287 -14.342 3.904 1.00 0.00 H new ATOM 0 HG21 ILE A 108 7.705 -11.354 1.719 1.00 0.00 H new ATOM 0 HG22 ILE A 108 8.790 -10.293 2.648 1.00 0.00 H new ATOM 0 HG23 ILE A 108 9.463 -11.625 1.679 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.723 -14.879 2.102 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.083 -13.561 3.112 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.794 -13.199 1.521 1.00 0.00 H new ATOM 1714 N LYS A 109 10.183 -14.069 5.836 1.00 0.00 N ATOM 1715 CA LYS A 109 10.037 -14.848 7.060 1.00 0.00 C ATOM 1716 C LYS A 109 10.379 -14.007 8.285 1.00 0.00 C ATOM 1717 O LYS A 109 9.947 -14.308 9.398 1.00 0.00 O ATOM 1718 CB LYS A 109 10.935 -16.086 7.012 1.00 0.00 C ATOM 1719 CG LYS A 109 10.512 -17.183 7.974 1.00 0.00 C ATOM 1720 CD LYS A 109 9.291 -17.930 7.466 1.00 0.00 C ATOM 1721 CE LYS A 109 8.568 -18.649 8.595 1.00 0.00 C ATOM 1722 NZ LYS A 109 9.191 -19.966 8.902 1.00 0.00 N ATOM 0 H LYS A 109 10.800 -14.489 5.141 1.00 0.00 H new ATOM 0 HA LYS A 109 8.997 -15.164 7.137 1.00 0.00 H new ATOM 0 HB2 LYS A 109 10.936 -16.485 5.998 1.00 0.00 H new ATOM 0 HB3 LYS A 109 11.959 -15.790 7.239 1.00 0.00 H new ATOM 0 HG2 LYS A 109 11.336 -17.883 8.114 1.00 0.00 H new ATOM 0 HG3 LYS A 109 10.294 -16.748 8.950 1.00 0.00 H new ATOM 0 HD2 LYS A 109 8.609 -17.230 6.984 1.00 0.00 H new ATOM 0 HD3 LYS A 109 9.594 -18.653 6.708 1.00 0.00 H new ATOM 0 HE2 LYS A 109 8.579 -18.025 9.489 1.00 0.00 H new ATOM 0 HE3 LYS A 109 7.523 -18.796 8.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 8.670 -20.425 9.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 9.158 -20.571 8.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 10.181 -19.824 9.188 1.00 0.00 H new ATOM 1736 N ASP A 110 11.156 -12.950 8.073 1.00 0.00 N ATOM 1737 CA ASP A 110 11.554 -12.063 9.160 1.00 0.00 C ATOM 1738 C ASP A 110 10.341 -11.349 9.750 1.00 0.00 C ATOM 1739 O ASP A 110 10.381 -10.871 10.884 1.00 0.00 O ATOM 1740 CB ASP A 110 12.573 -11.037 8.662 1.00 0.00 C ATOM 1741 CG ASP A 110 13.995 -11.557 8.722 1.00 0.00 C ATOM 1742 OD1 ASP A 110 14.295 -12.546 8.019 1.00 0.00 O ATOM 1743 OD2 ASP A 110 14.808 -10.976 9.470 1.00 0.00 O ATOM 0 H ASP A 110 11.523 -12.687 7.158 1.00 0.00 H new ATOM 0 HA ASP A 110 12.012 -12.669 9.942 1.00 0.00 H new ATOM 0 HB2 ASP A 110 12.334 -10.760 7.635 1.00 0.00 H new ATOM 0 HB3 ASP A 110 12.495 -10.131 9.263 1.00 0.00 H new ATOM 1748 N TYR A 111 9.265 -11.281 8.974 1.00 0.00 N ATOM 1749 CA TYR A 111 8.043 -10.623 9.419 1.00 0.00 C ATOM 1750 C TYR A 111 6.811 -11.324 8.855 1.00 0.00 C ATOM 1751 O TYR A 111 5.792 -10.690 8.581 1.00 0.00 O ATOM 1752 CB TYR A 111 8.046 -9.154 8.994 1.00 0.00 C ATOM 1753 CG TYR A 111 8.022 -8.957 7.495 1.00 0.00 C ATOM 1754 CD1 TYR A 111 9.185 -9.064 6.742 1.00 0.00 C ATOM 1755 CD2 TYR A 111 6.838 -8.662 6.832 1.00 