USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1000 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 116 SER OG : rot -68:sc= 0.371 USER MOD Set 1.2: A 117 HIS : no HD1:sc= 0.16 K(o=0.53,f=-0.28) USER MOD Set 2.1: A 79 LYS NZ :NH3+ 130:sc= -0.234 (180deg=-0.0911) USER MOD Set 2.2: A 87 GLN : amide:sc= -5.71! K(o=-5.9!,f=-2.5) USER MOD Set 3.1: A 28 THR OG1 : rot -14:sc= 0.725 USER MOD Set 3.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 0 MET CE :methyl 154:sc= -0.294 (180deg=-1.13) USER MOD Single : A 0 MET N :NH3+ 159:sc= -0.164 (180deg=-0.696) USER MOD Single : A 1 ASN : amide:sc= -13.1! C(o=-13!,f=-7.6!) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 168:sc= -2.03 (180deg=-2.44!) USER MOD Single : A 17 THR OG1 : rot -33:sc= 0.48 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.00887 USER MOD Single : A 24 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00774) USER MOD Single : A 25 THR OG1 : rot 160:sc= 0.0762 USER MOD Single : A 27 THR OG1 : rot 120:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -166:sc= -0.0128 (180deg=-0.204) USER MOD Single : A 31 TYR OH : rot 180:sc= -0.173 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.549 USER MOD Single : A 37 TYR OH : rot 30:sc= -3.31! USER MOD Single : A 40 SER OG : rot -131:sc= -1.5 USER MOD Single : A 41 HIS : no HD1:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 42 SER OG : rot -30:sc= 0.382 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -4.86! C(o=-4.9!,f=-1.8!) USER MOD Single : A 45 THR OG1 : rot 32:sc= 0.223 USER MOD Single : A 49 ASN : amide:sc= -14.7! C(o=-15!,f=-14!) USER MOD Single : A 50 SER OG : rot -52:sc= 0.492 USER MOD Single : A 56 TYR OH : rot -163:sc= 0.322! USER MOD Single : A 57 ASN : amide:sc= -2.67! K(o=-2.7!,f=-0.16) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 112:sc= 1.06 USER MOD Single : A 63 LYS NZ :NH3+ 158:sc= 0.697 (180deg=0.445) USER MOD Single : A 67 HIS : no HD1:sc= -2.36! K(o=-2.4!,f=-0.47) USER MOD Single : A 73 ASN : amide:sc=-0.000214 K(o=-0.00021,f=-0.87) USER MOD Single : A 75 GLN : amide:sc= -1.28! K(o=-1.3!,f=-0.036) USER MOD Single : A 80 THR OG1 : rot -140:sc= 0.166 USER MOD Single : A 83 SER OG : rot 77:sc= 0.67 USER MOD Single : A 86 SER OG : rot 93:sc= 1.05 USER MOD Single : A 91 SER OG : rot -22:sc= 0.556 USER MOD Single : A 93 SER OG : rot 180:sc= -0.0113 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 141:sc= 0.17! USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 128 HIS : no HD1:sc=-0.00664 X(o=-0.0066,f=-0.32) USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 130 HIS : no HD1:sc= -0.0106 X(o=-0.011,f=0) USER MOD Single : A 131 HIS : no HD1:sc= -0.124 X(o=-0.12,f=-0.13) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 35.616 -3.499 0.059 1.00 0.00 N ATOM 2 CA MET A 0 34.203 -3.944 -0.060 1.00 0.00 C ATOM 3 C MET A 0 33.252 -2.752 -0.035 1.00 0.00 C ATOM 4 O MET A 0 33.166 -2.029 0.959 1.00 0.00 O ATOM 5 CB MET A 0 33.860 -4.918 1.071 1.00 0.00 C ATOM 6 CG MET A 0 34.181 -4.383 2.457 1.00 0.00 C ATOM 7 SD MET A 0 34.103 -5.660 3.728 1.00 0.00 S ATOM 8 CE MET A 0 35.415 -6.752 3.187 1.00 0.00 C ATOM 0 H1 MET A 0 36.202 -4.291 0.392 1.00 0.00 H new ATOM 0 H2 MET A 0 35.959 -3.181 -0.870 1.00 0.00 H new ATOM 0 H3 MET A 0 35.677 -2.713 0.738 1.00 0.00 H new ATOM 0 HA MET A 0 34.085 -4.454 -1.016 1.00 0.00 H new ATOM 0 HB2 MET A 0 32.798 -5.159 1.021 1.00 0.00 H new ATOM 0 HB3 MET A 0 34.406 -5.849 0.915 1.00 0.00 H new ATOM 0 HG2 MET A 0 35.178 -3.942 2.450 1.00 0.00 H new ATOM 0 HG3 MET A 0 33.481 -3.585 2.705 1.00 0.00 H new ATOM 0 HE1 MET A 0 35.807 -7.301 4.043 1.00 0.00 H new ATOM 0 HE2 MET A 0 35.023 -7.456 2.453 1.00 0.00 H new ATOM 0 HE3 MET A 0 36.215 -6.164 2.736 1.00 0.00 H new ATOM 20 N ASN A 1 32.543 -2.549 -1.140 1.00 0.00 N ATOM 21 CA ASN A 1 31.597 -1.444 -1.257 1.00 0.00 C ATOM 22 C ASN A 1 30.583 -1.722 -2.359 1.00 0.00 C ATOM 23 O ASN A 1 30.757 -2.640 -3.161 1.00 0.00 O ATOM 24 CB ASN A 1 32.342 -0.142 -1.558 1.00 0.00 C ATOM 25 CG ASN A 1 31.440 1.074 -1.512 1.00 0.00 C ATOM 26 OD1 ASN A 1 31.644 2.038 -2.249 1.00 0.00 O ATOM 27 ND2 ASN A 1 30.438 1.040 -0.643 1.00 0.00 N ATOM 0 H ASN A 1 32.606 -3.137 -1.971 1.00 0.00 H new ATOM 0 HA ASN A 1 31.068 -1.344 -0.310 1.00 0.00 H new ATOM 0 HB2 ASN A 1 33.151 -0.016 -0.838 1.00 0.00 H new ATOM 0 HB3 ASN A 1 32.801 -0.211 -2.544 1.00 0.00 H new ATOM 0 HD21 ASN A 1 29.801 1.833 -0.568 1.00 0.00 H new ATOM 0 HD22 ASN A 1 30.304 0.221 -0.050 1.00 0.00 H new ATOM 34 N CYS A 2 29.524 -0.922 -2.395 1.00 0.00 N ATOM 35 CA CYS A 2 28.485 -1.080 -3.402 1.00 0.00 C ATOM 36 C CYS A 2 28.421 0.138 -4.316 1.00 0.00 C ATOM 37 O CYS A 2 29.055 1.158 -4.047 1.00 0.00 O ATOM 38 CB CYS A 2 27.127 -1.308 -2.739 1.00 0.00 C ATOM 39 SG CYS A 2 26.877 -3.005 -2.127 1.00 0.00 S ATOM 0 H CYS A 2 29.363 -0.158 -1.738 1.00 0.00 H new ATOM 0 HA CYS A 2 28.734 -1.952 -4.007 1.00 0.00 H new ATOM 0 HB2 CYS A 2 27.019 -0.613 -1.906 1.00 0.00 H new ATOM 0 HB3 CYS A 2 26.340 -1.071 -3.455 1.00 0.00 H new ATOM 44 N GLY A 3 27.656 0.031 -5.395 1.00 0.00 N ATOM 45 CA GLY A 3 27.496 1.159 -6.293 1.00 0.00 C ATOM 46 C GLY A 3 26.398 2.091 -5.817 1.00 0.00 C ATOM 47 O GLY A 3 25.680 1.756 -4.876 1.00 0.00 O ATOM 0 H GLY A 3 27.146 -0.811 -5.664 1.00 0.00 H new ATOM 0 HA2 GLY A 3 28.436 1.707 -6.363 1.00 0.00 H new ATOM 0 HA3 GLY A 3 27.261 0.799 -7.295 1.00 0.00 H new ATOM 51 N PRO A 4 26.241 3.277 -6.433 1.00 0.00 N ATOM 52 CA PRO A 4 25.199 4.231 -6.039 1.00 0.00 C ATOM 53 C PRO A 4 23.830 3.562 -5.922 1.00 0.00 C ATOM 54 O PRO A 4 23.425 2.809 -6.809 1.00 0.00 O ATOM 55 CB PRO A 4 25.219 5.256 -7.172 1.00 0.00 C ATOM 56 CG PRO A 4 26.625 5.223 -7.664 1.00 0.00 C ATOM 57 CD PRO A 4 27.062 3.787 -7.549 1.00 0.00 C ATOM 0 HA PRO A 4 25.380 4.670 -5.058 1.00 0.00 H new ATOM 0 HB2 PRO A 4 24.514 4.993 -7.961 1.00 0.00 H new ATOM 0 HB3 PRO A 4 24.944 6.249 -6.817 1.00 0.00 H new ATOM 0 HG2 PRO A 4 26.687 5.570 -8.695 1.00 0.00 H new ATOM 0 HG3 PRO A 4 27.264 5.876 -7.069 1.00 0.00 H new ATOM 0 HD2 PRO A 4 26.878 3.234 -8.470 1.00 0.00 H new ATOM 0 HD3 PRO A 4 28.128 3.706 -7.336 1.00 0.00 H new ATOM 65 N PRO A 5 23.102 3.828 -4.821 1.00 0.00 N ATOM 66 CA PRO A 5 21.784 3.231 -4.579 1.00 0.00 C ATOM 67 C PRO A 5 20.832 3.381 -5.762 1.00 0.00 C ATOM 68 O PRO A 5 20.484 4.496 -6.151 1.00 0.00 O ATOM 69 CB PRO A 5 21.261 4.007 -3.370 1.00 0.00 C ATOM 70 CG PRO A 5 22.487 4.457 -2.656 1.00 0.00 C ATOM 71 CD PRO A 5 23.502 4.739 -3.729 1.00 0.00 C ATOM 0 HA PRO A 5 21.856 2.155 -4.420 1.00 0.00 H new ATOM 0 HB2 PRO A 5 20.647 4.854 -3.677 1.00 0.00 H new ATOM 0 HB3 PRO A 5 20.639 3.378 -2.733 1.00 0.00 H new ATOM 0 HG2 PRO A 5 22.289 5.348 -2.061 1.00 0.00 H new ATOM 0 HG3 PRO A 5 22.845 3.689 -1.970 1.00 0.00 H new ATOM 0 HD2 PRO A 5 23.475 5.782 -4.045 1.00 0.00 H new ATOM 0 HD3 PRO A 5 24.517 4.536 -3.387 1.00 0.00 H new ATOM 79 N PRO A 6 20.402 2.248 -6.352 1.00 0.00 N ATOM 80 CA PRO A 6 19.470 2.245 -7.485 1.00 0.00 C ATOM 81 C PRO A 6 18.181 2.982 -7.152 1.00 0.00 C ATOM 82 O PRO A 6 18.040 3.608 -6.101 1.00 0.00 O ATOM 83 CB PRO A 6 19.174 0.755 -7.718 1.00 0.00 C ATOM 84 CG PRO A 6 19.678 0.046 -6.505 1.00 0.00 C ATOM 85 CD PRO A 6 20.796 0.886 -5.965 1.00 0.00 C ATOM 0 HA PRO A 6 19.890 2.747 -8.357 1.00 0.00 H new ATOM 0 HB2 PRO A 6 18.106 0.585 -7.855 1.00 0.00 H new ATOM 0 HB3 PRO A 6 19.672 0.393 -8.618 1.00 0.00 H new ATOM 0 HG2 PRO A 6 18.886 -0.071 -5.765 1.00 0.00 H new ATOM 0 HG3 PRO A 6 20.029 -0.955 -6.757 1.00 0.00 H new ATOM 0 HD2 PRO A 6 20.891 0.785 -4.884 1.00 0.00 H new ATOM 0 HD3 PRO A 6 21.757 0.606 -6.397 1.00 0.00 H new ATOM 93 N THR A 7 17.241 2.877 -8.087 1.00 0.00 N ATOM 94 CA THR A 7 15.935 3.499 -7.950 1.00 0.00 C ATOM 95 C THR A 7 14.934 2.479 -7.424 1.00 0.00 C ATOM 96 O THR A 7 14.820 1.378 -7.964 1.00 0.00 O ATOM 97 CB THR A 7 15.432 4.070 -9.290 1.00 0.00 C ATOM 98 OG1 THR A 7 16.314 5.103 -9.744 1.00 0.00 O ATOM 99 CG2 THR A 7 14.022 4.624 -9.153 1.00 0.00 C ATOM 0 H THR A 7 17.366 2.359 -8.957 1.00 0.00 H new ATOM 0 HA THR A 7 16.032 4.326 -7.247 1.00 0.00 H new ATOM 0 HB THR A 7 15.415 3.259 -10.019 1.00 0.00 H new ATOM 0 HG1 THR A 7 15.989 5.460 -10.597 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.692 5.020 -10.113 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.347 3.828 -8.838 1.00 0.00 H new ATOM 0 HG23 THR A 7 14.015 5.421 -8.410 1.00 0.00 H new ATOM 107 N LEU A 8 14.211 2.842 -6.376 1.00 0.00 N ATOM 108 CA LEU A 8 13.216 1.957 -5.801 1.00 0.00 C ATOM 109 C LEU A 8 11.805 2.446 -6.090 1.00 0.00 C ATOM 110 O LEU A 8 11.365 3.458 -5.545 1.00 0.00 O ATOM 111 CB LEU A 8 13.430 1.840 -4.297 1.00 0.00 C ATOM 112 CG LEU A 8 14.749 1.186 -3.898 1.00 0.00 C ATOM 113 CD1 LEU A 8 15.886 2.196 -3.930 1.00 0.00 C ATOM 114 CD2 LEU A 8 14.629 0.554 -2.521 1.00 0.00 C ATOM 0 H LEU A 8 14.296 3.744 -5.908 1.00 0.00 H new ATOM 0 HA LEU A 8 13.332 0.976 -6.261 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.385 2.836 -3.857 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.609 1.265 -3.869 1.00 0.00 H new ATOM 0 HG LEU A 8 14.976 0.402 -4.620 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.816 1.706 -3.642 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.986 2.600 -4.938 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.672 3.007 -3.234 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.578 0.091 -2.249 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.377 1.321 -1.789 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.846 -0.204 -2.536 1.00 0.00 H new ATOM 126 N SER A 9 11.100 1.723 -6.952 1.00 0.00 N ATOM 127 CA SER A 9 9.732 2.076 -7.298 1.00 0.00 C ATOM 128 C SER A 9 8.801 1.714 -6.152 1.00 0.00 C ATOM 129 O SER A 9 7.730 2.299 -5.996 1.00 0.00 O ATOM 130 CB SER A 9 9.297 1.361 -8.579 1.00 0.00 C ATOM 131 OG SER A 9 9.441 -0.042 -8.453 1.00 0.00 O ATOM 0 H SER A 9 11.454 0.890 -7.423 1.00 0.00 H new ATOM 0 HA SER A 9 9.682 3.151 -7.473 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.258 1.605 -8.800 1.00 0.00 H new ATOM 0 HB3 SER A 9 9.894 1.717 -9.419 1.00 0.00 H new ATOM 0 HG SER A 9 9.155 -0.476 -9.284 1.00 0.00 H new ATOM 137 N PHE A 10 9.229 0.742 -5.350 1.00 0.00 N ATOM 138 CA PHE A 10 8.454 0.298 -4.201 1.00 0.00 C ATOM 139 C PHE A 10 8.926 1.011 -2.937 1.00 0.00 C ATOM 140 O PHE A 10 9.029 0.406 -1.870 1.00 0.00 O ATOM 141 CB PHE A 10 8.561 -1.220 -4.031 1.00 0.00 C ATOM 142 CG PHE A 10 9.944 -1.757 -4.253 1.00 0.00 C ATOM 143 CD1 PHE A 10 10.359 -2.130 -5.522 1.00 0.00 C ATOM 144 CD2 PHE A 10 10.828 -1.889 -3.197 1.00 0.00 C ATOM 145 CE1 PHE A 10 11.631 -2.623 -5.733 1.00 0.00 C ATOM 146 CE2 PHE A 10 12.103 -2.382 -3.401 1.00 0.00 C ATOM 147 CZ PHE A 10 12.504 -2.749 -4.672 1.00 0.00 C ATOM 0 H PHE A 10 10.112 0.247 -5.478 1.00 0.00 H new ATOM 0 HA PHE A 10 7.407 0.549 -4.373 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.234 -1.488 -3.026 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.877 -1.704 -4.728 1.00 0.00 H new ATOM 0 HD1 PHE A 10 9.679 -2.034 -6.356 1.00 0.00 H new ATOM 0 HD2 PHE A 10 10.518 -1.604 -2.202 1.00 0.00 H new ATOM 0 HE1 PHE A 10 11.942 -2.910 -6.727 1.00 0.00 H new ATOM 0 HE2 PHE A 10 12.785 -2.480 -2.569 1.00 0.00 H new ATOM 0 HZ PHE A 10 13.500 -3.134 -4.834 1.00 0.00 H new ATOM 157 N ALA A 11 9.181 2.315 -3.078 1.00 0.00 N ATOM 158 CA ALA A 11 9.640 3.163 -1.980 1.00 0.00 C ATOM 159 C ALA A 11 10.149 4.492 -2.531 1.00 0.00 C ATOM 160 O ALA A 11 9.974 4.817 -3.706 1.00 0.00 O ATOM 161 CB ALA A 11 10.714 2.480 -1.144 1.00 0.00 C ATOM 0 H ALA A 11 9.074 2.812 -3.962 1.00 0.00 H new ATOM 0 HA ALA A 11 8.792 3.348 -1.321 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.027 3.145 -0.339 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.314 1.560 -0.719 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.572 2.246 -1.775 1.00 0.00 H new ATOM 167 N ALA A 12 10.781 5.247 -1.635 1.00 0.00 N ATOM 168 CA ALA A 12 11.313 6.562 -1.971 1.00 0.00 C ATOM 169 C ALA A 12 12.185 7.089 -0.834 1.00 0.00 C ATOM 170 O ALA A 12 11.843 6.931 0.334 1.00 0.00 O ATOM 171 CB ALA A 12 10.183 7.536 -2.272 1.00 0.00 C ATOM 0 H ALA A 12 10.937 4.967 -0.667 1.00 0.00 H new ATOM 0 HA ALA A 12 11.930 6.466 -2.865 1.00 0.00 H new ATOM 0 HB1 ALA A 12 10.600 8.512 -2.521 1.00 0.00 H new ATOM 0 HB2 ALA A 12 9.598 7.166 -3.114 1.00 0.00 H new ATOM 0 HB3 ALA A 12 9.540 7.629 -1.397 1.00 0.00 H new ATOM 177 N PRO A 13 13.322 7.728 -1.157 1.00 0.00 N ATOM 178 CA PRO A 13 14.238 8.263 -0.142 1.00 0.00 C ATOM 179 C PRO A 13 13.503 9.064 0.927 1.00 0.00 C ATOM 180 O PRO A 13 12.417 9.592 0.686 1.00 0.00 O ATOM 181 CB PRO A 13 15.167 9.168 -0.951 1.00 0.00 C ATOM 182 CG PRO A 13 15.171 8.574 -2.319 1.00 0.00 C ATOM 183 CD PRO A 13 13.797 7.998 -2.529 1.00 0.00 C ATOM 0 HA PRO A 13 14.759 7.475 0.402 1.00 0.00 H new ATOM 0 HB2 PRO A 13 14.805 10.196 -0.966 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.170 9.189 -0.525 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.396 9.330 -3.071 1.00 0.00 H new ATOM 0 HG3 PRO A 13 15.935 7.801 -2.406 1.00 0.00 H new ATOM 0 HD2 PRO A 13 13.144 8.698 -3.049 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.831 7.088 -3.128 1.00 0.00 H new ATOM 191 N MET A 14 14.105 9.150 2.112 1.00 0.00 N ATOM 192 CA MET A 14 13.495 9.882 3.210 1.00 0.00 C ATOM 193 C MET A 14 14.520 10.733 3.938 1.00 0.00 C ATOM 194 O MET A 14 14.351 11.945 4.079 1.00 0.00 O ATOM 195 CB MET A 14 12.838 8.912 4.194 1.00 0.00 C ATOM 196 CG MET A 14 12.044 9.606 5.289 1.00 0.00 C ATOM 197 SD MET A 14 11.957 8.640 6.809 1.00 0.00 S ATOM 198 CE MET A 14 11.111 7.170 6.237 1.00 0.00 C ATOM 0 H MET A 14 15.006 8.725 2.331 1.00 0.00 H new ATOM 0 HA MET A 14 12.735 10.541 2.790 1.00 0.00 H new ATOM 0 HB2 MET A 14 12.176 8.242 3.645 1.00 0.00 H new ATOM 0 HB3 MET A 14 13.610 8.293 4.652 1.00 0.00 H new ATOM 0 HG2 MET A 14 12.499 10.573 5.504 1.00 0.00 H new ATOM 0 HG3 MET A 14 11.034 9.802 4.930 1.00 0.00 H new ATOM 0 HE1 MET A 14 11.171 6.395 7.001 1.00 0.00 H new ATOM 0 HE2 MET A 14 10.065 7.405 6.041 1.00 0.00 H new ATOM 0 HE3 MET A 14 11.581 6.813 5.320 1.00 0.00 H new ATOM 208 N ASP A 15 15.583 10.088 4.390 1.00 0.00 N ATOM 209 CA ASP A 15 16.637 10.774 5.121 1.00 0.00 C ATOM 210 C ASP A 15 17.787 9.832 5.441 1.00 0.00 C ATOM 211 O ASP A 15 17.683 8.998 6.341 1.00 0.00 O ATOM 212 CB ASP A 15 16.063 11.330 6.414 1.00 0.00 C ATOM 213 CG ASP A 15 17.017 12.270 7.127 1.00 0.00 C ATOM 214 OD1 ASP A 15 17.076 13.458 6.744 1.00 0.00 O ATOM 215 OD2 ASP A 15 17.700 11.820 8.070 1.00 0.00 O ATOM 0 H ASP A 15 15.739 9.088 4.263 1.00 0.00 H new ATOM 0 HA ASP A 15 17.022 11.582 4.499 1.00 0.00 H new ATOM 0 HB2 ASP A 15 15.135 11.859 6.196 1.00 0.00 H new ATOM 0 HB3 ASP A 15 15.811 10.504 7.079 1.00 0.00 H new ATOM 220 N ILE A 16 18.883 9.960 4.705 1.00 0.00 N ATOM 221 CA ILE A 16 20.034 9.121 4.922 1.00 0.00 C ATOM 222 C ILE A 16 21.333 9.899 4.728 1.00 0.00 C ATOM 223 O ILE A 16 21.647 10.802 5.506 1.00 0.00 O ATOM 224 CB ILE A 16 19.988 7.918 3.975 1.00 0.00 C ATOM 225 CG1 ILE A 16 19.564 8.355 2.569 1.00 0.00 C ATOM 226 CG2 ILE A 16 19.033 6.869 4.519 1.00 0.00 C ATOM 227 CD1 ILE A 16 19.576 7.231 1.554 1.00 0.00 C ATOM 0 H ILE A 16 18.991 10.641 3.953 1.00 0.00 H new ATOM 0 HA ILE A 16 20.009 8.768 5.953 1.00 0.00 H new ATOM 0 HB ILE A 16 20.986 7.485 3.908 