USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1347 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 99 SER OG : rot 72:sc= 1.19 USER MOD Set 1.2: A 130 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 135 SER OG : rot -61:sc= 1.04 USER MOD Set 2.1: A 81 THR OG1 : rot 160:sc= 1.17 USER MOD Set 2.2: A 146 GLN : amide:sc= 0.993 K(o=2.2,f=-1.2) USER MOD Set 3.1: A 34 MET CE :methyl -171:sc= -11.7! (180deg=-11.7!) USER MOD Set 3.2: A 51 MET CE :methyl 173:sc= -3.05! (180deg=-3.35!) USER MOD Set 4.1: A 1 MET N :NH3+ -166:sc= 1.26 (180deg=0) USER MOD Set 4.2: A 5 THR OG1 : rot -25:sc= 1.52 USER MOD Single : A 1 MET CE :methyl -162:sc= -0.0796 (180deg=-0.502) USER MOD Single : A 3 SER OG : rot -62:sc= 0.0703 USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.0096) USER MOD Single : A 13 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 22 LYS NZ :NH3+ -155:sc= 0.916 (180deg=0.28) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 168:sc= -0.0371 (180deg=-0.239) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -7.49! C(o=-7.5!,f=-13!) USER MOD Single : A 42 LYS NZ :NH3+ 165:sc= -0.0453 (180deg=-0.274) USER MOD Single : A 45 LYS NZ :NH3+ -174:sc=-0.00705 (180deg=-0.0803) USER MOD Single : A 46 SER OG : rot 144:sc= 0.924 USER MOD Single : A 48 TYR OH : rot 130:sc= 0 USER MOD Single : A 49 MET CE :methyl 165:sc= -1.89 (180deg=-2.34) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.0022) USER MOD Single : A 74 THR OG1 : rot -52:sc= 0.36 USER MOD Single : A 75 GLN : amide:sc= -0.217 X(o=-0.22,f=-0.51) USER MOD Single : A 76 ASN : amide:sc= 1.02 K(o=1,f=-7.4!) USER MOD Single : A 85 LYS NZ :NH3+ -120:sc= 1.13 (180deg=0.587) USER MOD Single : A 91 SER OG : rot -179:sc= 1.85 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 110:sc= -0.408 USER MOD Single : A 112 MET CE :methyl 180:sc= -1.7 (180deg=-1.7) USER MOD Single : A 115 LYS NZ :NH3+ -174:sc= 2.29 (180deg=2.25) USER MOD Single : A 126 LYS NZ :NH3+ 152:sc= 1.28 (180deg=1.16) USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 GLN : amide:sc= -0.0387 X(o=-0.039,f=-0.043) USER MOD Single : A 150 SER OG : rot 125:sc= 1.64 USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 SER OG : rot 180:sc= 0.00393 USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 164 THR OG1 : rot -130:sc= -0.0559 USER MOD Single : A 168 MET CE :methyl -117:sc= -1.39 (180deg=-3.78!) USER MOD Single : A 169 GLN :FLIP amide:sc= 0 F(o=-0.93,f=0) USER MOD Single : A 171 THR OG1 : rot 16:sc= 0.682 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 173 SER OG : rot 180:sc= 0.00781 USER MOD Single : A 180 GLN : amide:sc= -0.0423 K(o=-0.042,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.654 46.141 -10.968 1.00 33.65 N ATOM 2 CA MET A 1 -7.613 45.114 -11.436 1.00 33.45 C ATOM 3 C MET A 1 -8.308 44.463 -10.246 1.00 33.18 C ATOM 4 O MET A 1 -7.656 44.152 -9.249 1.00 33.13 O ATOM 5 CB MET A 1 -6.882 44.050 -12.261 1.00 33.33 C ATOM 6 CG MET A 1 -7.807 42.976 -12.817 1.00 33.70 C ATOM 7 SD MET A 1 -6.940 41.725 -13.787 1.00 34.05 S ATOM 8 CE MET A 1 -6.293 42.713 -15.132 1.00 34.32 C ATOM 0 H1 MET A 1 -6.364 46.737 -11.770 1.00 33.65 H new ATOM 0 H2 MET A 1 -7.106 46.733 -10.242 1.00 33.65 H new ATOM 0 H3 MET A 1 -5.817 45.675 -10.563 1.00 33.65 H new ATOM 0 HA MET A 1 -8.364 45.595 -12.063 1.00 33.45 H new ATOM 0 HB2 MET A 1 -6.362 44.535 -13.087 1.00 33.33 H new ATOM 0 HB3 MET A 1 -6.121 43.578 -11.639 1.00 33.33 H new ATOM 0 HG2 MET A 1 -8.327 42.490 -11.991 1.00 33.70 H new ATOM 0 HG3 MET A 1 -8.567 43.447 -13.440 1.00 33.70 H new ATOM 0 HE1 MET A 1 -6.018 42.062 -15.962 1.00 34.32 H new ATOM 0 HE2 MET A 1 -7.054 43.420 -15.462 1.00 34.32 H new ATOM 0 HE3 MET A 1 -5.413 43.259 -14.792 1.00 34.32 H new ATOM 20 N GLY A 2 -9.614 44.258 -10.339 1.00 33.09 N ATOM 21 CA GLY A 2 -10.331 43.585 -9.271 1.00 32.90 C ATOM 22 C GLY A 2 -10.336 44.374 -7.977 1.00 32.89 C ATOM 23 O GLY A 2 -9.825 43.905 -6.955 1.00 32.86 O ATOM 0 H GLY A 2 -10.190 44.544 -11.131 1.00 33.09 H new ATOM 0 HA2 GLY A 2 -11.359 43.407 -9.586 1.00 32.90 H new ATOM 0 HA3 GLY A 2 -9.878 42.609 -9.094 1.00 32.90 H new ATOM 27 N SER A 3 -10.893 45.582 -8.039 1.00 32.98 N ATOM 28 CA SER A 3 -11.046 46.442 -6.871 1.00 33.04 C ATOM 29 C SER A 3 -9.698 46.735 -6.203 1.00 32.62 C ATOM 30 O SER A 3 -9.445 46.341 -5.062 1.00 32.63 O ATOM 31 CB SER A 3 -12.028 45.814 -5.872 1.00 33.70 C ATOM 32 OG SER A 3 -12.282 46.668 -4.766 1.00 34.12 O ATOM 0 H SER A 3 -11.251 45.991 -8.902 1.00 32.98 H new ATOM 0 HA SER A 3 -11.453 47.395 -7.208 1.00 33.04 H new ATOM 0 HB2 SER A 3 -12.966 45.589 -6.379 1.00 33.70 H new ATOM 0 HB3 SER A 3 -11.624 44.867 -5.513 1.00 33.70 H new ATOM 0 HG SER A 3 -11.448 46.828 -4.278 1.00 34.12 H new ATOM 38 N ALA A 4 -8.836 47.422 -6.963 1.00 32.32 N ATOM 39 CA ALA A 4 -7.517 47.859 -6.499 1.00 31.97 C ATOM 40 C ALA A 4 -6.596 46.678 -6.214 1.00 31.64 C ATOM 41 O ALA A 4 -6.667 46.064 -5.156 1.00 31.19 O ATOM 42 CB ALA A 4 -7.642 48.751 -5.268 1.00 31.74 C ATOM 0 H ALA A 4 -9.038 47.692 -7.926 1.00 32.32 H new ATOM 0 HA ALA A 4 -7.067 48.440 -7.304 1.00 31.97 H new ATOM 0 HB1 ALA A 4 -6.650 49.063 -4.942 1.00 31.74 H new ATOM 0 HB2 ALA A 4 -8.236 49.631 -5.515 1.00 31.74 H new ATOM 0 HB3 ALA A 4 -8.130 48.198 -4.466 1.00 31.74 H new ATOM 48 N THR A 5 -5.727 46.362 -7.166 1.00 31.95 N ATOM 49 CA THR A 5 -4.763 45.284 -6.990 1.00 31.80 C ATOM 50 C THR A 5 -3.820 45.586 -5.826 1.00 31.31 C ATOM 51 O THR A 5 -3.516 44.712 -5.013 1.00 31.16 O ATOM 52 CB THR A 5 -3.940 45.063 -8.273 1.00 32.30 C ATOM 53 OG1 THR A 5 -4.821 44.847 -9.384 1.00 32.53 O ATOM 54 CG2 THR A 5 -3.004 43.871 -8.126 1.00 32.74 C ATOM 0 H THR A 5 -5.670 46.837 -8.067 1.00 31.95 H new ATOM 0 HA THR A 5 -5.323 44.375 -6.770 1.00 31.80 H new ATOM 0 HB THR A 5 -3.338 45.954 -8.448 1.00 32.30 H new ATOM 0 HG1 THR A 5 -5.673 44.488 -9.060 1.00 32.53 H new ATOM 0 HG21 THR A 5 -2.436 43.739 -9.047 1.00 32.74 H new ATOM 0 HG22 THR A 5 -2.317 44.047 -7.298 1.00 32.74 H new ATOM 0 HG23 THR A 5 -3.588 42.972 -7.928 1.00 32.74 H new ATOM 62 N VAL A 6 -3.373 46.834 -5.746 1.00 31.15 N ATOM 63 CA VAL A 6 -2.491 47.270 -4.676 1.00 30.77 C ATOM 64 C VAL A 6 -2.795 48.718 -4.285 1.00 30.24 C ATOM 65 O VAL A 6 -2.735 49.630 -5.116 1.00 30.59 O ATOM 66 CB VAL A 6 -0.999 47.112 -5.069 1.00 31.07 C ATOM 67 CG1 VAL A 6 -0.703 47.803 -6.393 1.00 31.29 C ATOM 68 CG2 VAL A 6 -0.089 47.646 -3.970 1.00 31.20 C ATOM 0 H VAL A 6 -3.611 47.565 -6.416 1.00 31.15 H new ATOM 0 HA VAL A 6 -2.675 46.630 -3.813 1.00 30.77 H new ATOM 0 HB VAL A 6 -0.799 46.048 -5.192 1.00 31.07 H new ATOM 0 HG11 VAL A 6 0.350 47.675 -6.643 1.00 31.29 H new ATOM 0 HG12 VAL A 6 -1.318 47.363 -7.178 1.00 31.29 H new ATOM 0 HG13 VAL A 6 -0.929 48.866 -6.307 1.00 31.29 H new ATOM 0 HG21 VAL A 6 0.952 47.524 -4.269 1.00 31.20 H new ATOM 0 HG22 VAL A 6 -0.298 48.703 -3.806 1.00 31.20 H new ATOM 0 HG23 VAL A 6 -0.269 47.093 -3.048 1.00 31.20 H new ATOM 78 N ASN A 7 -3.155 48.917 -3.027 1.00 29.46 N ATOM 79 CA ASN A 7 -3.512 50.239 -2.533 1.00 28.96 C ATOM 80 C ASN A 7 -3.090 50.388 -1.078 1.00 28.50 C ATOM 81 O ASN A 7 -2.328 51.288 -0.729 1.00 28.42 O ATOM 82 CB ASN A 7 -5.024 50.465 -2.672 1.00 28.74 C ATOM 83 CG ASN A 7 -5.458 51.840 -2.200 1.00 28.54 C ATOM 84 OD1 ASN A 7 -5.792 52.036 -1.031 1.00 28.57 O ATOM 85 ND2 ASN A 7 -5.469 52.799 -3.109 1.00 28.41 N ATOM 0 H ASN A 7 -3.208 48.177 -2.327 1.00 29.46 H new ATOM 0 HA ASN A 7 -2.989 50.988 -3.127 1.00 28.96 H new ATOM 0 HB2 ASN A 7 -5.312 50.336 -3.715 1.00 28.74 H new ATOM 0 HB3 ASN A 7 -5.555 49.705 -2.099 1.00 28.74 H new ATOM 0 HD21 ASN A 7 -5.762 53.742 -2.852 1.00 28.41 H new ATOM 0 HD22 ASN A 7 -5.185 52.596 -4.067 1.00 28.41 H new ATOM 92 N GLY A 8 -3.585 49.495 -0.239 1.00 28.28 N ATOM 93 CA GLY A 8 -3.253 49.524 1.168 1.00 27.93 C ATOM 94 C GLY A 8 -3.439 48.164 1.801 1.00 27.61 C ATOM 95 O GLY A 8 -3.060 47.154 1.209 1.00 27.61 O ATOM 0 H GLY A 8 -4.218 48.743 -0.511 1.00 28.28 H new ATOM 0 HA2 GLY A 8 -2.220 49.849 1.294 1.00 27.93 H new ATOM 0 HA3 GLY A 8 -3.881 50.254 1.678 1.00 27.93 H new ATOM 99 N PRO A 9 -4.030 48.099 2.998 1.00 27.42 N ATOM 100 CA PRO A 9 -4.284 46.830 3.678 1.00 27.20 C ATOM 101 C PRO A 9 -5.303 45.976 2.927 1.00 26.67 C ATOM 102 O PRO A 9 -6.200 46.503 2.265 1.00 26.59 O ATOM 103 CB PRO A 9 -4.841 47.239 5.047 1.00 27.23 C ATOM 104 CG PRO A 9 -4.543 48.696 5.181 1.00 27.37 C ATOM 105 CD PRO A 9 -4.498 49.246 3.786 1.00 27.51 C ATOM 0 HA PRO A 9 -3.381 46.223 3.746 1.00 27.20 H new ATOM 0 HB2 PRO A 9 -5.913 47.051 5.106 1.00 27.23 H new ATOM 0 HB3 PRO A 9 -4.372 46.667 5.848 1.00 27.23 H new ATOM 0 HG2 PRO A 9 -5.310 49.197 5.772 1.00 27.37 H new ATOM 0 HG3 PRO A 9 -3.593 48.853 5.692 1.00 27.37 H new ATOM 0 HD2 PRO A 9 -5.478 49.591 3.456 1.00 27.51 H new ATOM 0 HD3 PRO A 9 -3.818 50.095 3.708 1.00 27.51 H new ATOM 113 N HIS A 10 -5.164 44.665 3.031 1.00 26.41 N ATOM 114 CA HIS A 10 -6.082 43.747 2.376 1.00 25.98 C ATOM 115 C HIS A 10 -6.101 42.421 3.125 1.00 25.20 C ATOM 116 O HIS A 10 -5.067 41.776 3.282 1.00 24.97 O ATOM 117 CB HIS A 10 -5.671 43.534 0.912 1.00 26.32 C ATOM 118 CG HIS A 10 -6.711 42.856 0.072 1.00 26.28 C ATOM 