0.00 C ATOM 1756 CE1 TYR A 111 9.169 -8.884 5.373 1.00 0.00 C ATOM 1757 CE2 TYR A 111 6.811 -8.482 5.463 1.00 0.00 C ATOM 1758 CZ TYR A 111 7.979 -8.594 4.737 1.00 0.00 C ATOM 1759 OH TYR A 111 7.957 -8.414 3.373 1.00 0.00 O ATOM 0 H TYR A 111 9.215 -11.674 8.034 1.00 0.00 H new ATOM 0 HA TYR A 111 8.006 -10.680 10.507 1.00 0.00 H new ATOM 0 HB2 TYR A 111 7.180 -8.656 9.431 1.00 0.00 H new ATOM 0 HB3 TYR A 111 8.933 -8.668 9.402 1.00 0.00 H new ATOM 0 HD1 TYR A 111 10.118 -9.292 7.236 1.00 0.00 H new ATOM 0 HD2 TYR A 111 5.922 -8.572 7.397 1.00 0.00 H new ATOM 0 HE1 TYR A 111 10.082 -8.970 4.803 1.00 0.00 H new ATOM 0 HE2 TYR A 111 5.881 -8.255 4.963 1.00 0.00 H new ATOM 0 HH TYR A 111 7.236 -8.952 2.984 1.00 0.00 H new ATOM 1769 N VAL A 112 6.912 -12.639 8.684 1.00 0.00 N ATOM 1770 CA VAL A 112 5.806 -13.428 8.155 1.00 0.00 C ATOM 1771 C VAL A 112 4.860 -13.864 9.268 1.00 0.00 C ATOM 1772 O VAL A 112 5.176 -14.759 10.052 1.00 0.00 O ATOM 1773 CB VAL A 112 6.315 -14.677 7.410 1.00 0.00 C ATOM 1774 CG1 VAL A 112 5.262 -15.774 7.426 1.00 0.00 C ATOM 1775 CG2 VAL A 112 6.706 -14.323 5.983 1.00 0.00 C ATOM 0 H VAL A 112 7.748 -13.180 8.904 1.00 0.00 H new ATOM 0 HA VAL A 112 5.268 -12.790 7.455 1.00 0.00 H new ATOM 0 HB VAL A 112 7.201 -15.050 7.924 1.00 0.00 H new ATOM 0 HG11 VAL A 112 5.639 -16.648 6.895 1.00 0.00 H new ATOM 0 HG12 VAL A 112 5.035 -16.045 8.457 1.00 0.00 H new ATOM 0 HG13 VAL A 112 4.356 -15.416 6.937 1.00 0.00 H new ATOM 0 HG21 VAL A 112 7.063 -15.217 5.471 1.00 0.00 H new ATOM 0 HG22 VAL A 112 5.839 -13.925 5.456 1.00 0.00 H new ATOM 0 HG23 VAL A 112 7.497 -13.573 5.998 1.00 0.00 H new ATOM 1910 N ILE A 122 -4.834 1.060 15.253 1.00 0.00 N ATOM 1911 CA ILE A 122 -6.240 0.802 15.538 1.00 0.00 C ATOM 1912 C ILE A 122 -7.107 1.996 15.151 1.00 0.00 C ATOM 1913 O ILE A 122 -6.701 3.147 15.309 1.00 0.00 O ATOM 1914 CB ILE A 122 -6.463 0.482 17.027 1.00 0.00 C ATOM 1915 CG1 ILE A 122 -5.679 -0.771 17.425 1.00 0.00 C ATOM 1916 CG2 ILE A 122 -7.946 0.298 17.314 1.00 0.00 C ATOM 1917 CD1 ILE A 122 -4.749 -0.555 18.598 1.00 0.00 C ATOM 0 HA ILE A 122 -6.529 -0.063 14.942 1.00 0.00 H new ATOM 0 HB ILE A 122 -6.099 1.320 17.621 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -6.382 -1.567 17.671 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -5.097 -1.113 16.569 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -8.087 0.072 18.371 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -8.481 1.214 17.064 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -8.334 -0.524 16.713 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -4.227 -1.485 18.824 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -4.022 0.218 18.349 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -5.327 -0.243 19.468 1.00 0.00 H new ATOM 1929 N GLU A 123 -8.303 1.713 