USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=36 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 -66:sc= 1.14 USER MOD Set 1.2: A 117 HIS : no HD1:sc= 0 X(o=1.1,f=1) USER MOD Set 2.1: A 42 SER OG : rot -130:sc= -0.549 USER MOD Set 2.2: A 57 ASN : amide:sc= 0 X(o=-0.55,f=-0.55) USER MOD Set 3.1: A 28 THR OG1 : rot 180:sc= 0.779 USER MOD Set 3.2: A 47 THR OG1 : rot -141:sc= 0.435 USER MOD Single : A 0 MET CE :methyl -158:sc= -0.156 (180deg=-0.791) USER MOD Single : A 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 ASN : amide:sc= -8.34! C(o=-8.3!,f=-2.9!) 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 -157:sc= -2.49! (180deg=-3.28!) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -157:sc= 0.445 (180deg=0.0495) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.00164 USER MOD Single : A 27 THR OG1 : rot -52:sc= 0.184 USER MOD Single : A 30 LYS NZ :NH3+ -161:sc= -0.106 (180deg=-0.512) USER MOD Single : A 31 TYR OH : rot -30:sc= -1.5! USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot -128:sc= 0.0587 USER MOD Single : A 40 SER OG : rot -35:sc= 0.624 USER MOD Single : A 41 HIS : no HD1:sc= -0.0879 K(o=-0.088,f=-0.95) USER MOD Single : A 43 THR OG1 : rot -32:sc= 0.286 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.142 USER MOD Single : A 49 ASN : amide:sc= -10.6! C(o=-11!,f=-8.2!) USER MOD Single : A 50 SER OG : rot 180:sc=-0.00142 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 124:sc= -0.0241 USER MOD Single : A 63 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.039) USER MOD Single : A 67 HIS : no HD1:sc= -0.0337 X(o=-0.034,f=-0.041) USER MOD Single : A 73 ASN : amide:sc= -4.41! C(o=-4.4!,f=-2.5!) USER MOD Single : A 75 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 79 LYS NZ :NH3+ -126:sc= -2.43! (180deg=-5.95!) USER MOD Single : A 80 THR OG1 : rot -120:sc= -0.817 USER MOD Single : A 83 SER OG : rot 60:sc= 0.602 USER MOD Single : A 86 SER OG : rot 100:sc= -1.89! USER MOD Single : A 87 GLN : amide:sc= -3.34! K(o=-3.3!,f=-1.1) USER MOD Single : A 91 SER OG : rot -6:sc= 1.07 USER MOD Single : A 93 SER OG : rot -88:sc= 1.22 USER MOD Single : A 101 SER OG : rot 16:sc= 1.14 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 3:sc= -0.685 USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 121 GLN : amide:sc= -3.45! K(o=-3.5!,f=-1.3) USER MOD Single : A 127 HIS : no HD1:sc= -1.19 K(o=-1.2,f=-0.4) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 130 HIS : no HD1:sc= -0.0207 X(o=-0.021,f=0) USER MOD Single : A 131 HIS : no HD1:sc= -0.521 K(o=-0.52,f=0.0083) USER MOD Single : A 132 HIS : no HD1:sc= -0.0168 X(o=-0.017,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 33.103 -2.759 -0.269 1.00 0.00 N ATOM 2 CA MET A 0 33.192 -1.456 0.438 1.00 0.00 C ATOM 3 C MET A 0 32.368 -0.391 -0.279 1.00 0.00 C ATOM 4 O MET A 0 32.757 0.095 -1.341 1.00 0.00 O ATOM 5 CB MET A 0 34.653 -1.006 0.532 1.00 0.00 C ATOM 6 CG MET A 0 34.838 0.331 1.231 1.00 0.00 C ATOM 7 SD MET A 0 36.574 0.783 1.419 1.00 0.00 S ATOM 8 CE MET A 0 37.155 -0.539 2.479 1.00 0.00 C ATOM 0 H1 MET A 0 33.671 -3.468 0.237 1.00 0.00 H new ATOM 0 H2 MET A 0 32.111 -3.069 -0.301 1.00 0.00 H new ATOM 0 H3 MET A 0 33.464 -2.653 -1.238 1.00 0.00 H new ATOM 0 HA MET A 0 32.790 -1.586 1.443 1.00 0.00 H new ATOM 0 HB2 MET A 0 35.224 -1.766 1.065 1.00 0.00 H new ATOM 0 HB3 MET A 0 35.069 -0.941 -0.473 1.00 0.00 H new ATOM 0 HG2 MET A 0 34.324 1.107 0.664 1.00 0.00 H new ATOM 0 HG3 MET A 0 34.369 0.291 2.214 1.00 0.00 H new ATOM 0 HE1 MET A 0 38.059 -0.219 2.997 1.00 0.00 H new ATOM 0 HE2 MET A 0 36.385 -0.784 3.210 1.00 0.00 H new ATOM 0 HE3 MET A 0 37.375 -1.419 1.875 1.00 0.00 H new ATOM 20 N ASN A 1 31.233 -0.032 0.316 1.00 0.00 N ATOM 21 CA ASN A 1 30.344 0.979 -0.254 1.00 0.00 C ATOM 22 C ASN A 1 29.761 0.521 -1.586 1.00 0.00 C ATOM 23 O ASN A 1 30.473 0.014 -2.453 1.00 0.00 O ATOM 24 CB ASN A 1 31.087 2.308 -0.429 1.00 0.00 C ATOM 25 CG ASN A 1 31.266 3.042 0.885 1.00 0.00 C ATOM 26 OD1 ASN A 1 32.245 2.829 1.599 1.00 0.00 O ATOM 27 ND2 ASN A 1 30.319 3.915 1.203 1.00 0.00 N ATOM 0 H ASN A 1 30.905 -0.428 1.197 1.00 0.00 H new ATOM 0 HA ASN A 1 29.518 1.124 0.442 1.00 0.00 H new ATOM 0 HB2 ASN A 1 32.064 2.120 -0.874 1.00 0.00 H new ATOM 0 HB3 ASN A 1 30.536 2.941 -1.125 1.00 0.00 H new ATOM 0 HD21 ASN A 1 30.384 4.444 2.073 1.00 0.00 H new ATOM 0 HD22 ASN A 1 29.526 4.057 0.578 1.00 0.00 H new ATOM 34 N CYS A 2 28.453 0.707 -1.746 1.00 0.00 N ATOM 35 CA CYS A 2 27.768 0.313 -2.971 1.00 0.00 C ATOM 36 C CYS A 2 27.719 1.465 -3.967 1.00 0.00 C ATOM 37 O CYS A 2 28.309 2.521 -3.737 1.00 0.00 O ATOM 38 CB CYS A 2 26.347 -0.158 -2.661 1.00 0.00 C ATOM 39 SG CYS A 2 26.244 -1.383 -1.319 1.00 0.00 S ATOM 0 H CYS A 2 27.847 1.128 -1.042 1.00 0.00 H new ATOM 0 HA CYS A 2 28.330 -0.508 -3.416 1.00 0.00 H new ATOM 0 HB2 CYS A 2 25.739 0.707 -2.396 1.00 0.00 H new ATOM 0 HB3 CYS A 2 25.913 -0.587 -3.564 1.00 0.00 H new ATOM 44 N GLY A 3 27.015 1.259 -5.072 1.00 0.00 N ATOM 45 CA GLY A 3 26.865 2.312 -6.055 1.00 0.00 C ATOM 46 C GLY A 3 25.723 3.241 -5.682 1.00 0.00 C ATOM 47 O GLY A 3 24.905 2.886 -4.832 1.00 0.00 O ATOM 0 H GLY A 3 26.546 0.383 -5.304 1.00 0.00 H new ATOM 0 HA2 GLY A 3 27.792 2.880 -6.130 1.00 0.00 H new ATOM 0 HA3 GLY A 3 26.679 1.875 -7.036 1.00 0.00 H new ATOM 51 N PRO A 4 25.637 4.440 -6.286 1.00 0.00 N ATOM 52 CA PRO A 4 24.568 5.395 -5.984 1.00 0.00 C ATOM 53 C PRO A 4 23.200 4.720 -5.865 1.00 0.00 C ATOM 54 O PRO A 4 22.747 4.054 -6.796 1.00 0.00 O ATOM 55 CB PRO A 4 24.608 6.343 -7.177 1.00 0.00 C ATOM 56 CG PRO A 4 26.038 6.343 -7.598 1.00 0.00 C ATOM 57 CD PRO A 4 26.568 4.961 -7.307 1.00 0.00 C ATOM 0 HA PRO A 4 24.713 5.891 -5.024 1.00 0.00 H new ATOM 0 HB2 PRO A 4 23.957 5.999 -7.980 1.00 0.00 H new ATOM 0 HB3 PRO A 4 24.274 7.343 -6.902 1.00 0.00 H new ATOM 0 HG2 PRO A 4 26.131 6.579 -8.658 1.00 0.00 H new ATOM 0 HG3 PRO A 4 26.603 7.099 -7.052 1.00 0.00 H new ATOM 0 HD2 PRO A 4 26.573 4.337 -8.201 1.00 0.00 H new ATOM 0 HD3 PRO A 4 27.592 4.994 -6.936 1.00 0.00 H new ATOM 65 N PRO A 5 22.531 4.889 -4.709 1.00 0.00 N ATOM 66 CA PRO A 5 21.219 4.288 -4.445 1.00 0.00 C ATOM 67 C PRO A 5 20.249 4.411 -5.616 1.00 0.00 C ATOM 68 O PRO A 5 19.974 5.510 -6.097 1.00 0.00 O ATOM 69 CB PRO A 5 20.714 5.087 -3.248 1.00 0.00 C ATOM 70 CG PRO A 5 21.949 5.461 -2.510 1.00 0.00 C ATOM 71 CD PRO A 5 23.005 5.685 -3.560 1.00 0.00 C ATOM 0 HA PRO A 5 21.296 3.214 -4.273 1.00 0.00 H new ATOM 0 HB2 PRO A 5 20.157 5.969 -3.565 1.00 0.00 H new ATOM 0 HB3 PRO A 5 20.044 4.493 -2.627 1.00 0.00 H new ATOM 0 HG2 PRO A 5 21.792 6.361 -1.916 1.00 0.00 H new ATOM 0 HG3 PRO A 5 22.246 4.671 -1.820 1.00 0.00 H new ATOM 0 HD2 PRO A 5 23.098 6.741 -3.815 1.00 0.00 H new ATOM 0 HD3 PRO A 5 23.985 5.352 -3.219 1.00 0.00 H new ATOM 79 N PRO A 6 19.720 3.268 -6.088 1.00 0.00 N ATOM 80 CA PRO A 6 18.766 3.235 -7.203 1.00 0.00 C ATOM 81 C PRO A 6 17.429 3.881 -6.850 1.00 0.00 C ATOM 82 O PRO A 6 17.217 4.393 -5.750 1.00 0.00 O ATOM 83 CB PRO A 6 18.565 1.738 -7.466 1.00 0.00 C ATOM 84 CG PRO A 6 18.977 1.052 -6.207 1.00 0.00 C ATOM 85 CD PRO A 6 20.025 1.919 -5.575 1.00 0.00 C ATOM 0 HA PRO A 6 19.140 3.791 -8.062 1.00 0.00 H new ATOM 0 HB2 PRO A 6 17.526 1.519 -7.710 1.00 0.00 H new ATOM 0 HB3 PRO A 6 19.168 1.404 -8.310 1.00 0.00 H new ATOM 0 HG2 PRO A 6 18.126 0.923 -5.539 1.00 0.00 H new ATOM 0 HG3 PRO A 6 19.371 0.058 -6.418 1.00 0.00 H new ATOM 0 HD2 PRO A 6 19.971 1.883 -4.487 1.00 0.00 H new ATOM 0 HD3 PRO A 6 21.029 1.602 -5.855 1.00 0.00 H new ATOM 93 N THR A 7 16.540 3.829 -7.840 1.00 0.00 N ATOM 94 CA THR A 7 15.196 4.385 -7.736 1.00 0.00 C ATOM 95 C THR A 7 14.194 3.253 -7.533 1.00 0.00 C ATOM 96 O THR A 7 13.327 3.030 -8.380 1.00 0.00 O ATOM 97 CB THR A 7 14.821 5.158 -9.016 1.00 0.00 C ATOM 98 OG1 THR A 7 15.885 6.046 -9.380 1.00 0.00 O ATOM 99 CG2 THR A 7 13.542 5.956 -8.811 1.00 0.00 C ATOM 0 H THR A 7 16.735 3.396 -8.743 1.00 0.00 H new ATOM 0 HA THR A 7 15.172 5.071 -6.889 1.00 0.00 H new ATOM 0 HB THR A 7 14.658 4.435 -9.815 1.00 0.00 H new ATOM 0 HG1 THR A 7 15.641 6.533 -10.195 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.297 6.493 -9.727 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.727 5.278 -8.559 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.684 6.670 -7.999 1.00 0.00 H new ATOM 107 N LEU A 8 14.314 2.531 -6.424 1.00 0.00 N ATOM 108 CA LEU A 8 13.435 1.392 -6.170 1.00 0.00 C ATOM 109 C LEU A 8 11.973 1.765 -6.384 1.00 0.00 C ATOM 110 O LEU A 8 11.454 2.673 -5.739 1.00 0.00 O ATOM 111 CB LEU A 8 13.622 0.880 -4.741 1.00 0.00 C ATOM 112 CG LEU A 8 14.998 0.292 -4.428 1.00 0.00 C ATOM 113 CD1 LEU A 8 16.049 1.389 -4.364 1.00 0.00 C ATOM 114 CD2 LEU A 8 14.952 -0.477 -3.119 1.00 0.00 C ATOM 0 H LEU A 8 15.003 2.710 -5.693 1.00 0.00 H new ATOM 0 HA LEU A 8 13.703 0.606 -6.876 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.432 1.702 -4.051 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.867 0.118 -4.545 1.00 0.00 H new ATOM 0 HG LEU A 8 15.272 -0.395 -5.229 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.021 0.949 -4.140 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.096 1.904 -5.323 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.784 2.101 -3.582 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.937 -0.892 -2.906 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.659 0.195 -2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.227 -1.287 -3.198 1.00 0.00 H new ATOM 126 N SER A 9 11.317 1.056 -7.296 1.00 0.00 N ATOM 127 CA SER A 9 9.914 1.315 -7.590 1.00 0.00 C ATOM 128 C SER A 9 9.034 0.893 -6.417 1.00 0.00 C ATOM 129 O SER A 9 7.903 1.359 -6.278 1.00 0.00 O ATOM 130 CB SER A 9 9.488 0.571 -8.858 1.00 0.00 C ATOM 131 OG SER A 9 10.330 0.900 -9.949 1.00 0.00 O ATOM 0 H SER A 9 11.733 0.301 -7.842 1.00 0.00 H new ATOM 0 HA SER A 9 9.791 2.386 -7.752 1.00 0.00 H new ATOM 0 HB2 SER A 9 9.520 -0.504 -8.681 1.00 0.00 H new ATOM 0 HB3 SER A 9 8.456 0.823 -9.102 1.00 0.00 H new ATOM 0 HG SER A 9 10.038 0.411 -10.746 1.00 0.00 H new ATOM 137 N PHE A 10 9.562 0.006 -5.577 1.00 0.00 N ATOM 138 CA PHE A 10 8.828 -0.481 -4.413 1.00 0.00 C ATOM 139 C PHE A 10 8.810 0.561 -3.300 1.00 0.00 C ATOM 140 O PHE A 10 8.009 0.476 -2.371 1.00 0.00 O ATOM 141 CB PHE A 10 9.459 -1.766 -3.873 1.00 0.00 C ATOM 142 CG PHE A 10 9.596 -2.870 -4.880 1.00 0.00 C ATOM 143 CD1 PHE A 10 10.711 -2.943 -5.700 1.00 0.00 C ATOM 144 CD2 PHE A 10 8.619 -3.846 -4.992 1.00 0.00 C ATOM 145 CE1 PHE A 10 10.846 -3.969 -6.617 1.00 0.00 C ATOM 146 CE2 PHE A 10 8.748 -4.871 -5.908 1.00 0.00 C ATOM 147 CZ PHE A 10 9.863 -4.934 -6.721 1.00 0.00 C ATOM 0 H PHE A 10 10.496 -0.390 -5.681 1.00 0.00 H new ATOM 0 HA PHE A 10 7.806 -0.681 -4.736 1.00 0.00 H new ATOM 0 HB2 PHE A 10 10.446 -1.530 -3.476 1.00 0.00 H new ATOM 0 HB3 PHE A 10 8.858 -2.127 -3.038 1.00 0.00 H new ATOM 0 HD1 PHE A 10 11.482 -2.191 -5.622 1.00 0.00 H new ATOM 0 HD2 PHE A 10 7.747 -3.805 -4.356 1.00 0.00 H new ATOM 0 HE1 PHE A 10 11.719 -4.016 -7.251 1.00 0.00 H new ATOM 0 HE2 PHE A 10 7.977 -5.623 -5.989 1.00 0.00 H new ATOM 0 HZ PHE A 10 9.966 -5.736 -7.437 1.00 0.00 H new ATOM 157 N ALA A 11 9.699 1.544 -3.401 1.00 0.00 N ATOM 158 CA ALA A 11 9.794 2.587 -2.386 1.00 0.00 C ATOM 159 C ALA A 11 10.209 3.924 -2.992 1.00 0.00 C ATOM 160 O ALA A 11 10.071 4.177 -4.188 1.00 0.00 O ATOM 161 CB ALA A 11 10.791 2.164 -1.317 1.00 0.00 C ATOM 0 H ALA A 11 10.361 1.640 -4.171 1.00 0.00 H new ATOM 0 HA ALA A 11 8.809 2.720 -1.939 1.00 0.00 H new ATOM 0 HB1 ALA A 11 10.863 2.943 -0.558 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.456 1.236 -0.854 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.769 2.010 -1.772 1.00 0.00 H new ATOM 167 N ALA A 12 10.714 4.769 -2.096 1.00 0.00 N ATOM 168 CA ALA A 12 11.145 6.115 -2.447 1.00 0.00 C ATOM 169 C ALA A 12 12.044 6.682 -1.348 1.00 0.00 C ATOM 170 O ALA A 12 11.758 6.515 -0.163 1.00 0.00 O ATOM 171 CB ALA A 12 9.944 7.020 -2.673 1.00 0.00 C ATOM 0 H ALA A 12 10.835 4.538 -1.110 1.00 0.00 H new ATOM 0 HA ALA A 12 11.714 6.067 -3.375 1.00 0.00 H new ATOM 0 HB1 ALA A 12 10.287 8.021 -2.934 1.00 0.00 H new ATOM 0 HB2 ALA A 12 9.336 6.621 -3.485 1.00 0.00 H new ATOM 0 HB3 ALA A 12 9.347 7.067 -1.762 1.00 0.00 H new ATOM 177 N PRO A 13 13.143 7.360 -1.721 1.00 0.00 N ATOM 178 CA PRO A 13 14.082 7.937 -0.749 1.00 0.00 C ATOM 179 C PRO A 13 13.374 8.761 0.322 1.00 0.00 C ATOM 180 O PRO A 13 12.399 9.459 0.045 1.00 0.00 O ATOM 181 CB PRO A 13 14.975 8.830 -1.612 1.00 0.00 C ATOM 182 CG PRO A 13 14.931 8.210 -2.966 1.00 0.00 C ATOM 183 CD PRO A 13 13.551 7.630 -3.113 1.00 0.00 C ATOM 0 HA PRO A 13 14.627 7.169 -0.199 1.00 0.00 H new ATOM 0 HB2 PRO A 13 14.607 9.856 -1.634 1.00 0.00 H new ATOM 0 HB3 PRO A 13 15.993 8.865 -1.225 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.127 8.951 -3.741 1.00 0.00 H new ATOM 0 HG3 PRO A 13 15.692 7.436 -3.065 1.00 0.00 H new ATOM 0 HD2 PRO A 13 12.872 8.328 -3.602 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.559 6.720 -3.713 1.00 0.00 H new ATOM 191 N MET A 14 13.884 8.671 1.552 1.00 0.00 N ATOM 192 CA MET A 14 13.301 9.400 2.674 1.00 0.00 C ATOM 193 C MET A 14 14.369 9.790 3.694 1.00 0.00 C ATOM 194 O MET A 14 14.113 10.577 4.606 1.00 0.00 O ATOM 195 CB MET A 14 12.224 8.546 3.346 1.00 0.00 C ATOM 196 CG MET A 14 11.469 9.256 4.461 1.00 0.00 C ATOM 197 SD MET A 14 10.370 10.551 3.853 1.00 0.00 S ATOM 198 CE MET A 14 11.492 11.942 3.759 1.00 0.00 C ATOM 0 H MET A 14 14.696 8.103 1.793 1.00 0.00 H new ATOM 0 HA MET A 14 12.851 10.315 2.288 1.00 0.00 H new ATOM 0 HB2 MET A 14 11.510 8.220 2.589 1.00 0.00 H new ATOM 0 HB3 MET A 14 12.690 7.648 3.752 1.00 0.00 H new ATOM 0 HG2 MET A 14 10.886 8.525 5.020 1.00 0.00 H new ATOM 0 HG3 MET A 14 12.185 9.692 5.157 1.00 0.00 H new ATOM 0 HE1 MET A 14 10.924 12.871 3.803 1.00 0.00 H new ATOM 0 HE2 MET A 14 12.190 11.904 4.595 1.00 0.00 H new ATOM 0 HE3 MET A 14 12.046 11.900 2.821 1.00 0.00 H new ATOM 208 N ASP A 15 15.566 9.243 3.531 1.00 0.00 N ATOM 209 CA ASP A 15 16.669 9.532 4.442 1.00 0.00 C ATOM 210 C ASP A 15 18.000 9.471 3.707 1.00 0.00 C ATOM 211 O ASP A 15 18.832 8.601 3.970 1.00 0.00 O ATOM 212 CB ASP A 15 16.670 8.543 5.607 1.00 0.00 C ATOM 213 CG ASP A 15 17.621 8.952 6.714 1.00 0.00 C ATOM 214 OD1 ASP A 15 17.189 9.684 7.628 1.00 0.00 O ATOM 215 OD2 ASP A 15 18.800 8.541 6.666 1.00 0.00 O ATOM 0 H ASP A 15 15.800 8.597 2.777 1.00 0.00 H new ATOM 0 HA ASP A 15 16.533 10.540 4.835 1.00 0.00 H new ATOM 0 HB2 ASP A 15 15.661 8.461 6.011 1.00 0.00 H new ATOM 0 HB3 ASP A 15 16.948 7.555 5.240 1.00 0.00 H new ATOM 220 N ILE A 16 18.189 10.396 2.776 1.00 0.00 N ATOM 221 CA ILE A 16 19.407 10.452 1.989 1.00 0.00 C ATOM 222 C ILE A 16 19.507 11.766 1.232 1.00 0.00 C ATOM 223 O ILE A 16 20.595 12.313 1.040 1.00 0.00 O ATOM 224 CB ILE A 16 19.446 9.283 0.993 1.00 0.00 C ATOM 225 CG1 ILE A 16 20.641 9.414 0.048 1.00 0.00 C ATOM 226 CG2 ILE A 16 18.141 9.222 0.215 1.00 0.00 C ATOM 227 CD1 ILE A 16 20.713 8.320 -0.997 1.00 0.00 C ATOM 0 H ILE A 16 17.508 11.121 2.549 1.00 0.00 H new ATOM 0 HA ILE A 16 20.253 10.378 2.672 1.00 0.00 H new ATOM 0 HB ILE A 16 19.564 8.353 1.548 1.00 0.00 H new ATOM 0 HG12 ILE A 16 20.592 10.381 -0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 16 21.560 9.405 0.635 