1.00 0.00 H new ATOM 0 HG12 ILE A 16 18.561 8.779 2.617 1.00 0.00 H new ATOM 0 HG13 ILE A 16 20.230 9.148 2.228 1.00 0.00 H new ATOM 0 HG21 ILE A 16 19.005 6.016 3.841 1.00 0.00 H new ATOM 0 HG22 ILE A 16 19.374 6.541 5.501 1.00 0.00 H new ATOM 0 HG23 ILE A 16 18.034 7.297 4.606 1.00 0.00 H new ATOM 0 HD11 ILE A 16 19.265 7.615 0.582 1.00 0.00 H new ATOM 0 HD12 ILE A 16 20.583 6.821 1.477 1.00 0.00 H new ATOM 0 HD13 ILE A 16 18.889 6.447 1.871 1.00 0.00 H new ATOM 239 N THR A 17 22.078 9.550 3.690 1.00 0.00 N ATOM 240 CA THR A 17 23.344 10.203 3.390 1.00 0.00 C ATOM 241 C THR A 17 23.768 9.897 1.965 1.00 0.00 C ATOM 242 O THR A 17 24.952 9.725 1.670 1.00 0.00 O ATOM 243 CB THR A 17 24.454 9.726 4.337 1.00 0.00 C ATOM 244 OG1 THR A 17 23.965 9.659 5.682 1.00 0.00 O ATOM 245 CG2 THR A 17 25.662 10.649 4.278 1.00 0.00 C ATOM 0 H THR A 17 21.824 8.810 3.035 1.00 0.00 H new ATOM 0 HA THR A 17 23.196 11.275 3.519 1.00 0.00 H new ATOM 0 HB THR A 17 24.763 8.732 4.014 1.00 0.00 H new ATOM 0 HG1 THR A 17 23.304 10.368 5.825 1.00 0.00 H new ATOM 0 HG21 THR A 17 26.431 10.285 4.959 1.00 0.00 H new ATOM 0 HG22 THR A 17 26.056 10.668 3.262 1.00 0.00 H new ATOM 0 HG23 THR A 17 25.365 11.656 4.570 1.00 0.00 H new ATOM 253 N LEU A 18 22.791 9.836 1.086 1.00 0.00 N ATOM 254 CA LEU A 18 23.031 9.539 -0.302 1.00 0.00 C ATOM 255 C LEU A 18 23.555 10.754 -1.051 1.00 0.00 C ATOM 256 O LEU A 18 23.461 10.842 -2.275 1.00 0.00 O ATOM 257 CB LEU A 18 21.743 9.022 -0.921 1.00 0.00 C ATOM 258 CG LEU A 18 20.463 9.753 -0.493 1.00 0.00 C ATOM 259 CD1 LEU A 18 20.664 11.261 -0.485 1.00 0.00 C ATOM 260 CD2 LEU A 18 19.307 9.370 -1.401 1.00 0.00 C ATOM 0 H LEU A 18 21.810 9.991 1.317 1.00 0.00 H new ATOM 0 HA LEU A 18 23.803 8.773 -0.376 1.00 0.00 H new ATOM 0 HB2 LEU A 18 21.831 9.085 -2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 18 21.638 7.966 -0.671 1.00 0.00 H new ATOM 0 HG LEU A 18 20.223 9.446 0.525 1.00 0.00 H new ATOM 0 HD11 LEU A 18 19.739 11.750 -0.178 1.00 0.00 H new ATOM 0 HD12 LEU A 18 21.460 11.518 0.214 1.00 0.00 H new ATOM 0 HD13 LEU A 18 20.937 11.597 -1.485 1.00 0.00 H new ATOM 0 HD21 LEU A 18 18.406 9.896 -1.085 1.00 0.00 H new ATOM 0 HD22 LEU A 18 19.545 9.644 -2.429 1.00 0.00 H new ATOM 0 HD23 LEU A 18 19.139 8.295 -1.342 1.00 0.00 H new ATOM 272 N THR A 19 24.112 11.682 -0.294 1.00 0.00 N ATOM 273 CA THR A 19 24.672 12.901 -0.855 1.00 0.00 C ATOM 274 C THR A 19 26.057 12.624 -1.421 1.00 0.00 C ATOM 275 O THR A 19 26.663 13.480 -2.069 1.00 0.00 O ATOM 276 CB THR A 19 24.762 14.011 0.206 1.00 0.00 C ATOM 277 OG1 THR A 19 25.702 13.642 1.223 1.00 0.00 O ATOM 278 CG2 THR A 19 23.399 14.259 0.836 1.00 0.00 C ATOM 0 H THR A 19 24.189 11.614 0.721 1.00 0.00 H new ATOM 0 HA THR A 19 24.011 13.240 -1.652 1.00 0.00 H new ATOM 0 HB THR A 19 25.097 14.927 -0.281 1.00 0.00 H new ATOM 0 HG1 THR A 19 25.755 14.355 1.894 1.00 0.00 H new ATOM 0 HG21 THR A 19 23.482 15.047 1.584 1.00 0.00 H new ATOM 0 HG22 THR A 19 22.692 14.564 0.065 1.00 0.00 H new ATOM 0 HG23 THR A 19 23.046 13.344 1.311 1.00 0.00 H new ATOM 286 N GLU A 20 26.547 11.416 -1.166 1.00 0.00 N ATOM 287 CA GLU A 20 27.855 10.995 -1.646 1.00 0.00 C ATOM 288 C GLU A 20 27.703 10.078 -2.854 1.00 0.00 C ATOM 289 O GLU A 20 26.621 9.973 -3.431 1.00 0.00 O ATOM 290 CB GLU A 20 28.619 10.272 -0.534 1.00 0.00 C ATOM 291 CG GLU A 20 28.710 11.064 0.760 1.00 0.00 C ATOM 292 CD GLU A 20 29.456 12.374 0.596 1.00 0.00 C ATOM 293 OE1 GLU A 20 30.704 12.358 0.647 1.00 0.00 O ATOM 294 OE2 GLU A 20 28.792 13.416 0.416 1.00 0.00 O ATOM 0 H GLU A 20 26.052 10.707 -0.625 1.00 0.00 H new ATOM 0 HA GLU A 20 28.418 11.880 -1.943 1.00 0.00 H new ATOM 0 HB2 GLU A 20 28.132 9.318 -0.332 1.00 0.00 H new ATOM 0 HB3 GLU A 20 29.627 10.048 -0.884 1.00 0.00 H new ATOM 0 HG2 GLU A 20 27.704 11.267 1.128 1.00 0.00 H new ATOM 0 HG3 GLU A 20 29.210 10.459 1.517 1.00 0.00 H new ATOM 301 N THR A 21 28.789 9.416 -3.230 1.00 0.00 N ATOM 302 CA THR A 21 28.771 8.509 -4.370 1.00 0.00 C ATOM 303 C THR A 21 28.869 7.052 -3.933 1.00 0.00 C ATOM 304 O THR A 21 28.264 6.170 -4.543 1.00 0.00 O ATOM 305 CB THR A 21 29.926 8.803 -5.342 1.00 0.00 C ATOM 306 OG1 THR A 21 31.080 9.244 -4.615 1.00 0.00 O ATOM 307 CG2 THR A 21 29.526 9.857 -6.364 1.00 0.00 C ATOM 0 H THR A 21 29.693 9.490 -2.763 1.00 0.00 H new ATOM 0 HA THR A 21 27.818 8.673 -4.873 1.00 0.00 H new ATOM 0 HB THR A 21 30.164 7.882 -5.874 1.00 0.00 H new ATOM 0 HG1 THR A 21 31.811 9.427 -5.241 1.00 0.00 H new ATOM 0 HG21 THR A 21 30.361 10.045 -7.038 1.00 0.00 H new ATOM 0 HG22 THR A 21 28.670 9.501 -6.937 1.00 0.00 H new ATOM 0 HG23 THR A 21 29.260 10.780 -5.849 1.00 0.00 H new ATOM 315 N ARG A 22 29.631 6.807 -2.874 1.00 0.00 N ATOM 316 CA ARG A 22 29.820 5.450 -2.370 1.00 0.00 C ATOM 317 C ARG A 22 29.395 5.335 -0.909 1.00 0.00 C ATOM 318 O ARG A 22 29.144 6.340 -0.245 1.00 0.00 O ATOM 319 CB ARG A 22 31.280 5.039 -2.510 1.00 0.00 C ATOM 320 CG ARG A 22 31.829 5.214 -3.916 1.00 0.00 C ATOM 321 CD ARG A 22 33.244 4.674 -4.034 1.00 0.00 C ATOM 322 NE ARG A 22 33.756 4.784 -5.397 1.00 0.00 N ATOM 323 CZ ARG A 22 34.932 4.301 -5.784 1.00 0.00 C ATOM 324 NH1 ARG A 22 35.717 3.680 -4.912 1.00 0.00 N ATOM 325 NH2 ARG A 22 35.324 4.438 -7.042 1.00 0.00 N ATOM 0 H ARG A 22 30.127 7.527 -2.348 1.00 0.00 H new ATOM 0 HA ARG A 22 29.193 4.784 -2.963 1.00 0.00 H new ATOM 0 HB2 ARG A 22 31.882 5.627 -1.818 1.00 0.00 H new ATOM 0 HB3 ARG A 22 31.385 3.995 -2.215 1.00 0.00 H new ATOM 0 HG2 ARG A 22 31.182 4.700 -4.627 1.00 0.00 H new ATOM 0 HG3 ARG A 22 31.819 6.271 -4.183 1.00 0.00 H new ATOM 0 HD2 ARG A 22 33.899 5.220 -3.355 1.00 0.00 H new ATOM 0 HD3 ARG A 22 33.261 3.630 -3.723 1.00 0.00 H new ATOM 0 HE ARG A 22 33.178 5.258 -6.091 1.00 0.00 H new ATOM 0 HH11 ARG A 22 35.418 3.573 -3.943 1.00 0.00 H new ATOM 0 HH12 ARG A 22 36.619 3.310 -5.211 1.00 0.00 H new ATOM 0 HH21 ARG A 22 34.723 4.915 -7.714 1.00 0.00 H new ATOM 0 HH22 ARG A 22 36.227 4.067 -7.338 1.00 0.00 H new ATOM 339 N PHE A 23 29.317 4.099 -0.412 1.00 0.00 N ATOM 340 CA PHE A 23 28.923 3.818 0.968 1.00 0.00 C ATOM 341 C PHE A 23 29.801 2.697 1.527 1.00 0.00 C ATOM 342 O PHE A 23 31.024 2.829 1.568 1.00 0.00 O ATOM 343 CB PHE A 23 27.439 3.423 1.023 1.00 0.00 C ATOM 344 CG PHE A 23 26.514 4.479 0.485 1.00 0.00 C ATOM 345 CD1 PHE A 23 26.509 4.782 -0.866 1.00 0.00 C ATOM 346 CD2 PHE A 23 25.657 5.172 1.326 1.00 0.00 C ATOM 347 CE1 PHE A 23 25.675 5.754 -1.371 1.00 0.00 C ATOM 348 CE2 PHE A 23 24.814 6.149 0.826 1.00 0.00 C ATOM 349 CZ PHE A 23 24.825 6.442 -0.525 1.00 0.00 C ATOM 0 H PHE A 23 29.526 3.263 -0.958 1.00 0.00 H new ATOM 0 HA PHE A 23 29.060 4.712 1.576 1.00 0.00 H new ATOM 0 HB2 PHE A 23 27.295 2.503 0.456 1.00 0.00 H new ATOM 0 HB3 PHE A 23 27.168 3.206 2.056 1.00 0.00 H new ATOM 0 HD1 PHE A 23 27.169 4.248 -1.533 1.00 0.00 H new ATOM 0 HD2 PHE A 23 25.647 4.947 2.382 1.00 0.00 H new ATOM 0 HE1 PHE A 23 25.685 5.979 -2.427 1.00 0.00 H new ATOM 0 HE2 PHE A 23 24.149 6.681 1.490 1.00 0.00 H new ATOM 0 HZ PHE A 23 24.171 7.206 -0.919 1.00 0.00 H new ATOM 359 N LYS A 24 29.181 1.594 1.952 1.00 0.00 N ATOM 360 CA LYS A 24 29.925 0.451 2.478 1.00 0.00 C ATOM 361 C LYS A 24 28.992 -0.695 2.844 1.00 0.00 C ATOM 362 O LYS A 24 27.780 -0.513 2.943 1.00 0.00 O ATOM 363 CB LYS A 24 30.748 0.847 3.701 1.00 0.00 C ATOM 364 CG LYS A 24 30.043 1.832 4.621 1.00 0.00 C ATOM 365 CD LYS A 24 30.802 2.023 5.925 1.00 0.00 C ATOM 366 CE LYS A 24 30.035 2.914 6.889 1.00 0.00 C ATOM 367 NZ LYS A 24 29.968 4.323 6.415 1.00 0.00 N ATOM 0 H LYS A 24 28.169 1.470 1.942 1.00 0.00 H new ATOM 0 HA LYS A 24 30.599 0.117 1.689 1.00 0.00 H new ATOM 0 HB2 LYS A 24 30.996 -0.051 4.267 1.00 0.00 H new ATOM 0 HB3 LYS A 24 31.689 1.284 3.368 1.00 0.00 H new ATOM 0 HG2 LYS A 24 29.939 2.792 4.116 1.00 0.00 H new ATOM 0 HG3 LYS A 24 29.036 1.474 4.835 1.00 0.00 H new ATOM 0 HD2 LYS A 24 30.981 1.053 6.389 1.00 0.00 H new ATOM 0 HD3 LYS A 24 31.778 2.463 5.719 1.00 0.00 H new ATOM 0 HE2 LYS A 24 29.024 2.526 7.015 1.00 0.00 H new ATOM 0 HE3 LYS A 24 30.513 2.884 7.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 29.466 4.902 7.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 30.932 4.692 6.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 29.459 4.361 5.509 1.00 0.00 H new ATOM 381 N THR A 25 29.568 -1.876 3.052 1.00 0.00 N ATOM 382 CA THR A 25 28.783 -3.049 3.404 1.00 0.00 C ATOM 383 C THR A 25 28.169 -2.906 4.788 1.00 0.00 C ATOM 384 O THR A 25 27.421 -3.774 5.241 1.00 0.00 O ATOM 385 CB THR A 25 29.621 -4.332 3.371 1.00 0.00 C ATOM 386 OG1 THR A 25 30.997 -4.031 3.632 1.00 0.00 O ATOM 387 CG2 THR A 25 29.488 -5.063 2.032 1.00 0.00 C ATOM 0 H THR A 25 30.572 -2.043 2.983 1.00 0.00 H new ATOM 0 HA THR A 25 27.993 -3.122 2.656 1.00 0.00 H new ATOM 0 HB THR A 25 29.241 -4.994 4.150 1.00 0.00 H new ATOM 0 HG1 THR A 25 31.460 -4.844 3.924 1.00 0.00 H new ATOM 0 HG21 THR A 25 30.097 -5.967 2.049 1.00 0.00 H new ATOM 0 HG22 THR A 25 28.445 -5.331 1.866 1.00 0.00 H new ATOM 0 HG23 THR A 25 29.828 -4.412 1.227 1.00 0.00 H new ATOM 395 N GLY A 26 28.489 -1.807 5.453 1.00 0.00 N ATOM 396 CA GLY A 26 27.960 -1.561 6.779 1.00 0.00 C ATOM 397 C GLY A 26 26.947 -0.438 6.776 1.00 0.00 C ATOM 398 O GLY A 26 26.223 -0.239 7.751 1.00 0.00 O ATOM 0 H GLY A 26 29.108 -1.078 5.097 1.00 0.00 H new ATOM 0 HA2 GLY A 26 27.495 -2.470 7.160 1.00 0.00 H new ATOM 0 HA3 GLY A 26 28.777 -1.313 7.457 1.00 0.00 H new ATOM 402 N THR A 27 26.902 0.297 5.670 1.00 0.00 N ATOM 403 CA THR A 27 25.974 1.418 5.525 1.00 0.00 C ATOM 404 C THR A 27 24.527 0.936 5.623 1.00 0.00 C ATOM 405 O THR A 27 24.258 -0.257 5.491 1.00 0.00 O ATOM 406 CB THR A 27 26.173 2.150 4.182 1.00 0.00 C ATOM 407 OG1 THR A 27 25.656 3.483 4.273 1.00 0.00 O ATOM 408 CG2 THR A 27 25.470 1.416 3.052 1.00 0.00 C ATOM 0 H THR A 27 27.498 0.138 4.858 1.00 0.00 H new ATOM 0 HA THR A 27 26.184 2.115 6.337 1.00 0.00 H new ATOM 0 HB THR A 27 27.241 2.180 3.968 1.00 0.00 H new ATOM 0 HG1 THR A 27 26.377 4.126 4.105 1.00 0.00 H new ATOM 0 HG21 THR A 27 25.626 1.953 2.117 1.00 0.00 H new ATOM 0 HG22 THR A 27 25.877 0.408 2.964 1.00 0.00 H new ATOM 0 HG23 THR A 27 24.402 1.359 3.264 1.00 0.00 H new ATOM 416 N THR A 28 23.597 1.861 5.850 1.00 0.00 N ATOM 417 CA THR A 28 22.186 1.500 5.954 1.00 0.00 C ATOM 418 C THR A 28 21.274 2.685 5.641 1.00 0.00 C ATOM 419 O THR A 28 21.361 3.737 6.275 1.00 0.00 O ATOM 420 CB THR A 28 21.846 0.952 7.354 1.00 0.00 C ATOM 421 OG1 THR A 28 22.662 -0.188 7.648 1.00 0.00 O ATOM 422 CG2 THR A 28 20.378 0.565 7.446 1.00 0.00 C ATOM 0 H THR A 28 23.792 2.856 5.964 1.00 0.00 H new ATOM 0 HA THR A 28 22.012 0.719 5.214 1.00 0.00 H new ATOM 0 HB THR A 28 22.044 1.739 8.082 1.00 0.00 H new ATOM 0 HG1 THR A 28 23.093 -0.502 6.826 1.00 0.00 H new ATOM 0 HG21 THR A 28 20.165 0.181 8.444 1.00 0.00 H new ATOM 0 HG22 THR A 28 19.758 1.441 7.254 1.00 0.00 H new ATOM 0 HG23 THR A 28 20.158 -0.205 6.707 1.00 0.00 H new ATOM 430 N LEU A 29 20.399 2.499 4.655 1.00 0.00 N ATOM 431 CA LEU A 29 19.483 3.554 4.232 1.00 0.00 C ATOM 432 C LEU A 29 18.181 3.532 5.032 1.00 0.00 C ATOM 433 O LEU A 29 18.052 2.802 6.015 1.00 0.00 O ATOM 434 CB LEU A 29 19.165 3.423 2.739 1.00 0.00 C ATOM 435 CG LEU A 29 20.277 3.877 1.792 1.00 0.00 C ATOM 436 CD1 LEU A 29 21.484 2.964 1.911 1.00 0.00 C ATOM 437 CD2 LEU A 29 19.776 3.908 0.357 1.00 0.00 C ATOM 0 H LEU A 29 20.306 1.627 4.134 1.00 0.00 H new ATOM 0 HA LEU A 29 19.982 4.505 4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 29 18.931 2.380 2.524 1.00 0.00 H new ATOM 0 HB3 LEU A 29 18.267 4.002 2.523 1.00 0.00 H new ATOM 0 HG LEU A 29 20.577 4.886 2.075 1.00 0.00 H new ATOM 0 HD11 LEU A 29 22.265 3.302 1.230 1.00 0.00 H new ATOM 0 HD12 LEU A 29 21.859 2.988 2.934 1.00 0.00 H new ATOM 0 HD13 LEU A 29 21.196 1.945 1.655 1.00 0.00 H new ATOM 0 HD21 LEU A 29 20.581 4.233 -0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.448 2.911 0.065 1.00 0.00 H new ATOM 0 HD23 LEU A 29 18.940 4.602 0.279 1.00 0.00 H new ATOM 449 N LYS A 30 17.222 4.347 4.594 1.00 0.00 N ATOM 450 CA LYS A 30 15.919 4.436 5.246 1.00 0.00 C ATOM 451 C LYS A 30 14.802 4.167 4.242 1.00 0.00 C ATOM 452 O LYS A 30 14.252 3.068 4.195 1.00 0.00 O ATOM 453 CB LYS A 30 15.731 5.815 5.883 1.00 0.00 C ATOM 454 CG LYS A 30 15.355 5.759 7.356 1.00 0.00 C ATOM 455 CD LYS A 30 13.984 5.134 7.563 1.00 0.00 C ATOM 456 CE LYS A 30 13.662 4.968 9.039 1.00 0.00 C ATOM 457 NZ LYS A 30 14.563 3.983 9.698 1.00 0.00 N ATOM 0 H LYS A 30 17.326 4.959 3.784 1.00 0.00 H new ATOM 0 HA LYS A 30 15.876 3.680 6.030 1.00 0.00 H new ATOM 0 HB2 LYS A 30 16.653 6.385 5.773 1.00 0.00 H new ATOM 0 HB3 LYS A 30 14.956 6.355 5.339 1.00 0.00 H new ATOM 0 HG2 LYS A 30 16.103 5.184 7.901 1.00 0.00 H new ATOM 0 HG3 LYS A 30 15.362 6.766 7.772 1.00 0.00 H new ATOM 0 HD2 LYS A 30 13.224 5.758 7.092 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.948 4.162 7.071 1.00 0.00 H new ATOM 0 HE2 LYS A 30 13.750 5.932 9.540 1.00 0.00 H new ATOM 0 HE3 LYS A 30 12.627 4.644 9.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 14.172 3.721 10.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 14.643 3.134 9.