14.645 1.00 0.00 N ATOM 1930 CA GLU A 123 -9.228 2.764 14.236 1.00 0.00 C ATOM 1931 C GLU A 123 -8.643 3.590 13.094 1.00 0.00 C ATOM 1932 O GLU A 123 -9.107 4.694 12.811 1.00 0.00 O ATOM 1933 CB GLU A 123 -9.556 3.674 15.422 1.00 0.00 C ATOM 1934 CG GLU A 123 -10.961 3.481 15.966 1.00 0.00 C ATOM 1935 CD GLU A 123 -11.806 4.735 15.857 1.00 0.00 C ATOM 1936 OE1 GLU A 123 -11.450 5.747 16.496 1.00 0.00 O ATOM 1937 OE2 GLU A 123 -12.824 4.705 15.134 1.00 0.00 O ATOM 0 H GLU A 123 -8.654 0.765 14.508 1.00 0.00 H new ATOM 0 HA GLU A 123 -10.145 2.290 13.886 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -8.838 3.489 16.221 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -9.433 4.713 15.117 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -11.448 2.671 15.424 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -10.903 3.176 17.011 1.00 0.00 H new ATOM 1944 N ALA A 124 -7.620 3.046 12.442 1.00 0.00 N ATOM 1945 CA ALA A 124 -6.972 3.731 11.330 1.00 0.00 C ATOM 1946 C ALA A 124 -7.516 3.241 9.992 1.00 0.00 C ATOM 1947 O ALA A 124 -7.835 4.038 9.110 1.00 0.00 O ATOM 1948 CB ALA A 124 -5.465 3.532 11.395 1.00 0.00 C ATOM 0 H ALA A 124 -7.223 2.133 12.665 1.00 0.00 H new ATOM 0 HA ALA A 124 -7.191 4.796 11.413 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -4.993 4.049 10.559 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.085 3.937 12.333 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.236 2.468 11.340 1.00 0.00 H new ATOM 1954 N LYS A 125 -7.618 1.924 9.847 1.00 0.00 N ATOM 1955 CA LYS A 125 -8.123 1.327 8.617 1.00 0.00 C ATOM 1956 C LYS A 125 -9.640 1.466 8.527 1.00 0.00 C ATOM 1957 O LYS A 125 -10.198 1.598 7.438 1.00 0.00 O ATOM 1958 CB LYS A 125 -7.731 -0.151 8.544 1.00 0.00 C ATOM 1959 CG LYS A 125 -7.783 -0.725 7.139 1.00 0.00 C ATOM 1960 CD LYS A 125 -7.223 -2.137 7.093 1.00 0.00 C ATOM 1961 CE LYS A 125 -8.327 -3.170 6.926 1.00 0.00 C ATOM 1962 NZ LYS A 125 -8.367 -3.722 5.544 1.00 0.00 N ATOM 0 H LYS A 125 -7.357 1.250 10.567 1.00 0.00 H new ATOM 0 HA LYS A 125 -7.676 1.857 7.776 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -6.722 -0.271 8.939 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -8.396 -0.727 9.188 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -8.814 -0.730 6.785 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -7.216 -0.085 6.462 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -6.516 -2.222 6.268 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -6.669 -2.340 8.010 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -8.175 -3.982 7.637 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -9.289 -2.715 7.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -9.133 -4.422 5.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -8.538 -2.951 4.