1.00 0.00 H new ATOM 0 HG21 ILE A 16 18.176 8.391 -0.489 1.00 0.00 H new ATOM 0 HG22 ILE A 16 17.311 9.077 0.907 1.00 0.00 H new ATOM 0 HG23 ILE A 16 17.999 10.155 -0.331 1.00 0.00 H new ATOM 0 HD11 ILE A 16 21.586 8.479 -1.631 1.00 0.00 H new ATOM 0 HD12 ILE A 16 20.794 7.351 -0.504 1.00 0.00 H new ATOM 0 HD13 ILE A 16 19.811 8.342 -1.609 1.00 0.00 H new ATOM 239 N THR A 17 18.357 12.256 0.809 1.00 0.00 N ATOM 240 CA THR A 17 18.263 13.503 0.064 1.00 0.00 C ATOM 241 C THR A 17 18.987 13.380 -1.265 1.00 0.00 C ATOM 242 O THR A 17 19.220 14.368 -1.963 1.00 0.00 O ATOM 243 CB THR A 17 18.850 14.678 0.864 1.00 0.00 C ATOM 244 OG1 THR A 17 18.363 14.642 2.211 1.00 0.00 O ATOM 245 CG2 THR A 17 18.490 16.014 0.230 1.00 0.00 C ATOM 0 H THR A 17 17.458 11.802 0.971 1.00 0.00 H new ATOM 0 HA THR A 17 17.206 13.702 -0.115 1.00 0.00 H new ATOM 0 HB THR A 17 19.935 14.578 0.860 1.00 0.00 H new ATOM 0 HG1 THR A 17 18.742 15.392 2.716 1.00 0.00 H new ATOM 0 HG21 THR A 17 18.920 16.824 0.819 1.00 0.00 H new ATOM 0 HG22 THR A 17 18.886 16.054 -0.785 1.00 0.00 H new ATOM 0 HG23 THR A 17 17.406 16.122 0.201 1.00 0.00 H new ATOM 253 N LEU A 18 19.309 12.145 -1.602 1.00 0.00 N ATOM 254 CA LEU A 18 20.011 11.824 -2.829 1.00 0.00 C ATOM 255 C LEU A 18 21.025 12.910 -3.175 1.00 0.00 C ATOM 256 O LEU A 18 20.764 13.782 -4.004 1.00 0.00 O ATOM 257 CB LEU A 18 19.003 11.646 -3.959 1.00 0.00 C ATOM 258 CG LEU A 18 19.444 10.721 -5.099 1.00 0.00 C ATOM 259 CD1 LEU A 18 20.899 10.967 -5.457 1.00 0.00 C ATOM 260 CD2 LEU A 18 19.234 9.264 -4.713 1.00 0.00 C ATOM 0 H LEU A 18 19.089 11.331 -1.028 1.00 0.00 H new ATOM 0 HA LEU A 18 20.559 10.892 -2.690 1.00 0.00 H new ATOM 0 HB2 LEU A 18 18.076 11.257 -3.537 1.00 0.00 H new ATOM 0 HB3 LEU A 18 18.776 12.627 -4.378 1.00 0.00 H new ATOM 0 HG LEU A 18 18.832 10.941 -5.974 1.00 0.00 H new ATOM 0 HD11 LEU A 18 21.192 10.300 -6.268 1.00 0.00 H new ATOM 0 HD12 LEU A 18 21.026 12.002 -5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 18 21.525 10.775 -4.586 1.00 0.00 H new ATOM 0 HD21 LEU A 18 19.552 8.621 -5.533 1.00 0.00 H new ATOM 0 HD22 LEU A 18 19.821 9.035 -3.824 1.00 0.00 H new ATOM 0 HD23 LEU A 18 18.178 9.091 -4.505 1.00 0.00 H new ATOM 272 N THR A 19 22.180 12.849 -2.528 1.00 0.00 N ATOM 273 CA THR A 19 23.239 13.822 -2.749 1.00 0.00 C ATOM 274 C THR A 19 24.609 13.173 -2.608 1.00 0.00 C ATOM 275 O THR A 19 25.614 13.701 -3.084 1.00 0.00 O ATOM 276 CB THR A 19 23.125 14.995 -1.765 1.00 0.00 C ATOM 277 OG1 THR A 19 24.421 15.535 -1.479 1.00 0.00 O ATOM 278 CG2 THR A 19 22.457 14.537 -0.484 1.00 0.00 C ATOM 0 H THR A 19 22.408 12.130 -1.841 1.00 0.00 H new ATOM 0 HA THR A 19 23.127 14.202 -3.765 1.00 0.00 H new ATOM 0 HB THR A 19 22.516 15.775 -2.222 1.00 0.00 H new ATOM 0 HG1 THR A 19 24.333 16.283 -0.852 1.00 0.00 H new ATOM 0 HG21 THR A 19 22.381 15.377 0.207 1.00 0.00 H new ATOM 0 HG22 THR A 19 21.459 14.160 -0.709 1.00 0.00 H new ATOM 0 HG23 THR A 19 23.050 13.744 -0.028 1.00 0.00 H new ATOM 286 N GLU A 20 24.633 12.022 -1.948 1.00 0.00 N ATOM 287 CA GLU A 20 25.869 11.282 -1.737 1.00 0.00 C ATOM 288 C GLU A 20 26.196 10.439 -2.967 1.00 0.00 C ATOM 289 O GLU A 20 25.565 10.592 -4.014 1.00 0.00 O ATOM 290 CB GLU A 20 25.740 10.401 -0.493 1.00 0.00 C ATOM 291 CG GLU A 20 27.067 10.086 0.177 1.00 0.00 C ATOM 292 CD GLU A 20 26.894 9.517 1.572 1.00 0.00 C ATOM 293 OE1 GLU A 20 26.674 8.295 1.692 1.00 0.00 O ATOM 294 OE2 GLU A 20 26.977 10.297 2.544 1.00 0.00 O ATOM 0 H GLU A 20 23.806 11.580 -1.548 1.00 0.00 H new ATOM 0 HA GLU A 20 26.686 11.986 -1.581 1.00 0.00 H new ATOM 0 HB2 GLU A 20 25.089 10.898 0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 20 25.253 9.466 -0.770 1.00 0.00 H new ATOM 0 HG2 GLU A 20 27.620 9.374 -0.436 1.00 0.00 H new ATOM 0 HG3 GLU A 20 27.668 10.994 0.231 1.00 0.00 H new ATOM 301 N THR A 21 27.178 9.552 -2.844 1.00 0.00 N ATOM 302 CA THR A 21 27.576 8.706 -3.965 1.00 0.00 C ATOM 303 C THR A 21 27.708 7.240 -3.565 1.00 0.00 C ATOM 304 O THR A 21 27.202 6.353 -4.254 1.00 0.00 O ATOM 305 CB THR A 21 28.910 9.174 -4.567 1.00 0.00 C ATOM 306 OG1 THR A 21 29.866 9.400 -3.524 1.00 0.00 O ATOM 307 CG2 THR A 21 28.724 10.448 -5.378 1.00 0.00 C ATOM 0 H THR A 21 27.710 9.400 -1.987 1.00 0.00 H new ATOM 0 HA THR A 21 26.783 8.796 -4.707 1.00 0.00 H new ATOM 0 HB THR A 21 29.276 8.392 -5.232 1.00 0.00 H new ATOM 0 HG1 THR A 21 30.714 9.696 -3.916 1.00 0.00 H new ATOM 0 HG21 THR A 21 29.683 10.758 -5.793 1.00 0.00 H new ATOM 0 HG22 THR A 21 28.020 10.263 -6.189 1.00 0.00 H new ATOM 0 HG23 THR A 21 28.336 11.236 -4.733 1.00 0.00 H new ATOM 315 N ARG A 22 28.389 6.986 -2.455 1.00 0.00 N ATOM 316 CA ARG A 22 28.599 5.620 -1.982 1.00 0.00 C ATOM 317 C ARG A 22 28.082 5.454 -0.557 1.00 0.00 C ATOM 318 O ARG A 22 28.004 6.425 0.196 1.00 0.00 O ATOM 319 CB ARG A 22 30.078 5.268 -2.039 1.00 0.00 C ATOM 320 CG ARG A 22 30.676 5.383 -3.431 1.00 0.00 C ATOM 321 CD ARG A 22 32.164 5.069 -3.429 1.00 0.00 C ATOM 322 NE ARG A 22 32.896 5.907 -2.485 1.00 0.00 N ATOM 323 CZ ARG A 22 34.220 5.908 -2.373 1.00 0.00 C ATOM 324 NH1 ARG A 22 34.955 5.124 -3.149 1.00 0.00 N ATOM 325 NH2 ARG A 22 34.810 6.695 -1.484 1.00 0.00 N ATOM 0 H ARG A 22 28.806 7.706 -1.865 1.00 0.00 H new ATOM 0 HA ARG A 22 28.043 4.945 -2.633 1.00 0.00 H new ATOM 0 HB2 ARG A 22 30.626 5.924 -1.362 1.00 0.00 H new ATOM 0 HB3 ARG A 22 30.215 4.249 -1.677 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.160 4.700 -4.107 1.00 0.00 H new ATOM 0 HG3 ARG A 22 30.517 6.391 -3.814 1.00 0.00 H new ATOM 0 HD2 ARG A 22 32.313 4.020 -3.174 1.00 0.00 H new ATOM 0 HD3 ARG A 22 32.567 5.214 -4.431 1.00 0.00 H new ATOM 0 HE ARG A 22 32.361 6.527 -1.877 1.00 0.00 H new ATOM 0 HH11 ARG A 22 34.504 4.518 -3.834 1.00 0.00 H new ATOM 0 HH12 ARG A 22 35.971 5.127 -3.061 1.00 0.00 H new ATOM 0 HH21 ARG A 22 34.248 7.300 -0.886 1.00 0.00 H new ATOM 0 HH22 ARG A 22 35.826 6.695 -1.398 1.00 0.00 H new ATOM 339 N PHE A 23 27.735 4.222 -0.182 1.00 0.00 N ATOM 340 CA PHE A 23 27.210 3.918 1.149 1.00 0.00 C ATOM 341 C PHE A 23 27.733 2.563 1.618 1.00 0.00 C ATOM 342 O PHE A 23 27.310 1.523 1.118 1.00 0.00 O ATOM 343 CB PHE A 23 25.675 3.900 1.121 1.00 0.00 C ATOM 344 CG PHE A 23 25.055 5.203 0.699 1.00 0.00 C ATOM 345 CD1 PHE A 23 25.203 5.663 -0.598 1.00 0.00 C ATOM 346 CD2 PHE A 23 24.334 5.971 1.599 1.00 0.00 C ATOM 347 CE1 PHE A 23 24.652 6.861 -0.992 1.00 0.00 C ATOM 348 CE2 PHE A 23 23.774 7.173 1.208 1.00 0.00 C ATOM 349 CZ PHE A 23 23.934 7.619 -0.089 1.00 0.00 C ATOM 0 H PHE A 23 27.810 3.408 -0.792 1.00 0.00 H new ATOM 0 HA PHE A 23 27.543 4.690 1.842 1.00 0.00 H new ATOM 0 HB2 PHE A 23 25.344 3.115 0.441 1.00 0.00 H new ATOM 0 HB3 PHE A 23 25.307 3.639 2.113 1.00 0.00 H new ATOM 0 HD1 PHE A 23 25.759 5.073 -1.311 1.00 0.00 H new ATOM 0 HD2 PHE A 23 24.208 5.628 2.615 1.00 0.00 H new ATOM 0 HE1 PHE A 23 24.781 7.208 -2.007 1.00 0.00 H new ATOM 0 HE2 PHE A 23 23.212 7.763 1.917 1.00 0.00 H new ATOM 0 HZ PHE A 23 23.499 8.558 -0.396 1.00 0.00 H new ATOM 359 N LYS A 24 28.670 2.584 2.563 1.00 0.00 N ATOM 360 CA LYS A 24 29.246 1.354 3.104 1.00 0.00 C ATOM 361 C LYS A 24 28.161 0.395 3.552 1.00 0.00 C ATOM 362 O LYS A 24 26.980 0.731 3.551 1.00 0.00 O ATOM 363 CB LYS A 24 30.151 1.663 4.296 1.00 0.00 C ATOM 364 CG LYS A 24 29.595 2.728 5.229 1.00 0.00 C ATOM 365 CD LYS A 24 30.561 3.039 6.363 1.00 0.00 C ATOM 366 CE LYS A 24 30.776 1.834 7.265 1.00 0.00 C ATOM 367 NZ LYS A 24 29.518 1.407 7.936 1.00 0.00 N ATOM 0 H LYS A 24 29.047 3.440 2.971 1.00 0.00 H new ATOM 0 HA LYS A 24 29.830 0.891 2.308 1.00 0.00 H new ATOM 0 HB2 LYS A 24 30.315 0.747 4.863 1.00 0.00 H new ATOM 0 HB3 LYS A 24 31.124 1.988 3.927 1.00 0.00 H new ATOM 0 HG2 LYS A 24 29.392 3.638 4.664 1.00 0.00 H new ATOM 0 HG3 LYS A 24 28.645 2.390 5.642 1.00 0.00 H new ATOM 0 HD2 LYS A 24 31.517 3.359 5.949 1.00 0.00 H new ATOM 0 HD3 LYS A 24 30.175 3.870 6.952 1.00 0.00 H new ATOM 0 HE2 LYS A 24 31.171 1.006 6.676 1.00 0.00 H new ATOM 0 HE3 LYS A 24 31.525 2.075 8.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 29.748 0.874 8.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 28.956 2.246 8.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 28.969 0.802 7.292 1.00 0.00 H new ATOM 381 N THR A 25 28.565 -0.805 3.936 1.00 0.00 N ATOM 382 CA THR A 25 27.624 -1.786 4.423 1.00 0.00 C ATOM 383 C THR A 25 27.072 -1.312 5.764 1.00 0.00 C ATOM 384 O THR A 25 27.617 -0.384 6.363 1.00 0.00 O ATOM 385 CB THR A 25 28.287 -3.169 4.584 1.00 0.00 C ATOM 386 OG1 THR A 25 29.530 -3.040 5.283 1.00 0.00 O ATOM 387 CG2 THR A 25 28.524 -3.832 3.227 1.00 0.00 C ATOM 0 H THR A 25 29.536 -1.117 3.918 1.00 0.00 H new ATOM 0 HA THR A 25 26.817 -1.891 3.698 1.00 0.00 H new ATOM 0 HB THR A 25 27.610 -3.801 5.159 1.00 0.00 H new ATOM 0 HG1 THR A 25 29.943 -3.923 5.382 1.00 0.00 H new ATOM 0 HG21 THR A 25 28.992 -4.805 3.374 1.00 0.00 H new ATOM 0 HG22 THR A 25 27.571 -3.962 2.714 1.00 0.00 H new ATOM 0 HG23 THR A 25 29.178 -3.202 2.624 1.00 0.00 H new ATOM 395 N GLY A 26 26.004 -1.935 6.244 1.00 0.00 N ATOM 396 CA GLY A 26 25.414 -1.539 7.514 1.00 0.00 C ATOM 397 C GLY A 26 24.841 -0.125 7.498 1.00 0.00 C ATOM 398 O GLY A 26 24.163 0.278 8.443 1.00 0.00 O ATOM 0 H GLY A 26 25.532 -2.710 5.777 1.00 0.00 H new ATOM 0 HA2 GLY A 26 24.622 -2.242 7.774 1.00 0.00 H new ATOM 0 HA3 GLY A 26 26.171 -1.608 8.296 1.00 0.00 H new ATOM 402 N THR A 27 25.128 0.635 6.438 1.00 0.00 N ATOM 403 CA THR A 27 24.651 2.015 6.284 1.00 0.00 C ATOM 404 C THR A 27 23.132 2.097 6.110 1.00 0.00 C ATOM 405 O THR A 27 22.612 3.071 5.564 1.00 0.00 O ATOM 406 CB THR A 27 25.318 2.676 5.070 1.00 0.00 C ATOM 407 OG1 THR A 27 25.254 4.103 5.186 1.00 0.00 O ATOM 408 CG2 THR A 27 24.632 2.238 3.787 1.00 0.00 C ATOM 0 H THR A 27 25.700 0.311 5.658 1.00 0.00 H new ATOM 0 HA THR A 27 24.918 2.538 7.202 1.00 0.00 H new ATOM 0 HB THR A 27 26.362 2.365 5.039 1.00 0.00 H new ATOM 0 HG1 THR A 27 24.330 4.376 5.363 1.00 0.00 H new ATOM 0 HG21 THR A 27 25.116 2.715 2.935 1.00 0.00 H new ATOM 0 HG22 THR A 27 24.705 1.155 3.687 1.00 0.00 H new ATOM 0 HG23 THR A 27 23.582 2.529 3.818 1.00 0.00 H new ATOM 416 N THR A 28 22.443 1.078 6.598 1.00 0.00 N ATOM 417 CA THR A 28 20.985 0.973 6.512 1.00 0.00 C ATOM 418 C THR A 28 20.289 2.323 6.320 1.00 0.00 C ATOM 419 O THR A 28 20.469 3.248 7.111 1.00 0.00 O ATOM 420 CB THR A 28 20.418 0.312 7.777 1.00 0.00 C ATOM 421 OG1 THR A 28 21.076 -0.938 8.019 1.00 0.00 O ATOM 422 CG2 THR A 28 18.919 0.085 7.649 1.00 0.00 C ATOM 0 H THR A 28 22.881 0.288 7.072 1.00 0.00 H new ATOM 0 HA THR A 28 20.785 0.364 5.631 1.00 0.00 H new ATOM 0 HB THR A 28 20.596 0.984 8.617 1.00 0.00 H new ATOM 0 HG1 THR A 28 20.708 -1.350 8.828 1.00 0.00 H new ATOM 0 HG21 THR A 28 18.543 -0.384 8.558 1.00 0.00 H new ATOM 0 HG22 THR A 28 18.418 1.041 7.500 1.00 0.00 H new ATOM 0 HG23 THR A 28 18.721 -0.565 6.797 1.00 0.00 H new ATOM 430 N LEU A 29 19.488 2.414 5.262 1.00 0.00 N ATOM 431 CA LEU A 29 18.759 3.643 4.952 1.00 0.00 C ATOM 432 C LEU A 29 17.296 3.511 5.371 1.00 0.00 C ATOM 433 O LEU A 29 16.927 2.564 6.067 1.00 0.00 O ATOM 434 CB LEU A 29 18.852 3.972 3.458 1.00 0.00 C ATOM 435 CG LEU A 29 20.230 4.435 2.977 1.00 0.00 C ATOM 436 CD1 LEU A 29 21.165 3.247 2.815 1.00 0.00 C ATOM 437 CD2 LEU A 29 20.111 5.197 1.665 1.00 0.00 C ATOM 0 H LEU A 29 19.326 1.652 4.604 1.00 0.00 H new ATOM 0 HA LEU A 29 19.216 4.459 5.512 1.00 0.00 H new ATOM 0 HB2 LEU A 29 18.564 3.088 2.889 1.00 0.00 H new ATOM 0 HB3 LEU A 29 18.124 4.750 3.228 1.00 0.00 H new ATOM 0 HG LEU A 29 20.647 5.105 3.729 1.00 0.00 H new ATOM 0 HD11 LEU A 29 22.140 3.595 2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 29 21.277 2.739 3.773 1.00 0.00 H new ATOM 0 HD13 LEU A 29 20.750 2.554 2.083 1.00 0.00 H new ATOM 0 HD21 LEU A 29 21.101 5.518 1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.672 4.549 0.906 1.00 0.00 H new ATOM 0 HD23 LEU A 29 19.475 6.071 1.808 1.00 0.00 H new ATOM 449 N LYS A 30 16.465 4.459 4.948 1.00 0.00 N ATOM 450 CA LYS A 30 15.048 4.436 5.293 1.00 0.00 C ATOM 451 C LYS A 30 14.193 3.945 4.130 1.00 0.00 C ATOM 452 O LYS A 30 13.814 2.775 4.081 1.00 0.00 O ATOM 453 CB LYS A 30 14.583 5.825 5.731 1.00 0.00 C ATOM 454 CG LYS A 30 14.309 5.936 7.223 1.00 0.00 C ATOM 455 CD LYS A 30 13.130 5.072 7.647 1.00 0.00 C ATOM 456 CE LYS A 30 11.821 5.584 7.066 1.00 0.00 C ATOM 457 NZ LYS A 30 11.577 7.010 7.422 1.00 0.00 N ATOM 0 H LYS A 30 16.747 5.249 4.368 1.00 0.00 H new ATOM 0 HA LYS A 30 14.924 3.737 6.120 1.00 0.00 H new ATOM 0 HB2 LYS A 30 15.342 6.557 5.455 1.00 0.00 H new ATOM 0 HB3 LYS A 30 13.677 6.084 5.184 1.00 0.00 H new ATOM 0 HG2 LYS A 30 15.197 5.637 7.779 1.00 0.00 H new ATOM 0 HG3 LYS A 30 14.108 6.976 7.479 1.00 0.00 H new ATOM 0 HD2 LYS A 30 13.296 4.045 7.322 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.064 5.055 8.735 1.00 0.00 H new ATOM 0 HE2 LYS A 30 11.839 5.478 5.981 1.00 0.00 H new ATOM 0 HE3 LYS A 30 10.997 4.972 7.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 10.568 7.231 7.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 11.849 7.172 8.