119 ND1 HIS A 10 -7.508 43.533 -0.826 1.00 26.46 N ATOM 120 CD2 HIS A 10 -7.067 41.553 -0.026 1.00 26.19 C ATOM 121 CE1 HIS A 10 -8.307 42.679 -1.436 1.00 26.48 C ATOM 122 NE2 HIS A 10 -8.059 41.472 -0.970 1.00 26.32 N ATOM 0 H HIS A 10 -4.422 44.211 3.564 1.00 26.41 H new ATOM 0 HA HIS A 10 -7.085 44.175 2.389 1.00 25.98 H new ATOM 0 HB2 HIS A 10 -5.436 44.502 0.468 1.00 26.32 H new ATOM 0 HB3 HIS A 10 -4.757 42.941 0.886 1.00 26.32 H new ATOM 0 HD2 HIS A 10 -6.648 40.731 0.535 1.00 26.19 H new ATOM 0 HE1 HIS A 10 -9.040 42.927 -2.189 1.00 26.48 H new ATOM 0 HE2 HIS A 10 -8.529 40.616 -1.264 1.00 26.32 H new ATOM 131 N ASP A 11 -7.272 42.018 3.588 1.00 24.90 N ATOM 132 CA ASP A 11 -7.406 40.784 4.352 1.00 24.25 C ATOM 133 C ASP A 11 -8.644 40.024 3.913 1.00 23.73 C ATOM 134 O ASP A 11 -9.480 40.554 3.180 1.00 23.90 O ATOM 135 CB ASP A 11 -7.495 41.081 5.852 1.00 24.28 C ATOM 136 CG ASP A 11 -8.811 41.725 6.246 1.00 24.24 C ATOM 137 OD1 ASP A 11 -8.939 42.957 6.106 1.00 24.51 O1- ATOM 138 OD2 ASP A 11 -9.723 41.003 6.703 1.00 24.02 O ATOM 0 H ASP A 11 -8.146 42.526 3.449 1.00 24.90 H new ATOM 0 HA ASP A 11 -6.522 40.174 4.165 1.00 24.25 H new ATOM 0 HB2 ASP A 11 -7.368 40.153 6.410 1.00 24.28 H new ATOM 0 HB3 ASP A 11 -6.674 41.739 6.137 1.00 24.28 H new ATOM 143 N GLY A 12 -8.756 38.785 4.362 1.00 23.19 N ATOM 144 CA GLY A 12 -9.915 37.985 4.036 1.00 22.76 C ATOM 145 C GLY A 12 -9.543 36.600 3.561 1.00 21.82 C ATOM 146 O GLY A 12 -10.402 35.723 3.481 1.00 21.65 O ATOM 0 H GLY A 12 -8.063 38.318 4.948 1.00 23.19 H new ATOM 0 HA2 GLY A 12 -10.557 37.905 4.914 1.00 22.76 H new ATOM 0 HA3 GLY A 12 -10.495 38.488 3.262 1.00 22.76 H new ATOM 150 N HIS A 13 -8.263 36.418 3.224 1.00 21.31 N ATOM 151 CA HIS A 13 -7.724 35.126 2.771 1.00 20.46 C ATOM 152 C HIS A 13 -8.185 34.791 1.350 1.00 19.83 C ATOM 153 O HIS A 13 -7.416 34.252 0.556 1.00 19.78 O ATOM 154 CB HIS A 13 -8.105 33.996 3.745 1.00 20.39 C ATOM 155 CG HIS A 13 -7.603 32.640 3.343 1.00 20.50 C ATOM 156 ND1 HIS A 13 -8.440 31.599 3.004 1.00 20.49 N ATOM 157 CD2 HIS A 13 -6.343 32.151 3.250 1.00 20.77 C ATOM 158 CE1 HIS A 13 -7.719 30.531 2.721 1.00 20.74 C ATOM 159 NE2 HIS A 13 -6.446 30.839 2.864 1.00 20.92 N ATOM 0 H HIS A 13 -7.567 37.163 3.257 1.00 21.31 H new ATOM 0 HA HIS A 13 -6.638 35.215 2.756 1.00 20.46 H new ATOM 0 HB2 HIS A 13 -7.714 34.237 4.734 1.00 20.39 H new ATOM 0 HB3 HIS A 13 -9.191 33.958 3.832 1.00 20.39 H new ATOM 0 HD2 HIS A 13 -5.429 32.693 3.444 1.00 20.77 H new ATOM 0 HE1 HIS A 13 -8.106 29.568 2.423 1.00 20.74 H new ATOM 0 HE2 HIS A 13 -5.663 30.204 2.712 1.00 20.92 H new ATOM 168 N ASP A 14 -9.438 35.103 1.040 1.00 19.48 N ATOM 169 CA ASP A 14 -9.984 34.865 -0.290 1.00 18.98 C ATOM 170 C ASP A 14 -9.303 35.765 -1.308 1.00 18.18 C ATOM 171 O ASP A 14 -9.102 36.956 -1.055 1.00 18.03 O ATOM 172 CB ASP A 14 -11.493 35.126 -0.317 1.00 19.31 C ATOM 173 CG ASP A 14 -12.264 34.267 0.660 1.00 19.60 C ATOM 174 OD1 ASP A 14 -12.394 33.048 0.416 1.00 19.65 O1- ATOM 175 OD2 ASP A 14 -12.754 34.809 1.676 1.00 19.89 O ATOM 0 H ASP A 14 -10.097 35.523 1.695 1.00 19.48 H new ATOM 0 HA ASP A 14 -9.801 33.821 -0.544 1.00 18.98 H new ATOM 0 HB2 ASP A 14 -11.678 36.176 -0.091 1.00 19.31 H new ATOM 0 HB3 ASP A 14 -11.868 34.946 -1.324 1.00 19.31 H new ATOM 180 N PRO A 15 -8.933 35.218 -2.472 1.00 17.80 N ATOM 181 CA PRO A 15 -8.292 35.989 -3.529 1.00 17.14 C ATOM 182 C PRO A 15 -9.289 36.826 -4.325 1.00 16.68 C ATOM 183 O PRO A 15 -10.497 36.790 -4.070 1.00 16.69 O ATOM 184 CB PRO A 15 -7.665 34.914 -4.414 1.00 17.09 C ATOM 185 CG PRO A 15 -8.553 33.728 -4.249 1.00 17.72 C ATOM 186 CD PRO A 15 -9.106 33.801 -2.847 1.00 18.12 C ATOM 0 HA PRO A 15 -7.575 36.708 -3.134 1.00 17.14 H new ATOM 0 HB2 PRO A 15 -7.620 35.234 -5.455 1.00 17.09 H new ATOM 0 HB3 PRO A 15 -6.644 34.691 -4.104 1.00 17.09 H new ATOM 0 HG2 PRO A 15 -9.357 33.740 -4.985 1.00 17.72 H new ATOM 0 HG3 PRO A 15 -7.997 32.803 -4.399 1.00 17.72 H new ATOM 0 HD2 PRO A 15 -10.154 33.504 -2.815 1.00 18.12 H new ATOM 0 HD3 PRO A 15 -8.566 33.139 -2.169 1.00 18.12 H new ATOM 194 N ALA A 16 -8.780 37.578 -5.284 1.00 16.42 N ATOM 195 CA ALA A 16 -9.618 38.346 -6.181 1.00 16.13 C ATOM 196 C ALA A 16 -9.732 37.613 -7.506 1.00 15.32 C ATOM 197 O ALA A 16 -8.905 37.798 -8.403 1.00 15.30 O ATOM 198 CB ALA A 16 -9.054 39.746 -6.379 1.00 16.58 C ATOM 0 H ALA A 16 -7.780 37.672 -5.461 1.00 16.42 H new ATOM 0 HA ALA A 16 -10.612 38.452 -5.746 1.00 16.13 H new ATOM 0 HB1 ALA A 16 -9.699 40.306 -7.056 1.00 16.58 H new ATOM 0 HB2 ALA A 16 -9.006 40.258 -5.418 1.00 16.58 H new ATOM 0 HB3 ALA A 16 -8.053 39.678 -6.805 1.00 16.58 H new ATOM 204 N ALA A 17 -10.742 36.753 -7.592 1.00 14.80 N ATOM 205 CA ALA A 17 -10.974 35.916 -8.763 1.00 14.13 C ATOM 206 C ALA A 17 -9.866 34.879 -8.909 1.00 13.59 C ATOM 207 O ALA A 17 -8.911 35.064 -9.668 1.00 13.72 O ATOM 208 CB ALA A 17 -11.109 36.759 -10.027 1.00 14.36 C ATOM 0 H ALA A 17 -11.426 36.617 -6.847 1.00 14.80 H new ATOM 0 HA ALA A 17 -11.917 35.388 -8.620 1.00 14.13 H new ATOM 0 HB1 ALA A 17 -11.281 36.106 -10.883 1.00 14.36 H new ATOM 0 HB2 ALA A 17 -11.949 37.445 -9.919 1.00 14.36 H new ATOM 0 HB3 ALA A 17 -10.193 37.329 -10.184 1.00 14.36 H new ATOM 214 N GLY A 18 -10.000 33.789 -8.163 1.00 13.17 N ATOM 215 CA GLY A 18 -9.004 32.740 -8.181 1.00 12.81 C ATOM 216 C GLY A 18 -9.162 31.821 -9.372 1.00 12.32 C ATOM 217 O GLY A 18 -9.725 30.729 -9.257 1.00 12.26 O ATOM 0 H GLY A 18 -10.789 33.614 -7.541 1.00 13.17 H new ATOM 0 HA2 GLY A 18 -8.010 33.186 -8.198 1.00 12.81 H new ATOM 0 HA3 GLY A 18 -9.076 32.157 -7.263 1.00 12.81 H new ATOM 221 N ALA A 19 -8.690 32.279 -10.521 1.00 12.17 N ATOM 222 CA ALA A 19 -8.707 31.478 -11.738 1.00 11.91 C ATOM 223 C ALA A 19 -7.816 30.251 -11.585 1.00 11.79 C ATOM 224 O ALA A 19 -8.168 29.169 -12.050 1.00 11.90 O ATOM 225 CB ALA A 19 -8.265 32.312 -12.930 1.00 11.75 C ATOM 0 H ALA A 19 -8.287 33.209 -10.638 1.00 12.17 H new ATOM 0 HA ALA A 19 -9.729 31.140 -11.913 1.00 11.91 H new ATOM 0 HB1 ALA A 19 -8.284 31.698 -13.830 1.00 11.75 H new ATOM 0 HB2 ALA A 19 -8.942 33.158 -13.053 1.00 11.75 H new ATOM 0 HB3 ALA A 19 -7.252 32.679 -12.762 1.00 11.75 H new ATOM 231 N GLU A 20 -6.665 30.451 -10.935 1.00 11.76 N ATOM 232 CA GLU A 20 -5.710 29.381 -10.617 1.00 11.81 C ATOM 233 C GLU A 20 -5.475 28.440 -11.802 1.00 11.36 C ATOM 234 O GLU A 20 -6.035 27.344 -11.881 1.00 11.31 O ATOM 235 CB GLU A 20 -6.177 28.605 -9.375 1.00 12.34 C ATOM 236 CG GLU A 20 -5.209 27.526 -8.911 1.00 12.69 C ATOM 237 CD GLU A 20 -5.608 26.916 -7.580 1.00 13.43 C ATOM 238 OE1 GLU A 20 -6.526 26.060 -7.567 1.00 13.82 O ATOM 239 OE2 GLU A 20 -5.012 27.277 -6.544 1.00 13.77 O1- ATOM 0 H GLU A 20 -6.366 31.370 -10.611 1.00 11.76 H new ATOM 0 HA GLU A 20 -4.750 29.850 -10.398 1.00 11.81 H new ATOM 0 HB2 GLU A 20 -6.336 29.310 -8.559 1.00 12.34 H new ATOM 0 HB3 GLU A 20 -7.141 28.144 -9.590 1.00 12.34 H new ATOM 0 HG2 GLU A 20 -5.158 26.741 -9.665 1.00 12.69 H new ATOM 0 HG3 GLU A 20 -4.209 27.952 -8.826 1.00 12.69 H new ATOM 246 N LEU A 21 -4.638 28.907 -12.732 1.00 11.26 N ATOM 247 CA LEU A 21 -4.183 28.115 -13.876 1.00 11.08 C ATOM 248 C LEU A 21 -5.342 27.783 -14.817 1.00 10.75 C ATOM 249 O LEU A 21 -5.236 26.906 -15.675 1.00 10.51 O ATOM 250 CB LEU A 21 -3.480 26.836 -13.391 1.00 11.53 C ATOM 251 CG LEU A 21 -2.880 25.945 -14.482 1.00 11.78 C ATOM 252 CD1 LEU A 21 -1.879 26.723 -15.320 1.00 11.96 C ATOM 253 CD2 LEU A 21 -2.224 24.723 -13.863 1.00 12.13 C ATOM 0 H LEU A 21 -4.255 29.852 -12.712 1.00 11.26 H new ATOM 0 HA LEU A 21 -3.466 28.710 -14.441 1.00 11.08 H new ATOM 0 HB2 LEU A 21 -2.683 27.121 -12.704 1.00 11.53 H new ATOM 0 HB3 LEU A 21 -4.197 26.245 -12.821 1.00 11.53 H new ATOM 0 HG LEU A 21 -3.685 25.612 -15.137 1.00 11.78 H new ATOM 0 HD11 LEU A 21 -1.464 26.072 -16.089 1.00 11.96 H new ATOM 0 HD12 LEU A 21 -2.379 27.569 -15.792 1.00 11.96 H new ATOM 0 HD13 LEU A 21 -1.075 27.087 -14.681 1.00 11.96 H new ATOM 0 HD21 LEU A 21 -1.802 24.099 -14.650 1.00 12.13 H new ATOM 0 HD22 LEU A 21 -1.430 25.040 -13.186 1.00 12.13 H new ATOM 0 HD23 LEU A 21 -2.968 24.153 -13.308 1.00 12.13 H new ATOM 265 N LYS A 22 -6.440 28.525 -14.652 1.00 10.97 N ATOM 266 CA LYS A 22 -7.669 28.336 -15.428 1.00 10.97 C ATOM 267 C LYS A 22 -8.398 27.063 -14.988 1.00 10.51 C ATOM 268 O LYS A 22 -9.519 26.789 -15.422 1.00 10.50 O ATOM 269 CB LYS A 22 -7.371 28.325 -16.943 1.00 11.77 C ATOM 270 CG LYS A 22 -8.579 28.133 -17.860 1.00 12.31 C ATOM 271 CD LYS A 22 -9.350 29.427 -18.112 1.00 13.08 C ATOM 272 CE LYS A 22 -10.260 29.797 -16.952 1.00 13.66 C ATOM 273 NZ LYS A 22 -11.185 28.690 -16.596 1.00 14.10 N1+ ATOM 0 H LYS A 22 -6.502 29.281 -13.970 1.00 10.97 H new ATOM 0 HA LYS A 22 -8.330 29.180 -15.232 1.00 10.97 H new ATOM 0 HB2 LYS A 22 -6.886 29.265 -17.205 1.00 11.77 H new ATOM 0 HB3 LYS A 22 -6.654 27.529 -17.147 1.00 11.77 H new ATOM 0 HG2 LYS A 22 -8.243 27.725 -18.813 1.00 12.31 H new ATOM 0 HG3 LYS A 22 -9.250 27.397 -17.418 1.00 12.31 H new ATOM 0 HD2 LYS A 22 -8.644 30.238 -18.289 1.00 13.08 H new ATOM 0 HD3 LYS A 22 -9.947 29.320 -19.018 1.00 13.08 H new ATOM 0 HE2 LYS A 22 -9.654 30.056 -16.084 1.00 13.66 H new ATOM 0 HE3 