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -7.458 -4.179 5.326 1.00 0.00 H new ATOM 1976 N VAL A 126 -10.301 1.435 9.680 1.00 0.00 N ATOM 1977 CA VAL A 126 -11.753 1.560 9.732 1.00 0.00 C ATOM 1978 C VAL A 126 -12.208 2.910 9.188 1.00 0.00 C ATOM 1979 O VAL A 126 -13.287 3.024 8.606 1.00 0.00 O ATOM 1980 CB VAL A 126 -12.280 1.394 11.170 1.00 0.00 C ATOM 1981 CG1 VAL A 126 -13.797 1.490 11.197 1.00 0.00 C ATOM 1982 CG2 VAL A 126 -11.810 0.072 11.759 1.00 0.00 C ATOM 0 H VAL A 126 -9.854 1.324 10.590 1.00 0.00 H new ATOM 0 HA VAL A 126 -12.162 0.764 9.109 1.00 0.00 H new ATOM 0 HB VAL A 126 -11.878 2.202 11.782 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -14.151 1.370 12.221 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -14.107 2.464 10.817 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -14.222 0.705 10.572 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -12.191 -0.030 12.775 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -12.181 -0.751 11.148 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -10.720 0.048 11.776 1.00 0.00 H new ATOM 1992 N ARG A 127 -11.379 3.930 9.383 1.00 0.00 N ATOM 1993 CA ARG A 127 -11.697 5.273 8.913 1.00 0.00 C ATOM 1994 C ARG A 127 -11.511 5.379 7.402 1.00 0.00 C ATOM 1995 O ARG A 127 -12.139 6.209 6.746 1.00 0.00 O ATOM 1996 CB ARG A 127 -10.815 6.305 9.620 1.00 0.00 C ATOM 1997 CG ARG A 127 -11.216 6.562 11.063 1.00 0.00 C ATOM 1998 CD ARG A 127 -11.548 8.027 11.297 1.00 0.00 C ATOM 1999 NE ARG A 127 -12.464 8.208 12.420 1.00 0.00 N ATOM 2000 CZ ARG A 127 -12.126 7.992 13.686 1.00 0.00 C ATOM 2001 NH1 ARG A 127 -10.899 7.590 13.989 1.00 0.00 N ATOM 2002 NH2 ARG A 127 -13.016 8.179 14.653 1.00 0.00 N ATOM 0 H ARG A 127 -10.482 3.852 9.863 1.00 0.00 H new ATOM 0 HA ARG A 127 -12.742 5.475 9.148 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -9.780 5.964 9.595 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -10.855 7.244 9.068 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -12.080 5.947 11.317 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -10.405 6.261 11.726 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -10.629 8.581 11.486 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -11.993 8.446 10.395 1.00 0.00 H new ATOM 0 HE ARG A 127 -13.415 8.517 12.221 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -10.212 7.446 13.249 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -10.642 7.425 14.962 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -13.960 8.489 14.424 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -12.755 8.013 15.625 1.00 0.00 H new ATOM 2016 N MET A 128 -10.643 4.532 6.858 1.00 0.00 N ATOM 2017 CA MET A 128 -10.375 4.530 5.424 1.00 0.00 C ATOM 2018 C MET A 128 -11.335 3.597 4.693 1.00 0.00 C ATOM 2019 O MET A 128 -11.689 3.837 3.538 1.00 0.00 O ATOM 2020 CB MET A 128 -8.930 