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 12.144 7.624 6.803 1.00 0.00 H new ATOM 471 N TYR A 31 13.890 4.849 3.199 1.00 0.00 N ATOM 472 CA TYR A 31 13.067 4.517 2.041 1.00 0.00 C ATOM 473 C TYR A 31 11.636 4.197 2.463 1.00 0.00 C ATOM 474 O TYR A 31 11.409 3.496 3.450 1.00 0.00 O ATOM 475 CB TYR A 31 13.671 3.344 1.266 1.00 0.00 C ATOM 476 CG TYR A 31 14.827 3.743 0.378 1.00 0.00 C ATOM 477 CD1 TYR A 31 16.103 3.910 0.899 1.00 0.00 C ATOM 478 CD2 TYR A 31 14.639 3.956 -0.982 1.00 0.00 C ATOM 479 CE1 TYR A 31 17.161 4.278 0.089 1.00 0.00 C ATOM 480 CE2 TYR A 31 15.690 4.324 -1.797 1.00 0.00 C ATOM 481 CZ TYR A 31 16.948 4.484 -1.258 1.00 0.00 C ATOM 482 OH TYR A 31 17.997 4.851 -2.067 1.00 0.00 O ATOM 0 H TYR A 31 14.204 5.819 3.226 1.00 0.00 H new ATOM 0 HA TYR A 31 13.043 5.388 1.385 1.00 0.00 H new ATOM 0 HB2 TYR A 31 14.010 2.587 1.973 1.00 0.00 H new ATOM 0 HB3 TYR A 31 12.895 2.884 0.655 1.00 0.00 H new ATOM 0 HD1 TYR A 31 16.272 3.750 1.954 1.00 0.00 H new ATOM 0 HD2 TYR A 31 13.654 3.832 -1.408 1.00 0.00 H new ATOM 0 HE1 TYR A 31 18.148 4.403 0.508 1.00 0.00 H new ATOM 0 HE2 TYR A 31 15.527 4.486 -2.852 1.00 0.00 H new ATOM 0 HH TYR A 31 18.646 5.369 -1.546 1.00 0.00 H new ATOM 492 N THR A 32 10.673 4.716 1.707 1.00 0.00 N ATOM 493 CA THR A 32 9.262 4.499 2.002 1.00 0.00 C ATOM 494 C THR A 32 8.531 3.921 0.796 1.00 0.00 C ATOM 495 O THR A 32 8.667 4.416 -0.323 1.00 0.00 O ATOM 496 CB THR A 32 8.574 5.807 2.433 1.00 0.00 C ATOM 497 OG1 THR A 32 7.157 5.615 2.516 1.00 0.00 O ATOM 498 CG2 THR A 32 8.884 6.931 1.455 1.00 0.00 C ATOM 0 H THR A 32 10.846 5.292 0.883 1.00 0.00 H new ATOM 0 HA THR A 32 9.214 3.785 2.824 1.00 0.00 H new ATOM 0 HB THR A 32 8.958 6.085 3.414 1.00 0.00 H new ATOM 0 HG1 THR A 32 6.729 6.452 2.792 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.387 7.844 1.781 1.00 0.00 H new ATOM 0 HG22 THR A 32 9.961 7.097 1.420 1.00 0.00 H new ATOM 0 HG23 THR A 32 8.527 6.658 0.462 1.00 0.00 H new ATOM 506 N CYS A 33 7.748 2.873 1.033 1.00 0.00 N ATOM 507 CA CYS A 33 7.002 2.210 -0.030 1.00 0.00 C ATOM 508 C CYS A 33 5.789 3.032 -0.473 1.00 0.00 C ATOM 509 O CYS A 33 5.002 3.527 0.335 1.00 0.00 O ATOM 510 CB CYS A 33 6.553 0.823 0.437 1.00 0.00 C ATOM 511 SG CYS A 33 7.906 -0.389 0.598 1.00 0.00 S ATOM 0 H CYS A 33 7.614 2.463 1.957 1.00 0.00 H new ATOM 0 HA CYS A 33 7.665 2.111 -0.890 1.00 0.00 H new ATOM 0 HB2 CYS A 33 6.052 0.921 1.400 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.816 0.436 -0.267 1.00 0.00 H new ATOM 516 N LEU A 34 5.683 3.152 -1.798 1.00 0.00 N ATOM 517 CA LEU A 34 4.624 3.923 -2.447 1.00 0.00 C ATOM 518 C LEU A 34 3.237 3.505 -1.958 1.00 0.00 C ATOM 519 O LEU A 34 3.064 2.414 -1.416 1.00 0.00 O ATOM 520 CB LEU A 34 4.720 3.772 -3.967 1.00 0.00 C ATOM 521 CG LEU A 34 6.016 4.304 -4.588 1.00 0.00 C ATOM 522 CD1 LEU A 34 6.042 4.026 -6.083 1.00 0.00 C ATOM 523 CD2 LEU A 34 6.165 5.795 -4.322 1.00 0.00 C ATOM 0 H LEU A 34 6.332 2.715 -2.452 1.00 0.00 H new ATOM 0 HA LEU A 34 4.764 4.970 -2.180 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.620 2.716 -4.220 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.876 4.290 -4.423 1.00 0.00 H new ATOM 0 HG LEU A 34 6.856 3.787 -4.125 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.969 4.410 -6.508 1.00 0.00 H new ATOM 0 HD12 LEU A 34 5.982 2.951 -6.254 1.00 0.00 H new ATOM 0 HD13 LEU A 34 5.193 4.517 -6.559 1.00 0.00 H new ATOM 0 HD21 LEU A 34 7.091 6.154 -4.771 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.320 6.329 -4.758 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.190 5.972 -3.247 1.00 0.00 H new ATOM 535 N PRO A 35 2.230 4.385 -2.139 1.00 0.00 N ATOM 536 CA PRO A 35 0.850 4.116 -1.715 1.00 0.00 C ATOM 537 C PRO A 35 0.316 2.787 -2.241 1.00 0.00 C ATOM 538 O PRO A 35 0.004 2.649 -3.424 1.00 0.00 O ATOM 539 CB PRO A 35 0.058 5.283 -2.307 1.00 0.00 C ATOM 540 CG PRO A 35 1.052 6.383 -2.441 1.00 0.00 C ATOM 541 CD PRO A 35 2.360 5.717 -2.763 1.00 0.00 C ATOM 0 HA PRO A 35 0.774 4.036 -0.631 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.374 5.019 -3.272 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -0.768 5.572 -1.657 1.00 0.00 H new ATOM 0 HG2 PRO A 35 0.762 7.078 -3.230 1.00 0.00 H new ATOM 0 HG3 PRO A 35 1.124 6.960 -1.519 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.519 5.643 -3.839 1.00 0.00 H new ATOM 0 HD3 PRO A 35 3.204 6.272 -2.354 1.00 0.00 H new ATOM 549 N GLY A 36 0.223 1.814 -1.343 1.00 0.00 N ATOM 550 CA GLY A 36 -0.281 0.504 -1.714 1.00 0.00 C ATOM 551 C GLY A 36 0.732 -0.586 -1.441 1.00 0.00 C ATOM 552 O GLY A 36 0.369 -1.716 -1.120 1.00 0.00 O ATOM 0 H GLY A 36 0.488 1.908 -0.363 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -1.196 0.296 -1.160 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.542 0.501 -2.772 1.00 0.00 H new ATOM 556 N TYR A 37 2.008 -0.236 -1.573 1.00 0.00 N ATOM 557 CA TYR A 37 3.080 -1.191 -1.319 1.00 0.00 C ATOM 558 C TYR A 37 3.036 -1.613 0.139 1.00 0.00 C ATOM 559 O TYR A 37 3.717 -1.023 0.978 1.00 0.00 O ATOM 560 CB TYR A 37 4.452 -0.575 -1.625 1.00 0.00 C ATOM 561 CG TYR A 37 4.901 -0.704 -3.061 1.00 0.00 C ATOM 562 CD1 TYR A 37 5.331 -1.924 -3.569 1.00 0.00 C ATOM 563 CD2 TYR A 37 4.890 0.394 -3.912 1.00 0.00 C ATOM 564 CE1 TYR A 37 5.735 -2.045 -4.886 1.00 0.00 C ATOM 565 CE2 TYR A 37 5.292 0.281 -5.229 1.00 0.00 C ATOM 566 CZ TYR A 37 5.713 -0.940 -5.712 1.00 0.00 C ATOM 567 OH TYR A 37 6.114 -1.057 -7.022 1.00 0.00 O ATOM 0 H TYR A 37 2.323 0.693 -1.852 1.00 0.00 H new ATOM 0 HA TYR A 37 2.936 -2.054 -1.969 1.00 0.00 H new ATOM 0 HB2 TYR A 37 4.426 0.482 -1.361 1.00 0.00 H new ATOM 0 HB3 TYR A 37 5.197 -1.046 -0.983 1.00 0.00 H new ATOM 0 HD1 TYR A 37 5.350 -2.791 -2.925 1.00 0.00 H new ATOM 0 HD2 TYR A 37 4.562 1.352 -3.538 1.00 0.00 H new ATOM 0 HE1 TYR A 37 6.066 -3.000 -5.266 1.00 0.00 H new ATOM 0 HE2 TYR A 37 5.277 1.145 -5.877 1.00 0.00 H new ATOM 0 HH TYR A 37 6.781 -0.368 -7.223 1.00 0.00 H new ATOM 577 N VAL A 38 2.227 -2.622 0.455 1.00 0.00 N ATOM 578 CA VAL A 38 2.056 -3.136 1.801 1.00 0.00 C ATOM 579 C VAL A 38 3.106 -4.188 2.130 1.00 0.00 C ATOM 580 O VAL A 38 3.546 -4.927 1.253 1.00 0.00 O ATOM 581 CB VAL A 38 0.649 -3.762 1.929 1.00 0.00 C ATOM 582 CG1 VAL A 38 0.655 -4.983 2.831 1.00 0.00 C ATOM 583 CG2 VAL A 38 -0.365 -2.737 2.402 1.00 0.00 C ATOM 0 H VAL A 38 1.662 -3.112 -0.238 1.00 0.00 H new ATOM 0 HA VAL A 38 2.171 -2.309 2.502 1.00 0.00 H new ATOM 0 HB VAL A 38 0.352 -4.096 0.935 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.353 -5.393 2.895 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.328 -5.736 2.420 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.994 -4.698 3.827 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.346 -3.206 2.483 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.065 -2.352 3.377 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.413 -1.916 1.687 1.00 0.00 H new ATOM 593 N ARG A 39 3.499 -4.260 3.395 1.00 0.00 N ATOM 594 CA ARG A 39 4.504 -5.222 3.815 1.00 0.00 C ATOM 595 C ARG A 39 3.907 -6.611 4.004 1.00 0.00 C ATOM 596 O ARG A 39 2.725 -6.759 4.313 1.00 0.00 O ATOM 597 CB ARG A 39 5.179 -4.767 5.109 1.00 0.00 C ATOM 598 CG ARG A 39 4.242 -4.728 6.305 1.00 0.00 C ATOM 599 CD ARG A 39 5.008 -4.549 7.605 1.00 0.00 C ATOM 600 NE ARG A 39 5.926 -5.658 7.856 1.00 0.00 N ATOM 601 CZ ARG A 39 6.714 -5.737 8.924 1.00 0.00 C ATOM 602 NH1 ARG A 39 6.696 -4.776 9.838 1.00 0.00 N ATOM 603 NH2 ARG A 39 7.521 -6.778 9.080 1.00 0.00 N ATOM 0 H ARG A 39 3.139 -3.667 4.142 1.00 0.00 H new ATOM 0 HA ARG A 39 5.250 -5.278 3.023 1.00 0.00 H new ATOM 0 HB2 ARG A 39 6.009 -5.438 5.331 1.00 0.00 H new ATOM 0 HB3 ARG A 39 5.603 -3.774 4.958 1.00 0.00 H new ATOM 0 HG2 ARG A 39 3.530 -3.911 6.185 1.00 0.00 H new ATOM 0 HG3 ARG A 39 3.664 -5.651 6.346 1.00 0.00 H new ATOM 0 HD2 ARG A 39 5.569 -3.615 7.570 1.00 0.00 H new ATOM 0 HD3 ARG A 39 4.304 -4.467 8.433 1.00 0.00 H new ATOM 0 HE ARG A 39 5.964 -6.415 7.173 1.00 0.00 H new ATOM 0 HH11 ARG A 39 6.077 -3.974 9.723 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.302 -4.839 10.656 1.00 0.00 H new ATOM 0 HH21 ARG A 39 7.538 -7.520 8.380 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.125 -6.837 9.900 1.00 0.00 H new ATOM 617 N SER A 40 4.746 -7.621 3.812 1.00 0.00 N ATOM 618 CA SER A 40 4.334 -9.010 3.955 1.00 0.00 C ATOM 619 C SER A 40 5.557 -9.919 3.975 1.00 0.00 C ATOM 620 O SER A 40 5.439 -11.137 4.112 1.00 0.00 O ATOM 621 CB SER A 40 3.400 -9.410 2.810 1.00 0.00 C ATOM 622 OG SER A 40 2.973 -10.754 2.945 1.00 0.00 O ATOM 0 H SER A 40 5.726 -7.501 3.554 1.00 0.00 H new ATOM 0 HA SER A 40 3.796 -9.119 4.897 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.533 -8.750 2.796 1.00 0.00 H new ATOM 0 HB3 SER A 40 3.913 -9.282 1.857 1.00 0.00 H new ATOM 0 HG SER A 40 3.696 -11.290 3.333 1.00 0.00 H new ATOM 628 N HIS A 41 6.732 -9.311 3.835 1.00 0.00 N ATOM 629 CA HIS A 41 7.988 -10.052 3.833 1.00 0.00 C ATOM 630 C HIS A 41 9.108 -9.241 4.468 1.00 0.00 C ATOM 631 O HIS A 41 9.111 -8.013 4.407 1.00 0.00 O ATOM 632 CB HIS A 41 8.385 -10.424 2.407 1.00 0.00 C ATOM 633 CG HIS A 41 7.502 -11.462 1.787 1.00 0.00 C ATOM 634 ND1 HIS A 41 6.385 -11.153 1.039 1.00 0.00 N ATOM 635 CD2 HIS A 41 7.577 -12.815 1.805 1.00 0.00 C ATOM 636 CE1 HIS A 41 5.810 -12.268 0.626 1.00 0.00 C ATOM 637 NE2 HIS A 41 6.513 -13.290 1.078 1.00 0.00 N ATOM 0 H HIS A 41 6.839 -8.303 3.721 1.00 0.00 H new ATOM 0 HA HIS A 41 7.835 -10.958 4.419 1.00 0.00 H new ATOM 0 HB2 HIS A 41 8.366 -9.527 1.788 1.00 0.00 H new ATOM 0 HB3 HIS A 41 9.412 -10.788 2.409 1.00 0.00 H new ATOM 0 HD2 HIS A 41 8.332 -13.409 2.299 1.00 0.00 H new ATOM 0 HE1 HIS A 41 4.917 -12.333 0.022 1.00 0.00 H new ATOM 0 HE2 HIS A 41 6.300 -14.274 0.914 1.00 0.00 H new ATOM 646 N SER A 42 10.063 -9.945 5.066 1.00 0.00 N ATOM 647 CA SER A 42 11.208 -9.314 5.707 1.00 0.00 C ATOM 648 C SER A 42 10.786 -8.152 6.599 1.00 0.00 C ATOM 649 O SER A 42 10.381 -8.355 7.744 1.00 0.00 O ATOM 650 CB SER A 42 12.210 -8.835 4.654 1.00 0.00 C ATOM 651 OG SER A 42 12.658 -9.915 3.854 1.00 0.00 O ATOM 0 H SER A 42 10.065 -10.964 5.119 1.00 0.00 H new ATOM 0 HA SER A 42 11.684 -10.062 6.340 1.00 0.00 H new ATOM 0 HB2 SER A 42 11.746 -8.078 4.022 1.00 0.00 H new ATOM 0 HB3 SER A 42 13.061 -8.363 5.144 1.00 0.00 H new ATOM 0 HG SER A 42 13.637 -9.907 3.812 1.00 0.00 H new ATOM 657 N THR A 43 10.863 -6.939 6.060 1.00 0.00 N ATOM 658 CA THR A 43 10.511 -5.737 6.818 1.00 0.00 C ATOM 659 C THR A 43 10.398 -4.509 5.912 1.00 0.00 C ATOM 660 O THR A 43 9.415 -4.350 5.190 1.00 0.00 O ATOM 661 CB THR A 43 11.554 -5.442 7.911 1.00 0.00 C ATOM 662 OG1 THR A 43 11.867 -6.630 8.646 1.00 0.00 O ATOM 663 CG2 THR A 43 11.050 -4.372 8.869 1.00 0.00 C ATOM 0 H THR A 43 11.165 -6.760 5.102 1.00 0.00 H new ATOM 0 HA THR A 43 9.542 -5.936 7.277 1.00 0.00 H new ATOM 0 HB THR A 43 12.455 -5.079 7.417 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.077 -7.208 8.685 1.00 0.00 H new ATOM 0 HG21 THR A 43 11.805 -4.182 9.632 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.852 -3.453 8.317 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.131 -4.714 9.345 1.00 0.00 H new ATOM 671 N GLN A 44 11.419 -3.643 5.968 1.00 0.00 N ATOM 672 CA GLN A 44 11.458 -2.419 5.164 1.00 0.00 C ATOM 673 C GLN A 44 12.695 -1.585 5.497 1.00 0.00 C ATOM 674 O GLN A 44 12.693 -0.821 6.463 1.00 0.00 O ATOM 675 CB GLN A 44 10.197 -1.580 5.390 1.00 0.00 C ATOM 676 CG GLN A 44 10.141 -0.324 4.536 1.00 0.00 C ATOM 677 CD GLN A 44 8.882 0.487 4.771 1.00 0.00 C ATOM 678 OE1 GLN A 44 7.862 0.278 4.111 1.00 0.00 O ATOM 679 NE2 GLN A 44 8.946 1.421 5.713 1.00 0.00 N ATOM 0 H GLN A 44 12.234 -3.772 6.568 1.00 0.00 H new ATOM 0 HA GLN A 44 11.505 -2.715 4.116 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.320 -2.192 5.179 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.142 -1.297 6.441 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.012 0.295 4.750 1.00 0.00 H new ATOM 0 HG3 GLN A 44 10.198 -0.602 3.484 1.00 0.00 H new ATOM 0 HE21 GLN A 44 9.811 1.560 6.235 1.00 0.00 H new ATOM 0 HE22 GLN A 44 8.130 1.999 5.914 1.00 0.00 H new ATOM 688 N THR A 45 13.743 -1.734 4.687 1.00 0.00 N ATOM 689 CA THR A 45 14.993 -0.998 4.880 1.00 0.00 C ATOM 690 C THR A 45 15.992 -1.326 3.774 1.00 0.00 C ATOM 691 O THR A 45 16.032 -2.451 3.277 1.00 0.00 O ATOM 692 CB THR A 45 15.643 -1.306 6.244 1.00 0.00 C ATOM 693 OG1 THR A 45 15.137 -2.539 6.766 1.00 0.00 O ATOM 694 CG2 THR A 45 15.390 -0.180 7.237 1.00 0.00 C ATOM 0 H THR A 45 13.751 -2.363 3.884 1.00 0.00 H new ATOM 0 HA THR A 45 14.737 0.061 4.848 1.00 0.00 H new ATOM 0 HB THR A 45 16.719 -1.395 6.093 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.558 -2.725 7.631 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.859 -0.423 8.190 1.00 0.00 H new ATOM 0 HG22 THR A 45 15.813 0.748 6.851 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.317 -0.057 7.382 1.00 0.00 H new ATOM 702 N LEU A 46 16.797 -0.338 3.394 1.00 0.00 N ATOM 703 CA LEU A 46 17.793 -0.518 2.342 1.00 0.00 C ATOM 704 C LEU A 46 19.206 -0.403 2.906 1.00 0.00 C ATOM 705 O LEU A 46 19.692 0.695 3.160 1.00 0.00 O ATOM 706 CB LEU A 46 17.596 0.521 1.235 1.00 0.00 C ATOM 707 CG LEU A 46 17.114 -0.037 -0.104 1.00 0.00 C ATOM 708 CD1 LEU A 46 17.095 1.058 -1.157 1.00 0.00 C ATOM 709 CD2 LEU A 46 17.996 -1.192 -0.549 1.00 0.00 C ATOM 0 H LEU A 46 16.779 0.598 3.800 1.00 0.00 H new ATOM 0 HA LEU A 46 17.662 -1.516 1.924 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.877 1.264 1.580 1.00 0.00 H new ATOM 0 HB3 LEU A 46 18.540 1.041 1.075 1.00 0.00 H new ATOM 0 HG LEU A 46 16.098 -0.412 0.022 1.00 0.00 H new ATOM 0 HD11 LEU A 46 16.750 0.645 -2.105 1.00 0.00 H new ATOM 0 HD12 LEU A 46 16.422 1.855 -0.841 1.00 0.00 H new ATOM 0 HD13 LEU A 46 18.100 1.461 -1.281 1.00 0.00 H new ATOM 0 HD21 LEU A 46 17.638 -1.576 -1.504 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.023 -0.844 -0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 46 17.961 -1.985 0.198 1.00 0.00 H new ATOM 721 N THR A 47 19.863 -1.544 3.091 1.00 0.00 N ATOM 722 CA THR A 47 21.222 -1.567 3.625 1.00 0.00 C ATOM 723 C THR A 47 22.185 -2.218 2.647 1.00 0.00 C ATOM 724 O THR A 47 21.787 -3.058 1.839 1.00 0.00 O ATOM 725 CB THR A 47 21.294 -2.350 4.947 1.00 0.00 C ATOM 726 OG1 THR A 47 20.159 -2.044 5.765 1.00 0.00 O ATOM 727 CG2 THR A 47 22.572 -2.017 5.699 1.00 0.00 C ATOM 0 H THR A 47 19.477 -2.464 2.879 1.00 0.00 H new ATOM 0 HA THR A 47 21.504 -0.528 3.794 1.00 0.00 H new ATOM 0 HB THR A 47 21.292 -3.415 4.714 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.437 -1.990 6.703 1.00 0.00 H new ATOM 0 HG21 THR A 47 22.603 -2.581 6.631 1.00 0.00 H new ATOM 0 HG22 THR A 47 23.434 -2.281 5.086 1.00 0.00 H new ATOM 0 HG23 THR A 47 22.597 -0.950 5.920 1.00 0.00 H new ATOM 735 N CYS A 48 23.456 -1.834 2.723 1.00 0.00 N ATOM 736 CA CYS A 48 24.462 -2.417 1.859 1.00 0.00 C ATOM 737 C CYS A 48 24.948 -3.718 2.471 1.00 0.00 C ATOM 738 O CYS A 48 25.438 -3.758 3.599 1.00 0.00 O ATOM 739 CB CYS A 48 25.621 -1.450 1.645 1.00 0.00 C ATOM 740 SG CYS A 48 25.406 -0.351 0.213 1.00 0.00 S ATOM 0 H CYS A 48 23.806 -1.127 3.370 1.00 0.00 H new ATOM 0 HA CYS A 48 24.023 -2.621 0.882 1.00 0.00 H new ATOM 0 HB2 CYS A 48 25.745 -0.843 2.542 1.00 0.00 H new ATOM 0 HB3 CYS A 48 26.540 -2.022 1.517 1.00 0.00 H new ATOM 745 N ASN A 49 24.794 -4.778 1.699 1.00 0.00 N ATOM 746 CA ASN A 49 25.261 -6.090 2.104 1.00 0.00 C ATOM 747 C ASN A 49 26.583 -6.388 1.404 1.00 0.00 C ATOM 748 O ASN A 49 27.062 -5.576 0.612 1.00 0.00 O ATOM 749 CB ASN A 49 24.215 -7.151 1.762 1.00 0.00 C ATOM 750 CG ASN A 49 23.727 -7.034 0.335 1.00 0.00 C ATOM 751 OD1 ASN A 49 24.069 -7.850 -0.518 1.00 0.00 O ATOM 752 ND2 ASN A 49 22.930 -6.010 0.065 1.00 0.00 N ATOM 0 H ASN A 49 24.346 -4.755 0.783 1.00 0.00 H new ATOM 0 HA ASN A 49 25.417 -6.107 3.183 1.00 0.00 H new ATOM 0 HB2 ASN A 49 24.641 -8.142 1.918 1.00 0.00 H new ATOM 0 HB3 ASN A 49 23.369 -7.057 2.442 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.575 -5.876 -0.882 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.671 -5.356 0.804 1.00 0.00 H new ATOM 759 N SER A 50 27.172 -7.541 1.686 1.00 0.00 N ATOM 760 CA SER A 50 28.437 -7.911 1.060 1.00 0.00 C ATOM 761 C SER A 50 28.158 -8.564 -0.292 1.00 0.00 C ATOM 762 O SER A 50 28.405 -9.751 -0.502 1.00 0.00 O ATOM 763 CB SER A 50 29.230 -8.853 1.965 1.00 0.00 C ATOM 764 OG SER A 50 30.418 -9.292 1.331 1.00 0.00 O ATOM 0 H SER A 50 26.800 -8.232 2.338 1.00 0.00 H new ATOM 0 HA SER A 50 29.039 -7.015 0.906 1.00 0.00 H new ATOM 0 HB2 SER A 50 29.478 -8.344 2.896 1.00 0.00 H new ATOM 0 HB3 SER A 50 28.615 -9.714 2.227 1.00 0.00 H new ATOM 0 HG SER A 50 30.907 -9.892 1.932 1.00 0.00 H new ATOM 770 N ASP A 51 27.629 -7.747 -1.195 1.00 0.00 N ATOM 771 CA ASP A 51 27.268 -8.172 -2.544 1.00 0.00 C ATOM 772 C ASP A 51 27.341 -6.996 -3.509 1.00 0.00 C ATOM 773 O ASP A 51 27.049 -7.131 -4.698 1.00 0.00 O ATOM 774 CB ASP A 51 25.849 -8.733 -2.551 1.00 0.00 C ATOM 775 CG ASP A 51 25.569 -9.586 -3.773 1.00 0.00 C ATOM 776 OD1 ASP A 51 25.333 -9.014 -4.857 1.00 0.00 O ATOM 777 OD2 ASP A 51 25.585 -10.828 -3.646 1.00 0.00 O ATOM 0 H ASP A 51 27.437 -6.762 -1.011 1.00 0.00 H new ATOM 0 HA ASP A 51 27.971 -8.942 -2.861 1.00 0.00 H new ATOM 0 HB2 ASP A 51 25.693 -9.329 -1.652 1.00 0.00 H new ATOM 0 HB3 ASP A 51 25.136 -7.910 -2.515 1.00 0.00 H new ATOM 782 N GLY A 52 27.743 -5.845 -2.984 1.00 0.00 N ATOM 783 CA GLY A 52 27.816 -4.651 -3.806 1.00 0.00 C ATOM 784 C GLY A 52 26.476 -4.318 -4.433 1.00 0.00 C ATOM 785 O GLY A 52 26.380 -3.547 -5.387 1.00 0.00 O ATOM 0 H GLY A 52 28.018 -5.717 -2.010 1.00 0.00 H new ATOM 0 HA2 GLY A 52 28.152 -3.811 -3.198 1.00 0.00 H new ATOM 0 HA3 GLY A 52 28.559 -4.794 -4.590 1.00 0.00 H new ATOM 789 N GLU A 53 25.448 -4.927 -3.858 1.00 0.00 N ATOM 790 CA GLU A 53 24.079 -4.698 -4.292 1.00 0.00 C ATOM 791 C GLU A 53 23.217 -4.336 -3.095 1.00 0.00 C ATOM 792 O GLU A 53 23.583 -4.614 -1.956 1.00 0.00 O ATOM 793 CB GLU A 53 23.507 -5.936 -4.990 1.00 0.00 C ATOM 794 CG GLU A 53 22.891 -6.949 -4.033 1.00 0.00 C ATOM 795 CD GLU A 53 22.156 -8.062 -4.752 1.00 0.00 C ATOM 796 OE1 GLU A 53 20.960 -7.879 -5.063 1.00 0.00 O ATOM 797 OE2 GLU A 53 22.772 -9.119 -5.001 1.00 0.00 O ATOM 0 H GLU A 53 25.539 -5.587 -3.086 1.00 0.00 H new ATOM 0 HA GLU A 53 24.078 -3.875 -5.006 1.00 0.00 H new ATOM 0 HB2 GLU A 53 22.750 -5.620 -5.708 1.00 0.00 H new ATOM 0 HB3 GLU A 53 24.301 -6.422 -5.557 1.00 0.00 H new ATOM 0 HG2 GLU A 53 23.676 -7.380 -3.412 1.00 0.00 H new ATOM 0 HG3 GLU A 53 22.200 -6.437 -3.363 1.00 0.00 H new ATOM 804 N TRP A 54 22.083 -3.706 -3.350 1.00 0.00 N ATOM 805 CA TRP A 54 21.181 -3.329 -2.288 1.00 0.00 C ATOM 806 C TRP A 54 20.196 -4.455 -2.006 1.00 0.00 C ATOM 807 O TRP A 54 19.321 -4.763 -2.814 1.00 0.00 O ATOM 808 CB TRP A 54 20.451 -2.051 -2.683 1.00 0.00 C ATOM 809 CG TRP A 54 21.380 -0.907 -2.955 1.00 0.00 C ATOM 810 CD1 TRP A 54 21.902 -0.533 -4.161 1.00 0.00 C ATOM 811 CD2 TRP A 54 21.908 0.003 -1.990 1.00 0.00 C ATOM 812 NE1 TRP A 54 22.719 0.562 -4.000 1.00 0.00 N ATOM 813 CE2 TRP A 54 22.738 0.909 -2.675 1.00 0.00 C ATOM 814 CE3 TRP A 54 21.752 0.137 -0.614 1.00 0.00 C ATOM 815 CZ2 TRP A 54 23.413 1.938 -2.020 1.00 0.00 C ATOM 816 CZ3 TRP A 54 22.419 1.156 0.037 1.00 0.00 C ATOM 817 CH2 TRP A 54 23.241 2.046 -0.667 1.00 0.00 C ATOM 0 H TRP A 54 21.770 -3.447 -4.285 1.00 0.00 H new ATOM 0 HA TRP A 54 21.747 -3.146 -1.374 1.00 0.00 H new ATOM 0 HB2 TRP A 54 19.849 -2.242 -3.571 1.00 0.00 H new ATOM 0 HB3 TRP A 54 19.762 -1.771 -1.886 1.00 0.00 H new ATOM 0 HD1 TRP A 54 21.703 -1.024 -5.102 1.00 0.00 H new ATOM 0 HE1 TRP A 54 23.227 1.038 -4.745 1.00 0.00 H new ATOM 0 HE3 TRP A 54 21.120 -0.545 -0.064 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 24.048 2.624 -2.