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 15.505 4.406 9.827 1.00 0.00 H new ATOM 471 N TYR A 31 14.476 5.178 3.441 1.00 0.00 N ATOM 472 CA TYR A 31 13.434 5.052 2.423 1.00 0.00 C ATOM 473 C TYR A 31 12.055 4.819 3.041 1.00 0.00 C ATOM 474 O TYR A 31 11.926 4.213 4.104 1.00 0.00 O ATOM 475 CB TYR A 31 13.785 3.924 1.449 1.00 0.00 C ATOM 476 CG TYR A 31 14.618 4.386 0.275 1.00 0.00 C ATOM 477 CD1 TYR A 31 15.925 4.820 0.454 1.00 0.00 C ATOM 478 CD2 TYR A 31 14.095 4.392 -1.012 1.00 0.00 C ATOM 479 CE1 TYR A 31 16.688 5.246 -0.615 1.00 0.00 C ATOM 480 CE2 TYR A 31 14.852 4.817 -2.086 1.00 0.00 C ATOM 481 CZ TYR A 31 16.149 5.243 -1.882 1.00 0.00 C ATOM 482 OH TYR A 31 16.905 5.668 -2.950 1.00 0.00 O ATOM 0 H TYR A 31 14.919 6.096 3.477 1.00 0.00 H new ATOM 0 HA TYR A 31 13.387 5.995 1.878 1.00 0.00 H new ATOM 0 HB2 TYR A 31 14.327 3.145 1.986 1.00 0.00 H new ATOM 0 HB3 TYR A 31 12.864 3.474 1.078 1.00 0.00 H new ATOM 0 HD1 TYR A 31 16.352 4.824 1.446 1.00 0.00 H new ATOM 0 HD2 TYR A 31 13.081 4.059 -1.175 1.00 0.00 H new ATOM 0 HE1 TYR A 31 17.703 5.580 -0.458 1.00 0.00 H new ATOM 0 HE2 TYR A 31 14.431 4.816 -3.081 1.00 0.00 H new ATOM 0 HH TYR A 31 16.376 5.602 -3.772 1.00 0.00 H new ATOM 492 N THR A 32 11.027 5.315 2.355 1.00 0.00 N ATOM 493 CA THR A 32 9.645 5.188 2.810 1.00 0.00 C ATOM 494 C THR A 32 8.750 4.626 1.705 1.00 0.00 C ATOM 495 O THR A 32 9.152 4.566 0.545 1.00 0.00 O ATOM 496 CB THR A 32 9.096 6.555 3.261 1.00 0.00 C ATOM 497 OG1 THR A 32 7.664 6.532 3.287 1.00 0.00 O ATOM 498 CG2 THR A 32 9.580 7.656 2.328 1.00 0.00 C ATOM 0 H THR A 32 11.128 5.814 1.471 1.00 0.00 H new ATOM 0 HA THR A 32 9.640 4.498 3.654 1.00 0.00 H new ATOM 0 HB THR A 32 9.465 6.759 4.266 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.328 7.406 3.577 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.183 8.615 2.661 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.669 7.690 2.340 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.234 7.452 1.315 1.00 0.00 H new ATOM 506 N CYS A 33 7.535 4.222 2.072 1.00 0.00 N ATOM 507 CA CYS A 33 6.588 3.655 1.111 1.00 0.00 C ATOM 508 C CYS A 33 5.446 4.623 0.787 1.00 0.00 C ATOM 509 O CYS A 33 4.625 4.970 1.637 1.00 0.00 O ATOM 510 CB CYS A 33 5.999 2.347 1.659 1.00 0.00 C ATOM 511 SG CYS A 33 7.094 0.893 1.519 1.00 0.00 S ATOM 0 H CYS A 33 7.182 4.276 3.028 1.00 0.00 H new ATOM 0 HA CYS A 33 7.141 3.463 0.191 1.00 0.00 H new ATOM 0 HB2 CYS A 33 5.744 2.492 2.709 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.069 2.135 1.132 1.00 0.00 H new ATOM 516 N LEU A 34 5.450 5.049 -0.480 1.00 0.00 N ATOM 517 CA LEU A 34 4.478 6.001 -1.026 1.00 0.00 C ATOM 518 C LEU A 34 3.042 5.692 -0.596 1.00 0.00 C ATOM 519 O LEU A 34 2.762 4.636 -0.035 1.00 0.00 O ATOM 520 CB LEU A 34 4.576 6.011 -2.555 1.00 0.00 C ATOM 521 CG LEU A 34 5.980 6.262 -3.112 1.00 0.00 C ATOM 522 CD1 LEU A 34 5.992 6.091 -4.624 1.00 0.00 C ATOM 523 CD2 LEU A 34 6.467 7.651 -2.727 1.00 0.00 C ATOM 0 H LEU A 34 6.139 4.738 -1.165 1.00 0.00 H new ATOM 0 HA LEU A 34 4.724 6.984 -0.625 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.217 5.054 -2.933 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.905 6.778 -2.942 1.00 0.00 H new ATOM 0 HG LEU A 34 6.659 5.528 -2.678 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.998 6.273 -5.003 1.00 0.00 H new ATOM 0 HD12 LEU A 34 5.687 5.076 -4.878 1.00 0.00 H new ATOM 0 HD13 LEU A 34 5.300 6.801 -5.076 1.00 0.00 H new ATOM 0 HD21 LEU A 34 7.466 7.811 -3.132 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.787 8.400 -3.132 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.497 7.738 -1.641 1.00 0.00 H new ATOM 535 N PRO A 35 2.108 6.633 -0.838 1.00 0.00 N ATOM 536 CA PRO A 35 0.699 6.449 -0.481 1.00 0.00 C ATOM 537 C PRO A 35 0.035 5.309 -1.250 1.00 0.00 C ATOM 538 O PRO A 35 -0.315 5.450 -2.423 1.00 0.00 O ATOM 539 CB PRO A 35 0.048 7.789 -0.845 1.00 0.00 C ATOM 540 CG PRO A 35 0.976 8.418 -1.826 1.00 0.00 C ATOM 541 CD PRO A 35 2.353 7.956 -1.444 1.00 0.00 C ATOM 0 HA PRO A 35 0.590 6.179 0.569 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.942 7.642 -1.277 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -0.079 8.418 0.036 1.00 0.00 H new ATOM 0 HG2 PRO A 35 0.731 8.116 -2.844 1.00 0.00 H new ATOM 0 HG3 PRO A 35 0.905 9.505 -1.790 1.00 0.00 H new ATOM 0 HD2 PRO A 35 3.010 7.886 -2.311 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.827 8.640 -0.740 1.00 0.00 H new ATOM 549 N GLY A 36 -0.126 4.178 -0.572 1.00 0.00 N ATOM 550 CA GLY A 36 -0.779 3.045 -1.208 1.00 0.00 C ATOM 551 C GLY A 36 -0.158 1.704 -0.856 1.00 0.00 C ATOM 552 O GLY A 36 -0.696 0.658 -1.219 1.00 0.00 O ATOM 0 H GLY A 36 0.177 4.024 0.390 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -1.830 3.035 -0.920 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.745 3.178 -2.289 1.00 0.00 H new ATOM 556 N TYR A 37 0.963 1.723 -0.144 1.00 0.00 N ATOM 557 CA TYR A 37 1.619 0.483 0.254 1.00 0.00 C ATOM 558 C TYR A 37 0.910 -0.101 1.466 1.00 0.00 C ATOM 559 O TYR A 37 0.355 0.637 2.280 1.00 0.00 O ATOM 560 CB TYR A 37 3.099 0.721 0.557 1.00 0.00 C ATOM 561 CG TYR A 37 3.921 1.077 -0.665 1.00 0.00 C ATOM 562 CD1 TYR A 37 3.828 2.335 -1.239 1.00 0.00 C ATOM 563 CD2 TYR A 37 4.794 0.161 -1.237 1.00 0.00 C ATOM 564 CE1 TYR A 37 4.577 2.673 -2.347 1.00 0.00 C ATOM 565 CE2 TYR A 37 5.551 0.493 -2.347 1.00 0.00 C ATOM 566 CZ TYR A 37 5.437 1.752 -2.896 1.00 0.00 C ATOM 567 OH TYR A 37 6.182 2.092 -3.999 1.00 0.00 O ATOM 0 H TYR A 37 1.433 2.573 0.167 1.00 0.00 H new ATOM 0 HA TYR A 37 1.560 -0.227 -0.571 1.00 0.00 H new ATOM 0 HB2 TYR A 37 3.186 1.524 1.289 1.00 0.00 H new ATOM 0 HB3 TYR A 37 3.516 -0.176 1.016 1.00 0.00 H new ATOM 0 HD1 TYR A 37 3.156 3.064 -0.811 1.00 0.00 H new ATOM 0 HD2 TYR A 37 4.884 -0.826 -0.809 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.488 3.658 -2.782 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.227 -0.230 -2.780 1.00 0.00 H new ATOM 0 HH TYR A 37 6.368 3.054 -3.984 1.00 0.00 H new ATOM 577 N VAL A 38 0.923 -1.423 1.590 1.00 0.00 N ATOM 578 CA VAL A 38 0.255 -2.114 2.681 1.00 0.00 C ATOM 579 C VAL A 38 1.203 -3.126 3.325 1.00 0.00 C ATOM 580 O VAL A 38 2.354 -2.810 3.625 1.00 0.00 O ATOM 581 CB VAL A 38 -1.007 -2.829 2.161 1.00 0.00 C ATOM 582 CG1 VAL A 38 -2.011 -1.825 1.617 1.00 0.00 C ATOM 583 CG2 VAL A 38 -0.639 -3.831 1.084 1.00 0.00 C ATOM 0 H VAL A 38 1.398 -2.044 0.935 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.039 -1.381 3.432 1.00 0.00 H new ATOM 0 HB VAL A 38 -1.466 -3.359 2.996 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.894 -2.353 1.256 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -2.300 -1.134 2.409 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.560 -1.268 0.796 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.541 -4.328 0.726 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.157 -3.313 0.255 1.00 0.00 H new ATOM 0 HG23 VAL A 38 0.045 -4.573 1.496 1.00 0.00 H new ATOM 593 N ARG A 39 0.686 -4.328 3.556 1.00 0.00 N ATOM 594 CA ARG A 39 1.434 -5.426 4.174 1.00 0.00 C ATOM 595 C ARG A 39 2.799 -5.676 3.510 1.00 0.00 C ATOM 596 O ARG A 39 3.382 -4.791 2.890 1.00 0.00 O ATOM 597 CB ARG A 39 0.589 -6.702 4.124 1.00 0.00 C ATOM 598 CG ARG A 39 0.843 -7.659 5.280 1.00 0.00 C ATOM 599 CD ARG A 39 0.325 -7.102 6.597 1.00 0.00 C ATOM 600 NE ARG A 39 0.374 -8.095 7.666 1.00 0.00 N ATOM 601 CZ ARG A 39 -0.172 -7.918 8.865 1.00 0.00 C ATOM 602 NH1 ARG A 39 -0.795 -6.784 9.153 1.00 0.00 N ATOM 603 NH2 ARG A 39 -0.092 -8.876 9.778 1.00 0.00 N ATOM 0 H ARG A 39 -0.275 -4.574 3.318 1.00 0.00 H new ATOM 0 HA ARG A 39 1.638 -5.139 5.206 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.466 -6.427 4.119 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.788 -7.221 3.186 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.360 -8.614 5.074 1.00 0.00 H new ATOM 0 HG3 ARG A 39 1.912 -7.854 5.363 1.00 0.00 H new ATOM 0 HD2 ARG A 39 0.918 -6.233 6.882 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.701 -6.759 6.467 1.00 0.00 H new ATOM 0 HE ARG A 39 0.855 -8.976 7.482 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.857 -6.044 8.454 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -1.213 -6.651 10.074 1.00 0.00 H new ATOM 0 HH21 ARG A 39 0.389 -9.749 9.560 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -0.511 -8.740 10.698 1.00 0.00 H new ATOM 617 N SER A 40 3.293 -6.907 3.660 1.00 0.00 N ATOM 618 CA SER A 40 4.586 -7.325 3.119 1.00 0.00 C ATOM 619 C SER A 40 5.735 -6.649 3.856 1.00 0.00 C ATOM 620 O SER A 40 6.432 -5.802 3.301 1.00 0.00 O ATOM 621 CB SER A 40 4.679 -7.041 1.619 1.00 0.00 C ATOM 622 OG SER A 40 3.870 -7.940 0.880 1.00 0.00 O ATOM 0 H SER A 40 2.803 -7.646 4.164 1.00 0.00 H new ATOM 0 HA SER A 40 4.667 -8.402 3.268 1.00 0.00 H new ATOM 0 HB2 SER A 40 4.366 -6.016 1.419 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.715 -7.127 1.293 1.00 0.00 H new ATOM 0 HG SER A 40 4.392 -8.320 0.143 1.00 0.00 H new ATOM 628 N HIS A 41 5.925 -7.035 5.116 1.00 0.00 N ATOM 629 CA HIS A 41 6.989 -6.475 5.942 1.00 0.00 C ATOM 630 C HIS A 41 6.834 -4.963 6.079 1.00 0.00 C ATOM 631 O HIS A 41 5.831 -4.390 5.655 1.00 0.00 O ATOM 632 CB HIS A 41 8.357 -6.809 5.345 1.00 0.00 C ATOM 633 CG HIS A 41 8.559 -8.272 5.096 1.00 0.00 C ATOM 634 ND1 HIS A 41 8.215 -8.887 3.911 1.00 0.00 N ATOM 635 CD2 HIS A 41 9.073 -9.243 5.887 1.00 0.00 C ATOM 636 CE1 HIS A 41 8.508 -10.173 3.984 1.00 0.00 C ATOM 637 NE2 HIS A 41 9.030 -10.414 5.172 1.00 0.00 N ATOM 0 H HIS A 41 5.353 -7.736 5.587 1.00 0.00 H new ATOM 0 HA HIS A 41 6.916 -6.920 6.934 1.00 0.00 H new ATOM 0 HB2 HIS A 41 8.476 -6.269 4.406 1.00 0.00 H new ATOM 0 HB3 HIS A 41 9.136 -6.452 6.019 1.00 0.00 H new ATOM 0 HD2 HIS A 41 9.447 -9.119 6.893 1.00 0.00 H new ATOM 0 HE1 HIS A 41 8.348 -10.903 3.204 1.00 0.00 H new ATOM 0 HE2 HIS A 41 9.350 -11.323 5.505 1.00 0.00 H new ATOM 646 N SER A 42 7.832 -4.324 6.679 1.00 0.00 N ATOM 647 CA SER A 42 7.810 -2.879 6.873 1.00 0.00 C ATOM 648 C SER A 42 9.225 -2.335 7.021 1.00 0.00 C ATOM 649 O SER A 42 9.444 -1.123 6.999 1.00 0.00 O ATOM 650 CB SER A 42 6.978 -2.523 8.106 1.00 0.00 C ATOM 651 OG SER A 42 6.950 -1.121 8.317 1.00 0.00 O ATOM 0 H SER A 42 8.667 -4.785 7.040 1.00 0.00 H new ATOM 0 HA SER A 42 7.354 -2.422 5.995 1.00 0.00 H new ATOM 0 HB2 SER A 42 5.961 -2.895 7.982 1.00 0.00 H new ATOM 0 HB3 SER A 42 7.394 -3.018 8.984 1.00 0.00 H new ATOM 0 HG SER A 42 7.784 -0.724 7.989 1.00 0.00 H new ATOM 657 N THR A 43 10.182 -3.242 7.169 1.00 0.00 N ATOM 658 CA THR A 43 11.582 -2.865 7.318 1.00 0.00 C ATOM 659 C THR A 43 12.137 -2.304 6.015 1.00 0.00 C ATOM 660 O THR A 43 12.195 -3.001 5.002 1.00 0.00 O ATOM 661 CB THR A 43 12.442 -4.066 7.748 1.00 0.00 C ATOM 662 OG1 THR A 43 11.883 -4.678 8.916 1.00 0.00 O ATOM 663 CG2 THR A 43 13.873 -3.634 8.033 1.00 0.00 C ATOM 0 H THR A 43 10.013 -4.248 7.189 1.00 0.00 H new ATOM 0 HA THR A 43 11.624 -2.099 8.092 1.00 0.00 H new ATOM 0 HB THR A 43 12.452 -4.787 6.930 1.00 0.00 H new ATOM 0 HG1 THR A 43 12.436 -5.442 9.181 1.00 0.00 H new ATOM 0 HG21 THR A 43 14.461 -4.500 8.335 1.00 0.00 H new ATOM 0 HG22 THR A 43 14.307 -3.196 7.134 1.00 0.00 H new ATOM 0 HG23 THR A 43 13.877 -2.895 8.834 1.00 0.00 H new ATOM 671 N GLN A 44 12.549 -1.042 6.049 1.00 0.00 N ATOM 672 CA GLN A 44 13.099 -0.384 4.873 1.00 0.00 C ATOM 673 C GLN A 44 14.532 0.055 5.135 1.00 0.00 C ATOM 674 O GLN A 44 14.769 1.105 5.732 1.00 0.00 O ATOM 675 CB GLN A 44 12.241 0.825 4.495 1.00 0.00 C ATOM 676 CG GLN A 44 10.751 0.526 4.480 1.00 0.00 C ATOM 677 CD GLN A 44 9.914 1.740 4.131 1.00 0.00 C ATOM 678 OE1 GLN A 44 9.513 2.506 5.007 1.00 0.00 O ATOM 679 NE2 GLN A 44 9.645 1.921 2.844 1.00 0.00 N ATOM 0 H GLN A 44 12.512 -0.454 6.881 1.00 0.00 H new ATOM 0 HA GLN A 44 13.095 -1.092 4.044 1.00 0.00 H new ATOM 0 HB2 GLN A 44 12.435 1.633 5.200 1.00 0.00 H new ATOM 0 HB3 GLN A 44 12.543 1.182 3.510 1.00 0.00 H new ATOM 0 HG2 GLN A 44 10.551 -0.267 3.760 1.00 0.00 H new ATOM 0 HG3 GLN A 44 10.450 0.151 5.458 1.00 0.00 H new ATOM 0 HE21 GLN A 44 9.998 1.261 2.151 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.085 2.720 2.548 1.00 0.00 H new ATOM 688 N THR A 45 15.487 -0.756 4.693 1.00 0.00 N ATOM 689 CA THR A 45 16.896 -0.451 4.895 1.00 0.00 C ATOM 690 C THR A 45 17.758 -1.040 3.784 1.00 0.00 C ATOM 691 O THR A 45 17.700 -2.239 3.508 1.00 0.00 O ATOM 692 CB THR A 45 17.403 -0.989 6.247 1.00 0.00 C ATOM 693 OG1 THR A 45 17.125 -2.390 6.353 1.00 0.00 O ATOM 694 CG2 THR A 45 16.754 -0.249 7.408 1.00 0.00 C ATOM 0 H THR A 45 15.310 -1.628 4.194 1.00 0.00 H new ATOM 0 HA THR A 45 16.980 0.636 4.884 1.00 0.00 H new ATOM 0 HB THR A 45 18.480 -0.827 6.293 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.169 -2.800 5.464 1.00 0.00 H new ATOM 0 HG21 THR A 45 17.130 -0.649 8.350 1.00 0.00 H new ATOM 0 HG22 THR A 45 16.994 0.812 7.343 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.673 -0.380 7.364 1.00 0.00 H new ATOM 702 N LEU A 46 18.557 -0.189 3.152 1.00 0.00 N ATOM 703 CA LEU A 46 19.447 -0.624 2.083 1.00 0.00 C ATOM 704 C LEU A 46 20.863 -0.772 2.627 1.00 0.00 C ATOM 705 O LEU A 46 21.514 0.216 2.964 1.00 0.00 O ATOM 706 CB LEU A 46 19.429 0.366 0.914 1.00 0.00 C ATOM 707 CG LEU A 46 18.396 0.069 -0.178 1.00 0.00 C ATOM 708 CD1 LEU A 46 18.525 1.065 -1.322 1.00 0.00 C ATOM 709 CD2 LEU A 46 18.559 -1.350 -0.693 1.00 0.00 C ATOM 0 H LEU A 46 18.607 0.808 3.362 1.00 0.00 H new ATOM 0 HA LEU A 46 19.098 -1.587 1.711 1.00 0.00 H new ATOM 0 HB2 LEU A 46 19.241 1.365 1.308 1.00 0.00 H new ATOM 0 HB3 LEU A 46 20.419 0.384 0.459 1.00 0.00 H new ATOM 0 HG LEU A 46 17.401 0.168 0.256 1.00 0.00 H new ATOM 0 HD11 LEU A 46 17.783 0.838 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 46 18.361 2.075 -0.946 1.00 0.00 H new ATOM 0 HD13 LEU A 46 19.524 0.997 -1.753 1.00 0.00 H new ATOM 0 HD21 LEU A 46 17.817 -1.543 -1.468 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.559 -1.473 -1.109 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.418 -2.053 0.128 1.00 0.00 H new ATOM 721 N THR A 47 21.332 -2.011 2.717 1.00 0.00 N ATOM 722 CA THR A 47 22.672 -2.282 3.215 1.00 0.00 C ATOM 723 C THR A 47 23.499 -2.964 2.141 1.00 0.00 C ATOM 724 O THR A 47 22.977 -3.768 1.369 1.00 0.00 O ATOM 725 CB THR A 47 22.641 -3.185 4.464 1.00 0.00 C ATOM 726 OG1 THR A 47 21.702 -2.673 5.417 1.00 0.00 O ATOM 727 CG2 THR A 47 24.019 -3.273 5.103 1.00 0.00 C ATOM 0 H THR A 47 20.804 -2.842 2.452 1.00 0.00 H new ATOM 0 HA THR A 47 23.118 -1.325 3.485 1.00 0.00 H new ATOM 0 HB THR A 47 22.336 -4.184 4.154 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.688 -3.254 6.206 1.00 0.00 H new ATOM 0 HG21 THR A 47 23.972 -3.915 5.982 1.00 0.00 H new ATOM 0 HG22 THR A 47 24.726 -3.690 4.386 1.00 0.00 H new ATOM 0 HG23 THR A 47 24.347 -2.277 5.399 1.00 0.00 H new ATOM 735 N CYS A 48 24.787 -2.649 2.081 1.00 0.00 N ATOM 736 CA CYS A 48 25.644 -3.264 1.090 1.00 0.00 C ATOM 737 C CYS A 48 26.001 -4.662 1.560 1.00 0.00 C ATOM 738 O CYS A 48 26.617 -4.841 2.611 1.00 0.00 O ATOM 739 CB CYS A 48 26.898 -2.422 0.850 1.00 0.00 C ATOM 740 SG CYS A 48 28.003 -3.081 -0.439 1.00 0.00 S ATOM 0 H CYS A 48 25.250 -1.982 2.698 1.00 0.00 H new ATOM 0 HA CYS A 48 25.117 -3.326 0.138 1.00 0.00 H new ATOM 0 HB2 CYS A 48 26.596 -1.412 0.573 1.00 0.00 H new ATOM 0 HB3 CYS A 48 27.454 -2.344 1.784 1.00 0.00 H new ATOM 745 N ASN A 49 25.587 -5.650 0.788 1.00 0.00 N ATOM 746 CA ASN A 49 25.879 -7.035 1.108 1.00 0.00 C ATOM 747 C ASN A 49 27.171 -7.461 0.422 1.00 0.00 C ATOM 748 O ASN A 49 27.928 -6.619 -0.061 1.00 0.00 O ATOM 749 CB ASN A 49 24.727 -7.930 0.664 1.00 0.00 C ATOM 750 CG ASN A 49 24.451 -7.795 -0.816 1.00 0.00 C ATOM 751 OD1 ASN A 49 25.040 -8.496 -1.630 1.00 0.00 O ATOM 752 ND2 ASN A 49 23.555 -6.885 -1.171 1.00 0.00 N ATOM 0 H ASN A 49 25.046 -5.518 -0.067 1.00 0.00 H new ATOM 0 HA ASN A 49 26.001 -7.134 2.187 1.00 0.00 H new ATOM 0 HB2 ASN A 49 24.963 -8.968 0.897 1.00 0.00 H new ATOM 0 HB3 ASN A 49 23.829 -7.673 1.226 1.00 0.00 H new ATOM 0 HD21 ASN A 49 23.332 -6.746 -2.157 1.00 0.00 H new ATOM 0 HD22 ASN A 49 23.089 -6.323 -0.459 1.00 0.00 H new ATOM 759 N SER A 50 27.422 -8.762 0.377 1.00 0.00 N ATOM 760 CA SER A 50 28.628 -9.271 -0.260 1.00 0.00 C ATOM 761 C SER A 50 28.274 -10.062 -1.528 1.00 0.00 C ATOM 762 O SER A 50 28.667 -11.218 -1.688 1.00 0.00 O ATOM 763 CB SER A 50 29.408 -10.153 0.717 1.00 0.00 C ATOM 764 OG SER A 50 30.589 -10.657 0.119 1.00 0.00 O ATOM 0 H SER A 50 26.812 -9.479 0.770 1.00 0.00 H new ATOM 0 HA SER A 50 29.254 -8.425 -0.546 1.00 0.00 H new ATOM 0 HB2 SER A 50 29.664 -9.577 1.606 1.00 0.00 H new ATOM 0 HB3 SER A 50 28.780 -10.982 1.044 1.00 0.00 H new ATOM 0 HG SER A 50 30.367 -11.081 -0.736 1.00 0.00 H new ATOM 770 N ASP A 51 27.527 -9.412 -2.421 1.00 0.00 N ATOM 771 CA ASP A 51 27.116 -10.002 -3.701 1.00 0.00 C ATOM 772 C ASP A 51 27.553 -9.096 -4.845 1.00 0.00 C ATOM 773 O ASP A 51 27.983 -9.565 -5.899 1.00 0.00 O ATOM 774 CB ASP A 51 25.596 -10.175 -3.750 1.00 0.00 C ATOM 775 CG ASP A 51 25.116 -11.349 -2.918 1.00 0.00 C ATOM 776 OD1 ASP A 51 25.205 -12.497 -3.404 1.00 0.00 O ATOM 777 OD2 ASP A 51 24.650 -11.122 -1.781 1.00 0.00 O ATOM 0 H ASP A 51 27.188 -8.460 -2.280 1.00 0.00 H new ATOM 0 HA ASP A 51 27.588 -10.980 -3.799 1.00 0.00 H new ATOM 0 HB2 ASP A 51 25.118 -9.262 -3.394 1.00 0.00 H new ATOM 0 HB3 ASP A 51 25.283 -10.315 -4.785 1.00 0.00 H new ATOM 782 N GLY A 52 27.437 -7.793 -4.619 1.00 0.00 N ATOM 783 CA GLY A 52 27.818 -6.822 -5.628 1.00 0.00 C ATOM 784 C GLY A 52 26.808 -5.696 -5.720 1.00 0.00 C ATOM 785 O GLY A 52 26.918 -4.802 -6.559 1.00 0.00 O ATOM 0 H GLY A 52 27.084 -7.390 -3.751 1.00 0.00 H new ATOM 0 HA2 GLY A 52 28.800 -6.414 -5.390 1.00 0.00 H new ATOM 0 HA3 GLY A 52 27.904 -7.316 -6.596 1.00 0.00 H new ATOM 789 N GLU A 53 25.818 -5.762 -4.833 1.00 0.00 N ATOM 790 CA GLU A 53 24.761 -4.755 -4.807 1.00 0.00 C ATOM 791 C GLU A 53 24.137 -4.598 -3.426 1.00 0.00 C ATOM 792 O GLU A 53 24.709 -4.997 -2.413 1.00 0.00 O ATOM 793 CB GLU A 53 23.674 -5.126 -5.816 1.00 0.00 C ATOM 794 CG GLU A 53 23.106 -6.522 -5.609 1.00 0.00 C ATOM 795 CD GLU A 53 23.899 -7.590 -6.337 1.00 0.00 C ATOM 796 OE1 GLU A 53 24.897 -8.079 -5.770 1.00 0.00 O ATOM 797 OE2 GLU A 53 23.519 -7.940 -7.474 1.00 0.00 O ATOM 0 H GLU A 53 25.726 -6.495 -4.129 1.00 0.00 H new ATOM 0 HA GLU A 53 25.217 -3.801 -5.070 1.00 0.00 H new ATOM 0 HB2 GLU A 53 22.864 -4.399 -5.750 1.00 0.00 H new ATOM 0 HB3 GLU A 53 24.085 -5.055 -6.823 1.00 0.00 H new ATOM 0 HG2 GLU A 53 23.091 -6.749 -4.543 1.00 0.00 H new ATOM 0 HG3 GLU A 53 22.072 -6.544 -5.954 1.00 0.00 H new ATOM 804 N TRP A 54 22.951 -3.996 -3.413 1.00 0.00 N ATOM 805 CA TRP A 54 22.202 -3.744 -2.199 1.00 0.00 C ATOM 806 C TRP A 54 21.159 -4.826 -1.944 1.00 0.00 C ATOM 807 O TRP A 54 20.267 -5.060 -2.760 1.00 0.00 O ATOM 808 CB TRP A 54 21.524 -2.386 -2.325 1.00 0.00 C ATOM 809 CG TRP A 54 22.483 -1.293 -2.680 1.00 0.00 C ATOM 810 CD1 TRP A 54 22.834 -0.875 -3.930 1.00 0.00 C ATOM 811 CD2 TRP A 54 23.225 -0.491 -1.765 1.00 0.00 C ATOM 812 NE1 TRP A 54 23.749 0.147 -3.843 1.00 0.00 N ATOM 813 CE2 TRP A 54 24.004 0.402 -2.522 1.00 0.00 C ATOM 814 CE3 TRP A 54 23.300 -0.442 -0.377 1.00 0.00 C ATOM 815 CZ2 TRP A 54 24.851 1.336 -1.929 1.00 0.00 C ATOM 816 CZ3 TRP A 54 24.138 0.482 0.212 1.00 0.00 C ATOM 817 CH2 TRP A 54 24.904 1.362 -0.563 1.00 0.00 C ATOM 0 H TRP A 54 22.483 -3.668 -4.258 1.00 0.00 H new ATOM 0 HA TRP A 54 22.889 -3.753 -1.353 1.00 0.00 H new ATOM 0 HB2 TRP A 54 20.746 -2.442 -3.086 1.00 0.00 H new ATOM 0 HB3 TRP A 54 21.032 -2.141 -1.384 1.00 0.00 H new ATOM 0 HD1 TRP A 54 22.450 -1.286 -4.852 1.00 0.00 H new ATOM 0 HE1 TRP A 54 24.169 0.636 -4.633 1.00 0.00 H new ATOM 0 HE3 TRP A 54 22.712 -1.116 0.229 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 25.443 2.014 -2.526 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 24.205 0.528 1.289 1.00 0.00 H new ATOM 0 HH2 TRP A 54 25.549 2.075 -0.072 1.00 0.00 H new ATOM 828 N VAL A 55 21.293 -5.476 -0.796 1.00 0.00 N ATOM 829 CA VAL A 55 20.391 -6.539 -0.376 1.00 0.00 C ATOM 830 C VAL A 55 19.381 -5.979 0.615 1.00 0.00 C ATOM 831 O VAL A 55 19.668 -4.991 1.294 1.00 0.00 O ATOM 832 CB VAL A 55 21.167 -7.710 0.262 1.00 0.00 C ATOM 833 CG1 VAL A 55 20.471 -8.223 1.511 1.00 0.00 C ATOM 834 CG2 VAL A 55 21.352 -8.833 -0.746 1.00 0.00 C ATOM 0 H VAL A 55 22.036 -5.279 -0.125 1.00 0.00 H new ATOM 0 HA VAL A 55 19.872 -6.923 -1.254 1.00 0.00 H new ATOM 0 HB VAL A 55 22.148 -7.339 0.559 1.00 0.00 H new ATOM 0 HG11 VAL A 55 21.045 -9.047 1.935 1.00 0.00 H new ATOM 0 HG12 VAL A 55 20.397 -7.419 2.243 1.00 0.00 H new ATOM 0 HG13 VAL A 55 19.471 -8.572 1.253 1.00 0.00 H new ATOM 0 HG21 VAL A 55 21.901 -9.652 -0.282 1.00 0.00 H new ATOM 0 HG22 VAL A 55 20.376 -9.191 -1.075 1.00 0.00 H new ATOM 0 HG23 VAL A 55 21.911 -8.462 -1.605 1.00 0.00 H new ATOM 844 N TYR A 56 18.210 -6.610 0.715 1.00 0.00 N ATOM 845 CA TYR A 56 17.198 -6.150 1.660 1.00 0.00 C ATOM 846 C TYR A 56 15.880 -6.899 1.498 1.00 0.00 C ATOM 847 O TYR A 56 15.707 -7.661 0.547 1.00 0.00 O ATOM 848 CB TYR A 56 16.944 -4.649 1.472 1.00 0.00 C ATOM 849 CG TYR A 56 16.490 -4.288 0.070 1.00 0.00 C ATOM 850 CD1 TYR A 56 17.365 -4.357 -1.008 1.00 0.00 C ATOM 851 CD2 TYR A 56 15.185 -3.882 -0.177 1.00 0.00 C ATOM 852 CE1 TYR A 56 16.957 -4.032 -2.286 1.00 0.00 C ATOM 853 CE2 TYR A 56 14.768 -3.555 -1.453 1.00 0.00 C ATOM 854 CZ TYR A 56 15.658 -3.632 -2.504 1.00 0.00 C ATOM 855 OH TYR A 56 15.249 -3.307 -3.775 1.00 0.00 O ATOM 0 H TYR A 56 17.944 -7.426 0.163 1.00 0.00 H new ATOM 0 HA TYR A 56 17.582 -6.346 2.661 1.00 0.00 H new ATOM 0 HB2 TYR A 56 16.188 -4.323 2.186 1.00 0.00 H new ATOM 0 HB3 TYR A 56 17.858 -4.101 1.703 1.00 0.00 H new ATOM 0 HD1 TYR A 56 18.385 -4.671 -0.842 1.00 0.00 H new ATOM 0 HD2 TYR A 56 14.484 -3.821 0.642 1.00 0.00 H new ATOM 0 HE1 TYR A 56 17.653 -4.091 -3.110 1.00 0.00 H new ATOM 0 HE2 TYR A 56 13.750 -3.240 -1.627 1.00 0.00 H new ATOM 0 HH TYR A 56 14.414 -2.796 -3.729 1.00 0.00 H new ATOM 865 N ASN A 57 14.954 -6.683 2.424 1.00 0.00 N ATOM 866 CA ASN A 57 13.653 -7.336 2.357 1.00 0.00 C ATOM 867 C ASN A 57 12.709 -6.533 1.474 1.00 0.00 C ATOM 868 O ASN A 57 12.998 -5.388 1.129 1.00 0.00 O ATOM 869 CB ASN A 57 13.056 -7.497 3.758 1.00 0.00 C ATOM 870 CG ASN A 57 13.772 -8.549 4.585 1.00 0.00 C ATOM 871 OD1 ASN A 57 13.158 -9.229 5.407 1.00 0.00 O ATOM 872 ND2 ASN A 57 15.076 -8.688 4.376 1.00 0.00 N ATOM 0 H ASN A 57 15.078 -6.065 3.226 1.00 0.00 H new ATOM 0 HA ASN A 57 13.787 -8.327 1.924 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.100 -6.540 4.279 1.00 0.00 H new ATOM 0 HB3 ASN A 57 12.003 -7.765 3.671 1.00 0.00 H new ATOM 0 HD21 ASN A 57 15.607 -9.379 4.907 1.00 0.00 H new ATOM 0 HD22 ASN A 57 15.547 -8.104 3.685 1.00 0.00 H new ATOM 879 N THR A 58 11.580 -7.127 1.113 1.00 0.00 N ATOM 880 CA THR A 58 10.611 -6.445 0.268 1.00 0.00 C ATOM 881 C THR A 58 9.603 -5.675 1.108 1.00 0.00 C ATOM 882 O THR A 58 8.455 -6.092 1.258 1.00 0.00 O ATOM 883 CB THR A 58 9.860 -7.428 -0.649 1.00 0.00 C ATOM 884 OG1 THR A 58 10.785 -8.341 -1.254 1.00 0.00 O ATOM 885 CG2 THR A 58 9.104 -6.677 -1.736 1.00 0.00 C ATOM 0 H THR A 58 11.314 -8.072 1.390 1.00 0.00 H new ATOM 0 HA THR A 58 11.173 -5.749 -0.355 1.00 0.00 H new ATOM 0 HB THR A 58 9.145 -7.984 -0.042 1.00 0.00 H new ATOM 0 HG1 THR A 58 10.298 -8.963 -1.834 1.00 0.00 H new ATOM 0 HG21 THR A 58 8.580 -7.389 -2.373 1.00 0.00 H new ATOM 0 HG22 THR A 58 8.382 -6.002 -1.277 1.00 0.00 H new ATOM 0 HG23 THR A 58 9.808 -6.101 -2.337 1.00 0.00 H new ATOM 893 N PHE A 59 10.047 -4.554 1.668 1.00 0.00 N ATOM 894 CA PHE A 59 9.181 -3.722 2.493 1.00 0.00 C ATOM 895 C PHE A 59 7.927 -3.326 1.723 1.00 0.00 C ATOM 896 O PHE A 59 8.002 -2.907 0.568 1.00 0.00 O ATOM 897 CB PHE A 59 9.926 -2.474 2.970 1.00 0.00 C ATOM 898 CG PHE A 59 10.872 -1.903 1.952 1.00 0.00 C ATOM 899 CD1 PHE A 59 10.400 -1.140 0.898 1.00 0.00 C ATOM 900 CD2 PHE A 59 12.236 -2.126 2.055 1.00 0.00 C ATOM 901 CE1 PHE A 59 11.271 -0.611 -0.035 1.00 0.00 C ATOM 902 CE2 PHE A 59 13.110 -1.600 1.125 1.00 0.00 C ATOM 903 CZ PHE A 59 12.627 -0.841 0.079 1.00 0.00 C ATOM 0 H PHE A 59 10.999 -4.202 1.565 1.00 0.00 H new ATOM 0 HA PHE A 59 8.884 -4.302 3.367 1.00 0.00 H new ATOM 0 HB2 PHE A 59 9.198 -1.710 3.243 1.00 0.00 H new ATOM 0 HB3 PHE A 59 10.485 -2.719 3.873 1.00 0.00 H new ATOM 0 HD1 PHE A 59 9.340 -0.956 0.804 1.00 0.00 H new ATOM 0 HD2 PHE A 59 12.620 -2.718 2.873 1.00 0.00 H new ATOM 0 HE1 PHE A 59 10.891 -0.018 -0.853 1.00 0.00 H new ATOM 0 HE2 PHE A 59 14.171 -1.782 1.216 1.00 0.00 H new ATOM 0 HZ PHE A 59 13.309 -0.428 -0.649 1.00 0.00 H new ATOM 913 N CYS A 60 6.779 -3.468 2.372 1.00 0.00 N ATOM 914 CA CYS A 60 5.499 -3.138 1.759 1.00 0.00 C ATOM 915 C CYS A 60 5.253 -3.992 0.514 1.00 0.00 C ATOM 916 O CYS A 60 6.113 -4.771 0.103 1.00 0.00 O ATOM 917 CB CYS A 60 5.444 -1.658 1.387 1.00 0.00 C ATOM 918 SG CYS A 60 6.161 -0.530 2.630 1.00 0.00 S ATOM 0 H CYS A 60 6.708 -3.812 3.330 1.00 0.00 H new ATOM 0 HA CYS A 60 4.718 -3.349 2.489 1.00 0.00 H new ATOM 0 HB2 CYS A 60 5.968 -1.515 0.442 1.00 0.00 H new ATOM 0 HB3 CYS A 60 4.404 -1.378 1.220 1.00 0.00 H new ATOM 923 N ILE A 61 4.072 -3.840 -0.081 1.00 0.00 N ATOM 924 CA ILE A 61 3.712 -4.594 -1.281 1.00 0.00 C ATOM 925 C ILE A 61 2.965 -3.728 -2.276 1.00 0.00 C ATOM 926 O ILE A 61 3.180 -3.823 -3.485 1.00 0.00 O ATOM 927 CB ILE A 61 2.819 -5.816 -0.952 1.00 0.00 C ATOM 928 CG1 ILE A 61 1.844 -6.099 -2.105 1.00 0.00 C ATOM 929 CG2 ILE A 61 2.050 -5.578 0.338 1.00 0.00 C ATOM 930 CD1 ILE A 61 1.106 -7.417 -1.986 1.00 0.00 C ATOM 0 H ILE A 61 3.348 -3.202 0.248 1.00 0.00 H new ATOM 0 HA ILE A 61 4.653 -4.935 -1.712 1.00 0.00 H new ATOM 0 HB ILE A 61 3.463 -6.686 -0.821 1.00 0.00 H new ATOM 0 HG12 ILE A 61 1.115 -5.291 -2.156 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.397 -6.089 -3.044 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.427 -6.446 0.556 1.00 0.00 H new ATOM 0 HG22 ILE A 61 2.752 -5.421 1.157 1.00 0.00 H new ATOM 0 HG23 ILE A 61 1.418 -4.696 0.228 1.00 0.00 H new ATOM 0 HD11 ILE A 61 0.439 -7.539 -2.839 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.825 -8.236 -1.968 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.523 -7.425 -1.065 1.00 0.00 H new ATOM 942 N TYR A 62 2.087 -2.890 -1.753 1.00 0.00 N ATOM 943 CA TYR A 62 1.257 -2.038 -2.583 1.00 0.00 C ATOM 944 C TYR A 62 0.263 -2.903 -3.340 1.00 0.00 C ATOM 945 O TYR A 62 0.614 -3.588 -4.301 1.00 0.00 O ATOM 946 CB TYR A 62 2.091 -1.201 -3.554 1.00 0.00 C ATOM 947 CG TYR A 62 1.461 0.135 -3.876 1.00 0.00 C ATOM 948 CD1 TYR A 62 0.085 0.265 -4.019 1.00 0.00 C ATOM 949 CD2 TYR A 62 2.244 1.269 -4.017 1.00 0.00 C ATOM 950 CE1 TYR A 62 -0.492 1.490 -4.291 1.00 0.00 C ATOM 951 CE2 TYR A 62 1.681 2.498 -4.291 1.00 0.00 C ATOM 952 CZ TYR A 62 0.311 2.605 -4.425 1.00 0.00 C ATOM 953 OH TYR A 62 -0.253 3.830 -4.692 1.00 0.00 O ATOM 0 H TYR A 62 1.931 -2.782 -0.751 1.00 0.00 H new ATOM 0 HA TYR A 62 0.725 -1.338 -1.939 1.00 0.00 H new ATOM 0 HB2 TYR A 62 3.080 -1.036 -3.126 1.00 0.00 H new ATOM 0 HB3 TYR A 62 2.233 -1.761 -4.478 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -0.544 -0.607 -3.916 1.00 0.00 H new ATOM 0 HD2 TYR A 62 3.316 1.189 -3.910 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.563 1.575 -4.398 1.00 0.00 H new ATOM 0 HE2 TYR A 62 2.308 3.371 -4.400 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.145 4.416 -3.914 1.00 0.00 H new ATOM 963 N LYS A 63 -0.982 -2.859 -2.890 1.00 0.00 N ATOM 964 CA LYS A 63 -2.041 -3.658 -3.484 1.00 0.00 C ATOM 965 C LYS A 63 -3.403 -3.136 -3.067 1.00 0.00 C ATOM 966 O LYS A 63 -3.849 -3.383 -1.945 1.00 0.00 O ATOM 967 CB LYS A 63 -1.900 -5.119 -3.051 1.00 0.00 C ATOM 968 CG LYS A 63 -1.489 -5.280 -1.594 1.00 0.00 C ATOM 969 CD LYS A 63 -2.039 -6.561 -0.985 1.00 0.00 C ATOM 970 CE LYS A 63 -1.306 -6.945 0.289 1.00 0.00 C ATOM 971 NZ LYS A 63 -1.897 -8.156 0.924 1.00 0.00 N ATOM 0 H LYS A 63 -1.284 -2.274 -2.111 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.955 -3.590 -4.568 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -2.849 -5.631 -3.212 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.161 -5.609 -3.686 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.401 -5.282 -1.522 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.844 -4.424 -1.020 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -3.100 -6.433 -0.769 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -1.957 -7.371 -1.709 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.256 -7.129 0.063 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -1.339 -6.113 0.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -1.191 -8.603 1.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -2.728 -7.882 1.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -2.186 -8.829 0.186 1.00 0.00 H new ATOM 985 N ARG A 64 -4.070 -2.409 -3.956 1.00 0.00 N ATOM 986 CA ARG A 64 -5.385 -1.868 -3.667 1.00 0.00 C ATOM 987 C ARG A 64 -6.463 -2.845 -4.120 1.00 0.00 C ATOM 988 O ARG A 64 -6.159 -3.950 -4.570 1.00 0.00 O ATOM 989 CB ARG A 64 -5.578 -0.516 -4.361 1.00 0.00 C ATOM 990 CG ARG A 64 -5.090 -0.492 -5.799 1.00 0.00 C ATOM 991 CD ARG A 64 -3.697 0.109 -5.900 1.00 0.00 C ATOM 992 NE ARG A 64 -3.701 1.546 -5.639 1.00 0.00 N ATOM 993 CZ ARG A 64 -3.074 2.435 -6.404 1.00 0.00 C ATOM 994 NH1 ARG A 64 -2.398 2.036 -7.472 1.00 0.00 N ATOM 995 NH2 ARG A 64 -3.126 3.726 -6.102 1.00 0.00 N ATOM 0 H ARG A 64 -3.717 -2.182 -4.886 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.468 -1.719 -2.590 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.636 -0.256 -4.342 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -5.050 0.252 -3.795 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -5.081 -1.506 -6.199 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -5.783 0.086 -6.411 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.036 -0.387 -5.189 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.293 -0.078 -6.895 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.213 1.887 -4.825 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -2.358 1.045 -7.709 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -1.918 2.720 -8.057 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -3.647 4.037 -5.282 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -2.645 4.407 -6.689 1.00 0.00 H new ATOM 1009 N CYS A 65 -7.717 -2.434 -4.008 1.00 0.00 N ATOM 1010 CA CYS A 65 -8.835 -3.272 -4.409 1.00 0.00 C ATOM 1011 C CYS A 65 -9.593 -2.594 -5.529 1.00 0.00 C ATOM 1012 O CYS A 65 -9.701 -1.366 -5.551 1.00 0.00 O ATOM 1013 CB CYS A 65 -9.773 -3.520 -3.225 1.00 0.00 C ATOM 1014 SG CYS A 65 -8.921 -3.946 -1.674 1.00 0.00 S ATOM 0 H CYS A 65 -7.986 -1.521 -3.641 1.00 0.00 H new ATOM 0 HA CYS A 65 -8.451 -4.232 -4.753 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -10.377 -2.627 -3.061 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -10.460 -4.327 -3.483 1.00 0.00 H new ATOM 1019 N ARG A 66 -10.114 -3.375 -6.465 1.00 0.00 N ATOM 1020 CA ARG A 66 -10.852 -2.792 -7.569 1.00 0.00 C ATOM 1021 C ARG A 66 -11.947 -1.892 -7.014 1.00 0.00 C ATOM 1022 O ARG A 66 -12.628 -2.253 -6.056 1.00 0.00 O ATOM 1023 CB ARG A 66 -11.445 -3.874 -8.470 1.00 0.00 C ATOM 1024 CG ARG A 66 -12.013 -3.340 -9.770 1.00 0.00 C ATOM 1025 CD ARG A 66 -13.515 -3.511 -9.805 1.00 0.00 C ATOM 1026 NE ARG A 66 -14.055 -3.376 -11.155 1.00 0.00 N ATOM 1027 CZ ARG A 66 -15.323 -3.626 -11.469 1.00 0.00 C ATOM 1028 NH1 ARG A 66 -16.178 -4.006 -10.529 1.00 0.00 N ATOM 1029 NH2 ARG A 66 -15.736 -3.495 -12.722 1.00 0.00 N ATOM 0 H ARG A 66 -10.041 -4.392 -6.481 1.00 0.00 H new ATOM 0 HA ARG A 66 -10.170 -2.201 -8.180 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -10.673 -4.610 -8.696 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -12.233 -4.395 -7.926 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -11.759 -2.286 -9.878 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -11.562 -3.864 -10.613 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -13.777 -4.492 -9.407 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.979 -2.769 -9.154 1.00 0.00 H new ATOM 0 HE ARG A 66 -13.425 -3.073 -11.898 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -15.863 -4.107 -9.564 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -17.150 -4.197 -10.771 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -15.081 -3.202 -13.447 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -16.709 -3.687 -12.961 1.00 0.00 H new ATOM 1043 N HIS A 67 -12.109 -0.727 -7.617 1.00 0.00 N ATOM 1044 CA HIS A 67 -13.109 0.227 -7.159 1.00 0.00 C ATOM 1045 C HIS A 67 -14.477 -0.444 -7.028 1.00 0.00 C ATOM 1046 O HIS A 67 -15.053 -0.881 -8.025 1.00 0.00 O ATOM 1047 CB HIS A 67 -13.190 1.406 -8.132 1.00 0.00 C ATOM 1048 CG HIS A 67 -13.747 2.657 -7.528 1.00 0.00 C ATOM 1049 ND1 