4.107 5.154 1.00 0.00 C ATOM 2021 CG MET A 128 -7.903 4.935 5.910 1.00 0.00 C ATOM 2022 SD MET A 128 -7.956 6.682 5.464 1.00 0.00 S ATOM 2023 CE MET A 128 -7.114 7.414 6.866 1.00 0.00 C ATOM 0 H MET A 128 -10.114 3.839 7.387 1.00 0.00 H new ATOM 0 HA MET A 128 -10.525 5.543 5.050 1.00 0.00 H new ATOM 0 HB2 MET A 128 -8.810 3.058 5.426 1.00 0.00 H new ATOM 0 HB3 MET A 128 -8.731 4.184 4.085 1.00 0.00 H new ATOM 0 HG2 MET A 128 -8.076 4.832 6.981 1.00 0.00 H new ATOM 0 HG3 MET A 128 -6.906 4.543 5.709 1.00 0.00 H new ATOM 0 HE1 MET A 128 -7.066 8.495 6.738 1.00 0.00 H new ATOM 0 HE2 MET A 128 -7.659 7.181 7.780 1.00 0.00 H new ATOM 0 HE3 MET A 128 -6.103 7.012 6.934 1.00 0.00 H new ATOM 2033 N ARG A 129 -11.753 2.534 5.372 1.00 0.00 N ATOM 2034 CA ARG A 129 -12.671 1.565 4.786 1.00 0.00 C ATOM 2035 C ARG A 129 -14.117 2.025 4.938 1.00 0.00 C ATOM 2036 O ARG A 129 -14.984 1.652 4.148 1.00 0.00 O ATOM 2037 CB ARG A 129 -12.488 0.196 5.443 1.00 0.00 C ATOM 2038 CG ARG A 129 -12.552 -0.964 4.463 1.00 0.00 C ATOM 2039 CD ARG A 129 -13.676 -1.927 4.811 1.00 0.00 C ATOM 2040 NE ARG A 129 -13.779 -3.020 3.847 1.00 0.00 N ATOM 2041 CZ ARG A 129 -14.697 -3.977 3.917 1.00 0.00 C ATOM 2042 NH1 ARG A 129 -15.588 -3.975 4.899 1.00 0.00 N ATOM 2043 NH2 ARG A 129 -14.727 -4.937 3.002 1.00 0.00 N ATOM 0 H ARG A 129 -11.470 2.322 6.329 1.00 0.00 H new ATOM 0 HA ARG A 129 -12.444 1.484 3.723 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -11.527 0.174 5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -13.258 0.061 6.203 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -12.700 -0.581 3.453 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -11.601 -1.497 4.466 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -13.507 -2.337 5.807 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -14.621 -1.384 4.846 1.00 0.00 H new ATOM 0 HE ARG A 129 -13.109 -3.050 3.078 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -15.569 -3.237 5.603 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -16.292 -4.711 4.950 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -14.045 -4.940 2.244 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -15.432 -5.672 3.057 1.00 0.00 H new ATOM 2057 N SER A 130 -14.370 2.838 5.959 1.00 0.00 N ATOM 2058 CA SER A 130 -15.713 3.346 6.217 1.00 0.00 C ATOM 2059 C SER A 130 -15.847 4.790 5.745 1.00 0.00 C ATOM 2060 O SER A 130 -16.444 5.624 6.427 1.00 0.00 O ATOM 2061 CB SER A 130 -16.038 3.253 7.709 1.00 0.00 C ATOM 2062 OG SER A 130 -17.425 3.051 7.918 1.00 0.00 O ATOM 0 H SER A 130 -13.663 3.159 6.621 1.00 0.00 H new ATOM 0 HA SER A 130 -16.421 2.732 5.659 1.00 0.00 H new ATOM 0 HB2 SER A 130 -15.477 2.433 8.156 1.00 0.00 H new ATOM 0 HB3 SER A 130 -15.721 4.167 8.211 1.00 0.00 H new ATOM 0 HG SER A 130 -17.606 2.994 8.879 1.00 0.00 H new