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 22.305 1.269 1.105 1.00 0.00 H new ATOM 0 HH2 TRP A 54 23.749 2.834 -0.130 1.00 0.00 H new ATOM 828 N VAL A 55 20.369 -5.061 -0.835 1.00 0.00 N ATOM 829 CA VAL A 55 19.535 -6.167 -0.388 1.00 0.00 C ATOM 830 C VAL A 55 18.411 -5.620 0.476 1.00 0.00 C ATOM 831 O VAL A 55 18.624 -4.678 1.240 1.00 0.00 O ATOM 832 CB VAL A 55 20.358 -7.181 0.438 1.00 0.00 C ATOM 833 CG1 VAL A 55 19.529 -7.774 1.563 1.00 0.00 C ATOM 834 CG2 VAL A 55 20.913 -8.278 -0.454 1.00 0.00 C ATOM 0 H VAL A 55 21.095 -4.796 -0.169 1.00 0.00 H new ATOM 0 HA VAL A 55 19.133 -6.677 -1.263 1.00 0.00 H new ATOM 0 HB VAL A 55 21.195 -6.645 0.885 1.00 0.00 H new ATOM 0 HG11 VAL A 55 20.135 -8.484 2.126 1.00 0.00 H new ATOM 0 HG12 VAL A 55 19.193 -6.977 2.226 1.00 0.00 H new ATOM 0 HG13 VAL A 55 18.663 -8.288 1.145 1.00 0.00 H new ATOM 0 HG21 VAL A 55 21.489 -8.980 0.149 1.00 0.00 H new ATOM 0 HG22 VAL A 55 20.090 -8.804 -0.938 1.00 0.00 H new ATOM 0 HG23 VAL A 55 21.559 -7.837 -1.214 1.00 0.00 H new ATOM 844 N TYR A 56 17.221 -6.201 0.370 1.00 0.00 N ATOM 845 CA TYR A 56 16.114 -5.728 1.192 1.00 0.00 C ATOM 846 C TYR A 56 14.842 -6.542 0.989 1.00 0.00 C ATOM 847 O TYR A 56 13.804 -6.243 1.581 1.00 0.00 O ATOM 848 CB TYR A 56 15.822 -4.267 0.852 1.00 0.00 C ATOM 849 CG TYR A 56 15.532 -4.056 -0.621 1.00 0.00 C ATOM 850 CD1 TYR A 56 16.564 -3.947 -1.545 1.00 0.00 C ATOM 851 CD2 TYR A 56 14.227 -3.981 -1.088 1.00 0.00 C ATOM 852 CE1 TYR A 56 16.304 -3.768 -2.890 1.00 0.00 C ATOM 853 CE2 TYR A 56 13.958 -3.805 -2.431 1.00 0.00 C ATOM 854 CZ TYR A 56 15.000 -3.698 -3.329 1.00 0.00 C ATOM 855 OH TYR A 56 14.736 -3.521 -4.667 1.00 0.00 O ATOM 0 H TYR A 56 17.001 -6.976 -0.256 1.00 0.00 H new ATOM 0 HA TYR A 56 16.416 -5.838 2.234 1.00 0.00 H new ATOM 0 HB2 TYR A 56 14.969 -3.925 1.439 1.00 0.00 H new ATOM 0 HB3 TYR A 56 16.675 -3.653 1.142 1.00 0.00 H new ATOM 0 HD1 TYR A 56 17.588 -4.003 -1.206 1.00 0.00 H new ATOM 0 HD2 TYR A 56 13.408 -4.062 -0.389 1.00 0.00 H new ATOM 0 HE1 TYR A 56 17.119 -3.683 -3.594 1.00 0.00 H new ATOM 0 HE2 TYR A 56 12.936 -3.751 -2.777 1.00 0.00 H new ATOM 0 HH TYR A 56 13.767 -3.494 -4.808 1.00 0.00 H new ATOM 865 N ASN A 57 14.935 -7.580 0.159 1.00 0.00 N ATOM 866 CA ASN A 57 13.790 -8.437 -0.135 1.00 0.00 C ATOM 867 C ASN A 57 12.571 -7.593 -0.488 1.00 0.00 C ATOM 868 O ASN A 57 12.686 -6.390 -0.715 1.00 0.00 O ATOM 869 CB ASN A 57 13.478 -9.340 1.058 1.00 0.00 C ATOM 870 CG ASN A 57 14.562 -10.371 1.301 1.00 0.00 C ATOM 871 OD1 ASN A 57 14.511 -11.479 0.766 1.00 0.00 O ATOM 872 ND2 ASN A 57 15.550 -10.013 2.111 1.00 0.00 N ATOM 0 H ASN A 57 15.794 -7.847 -0.322 1.00 0.00 H new ATOM 0 HA ASN A 57 14.041 -9.064 -0.991 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.356 -8.728 1.951 1.00 0.00 H new ATOM 0 HB3 ASN A 57 12.529 -9.848 0.887 1.00 0.00 H new ATOM 0 HD21 ASN A 57 16.307 -10.666 2.312 1.00 0.00 H new ATOM 0 HD22 ASN A 57 15.552 -9.084 2.533 1.00 0.00 H new ATOM 879 N THR A 58 11.403 -8.218 -0.551 1.00 0.00 N ATOM 880 CA THR A 58 10.179 -7.499 -0.866 1.00 0.00 C ATOM 881 C THR A 58 9.544 -6.938 0.403 1.00 0.00 C ATOM 882 O THR A 58 8.514 -7.429 0.865 1.00 0.00 O ATOM 883 CB THR A 58 9.162 -8.403 -1.588 1.00 0.00 C ATOM 884 OG1 THR A 58 9.827 -9.191 -2.583 1.00 0.00 O ATOM 885 CG2 THR A 58 8.072 -7.572 -2.246 1.00 0.00 C ATOM 0 H THR A 58 11.279 -9.217 -0.389 1.00 0.00 H new ATOM 0 HA THR A 58 10.449 -6.679 -1.532 1.00 0.00 H new ATOM 0 HB THR A 58 8.704 -9.059 -0.848 1.00 0.00 H new ATOM 0 HG1 THR A 58 9.174 -9.764 -3.036 1.00 0.00 H new ATOM 0 HG21 THR A 58 7.366 -8.232 -2.750 1.00 0.00 H new ATOM 0 HG22 THR A 58 7.548 -6.992 -1.486 1.00 0.00 H new ATOM 0 HG23 THR A 58 8.520 -6.896 -2.974 1.00 0.00 H new ATOM 893 N PHE A 59 10.178 -5.910 0.970 1.00 0.00 N ATOM 894 CA PHE A 59 9.681 -5.278 2.190 1.00 0.00 C ATOM 895 C PHE A 59 8.206 -4.889 2.053 1.00 0.00 C ATOM 896 O PHE A 59 7.503 -4.726 3.051 1.00 0.00 O ATOM 897 CB PHE A 59 10.529 -4.053 2.558 1.00 0.00 C ATOM 898 CG PHE A 59 10.966 -3.185 1.405 1.00 0.00 C ATOM 899 CD1 PHE A 59 10.246 -3.134 0.224 1.00 0.00 C ATOM 900 CD2 PHE A 59 12.110 -2.408 1.518 1.00 0.00 C ATOM 901 CE1 PHE A 59 10.657 -2.328 -0.820 1.00 0.00 C ATOM 902 CE2 PHE A 59 12.525 -1.600 0.479 1.00 0.00 C ATOM 903 CZ PHE A 59 11.797 -1.560 -0.693 1.00 0.00 C ATOM 0 H PHE A 59 11.036 -5.499 0.603 1.00 0.00 H new ATOM 0 HA PHE A 59 9.764 -6.007 2.996 1.00 0.00 H new ATOM 0 HB2 PHE A 59 9.961 -3.438 3.256 1.00 0.00 H new ATOM 0 HB3 PHE A 59 11.418 -4.396 3.087 1.00 0.00 H new ATOM 0 HD1 PHE A 59 9.353 -3.731 0.117 1.00 0.00 H new ATOM 0 HD2 PHE A 59 12.684 -2.436 2.432 1.00 0.00 H new ATOM 0 HE1 PHE A 59 10.086 -2.299 -1.736 1.00 0.00 H new ATOM 0 HE2 PHE A 59 13.417 -1.000 0.583 1.00 0.00 H new ATOM 0 HZ PHE A 59 12.118 -0.929 -1.509 1.00 0.00 H new ATOM 913 N CYS A 60 7.748 -4.742 0.813 1.00 0.00 N ATOM 914 CA CYS A 60 6.356 -4.394 0.533 1.00 0.00 C ATOM 915 C CYS A 60 5.929 -4.985 -0.809 1.00 0.00 C ATOM 916 O CYS A 60 6.479 -4.635 -1.853 1.00 0.00 O ATOM 917 CB CYS A 60 6.162 -2.872 0.541 1.00 0.00 C ATOM 918 SG CYS A 60 7.300 -1.952 -0.546 1.00 0.00 S ATOM 0 H CYS A 60 8.324 -4.859 -0.020 1.00 0.00 H new ATOM 0 HA CYS A 60 5.728 -4.816 1.317 1.00 0.00 H new ATOM 0 HB2 CYS A 60 5.137 -2.649 0.244 1.00 0.00 H new ATOM 0 HB3 CYS A 60 6.284 -2.509 1.562 1.00 0.00 H new ATOM 923 N ILE A 61 4.944 -5.884 -0.776 1.00 0.00 N ATOM 924 CA ILE A 61 4.475 -6.544 -1.992 1.00 0.00 C ATOM 925 C ILE A 61 3.328 -5.796 -2.676 1.00 0.00 C ATOM 926 O ILE A 61 2.906 -6.187 -3.766 1.00 0.00 O ATOM 927 CB ILE A 61 4.045 -8.000 -1.714 1.00 0.00 C ATOM 928 CG1 ILE A 61 2.732 -8.042 -0.931 1.00 0.00 C ATOM 929 CG2 ILE A 61 5.140 -8.736 -0.954 1.00 0.00 C ATOM 930 CD1 ILE A 61 2.211 -9.446 -0.703 1.00 0.00 C ATOM 0 H ILE A 61 4.459 -6.169 0.075 1.00 0.00 H new ATOM 0 HA ILE A 61 5.326 -6.540 -2.673 1.00 0.00 H new ATOM 0 HB ILE A 61 3.885 -8.498 -2.670 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.877 -7.555 0.034 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.979 -7.466 -1.468 1.00 0.00 H new ATOM 0 HG21 ILE A 61 4.825 -9.762 -0.764 1.00 0.00 H new ATOM 0 HG22 ILE A 61 6.054 -8.742 -1.548 1.00 0.00 H new ATOM 0 HG23 ILE A 61 5.326 -8.232 -0.006 1.00 0.00 H new ATOM 0 HD11 ILE A 61 1.278 -9.401 -0.142 1.00 0.00 H new ATOM 0 HD12 ILE A 61 2.034 -9.929 -1.664 1.00 0.00 H new ATOM 0 HD13 ILE A 61 2.946 -10.020 -0.139 1.00 0.00 H new ATOM 942 N TYR A 62 2.818 -4.736 -2.043 1.00 0.00 N ATOM 943 CA TYR A 62 1.738 -3.939 -2.641 1.00 0.00 C ATOM 944 C TYR A 62 0.426 -4.711 -2.724 1.00 0.00 C ATOM 945 O TYR A 62 0.377 -5.787 -3.321 1.00 0.00 O ATOM 946 CB TYR A 62 2.145 -3.528 -4.061 1.00 0.00 C ATOM 947 CG TYR A 62 1.461 -2.282 -4.574 1.00 0.00 C ATOM 948 CD1 TYR A 62 0.158 -2.309 -5.050 1.00 0.00 C ATOM 949 CD2 TYR A 62 2.136 -1.077 -4.588 1.00 0.00 C ATOM 950 CE1 TYR A 62 -0.446 -1.159 -5.524 1.00 0.00 C ATOM 951 CE2 TYR A 62 1.548 0.075 -5.055 1.00 0.00 C ATOM 952 CZ TYR A 62 0.255 0.032 -5.524 1.00 0.00 C ATOM 953 OH TYR A 62 -0.336 1.180 -5.995 1.00 0.00 O ATOM 0 H TYR A 62 3.129 -4.411 -1.128 1.00 0.00 H new ATOM 0 HA TYR A 62 1.582 -3.070 -2.002 1.00 0.00 H new ATOM 0 HB2 TYR A 62 3.223 -3.371 -4.085 1.00 0.00 H new ATOM 0 HB3 TYR A 62 1.928 -4.352 -4.740 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -0.391 -3.239 -5.050 1.00 0.00 H new ATOM 0 HD2 TYR A 62 3.152 -1.039 -4.223 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.461 -1.191 -5.892 1.00 0.00 H new ATOM 0 HE2 TYR A 62 2.096 1.005 -5.054 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.302 1.873 -5.303 1.00 0.00 H new ATOM 963 N LYS A 63 -0.645 -4.174 -2.130 1.00 0.00 N ATOM 964 CA LYS A 63 -1.950 -4.813 -2.224 1.00 0.00 C ATOM 965 C LYS A 63 -2.915 -3.992 -3.061 1.00 0.00 C ATOM 966 O LYS A 63 -2.986 -4.133 -4.282 1.00 0.00 O ATOM 967 CB LYS A 63 -2.542 -5.007 -0.823 1.00 0.00 C ATOM 968 CG LYS A 63 -1.555 -5.552 0.192 1.00 0.00 C ATOM 969 CD LYS A 63 -1.186 -6.987 -0.104 1.00 0.00 C ATOM 970 CE LYS A 63 -0.063 -7.459 0.800 1.00 0.00 C ATOM 971 NZ LYS A 63 -0.582 -8.042 2.068 1.00 0.00 N ATOM 0 H LYS A 63 -0.630 -3.310 -1.588 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.808 -5.779 -2.708 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -2.925 -4.051 -0.466 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.392 -5.686 -0.889 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.655 -4.937 0.191 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.986 -5.485 1.191 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.059 -7.626 0.031 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.881 -7.080 -1.146 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.537 -8.203 0.276 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.596 -6.622 1.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.215 -8.291 2.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -1.189 -7.346 2.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -1.135 -8.897 1.856 1.00 0.00 H new ATOM 985 N ARG A 64 -3.643 -3.128 -2.374 1.00 0.00 N ATOM 986 CA ARG A 64 -4.638 -2.260 -2.991 1.00 0.00 C ATOM 987 C ARG A 64 -5.735 -3.073 -3.663 1.00 0.00 C ATOM 988 O ARG A 64 -5.471 -3.902 -4.534 1.00 0.00 O ATOM 989 CB ARG A 64 -3.983 -1.307 -3.990 1.00 0.00 C ATOM 990 CG ARG A 64 -3.660 0.052 -3.389 1.00 0.00 C ATOM 991 CD ARG A 64 -2.800 0.889 -4.316 1.00 0.00 C ATOM 992 NE ARG A 64 -3.489 1.207 -5.565 1.00 0.00 N ATOM 993 CZ ARG A 64 -3.274 2.319 -6.264 1.00 0.00 C ATOM 994 NH1 ARG A 64 -2.387 3.211 -5.843 1.00 0.00 N ATOM 995 NH2 ARG A 64 -3.948 2.539 -7.386 1.00 0.00 N ATOM 0 H ARG A 64 -3.561 -3.006 -1.365 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.097 -1.665 -2.201 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -3.066 -1.759 -4.367 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.647 -1.172 -4.844 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -4.587 0.584 -3.174 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.144 -0.084 -2.439 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.518 1.814 -3.812 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -1.877 0.352 -4.538 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.173 0.539 -5.921 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -1.867 3.046 -4.981 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -2.225 4.062 -6.381 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -4.631 1.856 -7.713 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -3.783 3.391 -7.921 1.00 0.00 H new ATOM 1009 N CYS A 65 -6.972 -2.822 -3.253 1.00 0.00 N ATOM 1010 CA CYS A 65 -8.118 -3.525 -3.804 1.00 0.00 C ATOM 1011 C CYS A 65 -8.788 -2.653 -4.845 1.00 0.00 C ATOM 1012 O CYS A 65 -8.664 -1.429 -4.803 1.00 0.00 O ATOM 1013 CB CYS A 65 -9.114 -3.873 -2.699 1.00 0.00 C ATOM 1014 SG CYS A 65 -8.342 -4.374 -1.130 1.00 0.00 S ATOM 0 H CYS A 65 -7.205 -2.133 -2.538 1.00 0.00 H new ATOM 0 HA CYS A 65 -7.778 -4.452 -4.266 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -9.754 -3.009 -2.517 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -9.759 -4.680 -3.047 1.00 0.00 H new ATOM 1019 N ARG A 66 -9.492 -3.266 -5.782 1.00 0.00 N ATOM 1020 CA ARG A 66 -10.151 -2.492 -6.815 1.00 0.00 C ATOM 1021 C ARG A 66 -11.254 -1.629 -6.213 1.00 0.00 C ATOM 1022 O ARG A 66 -12.075 -2.103 -5.434 1.00 0.00 O ATOM 1023 CB ARG A 66 -10.702 -3.392 -7.924 1.00 0.00 C ATOM 1024 CG ARG A 66 -11.299 -2.623 -9.093 1.00 0.00 C ATOM 1025 CD ARG A 66 -10.258 -1.753 -9.778 1.00 0.00 C ATOM 1026 NE ARG A 66 -10.820 -1.000 -10.896 1.00 0.00 N ATOM 1027 CZ ARG A 66 -10.083 -0.332 -11.779 1.00 0.00 C ATOM 1028 NH1 ARG A 66 -8.761 -0.328 -11.676 1.00 0.00 N ATOM 1029 NH2 ARG A 66 -10.670 0.331 -12.766 1.00 0.00 N ATOM 0 H ARG A 66 -9.619 -4.276 -5.848 1.00 0.00 H new ATOM 0 HA ARG A 66 -9.408 -1.835 -7.268 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -9.900 -4.032 -8.293 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -11.465 -4.047 -7.503 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -11.720 -3.324 -9.814 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -12.119 -1.999 -8.738 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -9.832 -1.060 -9.053 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -9.442 -2.380 -10.138 1.00 0.00 H new ATOM 0 HE ARG A 66 -11.834 -0.986 -11.006 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -8.307 -0.838 -10.918 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -8.198 0.185 -12.355 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.687 0.329 -12.848 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.105 0.843 -13.443 1.00 0.00 H new ATOM 1043 N HIS A 67 -11.261 -0.365 -6.602 1.00 0.00 N ATOM 1044 CA HIS A 67 -12.230 0.590 -6.086 1.00 0.00 C ATOM 1045 C HIS A 67 -13.623 -0.029 -5.936 1.00 0.00 C ATOM 1046 O HIS A 67 -14.124 -0.676 -6.855 1.00 0.00 O ATOM 1047 CB HIS A 67 -12.296 1.803 -7.012 1.00 0.00 C ATOM 1048 CG HIS A 67 -11.024 2.592 -7.058 1.00 0.00 C ATOM 1049 