LYS A 22 -10.838 30.683 -17.213 1.00 13.66 H new ATOM 0 HZ1 LYS A 22 -12.032 29.080 -16.135 1.00 14.10 H new ATOM 0 HZ2 LYS A 22 -11.464 28.180 -17.458 1.00 14.10 H new ATOM 0 HZ3 LYS A 22 -10.707 28.034 -15.945 1.00 14.10 H new ATOM 287 N THR A 23 -7.778 26.312 -14.090 1.00 10.33 N ATOM 288 CA THR A 23 -8.403 25.134 -13.520 1.00 10.01 C ATOM 289 C THR A 23 -8.583 25.295 -12.022 1.00 10.01 C ATOM 290 O THR A 23 -8.433 24.347 -11.253 1.00 10.38 O ATOM 291 CB THR A 23 -7.595 23.860 -13.832 1.00 10.64 C ATOM 292 OG1 THR A 23 -6.191 24.103 -13.653 1.00 10.93 O ATOM 293 CG2 THR A 23 -7.858 23.398 -15.253 1.00 11.05 C ATOM 0 H THR A 23 -6.838 26.501 -13.741 1.00 10.33 H new ATOM 0 HA THR A 23 -9.385 25.027 -13.980 1.00 10.01 H new ATOM 0 HB THR A 23 -7.912 23.077 -13.142 1.00 10.64 H new ATOM 0 HG1 THR A 23 -5.689 23.285 -13.853 1.00 10.93 H new ATOM 0 HG21 THR A 23 -7.279 22.497 -15.456 1.00 11.05 H new ATOM 0 HG22 THR A 23 -8.919 23.182 -15.375 1.00 11.05 H new ATOM 0 HG23 THR A 23 -7.565 24.182 -15.951 1.00 11.05 H new ATOM 301 N GLY A 24 -8.938 26.505 -11.624 1.00 9.82 N ATOM 302 CA GLY A 24 -9.139 26.803 -10.229 1.00 10.05 C ATOM 303 C GLY A 24 -10.474 26.342 -9.716 1.00 9.39 C ATOM 304 O GLY A 24 -11.215 27.115 -9.103 1.00 9.61 O ATOM 0 H GLY A 24 -9.091 27.293 -12.253 1.00 9.82 H new ATOM 0 HA2 GLY A 24 -8.349 26.331 -9.645 1.00 10.05 H new ATOM 0 HA3 GLY A 24 -9.049 27.879 -10.076 1.00 10.05 H new ATOM 308 N LYS A 25 -10.780 25.090 -9.958 1.00 8.70 N ATOM 309 CA LYS A 25 -12.052 24.541 -9.574 1.00 8.11 C ATOM 310 C LYS A 25 -11.993 23.029 -9.653 1.00 7.19 C ATOM 311 O LYS A 25 -12.789 22.371 -10.315 1.00 6.94 O ATOM 312 CB LYS A 25 -13.183 25.156 -10.419 1.00 8.62 C ATOM 313 CG LYS A 25 -13.247 24.709 -11.879 1.00 9.02 C ATOM 314 CD LYS A 25 -12.193 25.391 -12.728 1.00 9.74 C ATOM 315 CE LYS A 25 -12.245 24.922 -14.174 1.00 10.22 C ATOM 316 NZ LYS A 25 -13.572 25.170 -14.799 1.00 10.38 N1+ ATOM 0 H LYS A 25 -10.157 24.430 -10.423 1.00 8.70 H new ATOM 0 HA LYS A 25 -12.278 24.799 -8.539 1.00 8.11 H new ATOM 0 HB2 LYS A 25 -14.135 24.918 -9.945 1.00 8.62 H new ATOM 0 HB3 LYS A 25 -13.078 26.241 -10.396 1.00 8.62 H new ATOM 0 HG2 LYS A 25 -13.113 23.629 -11.934 1.00 9.02 H new ATOM 0 HG3 LYS A 25 -14.235 24.929 -12.282 1.00 9.02 H new ATOM 0 HD2 LYS A 25 -12.338 26.471 -12.690 1.00 9.74 H new ATOM 0 HD3 LYS A 25 -11.205 25.187 -12.315 1.00 9.74 H new ATOM 0 HE2 LYS A 25 -11.474 25.435 -14.748 1.00 10.22 H new ATOM 0 HE3 LYS A 25 -12.019 23.857 -14.217 1.00 10.22 H new ATOM 0 HZ1 LYS A 25 -13.504 25.027 -15.827 1.00 10.38 H new ATOM 0 HZ2 LYS A 25 -14.271 24.510 -14.403 1.00 10.38 H new ATOM 0 HZ3 LYS A 25 -13.870 26.147 -14.605 1.00 10.38 H new ATOM 330 N ARG A 26 -11.014 22.504 -8.954 1.00 6.90 N ATOM 331 CA ARG A 26 -10.830 21.074 -8.803 1.00 6.23 C ATOM 332 C ARG A 26 -10.928 20.719 -7.331 1.00 5.83 C ATOM 333 O ARG A 26 -10.585 21.512 -6.452 1.00 6.27 O ATOM 334 CB ARG A 26 -9.479 20.659 -9.359 1.00 6.68 C ATOM 335 CG ARG A 26 -9.385 20.755 -10.866 1.00 7.16 C ATOM 336 CD ARG A 26 -8.102 20.120 -11.361 1.00 7.38 C ATOM 337 NE ARG A 26 -7.980 20.177 -12.813 1.00 7.54 N ATOM 338 CZ ARG A 26 -6.827 20.076 -13.465 1.00 7.99 C ATOM 339 NH1 ARG A 26 -5.687 19.926 -12.797 1.00 8.33 N1+ ATOM 340 NH2 ARG A 26 -6.813 20.138 -14.789 1.00 8.37 N ATOM 0 H ARG A 26 -10.313 23.062 -8.467 1.00 6.90 H new ATOM 0 HA ARG A 26 -11.604 20.543 -9.357 1.00 6.23 H new ATOM 0 HB2 ARG A 26 -8.705 21.286 -8.915 1.00 6.68 H new ATOM 0 HB3 ARG A 26 -9.271 19.633 -9.056 1.00 6.68 H new ATOM 0 HG2 ARG A 26 -10.242 20.259 -11.322 1.00 7.16 H new ATOM 0 HG3 ARG A 26 -9.422 21.800 -11.172 1.00 7.16 H new ATOM 0 HD2 ARG A 26 -7.250 20.626 -10.907 1.00 7.38 H new ATOM 0 HD3 ARG A 26 -8.065 19.080 -11.036 1.00 7.38 H new ATOM 0 HE ARG A 26 -8.831 20.302 -13.361 1.00 7.54 H new ATOM 0 HH11 ARG A 26 -5.694 19.888 -11.778 1.00 8.33 H new ATOM 0 HH12 ARG A 26 -4.805 19.849 -13.304 1.00 8.33 H new ATOM 0 HH21 ARG A 26 -7.685 20.263 -15.303 1.00 8.37 H new ATOM 0 HH22 ARG A 26 -5.930 20.061 -15.294 1.00 8.37 H new ATOM 354 N ILE A 27 -11.422 19.509 -7.101 1.00 5.15 N ATOM 355 CA ILE A 27 -11.879 19.052 -5.798 1.00 4.81 C ATOM 356 C ILE A 27 -10.878 19.244 -4.689 1.00 5.34 C ATOM 357 O ILE A 27 -9.752 18.748 -4.733 1.00 5.76 O ATOM 358 CB ILE A 27 -12.293 17.573 -5.850 1.00 4.32 C ATOM 359 CG1 ILE A 27 -13.472 17.400 -6.798 1.00 4.09 C ATOM 360 CG2 ILE A 27 -12.636 17.057 -4.464 1.00 4.22 C ATOM 361 CD1 ILE A 27 -14.724 18.116 -6.369 1.00 4.18 C ATOM 0 H ILE A 27 -11.517 18.804 -7.832 1.00 5.15 H new ATOM 0 HA ILE A 27 -12.737 19.682 -5.564 1.00 4.81 H new ATOM 0 HB ILE A 27 -11.452 16.988 -6.223 1.00 4.32 H new ATOM 0 HG12 ILE A 27 -13.184 17.758 -7.786 1.00 4.09 H new ATOM 0 HG13 ILE A 27 -13.691 16.337 -6.896 1.00 4.09 H new ATOM 0 HG21 ILE A 27 -12.926 16.008 -4.528 1.00 4.22 H new ATOM 0 HG22 ILE A 27 -11.766 17.154 -3.814 1.00 4.22 H new ATOM 0 HG23 ILE A 27 -13.462 17.637 -4.054 1.00 4.22 H new ATOM 0 HD11 ILE A 27 -15.513 17.939 -7.100 1.00 4.18 H new ATOM 0 HD12 ILE A 27 -15.041 17.742 -5.396 1.00 4.18 H new ATOM 0 HD13 ILE A 27 -14.526 19.186 -6.300 1.00 4.18 H new ATOM 373 N LEU A 28 -11.350 19.941 -3.675 1.00 5.52 N ATOM 374 CA LEU A 28 -10.580 20.223 -2.495 1.00 6.20 C ATOM 375 C LEU A 28 -11.165 19.468 -1.303 1.00 6.05 C ATOM 376 O LEU A 28 -10.434 19.036 -0.415 1.00 6.59 O ATOM 377 CB LEU A 28 -10.614 21.727 -2.251 1.00 6.86 C ATOM 378 CG LEU A 28 -9.538 22.275 -1.306 1.00 7.51 C ATOM 379 CD1 LEU A 28 -8.145 21.979 -1.841 1.00 8.22 C ATOM 380 CD2 LEU A 28 -9.728 23.769 -1.109 1.00 7.71 C ATOM 0 H LEU A 28 -12.293 20.330 -3.654 1.00 5.52 H new ATOM 0 HA LEU A 28 -9.548 19.898 -2.626 1.00 6.20 H new ATOM 0 HB2 LEU A 28 -10.519 22.234 -3.211 1.00 6.86 H new ATOM 0 HB3 LEU A 28 -11.592 21.988 -1.848 1.00 6.86 H new ATOM 0 HG LEU A 28 -9.640 21.778 -0.341 1.00 7.51 H new ATOM 0 HD11 LEU A 28 -7.399 22.377 -1.153 1.00 8.22 H new ATOM 0 HD12 LEU A 28 -8.013 20.901 -1.935 1.00 8.22 H new ATOM 0 HD13 LEU A 28 -8.024 22.446 -2.818 1.00 8.22 H new ATOM 0 HD21 LEU A 28 -8.959 24.148 -0.436 1.00 7.71 H new ATOM 0 HD22 LEU A 28 -9.650 24.276 -2.071 1.00 7.71 H new ATOM 0 HD23 LEU A 28 -10.711 23.957 -0.678 1.00 7.71 H new ATOM 392 N TYR A 29 -12.494 19.297 -1.313 1.00 5.47 N ATOM 393 CA TYR A 29 -13.205 18.635 -0.221 1.00 5.43 C ATOM 394 C TYR A 29 -14.703 18.530 -0.530 1.00 4.86 C ATOM 395 O TYR A 29 -15.150 18.891 -1.623 1.00 4.58 O ATOM 396 CB TYR A 29 -13.003 19.399 1.084 1.00 6.20 C ATOM 397 CG TYR A 29 -13.727 20.728 1.131 1.00 6.41 C ATOM 398 CD1 TYR A 29 -13.232 21.842 0.467 1.00 6.76 C ATOM 399 CD2 TYR A 29 -14.897 20.865 1.855 1.00 6.48 C ATOM 400 CE1 TYR A 29 -13.886 23.057 0.529 1.00 7.24 C ATOM 401 CE2 TYR A 29 -15.558 22.074 1.926 1.00 6.91 C ATOM 402 CZ TYR A 29 -15.061 23.166 1.172 1.00 7.33 C ATOM 403 OH TYR A 29 -15.703 24.377 1.330 1.00 7.99 O ATOM 0 H TYR A 29 -13.098 19.612 -2.072 1.00 5.47 H new ATOM 0 HA TYR A 29 -12.798 17.629 -0.115 1.00 5.43 H new ATOM 0 HB2 TYR A 29 -13.345 18.780 1.913 1.00 6.20 H new ATOM 0 HB3 TYR A 29 -11.937 19.571 1.233 1.00 6.20 H new ATOM 0 HD1 TYR A 29 -12.321 21.757 -0.107 1.00 6.76 H new ATOM 0 HD2 TYR A 29 -15.301 20.009 2.375 1.00 6.48 H new ATOM 0 HE1 TYR A 29 -13.450 23.925 0.057 1.00 7.24 H new ATOM 0 HE2 TYR A 29 -16.437 22.186 2.544 1.00 6.91 H new ATOM 0 HH TYR A 29 -16.540 24.242 1.822 1.00 7.99 H new ATOM 413 N TRP A 30 -15.460 18.026 0.446 1.00 4.95 N ATOM 414 CA TRP A 30 -16.898 17.787 0.301 1.00 4.73 C ATOM 415 C TRP A 30 -17.696 18.585 1.324 1.00 5.18 C ATOM 416 O TRP A 30 -17.250 18.784 2.458 1.00 5.61 O ATOM 417 CB TRP A 30 -17.195 16.303 0.495 1.00 4.74 C ATOM 418 CG TRP A 30 -17.264 15.520 -0.778 1.00 4.48 C ATOM 419 CD1 TRP A 30 -18.385 14.999 -1.355 1.00 4.66 C ATOM 420 CD2 TRP A 30 -16.172 15.162 -1.631 1.00 4.33 C ATOM 421 NE1 TRP A 30 -18.053 14.334 -2.509 1.00 4.65 N ATOM 422 CE2 TRP A 30 -16.703 14.418 -2.700 1.00 4.37 C ATOM 423 CE3 TRP A 30 -14.799 15.395 -1.591 1.00 4.46 C ATOM 424 CZ2 TRP A 30 -15.907 13.908 -3.719 1.00 4.41 C ATOM 425 CZ3 TRP A 30 -14.010 14.890 -2.603 1.00 4.49 C ATOM 426 CH2 TRP A 30 -14.566 14.152 -3.652 1.00 4.40 C ATOM 0 H TRP A 30 -15.092 17.771 1.363 1.00 4.95 H new ATOM 0 HA TRP A 30 -17.191 18.105 -0.699 1.00 4.73 H new ATOM 0 HB2 TRP A 30 -16.425 15.870 1.133 1.00 4.74 H new ATOM 0 HB3 TRP A 30 -18.142 16.200 1.024 1.00 4.74 H new ATOM 0 HD1 TRP A 30 -19.386 15.096 -0.962 1.00 4.66 H new ATOM 0 HE1 TRP A 30 -18.709 13.854 -3.125 1.00 4.65 H new ATOM 0 HE3 TRP A 30 -14.361 15.961 -0.782 1.00 4.46 H new ATOM 0 HZ2 TRP A 30 -16.334 13.340 -4.533 1.00 4.41 H new ATOM 0 HZ3 TRP A 30 -12.945 15.068 -2.585 1.00 4.49 H new ATOM 0 HH2 TRP A 30 -13.920 13.766 -4.427 1.00 4.40 H new ATOM 437 N ARG A 31 -18.880 19.025 0.915 1.00 5.31 N ATOM 438 CA ARG A 31 -19.775 19.784 1.774 1.00 5.89 C ATOM 439 C ARG A 31 -21.215 19.523 1.346 1.00 6.18 C ATOM 440 O ARG A 31 -21.490 19.333 0.161 1.00 6.15 O ATOM 441 CB ARG A 31 -19.462 21.281 1.676 1.00 6.39 C ATOM 442 CG ARG A 31 -20.221 21.996 0.565 1.00 6.58 C ATOM 443 CD ARG A 31 -19.552 23.293 0.149 1.00 7.25 C ATOM 444 NE ARG A 31 -19.137 24.116 1.288 1.00 7.68 