HIS A 67 -13.006 3.812 -7.383 1.00 0.00 N ATOM 1050 CD2 HIS A 67 -14.979 2.938 -7.042 1.00 0.00 C ATOM 1051 CE1 HIS A 67 -13.758 4.748 -6.833 1.00 0.00 C ATOM 1052 NE2 HIS A 67 -14.959 4.245 -6.617 1.00 0.00 N ATOM 0 H HIS A 67 -11.564 -0.418 -8.422 1.00 0.00 H new ATOM 0 HA HIS A 67 -12.813 0.595 -6.177 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -12.192 1.614 -8.518 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.808 1.120 -8.983 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -15.820 2.262 -6.997 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -13.444 5.754 -6.600 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -15.745 4.745 -6.202 1.00 0.00 H new ATOM 1061 N PRO A 68 -15.007 -0.546 -5.788 1.00 0.00 N ATOM 1062 CA PRO A 68 -16.313 -1.153 -5.522 1.00 0.00 C ATOM 1063 C PRO A 68 -17.322 -0.848 -6.615 1.00 0.00 C ATOM 1064 O PRO A 68 -18.160 -1.683 -6.958 1.00 0.00 O ATOM 1065 CB PRO A 68 -16.726 -0.476 -4.223 1.00 0.00 C ATOM 1066 CG PRO A 68 -15.444 -0.271 -3.492 1.00 0.00 C ATOM 1067 CD PRO A 68 -14.379 -0.057 -4.543 1.00 0.00 C ATOM 0 HA PRO A 68 -16.268 -2.241 -5.473 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -17.233 0.471 -4.411 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -17.415 -1.098 -3.652 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -15.510 0.590 -2.826 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -15.209 -1.136 -2.872 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -14.101 0.994 -4.622 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -13.470 -0.611 -4.309 1.00 0.00 H new ATOM 1075 N GLY A 69 -17.235 0.357 -7.158 1.00 0.00 N ATOM 1076 CA GLY A 69 -18.154 0.770 -8.190 1.00 0.00 C ATOM 1077 C GLY A 69 -19.135 1.806 -7.687 1.00 0.00 C ATOM 1078 O GLY A 69 -19.034 2.299 -6.563 1.00 0.00 O ATOM 0 H GLY A 69 -16.540 1.057 -6.899 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.595 1.177 -9.033 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.700 -0.098 -8.559 1.00 0.00 H new ATOM 1082 N GLU A 70 -20.085 2.125 -8.549 1.00 0.00 N ATOM 1083 CA GLU A 70 -21.106 3.108 -8.226 1.00 0.00 C ATOM 1084 C GLU A 70 -22.202 2.478 -7.393 1.00 0.00 C ATOM 1085 O GLU A 70 -22.810 1.482 -7.783 1.00 0.00 O ATOM 1086 CB GLU A 70 -21.679 3.751 -9.489 1.00 0.00 C ATOM 1087 CG GLU A 70 -22.619 4.912 -9.207 1.00 0.00 C ATOM 1088 CD GLU A 70 -23.173 5.535 -10.473 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -24.109 4.953 -11.061 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -22.672 6.606 -10.876 1.00 0.00 O ATOM 0 H GLU A 70 -20.171 1.717 -9.480 1.00 0.00 H new ATOM 0 HA GLU A 70 -20.639 3.899 -7.639 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -20.857 4.103 -10.113 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -22.213 2.993 -10.063 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -23.445 4.564 -8.587 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -22.089 5.673 -8.634 1.00 0.00 H new ATOM 1097 N LEU A 71 -22.481 3.114 -6.268 1.00 0.00 N ATOM 1098 CA LEU A 71 -23.505 2.648 -5.360 1.00 0.00 C ATOM 1099 C LEU A 71 -24.804 3.369 -5.688 1.00 0.00 C ATOM 1100 O LEU A 71 -25.031 4.499 -5.256 1.00 0.00 O ATOM 1101 CB LEU A 71 -23.057 2.893 -3.912 1.00 0.00 C ATOM 1102 CG LEU A 71 -24.047 2.470 -2.830 1.00 0.00 C ATOM 1103 CD1 LEU A 71 -24.438 1.008 -2.977 1.00 0.00 C ATOM 1104 CD2 LEU A 71 -23.482 2.744 -1.443 1.00 0.00 C ATOM 0 H LEU A 71 -22.005 3.963 -5.963 1.00 0.00 H new ATOM 0 HA LEU A 71 -23.669 1.576 -5.472 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -22.119 2.363 -3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -22.848 3.956 -3.791 1.00 0.00 H new ATOM 0 HG LEU A 71 -24.950 3.067 -2.955 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -25.144 0.739 -2.191 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -24.902 0.852 -3.951 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -23.548 0.383 -2.895 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -24.205 2.435 -0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -22.556 2.184 -1.310 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -23.280 3.810 -1.337 1.00 0.00 H new ATOM 1116 N ARG A 72 -25.649 2.701 -6.470 1.00 0.00 N ATOM 1117 CA ARG A 72 -26.925 3.282 -6.875 1.00 0.00 C ATOM 1118 C ARG A 72 -27.773 3.566 -5.648 1.00 0.00 C ATOM 1119 O ARG A 72 -28.034 2.683 -4.829 1.00 0.00 O ATOM 1120 CB ARG A 72 -27.663 2.384 -7.869 1.00 0.00 C ATOM 1121 CG ARG A 72 -28.944 2.994 -8.412 1.00 0.00 C ATOM 1122 CD ARG A 72 -29.574 2.113 -9.478 1.00 0.00 C ATOM 1123 NE ARG A 72 -29.984 0.816 -8.945 1.00 0.00 N ATOM 1124 CZ ARG A 72 -30.483 -0.164 -9.692 1.00 0.00 C ATOM 1125 NH1 ARG A 72 -30.628 0.000 -11.000 1.00 0.00 N ATOM 1126 NH2 ARG A 72 -30.837 -1.313 -9.130 1.00 0.00 N ATOM 0 H ARG A 72 -25.475 1.764 -6.833 1.00 0.00 H new ATOM 0 HA ARG A 72 -26.728 4.223 -7.389 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -26.998 2.157 -8.702 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -27.900 1.438 -7.383 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -29.652 3.142 -7.596 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -28.731 3.977 -8.831 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -30.440 2.621 -9.902 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -28.863 1.963 -10.290 1.00 0.00 H new ATOM 0 HE ARG A 72 -29.882 0.653 -7.943 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -30.356 0.881 -11.437 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -31.011 -0.755 -11.569 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -30.726 -1.444 -8.125 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -31.220 -2.065 -9.703 1.00 0.00 H new ATOM 1140 N ASN A 73 -28.196 4.824 -5.540 1.00 0.00 N ATOM 1141 CA ASN A 73 -28.952 5.280 -4.392 1.00 0.00 C ATOM 1142 C ASN A 73 -28.062 5.097 -3.180 1.00 0.00 C ATOM 1143 O ASN A 73 -28.507 4.637 -2.131 1.00 0.00 O ATOM 1144 CB ASN A 73 -30.263 4.502 -4.242 1.00 0.00 C ATOM 1145 CG ASN A 73 -31.208 4.735 -5.406 1.00 0.00 C ATOM 1146 OD1 ASN A 73 -31.205 5.802 -6.019 1.00 0.00 O ATOM 1147 ND2 ASN A 73 -32.023 3.733 -5.717 1.00 0.00 N ATOM 0 H ASN A 73 -28.023 5.544 -6.242 1.00 0.00 H new ATOM 0 HA ASN A 73 -29.233 6.327 -4.509 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -30.044 3.437 -4.163 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -30.753 4.797 -3.314 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -32.680 3.831 -6.491 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -31.992 2.865 -5.182 1.00 0.00 H new ATOM 1154 N GLY A 74 -26.802 5.496 -3.331 1.00 0.00 N ATOM 1155 CA GLY A 74 -25.857 5.339 -2.253 1.00 0.00 C ATOM 1156 C GLY A 74 -24.557 6.082 -2.504 1.00 0.00 C ATOM 1157 O GLY A 74 -24.363 6.667 -3.570 1.00 0.00 O ATOM 0 H GLY A 74 -26.426 5.922 -4.178 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -26.305 5.700 -1.327 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -25.644 4.279 -2.113 1.00 0.00 H new ATOM 1161 N GLN A 75 -23.668 6.058 -1.516 1.00 0.00 N ATOM 1162 CA GLN A 75 -22.384 6.740 -1.632 1.00 0.00 C ATOM 1163 C GLN A 75 -21.240 5.833 -1.185 1.00 0.00 C ATOM 1164 O GLN A 75 -21.330 5.161 -0.160 1.00 0.00 O ATOM 1165 CB GLN A 75 -22.390 8.026 -0.802 1.00 0.00 C ATOM 1166 CG GLN A 75 -21.158 8.893 -1.011 1.00 0.00 C ATOM 1167 CD GLN A 75 -21.230 10.205 -0.253 1.00 0.00 C ATOM 1168 OE1 GLN A 75 -20.208 10.752 0.162 1.00 0.00 O ATOM 1169 NE2 GLN A 75 -22.441 10.722 -0.072 1.00 0.00 N ATOM 0 H GLN A 75 -23.812 5.575 -0.629 1.00 0.00 H new ATOM 0 HA GLN A 75 -22.229 6.994 -2.681 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -23.278 8.606 -1.053 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -22.466 7.766 0.254 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -20.273 8.342 -0.693 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -21.040 9.099 -2.075 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -23.262 10.236 -0.432 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -22.549 11.605 0.427 1.00 0.00 H new ATOM 1178 N VAL A 76 -20.164 5.823 -1.967 1.00 0.00 N ATOM 1179 CA VAL A 76 -19.002 5.001 -1.642 1.00 0.00 C ATOM 1180 C VAL A 76 -17.858 5.865 -1.131 1.00 0.00 C ATOM 1181 O VAL A 76 -17.230 6.591 -1.901 1.00 0.00 O ATOM 1182 CB VAL A 76 -18.507 4.187 -2.851 1.00 0.00 C ATOM 1183 CG1 VAL A 76 -17.385 3.249 -2.427 1.00 0.00 C ATOM 1184 CG2 VAL A 76 -19.654 3.410 -3.479 1.00 0.00 C ATOM 0 H VAL A 76 -20.072 6.370 -2.823 1.00 0.00 H new ATOM 0 HA VAL A 76 -19.322 4.306 -0.866 1.00 0.00 H new ATOM 0 HB VAL A 76 -18.117 4.876 -3.601 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -17.042 2.678 -3.290 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -16.556 3.832 -2.025 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -17.752 2.565 -1.662 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -19.284 2.841 -4.332 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -20.077 2.727 -2.743 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -20.424 4.105 -3.813 1.00 0.00 H new ATOM 1194 N GLU A 77 -17.587 5.790 0.166 1.00 0.00 N ATOM 1195 CA GLU A 77 -16.501 6.567 0.745 1.00 0.00 C ATOM 1196 C GLU A 77 -15.156 5.956 0.372 1.00 0.00 C ATOM 1197 O GLU A 77 -14.709 4.988 0.988 1.00 0.00 O ATOM 1198 CB GLU A 77 -16.631 6.640 2.264 1.00 0.00 C ATOM 1199 CG GLU A 77 -15.489 7.393 2.928 1.00 0.00 C ATOM 1200 CD GLU A 77 -15.463 8.862 2.554 1.00 0.00 C ATOM 1201 OE1 GLU A 77 -16.220 9.645 3.166 1.00 0.00 O ATOM 1202 OE2 GLU A 77 -14.687 9.230 1.646 1.00 0.00 O ATOM 0 H GLU A 77 -18.097 5.207 0.829 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.560 7.578 0.343 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.574 7.125 2.519 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -16.674 5.628 2.667 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -15.578 7.299 4.010 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.542 6.933 2.645 1.00 0.00 H new ATOM 1209 N ILE A 78 -14.518 6.524 -0.643 1.00 0.00 N ATOM 1210 CA ILE A 78 -13.223 6.037 -1.098 1.00 0.00 C ATOM 1211 C ILE A 78 -12.121 7.016 -0.718 1.00 0.00 C ATOM 1212 O ILE A 78 -11.846 7.977 -1.438 1.00 0.00 O ATOM 1213 CB ILE A 78 -13.205 5.800 -2.622 1.00 0.00 C ATOM 1214 CG1 ILE A 78 -14.244 4.742 -3.008 1.00 0.00 C ATOM 1215 CG2 ILE A 78 -11.814 5.380 -3.080 1.00 0.00 C ATOM 1216 CD1 ILE A 78 -13.968 3.370 -2.428 1.00 0.00 C ATOM 0 H ILE A 78 -14.876 7.323 -1.167 1.00 0.00 H new ATOM 0 HA ILE A 78 -13.045 5.082 -0.604 1.00 0.00 H new ATOM 0 HB ILE A 78 -13.462 6.734 -3.122 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -15.227 5.075 -2.676 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -14.283 4.665 -4.095 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -11.820 5.217 -4.158 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -11.098 6.165 -2.835 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -11.528 4.457 -2.575 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -14.747 2.677 -2.746 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -13.000 3.014 -2.780 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.959 3.430 -1.340 1.00 0.00 H new ATOM 1228 N LYS A 79 -11.506 6.763 0.427 1.00 0.00 N ATOM 1229 CA LYS A 79 -10.440 7.613 0.938 1.00 0.00 C ATOM 1230 C LYS A 79 -9.216 6.788 1.277 1.00 0.00 C ATOM 1231 O LYS A 79 -8.364 7.205 2.063 1.00 0.00 O ATOM 1232 CB LYS A 79 -10.928 8.345 2.184 1.00 0.00 C ATOM 1233 CG LYS A 79 -12.037 7.603 2.917 1.00 0.00 C ATOM 1234 CD LYS A 79 -11.559 6.306 3.530 1.00 0.00 C ATOM 1235 CE LYS A 79 -12.714 5.568 4.180 1.00 0.00 C ATOM 1236 NZ LYS A 79 -13.234 6.285 5.377 1.00 0.00 N ATOM 0 H LYS A 79 -11.729 5.968 1.026 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.168 8.336 0.169 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -10.088 8.494 2.863 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -11.287 9.334 1.900 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -12.442 8.244 3.700 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.851 7.395 2.223 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -11.106 5.679 2.762 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -10.787 6.510 4.272 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -13.518 5.444 3.455 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -12.388 4.569 4.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -14.268 6.373 5.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.989 5.751 6.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.809 7.233 5.426 1.00 0.00 H new ATOM 1250 N THR A 80 -9.133 5.619 0.671 1.00 0.00 N ATOM 1251 CA THR A 80 -8.022 4.721 0.911 1.00 0.00 C ATOM 1252 C THR A 80 -7.584 4.059 -0.380 1.00 0.00 C ATOM 1253 O THR A 80 -6.684 3.218 -0.379 1.00 0.00 O ATOM 1254 CB THR A 80 -8.407 3.629 1.924 1.00 0.00 C ATOM 1255 OG1 THR A 80 -9.230 2.641 1.290 1.00 0.00 O ATOM 1256 CG2 THR A 80 -9.157 4.227 3.105 1.00 0.00 C ATOM 0 H THR A 80 -9.824 5.269 0.007 1.00 0.00 H new ATOM 0 HA THR A 80 -7.202 5.314 1.315 1.00 0.00 H new ATOM 0 HB THR A 80 -7.490 3.165 2.288 1.00 0.00 H new ATOM 0 HG1 THR A 80 -9.943 2.366 1.904 1.00 0.00 H new ATOM 0 HG21 THR A 80 -9.419 3.436 3.808 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.524 4.961 3.604 1.00 0.00 H new ATOM 0 HG23 THR A 80 -10.066 4.713 2.750 1.00 0.00 H new ATOM 1264 N ASP A 81 -8.226 4.438 -1.486 1.00 0.00 N ATOM 1265 CA ASP A 81 -7.900 3.849 -2.781 1.00 0.00 C ATOM 1266 C ASP A 81 -8.120 2.344 -2.730 1.00 0.00 C ATOM 1267 O ASP A 81 -7.758 1.609 -3.649 1.00 0.00 O ATOM 1268 CB ASP A 81 -6.443 4.130 -3.122 1.00 0.00 C ATOM 1269 CG ASP A 81 -6.173 5.605 -3.345 1.00 0.00 C ATOM 1270 OD1 ASP A 81 -5.858 6.306 -2.360 1.00 0.00 O ATOM 1271 OD2 ASP A 81 -6.276 6.059 -4.505 1.00 0.00 O ATOM 0 H ASP A 81 -8.965 5.141 -1.510 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.544 4.287 -3.543 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -5.808 3.766 -2.315 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -6.169 3.574 -4.019 1.00 0.00 H new ATOM 1276 N LEU A 82 -8.718 1.914 -1.627 1.00 0.00 N ATOM 1277 CA LEU A 82 -8.998 0.509 -1.380 1.00 0.00 C ATOM 1278 C LEU A 82 -7.684 -0.247 -1.196 1.00 0.00 C ATOM 1279 O LEU A 82 -7.455 -1.264 -1.841 1.00 0.00 O ATOM 1280 CB LEU A 82 -9.786 -0.098 -2.546 1.00 0.00 C ATOM 1281 CG LEU A 82 -11.171 0.502 -2.820 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -11.923 0.749 -1.524 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -11.054 1.790 -3.620 1.00 0.00 C ATOM 0 H LEU A 82 -9.023 2.534 -0.876 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.600 0.425 -0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.186 -0.000 -3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -9.907 -1.165 -2.358 1.00 0.00 H new ATOM 0 HG LEU A 82 -11.736 -0.219 -3.410 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.902 1.175 -1.747 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -12.050 -0.194 -0.992 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -11.358 1.444 -0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -12.049 2.197 -3.802 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.463 2.514 -3.059 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.567 1.584 -4.573 1.00 0.00 H new ATOM 1295 N SER A 83 -6.842 0.227 -0.293 1.00 0.00 N ATOM 1296 CA SER A 83 -5.564 -0.433 -0.043 1.00 0.00 C ATOM 1297 C SER