ND1 HIS A 67 -10.374 2.907 -8.233 1.00 0.00 N ATOM 1050 CD2 HIS A 67 -10.284 3.137 -6.063 1.00 0.00 C ATOM 1051 CE1 HIS A 67 -9.290 3.611 -7.959 1.00 0.00 C ATOM 1052 NE2 HIS A 67 -9.214 3.765 -6.649 1.00 0.00 N ATOM 0 H HIS A 67 -10.603 0.026 -7.277 1.00 0.00 H new ATOM 0 HA HIS A 67 -11.900 0.896 -5.093 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -12.542 1.468 -8.019 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.107 2.455 -6.686 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -10.497 3.087 -5.005 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -8.586 3.995 -8.682 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -8.479 4.269 -6.153 1.00 0.00 H new ATOM 1061 N PRO A 68 -14.259 0.163 -4.760 1.00 0.00 N ATOM 1062 CA PRO A 68 -15.605 -0.347 -4.473 1.00 0.00 C ATOM 1063 C PRO A 68 -16.561 -0.126 -5.634 1.00 0.00 C ATOM 1064 O PRO A 68 -17.367 -0.993 -5.972 1.00 0.00 O ATOM 1065 CB PRO A 68 -16.060 0.501 -3.273 1.00 0.00 C ATOM 1066 CG PRO A 68 -14.979 1.508 -3.040 1.00 0.00 C ATOM 1067 CD PRO A 68 -13.731 0.913 -3.618 1.00 0.00 C ATOM 0 HA PRO A 68 -15.597 -1.421 -4.289 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -17.011 0.992 -3.481 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -16.209 -0.121 -2.391 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -15.219 2.456 -3.521 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -14.858 1.712 -1.976 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.018 1.678 -3.925 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -13.218 0.267 -2.906 1.00 0.00 H new ATOM 1075 N GLY A 69 -16.457 1.051 -6.236 1.00 0.00 N ATOM 1076 CA GLY A 69 -17.340 1.417 -7.320 1.00 0.00 C ATOM 1077 C GLY A 69 -18.266 2.537 -6.895 1.00 0.00 C ATOM 1078 O GLY A 69 -18.253 2.970 -5.743 1.00 0.00 O ATOM 0 H GLY A 69 -15.770 1.763 -5.988 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.754 1.730 -8.184 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -17.925 0.551 -7.628 1.00 0.00 H new ATOM 1082 N GLU A 70 -19.069 3.000 -7.841 1.00 0.00 N ATOM 1083 CA GLU A 70 -20.008 4.077 -7.581 1.00 0.00 C ATOM 1084 C GLU A 70 -21.274 3.547 -6.919 1.00 0.00 C ATOM 1085 O GLU A 70 -21.894 2.596 -7.395 1.00 0.00 O ATOM 1086 CB GLU A 70 -20.340 4.838 -8.865 1.00 0.00 C ATOM 1087 CG GLU A 70 -21.306 5.993 -8.658 1.00 0.00 C ATOM 1088 CD GLU A 70 -20.769 7.038 -7.698 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -21.003 6.898 -6.479 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -20.114 7.993 -8.166 1.00 0.00 O ATOM 0 H GLU A 70 -19.088 2.645 -8.797 1.00 0.00 H new ATOM 0 HA GLU A 70 -19.534 4.775 -6.891 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -19.416 5.222 -9.299 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -20.767 4.144 -9.588 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -21.517 6.462 -9.619 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -22.252 5.607 -8.277 1.00 0.00 H new ATOM 1097 N LEU A 71 -21.661 4.198 -5.825 1.00 0.00 N ATOM 1098 CA LEU A 71 -22.863 3.838 -5.084 1.00 0.00 C ATOM 1099 C LEU A 71 -24.014 4.705 -5.581 1.00 0.00 C ATOM 1100 O LEU A 71 -24.136 5.861 -5.179 1.00 0.00 O ATOM 1101 CB LEU A 71 -22.637 4.067 -3.582 1.00 0.00 C ATOM 1102 CG LEU A 71 -23.241 3.023 -2.631 1.00 0.00 C ATOM 1103 CD1 LEU A 71 -23.131 3.498 -1.191 1.00 0.00 C ATOM 1104 CD2 LEU A 71 -24.691 2.724 -2.984 1.00 0.00 C ATOM 0 H LEU A 71 -21.151 4.988 -5.429 1.00 0.00 H new ATOM 0 HA LEU A 71 -23.100 2.786 -5.240 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -21.563 4.112 -3.402 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -23.045 5.043 -3.321 1.00 0.00 H new ATOM 0 HG LEU A 71 -22.675 2.098 -2.743 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -23.563 2.749 -0.527 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -22.082 3.647 -0.936 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -23.670 4.439 -1.076 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -25.088 1.982 -2.292 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -25.279 3.639 -2.912 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -24.745 2.337 -4.002 1.00 0.00 H new ATOM 1116 N ARG A 72 -24.845 4.165 -6.466 1.00 0.00 N ATOM 1117 CA ARG A 72 -25.977 4.934 -6.981 1.00 0.00 C ATOM 1118 C ARG A 72 -26.913 5.299 -5.834 1.00 0.00 C ATOM 1119 O ARG A 72 -27.433 4.435 -5.127 1.00 0.00 O ATOM 1120 CB ARG A 72 -26.712 4.188 -8.095 1.00 0.00 C ATOM 1121 CG ARG A 72 -27.878 4.962 -8.683 1.00 0.00 C ATOM 1122 CD ARG A 72 -28.590 4.163 -9.764 1.00 0.00 C ATOM 1123 NE ARG A 72 -29.622 4.948 -10.435 1.00 0.00 N ATOM 1124 CZ ARG A 72 -30.233 4.561 -11.551 1.00 0.00 C ATOM 1125 NH1 ARG A 72 -29.922 3.400 -12.112 1.00 0.00 N ATOM 1126 NH2 ARG A 72 -31.157 5.333 -12.107 1.00 0.00 N ATOM 0 H ARG A 72 -24.762 3.218 -6.837 1.00 0.00 H new ATOM 0 HA ARG A 72 -25.597 5.853 -7.427 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -26.005 3.954 -8.891 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -27.078 3.239 -7.704 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -28.584 5.215 -7.892 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -27.518 5.902 -9.102 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -27.862 3.818 -10.498 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -29.041 3.275 -9.321 1.00 0.00 H new ATOM 0 HE ARG A 72 -29.889 5.843 -10.025 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -29.213 2.802 -11.687 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -30.392 3.105 -12.968 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -31.401 6.226 -11.679 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -31.624 5.034 -12.963 1.00 0.00 H new ATOM 1140 N ASN A 73 -27.098 6.613 -5.674 1.00 0.00 N ATOM 1141 CA ASN A 73 -27.896 7.185 -4.593 1.00 0.00 C ATOM 1142 C ASN A 73 -27.104 7.051 -3.303 1.00 0.00 C ATOM 1143 O ASN A 73 -27.436 7.654 -2.287 1.00 0.00 O ATOM 1144 CB ASN A 73 -29.266 6.510 -4.474 1.00 0.00 C ATOM 1145 CG ASN A 73 -30.138 6.759 -5.688 1.00 0.00 C ATOM 1146 OD1 ASN A 73 -30.879 7.740 -5.745 1.00 0.00 O ATOM 1147 ND2 ASN A 73 -30.055 5.867 -6.668 1.00 0.00 N ATOM 0 H ASN A 73 -26.694 7.312 -6.297 1.00 0.00 H new ATOM 0 HA ASN A 73 -28.094 8.236 -4.806 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -29.129 5.437 -4.342 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -29.774 6.879 -3.583 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -30.619 5.981 -7.510 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -29.427 5.068 -6.579 1.00 0.00 H new ATOM 1154 N GLY A 74 -26.046 6.256 -3.368 1.00 0.00 N ATOM 1155 CA GLY A 74 -25.217 6.045 -2.205 1.00 0.00 C ATOM 1156 C GLY A 74 -23.904 6.798 -2.271 1.00 0.00 C ATOM 1157 O GLY A 74 -23.615 7.482 -3.253 1.00 0.00 O ATOM 0 H GLY A 74 -25.749 5.755 -4.205 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -25.764 6.356 -1.315 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -25.014 4.979 -2.099 1.00 0.00 H new ATOM 1161 N GLN A 75 -23.111 6.672 -1.214 1.00 0.00 N ATOM 1162 CA GLN A 75 -21.818 7.336 -1.140 1.00 0.00 C ATOM 1163 C GLN A 75 -20.756 6.375 -0.618 1.00 0.00 C ATOM 1164 O GLN A 75 -20.985 5.648 0.344 1.00 0.00 O ATOM 1165 CB GLN A 75 -21.902 8.565 -0.234 1.00 0.00 C ATOM 1166 CG GLN A 75 -20.595 9.334 -0.123 1.00 0.00 C ATOM 1167 CD GLN A 75 -20.689 10.514 0.825 1.00 0.00 C ATOM 1168 OE1 GLN A 75 -21.751 11.115 0.983 1.00 0.00 O ATOM 1169 NE2 GLN A 75 -19.573 10.850 1.463 1.00 0.00 N ATOM 0 H GLN A 75 -23.343 6.113 -0.393 1.00 0.00 H new ATOM 0 HA GLN A 75 -21.538 7.657 -2.143 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -22.675 9.233 -0.614 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -22.214 8.250 0.762 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -19.810 8.660 0.219 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -20.302 9.689 -1.111 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -18.715 10.323 1.301 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -19.575 11.635 2.115 1.00 0.00 H new ATOM 1178 N VAL A 76 -19.596 6.380 -1.261 1.00 0.00 N ATOM 1179 CA VAL A 76 -18.506 5.504 -0.856 1.00 0.00 C ATOM 1180 C VAL A 76 -17.364 6.303 -0.230 1.00 0.00 C ATOM 1181 O VAL A 76 -16.634 7.013 -0.923 1.00 0.00 O ATOM 1182 CB VAL A 76 -17.989 4.664 -2.038 1.00 0.00 C ATOM 1183 CG1 VAL A 76 -18.198 5.400 -3.337 1.00 0.00 C ATOM 1184 CG2 VAL A 76 -16.533 4.278 -1.849 1.00 0.00 C ATOM 0 H VAL A 76 -19.387 6.977 -2.061 1.00 0.00 H new ATOM 0 HA VAL A 76 -18.901 4.820 -0.105 1.00 0.00 H new ATOM 0 HB VAL A 76 -18.564 3.739 -2.074 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -17.827 4.793 -4.163 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -19.261 5.594 -3.478 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -17.657 6.346 -3.310 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -16.200 3.686 -2.701 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -15.925 5.179 -1.773 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -16.428 3.692 -0.936 1.00 0.00 H new ATOM 1194 N GLU A 77 -17.227 6.192 1.084 1.00 0.00 N ATOM 1195 CA GLU A 77 -16.172 6.902 1.797 1.00 0.00 C ATOM 1196 C GLU A 77 -14.799 6.326 1.465 1.00 0.00 C ATOM 1197 O GLU A 77 -14.405 5.289 1.998 1.00 0.00 O ATOM 1198 CB GLU A 77 -16.401 6.845 3.306 1.00 0.00 C ATOM 1199 CG GLU A 77 -15.305 7.534 4.104 1.00 0.00 C ATOM 1200 CD GLU A 77 -15.268 9.033 3.877 1.00 0.00 C ATOM 1201 OE1 GLU A 77 -16.061 9.751 4.524 1.00 0.00 O ATOM 1202 OE2 GLU A 77 -14.446 9.490 3.056 1.00 0.00 O ATOM 0 H GLU A 77 -17.829 5.620 1.676 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.203 7.942 1.473 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.359 7.310 3.540 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -16.468 5.803 3.618 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -15.455 7.335 5.165 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.340 7.106 3.832 1.00 0.00 H new ATOM 1209 N ILE A 78 -14.075 7.007 0.583 1.00 0.00 N ATOM 1210 CA ILE A 78 -12.739 6.571 0.187 1.00 0.00 C ATOM 1211 C ILE A 78 -11.693 7.576 0.645 1.00 0.00 C ATOM 1212 O ILE A 78 -11.918 8.786 0.602 1.00 0.00 O ATOM 1213 CB ILE A 78 -12.623 6.379 -1.341 1.00 0.00 C ATOM 1214 CG1 ILE A 78 -13.397 5.136 -1.786 1.00 0.00 C ATOM 1215 CG2 ILE A 78 -11.164 6.278 -1.765 1.00 0.00 C ATOM 1216 CD1 ILE A 78 -12.839 3.833 -1.247 1.00 0.00 C ATOM 0 H ILE A 78 -14.390 7.864 0.128 1.00 0.00 H new ATOM 0 HA ILE A 78 -12.563 5.609 0.668 1.00 0.00 H new ATOM 0 HB ILE A 78 -13.059 7.252 -1.827 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -14.435 5.234 -1.467 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -13.401 5.094 -2.875 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -11.108 6.143 -2.845 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -10.640 7.192 -1.486 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -10.699 5.427 -1.268 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -13.444 3.001 -1.608 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -11.811 3.709 -1.587 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -12.861 3.851 -0.157 1.00 0.00 H new ATOM 1228 N LYS A 79 -10.547 7.070 1.081 1.00 0.00 N ATOM 1229 CA LYS A 79 -9.469 7.925 1.554 1.00 0.00 C ATOM 1230 C LYS A 79 -8.173 7.144 1.684 1.00 0.00 C ATOM 1231 O LYS A 79 -7.119 7.583 1.224 1.00 0.00 O ATOM 1232 CB LYS A 79 -9.832 8.553 2.907 1.00 0.00 C ATOM 1233 CG LYS A 79 -10.050 7.548 4.034 1.00 0.00 C ATOM 1234 CD LYS A 79 -11.274 6.676 3.799 1.00 0.00 C ATOM 1235 CE LYS A 79 -11.684 5.941 5.064 1.00 0.00 C ATOM 1236 NZ LYS A 79 -12.869 5.069 4.841 1.00 0.00 N ATOM 0 H LYS A 79 -10.341 6.072 1.117 1.00 0.00 H new ATOM 0 HA LYS A 79 -9.327 8.718 0.820 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -9.038 9.240 3.199 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -10.738 9.146 2.786 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -9.168 6.915 4.129 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -10.162 8.082 4.978 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.102 7.294 3.452 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -11.062 5.954 3.010 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -10.850 5.336 5.419 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.908 6.665 5.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.607 5.303 5.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -13.236 5.222 3.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.593 4.073 4.952 1.00 0.00 H new ATOM 1250 N THR A 80 -8.262 5.986 2.317 1.00 0.00 N ATOM 1251 CA THR A 80 -7.102 5.141 2.533 1.00 0.00 C ATOM 1252 C THR A 80 -6.662 4.428 1.260 1.00 0.00 C ATOM 1253 O THR A 80 -5.794 3.555 1.306 1.00 0.00 O ATOM 1254 CB THR A 80 -7.391 4.101 3.624 1.00 0.00 C ATOM 1255 OG1 THR A 80 -8.343 3.145 3.146 1.00 0.00 O ATOM 1256 CG2 THR A 80 -7.932 4.784 4.871 1.00 0.00 C ATOM 0 H THR A 80 -9.132 5.609 2.692 1.00 0.00 H new ATOM 0 HA THR A 80 -6.290 5.795 2.850 1.00 0.00 H new ATOM 0 HB THR A 80 -6.462 3.589 3.875 1.00 0.00 H new ATOM 0 HG1 THR A 80 -9.138 3.160 3.719 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.133 4.036 5.638 1.00 0.00 H new ATOM 0 HG22 THR A 80 -7.196 5.497 5.244 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.855 5.310 4.626 1.00 0.00 H new ATOM 1264 N ASP A 81 -7.263 4.792 0.126 1.00 0.00 N ATOM 1265 CA ASP A 81 -6.896 4.182 -1.152 1.00 0.00 C ATOM 1266 C ASP A 81 -7.169 2.683 -1.158 1.00 0.00 C ATOM 1267 O ASP A 81 -6.807 1.983 -2.105 1.00 0.00 O ATOM 1268 CB ASP A 81 -5.410 4.406 -1.406 1.00 0.00 C ATOM 1269 CG ASP A 81 -5.013 5.864 -1.297 1.00 0.00 C ATOM 1270 OD1 ASP A 81 -5.163 6.596 -2.297 1.00 0.00 O ATOM 1271 OD2 ASP A 81 -4.552 6.274 -0.211 1.00 0.00 O ATOM 0 H ASP A 81 -7.997 5.498 0.066 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.500 4.647 -1.931 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -4.831 3.821 -0.691 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.156 4.037 -2.400 1.00 0.00 H new ATOM 1276 N LEU A 82 -7.817 2.208 -0.099 1.00 0.00 N ATOM 1277 CA LEU A 82 -8.138 0.789 0.066 1.00 0.00 C ATOM 1278 C LEU A 82 -6.871 -0.021 0.349 1.00 0.00 C ATOM 1279 O LEU A 82 -6.928 -1.010 1.072 1.00 0.00 O ATOM 1280 CB LEU A 82 -8.811 0.230 -1.194 1.00 0.00 C ATOM 1281 CG LEU A 82 -10.187 0.801 -1.555 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -11.039 0.997 -0.314 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -10.042 2.106 -2.321 1.00 0.00 C ATOM 0 H LEU A 82 -8.136 2.795 0.672 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.823 0.704 0.909 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -8.142 0.396 -2.038 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.912 -0.849 -1.075 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.693 0.081 -2.198 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.009 1.403 -0.599 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.179 0.039 0.186 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -10.541 1.690 0.364 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.030 2.495 -2.568 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.510 2.832 -1.706 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.482 1.929 -3.239 1.00 0.00 H new ATOM 1295 N SER A 83 -5.751 0.423 -0.226 1.00 0.00 N ATOM 1296 CA SER A 83 -4.449 -0.251 -0.091 