N ATOM 445 CZ ARG A 31 -19.405 25.421 1.401 1.00 8.49 C ATOM 446 NH1 ARG A 31 -20.174 26.035 0.508 1.00 8.90 N1+ ATOM 447 NH2 ARG A 31 -18.903 26.114 2.413 1.00 9.06 N ATOM 0 H ARG A 31 -19.245 18.864 -0.024 1.00 5.31 H new ATOM 0 HA ARG A 31 -19.637 19.470 2.809 1.00 5.89 H new ATOM 0 HB2 ARG A 31 -19.698 21.755 2.628 1.00 6.39 H new ATOM 0 HB3 ARG A 31 -18.392 21.409 1.513 1.00 6.39 H new ATOM 0 HG2 ARG A 31 -20.299 21.337 -0.300 1.00 6.58 H new ATOM 0 HG3 ARG A 31 -21.237 22.205 0.899 1.00 6.58 H new ATOM 0 HD2 ARG A 31 -18.680 23.065 -0.464 1.00 7.25 H new ATOM 0 HD3 ARG A 31 -20.239 23.866 -0.474 1.00 7.25 H new ATOM 0 HE ARG A 31 -18.613 23.667 2.039 1.00 7.68 H new ATOM 0 HH11 ARG A 31 -20.567 25.510 -0.274 1.00 8.90 H new ATOM 0 HH12 ARG A 31 -20.372 27.031 0.604 1.00 8.90 H new ATOM 0 HH21 ARG A 31 -18.313 25.652 3.105 1.00 9.06 H new ATOM 0 HH22 ARG A 31 -19.107 27.110 2.500 1.00 9.06 H new ATOM 461 N ASP A 32 -22.131 19.503 2.293 1.00 6.64 N ATOM 462 CA ASP A 32 -23.534 19.280 1.970 1.00 7.19 C ATOM 463 C ASP A 32 -24.204 20.527 1.418 1.00 7.82 C ATOM 464 O ASP A 32 -23.851 21.642 1.810 1.00 8.07 O ATOM 465 CB ASP A 32 -24.313 18.827 3.186 1.00 7.56 C ATOM 466 CG ASP A 32 -24.714 17.372 3.156 1.00 7.94 C ATOM 467 OD1 ASP A 32 -24.278 16.668 2.219 1.00 8.31 O1- ATOM 468 OD2 ASP A 32 -25.414 16.922 4.080 1.00 8.10 O ATOM 0 H ASP A 32 -21.936 19.637 3.285 1.00 6.64 H new ATOM 0 HA ASP A 32 -23.542 18.502 1.207 1.00 7.19 H new ATOM 0 HB2 ASP A 32 -23.712 19.009 4.077 1.00 7.56 H new ATOM 0 HB3 ASP A 32 -25.211 19.438 3.277 1.00 7.56 H new ATOM 473 N PRO A 33 -25.167 20.369 0.511 1.00 8.28 N ATOM 474 CA PRO A 33 -25.860 21.502 -0.111 1.00 9.11 C ATOM 475 C PRO A 33 -26.452 22.468 0.913 1.00 9.74 C ATOM 476 O PRO A 33 -26.105 23.655 0.950 1.00 10.41 O ATOM 477 CB PRO A 33 -26.988 20.823 -0.893 1.00 9.60 C ATOM 478 CG PRO A 33 -26.501 19.443 -1.160 1.00 8.98 C ATOM 479 CD PRO A 33 -25.629 19.072 -0.001 1.00 8.23 C ATOM 0 HA PRO A 33 -25.185 22.107 -0.716 1.00 9.11 H new ATOM 0 HB2 PRO A 33 -27.914 20.810 -0.317 1.00 9.60 H new ATOM 0 HB3 PRO A 33 -27.198 21.353 -1.822 1.00 9.60 H new ATOM 0 HG2 PRO A 33 -27.335 18.748 -1.256 1.00 8.98 H new ATOM 0 HG3 PRO A 33 -25.943 19.402 -2.095 1.00 8.98 H new ATOM 0 HD2 PRO A 33 -26.183 18.516 0.756 1.00 8.23 H new ATOM 0 HD3 PRO A 33 -24.795 18.443 -0.312 1.00 8.23 H new ATOM 487 N MET A 34 -27.301 21.924 1.783 1.00 9.60 N ATOM 488 CA MET A 34 -28.107 22.745 2.688 1.00 10.19 C ATOM 489 C MET A 34 -27.395 23.090 3.985 1.00 9.99 C ATOM 490 O MET A 34 -27.978 23.720 4.870 1.00 10.53 O ATOM 491 CB MET A 34 -29.462 22.136 3.042 1.00 10.40 C ATOM 492 CG MET A 34 -29.633 20.655 2.811 1.00 10.85 C ATOM 493 SD MET A 34 -28.963 19.697 4.174 1.00 10.55 S ATOM 494 CE MET A 34 -27.283 19.515 3.676 1.00 10.30 C ATOM 0 H MET A 34 -27.449 20.920 1.881 1.00 9.60 H new ATOM 0 HA MET A 34 -28.271 23.654 2.109 1.00 10.19 H new ATOM 0 HB2 MET A 34 -29.659 22.339 4.095 1.00 10.40 H new ATOM 0 HB3 MET A 34 -30.228 22.658 2.468 1.00 10.40 H new ATOM 0 HG2 MET A 34 -30.691 20.424 2.688 1.00 10.85 H new ATOM 0 HG3 MET A 34 -29.135 20.370 1.884 1.00 10.85 H new ATOM 0 HE1 MET A 34 -26.781 18.810 4.339 1.00 10.30 H new ATOM 0 HE2 MET A 34 -27.245 19.141 2.653 1.00 10.30 H new ATOM 0 HE3 MET A 34 -26.782 20.481 3.727 1.00 10.30 H new ATOM 504 N VAL A 35 -26.154 22.667 4.111 1.00 9.32 N ATOM 505 CA VAL A 35 -25.334 23.016 5.282 1.00 9.27 C ATOM 506 C VAL A 35 -24.054 23.785 4.865 1.00 9.25 C ATOM 507 O VAL A 35 -22.937 23.454 5.274 1.00 8.98 O ATOM 508 CB VAL A 35 -24.970 21.750 6.098 1.00 8.70 C ATOM 509 CG1 VAL A 35 -26.226 20.997 6.535 1.00 8.84 C ATOM 510 CG2 VAL A 35 -24.052 20.861 5.308 1.00 7.95 C ATOM 0 H VAL A 35 -25.680 22.081 3.424 1.00 9.32 H new ATOM 0 HA VAL A 35 -25.927 23.674 5.917 1.00 9.27 H new ATOM 0 HB VAL A 35 -24.445 22.065 7.000 1.00 8.70 H new ATOM 0 HG11 VAL A 35 -25.940 20.113 7.106 1.00 8.84 H new ATOM 0 HG12 VAL A 35 -26.842 21.647 7.157 1.00 8.84 H new ATOM 0 HG13 VAL A 35 -26.793 20.693 5.655 1.00 8.84 H new ATOM 0 HG21 VAL A 35 -23.807 19.977 5.896 1.00 7.95 H new ATOM 0 HG22 VAL A 35 -24.545 20.557 4.385 1.00 7.95 H new ATOM 0 HG23 VAL A 35 -23.137 21.403 5.069 1.00 7.95 H new ATOM 520 N PRO A 36 -24.211 24.861 4.071 1.00 9.74 N ATOM 521 CA PRO A 36 -23.084 25.597 3.484 1.00 9.85 C ATOM 522 C PRO A 36 -22.217 26.286 4.540 1.00 10.22 C ATOM 523 O PRO A 36 -22.700 27.108 5.320 1.00 10.95 O ATOM 524 CB PRO A 36 -23.771 26.648 2.606 1.00 10.65 C ATOM 525 CG PRO A 36 -25.104 26.836 3.234 1.00 11.10 C ATOM 526 CD PRO A 36 -25.496 25.476 3.717 1.00 10.41 C ATOM 0 HA PRO A 36 -22.407 24.935 2.945 1.00 9.85 H new ATOM 0 HB2 PRO A 36 -23.206 27.580 2.585 1.00 10.65 H new ATOM 0 HB3 PRO A 36 -23.862 26.307 1.575 1.00 10.65 H new ATOM 0 HG2 PRO A 36 -25.056 27.549 4.057 1.00 11.10 H new ATOM 0 HG3 PRO A 36 -25.827 27.225 2.517 1.00 11.10 H new ATOM 0 HD2 PRO A 36 -26.166 25.531 4.575 1.00 10.41 H new ATOM 0 HD3 PRO A 36 -26.014 24.908 2.944 1.00 10.41 H new ATOM 534 N GLY A 37 -20.942 25.945 4.561 1.00 9.82 N ATOM 535 CA GLY A 37 -20.047 26.488 5.561 1.00 10.31 C ATOM 536 C GLY A 37 -19.283 25.389 6.259 1.00 9.86 C ATOM 537 O GLY A 37 -18.177 25.596 6.755 1.00 10.21 O ATOM 0 H GLY A 37 -20.507 25.300 3.902 1.00 9.82 H new ATOM 0 HA2 GLY A 37 -19.348 27.180 5.091 1.00 10.31 H new ATOM 0 HA3 GLY A 37 -20.618 27.060 6.293 1.00 10.31 H new ATOM 541 N GLN A 38 -19.889 24.215 6.300 1.00 9.21 N ATOM 542 CA GLN A 38 -19.245 23.039 6.857 1.00 8.88 C ATOM 543 C GLN A 38 -18.204 22.493 5.867 1.00 8.38 C ATOM 544 O GLN A 38 -18.413 22.520 4.653 1.00 8.00 O ATOM 545 CB GLN A 38 -20.333 22.017 7.242 1.00 8.51 C ATOM 546 CG GLN A 38 -20.182 20.627 6.657 1.00 8.11 C ATOM 547 CD GLN A 38 -20.837 20.484 5.307 1.00 8.18 C ATOM 548 OE1 GLN A 38 -21.309 19.416 4.933 1.00 8.47 O ATOM 549 NE2 GLN A 38 -20.849 21.554 4.564 1.00 8.21 N ATOM 0 H GLN A 38 -20.833 24.051 5.951 1.00 9.21 H new ATOM 0 HA GLN A 38 -18.694 23.282 7.765 1.00 8.88 H new ATOM 0 HB2 GLN A 38 -20.353 21.931 8.328 1.00 8.51 H new ATOM 0 HB3 GLN A 38 -21.300 22.415 6.935 1.00 8.51 H new ATOM 0 HG2 GLN A 38 -19.122 20.389 6.568 1.00 8.11 H new ATOM 0 HG3 GLN A 38 -20.615 19.900 7.344 1.00 8.11 H new ATOM 0 HE21 GLN A 38 -20.445 22.423 4.914 1.00 8.21 H new ATOM 0 HE22 GLN A 38 -21.262 21.523 3.632 1.00 8.21 H new ATOM 558 N ARG A 39 -17.056 22.080 6.383 1.00 8.53 N ATOM 559 CA ARG A 39 -15.954 21.645 5.552 1.00 8.21 C ATOM 560 C ARG A 39 -15.356 20.339 6.060 1.00 8.04 C ATOM 561 O ARG A 39 -14.750 20.301 7.135 1.00 8.70 O ATOM 562 CB ARG A 39 -14.890 22.721 5.573 1.00 8.96 C ATOM 563 CG ARG A 39 -13.722 22.401 4.683 1.00 8.86 C ATOM 564 CD ARG A 39 -12.779 23.567 4.587 1.00 9.10 C ATOM 565 NE ARG A 39 -12.124 23.861 5.861 1.00 10.02 N ATOM 566 CZ ARG A 39 -10.963 24.506 5.971 1.00 10.60 C ATOM 567 NH1 ARG A 39 -10.337 24.952 4.889 1.00 10.42 N1+ ATOM 568 NH2 ARG A 39 -10.426 24.706 7.168 1.00 11.51 N ATOM 0 H ARG A 39 -16.867 22.039 7.384 1.00 8.53 H new ATOM 0 HA ARG A 39 -16.321 21.475 4.540 1.00 8.21 H new ATOM 0 HB2 ARG A 39 -15.331 23.668 5.261 1.00 8.96 H new ATOM 0 HB3 ARG A 39 -14.536 22.856 6.595 1.00 8.96 H new ATOM 0 HG2 ARG A 39 -13.192 21.532 5.072 1.00 8.86 H new ATOM 0 HG3 ARG A 39 -14.081 22.137 3.688 1.00 8.86 H new ATOM 0 HD2 ARG A 39 -12.021 23.357 3.832 1.00 9.10 H new ATOM 0 HD3 ARG A 39 -13.327 24.447 4.252 1.00 9.10 H new ATOM 0 HE ARG A 39 -12.584 23.554 6.718 1.00 10.02 H new ATOM 0 HH11 ARG A 39 -10.744 24.802 3.966 1.00 10.42 H new ATOM 0 HH12 ARG A 39 -9.449 25.445 4.981 1.00 10.42 H new ATOM 0 HH21 ARG A 39 -10.902 24.366 8.004 1.00 11.51 H new ATOM 0 HH22 ARG A 39 -9.537 25.200 7.252 1.00 11.51 H new ATOM 582 N PHE A 40 -15.526 19.275 5.287 1.00 7.31 N ATOM 583 CA PHE A 40 -14.900 18.002 5.610 1.00 7.34 C ATOM 584 C PHE A 40 -13.628 17.869 4.812 1.00 7.47 C ATOM 585 O PHE A 40 -13.561 18.380 3.704 1.00 7.06 O ATOM 586 CB PHE A 40 -15.826 16.827 5.306 1.00 6.76 C ATOM 587 CG PHE A 40 -17.100 16.873 6.085 1.00 6.92 C ATOM 588 CD1 PHE A 40 -18.153 17.670 5.671 1.00 6.93 C ATOM 589 CD2 PHE A 40 -17.246 16.112 7.227 1.00 7.27 C ATOM 590 CE1 PHE A 40 -19.328 17.704 6.387 1.00 7.26 C ATOM 591 CE2 PHE A 40 -18.415 16.142 7.943 1.00 7.50 C ATOM 592 CZ PHE A 40 -19.457 16.977 7.525 1.00 7.49 C ATOM 0 H PHE A 40 -16.089 19.268 4.437 1.00 7.31 H new ATOM 0 HA PHE A 40 -14.683 17.983 6.678 1.00 7.34 H new ATOM 0 HB2 PHE A 40 -16.058 16.820 4.241 1.00 6.76 H new ATOM 0 HB3 PHE A 40 -15.306 15.895 5.525 1.00 6.76 H new ATOM 0 HD1 PHE A 40 -18.052 18.270 4.779 1.00 6.93 H new ATOM 0 HD2 PHE A 40 -16.431 15.486 7.560 1.00 7.27 H new ATOM 0 HE1 PHE A 40 -20.151 18.312 6.041 1.00 7.26 H new ATOM 0 HE2 PHE A 40 -18.531 15.526 8.823 1.00 7.50 H new ATOM 0 HZ PHE A 40 -20.364 17.043 8.108 1.00 7.49 H new ATOM 602 N ASP A 41 -12.635 17.182 5.335 1.00 8.18 N ATOM 603 CA ASP A 41 -11.379 17.053 4.613 1.00 8.62 C ATOM 604 C ASP A 41 -11.423 15.921 3.603 1.00 8.07 C ATOM 605 O ASP A 41 -10.412 15.592 2.981 1.00 8.18 O ATOM 606 CB ASP A 41 -10.194 16.876 5.559 1.00 9.62 C ATOM 607 CG ASP A 41 -9.806 18.163 6.246 1.00 10.23 C ATOM 608 OD1 ASP A 41 -10.363 18.463 7.324 1.00 10.48 