A 83 -5.676 -1.433 1.106 1.00 0.00 C ATOM 1298 O SER A 83 -6.215 -1.107 2.164 1.00 0.00 O ATOM 1299 CB SER A 83 -4.482 0.603 0.265 1.00 0.00 C ATOM 1300 OG SER A 83 -4.345 1.529 -0.799 1.00 0.00 O ATOM 0 H SER A 83 -7.014 1.056 0.275 1.00 0.00 H new ATOM 0 HA SER A 83 -5.286 -0.980 -0.944 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.733 1.134 1.183 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.531 0.100 0.438 1.00 0.00 H new ATOM 0 HG SER A 83 -5.078 2.178 -0.764 1.00 0.00 H new ATOM 1306 N PHE A 84 -5.183 -2.659 0.873 1.00 0.00 N ATOM 1307 CA PHE A 84 -5.199 -3.721 1.887 1.00 0.00 C ATOM 1308 C PHE A 84 -5.176 -3.121 3.291 1.00 0.00 C ATOM 1309 O PHE A 84 -4.347 -2.260 3.587 1.00 0.00 O ATOM 1310 CB PHE A 84 -3.984 -4.635 1.694 1.00 0.00 C ATOM 1311 CG PHE A 84 -3.866 -5.718 2.728 1.00 0.00 C ATOM 1312 CD1 PHE A 84 -4.534 -6.921 2.569 1.00 0.00 C ATOM 1313 CD2 PHE A 84 -3.083 -5.534 3.856 1.00 0.00 C ATOM 1314 CE1 PHE A 84 -4.426 -7.920 3.517 1.00 0.00 C ATOM 1315 CE2 PHE A 84 -2.970 -6.529 4.808 1.00 0.00 C ATOM 1316 CZ PHE A 84 -3.643 -7.724 4.639 1.00 0.00 C ATOM 0 H PHE A 84 -4.766 -2.939 -0.015 1.00 0.00 H new ATOM 0 HA PHE A 84 -6.114 -4.302 1.772 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -4.040 -5.094 0.707 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -3.079 -4.028 1.713 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -5.146 -7.080 1.694 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -2.555 -4.602 3.993 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -4.953 -8.853 3.382 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.357 -6.373 5.683 1.00 0.00 H new ATOM 0 HZ PHE A 84 -3.557 -8.503 5.382 1.00 0.00 H new ATOM 1326 N GLY A 85 -6.076 -3.576 4.157 1.00 0.00 N ATOM 1327 CA GLY A 85 -6.136 -3.059 5.511 1.00 0.00 C ATOM 1328 C GLY A 85 -6.854 -1.721 5.602 1.00 0.00 C ATOM 1329 O GLY A 85 -6.421 -0.834 6.339 1.00 0.00 O ATOM 0 H GLY A 85 -6.767 -4.296 3.944 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.644 -3.782 6.149 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.123 -2.949 5.898 1.00 0.00 H new ATOM 1333 N SER A 86 -7.952 -1.567 4.858 1.00 0.00 N ATOM 1334 CA SER A 86 -8.714 -0.317 4.881 1.00 0.00 C ATOM 1335 C SER A 86 -10.219 -0.562 4.852 1.00 0.00 C ATOM 1336 O SER A 86 -10.696 -1.560 4.316 1.00 0.00 O ATOM 1337 CB SER A 86 -8.328 0.588 3.713 1.00 0.00 C ATOM 1338 OG SER A 86 -6.965 0.967 3.786 1.00 0.00 O ATOM 0 H SER A 86 -8.330 -2.284 4.239 1.00 0.00 H new ATOM 0 HA SER A 86 -8.463 0.178 5.819 1.00 0.00 H new ATOM 0 HB2 SER A 86 -8.514 0.071 2.772 1.00 0.00 H new ATOM 0 HB3 SER A 86 -8.956 1.479 3.717 1.00 0.00 H new ATOM 0 HG SER A 86 -6.422 0.337 3.268 1.00 0.00 H new ATOM 1344 N GLN A 87 -10.948 0.378 5.437 1.00 0.00 N ATOM 1345 CA GLN A 87 -12.403 0.298 5.497 1.00 0.00 C ATOM 1346 C GLN A 87 -13.042 1.457 4.731 1.00 0.00 C ATOM 1347 O GLN A 87 -12.591 2.598 4.830 1.00 0.00 O ATOM 1348 CB GLN A 87 -12.864 0.284 6.962 1.00 0.00 C ATOM 1349 CG GLN A 87 -14.230 0.911 7.205 1.00 0.00 C ATOM 1350 CD GLN A 87 -14.138 2.397 7.488 1.00 0.00 C ATOM 1351 OE1 GLN A 87 -13.946 2.813 8.631 1.00 0.00 O ATOM 1352 NE2 GLN A 87 -14.292 3.206 6.450 1.00 0.00 N ATOM 0 H GLN A 87 -10.555 1.209 5.879 1.00 0.00 H new ATOM 0 HA GLN A 87 -12.725 -0.629 5.022 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -12.886 -0.748 7.312 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -12.125 0.810 7.566 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -14.863 0.748 6.332 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -14.712 0.412 8.046 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -14.449 2.818 5.520 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -14.253 4.217 6.581 1.00 0.00 H new ATOM 1361 N ILE A 88 -14.069 1.149 3.938 1.00 0.00 N ATOM 1362 CA ILE A 88 -14.787 2.165 3.170 1.00 0.00 C ATOM 1363 C ILE A 88 -16.277 2.129 3.500 1.00 0.00 C ATOM 1364 O ILE A 88 -16.968 1.152 3.211 1.00 0.00 O ATOM 1365 CB ILE A 88 -14.594 1.993 1.649 1.00 0.00 C ATOM 1366 CG1 ILE A 88 -15.042 0.605 1.194 1.00 0.00 C ATOM 1367 CG2 ILE A 88 -13.141 2.237 1.272 1.00 0.00 C ATOM 1368 CD1 ILE A 88 -15.242 0.499 -0.300 1.00 0.00 C ATOM 0 H ILE A 88 -14.423 0.201 3.811 1.00 0.00 H new ATOM 0 HA ILE A 88 -14.368 3.130 3.454 1.00 0.00 H new ATOM 0 HB ILE A 88 -15.215 2.730 1.140 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -14.299 -0.129 1.507 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -15.975 0.349 1.697 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -13.018 2.112 0.196 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -12.857 3.251 1.555 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -12.505 1.523 1.795 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -15.560 -0.512 -0.554 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -16.006 1.209 -0.616 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -14.305 0.724 -0.809 1.00 0.00 H new ATOM 1380 N GLU A 89 -16.764 3.196 4.121 1.00 0.00 N ATOM 1381 CA GLU A 89 -18.164 3.285 4.501 1.00 0.00 C ATOM 1382 C GLU A 89 -19.042 3.658 3.313 1.00 0.00 C ATOM 1383 O GLU A 89 -18.566 4.212 2.323 1.00 0.00 O ATOM 1384 CB GLU A 89 -18.333 4.312 5.618 1.00 0.00 C ATOM 1385 CG GLU A 89 -18.137 3.733 7.009 1.00 0.00 C ATOM 1386 CD GLU A 89 -18.242 4.783 8.098 1.00 0.00 C ATOM 1387 OE1 GLU A 89 -19.369 5.039 8.570 1.00 0.00 O ATOM 1388 OE2 GLU A 89 -17.196 5.350 8.479 1.00 0.00 O ATOM 0 H GLU A 89 -16.207 4.013 4.372 1.00 0.00 H new ATOM 0 HA GLU A 89 -18.481 2.304 4.856 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -17.620 5.122 5.467 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -19.330 4.748 5.552 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -18.883 2.958 7.184 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -17.160 3.254 7.065 1.00 0.00 H new ATOM 1395 N PHE A 90 -20.327 3.344 3.424 1.00 0.00 N ATOM 1396 CA PHE A 90 -21.289 3.644 2.371 1.00 0.00 C ATOM 1397 C PHE A 90 -22.373 4.573 2.897 1.00 0.00 C ATOM 1398 O PHE A 90 -22.378 4.929 4.076 1.00 0.00 O ATOM 1399 CB PHE A 90 -21.908 2.353 1.842 1.00 0.00 C ATOM 1400 CG PHE A 90 -20.884 1.374 1.348 1.00 0.00 C ATOM 1401 CD1 PHE A 90 -20.392 1.453 0.054 1.00 0.00 C ATOM 1402 CD2 PHE A 90 -20.412 0.375 2.181 1.00 0.00 C ATOM 1403 CE1 PHE A 90 -19.448 0.553 -0.398 1.00 0.00 C ATOM 1404 CE2 PHE A 90 -19.468 -0.527 1.734 1.00 0.00 C ATOM 1405 CZ PHE A 90 -18.986 -0.439 0.443 1.00 0.00 C ATOM 0 H PHE A 90 -20.729 2.879 4.238 1.00 0.00 H new ATOM 0 HA PHE A 90 -20.770 4.144 1.553 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -22.496 1.888 2.633 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -22.596 2.592 1.031 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -20.751 2.227 -0.608 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -20.786 0.300 3.191 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -19.072 0.625 -1.408 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -19.106 -1.302 2.394 1.00 0.00 H new ATOM 0 HZ PHE A 90 -18.248 -1.145 0.092 1.00 0.00 H new ATOM 1415 N SER A 91 -23.290 4.963 2.023 1.00 0.00 N ATOM 1416 CA SER A 91 -24.367 5.858 2.419 1.00 0.00 C ATOM 1417 C SER A 91 -25.547 5.772 1.465 1.00 0.00 C ATOM 1418 O SER A 91 -25.493 6.276 0.347 1.00 0.00 O ATOM 1419 CB SER A 91 -23.871 7.300 2.485 1.00 0.00 C ATOM 1420 OG SER A 91 -22.749 7.421 3.343 1.00 0.00 O ATOM 0 H SER A 91 -23.310 4.677 1.044 1.00 0.00 H new ATOM 0 HA SER A 91 -24.700 5.543 3.408 1.00 0.00 H new ATOM 0 HB2 SER A 91 -23.605 7.641 1.485 1.00 0.00 H new ATOM 0 HB3 SER A 91 -24.674 7.947 2.839 1.00 0.00 H new ATOM 0 HG SER A 91 -22.735 6.669 3.971 1.00 0.00 H new ATOM 1426 N CYS A 92 -26.620 5.157 1.934 1.00 0.00 N ATOM 1427 CA CYS A 92 -27.815 5.030 1.109 1.00 0.00 C ATOM 1428 C CYS A 92 -28.594 6.337 1.176 1.00 0.00 C ATOM 1429 O CYS A 92 -29.022 6.759 2.250 1.00 0.00 O ATOM 1430 CB CYS A 92 -28.685 3.850 1.556 1.00 0.00 C ATOM 1431 SG CYS A 92 -27.998 2.209 1.147 1.00 0.00 S ATOM 0 H CYS A 92 -26.691 4.744 2.864 1.00 0.00 H new ATOM 0 HA CYS A 92 -27.519 4.830 0.079 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -28.832 3.910 2.634 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -29.668 3.944 1.095 1.00 0.00 H new ATOM 1436 N SER A 93 -28.764 6.978 0.022 1.00 0.00 N ATOM 1437 CA SER A 93 -29.463 8.263 -0.051 1.00 0.00 C ATOM 1438 C SER A 93 -30.782 8.254 0.712 1.00 0.00 C ATOM 1439 O SER A 93 -31.293 7.201 1.092 1.00 0.00 O ATOM 1440 CB SER A 93 -29.730 8.645 -1.507 1.00 0.00 C ATOM 1441 OG SER A 93 -30.298 7.563 -2.225 1.00 0.00 O ATOM 0 H SER A 93 -28.428 6.630 -0.876 1.00 0.00 H new ATOM 0 HA SER A 93 -28.809 8.999 0.416 1.00 0.00 H new ATOM 0 HB2 SER A 93 -30.403 9.502 -1.543 1.00 0.00 H new ATOM 0 HB3 SER A 93 -28.798 8.951 -1.982 1.00 0.00 H new ATOM 0 HG SER A 93 -30.460 7.835 -3.152 1.00 0.00 H new ATOM 1447 N GLU A 94 -31.324 9.452 0.922 1.00 0.00 N ATOM 1448 CA GLU A 94 -32.589 9.628 1.625 1.00 0.00 C ATOM 1449 C GLU A 94 -33.619 8.608 1.148 1.00 0.00 C ATOM 1450 O GLU A 94 -33.595 8.173 -0.003 1.00 0.00 O ATOM 1451 CB GLU A 94 -33.106 11.050 1.397 1.00 0.00 C ATOM 1452 CG GLU A 94 -34.550 11.257 1.821 1.00 0.00 C ATOM 1453 CD GLU A 94 -34.729 11.238 3.326 1.00 0.00 C ATOM 1454 OE1 GLU A 94 -34.406 12.255 3.975 1.00 0.00 O ATOM 1455 OE2 GLU A 94 -35.193 10.207 3.856 1.00 0.00 O ATOM 0 H GLU A 94 -30.898 10.325 0.610 1.00 0.00 H new ATOM 0 HA GLU A 94 -32.425 9.470 2.691 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -32.473 11.748 1.945 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -33.010 11.296 0.339 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -34.906 12.210 1.429 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -35.170 10.478 1.376 1.00 0.00 H new ATOM 1462 N GLY A 95 -34.529 8.240 2.045 1.00 0.00 N ATOM 1463 CA GLY A 95 -35.561 7.277 1.713 1.00 0.00 C ATOM 1464 C GLY A 95 -35.044 5.853 1.673 1.00 0.00 C ATOM 1465 O GLY A 95 -35.761 4.923 2.035 1.00 0.00 O ATOM 0 H GLY A 95 -34.569 8.594 3.001 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -36.365 7.346 2.445 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -35.990 7.530 0.743 1.00 0.00 H new ATOM 1469 N PHE A 96 -33.800 5.672 1.244 1.00 0.00 N ATOM 1470 CA PHE A 96 -33.223 4.335 1.147 1.00 0.00 C ATOM 1471 C PHE A 96 -32.156 4.150 2.221 1.00 0.00 C ATOM 1472 O PHE A 96 -31.264 4.984 2.370 1.00 0.00 O ATOM 1473 CB PHE A 96 -32.610 4.110 -0.236 1.00 0.00 C ATOM 1474 CG PHE A 96 -33.447 4.639 -1.367 1.00 0.00 C ATOM 1475 CD1 PHE A 96 -34.550 3.934 -1.819 1.00 0.00 C ATOM 1476 CD2 PHE A 96 -33.128 5.841 -1.977 1.00 0.00 C ATOM 1477 CE1 PHE A 96 -35.320 4.417 -2.859 1.00 0.00 C ATOM 1478 CE2 PHE A 96 -33.894 6.330 -3.018 1.00 0.00 C ATOM 1479 CZ PHE A 96 -34.992 5.618 -3.459 1.00 0.00 C ATOM 0 H PHE A 96 -33.176 6.427 0.960 1.00 0.00 H new ATOM 0 HA PHE A 96 -34.018 3.605 1.298 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -31.630 4.585 -0.270 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -32.452 3.042 -0.383 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -34.811 2.995 -1.353 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -32.271 6.402 -1.635 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -36.177 3.857 -3.203 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -33.634 7.268 -3.486 1.00 0.00 H new ATOM 0 HZ PHE A 96 -35.593 5.999 -4.271 1.00 0.00 H new ATOM 1489 N PHE A 97 -32.255 3.060 2.976 1.00 0.00 N ATOM 1490 CA PHE A 97 -31.290 2.785 4.035 1.00 0.00 C ATOM 1491 C PHE A 97 -30.243 1.778 3.579 1.00 0.00 C ATOM 1492 O PHE A 97 -30.379 1.130 2.542 1.00 0.00 O ATOM 1493 CB PHE A 97 -31.997 2.295 5.306 1.00 0.00 C ATOM 1494 CG PHE A 97 -32.719 0.985 5.157 1.00 0.00 C ATOM 1495 CD1 PHE A 97 -33.874 0.894 4.397 1.00 0.00 C ATOM 1496 CD2 PHE A 97 -32.250 -0.154 5.794 1.00 0.00 C ATOM 1497 CE1 PHE A 97 -34.547 -0.307 4.273 1.00 0.00 C ATOM 1498 CE2 PHE A 97 -32.918 -1.357 5.673 1.00 0.00 C ATOM 1499 CZ PHE A 97 -34.068 -1.434 4.912 1.00 0.00 C ATOM 0 H PHE A 97 -32.988 2.358 2.876 1.00 0.00 H new ATOM 0 HA PHE A 97 -30.778 3.719 4.267 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -31.259 2.199 6.102 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -32.712 3.054 5.624 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -34.253 1.772 3.895 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -31.352 -0.100 6.392 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -35.446 -0.364 3.677 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -32.541 -2.237 6.173 1.00 0.00 H new ATOM 0 HZ PHE A 97 -34.592 -2.374 4.817 1.00 0.00 H new ATOM 1509 N LEU A 98 -29.200 1.667 4.392 1.00 0.00 N ATOM 1510 CA LEU A 98 -28.088 0.767 4.114 1.00 0.00 C ATOM 1511 C LEU A 98 -28.399 -0.645 4.590 1.00 0.00 C ATOM 1512 O LEU A 98 -28.927 -0.843 5.685 1.00 0.00 O ATOM 1513 CB LEU A 98 -26.821 1.290 4.808 1.00 0.00 C ATOM 1514 CG LEU A 98 -25.487 0.703 4.323 1.00 0.00 C ATOM 1515 CD1 LEU A 98 -25.356 -0.760 4.715 1.00 0.00 C ATOM 1516 CD2 LEU A 98 -25.332 0.872 2.821 1.00 0.00 C ATOM 0 H LEU A 98 -29.101 2.196 5.259 1.00 0.00 H new ATOM 0 HA LEU A 98 -27.927 0.733 3.036 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -26.784 2.372 4.682 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -26.912 1.096 5.877 1.00 0.00 H new ATOM 0 HG LEU A 98 -24.685 1.256 4.812 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -24.402 -1.148 4.358 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -25.402 -0.851 5.800 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -26.170 -1.331 4.268 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -24.379 0.448 2.504 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -26.146 0.357 2.311 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -25.359 1.932 2.569 1.00 0.00 H new ATOM 1528 N ILE A 99 -28.064 -1.626 3.758 1.00 0.00 N ATOM 1529 CA ILE A 99 -28.266 -3.038 4.061 1.00 0.00 C ATOM 1530 C ILE A 99 -27.288 -3.861 3.245 1.00 0.00 C ATOM 1531 O ILE A 99 -27.531 -4.204 2.088 1.00 0.00 O ATOM 1532 CB ILE A 99 -29.688 -3.509 3.702 1.00 0.00 C ATOM 1533 CG1 ILE A 99 -30.586 -2.309 3.426 1.00 0.00 C ATOM 1534 CG2 ILE A 99 -30.262 -4.368 4.817 1.00 0.00 C ATOM 1535 CD1 ILE A 99 -31.859 -2.652 2.684 1.00 0.00 C ATOM 0 H ILE A 99 -27.640 -1.461 2.845 1.00 0.00 H new ATOM 0 HA ILE A 99 -28.113 -3.169 5.132 1.00 0.00 H new ATOM 0 HB ILE A 99 -29.638 -4.116 2.798 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -30.846 -1.837 4.373 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -30.026 -1.575 2.847 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -31.267 -4.692 4.546 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -29.627 -5.241 4.967 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -30.304 -3.788 5.739 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -32.443 -1.746 2.526 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -31.610 -3.096 1.720 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -32.442 -3.362 3.271 1.00 0.00 H new ATOM 1547 N GLY A 100 -26.171 -4.159 3.887 1.00 0.00 N ATOM 1548 CA GLY A 100 -25.106 -4.915 3.267 1.00 0.00 C ATOM 1549 C GLY A 100 -23.769 -4.551 3.868 1.00 0.00 C ATOM 1550 O GLY A 100 -22.785 -4.360 3.153 1.00 0.00 O ATOM 0 H GLY A 100 -25.981 -3.883 4.850 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -25.289 -5.982 3.395 