1.00 0.00 C ATOM 1297 C SER A 83 -4.339 -1.118 1.168 1.00 0.00 C ATOM 1298 O SER A 83 -3.620 -0.769 2.102 1.00 0.00 O ATOM 1299 CB SER A 83 -3.326 0.787 -0.094 1.00 0.00 C ATOM 1300 OG SER A 83 -3.451 1.677 1.000 1.00 0.00 O ATOM 0 H SER A 83 -5.717 1.264 -0.802 1.00 0.00 H new ATOM 0 HA SER A 83 -4.357 -0.921 -0.946 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.361 0.283 -0.048 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.348 1.349 -1.028 1.00 0.00 H new ATOM 0 HG SER A 83 -3.402 1.173 1.839 1.00 0.00 H new ATOM 1306 N PHE A 84 -5.039 -2.258 1.161 1.00 0.00 N ATOM 1307 CA PHE A 84 -5.034 -3.203 2.286 1.00 0.00 C ATOM 1308 C PHE A 84 -5.242 -2.511 3.636 1.00 0.00 C ATOM 1309 O PHE A 84 -4.485 -1.619 4.015 1.00 0.00 O ATOM 1310 CB PHE A 84 -3.722 -3.989 2.309 1.00 0.00 C ATOM 1311 CG PHE A 84 -3.677 -5.049 3.374 1.00 0.00 C ATOM 1312 CD1 PHE A 84 -4.305 -6.270 3.181 1.00 0.00 C ATOM 1313 CD2 PHE A 84 -3.008 -4.825 4.566 1.00 0.00 C ATOM 1314 CE1 PHE A 84 -4.266 -7.247 4.158 1.00 0.00 C ATOM 1315 CE2 PHE A 84 -2.966 -5.797 5.547 1.00 0.00 C ATOM 1316 CZ PHE A 84 -3.596 -7.010 5.343 1.00 0.00 C ATOM 0 H PHE A 84 -5.624 -2.552 0.378 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.873 -3.882 2.133 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.570 -4.456 1.336 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -2.895 -3.296 2.462 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.831 -6.460 2.257 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -2.513 -3.879 4.731 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -4.759 -8.194 3.995 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.441 -5.609 6.472 1.00 0.00 H new ATOM 0 HZ PHE A 84 -3.565 -7.771 6.108 1.00 0.00 H new ATOM 1326 N GLY A 85 -6.259 -2.942 4.380 1.00 0.00 N ATOM 1327 CA GLY A 85 -6.524 -2.354 5.680 1.00 0.00 C ATOM 1328 C GLY A 85 -7.461 -1.166 5.596 1.00 0.00 C ATOM 1329 O GLY A 85 -7.086 -0.047 5.946 1.00 0.00 O ATOM 0 H GLY A 85 -6.901 -3.685 4.106 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.957 -3.109 6.336 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.583 -2.040 6.132 1.00 0.00 H new ATOM 1333 N SER A 86 -8.685 -1.407 5.133 1.00 0.00 N ATOM 1334 CA SER A 86 -9.669 -0.341 4.999 1.00 0.00 C ATOM 1335 C SER A 86 -11.092 -0.889 4.988 1.00 0.00 C ATOM 1336 O SER A 86 -11.362 -1.934 4.397 1.00 0.00 O ATOM 1337 CB SER A 86 -9.413 0.453 3.717 1.00 0.00 C ATOM 1338 OG SER A 86 -9.440 -0.393 2.581 1.00 0.00 O ATOM 0 H SER A 86 -9.016 -2.328 4.846 1.00 0.00 H new ATOM 0 HA SER A 86 -9.565 0.315 5.863 1.00 0.00 H new ATOM 0 HB2 SER A 86 -10.167 1.233 3.612 1.00 0.00 H new ATOM 0 HB3 SER A 86 -8.446 0.951 3.781 1.00 0.00 H new ATOM 0 HG SER A 86 -10.310 -0.317 2.137 1.00 0.00 H new ATOM 1344 N GLN A 87 -11.995 -0.175 5.655 1.00 0.00 N ATOM 1345 CA GLN A 87 -13.395 -0.579 5.712 1.00 0.00 C ATOM 1346 C GLN A 87 -14.205 0.263 4.737 1.00 0.00 C ATOM 1347 O GLN A 87 -15.095 -0.235 4.054 1.00 0.00 O ATOM 1348 CB GLN A 87 -13.961 -0.435 7.127 1.00 0.00 C ATOM 1349 CG GLN A 87 -12.913 -0.518 8.221 1.00 0.00 C ATOM 1350 CD GLN A 87 -12.267 0.823 8.503 1.00 0.00 C ATOM 1351 OE1 GLN A 87 -11.106 0.896 8.905 1.00 0.00 O ATOM 1352 NE2 GLN A 87 -13.023 1.895 8.292 1.00 0.00 N ATOM 0 H GLN A 87 -11.782 0.684 6.162 1.00 0.00 H new ATOM 0 HA GLN A 87 -13.461 -1.631 5.434 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -14.478 0.521 7.205 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -14.705 -1.214 7.291 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -13.373 -0.896 9.134 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -12.145 -1.235 7.931 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -13.981 1.786 7.958 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -12.646 2.827 8.464 1.00 0.00 H new ATOM 1361 N ILE A 88 -13.893 1.552 4.716 1.00 0.00 N ATOM 1362 CA ILE A 88 -14.543 2.515 3.827 1.00 0.00 C ATOM 1363 C ILE A 88 -16.060 2.411 3.906 1.00 0.00 C ATOM 1364 O ILE A 88 -16.699 1.706 3.126 1.00 0.00 O ATOM 1365 CB ILE A 88 -14.066 2.393 2.355 1.00 0.00 C ATOM 1366 CG1 ILE A 88 -14.376 1.012 1.764 1.00 0.00 C ATOM 1367 CG2 ILE A 88 -12.575 2.679 2.270 1.00 0.00 C ATOM 1368 CD1 ILE A 88 -14.437 0.999 0.251 1.00 0.00 C ATOM 0 H ILE A 88 -13.179 1.964 5.317 1.00 0.00 H new ATOM 0 HA ILE A 88 -14.243 3.501 4.181 1.00 0.00 H new ATOM 0 HB ILE A 88 -14.613 3.129 1.766 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -13.615 0.306 2.095 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -15.329 0.662 2.161 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -12.246 2.592 1.234 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -12.377 3.689 2.630 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -12.031 1.962 2.885 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -14.660 -0.010 -0.095 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -15.218 1.680 -0.088 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -13.477 1.318 -0.155 1.00 0.00 H new ATOM 1380 N GLU A 89 -16.631 3.124 4.870 1.00 0.00 N ATOM 1381 CA GLU A 89 -18.065 3.124 5.076 1.00 0.00 C ATOM 1382 C GLU A 89 -18.789 3.723 3.879 1.00 0.00 C ATOM 1383 O GLU A 89 -18.169 4.326 3.003 1.00 0.00 O ATOM 1384 CB GLU A 89 -18.405 3.906 6.340 1.00 0.00 C ATOM 1385 CG GLU A 89 -18.241 3.096 7.612 1.00 0.00 C ATOM 1386 CD GLU A 89 -18.563 3.896 8.859 1.00 0.00 C ATOM 1387 OE1 GLU A 89 -17.642 4.539 9.404 1.00 0.00 O ATOM 1388 OE2 GLU A 89 -19.734 3.879 9.290 1.00 0.00 O ATOM 0 H GLU A 89 -16.114 3.712 5.523 1.00 0.00 H new ATOM 0 HA GLU A 89 -18.396 2.092 5.190 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -17.767 4.788 6.395 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -19.434 4.260 6.274 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -18.891 2.222 7.568 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -17.217 2.729 7.675 1.00 0.00 H new ATOM 1395 N PHE A 90 -20.104 3.552 3.845 1.00 0.00 N ATOM 1396 CA PHE A 90 -20.909 4.082 2.755 1.00 0.00 C ATOM 1397 C PHE A 90 -22.062 4.922 3.292 1.00 0.00 C ATOM 1398 O PHE A 90 -22.167 5.144 4.499 1.00 0.00 O ATOM 1399 CB PHE A 90 -21.430 2.948 1.875 1.00 0.00 C ATOM 1400 CG PHE A 90 -20.333 2.130 1.255 1.00 0.00 C ATOM 1401 CD1 PHE A 90 -19.766 2.499 0.041 1.00 0.00 C ATOM 1402 CD2 PHE A 90 -19.866 0.989 1.890 1.00 0.00 C ATOM 1403 CE1 PHE A 90 -18.758 1.747 -0.524 1.00 0.00 C ATOM 1404 CE2 PHE A 90 -18.856 0.234 1.325 1.00 0.00 C ATOM 1405 CZ PHE A 90 -18.302 0.612 0.118 1.00 0.00 C ATOM 0 H PHE A 90 -20.634 3.051 4.558 1.00 0.00 H new ATOM 0 HA PHE A 90 -20.277 4.727 2.145 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -22.067 2.296 2.473 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -22.054 3.367 1.085 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -20.119 3.385 -0.466 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -20.295 0.688 2.834 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -18.325 2.045 -1.468 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -18.500 -0.653 1.828 1.00 0.00 H new ATOM 0 HZ PHE A 90 -17.513 0.021 -0.324 1.00 0.00 H new ATOM 1415 N SER A 91 -22.930 5.379 2.394 1.00 0.00 N ATOM 1416 CA SER A 91 -24.052 6.217 2.820 1.00 0.00 C ATOM 1417 C SER A 91 -25.145 6.325 1.763 1.00 0.00 C ATOM 1418 O SER A 91 -24.906 6.777 0.646 1.00 0.00 O ATOM 1419 CB SER A 91 -23.556 7.619 3.181 1.00 0.00 C ATOM 1420 OG SER A 91 -22.771 7.600 4.361 1.00 0.00 O ATOM 0 H SER A 91 -22.884 5.191 1.392 1.00 0.00 H new ATOM 0 HA SER A 91 -24.488 5.733 3.694 1.00 0.00 H new ATOM 0 HB2 SER A 91 -22.968 8.022 2.357 1.00 0.00 H new ATOM 0 HB3 SER A 91 -24.408 8.284 3.319 1.00 0.00 H new ATOM 0 HG SER A 91 -22.785 6.700 4.749 1.00 0.00 H new ATOM 1426 N CYS A 92 -26.352 5.921 2.142 1.00 0.00 N ATOM 1427 CA CYS A 92 -27.483 6.011 1.228 1.00 0.00 C ATOM 1428 C CYS A 92 -28.166 7.366 1.397 1.00 0.00 C ATOM 1429 O CYS A 92 -28.681 7.686 2.469 1.00 0.00 O ATOM 1430 CB CYS A 92 -28.471 4.860 1.446 1.00 0.00 C ATOM 1431 SG CYS A 92 -27.918 3.269 0.747 1.00 0.00 S ATOM 0 H CYS A 92 -26.570 5.534 3.060 1.00 0.00 H new ATOM 0 HA CYS A 92 -27.116 5.924 0.205 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -28.640 4.737 2.516 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -29.429 5.128 1.001 1.00 0.00 H new ATOM 1436 N SER A 93 -28.150 8.154 0.327 1.00 0.00 N ATOM 1437 CA SER A 93 -28.738 9.495 0.343 1.00 0.00 C ATOM 1438 C SER A 93 -30.129 9.512 0.961 1.00 0.00 C ATOM 1439 O SER A 93 -30.751 8.469 1.162 1.00 0.00 O ATOM 1440 CB SER A 93 -28.818 10.068 -1.072 1.00 0.00 C ATOM 1441 OG SER A 93 -29.506 9.184 -1.940 1.00 0.00 O ATOM 0 H SER A 93 -27.736 7.889 -0.566 1.00 0.00 H new ATOM 0 HA SER A 93 -28.082 10.110 0.959 1.00 0.00 H new ATOM 0 HB2 SER A 93 -29.328 11.031 -1.050 1.00 0.00 H new ATOM 0 HB3 SER A 93 -27.813 10.248 -1.453 1.00 0.00 H new ATOM 0 HG SER A 93 -28.871 8.548 -2.330 1.00 0.00 H new ATOM 1447 N GLU A 94 -30.607 10.719 1.249 1.00 0.00 N ATOM 1448 CA GLU A 94 -31.926 10.920 1.834 1.00 0.00 C ATOM 1449 C GLU A 94 -32.975 10.054 1.138 1.00 0.00 C ATOM 1450 O GLU A 94 -32.846 9.727 -0.042 1.00 0.00 O ATOM 1451 CB GLU A 94 -32.306 12.401 1.736 1.00 0.00 C ATOM 1452 CG GLU A 94 -33.794 12.670 1.862 1.00 0.00 C ATOM 1453 CD GLU A 94 -34.124 14.149 1.825 1.00 0.00 C ATOM 1454 OE1 GLU A 94 -33.945 14.825 2.860 1.00 0.00 O ATOM 1455 OE2 GLU A 94 -34.561 14.633 0.759 1.00 0.00 O ATOM 0 H GLU A 94 -30.091 11.583 1.083 1.00 0.00 H new ATOM 0 HA GLU A 94 -31.893 10.622 2.882 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -31.781 12.952 2.516 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -31.957 12.792 0.780 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -34.321 12.164 1.053 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -34.159 12.243 2.796 1.00 0.00 H new ATOM 1462 N GLY A 95 -34.018 9.699 1.884 1.00 0.00 N ATOM 1463 CA GLY A 95 -35.084 8.875 1.342 1.00 0.00 C ATOM 1464 C GLY A 95 -34.688 7.420 1.170 1.00 0.00 C ATOM 1465 O GLY A 95 -35.523 6.529 1.310 1.00 0.00 O ATOM 0 H GLY A 95 -34.144 9.969 2.859 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -35.950 8.933 2.001 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -35.390 9.278 0.377 1.00 0.00 H new ATOM 1469 N PHE A 96 -33.417 7.172 0.867 1.00 0.00 N ATOM 1470 CA PHE A 96 -32.938 5.808 0.661 1.00 0.00 C ATOM 1471 C PHE A 96 -31.999 5.402 1.794 1.00 0.00 C ATOM 1472 O PHE A 96 -31.081 6.143 2.141 1.00 0.00 O ATOM 1473 CB PHE A 96 -32.207 5.689 -0.680 1.00 0.00 C ATOM 1474 CG PHE A 96 -32.892 6.391 -1.819 1.00 0.00 C ATOM 1475 CD1 PHE A 96 -33.967 5.805 -2.468 1.00 0.00 C ATOM 1476 CD2 PHE A 96 -32.457 7.637 -2.243 1.00 0.00 C ATOM 1477 CE1 PHE A 96 -34.596 6.449 -3.517 1.00 0.00 C ATOM 1478 CE2 PHE A 96 -33.080 8.285 -3.291 1.00 0.00 C ATOM 1479 CZ PHE A 96 -34.151 7.691 -3.929 1.00 0.00 C ATOM 0 H PHE A 96 -32.703 7.893 0.759 1.00 0.00 H new ATOM 0 HA PHE A 96 -33.801 5.142 0.652 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -31.201 6.095 -0.570 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -32.100 4.634 -0.930 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -34.317 4.834 -2.151 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -31.620 8.107 -1.747 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -35.434 5.982 -4.014 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -32.730 9.255 -3.611 1.00 0.00 H new ATOM 0 HZ PHE A 96 -34.640 8.196 -4.749 1.00 0.00 H new ATOM 1489 N PHE A 97 -32.235 4.228 2.374 1.00 0.00 N ATOM 1490 CA PHE A 97 -31.393 3.747 3.463 1.00 0.00 C ATOM 1491 C PHE A 97 -30.379 2.730 2.963 1.00 0.00 C ATOM 1492 O PHE A 97 -30.484 2.206 1.854 1.00 0.00 O ATOM 1493 CB PHE A 97 -32.240 3.166 4.602 1.00 0.00 C ATOM 1494 CG PHE A 97 -32.951 1.882 4.274 1.00 0.00 C ATOM 1495 CD1 PHE A 97 -33.962 1.852 3.327 1.00 0.00 C ATOM 1496 CD2 PHE A 97 -32.618 0.709 4.932 1.00 0.00 C ATOM 1497 CE1 PHE A 97 -34.627 0.675 3.041 1.00 0.00 C ATOM 1498 CE2 PHE A 97 -33.283 -0.471 4.652 1.00 0.00 C ATOM 1499 CZ PHE A 97 -34.288 -0.488 3.704 1.00 0.00 C ATOM 0 H PHE A 97 -32.994 3.599 2.111 1.00 0.00 H new ATOM 0 HA PHE A 97 -30.843 4.600 3.859 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -31.595 2.997 5.464 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -32.981 3.908 4.899 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -34.233 2.759 2.807 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -31.831 0.716 5.671 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -35.412 0.665 2.299 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -33.017 -1.378 5.174 1.00 0.00 H new ATOM 0 HZ PHE A 97 -34.807 -1.409 3.482 1.00 0.00 H new ATOM 1509 N LEU A 98 -29.400 2.462 3.818 1.00 0.00 N ATOM 1510 CA LEU A 98 -28.336 1.528 3.485 1.00 0.00 C ATOM 1511 C LEU A 98 -28.672 0.108 3.916 1.00 0.00 C ATOM 1512 O LEU A 98 -29.286 -0.116 4.960 1.00 0.00 O ATOM 1513 CB LEU A 98 -27.025 1.968 4.127 1.00 0.00 C ATOM 1514 CG LEU A 98 -25.792 1.214 3.632 1.00 0.00 C ATOM 1515 CD1 LEU A 98 -24.556 2.087 3.758 1.00 0.00 C ATOM 1516 CD2 LEU A 98 -25.616 -0.086 4.402 1.00 0.00 C ATOM 0 H LEU A 98 -29.322 2.879 4.746 1.00 0.00 H new ATOM 0 HA LEU A 98 -28.228 1.531 2.400 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -26.883 3.033 3.941 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -27.103 1.841 5.207 1.00 0.00 H new ATOM 0 HG LEU A 98 -25.933 0.968 2.580 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -23.685 1.538 3.402 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -24.685 2.989 3.160 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -24.410 2.362 4.803 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -24.733 -0.609 4.036 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -25.494 0.133 5.463 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -26.495 -0.715 4.260 1.00 0.00 H new ATOM 1528 N ILE A 99 -28.256 -0.845 3.090 1.00 0.00 N ATOM 1529 CA ILE A 99 -28.469 -2.269 3.334 1.00 0.00 C ATOM 1530 C ILE A 99 -27.438 -3.072 2.560 1.00 0.00 C ATOM 1531 O ILE A 99 -27.299 -2.940 1.345 1.00 0.00 O ATOM 1532 CB ILE A 99 -29.861 -2.736 2.862 1.00 0.00 C ATOM 1533 CG1 ILE A 99 -30.817 -1.554 2.745 1.00 0.00 C ATOM 1534 CG2 ILE A 99 -30.415 -3.784 3.813 1.00 0.00 C ATOM 1535 CD1 ILE A 99 -31.921 -1.760 1.735 1.00 0.00 C ATOM 0 H ILE A 99 -27.756 -0.650 2.223 1.00 0.00 H new ATOM 0 HA ILE A 99 -28.384 -2.426 4.409 1.00 0.00 H new ATOM 0 HB ILE A 99 -29.758 -3.185 1.874 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -31.262 -1.361 3.721 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -30.249 -0.665 2.472 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -31.398 -4.105 3.468 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -29.743 -4.641 3.841 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -30.502 -3.358 4.813 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -32.560 -0.877 1.709 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -31.486 -1.923 0.749 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -32.515 -2.629 2.017 1.00 0.00 H new ATOM 1547 N GLY A 100 -26.723 -3.910 3.299 1.00 0.00 N ATOM 1548 CA GLY A 100 -25.680 -4.731 2.721 1.00 0.00 C ATOM 1549 C GLY A 100 -24.533 -4.923 3.688 1.00 0.00 C ATOM 1550 O GLY A 100 -24.352 -5.999 4.260 1.00 0.00 O ATOM 0 H GLY A 100 -26.851 -4.036 4.303 