O1- ATOM 609 OD2 ASP A 41 -8.942 18.888 5.705 1.00 10.61 O ATOM 0 H ASP A 41 -12.666 16.711 6.239 1.00 8.18 H new ATOM 0 HA ASP A 41 -11.239 17.987 4.069 1.00 8.62 H new ATOM 0 HB2 ASP A 41 -10.442 16.127 6.311 1.00 9.62 H new ATOM 0 HB3 ASP A 41 -9.340 16.495 4.999 1.00 9.62 H new ATOM 614 N LYS A 42 -12.602 15.351 3.411 1.00 7.60 N ATOM 615 CA LYS A 42 -12.771 14.299 2.432 1.00 7.23 C ATOM 616 C LYS A 42 -14.242 14.060 2.102 1.00 6.69 C ATOM 617 O LYS A 42 -15.126 14.601 2.769 1.00 6.78 O ATOM 618 CB LYS A 42 -12.109 13.002 2.914 1.00 8.14 C ATOM 619 CG LYS A 42 -12.492 12.634 4.336 1.00 8.90 C ATOM 620 CD LYS A 42 -11.810 11.354 4.788 1.00 9.77 C ATOM 621 CE LYS A 42 -12.221 10.970 6.202 1.00 10.52 C ATOM 622 NZ LYS A 42 -13.684 10.721 6.308 1.00 10.91 N1+ ATOM 0 H LYS A 42 -13.450 15.600 3.920 1.00 7.60 H new ATOM 0 HA LYS A 42 -12.279 14.625 1.515 1.00 7.23 H new ATOM 0 HB2 LYS A 42 -12.389 12.188 2.246 1.00 8.14 H new ATOM 0 HB3 LYS A 42 -11.026 13.108 2.851 1.00 8.14 H new ATOM 0 HG2 LYS A 42 -12.221 13.448 5.008 1.00 8.90 H new ATOM 0 HG3 LYS A 42 -13.573 12.513 4.402 1.00 8.90 H new ATOM 0 HD2 LYS A 42 -12.062 10.545 4.103 1.00 9.77 H new ATOM 0 HD3 LYS A 42 -10.728 11.482 4.745 1.00 9.77 H new ATOM 0 HE2 LYS A 42 -11.678 10.076 6.507 1.00 10.52 H new ATOM 0 HE3 LYS A 42 -11.938 11.766 6.891 1.00 10.52 H new ATOM 0 HZ1 LYS A 42 -13.888 10.224 7.199 1.00 10.91 H new ATOM 0 HZ2 LYS A 42 -14.193 11.628 6.293 1.00 10.91 H new ATOM 0 HZ3 LYS A 42 -13.996 10.136 5.506 1.00 10.91 H new ATOM 636 N PRO A 43 -14.518 13.299 1.042 1.00 6.27 N ATOM 637 CA PRO A 43 -15.866 12.807 0.716 1.00 6.04 C ATOM 638 C PRO A 43 -16.507 12.010 1.862 1.00 6.80 C ATOM 639 O PRO A 43 -15.867 11.725 2.881 1.00 7.51 O ATOM 640 CB PRO A 43 -15.626 11.904 -0.505 1.00 6.00 C ATOM 641 CG PRO A 43 -14.158 11.630 -0.489 1.00 6.35 C ATOM 642 CD PRO A 43 -13.548 12.897 0.023 1.00 6.19 C ATOM 0 HA PRO A 43 -16.561 13.626 0.532 1.00 6.04 H new ATOM 0 HB2 PRO A 43 -16.202 10.981 -0.435 1.00 6.00 H new ATOM 0 HB3 PRO A 43 -15.927 12.398 -1.429 1.00 6.00 H new ATOM 0 HG2 PRO A 43 -13.919 10.785 0.156 1.00 6.35 H new ATOM 0 HG3 PRO A 43 -13.789 11.385 -1.485 1.00 6.35 H new ATOM 0 HD2 PRO A 43 -12.556 12.733 0.444 1.00 6.19 H new ATOM 0 HD3 PRO A 43 -13.442 13.647 -0.761 1.00 6.19 H new ATOM 650 N GLY A 44 -17.789 11.692 1.714 1.00 6.81 N ATOM 651 CA GLY A 44 -18.458 10.856 2.691 1.00 7.59 C ATOM 652 C GLY A 44 -19.924 11.201 2.860 1.00 7.56 C ATOM 653 O GLY A 44 -20.504 11.914 2.038 1.00 7.08 O ATOM 0 H GLY A 44 -18.374 11.998 0.937 1.00 6.81 H new ATOM 0 HA2 GLY A 44 -18.368 9.812 2.390 1.00 7.59 H new ATOM 0 HA3 GLY A 44 -17.954 10.955 3.652 1.00 7.59 H new ATOM 657 N LYS A 45 -20.520 10.676 3.923 1.00 8.20 N ATOM 658 CA LYS A 45 -21.904 10.947 4.258 1.00 8.37 C ATOM 659 C LYS A 45 -21.977 12.057 5.296 1.00 8.15 C ATOM 660 O LYS A 45 -21.079 12.212 6.125 1.00 8.27 O ATOM 661 CB LYS A 45 -22.547 9.692 4.812 1.00 9.30 C ATOM 662 CG LYS A 45 -24.059 9.780 4.894 1.00 9.65 C ATOM 663 CD LYS A 45 -24.585 8.829 5.926 1.00 10.42 C ATOM 664 CE LYS A 45 -24.167 7.392 5.649 1.00 11.07 C ATOM 665 NZ LYS A 45 -24.680 6.904 4.341 1.00 11.68 N1+ ATOM 0 H LYS A 45 -20.052 10.049 4.577 1.00 8.20 H new ATOM 0 HA LYS A 45 -22.435 11.261 3.359 1.00 8.37 H new ATOM 0 HB2 LYS A 45 -22.273 8.844 4.185 1.00 9.30 H new ATOM 0 HB3 LYS A 45 -22.147 9.495 5.807 1.00 9.30 H new ATOM 0 HG2 LYS A 45 -24.357 10.798 5.144 1.00 9.65 H new ATOM 0 HG3 LYS A 45 -24.496 9.550 3.922 1.00 9.65 H new ATOM 0 HD2 LYS A 45 -24.224 9.127 6.910 1.00 10.42 H new ATOM 0 HD3 LYS A 45 -25.673 8.890 5.953 1.00 10.42 H new ATOM 0 HE2 LYS A 45 -23.079 7.322 5.660 1.00 11.07 H new ATOM 0 HE3 LYS A 45 -24.536 6.747 6.446 1.00 11.07 H new ATOM 0 HZ1 LYS A 45 -24.460 5.893 4.237 1.00 11.68 H new ATOM 0 HZ2 LYS A 45 -25.710 7.040 4.299 1.00 11.68 H new ATOM 0 HZ3 LYS A 45 -24.229 7.437 3.570 1.00 11.68 H new ATOM 679 N SER A 46 -23.048 12.830 5.224 1.00 8.03 N ATOM 680 CA SER A 46 -23.281 13.938 6.129 1.00 7.98 C ATOM 681 C SER A 46 -23.505 13.457 7.558 1.00 8.64 C ATOM 682 O SER A 46 -24.158 12.438 7.785 1.00 9.20 O ATOM 683 CB SER A 46 -24.490 14.727 5.642 1.00 8.03 C ATOM 684 OG SER A 46 -24.739 15.869 6.442 1.00 8.36 O ATOM 0 H SER A 46 -23.784 12.703 4.530 1.00 8.03 H new ATOM 0 HA SER A 46 -22.397 14.575 6.136 1.00 7.98 H new ATOM 0 HB2 SER A 46 -24.328 15.037 4.609 1.00 8.03 H new ATOM 0 HB3 SER A 46 -25.369 14.082 5.648 1.00 8.03 H new ATOM 0 HG SER A 46 -25.053 16.604 5.875 1.00 8.36 H new ATOM 690 N PRO A 47 -22.968 14.188 8.544 1.00 8.70 N ATOM 691 CA PRO A 47 -23.182 13.890 9.958 1.00 9.38 C ATOM 692 C PRO A 47 -24.543 14.393 10.423 1.00 9.63 C ATOM 693 O PRO A 47 -25.096 13.941 11.424 1.00 10.25 O ATOM 694 CB PRO A 47 -22.061 14.669 10.642 1.00 9.45 C ATOM 695 CG PRO A 47 -21.836 15.845 9.761 1.00 8.81 C ATOM 696 CD PRO A 47 -22.106 15.371 8.357 1.00 8.26 C ATOM 0 HA PRO A 47 -23.169 12.822 10.178 1.00 9.38 H new ATOM 0 HB2 PRO A 47 -22.347 14.975 11.648 1.00 9.45 H new ATOM 0 HB3 PRO A 47 -21.158 14.065 10.737 1.00 9.45 H new ATOM 0 HG2 PRO A 47 -22.500 16.666 10.030 1.00 8.81 H new ATOM 0 HG3 PRO A 47 -20.815 16.215 9.858 1.00 8.81 H new ATOM 0 HD2 PRO A 47 -22.604 16.139 7.764 1.00 8.26 H new ATOM 0 HD3 PRO A 47 -21.183 15.115 7.837 1.00 8.26 H new ATOM 704 N TYR A 48 -25.076 15.336 9.651 1.00 9.26 N ATOM 705 CA TYR A 48 -26.295 16.033 9.992 1.00 9.61 C ATOM 706 C TYR A 48 -27.489 15.158 9.688 1.00 9.96 C ATOM 707 O TYR A 48 -28.509 15.224 10.369 1.00 10.49 O ATOM 708 CB TYR A 48 -26.362 17.335 9.196 1.00 9.34 C ATOM 709 CG TYR A 48 -25.191 18.249 9.465 1.00 9.17 C ATOM 710 CD1 TYR A 48 -25.017 18.828 10.712 1.00 9.63 C ATOM 711 CD2 TYR A 48 -24.274 18.547 8.467 1.00 8.69 C ATOM 712 CE1 TYR A 48 -23.957 19.677 10.961 1.00 9.70 C ATOM 713 CE2 TYR A 48 -23.213 19.397 8.707 1.00 8.75 C ATOM 714 CZ TYR A 48 -23.015 19.899 9.960 1.00 9.30 C ATOM 715 OH TYR A 48 -22.005 20.806 10.197 1.00 9.57 O ATOM 0 H TYR A 48 -24.665 15.634 8.766 1.00 9.26 H new ATOM 0 HA TYR A 48 -26.306 16.265 11.057 1.00 9.61 H new ATOM 0 HB2 TYR A 48 -26.398 17.103 8.132 1.00 9.34 H new ATOM 0 HB3 TYR A 48 -27.287 17.857 9.440 1.00 9.34 H new ATOM 0 HD1 TYR A 48 -25.722 18.612 11.501 1.00 9.63 H new ATOM 0 HD2 TYR A 48 -24.392 18.107 7.488 1.00 8.69 H new ATOM 0 HE1 TYR A 48 -23.860 20.163 11.921 1.00 9.70 H new ATOM 0 HE2 TYR A 48 -22.541 19.664 7.905 1.00 8.75 H new ATOM 0 HH TYR A 48 -21.141 20.399 9.977 1.00 9.57 H new ATOM 725 N MET A 49 -27.351 14.357 8.639 1.00 9.74 N ATOM 726 CA MET A 49 -28.346 13.357 8.295 1.00 10.23 C ATOM 727 C MET A 49 -27.778 12.433 7.227 1.00 10.20 C ATOM 728 O MET A 49 -26.734 12.724 6.645 1.00 9.87 O ATOM 729 CB MET A 49 -29.618 14.016 7.803 1.00 10.28 C ATOM 730 CG MET A 49 -29.424 14.690 6.489 1.00 10.38 C ATOM 731 SD MET A 49 -30.220 16.283 6.417 1.00 10.09 S ATOM 732 CE MET A 49 -29.079 17.204 7.444 1.00 9.55 C ATOM 0 H MET A 49 -26.550 14.384 8.008 1.00 9.74 H new ATOM 0 HA MET A 49 -28.592 12.775 9.183 1.00 10.23 H new ATOM 0 HB2 MET A 49 -30.404 13.266 7.713 1.00 10.28 H new ATOM 0 HB3 MET A 49 -29.956 14.746 8.539 1.00 10.28 H new ATOM 0 HG2 MET A 49 -28.357 14.811 6.300 1.00 10.38 H new ATOM 0 HG3 MET A 49 -29.818 14.054 5.696 1.00 10.38 H new ATOM 0 HE1 MET A 49 -29.249 18.272 7.310 1.00 9.55 H new ATOM 0 HE2 MET A 49 -29.237 16.940 8.490 1.00 9.55 H new ATOM 0 HE3 MET A 49 -28.055 16.961 7.159 1.00 9.55 H new ATOM 742 N ASP A 50 -28.463 11.332 6.960 1.00 10.69 N ATOM 743 CA ASP A 50 -27.927 10.290 6.091 1.00 10.83 C ATOM 744 C ASP A 50 -28.109 10.616 4.610 1.00 10.64 C ATOM 745 O ASP A 50 -28.932 10.023 3.913 1.00 11.23 O ATOM 746 CB ASP A 50 -28.547 8.929 6.434 1.00 11.76 C ATOM 747 CG ASP A 50 -30.062 8.911 6.348 1.00 12.21 C ATOM 748 OD1 ASP A 50 -30.715 9.634 7.131 1.00 12.33 O1- ATOM 749 OD2 ASP A 50 -30.604 8.196 5.477 1.00 12.54 O ATOM 0 H ASP A 50 -29.392 11.135 7.332 1.00 10.69 H new ATOM 0 HA ASP A 50 -26.853 10.241 6.272 1.00 10.83 H new ATOM 0 HB2 ASP A 50 -28.144 8.175 5.757 1.00 11.76 H new ATOM 0 HB3 ASP A 50 -28.246 8.646 7.443 1.00 11.76 H new ATOM 754 N MET A 51 -27.322 11.569 4.143 1.00 9.87 N ATOM 755 CA MET A 51 -27.207 11.857 2.720 1.00 9.64 C ATOM 756 C MET A 51 -25.753 12.136 2.392 1.00 8.84 C ATOM 757 O MET A 51 -25.044 12.761 3.182 1.00 8.36 O ATOM 758 CB MET A 51 -28.104 13.032 2.270 1.00 9.70 C ATOM 759 CG MET A 51 -28.019 14.293 3.115 1.00 9.43 C ATOM 760 SD MET A 51 -28.946 15.659 2.373 1.00 9.38 S ATOM 761 CE MET A 51 -27.636 16.560 1.564 1.00 9.04 C ATOM 0 H MET A 51 -26.745 12.165 4.736 1.00 9.87 H new ATOM 0 HA MET A 51 -27.557 10.983 2.171 1.00 9.64 H new ATOM 0 HB2 MET A 51 -27.846 13.288 1.242 1.00 9.70 H new ATOM 0 HB3 MET A 51 -29.139 12.692 2.263 1.00 9.70 H new ATOM 0 HG2 MET A 51 -28.407 14.089 4.113 1.00 9.43 H new ATOM 0 HG3 MET A 51 -26.975 14.583 3.232 1.00 9.43 H new ATOM 0 HE1 MET A 51 -28.064 17.360 0.959 1.00 9.04 H new ATOM 0 HE2 MET A 51 -26.972 16.988 2.315 1.00 9.04 H new ATOM 0 HE3 MET A 51 -27.071 15.883 0.923 1.00 9.04 H new ATOM 771 N PRO A 52 -25.275 11.628 1.247 1.00 8.77 N ATOM 772 CA PRO A 52 -23.892 11.820 0.819 1.00 8.04 C ATOM 773 C PRO A 52 -23.594 13.280 0.530 