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -25.093 -4.721 2.195 1.00 0.00 H new ATOM 1554 N SER A 101 -23.748 -4.454 5.191 1.00 0.00 N ATOM 1555 CA SER A 101 -22.546 -4.083 5.920 1.00 0.00 C ATOM 1556 C SER A 101 -22.144 -2.656 5.569 1.00 0.00 C ATOM 1557 O SER A 101 -21.604 -2.401 4.493 1.00 0.00 O ATOM 1558 CB SER A 101 -21.406 -5.051 5.602 1.00 0.00 C ATOM 1559 OG SER A 101 -21.600 -6.298 6.246 1.00 0.00 O ATOM 0 H SER A 101 -24.559 -4.629 5.784 1.00 0.00 H new ATOM 0 HA SER A 101 -22.754 -4.138 6.989 1.00 0.00 H new ATOM 0 HB2 SER A 101 -21.342 -5.201 4.524 1.00 0.00 H new ATOM 0 HB3 SER A 101 -20.458 -4.618 5.920 1.00 0.00 H new ATOM 0 HG SER A 101 -20.858 -6.899 6.025 1.00 0.00 H new ATOM 1565 N THR A 102 -22.409 -1.725 6.483 1.00 0.00 N ATOM 1566 CA THR A 102 -22.083 -0.323 6.259 1.00 0.00 C ATOM 1567 C THR A 102 -20.583 -0.132 6.149 1.00 0.00 C ATOM 1568 O THR A 102 -20.104 0.966 5.868 1.00 0.00 O ATOM 1569 CB THR A 102 -22.622 0.574 7.390 1.00 0.00 C ATOM 1570 OG1 THR A 102 -21.925 0.293 8.611 1.00 0.00 O ATOM 1571 CG2 THR A 102 -24.112 0.354 7.596 1.00 0.00 C ATOM 0 H THR A 102 -22.848 -1.918 7.383 1.00 0.00 H new ATOM 0 HA THR A 102 -22.560 -0.031 5.323 1.00 0.00 H new ATOM 0 HB THR A 102 -22.460 1.613 7.105 1.00 0.00 H new ATOM 0 HG1 THR A 102 -22.271 0.868 9.325 1.00 0.00 H new ATOM 0 HG21 THR A 102 -24.467 0.999 8.400 1.00 0.00 H new ATOM 0 HG22 THR A 102 -24.646 0.593 6.676 1.00 0.00 H new ATOM 0 HG23 THR A 102 -24.293 -0.688 7.860 1.00 0.00 H new ATOM 1579 N THR A 103 -19.847 -1.205 6.370 1.00 0.00 N ATOM 1580 CA THR A 103 -18.408 -1.161 6.278 1.00 0.00 C ATOM 1581 C THR A 103 -17.928 -2.114 5.199 1.00 0.00 C ATOM 1582 O THR A 103 -18.622 -3.066 4.843 1.00 0.00 O ATOM 1583 CB THR A 103 -17.754 -1.513 7.615 1.00 0.00 C ATOM 1584 OG1 THR A 103 -18.264 -2.758 8.105 1.00 0.00 O ATOM 1585 CG2 THR A 103 -18.003 -0.413 8.634 1.00 0.00 C ATOM 0 H THR A 103 -20.228 -2.119 6.615 1.00 0.00 H new ATOM 0 HA THR A 103 -18.118 -0.143 6.018 1.00 0.00 H new ATOM 0 HB THR A 103 -16.680 -1.609 7.458 1.00 0.00 H new ATOM 0 HG1 THR A 103 -17.836 -2.973 8.960 1.00 0.00 H new ATOM 0 HG21 THR A 103 -17.531 -0.679 9.580 1.00 0.00 H new ATOM 0 HG22 THR A 103 -17.581 0.523 8.269 1.00 0.00 H new ATOM 0 HG23 THR A 103 -19.076 -0.293 8.785 1.00 0.00 H new ATOM 1593 N SER A 104 -16.739 -1.856 4.680 1.00 0.00 N ATOM 1594 CA SER A 104 -16.137 -2.713 3.675 1.00 0.00 C ATOM 1595 C SER A 104 -14.629 -2.664 3.831 1.00 0.00 C ATOM 1596 O SER A 104 -14.005 -1.621 3.651 1.00 0.00 O ATOM 1597 CB SER A 104 -16.557 -2.302 2.263 1.00 0.00 C ATOM 1598 OG SER A 104 -17.822 -2.851 1.936 1.00 0.00 O ATOM 0 H SER A 104 -16.168 -1.052 4.942 1.00 0.00 H new ATOM 0 HA SER A 104 -16.486 -3.735 3.822 1.00 0.00 H new ATOM 0 HB2 SER A 104 -16.598 -1.215 2.192 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.811 -2.640 1.544 1.00 0.00 H new ATOM 0 HG SER A 104 -18.341 -2.195 1.425 1.00 0.00 H new ATOM 1604 N ARG A 105 -14.050 -3.806 4.161 1.00 0.00 N ATOM 1605 CA ARG A 105 -12.616 -3.907 4.386 1.00 0.00 C ATOM 1606 C ARG A 105 -11.891 -4.465 3.173 1.00 0.00 C ATOM 1607 O ARG A 105 -12.409 -5.321 2.458 1.00 0.00 O ATOM 1608 CB ARG A 105 -12.353 -4.784 5.606 1.00 0.00 C ATOM 1609 CG ARG A 105 -13.033 -4.277 6.866 1.00 0.00 C ATOM 1610 CD ARG A 105 -12.227 -3.172 7.530 1.00 0.00 C ATOM 1611 NE ARG A 105 -12.828 -2.729 8.785 1.00 0.00 N ATOM 1612 CZ ARG A 105 -12.312 -1.775 9.554 1.00 0.00 C ATOM 1613 NH1 ARG A 105 -11.192 -1.163 9.194 1.00 0.00 N ATOM 1614 NH2 ARG A 105 -12.916 -1.432 10.683 1.00 0.00 N ATOM 0 H ARG A 105 -14.555 -4.684 4.280 1.00 0.00 H new ATOM 0 HA ARG A 105 -12.230 -2.903 4.562 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -12.697 -5.797 5.398 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -11.278 -4.842 5.779 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -14.027 -3.905 6.619 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -13.166 -5.102 7.566 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -11.214 -3.527 7.720 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -12.145 -2.325 6.849 1.00 0.00 H new ATOM 0 HE ARG A 105 -13.693 -3.177 9.089 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -10.725 -1.424 8.326 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -10.798 -0.431 9.785 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -13.778 -1.900 10.963 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -12.519 -0.700 11.272 1.00 0.00 H new ATOM 1628 N CYS A 106 -10.679 -3.972 2.956 1.00 0.00 N ATOM 1629 CA CYS A 106 -9.861 -4.410 1.839 1.00 0.00 C ATOM 1630 C CYS A 106 -8.918 -5.513 2.280 1.00 0.00 C ATOM 1631 O CYS A 106 -8.057 -5.305 3.132 1.00 0.00 O ATOM 1632 CB CYS A 106 -9.064 -3.239 1.269 1.00 0.00 C ATOM 1633 SG CYS A 106 -9.688 -2.633 -0.328 1.00 0.00 S ATOM 0 H CYS A 106 -10.241 -3.264 3.545 1.00 0.00 H new ATOM 0 HA CYS A 106 -10.519 -4.797 1.061 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -9.076 -2.420 1.988 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -8.024 -3.543 1.150 1.00 0.00 H new ATOM 1638 N GLU A 107 -9.089 -6.687 1.699 1.00 0.00 N ATOM 1639 CA GLU A 107 -8.270 -7.833 2.047 1.00 0.00 C ATOM 1640 C GLU A 107 -7.638 -8.429 0.796 1.00 0.00 C ATOM 1641 O GLU A 107 -7.705 -7.837 -0.279 1.00 0.00 O ATOM 1642 CB GLU A 107 -9.134 -8.876 2.762 1.00 0.00 C ATOM 1643 CG GLU A 107 -8.350 -9.824 3.654 1.00 0.00 C ATOM 1644 CD GLU A 107 -9.239 -10.827 4.363 1.00 0.00 C ATOM 1645 OE1 GLU A 107 -9.975 -10.422 5.286 1.00 0.00 O ATOM 1646 OE2 GLU A 107 -9.198 -12.021 3.994 1.00 0.00 O ATOM 0 H GLU A 107 -9.790 -6.872 0.982 1.00 0.00 H new ATOM 0 HA GLU A 107 -7.469 -7.516 2.714 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -9.882 -8.361 3.365 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -9.673 -9.459 2.015 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -7.614 -10.358 3.053 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -7.797 -9.246 4.395 1.00 0.00 H new ATOM 1653 N VAL A 108 -6.975 -9.564 0.966 1.00 0.00 N ATOM 1654 CA VAL A 108 -6.347 -10.271 -0.136 1.00 0.00 C ATOM 1655 C VAL A 108 -6.885 -11.699 -0.255 1.00 0.00 C ATOM 1656 O VAL A 108 -7.358 -12.275 0.725 1.00 0.00 O ATOM 1657 CB VAL A 108 -4.826 -10.267 0.014 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -4.438 -10.773 1.383 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.156 -11.061 -1.105 1.00 0.00 C ATOM 0 H VAL A 108 -6.859 -10.019 1.872 1.00 0.00 H new ATOM 0 HA VAL A 108 -6.597 -9.746 -1.058 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.468 -9.241 -0.076 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -3.352 -10.766 1.479 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -4.874 -10.128 2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -4.807 -11.790 1.513 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.075 -11.039 -0.970 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.504 -12.094 -1.077 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.410 -10.618 -2.068 1.00 0.00 H new ATOM 1669 N GLN A 109 -6.776 -12.259 -1.468 1.00 0.00 N ATOM 1670 CA GLN A 109 -7.269 -13.615 -1.759 1.00 0.00 C ATOM 1671 C GLN A 109 -7.479 -13.830 -3.251 1.00 0.00 C ATOM 1672 O GLN A 109 -8.272 -14.678 -3.659 1.00 0.00 O ATOM 1673 CB GLN A 109 -8.589 -13.890 -1.034 1.00 0.00 C ATOM 1674 CG GLN A 109 -9.716 -12.976 -1.477 1.00 0.00 C ATOM 1675 CD GLN A 109 -11.035 -13.305 -0.808 1.00 0.00 C ATOM 1676 OE1 GLN A 109 -11.819 -14.107 -1.318 1.00 0.00 O ATOM 1677 NE2 GLN A 109 -11.289 -12.688 0.339 1.00 0.00 N ATOM 0 H GLN A 109 -6.349 -11.792 -2.268 1.00 0.00 H new ATOM 0 HA GLN A 109 -6.504 -14.305 -1.404 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -8.881 -14.926 -1.206 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -8.437 -13.775 0.039 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -9.449 -11.943 -1.255 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -9.834 -13.049 -2.558 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.611 -12.031 0.726 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -12.162 -12.871 0.834 1.00 0.00 H new ATOM 1686 N ASP A 110 -6.757 -13.076 -4.059 1.00 0.00 N ATOM 1687 CA ASP A 110 -6.871 -13.183 -5.506 1.00 0.00 C ATOM 1688 C ASP A 110 -5.584 -12.732 -6.184 1.00 0.00 C ATOM 1689 O ASP A 110 -4.537 -13.360 -6.021 1.00 0.00 O ATOM 1690 CB ASP A 110 -8.060 -12.361 -6.017 1.00 0.00 C ATOM 1691 CG ASP A 110 -9.396 -12.943 -5.596 1.00 0.00 C ATOM 1692 OD1 ASP A 110 -9.812 -13.962 -6.188 1.00 0.00 O ATOM 1693 OD2 ASP A 110 -10.024 -12.381 -4.676 1.00 0.00 O ATOM 0 H ASP A 110 -6.083 -12.380 -3.739 1.00 0.00 H new ATOM 0 HA ASP A 110 -7.042 -14.230 -5.755 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -7.979 -11.340 -5.643 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -8.018 -12.306 -7.105 1.00 0.00 H new ATOM 1698 N ARG A 111 -5.660 -11.646 -6.946 1.00 0.00 N ATOM 1699 CA ARG A 111 -4.491 -11.126 -7.630 1.00 0.00 C ATOM 1700 C ARG A 111 -3.700 -10.215 -6.714 1.00 0.00 C ATOM 1701 O ARG A 111 -3.335 -9.097 -7.081 1.00 0.00 O ATOM 1702 CB ARG A 111 -4.892 -10.390 -8.911 1.00 0.00 C ATOM 1703 CG ARG A 111 -5.977 -9.348 -8.701 1.00 0.00 C ATOM 1704 CD ARG A 111 -6.310 -8.621 -9.995 1.00 0.00 C ATOM 1705 NE ARG A 111 -7.363 -7.626 -9.808 1.00 0.00 N ATOM 1706 CZ ARG A 111 -7.676 -6.707 -10.715 1.00 0.00 C ATOM 1707 NH1 ARG A 111 -7.019 -6.655 -11.866 1.00 0.00 N ATOM 1708 NH2 ARG A 111 -8.649 -5.839 -10.473 1.00 0.00 N ATOM 0 H ARG A 111 -6.516 -11.114 -7.102 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.857 -11.968 -7.908 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -4.011 -9.905 -9.332 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -5.237 -11.118 -9.645 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -6.874 -9.829 -8.311 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -5.651 -8.627 -7.951 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -5.414 -8.133 -10.378 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -6.624 -9.345 -10.747 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.887 -7.637 -8.933 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -6.271 -7.322 -12.057 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -7.262 -5.948 -12.560 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -9.158 -5.877 -9.590 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -8.888 -5.134 -11.170 1.00 0.00 H new ATOM 1722 N GLY A 112 -3.436 -10.713 -5.516 1.00 0.00 N ATOM 1723 CA GLY A 112 -2.690 -9.950 -4.549 1.00 0.00 C ATOM 1724 C GLY A 112 -3.601 -9.260 -3.570 1.00 0.00 C ATOM 1725 O GLY A 112 -3.146 -8.740 -2.553 1.00 0.00 O ATOM 0 H GLY A 112 -3.729 -11.637 -5.199 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -2.008 -10.609 -4.011 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -2.078 -9.209 -5.063 1.00 0.00 H new ATOM 1729 N VAL A 113 -4.899 -9.249 -3.876 1.00 0.00 N ATOM 1730 CA VAL A 113 -5.868 -8.616 -2.992 1.00 0.00 C ATOM 1731 C VAL A 113 -7.305 -9.041 -3.309 1.00 0.00 C ATOM 1732 O VAL A 113 -7.707 -9.145 -4.468 1.00 0.00 O ATOM 1733 CB VAL A 113 -5.738 -7.079 -3.029 1.00 0.00 C ATOM 1734 CG1 VAL A 113 -4.844 -6.667 -4.181 1.00 0.00 C ATOM 1735 CG2 VAL A 113 -7.098 -6.400 -3.121 1.00 0.00 C ATOM 0 H VAL A 113 -5.296 -9.666 -4.718 1.00 0.00 H new ATOM 0 HA VAL A 113 -5.641 -8.958 -1.982 1.00 0.00 H new ATOM 0 HB VAL A 113 -5.283 -6.752 -2.094 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.756 -5.581 -4.203 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.856 -7.109 -4.051 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -5.276 -7.014 -5.119 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.964 -5.319 -3.145 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -7.605 -6.723 -4.030 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -7.700 -6.672 -2.254 1.00 0.00 H new ATOM 1745 N GLY A 114 -8.054 -9.283 -2.246 1.00 0.00 N ATOM 1746 CA GLY A 114 -9.431 -9.694 -2.408 1.00 0.00 C ATOM 1747 C GLY A 114 -10.402 -8.713 -1.772 1.00 0.00 C ATOM 1748 O GLY A 114 -10.097 -8.126 -0.734 1.00 0.00 O ATOM 0 H GLY A 114 -7.736 -9.203 -1.280 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.657 -9.790 -3.470 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.569 -10.679 -1.963 1.00 0.00 H new ATOM 1752 N TRP A 115 -11.573 -8.527 -2.371 1.00 0.00 N ATOM 1753 CA TRP A 115 -12.570 -7.612 -1.823 1.00 0.00 C ATOM 1754 C TRP A 115 -13.480 -8.327 -0.830 1.00 0.00 C ATOM 1755 O TRP A 115 -14.107 -9.331 -1.164 1.00 0.00 O ATOM 1756 CB TRP A 115 -13.429 -6.988 -2.931 1.00 0.00 C ATOM 1757 CG TRP A 115 -13.392 -5.489 -2.950 1.00 0.00 C ATOM 1758 CD1 TRP A 115 -13.254 -4.689 -4.047 1.00 0.00 C ATOM 1759 CD2 TRP A 115 -13.495 -4.610 -1.822 1.00 0.00 C ATOM 1760 NE1 TRP A 115 -13.266 -3.367 -3.672 1.00 0.00 N ATOM 1761 CE2 TRP A 115 -13.411 -3.293 -2.312 1.00 0.00 C ATOM 1762 CE3 TRP A 115 -13.650 -4.804 -0.447 1.00 0.00 C ATOM 1763 CZ2 TRP A 115 -13.477 -2.183 -1.478 1.00 0.00 C ATOM 1764 CZ3 TRP A 115 -13.716 -3.700 0.380 1.00 0.00 C ATOM 1765 CH2 TRP A 115 -13.629 -2.404 -0.138 1.00 0.00 C ATOM 0 H TRP A 115 -11.855 -8.995 -3.232 1.00 0.00 H new ATOM 0 HA TRP A 115 -12.025 -6.820 -1.310 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -13.090 -7.363 -3.896 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -14.461 -7.316 -2.806 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -13.150 -5.043 -5.062 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -13.181 -2.571 -4.304 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -13.717 -5.801 -0.038 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -13.410 -1.181 -1.875 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -13.837 -3.840 1.444 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.683 -1.561 0.535 1.00 0.00 H new ATOM 1776 N SER A 116 -13.548 -7.804 0.390 1.00 0.00 N ATOM 1777 CA SER A 116 -14.397 -8.389 1.420 1.00 0.00 C ATOM 1778 C SER A 116 -15.869 -8.222 1.046 1.00 0.00 C ATOM 1779 O SER A 116 -16.600 -9.202 0.903 1.00 0.00 O ATOM 1780 CB SER A 116 -14.125 -7.733 2.776 1.00 0.00 C ATOM 1781 OG SER A 116 -14.965 -8.271 3.782 1.00 0.00 O ATOM 0 H SER A 116 -13.027 -6.979 0.688 1.00 0.00 H new ATOM 0 HA SER A 116 -14.167 -9.452 1.494 1.00 0.00 H new ATOM 0 HB2 SER A 116 -13.081 -7.882 3.052 1.00 0.00 H new ATOM 0 HB3 SER A 116 -14.285 -6.657 2.701 1.00 0.00 H new ATOM 0 HG SER A 116 -15.893 -8.009 3.608 1.00 0.00 H new ATOM 1787 N HIS A 117 -16.287 -6.968 0.884 1.00 0.00 N ATOM 1788 CA HIS A 117 -17.665 -6.648 0.516 1.00 0.00 C ATOM 1789 C HIS A 117 -17.716 -5.350 -0.291 1.00 0.00 C ATOM 1790 O HIS A 117 -17.045 -4.377 0.051 1.00 0.00 O ATOM 1791 CB HIS A 117 -18.538 -6.518 1.768 1.00 0.00 C ATOM 1792 CG HIS A 117 -18.760 -7.812 2.488 1.00 0.00 C ATOM 1793 ND1 HIS A 117 -18.062 -8.174 3.621 1.00 0.00 N ATOM 1794 CD2 HIS A 117 -19.611 -8.835 2.231 1.00 0.00 C ATOM 1795 CE1 HIS A 117 -18.473 -9.362 4.029 1.00 0.00 C ATOM 1796 NE2 HIS A 117 -19.413 -9.784 3.203 1.00 0.00 N ATOM 0 H HIS A 117 -15.687 -6.152 1.003 1.00 0.00 H new ATOM 0 HA HIS A 117 -18.051 -7.461 -0.100 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -18.073 -5.808 2.452 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -19.504 -6.101 1.484 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -20.314 -8.893 1.413 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -18.103 -9.897 4.891 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -19.911 -10.671 3.275 1.00 0.00 H new ATOM 1805 N PRO A 118 -18.504 -5.321 -1.381 1.00 0.00 N ATOM 1806 CA PRO A 118 -18.641 -4.153 -2.237 1.00 0.00 C ATOM 1807 C PRO A 118 -19.901 -3.341 -1.925 1.00 0.00 C ATOM 1808 O PRO A 118 -20.388 -3.332 -0.794 1.00 0.00 O ATOM 1809 CB PRO A 118 -18.761 -4.806 -3.607 1.00 0.00 C ATOM 1810 CG PRO A 118 -19.534 -6.064 -3.352 1.00 0.00 C ATOM 1811 CD PRO A 118 -19.321 -6.430 -1.897 1.00 0.00 C ATOM 0 HA PRO A 118 -17.822 -3.442 -2.128 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -19.279 -4.157 -4.313 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -17.781 -5.021 -4.032 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -20.593 -5.914 -3.561 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -19.191 -6.866 -4.005 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -20.267 -6.515 -1.362 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -18.810 -7.387 -1.794 1.00 0.00 H new ATOM 1819 N LEU A 119 -20.414 -2.659 -2.947 1.00 0.00 N ATOM 1820 CA LEU A 119 -21.623 -1.847 -2.836 1.00 0.00 C ATOM 1821 C LEU A 119 -22.765 -2.623 -2.177 1.00 0.00 C ATOM 1822 O LEU A 119 -23.197 -3.656 -2.691 1.00 0.00 O ATOM 1823 CB LEU A 119 -22.037 -1.404 -4.234 1.00 0.00 C ATOM 1824 CG LEU A 119 -20.878 -0.985 -5.143 1.00 0.00 C ATOM 1825 CD1 LEU A 119 -21.401 -0.418 -6.445 1.00 0.00 C ATOM 1826 CD2 LEU A 119 -19.994 0.024 -4.430 1.00 0.00 C ATOM 0 H LEU A 119 -20.001 -2.654 -3.879 1.00 0.00 H new ATOM 0 HA LEU A 119 -21.410 -0.983 -2.207 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -22.580 -2.219 -4.713 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -22.731 -0.568 -4.145 1.00 0.00 H new ATOM 0 HG LEU A 119 -20.279 -1.865 -5.376 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -20.563 -0.126 -7.077 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -21.996 -1.173 -6.958 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -22.021 0.454 -6.239 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -19.173 0.315 -5.085 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -20.582 0.905 -4.172 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -19.592 -0.423 -3.521 1.00 0.00 H new ATOM 1838 N PRO A 120 -23.269 -2.133 -1.028 1.00 0.00 N ATOM 1839 CA PRO A 120 -24.370 -2.778 -0.302 1.00 0.00 C ATOM 1840 C PRO A 120 -25.692 -2.664 -1.050 1.00 0.00 C ATOM 1841 O PRO A 120 -25.713 -2.410 -2.256 1.00 0.00 O ATOM 1842 CB PRO A 120 -24.444 -2.007 1.024 1.00 0.00 C ATOM 1843 CG PRO A 120 -23.194 -1.194 1.086 1.00 0.00 C ATOM 1844 CD PRO A 120 -22.806 -0.924 -0.338 1.00 0.00 C ATOM 0 HA PRO A 120 -24.195 -3.846 -0.174 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -25.328 -1.370 1.058 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -24.510 -2.690 1.871 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -23.360 -0.263 1.628 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -22.404 -1.732 1.610 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -23.287 -0.026 -0.726 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -21.731 -0.782 -0.446 1.00 0.00 H new ATOM 1852 N GLN A 121 -26.796 -2.852 -0.333 1.00 0.00 N ATOM 1853 CA GLN A 121 -28.124 -2.773 -0.928 1.00 0.00 C ATOM 1854 C GLN A 121 -28.893 -1.566 -0.400 1.00 0.00 C ATOM 1855 O GLN A 121 -29.179 -1.474 0.794 1.00 0.00 O ATOM 1856 CB GLN A 121 -28.909 -4.051 -0.629 1.00 0.00 C ATOM 1857 CG GLN A 121 -29.991 -4.356 -1.652 1.00 0.00 C ATOM 1858 CD GLN A 121 -30.689 -5.675 -1.385 1.00 0.00 C ATOM 1859 OE1 GLN A 121 -30.270 -6.724 -1.877 1.00 0.00 O ATOM 1860 NE2 GLN A 121 -31.760 -5.630 -0.603 1.00 0.00 N ATOM 0 H GLN A 121 -26.796 -3.061 0.665 1.00 0.00 H new ATOM 0 HA GLN A 121 -28.004 -2.661 -2.006 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -28.216 -4.891 -0.585 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -29.367 -3.964 0.356 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -30.727 -3.552 -1.648 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -29.549 -4.378 -2.648 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -32.072 -4.739 -0.217 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -32.271 -6.486 -0.388 1.00 0.00 H new ATOM 1869 N CYS A 122 -29.224 -0.641 -1.296 1.00 0.00 N ATOM 1870 CA CYS A 122 -29.972 0.546 -0.901 1.00 0.00 C ATOM 1871 C CYS A 122 -31.439 0.396 -1.292 1.00 0.00 C ATOM 1872 O CYS A 122 -31.790 0.448 -2.471 1.00 0.00 O ATOM 1873 CB CYS A 122 -29.374 1.804 -1.534 1.00 0.00 C ATOM 1874 SG CYS A 122 -27.741 2.272 -0.866 1.00 0.00 S ATOM 0 H CYS A 122 -28.990 -0.689 -2.288 1.00 0.00 H new ATOM 0 HA CYS A 122 -29.906 0.650 0.182 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -29.284 1.649 -2.609 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -30.065 2.634 -1.389 1.00 0.00 H new ATOM 1879 N GLU A 123 -32.290 0.209 -0.288 1.00 0.00 N ATOM 1880 CA GLU A 123 -33.719 0.031 -0.528 1.00 0.00 C ATOM 1881 C GLU A 123 -34.535 1.019 0.298 1.00 0.00 C ATOM 1882 O GLU A 123 -34.157 1.392 1.407 1.00 0.00 O ATOM 1883 CB GLU A 123 -34.139 -1.403 -0.198 1.00 0.00 C ATOM 1884 CG GLU A 123 -35.575 -1.720 -0.579 1.00 0.00 C ATOM 1885 CD GLU A 123 -35.834 -1.559 -2.064 1.00 0.00 C ATOM 1886 OE1 GLU A 123 -35.489 -2.482 -2.831 1.00 0.00 O ATOM 1887 OE2 GLU A 123 -36.383 -0.509 -2.460 1.00 0.00 O ATOM 0 H GLU A 123 -32.018 0.177 0.694 1.00 0.00 H new ATOM 0 HA GLU A 123 -33.913 0.222 -1.583 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -33.474 -2.095 -0.714 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -34.010 -1.574 0.871 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -35.808 -2.743 -0.282 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -36.247 -1.066 -0.024 1.00 0.00 H new ATOM 1894 N ILE A 124 -35.663 1.432 -0.272 1.00 0.00 N ATOM 1895 CA ILE A 124 -36.545 2.392 0.380 1.00 0.00 C ATOM 1896 C ILE A 124 -37.033 1.862 1.727 1.00 0.00 C ATOM 1897 O ILE A 124 -37.204 0.657 1.907 1.00 0.00 O ATOM 1898 CB ILE A 124 -37.758 2.727 -0.511 1.00 0.00 C ATOM 1899 CG1 ILE A 124 -38.624 3.812 0.133 1.00 0.00 C ATOM 1900 CG2 ILE A 124 -38.580 1.476 -0.784 1.00 0.00 C ATOM 1901 CD1 ILE A 124 -38.043 5.205 0.014 1.00 0.00 C ATOM 0 H ILE A 124 -35.988 1.116 -1.186 1.00 0.00 H new ATOM 0 HA ILE A 124 -35.967 3.301 0.545 1.00 0.00 H new ATOM 0 HB ILE A 124 -37.387 3.110 -1.462 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -39.611 3.799 -0.330 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -38.763 3.575 1.188 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -39.432 1.731 -1.414 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -37.960 0.737 -1.293 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -38.937 1.062 0.159 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -38.712 5.920 0.493 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -37.069 5.236 0.502 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -37.930 5.463 -1.039 1.00 0.00 H new ATOM 1913 N LEU A 125 -37.255 2.775 2.669 1.00 0.00 N ATOM 1914 CA LEU A 125 -37.719 2.410 4.002 1.00 0.00 C ATOM 1915 C LEU A 125 -39.139 1.857 3.951 1.00 0.00 C ATOM 1916 O LEU A 125 -39.418 0.783 4.484 1.00 0.00 O ATOM 1917 CB LEU A 125 -37.666 3.630 4.926 1.00 0.00 C ATOM 1918 CG LEU A 125 -36.264 4.181 5.193 1.00 0.00 C ATOM 1919 CD1 LEU A 125 -36.344 5.598 5.741 1.00 0.00 C ATOM 1920 CD2 LEU A 125 -35.511 3.279 6.160 1.00 0.00 C ATOM 0 H LEU A 125 -37.120 3.777 2.532 1.00 0.00 H new ATOM 0 HA LEU A 125 -37.062 1.633 4.393 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -38.274 4.423 4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -38.123 3.365 5.879 1.00 0.00 H new ATOM 0 HG LEU A 125 -35.719 4.206 4.249 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -35.338 5.974 5.925 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -36.845 6.240 5.017 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -36.907 5.596 6.674 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -34.516 3.687 6.338 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -36.054 3.223 7.103 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -35.423 2.280 5.732 1.00 0.00 H new ATOM 1932 N GLU A 126 -40.032 2.600 3.306 1.00 0.00 N ATOM 1933 CA GLU A 126 -41.427 2.190 3.184 1.00 0.00 C ATOM 1934 C GLU A 126 -41.781 1.889 1.732 1.00 0.00 C ATOM 1935 O GLU A 126 -41.049 2.258 0.814 1.00 0.00 O ATOM 1936 CB GLU A 126 -42.348 3.281 3.729 1.00 0.00 C ATOM 1937 CG GLU A 126 -42.119 4.641 3.092 1.00 0.00 C ATOM 1938 CD GLU A 126 -43.105 5.687 3.574 1.00 0.00 C ATOM 1939 OE1 GLU A 126 -42.879 6.260 4.659 1.00 0.00 O ATOM 1940 OE2 GLU A 126 -44.104 5.931 2.865 1.00 0.00 O ATOM 0 H GLU A 126 -39.815 3.491 2.859 1.00 0.00 H new ATOM 0 HA GLU A 126 -41.565 1.280 3.768 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -43.384 2.984 3.569 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -42.202 3.364 4.806 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -41.105 4.975 3.312 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -42.195 4.548 2.009 1.00 0.00 H new ATOM 1947 N HIS A 127 -42.909 1.218 1.530 1.00 0.00 N ATOM 1948 CA HIS A 127 -43.362 0.871 0.188 1.00 0.00 C ATOM 1949 C HIS A 127 -44.882 0.938 0.098 1.00 0.00 C ATOM 1950 O HIS A 127 -45.460 0.741 -0.971 1.00 0.00 O ATOM 1951 CB HIS A 127 -42.872 -0.527 -0.195 1.00 0.00 C ATOM 1952 CG HIS A 127 -43.288 -1.595 0.768 1.00 0.00 C ATOM 1953 ND1 HIS A 127 -42.507 -1.995 1.831 1.00 0.00 N ATOM 1954 CD2 HIS A 127 -44.410 -2.351 0.822 1.00 0.00 C ATOM 1955 CE1 HIS A 127 -43.129 -2.953 2.497 1.00 0.00 C ATOM 1956 NE2 HIS A 127 -44.285 -3.186 1.906 1.00 0.00 N ATOM 0 H HIS A 127 -43.527 0.903 2.278 1.00 0.00 H new ATOM 0 HA HIS A 127 -42.943 1.594 -0.511 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -43.251 -0.776 -1.186 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -41.784 -0.515 -0.263 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -45.247 -2.306 0.141 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -42.755 -3.458 3.375 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -44.975 -3.875 2.205 1.00 0.00 H new ATOM 1965 N HIS A 128 -45.522 1.219 1.228 1.00 0.00 N ATOM 1966 CA HIS A 128 -46.975 1.319 1.279 1.00 0.00 C ATOM 1967 C HIS A 128 -47.456 2.524 0.479 1.00 0.00 C ATOM 1968 O HIS A 128 -48.607 2.578 0.046 1.00 0.00 O ATOM 1969 CB HIS A 128 -47.448 1.432 2.730 1.00 0.00 C ATOM 1970 CG HIS A 128 -46.966 0.317 3.606 1.00 0.00 C ATOM 1971 ND1 HIS A 128 -45.775 0.367 4.300 1.00 0.00 N ATOM 1972 CD2 HIS A 128 -47.521 -0.883 3.900 1.00 0.00 C ATOM 1973 CE1 HIS A 128 -45.619 -0.753 4.984 1.00 0.00 C ATOM 1974 NE2 HIS A 128 -46.665 -1.526 4.759 1.00 0.00 N ATOM 0 H HIS A 128 -45.057 1.382 2.121 1.00 0.00 H new ATOM 0 HA HIS A 128 -47.398 0.416 0.838 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -47.105 2.381 3.142 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -48.538 1.452 2.748 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -48.461 -1.263 3.528 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -44.779 -0.995 5.619 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -46.813 -2.452 5.159 1.00 0.00 H new ATOM 1983 N HIS A 129 -46.560 3.489 0.288 1.00 0.00 N ATOM 1984 CA HIS A 129 -46.881 4.696 -0.462 1.00 0.00 C ATOM 1985 C HIS A 129 -46.554 4.513 -1.941 1.00 0.00 C ATOM 1986 O HIS A 129 -45.531 3.927 -2.293 1.00 0.00 O ATOM 1987 CB HIS A 129 -46.109 5.891 0.102 1.00 0.00 C ATOM 1988 CG HIS A 129 -46.324 7.162 -0.661 1.00 0.00 C ATOM 1989 ND1 HIS A 129 -47.532 7.825 -0.696 1.00 0.00 N ATOM 1990 CD2 HIS A 129 -45.475 7.890 -1.425 1.00 0.00 C ATOM 1991 CE1 HIS A 129 -47.417 8.906 -1.448 1.00 0.00 C ATOM 1992 NE2 HIS A 129 -46.179 8.968 -1.900 1.00 0.00 N ATOM 0 H HIS A 129 -45.605 3.457 0.644 1.00 0.00 H new ATOM 0 HA HIS A 129 -47.950 4.887 -0.364 1.00 0.00 H new ATOM 0 HB2 HIS A 129 -46.405 6.046 1.140 1.00 0.00 H new ATOM 0 HB3 HIS A 129 -45.045 5.656 0.106 1.00 0.00 H new ATOM 0 HD2 HIS A 129 -44.438 7.664 -1.623 1.00 0.00 H new ATOM 0 HE1 HIS A 129 -48.202 9.617 -1.657 1.00 0.00 H new ATOM 0 HE2 HIS A 129 -45.805 9.699 -2.505 1.00 0.00 H new ATOM 2001 N HIS A 130 -47.430 5.020 -2.802 1.00 0.00 N ATOM 2002 CA HIS A 130 -47.237 4.910 -4.243 1.00 0.00 C ATOM 2003 C HIS A 130 -46.710 6.219 -4.821 1.00 0.00 C ATOM 2004 O HIS A 130 -46.941 7.291 -4.264 1.00 0.00 O ATOM 2005 CB HIS A 130 -48.552 4.525 -4.922 1.00 0.00 C ATOM 2006 CG HIS A 130 -49.176 3.288 -4.352 1.00 0.00 C ATOM 2007 ND1 HIS A 130 -49.024 2.038 -4.915 1.00 0.00 N ATOM 2008 CD2 HIS A 130 -49.955 3.114 -3.258 1.00 0.00 C ATOM 2009 CE1 HIS A 130 -49.684 1.149 -4.193 1.00 0.00 C ATOM 2010 NE2 HIS A 130 -50.256 1.776 -3.182 1.00 0.00 N ATOM 0 H HIS A 130 -48.281 5.511 -2.527 1.00 0.00 H new ATOM 0 HA HIS A 130 -46.498 4.131 -4.432 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -49.255 5.353 -4.831 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -48.372 4.375 -5.987 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -50.279 3.884 -2.573 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -49.745 0.090 -4.396 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -50.829 1.338 -2.461 1.00 0.00 H new ATOM 2019 N HIS A 131 -46.000 6.119 -5.942 1.00 0.00 N ATOM 2020 CA HIS A 131 -45.433 7.294 -6.599 1.00 0.00 C ATOM 2021 C HIS A 131 -46.505 8.345 -6.866 1.00 0.00 C ATOM 2022 O HIS A 131 -47.687 8.024 -6.991 1.00 0.00 O ATOM 2023 CB HIS A 131 -44.761 6.892 -7.914 1.00 0.00 C ATOM 2024 CG HIS A 131 -43.745 5.804 -7.761 1.00 0.00 C ATOM 2025 ND1 HIS A 131 -43.944 4.519 -8.220 1.00 0.00 N ATOM 2026 CD2 HIS A 131 -42.514 5.814 -7.197 1.00 0.00 C ATOM 2027 CE1 HIS A 131 -42.880 3.785 -7.946 1.00 0.00 C ATOM 2028 NE2 HIS A 131 -41.998 4.547 -7.327 1.00 0.00 N ATOM 0 H HIS A 131 -45.804 5.237 -6.414 1.00 0.00 H new ATOM 0 HA HIS A 131 -44.688 7.726 -5.931 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -45.526 6.566 -8.618 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -44.280 7.768 -8.349 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -42.029 6.659 -6.732 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -42.754 2.740 -8.187 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -41.081 4.244 -6.998 1.00 0.00 H new ATOM 2037 N HIS A 132 -46.083 9.604 -6.952 1.00 0.00 N ATOM 2038 CA HIS A 132 -47.005 10.705 -7.206 1.00 0.00 C ATOM 2039 C HIS A 132 -46.452 11.637 -8.280 1.00 0.00 C ATOM 2040 O HIS A 132 -45.683 12.556 -7.928 1.00 0.00 O ATOM 2041 CB HIS A 132 -47.267 11.488 -5.917 1.00 0.00 C ATOM 2042 CG HIS A 132 -48.298 12.563 -6.069 1.00 0.00 C ATOM 2043 ND1 HIS A 132 -49.653 12.310 -6.081 1.00 0.00 N ATOM 2044 CD2 HIS A 132 -48.167 13.903 -6.219 1.00 0.00 C ATOM 2045 CE1 HIS A 132 -50.310 13.446 -6.231 1.00 0.00 C ATOM 2046 NE2 HIS A 132 -49.431 14.427 -6.317 1.00 0.00 N ATOM 2047 OXT HIS A 132 -46.794 11.438 -9.466 1.00 0.00 O ATOM 0 H HIS A 132 -45.108 9.886 -6.849 1.00 0.00 H new ATOM 0 HA HIS A 132 -47.946 10.285 -7.563 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -47.588 10.795 -5.140 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -46.333 11.937 -5.578 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -47.240 14.456 -6.255 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -51.384 13.554 -6.276 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -49.655 15.415 -6.437 1.00 0.00 H new TER 2056 HIS A 132