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -26.090 -5.702 2.443 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -25.313 -4.266 1.806 1.00 0.00 H new ATOM 1554 N SER A 101 -23.766 -3.858 3.861 1.00 0.00 N ATOM 1555 CA SER A 101 -22.623 -3.840 4.755 1.00 0.00 C ATOM 1556 C SER A 101 -22.007 -2.450 4.730 1.00 0.00 C ATOM 1557 O SER A 101 -21.287 -2.102 3.795 1.00 0.00 O ATOM 1558 CB SER A 101 -21.593 -4.887 4.328 1.00 0.00 C ATOM 1559 OG SER A 101 -20.979 -4.533 3.099 1.00 0.00 O ATOM 0 H SER A 101 -23.923 -2.973 3.379 1.00 0.00 H new ATOM 0 HA SER A 101 -22.946 -4.081 5.768 1.00 0.00 H new ATOM 0 HB2 SER A 101 -20.832 -4.988 5.102 1.00 0.00 H new ATOM 0 HB3 SER A 101 -22.078 -5.858 4.229 1.00 0.00 H new ATOM 0 HG SER A 101 -21.155 -3.589 2.906 1.00 0.00 H new ATOM 1565 N THR A 102 -22.296 -1.646 5.751 1.00 0.00 N ATOM 1566 CA THR A 102 -21.790 -0.284 5.803 1.00 0.00 C ATOM 1567 C THR A 102 -20.275 -0.267 5.791 1.00 0.00 C ATOM 1568 O THR A 102 -19.663 0.787 5.647 1.00 0.00 O ATOM 1569 CB THR A 102 -22.286 0.464 7.054 1.00 0.00 C ATOM 1570 OG1 THR A 102 -21.724 -0.125 8.233 1.00 0.00 O ATOM 1571 CG2 THR A 102 -23.803 0.426 7.144 1.00 0.00 C ATOM 0 H THR A 102 -22.874 -1.915 6.547 1.00 0.00 H new ATOM 0 HA THR A 102 -22.170 0.223 4.916 1.00 0.00 H new ATOM 0 HB THR A 102 -21.966 1.503 6.976 1.00 0.00 H new ATOM 0 HG1 THR A 102 -22.043 0.358 9.024 1.00 0.00 H new ATOM 0 HG21 THR A 102 -24.128 0.961 8.036 1.00 0.00 H new ATOM 0 HG22 THR A 102 -24.232 0.899 6.261 1.00 0.00 H new ATOM 0 HG23 THR A 102 -24.138 -0.610 7.200 1.00 0.00 H new ATOM 1579 N THR A 103 -19.675 -1.430 5.944 1.00 0.00 N ATOM 1580 CA THR A 103 -18.237 -1.530 5.920 1.00 0.00 C ATOM 1581 C THR A 103 -17.795 -2.425 4.780 1.00 0.00 C ATOM 1582 O THR A 103 -18.582 -3.205 4.244 1.00 0.00 O ATOM 1583 CB THR A 103 -17.689 -2.055 7.245 1.00 0.00 C ATOM 1584 OG1 THR A 103 -18.338 -3.282 7.603 1.00 0.00 O ATOM 1585 CG2 THR A 103 -17.880 -1.023 8.344 1.00 0.00 C ATOM 0 H THR A 103 -20.163 -2.315 6.086 1.00 0.00 H new ATOM 0 HA THR A 103 -17.835 -0.528 5.767 1.00 0.00 H new ATOM 0 HB THR A 103 -16.622 -2.245 7.125 1.00 0.00 H new ATOM 0 HG1 THR A 103 -17.976 -3.608 8.453 1.00 0.00 H new ATOM 0 HG21 THR A 103 -17.484 -1.413 9.282 1.00 0.00 H new ATOM 0 HG22 THR A 103 -17.351 -0.108 8.079 1.00 0.00 H new ATOM 0 HG23 THR A 103 -18.942 -0.808 8.460 1.00 0.00 H new ATOM 1593 N SER A 104 -16.535 -2.305 4.416 1.00 0.00 N ATOM 1594 CA SER A 104 -15.952 -3.108 3.361 1.00 0.00 C ATOM 1595 C SER A 104 -14.468 -3.264 3.650 1.00 0.00 C ATOM 1596 O SER A 104 -13.693 -2.326 3.485 1.00 0.00 O ATOM 1597 CB SER A 104 -16.185 -2.458 1.995 1.00 0.00 C ATOM 1598 OG SER A 104 -17.561 -2.469 1.655 1.00 0.00 O ATOM 0 H SER A 104 -15.885 -1.646 4.844 1.00 0.00 H new ATOM 0 HA SER A 104 -16.424 -4.090 3.332 1.00 0.00 H new ATOM 0 HB2 SER A 104 -15.819 -1.432 2.010 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.614 -2.989 1.233 1.00 0.00 H new ATOM 0 HG SER A 104 -18.078 -2.847 2.397 1.00 0.00 H new ATOM 1604 N ARG A 105 -14.072 -4.464 4.049 1.00 0.00 N ATOM 1605 CA ARG A 105 -12.688 -4.739 4.424 1.00 0.00 C ATOM 1606 C ARG A 105 -11.839 -5.177 3.241 1.00 0.00 C ATOM 1607 O ARG A 105 -12.284 -5.940 2.385 1.00 0.00 O ATOM 1608 CB ARG A 105 -12.652 -5.812 5.512 1.00 0.00 C ATOM 1609 CG ARG A 105 -13.504 -5.472 6.723 1.00 0.00 C ATOM 1610 CD ARG A 105 -13.437 -6.562 7.780 1.00 0.00 C ATOM 1611 NE ARG A 105 -14.199 -6.208 8.975 1.00 0.00 N ATOM 1612 CZ ARG A 105 -14.122 -6.874 10.124 1.00 0.00 C ATOM 1613 NH1 ARG A 105 -13.324 -7.928 10.232 1.00 0.00 N ATOM 1614 NH2 ARG A 105 -14.845 -6.485 11.165 1.00 0.00 N ATOM 0 H ARG A 105 -14.693 -5.270 4.122 1.00 0.00 H new ATOM 0 HA ARG A 105 -12.263 -3.808 4.799 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -12.993 -6.758 5.091 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -11.621 -5.960 5.832 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -13.167 -4.528 7.152 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -14.539 -5.330 6.412 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -13.823 -7.494 7.366 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -12.397 -6.741 8.052 1.00 0.00 H new ATOM 0 HE ARG A 105 -14.826 -5.405 8.926 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -12.767 -8.230 9.433 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -13.267 -8.436 11.114 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -15.460 -5.675 11.085 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -14.786 -6.995 12.046 1.00 0.00 H new ATOM 1628 N CYS A 106 -10.598 -4.699 3.219 1.00 0.00 N ATOM 1629 CA CYS A 106 -9.671 -5.039 2.156 1.00 0.00 C ATOM 1630 C CYS A 106 -8.847 -6.240 2.579 1.00 0.00 C ATOM 1631 O CYS A 106 -8.041 -6.158 3.505 1.00 0.00 O ATOM 1632 CB CYS A 106 -8.760 -3.856 1.826 1.00 0.00 C ATOM 1633 SG CYS A 106 -9.112 -3.071 0.223 1.00 0.00 S ATOM 0 H CYS A 106 -10.215 -4.074 3.929 1.00 0.00 H new ATOM 0 HA CYS A 106 -10.236 -5.283 1.257 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -8.855 -3.108 2.613 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -7.724 -4.196 1.832 1.00 0.00 H new ATOM 1638 N GLU A 107 -9.052 -7.352 1.898 1.00 0.00 N ATOM 1639 CA GLU A 107 -8.361 -8.581 2.233 1.00 0.00 C ATOM 1640 C GLU A 107 -7.383 -8.975 1.135 1.00 0.00 C ATOM 1641 O GLU A 107 -7.275 -8.298 0.115 1.00 0.00 O ATOM 1642 CB GLU A 107 -9.394 -9.684 2.455 1.00 0.00 C ATOM 1643 CG GLU A 107 -8.895 -10.842 3.303 1.00 0.00 C ATOM 1644 CD GLU A 107 -9.864 -12.008 3.328 1.00 0.00 C ATOM 1645 OE1 GLU A 107 -9.806 -12.846 2.403 1.00 0.00 O ATOM 1646 OE2 GLU A 107 -10.678 -12.084 4.271 1.00 0.00 O ATOM 0 H GLU A 107 -9.693 -7.428 1.108 1.00 0.00 H new ATOM 0 HA GLU A 107 -7.784 -8.431 3.145 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -10.274 -9.252 2.932 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -9.713 -10.068 1.486 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -7.934 -11.182 2.917 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -8.725 -10.494 4.322 1.00 0.00 H new ATOM 1653 N VAL A 108 -6.648 -10.051 1.378 1.00 0.00 N ATOM 1654 CA VAL A 108 -5.688 -10.539 0.399 1.00 0.00 C ATOM 1655 C VAL A 108 -5.726 -12.053 0.243 1.00 0.00 C ATOM 1656 O VAL A 108 -5.645 -12.806 1.213 1.00 0.00 O ATOM 1657 CB VAL A 108 -4.255 -10.081 0.726 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -3.234 -10.849 -0.104 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.123 -8.592 0.473 1.00 0.00 C ATOM 0 H VAL A 108 -6.697 -10.599 2.237 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.987 -10.099 -0.552 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.057 -10.287 1.778 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.230 -10.506 0.146 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -3.318 -11.914 0.111 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -3.423 -10.676 -1.164 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.107 -8.272 0.706 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.339 -8.380 -0.574 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.827 -8.052 1.105 1.00 0.00 H new ATOM 1669 N GLN A 109 -5.849 -12.472 -1.010 1.00 0.00 N ATOM 1670 CA GLN A 109 -5.896 -13.884 -1.353 1.00 0.00 C ATOM 1671 C GLN A 109 -4.833 -14.213 -2.394 1.00 0.00 C ATOM 1672 O GLN A 109 -4.673 -13.489 -3.377 1.00 0.00 O ATOM 1673 CB GLN A 109 -7.287 -14.246 -1.878 1.00 0.00 C ATOM 1674 CG GLN A 109 -8.409 -13.838 -0.934 1.00 0.00 C ATOM 1675 CD GLN A 109 -9.788 -14.036 -1.530 1.00 0.00 C ATOM 1676 OE1 GLN A 109 -10.000 -14.926 -2.354 1.00 0.00 O ATOM 1677 NE2 GLN A 109 -10.736 -13.200 -1.115 1.00 0.00 N ATOM 0 H GLN A 109 -5.919 -11.845 -1.812 1.00 0.00 H new ATOM 0 HA GLN A 109 -5.693 -14.472 -0.458 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -7.440 -13.765 -2.844 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -7.336 -15.322 -2.047 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -8.331 -14.417 -0.014 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -8.284 -12.790 -0.662 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.514 -12.477 -0.430 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -11.684 -13.282 -1.481 1.00 0.00 H new ATOM 1686 N ASP A 110 -4.108 -15.305 -2.168 1.00 0.00 N ATOM 1687 CA ASP A 110 -3.047 -15.730 -3.073 1.00 0.00 C ATOM 1688 C ASP A 110 -1.907 -14.718 -3.094 1.00 0.00 C ATOM 1689 O ASP A 110 -0.892 -14.901 -2.422 1.00 0.00 O ATOM 1690 CB ASP A 110 -3.602 -15.940 -4.481 1.00 0.00 C ATOM 1691 CG ASP A 110 -4.453 -17.189 -4.587 1.00 0.00 C ATOM 1692 OD1 ASP A 110 -3.878 -18.291 -4.711 1.00 0.00 O ATOM 1693 OD2 ASP A 110 -5.695 -17.067 -4.546 1.00 0.00 O ATOM 0 H ASP A 110 -4.238 -15.914 -1.360 1.00 0.00 H new ATOM 0 HA ASP A 110 -2.649 -16.677 -2.709 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -4.197 -15.073 -4.767 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.775 -16.006 -5.188 1.00 0.00 H new ATOM 1698 N ARG A 111 -2.079 -13.655 -3.866 1.00 0.00 N ATOM 1699 CA ARG A 111 -1.063 -12.616 -3.972 1.00 0.00 C ATOM 1700 C ARG A 111 -1.586 -11.394 -4.719 1.00 0.00 C ATOM 1701 O ARG A 111 -0.819 -10.493 -5.060 1.00 0.00 O ATOM 1702 CB ARG A 111 0.173 -13.165 -4.681 1.00 0.00 C ATOM 1703 CG ARG A 111 -0.036 -13.408 -6.166 1.00 0.00 C ATOM 1704 CD ARG A 111 1.230 -13.924 -6.830 1.00 0.00 C ATOM 1705 NE ARG A 111 2.375 -13.054 -6.574 1.00 0.00 N ATOM 1706 CZ ARG A 111 3.629 -13.379 -6.872 1.00 0.00 C ATOM 1707 NH1 ARG A 111 3.898 -14.544 -7.444 1.00 0.00 N ATOM 1708 NH2 ARG A 111 4.616 -12.536 -6.600 1.00 0.00 N ATOM 0 H ARG A 111 -2.913 -13.488 -4.429 1.00 0.00 H new ATOM 0 HA ARG A 111 -0.798 -12.305 -2.961 1.00 0.00 H new ATOM 0 HB2 ARG A 111 0.998 -12.466 -4.548 1.00 0.00 H new ATOM 0 HB3 ARG A 111 0.469 -14.101 -4.206 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -0.842 -14.128 -6.308 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -0.348 -12.481 -6.647 1.00 0.00 H new ATOM 0 HD2 ARG A 111 1.448 -14.927 -6.464 1.00 0.00 H new ATOM 0 HD3 ARG A 111 1.069 -14.004 -7.905 1.00 0.00 H new ATOM 0 HE ARG A 111 2.203 -12.146 -6.142 1.00 0.00 H new ATOM 0 HH11 ARG A 111 3.142 -15.194 -7.657 1.00 0.00 H new ATOM 0 HH12 ARG A 111 4.861 -14.790 -7.671 1.00 0.00 H new ATOM 0 HH21 ARG A 111 4.413 -11.638 -6.162 1.00 0.00 H new ATOM 0 HH22 ARG A 111 5.578 -12.786 -6.829 1.00 0.00 H new ATOM 1722 N GLY A 112 -2.890 -11.362 -4.969 1.00 0.00 N ATOM 1723 CA GLY A 112 -3.472 -10.239 -5.676 1.00 0.00 C ATOM 1724 C GLY A 112 -4.563 -9.551 -4.892 1.00 0.00 C ATOM 1725 O GLY A 112 -5.428 -8.894 -5.468 1.00 0.00 O ATOM 0 H GLY A 112 -3.551 -12.090 -4.696 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -2.689 -9.517 -5.908 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -3.878 -10.586 -6.626 1.00 0.00 H new ATOM 1729 N VAL A 113 -4.497 -9.690 -3.569 1.00 0.00 N ATOM 1730 CA VAL A 113 -5.466 -9.089 -2.647 1.00 0.00 C ATOM 1731 C VAL A 113 -6.911 -9.388 -3.044 1.00 0.00 C ATOM 1732 O VAL A 113 -7.271 -9.394 -4.219 1.00 0.00 O ATOM 1733 CB VAL A 113 -5.262 -7.557 -2.482 1.00 0.00 C ATOM 1734 CG1 VAL A 113 -4.323 -7.006 -3.535 1.00 0.00 C ATOM 1735 CG2 VAL A 113 -6.585 -6.810 -2.505 1.00 0.00 C ATOM 0 H VAL A 113 -3.766 -10.226 -3.101 1.00 0.00 H new ATOM 0 HA VAL A 113 -5.276 -9.558 -1.682 1.00 0.00 H new ATOM 0 HB VAL A 113 -4.805 -7.401 -1.505 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.203 -5.932 -3.390 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.352 -7.494 -3.448 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.737 -7.194 -4.526 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.402 -5.742 -2.387 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -7.088 -6.989 -3.456 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -7.216 -7.162 -1.689 1.00 0.00 H new ATOM 1745 N GLY A 114 -7.738 -9.635 -2.039 1.00 0.00 N ATOM 1746 CA GLY A 114 -9.125 -9.932 -2.317 1.00 0.00 C ATOM 1747 C GLY A 114 -10.063 -8.917 -1.692 1.00 0.00 C ATOM 1748 O GLY A 114 -9.796 -8.418 -0.600 1.00 0.00 O ATOM 0 H GLY A 114 -7.479 -9.635 -1.053 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.281 -9.953 -3.396 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.365 -10.926 -1.940 1.00 0.00 H new ATOM 1752 N TRP A 115 -11.162 -8.607 -2.372 1.00 0.00 N ATOM 1753 CA TRP A 115 -12.140 -7.655 -1.860 1.00 0.00 C ATOM 1754 C TRP A 115 -13.280 -8.385 -1.154 1.00 0.00 C ATOM 1755 O TRP A 115 -13.938 -9.241 -1.747 1.00 0.00 O ATOM 1756 CB TRP A 115 -12.705 -6.801 -3.003 1.00 0.00 C ATOM 1757 CG TRP A 115 -12.603 -5.318 -2.774 1.00 0.00 C ATOM 1758 CD1 TRP A 115 -12.204 -4.378 -3.680 1.00 0.00 C ATOM 1759 CD2 TRP A 115 -12.910 -4.601 -1.570 1.00 0.00 C ATOM 1760 NE1 TRP A 115 -12.240 -3.125 -3.112 1.00 0.00 N ATOM 1761 CE2 TRP A 115 -12.671 -3.236 -1.821 1.00 0.00 C ATOM 1762 CE3 TRP A 115 -13.363 -4.978 -0.305 1.00 0.00 C ATOM 1763 CZ2 TRP A 115 -12.869 -2.252 -0.859 1.00 0.00 C ATOM 1764 CZ3 TRP A 115 -13.559 -4.000 0.650 1.00 0.00 C ATOM 1765 CH2 TRP A 115 -13.312 -2.651 0.368 1.00 0.00 C ATOM 0 H TRP A 115 -11.398 -9.003 -3.282 1.00 0.00 H new ATOM 0 HA TRP A 115 -11.638 -7.005 -1.143 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -12.178 -7.052 -3.924 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -13.752 -7.063 -3.154 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -11.903 -4.587 -4.696 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -11.986 -2.255 -3.579 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -13.557 -6.016 -0.