1.00 7.35 C ATOM 774 O PRO A 52 -24.392 13.971 -0.109 1.00 7.56 O ATOM 775 CB PRO A 52 -23.777 10.981 -0.458 1.00 8.35 C ATOM 776 CG PRO A 52 -25.175 10.832 -0.947 1.00 9.16 C ATOM 777 CD PRO A 52 -26.046 10.832 0.278 1.00 9.51 C ATOM 0 HA PRO A 52 -23.180 11.522 1.589 1.00 8.04 H new ATOM 0 HB2 PRO A 52 -23.150 11.475 -1.200 1.00 8.35 H new ATOM 0 HB3 PRO A 52 -23.325 10.011 -0.254 1.00 8.35 H new ATOM 0 HG2 PRO A 52 -25.443 11.650 -1.616 1.00 9.16 H new ATOM 0 HG3 PRO A 52 -25.294 9.907 -1.510 1.00 9.16 H new ATOM 0 HD2 PRO A 52 -27.021 11.277 0.078 1.00 9.51 H new ATOM 0 HD3 PRO A 52 -26.226 9.821 0.642 1.00 9.51 H new ATOM 785 N LEU A 53 -22.448 13.738 1.003 1.00 6.71 N ATOM 786 CA LEU A 53 -22.045 15.123 0.830 1.00 6.20 C ATOM 787 C LEU A 53 -21.866 15.461 -0.647 1.00 5.97 C ATOM 788 O LEU A 53 -21.722 14.566 -1.488 1.00 6.05 O ATOM 789 CB LEU A 53 -20.752 15.390 1.603 1.00 5.79 C ATOM 790 CG LEU A 53 -20.859 15.204 3.118 1.00 6.23 C ATOM 791 CD1 LEU A 53 -19.496 14.946 3.730 1.00 6.10 C ATOM 792 CD2 LEU A 53 -21.489 16.429 3.755 1.00 6.57 C ATOM 0 H LEU A 53 -21.775 13.166 1.514 1.00 6.71 H new ATOM 0 HA LEU A 53 -22.833 15.764 1.225 1.00 6.20 H new ATOM 0 HB2 LEU A 53 -19.975 14.726 1.224 1.00 5.79 H new ATOM 0 HB3 LEU A 53 -20.427 16.410 1.399 1.00 5.79 H new ATOM 0 HG LEU A 53 -21.492 14.337 3.309 1.00 6.23 H new ATOM 0 HD11 LEU A 53 -19.599 14.817 4.807 1.00 6.10 H new ATOM 0 HD12 LEU A 53 -19.067 14.043 3.296 1.00 6.10 H new ATOM 0 HD13 LEU A 53 -18.840 15.792 3.527 1.00 6.10 H new ATOM 0 HD21 LEU A 53 -21.559 16.283 4.833 1.00 6.57 H new ATOM 0 HD22 LEU A 53 -20.874 17.304 3.546 1.00 6.57 H new ATOM 0 HD23 LEU A 53 -22.487 16.580 3.344 1.00 6.57 H new ATOM 804 N ILE A 54 -21.861 16.741 -0.963 1.00 5.92 N ATOM 805 CA ILE A 54 -21.679 17.175 -2.337 1.00 5.98 C ATOM 806 C ILE A 54 -20.267 17.675 -2.538 1.00 5.33 C ATOM 807 O ILE A 54 -19.720 18.402 -1.706 1.00 5.16 O ATOM 808 CB ILE A 54 -22.685 18.277 -2.733 1.00 6.77 C ATOM 809 CG1 ILE A 54 -24.096 17.693 -2.828 1.00 7.56 C ATOM 810 CG2 ILE A 54 -22.303 18.952 -4.045 1.00 7.04 C ATOM 811 CD1 ILE A 54 -24.220 16.554 -3.818 1.00 7.89 C ATOM 0 H ILE A 54 -21.980 17.498 -0.290 1.00 5.92 H new ATOM 0 HA ILE A 54 -21.861 16.314 -2.980 1.00 5.98 H new ATOM 0 HB ILE A 54 -22.662 19.039 -1.954 1.00 6.77 H new ATOM 0 HG12 ILE A 54 -24.400 17.340 -1.843 1.00 7.56 H new ATOM 0 HG13 ILE A 54 -24.789 18.485 -3.111 1.00 7.56 H new ATOM 0 HG21 ILE A 54 -23.037 19.721 -4.286 1.00 7.04 H new ATOM 0 HG22 ILE A 54 -21.319 19.409 -3.946 1.00 7.04 H new ATOM 0 HG23 ILE A 54 -22.280 18.210 -4.843 1.00 7.04 H new ATOM 0 HD11 ILE A 54 -25.248 16.192 -3.830 1.00 7.89 H new ATOM 0 HD12 ILE A 54 -23.948 16.906 -4.813 1.00 7.89 H new ATOM 0 HD13 ILE A 54 -23.553 15.743 -3.525 1.00 7.89 H new ATOM 823 N PRO A 55 -19.629 17.259 -3.624 1.00 5.13 N ATOM 824 CA PRO A 55 -18.300 17.711 -3.928 1.00 4.65 C ATOM 825 C PRO A 55 -18.288 19.074 -4.609 1.00 5.10 C ATOM 826 O PRO A 55 -19.122 19.380 -5.466 1.00 5.77 O ATOM 827 CB PRO A 55 -17.764 16.606 -4.826 1.00 4.51 C ATOM 828 CG PRO A 55 -18.956 16.035 -5.509 1.00 5.22 C ATOM 829 CD PRO A 55 -20.141 16.298 -4.619 1.00 5.58 C ATOM 0 HA PRO A 55 -17.691 17.869 -3.038 1.00 4.65 H new ATOM 0 HB2 PRO A 55 -17.049 17.000 -5.548 1.00 4.51 H new ATOM 0 HB3 PRO A 55 -17.243 15.845 -4.244 1.00 4.51 H new ATOM 0 HG2 PRO A 55 -19.098 16.496 -6.487 1.00 5.22 H new ATOM 0 HG3 PRO A 55 -18.829 14.965 -5.676 1.00 5.22 H new ATOM 0 HD2 PRO A 55 -20.979 16.712 -5.180 1.00 5.58 H new ATOM 0 HD3 PRO A 55 -20.496 15.383 -4.145 1.00 5.58 H new ATOM 837 N VAL A 56 -17.328 19.879 -4.180 1.00 5.00 N ATOM 838 CA VAL A 56 -17.153 21.255 -4.627 1.00 5.69 C ATOM 839 C VAL A 56 -17.025 21.379 -6.142 1.00 5.96 C ATOM 840 O VAL A 56 -16.612 20.450 -6.826 1.00 5.52 O ATOM 841 CB VAL A 56 -15.901 21.860 -3.982 1.00 5.77 C ATOM 842 CG1 VAL A 56 -16.036 21.927 -2.470 1.00 5.82 C ATOM 843 CG2 VAL A 56 -14.705 21.041 -4.388 1.00 5.28 C ATOM 0 H VAL A 56 -16.631 19.588 -3.494 1.00 5.00 H new ATOM 0 HA VAL A 56 -18.050 21.793 -4.322 1.00 5.69 H new ATOM 0 HB VAL A 56 -15.774 22.885 -4.331 1.00 5.77 H new ATOM 0 HG11 VAL A 56 -15.132 22.361 -2.043 1.00 5.82 H new ATOM 0 HG12 VAL A 56 -16.894 22.546 -2.208 1.00 5.82 H new ATOM 0 HG13 VAL A 56 -16.179 20.922 -2.073 1.00 5.82 H new ATOM 0 HG21 VAL A 56 -13.806 21.461 -3.936 1.00 5.28 H new ATOM 0 HG22 VAL A 56 -14.836 20.013 -4.049 1.00 5.28 H new ATOM 0 HG23 VAL A 56 -14.606 21.055 -5.473 1.00 5.28 H new ATOM 853 N TYR A 57 -17.330 22.588 -6.590 1.00 6.83 N ATOM 854 CA TYR A 57 -17.389 23.017 -8.000 1.00 7.44 C ATOM 855 C TYR A 57 -17.376 21.881 -9.023 1.00 7.10 C ATOM 856 O TYR A 57 -18.441 21.410 -9.428 1.00 7.48 O ATOM 857 CB TYR A 57 -16.243 24.001 -8.268 1.00 7.84 C ATOM 858 CG TYR A 57 -15.172 23.974 -7.195 1.00 7.40 C ATOM 859 CD1 TYR A 57 -14.095 23.106 -7.281 1.00 6.79 C ATOM 860 CD2 TYR A 57 -15.244 24.813 -6.092 1.00 7.77 C ATOM 861 CE1 TYR A 57 -13.117 23.080 -6.314 1.00 6.66 C ATOM 862 CE2 TYR A 57 -14.269 24.794 -5.114 1.00 7.62 C ATOM 863 CZ TYR A 57 -13.205 23.928 -5.232 1.00 7.11 C ATOM 864 OH TYR A 57 -12.226 23.911 -4.268 1.00 7.23 O ATOM 0 H TYR A 57 -17.558 23.349 -5.950 1.00 6.83 H new ATOM 0 HA TYR A 57 -18.359 23.495 -8.137 1.00 7.44 H new ATOM 0 HB2 TYR A 57 -15.790 23.768 -9.231 1.00 7.84 H new ATOM 0 HB3 TYR A 57 -16.649 25.010 -8.343 1.00 7.84 H new ATOM 0 HD1 TYR A 57 -14.022 22.436 -8.125 1.00 6.79 H new ATOM 0 HD2 TYR A 57 -16.078 25.493 -5.997 1.00 7.77 H new ATOM 0 HE1 TYR A 57 -12.284 22.398 -6.403 1.00 6.66 H new ATOM 0 HE2 TYR A 57 -14.341 25.454 -4.262 1.00 7.62 H new ATOM 0 HH TYR A 57 -12.438 24.570 -3.575 1.00 7.23 H new ATOM 874 N GLU A 58 -16.193 21.478 -9.452 1.00 6.59 N ATOM 875 CA GLU A 58 -16.022 20.455 -10.479 1.00 6.41 C ATOM 876 C GLU A 58 -16.903 19.241 -10.207 1.00 6.15 C ATOM 877 O GLU A 58 -17.555 18.723 -11.125 1.00 6.62 O ATOM 878 CB GLU A 58 -14.549 20.076 -10.495 1.00 5.89 C ATOM 879 CG GLU A 58 -14.201 18.742 -9.888 1.00 5.18 C ATOM 880 CD GLU A 58 -12.755 18.389 -10.145 1.00 5.25 C ATOM 881 OE1 GLU A 58 -12.322 18.470 -11.302 1.00 5.61 O1- ATOM 882 OE2 GLU A 58 -12.044 18.038 -9.184 1.00 5.25 O ATOM 0 H GLU A 58 -15.313 21.853 -9.097 1.00 6.59 H new ATOM 0 HA GLU A 58 -16.327 20.840 -11.452 1.00 6.41 H new ATOM 0 HB2 GLU A 58 -14.204 20.083 -11.529 1.00 5.89 H new ATOM 0 HB3 GLU A 58 -13.990 20.849 -9.968 1.00 5.89 H new ATOM 0 HG2 GLU A 58 -14.387 18.768 -8.814 1.00 5.18 H new ATOM 0 HG3 GLU A 58 -14.847 17.969 -10.305 1.00 5.18 H new ATOM 889 N GLU A 59 -16.952 18.834 -8.950 1.00 5.59 N ATOM 890 CA GLU A 59 -17.769 17.709 -8.526 1.00 5.52 C ATOM 891 C GLU A 59 -17.245 16.393 -9.120 1.00 5.43 C ATOM 892 O GLU A 59 -17.626 15.960 -10.219 1.00 6.06 O ATOM 893 CB GLU A 59 -19.238 17.941 -8.913 1.00 6.40 C ATOM 894 CG GLU A 59 -20.174 16.787 -8.595 1.00 6.94 C ATOM 895 CD GLU A 59 -21.421 16.814 -9.448 1.00 7.89 C ATOM 896 OE1 GLU A 59 -21.400 16.235 -10.554 1.00 8.58 O1- ATOM 897 OE2 GLU A 59 -22.427 17.415 -9.022 1.00 8.12 O ATOM 0 H GLU A 59 -16.427 19.274 -8.194 1.00 5.59 H new ATOM 0 HA GLU A 59 -17.707 17.629 -7.441 1.00 5.52 H new ATOM 0 HB2 GLU A 59 -19.597 18.833 -8.400 1.00 6.40 H new ATOM 0 HB3 GLU A 59 -19.289 18.147 -9.982 1.00 6.40 H new ATOM 0 HG2 GLU A 59 -19.651 15.843 -8.749 1.00 6.94 H new ATOM 0 HG3 GLU A 59 -20.454 16.828 -7.542 1.00 6.94 H new ATOM 904 N GLU A 60 -16.313 15.815 -8.348 1.00 4.88 N ATOM 905 CA GLU A 60 -15.854 14.430 -8.472 1.00 5.05 C ATOM 906 C GLU A 60 -15.164 14.169 -9.802 1.00 5.18 C ATOM 907 O GLU A 60 -15.617 13.360 -10.603 1.00 5.82 O ATOM 908 CB GLU A 60 -17.029 13.469 -8.235 1.00 5.91 C ATOM 909 CG GLU A 60 -16.601 12.046 -7.921 1.00 6.37 C ATOM 910 CD GLU A 60 -17.673 11.251 -7.203 1.00 7.13 C ATOM 911 OE1 GLU A 60 -17.749 11.339 -5.958 1.00 7.64 O ATOM 912 OE2 GLU A 60 -18.437 10.524 -7.871 1.00 7.41 O1- ATOM 0 H GLU A 60 -15.844 16.319 -7.595 1.00 4.88 H new ATOM 0 HA GLU A 60 -15.100 14.251 -7.705 1.00 5.05 H new ATOM 0 HB2 GLU A 60 -17.635 13.847 -7.412 1.00 5.91 H new ATOM 0 HB3 GLU A 60 -17.664 13.461 -9.121 1.00 5.91 H new ATOM 0 HG2 GLU A 60 -16.340 11.538 -8.849 1.00 6.37 H new ATOM 0 HG3 GLU A 60 -15.701 12.070 -7.306 1.00 6.37 H new ATOM 919 N ASN A 61 -14.026 14.827 -9.998 1.00 4.82 N ATOM 920 CA ASN A 61 -13.325 14.787 -11.286 1.00 5.21 C ATOM 921 C ASN A 61 -11.806 14.892 -11.130 1.00 4.96 C ATOM 922 O ASN A 61 -11.066 14.383 -11.969 1.00 5.37 O ATOM 923 CB ASN A 61 -13.809 15.933 -12.156 1.00 5.66 C ATOM 924 CG ASN A 61 -13.431 15.773 -13.616 1.00 6.39 C ATOM 925 OD1 ASN A 61 -12.349 16.178 -14.042 1.00 6.60 O ATOM 926 ND2 ASN A 61 -14.330 15.195 -14.396 1.00 7.02 N ATOM 0 H ASN A 61 -13.567 15.395 -9.286 1.00 4.82 H new ATOM 0 HA ASN A 61 -13.547 13.824 -11.746 1.00 5.21 H new ATOM 0 HB2 ASN A 61 -14.893 16.011 -12.074 1.00 5.66 H new ATOM 0 HB3 ASN A 61 -13.393 16.868 -11.780 1.00 5.66 H new ATOM 0 HD21 ASN A 61 -14.138 15.071 -15.390 1.00 7.02 H new ATOM 0 HD22 ASN A 61 -15.215 14.873 -14.003 1.00 7.02 H new ATOM 933 N ALA A 62 -11.374 15.577 -10.066 1.00 4.60 N ATOM 934 CA ALA A 62 -9.964 15.868 -9.770 1.00 4.73 C ATOM 935 C ALA A 62 -9.056 14.757 -10.224 