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -12.679 -1.211 -1.075 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -13.909 -4.281 1.632 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.476 -1.911 1.138 1.00 0.00 H new ATOM 1776 N SER A 116 -13.511 -8.050 0.112 1.00 0.00 N ATOM 1777 CA SER A 116 -14.577 -8.682 0.882 1.00 0.00 C ATOM 1778 C SER A 116 -15.947 -8.272 0.344 1.00 0.00 C ATOM 1779 O SER A 116 -16.709 -9.107 -0.143 1.00 0.00 O ATOM 1780 CB SER A 116 -14.463 -8.310 2.363 1.00 0.00 C ATOM 1781 OG SER A 116 -14.656 -6.921 2.556 1.00 0.00 O ATOM 0 H SER A 116 -12.977 -7.348 0.624 1.00 0.00 H new ATOM 0 HA SER A 116 -14.472 -9.762 0.782 1.00 0.00 H new ATOM 0 HB2 SER A 116 -15.202 -8.866 2.939 1.00 0.00 H new ATOM 0 HB3 SER A 116 -13.482 -8.600 2.739 1.00 0.00 H new ATOM 0 HG SER A 116 -13.924 -6.427 2.131 1.00 0.00 H new ATOM 1787 N HIS A 117 -16.251 -6.977 0.437 1.00 0.00 N ATOM 1788 CA HIS A 117 -17.525 -6.445 -0.043 1.00 0.00 C ATOM 1789 C HIS A 117 -17.303 -5.189 -0.887 1.00 0.00 C ATOM 1790 O HIS A 117 -16.448 -4.363 -0.565 1.00 0.00 O ATOM 1791 CB HIS A 117 -18.448 -6.115 1.133 1.00 0.00 C ATOM 1792 CG HIS A 117 -18.772 -7.289 2.003 1.00 0.00 C ATOM 1793 ND1 HIS A 117 -19.832 -8.137 1.759 1.00 0.00 N ATOM 1794 CD2 HIS A 117 -18.175 -7.750 3.128 1.00 0.00 C ATOM 1795 CE1 HIS A 117 -19.874 -9.065 2.698 1.00 0.00 C ATOM 1796 NE2 HIS A 117 -18.880 -8.854 3.539 1.00 0.00 N ATOM 0 H HIS A 117 -15.630 -6.276 0.842 1.00 0.00 H new ATOM 0 HA HIS A 117 -17.995 -7.209 -0.662 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -17.980 -5.343 1.743 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -19.377 -5.696 0.746 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -17.306 -7.328 3.612 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -20.600 -9.862 2.766 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -18.669 -9.419 4.361 1.00 0.00 H new ATOM 1805 N PRO A 118 -18.071 -5.026 -1.980 1.00 0.00 N ATOM 1806 CA PRO A 118 -17.958 -3.872 -2.861 1.00 0.00 C ATOM 1807 C PRO A 118 -18.871 -2.724 -2.444 1.00 0.00 C ATOM 1808 O PRO A 118 -18.485 -1.871 -1.646 1.00 0.00 O ATOM 1809 CB PRO A 118 -18.385 -4.453 -4.205 1.00 0.00 C ATOM 1810 CG PRO A 118 -19.414 -5.481 -3.859 1.00 0.00 C ATOM 1811 CD PRO A 118 -19.112 -5.956 -2.452 1.00 0.00 C ATOM 0 HA PRO A 118 -16.960 -3.433 -2.858 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -18.797 -3.683 -4.857 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -17.541 -4.898 -4.731 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -20.417 -5.057 -3.916 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -19.379 -6.313 -4.562 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -19.998 -5.918 -1.819 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -18.759 -6.987 -2.446 1.00 0.00 H new ATOM 1819 N LEU A 119 -20.081 -2.712 -2.987 1.00 0.00 N ATOM 1820 CA LEU A 119 -21.050 -1.679 -2.684 1.00 0.00 C ATOM 1821 C LEU A 119 -22.299 -2.267 -2.024 1.00 0.00 C ATOM 1822 O LEU A 119 -22.664 -3.414 -2.286 1.00 0.00 O ATOM 1823 CB LEU A 119 -21.428 -0.967 -3.974 1.00 0.00 C ATOM 1824 CG LEU A 119 -20.300 -0.184 -4.636 1.00 0.00 C ATOM 1825 CD1 LEU A 119 -20.776 0.454 -5.925 1.00 0.00 C ATOM 1826 CD2 LEU A 119 -19.784 0.864 -3.682 1.00 0.00 C ATOM 0 H LEU A 119 -20.413 -3.416 -3.646 1.00 0.00 H new ATOM 0 HA LEU A 119 -20.606 -0.973 -1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -21.801 -1.706 -4.683 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -22.250 -0.283 -3.765 1.00 0.00 H new ATOM 0 HG LEU A 119 -19.489 -0.870 -4.882 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -19.956 1.008 -6.381 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -21.116 -0.322 -6.611 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -21.599 1.136 -5.711 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -18.978 1.423 -4.157 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -20.592 1.546 -3.419 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -19.409 0.381 -2.780 1.00 0.00 H new ATOM 1838 N PRO A 120 -22.971 -1.485 -1.158 1.00 0.00 N ATOM 1839 CA PRO A 120 -24.184 -1.932 -0.466 1.00 0.00 C ATOM 1840 C PRO A 120 -25.428 -1.833 -1.347 1.00 0.00 C ATOM 1841 O PRO A 120 -25.356 -2.034 -2.560 1.00 0.00 O ATOM 1842 CB PRO A 120 -24.276 -0.963 0.710 1.00 0.00 C ATOM 1843 CG PRO A 120 -23.670 0.299 0.203 1.00 0.00 C ATOM 1844 CD PRO A 120 -22.600 -0.106 -0.779 1.00 0.00 C ATOM 0 HA PRO A 120 -24.135 -2.981 -0.175 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -25.310 -0.810 1.018 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -23.737 -1.341 1.579 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -24.422 0.925 -0.278 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -23.246 0.882 1.021 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -22.581 0.555 -1.645 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -21.608 -0.068 -0.328 1.00 0.00 H new ATOM 1852 N GLN A 121 -26.568 -1.521 -0.733 1.00 0.00 N ATOM 1853 CA GLN A 121 -27.820 -1.404 -1.474 1.00 0.00 C ATOM 1854 C GLN A 121 -28.635 -0.205 -0.995 1.00 0.00 C ATOM 1855 O GLN A 121 -29.036 -0.140 0.168 1.00 0.00 O ATOM 1856 CB GLN A 121 -28.641 -2.687 -1.329 1.00 0.00 C ATOM 1857 CG GLN A 121 -29.436 -3.044 -2.575 1.00 0.00 C ATOM 1858 CD GLN A 121 -30.474 -1.998 -2.930 1.00 0.00 C ATOM 1859 OE1 GLN A 121 -30.194 -1.056 -3.671 1.00 0.00 O ATOM 1860 NE2 GLN A 121 -31.682 -2.160 -2.402 1.00 0.00 N ATOM 0 H GLN A 121 -26.650 -1.346 0.269 1.00 0.00 H new ATOM 0 HA GLN A 121 -27.576 -1.251 -2.525 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -27.971 -3.512 -1.087 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -29.327 -2.577 -0.489 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -28.751 -3.169 -3.414 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -29.931 -4.003 -2.422 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -31.870 -2.956 -1.793 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -32.422 -1.488 -2.606 1.00 0.00 H new ATOM 1869 N CYS A 122 -28.873 0.741 -1.899 1.00 0.00 N ATOM 1870 CA CYS A 122 -29.642 1.930 -1.545 1.00 0.00 C ATOM 1871 C CYS A 122 -31.077 1.829 -2.057 1.00 0.00 C ATOM 1872 O CYS A 122 -31.321 1.884 -3.263 1.00 0.00 O ATOM 1873 CB CYS A 122 -28.975 3.191 -2.099 1.00 0.00 C ATOM 1874 SG CYS A 122 -27.483 3.709 -1.188 1.00 0.00 S ATOM 0 H CYS A 122 -28.551 0.710 -2.866 1.00 0.00 H new ATOM 0 HA CYS A 122 -29.669 1.996 -0.457 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -28.709 3.019 -3.142 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -29.698 4.007 -2.084 1.00 0.00 H new ATOM 1879 N GLU A 123 -32.022 1.679 -1.133 1.00 0.00 N ATOM 1880 CA GLU A 123 -33.435 1.570 -1.485 1.00 0.00 C ATOM 1881 C GLU A 123 -34.258 2.546 -0.652 1.00 0.00 C ATOM 1882 O GLU A 123 -33.956 2.797 0.514 1.00 0.00 O ATOM 1883 CB GLU A 123 -33.932 0.138 -1.265 1.00 0.00 C ATOM 1884 CG GLU A 123 -35.409 -0.050 -1.572 1.00 0.00 C ATOM 1885 CD GLU A 123 -35.899 -1.448 -1.249 1.00 0.00 C ATOM 1886 OE1 GLU A 123 -35.783 -2.335 -2.120 1.00 0.00 O ATOM 1887 OE2 GLU A 123 -36.399 -1.655 -0.123 1.00 0.00 O ATOM 0 H GLU A 123 -31.834 1.630 -0.132 1.00 0.00 H new ATOM 0 HA GLU A 123 -33.552 1.819 -2.540 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -33.351 -0.539 -1.891 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -33.746 -0.147 -0.229 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -35.990 0.675 -1.002 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -35.586 0.158 -2.627 1.00 0.00 H new ATOM 1894 N ILE A 124 -35.301 3.094 -1.267 1.00 0.00 N ATOM 1895 CA ILE A 124 -36.157 4.062 -0.591 1.00 0.00 C ATOM 1896 C ILE A 124 -36.918 3.417 0.563 1.00 0.00 C ATOM 1897 O ILE A 124 -37.282 2.243 0.503 1.00 0.00 O ATOM 1898 CB ILE A 124 -37.162 4.708 -1.567 1.00 0.00 C ATOM 1899 CG1 ILE A 124 -37.926 5.839 -0.870 1.00 0.00 C ATOM 1900 CG2 ILE A 124 -38.127 3.662 -2.106 1.00 0.00 C ATOM 1901 CD1 ILE A 124 -38.812 6.638 -1.801 1.00 0.00 C ATOM 0 H ILE A 124 -35.573 2.886 -2.228 1.00 0.00 H new ATOM 0 HA ILE A 124 -35.502 4.839 -0.196 1.00 0.00 H new ATOM 0 HB ILE A 124 -36.611 5.130 -2.407 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -38.539 5.415 -0.074 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -37.210 6.512 -0.397 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -38.829 4.134 -2.793 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -37.568 2.889 -2.633 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -38.676 3.213 -1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -39.320 7.420 -1.237 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -38.203 7.092 -2.583 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -39.552 5.978 -2.255 1.00 0.00 H new ATOM 1913 N LEU A 125 -37.150 4.197 1.616 1.00 0.00 N ATOM 1914 CA LEU A 125 -37.870 3.713 2.789 1.00 0.00 C ATOM 1915 C LEU A 125 -39.322 3.402 2.446 1.00 0.00 C ATOM 1916 O LEU A 125 -39.880 3.961 1.501 1.00 0.00 O ATOM 1917 CB LEU A 125 -37.814 4.752 3.912 1.00 0.00 C ATOM 1918 CG LEU A 125 -36.424 5.001 4.504 1.00 0.00 C ATOM 1919 CD1 LEU A 125 -36.449 6.205 5.435 1.00 0.00 C ATOM 1920 CD2 LEU A 125 -35.932 3.765 5.241 1.00 0.00 C ATOM 0 H LEU A 125 -36.849 5.169 1.680 1.00 0.00 H new ATOM 0 HA LEU A 125 -37.389 2.795 3.126 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -38.203 5.696 3.531 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -38.480 4.433 4.713 1.00 0.00 H new ATOM 0 HG LEU A 125 -35.733 5.213 3.688 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -35.453 6.367 5.847 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -36.760 7.089 4.878 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -37.152 6.022 6.248 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -34.943 3.958 5.656 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -36.623 3.524 6.048 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -35.877 2.926 4.548 1.00 0.00 H new ATOM 1932 N GLU A 126 -39.929 2.508 3.220 1.00 0.00 N ATOM 1933 CA GLU A 126 -41.318 2.123 2.998 1.00 0.00 C ATOM 1934 C GLU A 126 -42.267 3.204 3.507 1.00 0.00 C ATOM 1935 O GLU A 126 -42.340 3.463 4.709 1.00 0.00 O ATOM 1936 CB GLU A 126 -41.619 0.794 3.694 1.00 0.00 C ATOM 1937 CG GLU A 126 -40.773 -0.364 3.188 1.00 0.00 C ATOM 1938 CD GLU A 126 -40.991 -0.647 1.715 1.00 0.00 C ATOM 1939 OE1 GLU A 126 -41.992 -1.315 1.381 1.00 0.00 O ATOM 1940 OE2 GLU A 126 -40.160 -0.201 0.896 1.00 0.00 O ATOM 0 H GLU A 126 -39.481 2.037 4.006 1.00 0.00 H new ATOM 0 HA GLU A 126 -41.471 2.005 1.925 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -41.457 0.910 4.766 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -42.672 0.551 3.555 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -39.720 -0.141 3.359 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -41.007 -1.259 3.764 1.00 0.00 H new ATOM 1947 N HIS A 127 -42.989 3.833 2.586 1.00 0.00 N ATOM 1948 CA HIS A 127 -43.933 4.887 2.943 1.00 0.00 C ATOM 1949 C HIS A 127 -45.337 4.553 2.450 1.00 0.00 C ATOM 1950 O HIS A 127 -46.228 4.254 3.245 1.00 0.00 O ATOM 1951 CB HIS A 127 -43.480 6.225 2.357 1.00 0.00 C ATOM 1952 CG HIS A 127 -42.172 6.707 2.905 1.00 0.00 C ATOM 1953 ND1 HIS A 127 -41.033 6.829 2.138 1.00 0.00 N ATOM 1954 CD2 HIS A 127 -41.827 7.105 4.153 1.00 0.00 C ATOM 1955 CE1 HIS A 127 -40.044 7.280 2.890 1.00 0.00 C ATOM 1956 NE2 HIS A 127 -40.501 7.455 4.115 1.00 0.00 N ATOM 0 H HIS A 127 -42.939 3.632 1.587 1.00 0.00 H new ATOM 0 HA HIS A 127 -43.959 4.963 4.030 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -43.398 6.129 1.274 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -44.245 6.976 2.553 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -42.475 7.140 5.017 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -39.034 7.472 2.558 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -39.956 7.796 4.907 1.00 0.00 H new ATOM 1965 N HIS A 128 -45.526 4.609 1.133 1.00 0.00 N ATOM 1966 CA HIS A 128 -46.819 4.310 0.526 1.00 0.00 C ATOM 1967 C HIS A 128 -47.903 5.254 1.042 1.00 0.00 C ATOM 1968 O HIS A 128 -49.096 4.987 0.889 1.00 0.00 O ATOM 1969 CB HIS A 128 -47.217 2.859 0.804 1.00 0.00 C ATOM 1970 CG HIS A 128 -46.263 1.858 0.231 1.00 0.00 C ATOM 1971 ND1 HIS A 128 -46.505 1.172 -0.940 1.00 0.00 N ATOM 1972 CD2 HIS A 128 -45.060 1.425 0.677 1.00 0.00 C ATOM 1973 CE1 HIS A 128 -45.492 0.361 -1.191 1.00 0.00 C ATOM 1974 NE2 HIS A 128 -44.602 0.497 -0.226 1.00 0.00 N ATOM 0 H HIS A 128 -44.797 4.860 0.465 1.00 0.00 H new ATOM 0 HA HIS A 128 -46.723 4.454 -0.550 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -47.285 2.709 1.882 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -48.211 2.678 0.394 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -44.555 1.749 1.575 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -45.407 -0.300 -2.041 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -43.717 -0.006 -0.161 1.00 0.00 H new ATOM 1983 N HIS A 129 -47.480 6.359 1.649 1.00 0.00 N ATOM 1984 CA HIS A 129 -48.414 7.344 2.184 1.00 0.00 C ATOM 1985 C HIS A 129 -48.317 8.655 1.411 1.00 0.00 C ATOM 1986 O HIS A 129 -47.222 9.143 1.132 1.00 0.00 O ATOM 1987 CB HIS A 129 -48.136 7.589 3.668 1.00 0.00 C ATOM 1988 CG HIS A 129 -49.103 8.536 4.312 1.00 0.00 C ATOM 1989 ND1 HIS A 129 -48.717 9.712 4.923 1.00 0.00 N ATOM 1990 CD2 HIS A 129 -50.450 8.472 4.441 1.00 0.00 C ATOM 1991 CE1 HIS A 129 -49.783 10.329 5.400 1.00 0.00 C ATOM 1992 NE2 HIS A 129 -50.847 9.598 5.120 1.00 0.00 N ATOM 0 H HIS A 129 -46.497 6.595 1.783 1.00 0.00 H new ATOM 0 HA HIS A 129 -49.425 6.951 2.074 1.00 0.00 H new ATOM 0 HB2 HIS A 129 -48.167 6.636 4.197 1.00 0.00 H new ATOM 0 HB3 HIS A 129 -47.126 7.983 3.779 1.00 0.00 H new ATOM 0 HD2 HIS A 129 -51.092 7.683 4.078 1.00 0.00 H new ATOM 0 HE1 HIS A 129 -49.784 11.271 5.929 1.00 0.00 H new ATOM 0 HE2 HIS A 129 -51.808 9.832 5.368 1.00 0.00 H new ATOM 2001 N HIS A 130 -49.471 9.221 1.066 1.00 0.00 N ATOM 2002 CA HIS A 130 -49.515 10.474 0.322 1.00 0.00 C ATOM 2003 C HIS A 130 -50.370 11.510 1.046 1.00 0.00 C ATOM 2004 O HIS A 130 -51.584 11.354 1.166 1.00 0.00 O ATOM 2005 CB HIS A 130 -50.064 10.235 -1.085 1.00 0.00 C ATOM 2006 CG HIS A 130 -49.224 9.306 -1.906 1.00 0.00 C ATOM 2007 ND1 HIS A 130 -48.402 9.737 -2.926 1.00 0.00 N ATOM 2008 CD2 HIS A 130 -49.080 7.960 -1.853 1.00 0.00 C ATOM 2009 CE1 HIS A 130 -47.790 8.696 -3.465 1.00 0.00 C ATOM 2010 NE2 HIS A 130 -48.183 7.608 -2.831 1.00 0.00 N ATOM 0 H HIS A 130 -50.387 8.831 1.290 1.00 0.00 H new ATOM 0 HA HIS A 130 -48.498 10.859 0.248 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -51.072 9.828 -1.008 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -50.145 11.191 -1.602 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -49.578 7.289 -1.169 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -47.088 8.731 -4.285 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -47.871 6.658 -3.035 1.00 0.00 H new ATOM 2019 N HIS A 131 -49.724 12.566 1.528 1.00 0.00 N ATOM 2020 CA HIS A 131 -50.418 13.634 2.238 1.00 0.00 C ATOM 2021 C HIS A 131 -51.134 14.558 1.258 1.00 0.00 C ATOM 2022 O HIS A 131 -51.986 15.356 1.649 1.00 0.00 O ATOM 2023 CB HIS A 131 -49.427 14.441 3.080 1.00 0.00 C ATOM 2024 CG HIS A 131 -48.409 15.173 2.262 1.00 0.00 C ATOM 2025 ND1 HIS A 131 -48.430 16.541 2.087 1.00 0.00 N ATOM 2026 CD2 HIS A 131 -47.335 14.724 1.568 1.00 0.00 C ATOM 2027 CE1 HIS A 131 -47.415 16.901 1.321 1.00 0.00 C ATOM 2028 NE2 HIS A 131 -46.735 15.818 0.993 1.00 0.00 N ATOM 0 H HIS A 131 -48.717 12.705 1.439 1.00 0.00 H new ATOM 0 HA HIS A 131 -51.160 13.180 2.895 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -49.978 15.159 3.688 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -48.914 13.769 3.768 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -47.011 13.697 1.483 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -47.181 17.910 1.015 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -45.900 15.797 0.408 1.00 0.00 H new ATOM 2037 N HIS A 132 -50.780 14.441 -0.018 1.00 0.00 N ATOM 2038 CA HIS A 132 -51.381 15.267 -1.059 1.00 0.00 C ATOM 2039 C HIS A 132 -51.562 14.471 -2.348 1.00 0.00 C ATOM 2040 O HIS A 132 -50.582 14.354 -3.114 1.00 0.00 O ATOM 2041 CB HIS A 132 -50.511 16.501 -1.318 1.00 0.00 C ATOM 2042 CG HIS A 132 -51.048 17.406 -2.384 1.00 0.00 C ATOM 2043 ND1 HIS A 132 -51.927 18.436 -2.124 1.00 0.00 N ATOM 2044 CD2 HIS A 132 -50.822 17.436 -3.718 1.00 0.00 C ATOM 2045 CE1 HIS A 132 -52.218 19.060 -3.252 1.00 0.00 C ATOM 2046 NE2 HIS A 132 -51.560 18.472 -4.234 1.00 0.00 N ATOM 2047 OXT HIS A 132 -52.683 13.970 -2.579 1.00 0.00 O ATOM 0 H HIS A 132 -50.079 13.781 -0.356 1.00 0.00 H new ATOM 0 HA HIS A 132 -52.364 15.589 -0.716 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -50.412 17.066 -0.391 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -49.510 16.175 -1.601 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -50.180 16.769 -4.274 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -52.881 19.907 -3.353 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -51.594 18.743 -5.217 1.00 0.00 H new TER 2056 HIS A 132