1.00 4.93 C ATOM 936 O ALA A 62 -8.128 14.968 -11.010 1.00 5.41 O ATOM 937 CB ALA A 62 -9.777 16.100 -8.282 1.00 4.86 C ATOM 0 H ALA A 62 -12.012 15.956 -9.366 1.00 4.60 H new ATOM 0 HA ALA A 62 -9.696 16.770 -10.320 1.00 4.73 H new ATOM 0 HB1 ALA A 62 -8.728 16.314 -8.076 1.00 4.86 H new ATOM 0 HB2 ALA A 62 -10.389 16.945 -7.966 1.00 4.86 H new ATOM 0 HB3 ALA A 62 -10.079 15.208 -7.734 1.00 4.86 H new ATOM 943 N ASP A 63 -9.324 13.568 -9.731 1.00 4.87 N ATOM 944 CA ASP A 63 -8.648 12.413 -10.236 1.00 5.36 C ATOM 945 C ASP A 63 -9.648 11.369 -10.680 1.00 5.66 C ATOM 946 O ASP A 63 -9.788 10.314 -10.066 1.00 6.14 O ATOM 947 CB ASP A 63 -7.706 11.829 -9.210 1.00 5.84 C ATOM 948 CG ASP A 63 -6.799 10.780 -9.814 1.00 6.49 C ATOM 949 OD1 ASP A 63 -5.985 11.125 -10.695 1.00 7.01 O ATOM 950 OD2 ASP A 63 -6.876 9.610 -9.393 1.00 6.76 O1- ATOM 0 H ASP A 63 -9.999 13.385 -8.989 1.00 4.87 H new ATOM 0 HA ASP A 63 -8.055 12.726 -11.095 1.00 5.36 H new ATOM 0 HB2 ASP A 63 -7.102 12.626 -8.776 1.00 5.84 H new ATOM 0 HB3 ASP A 63 -8.282 11.387 -8.397 1.00 5.84 H new ATOM 955 N GLY A 64 -10.404 11.725 -11.699 1.00 5.66 N ATOM 956 CA GLY A 64 -11.367 10.815 -12.289 1.00 6.25 C ATOM 957 C GLY A 64 -12.646 10.816 -11.511 1.00 6.54 C ATOM 958 O GLY A 64 -13.725 11.080 -12.034 1.00 7.20 O ATOM 0 H GLY A 64 -10.370 12.645 -12.139 1.00 5.66 H new ATOM 0 HA2 GLY A 64 -11.564 11.106 -13.321 1.00 6.25 H new ATOM 0 HA3 GLY A 64 -10.953 9.807 -12.315 1.00 6.25 H new ATOM 962 N ALA A 65 -12.487 10.545 -10.242 1.00 6.34 N ATOM 963 CA ALA A 65 -13.578 10.491 -9.306 1.00 6.92 C ATOM 964 C ALA A 65 -13.184 11.238 -8.046 1.00 7.26 C ATOM 965 O ALA A 65 -13.764 11.044 -6.978 1.00 7.82 O ATOM 966 CB ALA A 65 -13.903 9.043 -9.008 1.00 7.42 C ATOM 0 H ALA A 65 -11.578 10.352 -9.823 1.00 6.34 H new ATOM 0 HA ALA A 65 -14.467 10.963 -9.723 1.00 6.92 H new ATOM 0 HB1 ALA A 65 -14.729 8.994 -8.299 1.00 7.42 H new ATOM 0 HB2 ALA A 65 -14.186 8.536 -9.931 1.00 7.42 H new ATOM 0 HB3 ALA A 65 -13.028 8.554 -8.580 1.00 7.42 H new ATOM 972 N ALA A 66 -12.165 12.087 -8.197 1.00 7.17 N ATOM 973 CA ALA A 66 -11.621 12.876 -7.095 1.00 7.77 C ATOM 974 C ALA A 66 -11.070 11.973 -6.002 1.00 7.57 C ATOM 975 O ALA A 66 -11.133 12.290 -4.815 1.00 8.11 O ATOM 976 CB ALA A 66 -12.669 13.826 -6.547 1.00 8.65 C ATOM 0 H ALA A 66 -11.695 12.245 -9.088 1.00 7.17 H new ATOM 0 HA ALA A 66 -10.795 13.474 -7.478 1.00 7.77 H new ATOM 0 HB1 ALA A 66 -12.243 14.404 -5.727 1.00 8.65 H new ATOM 0 HB2 ALA A 66 -12.995 14.503 -7.337 1.00 8.65 H new ATOM 0 HB3 ALA A 66 -13.523 13.255 -6.183 1.00 8.65 H new ATOM 982 N VAL A 67 -10.541 10.838 -6.428 1.00 6.98 N ATOM 983 CA VAL A 67 -9.898 9.895 -5.519 1.00 6.95 C ATOM 984 C VAL A 67 -8.565 10.465 -5.056 1.00 6.91 C ATOM 985 O VAL A 67 -8.092 10.196 -3.953 1.00 7.31 O ATOM 986 CB VAL A 67 -9.635 8.538 -6.210 1.00 6.72 C ATOM 987 CG1 VAL A 67 -9.555 7.415 -5.187 1.00 6.95 C ATOM 988 CG2 VAL A 67 -10.692 8.252 -7.265 1.00 6.89 C ATOM 0 H VAL A 67 -10.543 10.543 -7.404 1.00 6.98 H new ATOM 0 HA VAL A 67 -10.567 9.737 -4.673 1.00 6.95 H new ATOM 0 HB VAL A 67 -8.671 8.595 -6.715 1.00 6.72 H new ATOM 0 HG11 VAL A 67 -9.369 6.470 -5.698 1.00 6.95 H new ATOM 0 HG12 VAL A 67 -8.742 7.616 -4.489 1.00 6.95 H new ATOM 0 HG13 VAL A 67 -10.496 7.353 -4.640 1.00 6.95 H new ATOM 0 HG21 VAL A 67 -10.485 7.292 -7.737 1.00 6.89 H new ATOM 0 HG22 VAL A 67 -11.675 8.221 -6.796 1.00 6.89 H new ATOM 0 HG23 VAL A 67 -10.675 9.038 -8.020 1.00 6.89 H new ATOM 998 N ARG A 68 -7.969 11.257 -5.934 1.00 6.66 N ATOM 999 CA ARG A 68 -6.680 11.870 -5.688 1.00 6.87 C ATOM 1000 C ARG A 68 -6.730 13.376 -5.868 1.00 7.21 C ATOM 1001 O ARG A 68 -7.789 13.986 -6.012 1.00 7.68 O ATOM 1002 CB ARG A 68 -5.625 11.252 -6.589 1.00 7.41 C ATOM 1003 CG ARG A 68 -5.371 9.791 -6.297 1.00 7.79 C ATOM 1004 CD ARG A 68 -4.188 9.256 -7.088 1.00 8.65 C ATOM 1005 NE ARG A 68 -4.322 9.520 -8.516 1.00 8.94 N ATOM 1006 CZ ARG A 68 -3.324 9.458 -9.395 1.00 9.70 C ATOM 1007 NH1 ARG A 68 -2.122 9.036 -9.022 1.00 10.21 N1+ ATOM 1008 NH2 ARG A 68 -3.538 9.801 -10.655 1.00 10.14 N ATOM 0 H ARG A 68 -8.371 11.492 -6.841 1.00 6.66 H new ATOM 0 HA ARG A 68 -6.411 11.679 -4.649 1.00 6.87 H new ATOM 0 HB2 ARG A 68 -5.937 11.359 -7.628 1.00 7.41 H new ATOM 0 HB3 ARG A 68 -4.692 11.805 -6.477 1.00 7.41 H new ATOM 0 HG2 ARG A 68 -5.185 9.660 -5.231 1.00 7.79 H new ATOM 0 HG3 ARG A 68 -6.262 9.212 -6.539 1.00 7.79 H new ATOM 0 HD2 ARG A 68 -3.269 9.712 -6.720 1.00 8.65 H new ATOM 0 HD3 ARG A 68 -4.098 8.182 -6.925 1.00 8.65 H new ATOM 0 HE ARG A 68 -5.247 9.770 -8.866 1.00 8.94 H new ATOM 0 HH11 ARG A 68 -1.957 8.756 -8.055 1.00 10.21 H new ATOM 0 HH12 ARG A 68 -1.363 8.992 -9.702 1.00 10.21 H new ATOM 0 HH21 ARG A 68 -4.464 10.111 -10.949 1.00 10.14 H new ATOM 0 HH22 ARG A 68 -2.777 9.755 -11.332 1.00 10.14 H new ATOM 1022 N ILE A 69 -5.535 13.918 -5.863 1.00 7.25 N ATOM 1023 CA ILE A 69 -5.252 15.358 -5.824 1.00 7.89 C ATOM 1024 C ILE A 69 -5.918 16.144 -6.954 1.00 8.72 C ATOM 1025 O ILE A 69 -6.411 15.585 -7.930 1.00 8.86 O ATOM 1026 CB ILE A 69 -3.717 15.594 -5.910 1.00 7.93 C ATOM 1027 CG1 ILE A 69 -2.972 14.550 -5.068 1.00 7.29 C ATOM 1028 CG2 ILE A 69 -3.347 17.004 -5.451 1.00 8.79 C ATOM 1029 CD1 ILE A 69 -1.467 14.712 -5.069 1.00 7.43 C ATOM 0 H ILE A 69 -4.686 13.353 -5.887 1.00 7.25 H new ATOM 0 HA ILE A 69 -5.664 15.720 -4.882 1.00 7.89 H new ATOM 0 HB ILE A 69 -3.418 15.490 -6.953 1.00 7.93 H new ATOM 0 HG12 ILE A 69 -3.331 14.605 -4.040 1.00 7.29 H new ATOM 0 HG13 ILE A 69 -3.220 13.556 -5.440 1.00 7.29 H new ATOM 0 HG21 ILE A 69 -2.268 17.138 -5.523 1.00 8.79 H new ATOM 0 HG22 ILE A 69 -3.847 17.736 -6.085 1.00 8.79 H new ATOM 0 HG23 ILE A 69 -3.662 17.145 -4.417 1.00 8.79 H new ATOM 0 HD11 ILE A 69 -1.017 13.935 -4.451 1.00 7.43 H new ATOM 0 HD12 ILE A 69 -1.093 14.626 -6.089 1.00 7.43 H new ATOM 0 HD13 ILE A 69 -1.206 15.691 -4.668 1.00 7.43 H new ATOM 1041 N ASP A 70 -5.876 17.466 -6.774 1.00 9.49 N ATOM 1042 CA ASP A 70 -6.295 18.497 -7.738 1.00 10.50 C ATOM 1043 C ASP A 70 -5.536 18.404 -9.084 1.00 10.98 C ATOM 1044 O ASP A 70 -5.483 19.343 -9.869 1.00 11.84 O ATOM 1045 CB ASP A 70 -6.042 19.852 -7.033 1.00 11.29 C ATOM 1046 CG ASP A 70 -6.290 21.115 -7.847 1.00 12.36 C ATOM 1047 OD1 ASP A 70 -5.369 21.561 -8.567 1.00 13.02 O ATOM 1048 OD2 ASP A 70 -7.366 21.718 -7.698 1.00 12.66 O1- ATOM 0 H ASP A 70 -5.530 17.873 -5.905 1.00 9.49 H new ATOM 0 HA ASP A 70 -7.343 18.369 -8.007 1.00 10.50 H new ATOM 0 HB2 ASP A 70 -6.672 19.893 -6.144 1.00 11.29 H new ATOM 0 HB3 ASP A 70 -5.007 19.868 -6.692 1.00 11.29 H new ATOM 1053 N GLY A 71 -4.998 17.226 -9.365 1.00 10.56 N ATOM 1054 CA GLY A 71 -4.231 17.007 -10.569 1.00 11.12 C ATOM 1055 C GLY A 71 -2.803 17.458 -10.405 1.00 11.32 C ATOM 1056 O GLY A 71 -2.050 17.540 -11.372 1.00 12.13 O ATOM 0 H GLY A 71 -5.083 16.405 -8.766 1.00 10.56 H new ATOM 0 HA2 GLY A 71 -4.252 15.948 -10.827 1.00 11.12 H new ATOM 0 HA3 GLY A 71 -4.691 17.546 -11.397 1.00 11.12 H new ATOM 1060 N ARG A 72 -2.437 17.746 -9.166 1.00 10.73 N ATOM 1061 CA ARG A 72 -1.102 18.215 -8.854 1.00 11.04 C ATOM 1062 C ARG A 72 -0.192 17.038 -8.609 1.00 10.55 C ATOM 1063 O ARG A 72 -0.405 16.246 -7.691 1.00 9.83 O ATOM 1064 CB ARG A 72 -1.137 19.141 -7.646 1.00 11.16 C ATOM 1065 CG ARG A 72 -2.285 20.107 -7.755 1.00 10.42 C ATOM 1066 CD ARG A 72 -2.254 21.204 -6.706 1.00 10.89 C ATOM 1067 NE ARG A 72 -3.356 22.143 -6.905 1.00 11.31 N ATOM 1068 CZ ARG A 72 -3.507 23.291 -6.250 1.00 11.83 C ATOM 1069 NH1 ARG A 72 -2.640 23.653 -5.314 1.00 12.00 N1+ ATOM 1070 NH2 ARG A 72 -4.540 24.074 -6.531 1.00 12.38 N ATOM 0 H ARG A 72 -3.053 17.661 -8.357 1.00 10.73 H new ATOM 0 HA ARG A 72 -0.713 18.782 -9.700 1.00 11.04 H new ATOM 0 HB2 ARG A 72 -1.234 18.554 -6.733 1.00 11.16 H new ATOM 0 HB3 ARG A 72 -0.198 19.690 -7.574 1.00 11.16 H new ATOM 0 HG2 ARG A 72 -2.274 20.562 -8.746 1.00 10.42 H new ATOM 0 HG3 ARG A 72 -3.222 19.557 -7.667 1.00 10.42 H new ATOM 0 HD2 ARG A 72 -2.320 20.764 -5.711 1.00 10.89 H new ATOM 0 HD3 ARG A 72 -1.304 21.735 -6.757 1.00 10.89 H new ATOM 0 HE ARG A 72 -4.063 21.900 -7.599 1.00 11.31 H new ATOM 0 HH11 ARG A 72 -1.849 23.049 -5.091 1.00 12.00 H new ATOM 0 HH12 ARG A 72 -2.764 24.535 -4.817 1.00 12.00 H new ATOM 0 HH21 ARG A 72 -5.212 23.795 -7.245 1.00 12.38 H new ATOM 0 HH22 ARG A 72 -4.662 24.956 -6.033 1.00 12.38 H new ATOM 1084 N VAL A 73 0.809 16.926 -9.444 1.00 11.11 N ATOM 1085 CA VAL A 73 1.691 15.775 -9.412 1.00 10.97 C ATOM 1086 C VAL A 73 3.135 16.198 -9.181 1.00 10.92 C ATOM 1087 O VAL A 73 3.590 17.218 -9.697 1.00 11.44 O ATOM 1088 CB VAL A 73 1.587 14.963 -10.717 1.00 11.58 C ATOM 1089 CG1 VAL A 73 2.410 13.689 -10.638 1.00 11.61 C ATOM 1090 CG2 VAL A 73 0.131 14.640 -11.031 1.00 11.56 C ATOM 0 H VAL A 73 1.039 17.617 -10.158 1.00 11.11 H new ATOM 0 HA VAL A 73 1.375 15.144 -8.581 1.00 10.97 H new ATOM 0 HB VAL A 73 1.990 15.573 -11.525 1.00 11.58 H new ATOM 0 HG11 VAL A 73 2.317 13.137 -11.573 1.00 11.61 H new ATOM 0 HG12 VAL A 73 3.457 13.942 -10.469 1.00 11.61 H new ATOM 0 HG13 VAL A 73 2.048 13.072 -9.815 1.00 11.61 H new ATOM 0 HG21 VAL A 73 0.077 14.066 -11.956 1.00 11.56 H new ATOM 0 HG22 VAL A 73 -0.296 14.056 -10.216 1.00 11.56 H new ATOM 0 HG23 VAL A 73 -0.431 15.567 -11.146 1.00 11.56 H new ATOM 1100 N THR A 74 3.843 15.418 -8.386 1.00 10.48 N ATOM 1101 CA THR A 74 5.240 15.650 -8.126 1.00 10.58 C ATOM 1102 C THR A 74 6.017 14.359 -8.374 1.00 10.71 C ATOM 1103 O THR A 74 6.677 13.819 -7.481 1.00 10.65 O ATOM 1104 CB THR A 74 5.469 16.190 -6.689 1.00 10.38 C ATOM 1105 OG1 THR A 74 6.870 16.336 -6.421 1.00 10.63 O ATOM 1106 CG2 THR A 74 4.832 15.284 -5.640 1.00 9.98 C ATOM 0 H THR A 74 3.459 14.605 -7.904 1.00 10.48 H new ATOM 0 HA THR A 74 5.606 16.419 -8.806 1.00 10.58 H new ATOM 0 HB THR A 74 4.990 17.167 -6.629 1.00 10.38 H new ATOM 0 HG1 THR A 74 7.331 15.496 -6.625 1.00 10.63 H new ATOM 0 HG21 THR A 74 5.013 15.694 -4.647 1.00 9.98 H new ATOM 0 HG22 THR A 74 3.758 15.222 -5.817 1.00 9.98 H new ATOM 0 HG23 THR A 74 5.269 14.288 -5.706 1.00 9.98 H new ATOM 1114 N GLN A 75 5.914 13.872 -9.613 1.00 11.10 N ATOM 1115 CA GLN A 75 6.496 12.597 -10.016 1.00 11.47 C ATOM 1116 C GLN A 75 5.821 11.457 -9.273 1.00 11.19 C ATOM 1117 O GLN A 75 6.406 10.828 -8.389 1.00 11.49 O ATOM 1118 CB GLN A 75 8.003 12.566 -9.794 1.00 12.23 C ATOM 1119 CG GLN A 75 8.678 11.438 -10.543 1.00 12.99 C ATOM 1120 CD GLN A 75 8.659 11.645 -12.043 1.00 13.67 C ATOM 1121 OE1 GLN A 75 7.731 11.222 -12.728 1.00 13.95 O ATOM 1122 NE2 GLN A 75 9.678 12.307 -12.561 1.00 14.09 N ATOM 0 H GLN A 75 5.422 14.355 -10.365 1.00 11.10 H new ATOM 0 HA GLN A 75 6.325 12.476 -11.086 1.00 11.47 H new ATOM 0 HB2 GLN A 75 8.433 13.516 -10.111 1.00 12.23 H new ATOM 0 HB3 GLN A 75 8.208 12.463 -8.728 1.00 12.23 H new ATOM 0 HG2 GLN A 75 9.710 11.348 -10.205 1.00 12.99 H new ATOM 0 HG3 GLN A 75 8.181 10.498 -10.303 1.00 12.99 H new ATOM 0 HE21 GLN A 75 10.429 12.642 -11.957 1.00 14.09 H new ATOM 0 HE22 GLN A 75 9.714 12.484 -13.565 1.00 14.09 H new ATOM 1131 N ASN A 76 4.578 11.194 -9.638 1.00 10.79 N ATOM 1132 CA ASN A 76 3.805 10.144 -8.999 1.00 10.66 C ATOM 1133 C ASN A 76 3.198 9.223 -10.039 1.00 11.04 C ATOM 1134 O ASN A 76 2.074 9.465 -10.484 1.00 11.22 O ATOM 1135 CB ASN A 76 2.676 10.709 -8.140 1.00 10.19 C ATOM 1136 CG ASN A 76 3.127 11.770 -7.149 1.00 9.94 C ATOM 1137 OD1 ASN A 76 3.072 12.966 -7.434 1.00 10.12 O ATOM 1138 ND2 ASN A 76 3.586 11.347 -5.982 1.00 9.78 N ATOM 0 H ASN A 76 4.082 11.695 -10.375 1.00 10.79 H new ATOM 0 HA ASN A 76 4.494 9.593 -8.359 1.00 10.66 H new ATOM 0 HB2 ASN A 76 1.915 11.136 -8.793 1.00 10.19 H new ATOM 0 HB3 ASN A 76 2.205 9.892 -7.593 1.00 10.19 H new ATOM 0 HD21 ASN A 76 3.908 12.020 -5.286 1.00 9.78 H new ATOM 0 HD22 ASN A 76 3.618 10.348 -5.778 1.00 9.78 H new ATOM 1145 N LEU A 77 3.919 8.205 -10.453 1.00 11.36 N ATOM 1146 CA LEU A 77 3.398 7.289 -11.457 1.00 11.92 C ATOM 1147 C LEU A 77 2.086 6.670 -10.978 1.00 11.78 C ATOM 1148 O LEU A 77 1.050 6.788 -11.643 1.00 12.15 O ATOM 1149 CB LEU A 77 4.416 6.195 -11.789 1.00 12.58 C ATOM 1150 CG LEU A 77 4.021 5.280 -12.946 1.00 13.28 C ATOM 1151 CD1 LEU A 77 3.863 6.089 -14.221 1.00 13.59 C ATOM 1152 CD2 LEU A 77 5.050 4.175 -13.128 1.00 13.71 C ATOM 0 H LEU A 77 4.858 7.987 -10.118 1.00 11.36 H new ATOM 0 HA LEU A 77 3.208 7.857 -12.368 1.00 11.92 H new ATOM 0 HB2 LEU A 77 5.370 6.666 -12.027 1.00 12.58 H new ATOM 0 HB3 LEU A 77 4.575 5.585 -10.900 1.00 12.58 H new ATOM 0 HG LEU A 77 3.064 4.813 -12.714 1.00 13.28 H new ATOM 0 HD11 LEU A 77 3.581 5.427 -15.040 1.00 13.59 H new ATOM 0 HD12 LEU A 77 3.088 6.842 -14.080 1.00 13.59 H new ATOM 0 HD13 LEU A 77 4.806 6.580 -14.460 1.00 13.59 H new ATOM 0 HD21 LEU A 77 4.752 3.533 -13.957 1.00 13.71 H new ATOM 0 HD22 LEU A 77 6.023 4.616 -13.343 1.00 13.71 H new ATOM 0 HD23 LEU A 77 5.113 3.583 -12.215 1.00 13.71 H new ATOM 1164 N GLY A 78 2.130 6.042 -9.809 1.00 11.41 N ATOM 1165 CA GLY A 78 0.922 5.527 -9.199 1.00 11.44 C ATOM 1166 C GLY A 78 0.975 5.605 -7.693 1.00 10.55 C ATOM 1167 O GLY A 78 0.070 5.134 -7.006 1.00 10.48 O ATOM 0 H GLY A 78 2.983 5.881 -9.273 1.00 11.41 H new ATOM 0 HA2 GLY A 78 0.063 6.091 -9.562 1.00 11.44 H new ATOM 0 HA3 GLY A 78 0.774 4.491 -9.504 1.00 11.44 H new ATOM 1171 N VAL A 79 2.035 6.229 -7.182 1.00 9.99 N ATOM 1172 CA VAL A 79 2.245 6.370 -5.744 1.00 9.16 C ATOM 1173 C VAL A 79 2.293 5.005 -5.072 1.00 8.69 C ATOM 1174 O VAL A 79 1.658 4.757 -4.046 1.00 8.93 O ATOM 1175 CB VAL A 79 1.154 7.236 -5.090 1.00 9.21 C ATOM 1176 CG1 VAL A 79 1.473 7.521 -3.619 1.00 8.66 C ATOM 1177 CG2 VAL A 79 1.004 8.529 -5.857 1.00 9.75 C ATOM 0 H VAL A 79 2.769 6.649 -7.752 1.00 9.99 H new ATOM 0 HA VAL A 79 3.203 6.872 -5.606 1.00 9.16 H new ATOM 0 HB VAL A 79 0.214 6.685 -5.122 1.00 9.21 H new ATOM 0 HG11 VAL A 79 0.682 8.135 -3.188 1.00 8.66 H new ATOM 0 HG12 VAL A 79 1.541 6.580 -3.073 1.00 8.66 H new ATOM 0 HG13 VAL A 79 2.423 8.051 -3.549 1.00 8.66 H new ATOM 0 HG21 VAL A 79 0.231 9.140 -5.392 1.00 9.75 H new ATOM 0 HG22 VAL A 79 1.950 9.070 -5.846 1.00 9.75 H new ATOM 0 HG23 VAL A 79 0.723 8.310 -6.887 1.00 9.75 H new ATOM 1187 N ARG A 80 3.026 4.099 -5.668 1.00 8.26 N ATOM 1188 CA ARG A 80 3.264 2.838 -5.012 1.00 8.04 C ATOM 1189 C ARG A 80 4.481 2.972 -4.124 1.00 7.16 C ATOM 1190 O ARG A 80 5.364 3.786 -4.398 1.00 6.61 O ATOM 1191 CB ARG A 80 3.379 1.677 -6.001 1.00 8.39 C ATOM 1192 CG ARG A 80 2.096 1.474 -6.789 1.00 8.96 C ATOM 1193 CD ARG A 80 2.087 0.166 -7.557 1.00 9.63 C ATOM 1194 NE ARG A 80 0.839 -0.008 -8.302 1.00 10.25 N ATOM 1195 CZ ARG A 80 0.436 -1.156 -8.840 1.00 10.94 C ATOM 1196 NH1 ARG A 80 1.199 -2.239 -8.756 1.00 11.11 N1+ ATOM 1197 NH2 ARG A 80 -0.727 -1.218 -9.474 1.00 11.64 N ATOM 0 H ARG A 80 3.460 4.205 -6.585 1.00 8.26 H new ATOM 0 HA ARG A 80 2.402 2.592 -4.392 1.00 8.04 H new ATOM 0 HB2 ARG A 80 4.202 1.867 -6.690 1.00 8.39 H new ATOM 0 HB3 ARG A 80 3.621 0.762 -5.460 1.00 8.39 H new ATOM 0 HG2 ARG A 80 1.247 1.497 -6.106 1.00 8.96 H new ATOM 0 HG3 ARG A 80 1.967 2.302 -7.486 1.00 8.96 H new ATOM 0 HD2 ARG A 80 2.931 0.142 -8.247 1.00 9.63 H new ATOM 0 HD3 ARG A 80 2.218 -0.665 -6.864 1.00 9.63 H new ATOM 0 HE ARG A 80 0.237 0.807 -8.417 1.00 10.25 H new ATOM 0 HH11 ARG A 80 2.099 -2.193 -8.277 1.00 11.11 H new ATOM 0 HH12 ARG A 80 0.886 -3.117 -9.170 1.00 11.11 H new ATOM 0 HH21 ARG A 80 -1.312 -0.386 -9.549 1.00 11.64 H new ATOM 0 HH22 ARG A 80 -1.037 -2.098 -9.887 1.00 11.64 H new ATOM 1211 N THR A 81 4.521 2.213 -3.060 1.00 7.24 N ATOM 1212 CA THR A 81 5.529 2.396 -2.047 1.00 6.59 C ATOM 1213 C THR A 81 6.464 1.200 -1.965 1.00 6.82 C ATOM 1214 O THR A 81 6.246 0.171 -2.610 1.00 7.73 O ATOM 1215 CB THR A 81 4.873 2.632 -0.672 1.00 6.98 C ATOM 1216 OG1 THR A 81 3.803 1.697 -0.468 1.00 8.00 O ATOM 1217 CG2 THR A 81 4.335 4.049 -0.538 1.00 7.05 C ATOM 0 H THR A 81 3.863 1.457 -2.871 1.00 7.24 H new ATOM 0 HA THR A 81 6.116 3.271 -2.326 1.00 6.59 H new ATOM 0 HB THR A 81 5.644 2.487 0.085 1.00 6.98 H new ATOM 0 HG1 THR A 81 3.609 1.626 0.490 1.00 8.00 H new ATOM 0 HG21 THR A 81 3.881 4.174 0.445 1.00 7.05 H new ATOM 0 HG22 THR A 81 5.152 4.761 -0.654 1.00 7.05 H new ATOM 0 HG23 THR A 81 3.586 4.228 -1.309 1.00 7.05 H new ATOM 1225 N ALA A 82 7.526 1.371 -1.203 1.00 6.18 N ATOM 1226 CA ALA A 82 8.423 0.284 -0.875 1.00 6.65 C ATOM 1227 C ALA A 82 8.892 0.460 0.560 1.00 6.65 C ATOM 1228 O ALA A 82 9.358 1.539 0.937 1.00 5.88 O ATOM 1229 CB ALA A 82 9.599 0.242 -1.845 1.00 6.36 C ATOM 0 H ALA A 82 7.790 2.268 -0.795 1.00 6.18 H new ATOM 0 HA ALA A 82 7.901 -0.669 -0.967 1.00 6.65 H new ATOM 0 HB1 ALA A 82 10.260 -0.583 -1.580 1.00 6.36 H new ATOM 0 HB2 ALA A 82 9.229 0.098 -2.860 1.00 6.36 H new ATOM 0 HB3 ALA A 82 10.150 1.181 -1.790 1.00 6.36 H new ATOM 1235 N GLU A 83 8.732 -0.579 1.364 1.00 7.70 N ATOM 1236 CA GLU A 83 9.094 -0.515 2.765 1.00 8.10 C ATOM 1237 C GLU A 83 10.595 -0.685 2.921 1.00 7.90 C ATOM 1238 O GLU A 83 11.213 -1.499 2.239 1.00 8.21 O ATOM 1239 CB GLU A 83 8.347 -1.589 3.554 1.00 9.47 C ATOM 1240 CG GLU A 83 8.524 -1.464 5.057 1.00 10.14 C ATOM 1241 CD GLU A 83 7.702 -2.474 5.826 1.00 11.52 C ATOM 1242 OE1 GLU A 83 8.118 -3.643 5.911 1.00 12.15 O ATOM 1243 OE2 GLU A 83 6.632 -2.099 6.348 1.00 12.06 O1- ATOM 0 H GLU A 83 8.352 -1.478 1.066 1.00 7.70 H new ATOM 0 HA GLU A 83 8.811 0.461 3.160 1.00 8.10 H new ATOM 0 HB2 GLU A 83 7.285 -1.533 3.315 1.00 9.47 H new ATOM 0 HB3 GLU A 83 8.694 -2.572 3.235 1.00 9.47 H new ATOM 0 HG2 GLU A 83 9.577 -1.593 5.307 1.00 10.14 H new ATOM 0 HG3 GLU A 83 8.243 -0.458 5.370 1.00 10.14 H new ATOM 1250 N VAL A 84 11.164 0.114 3.805 1.00 7.58 N ATOM 1251 CA VAL A 84 12.594 0.107 4.065 1.00 7.50 C ATOM 1252 C VAL A 84 13.104 -1.257 4.489 1.00 8.74 C ATOM 1253 O VAL A 84 12.527 -1.912 5.361 1.00 9.71 O ATOM 1254 CB VAL A 84 12.959 1.146 5.141 1.00 7.28 C ATOM 1255 CG1 VAL A 84 14.366 0.915 5.656 1.00 7.49 C ATOM 1256 CG2 VAL A 84 12.813 2.554 4.590 1.00 6.28 C ATOM 0 H VAL A 84 10.646 0.790 4.366 1.00 7.58 H new ATOM 0 HA VAL A 84 13.078 0.366 3.123 1.00 7.50 H new ATOM 0 HB VAL A 84 12.270 1.030 5.977 1.00 7.28 H new ATOM 0 HG11 VAL A 84 14.603 1.661 6.415 1.00 7.49 H new ATOM 0 HG12 VAL A 84 14.435 -0.082 6.092 1.00 7.49 H new ATOM 0 HG13 VAL A 84 15.074 1.000 4.831 1.00 7.49 H new ATOM 0 HG21 VAL A 84 13.075 3.276 5.363 1.00 6.28 H new ATOM 0 HG22 VAL A 84 13.477 2.681 3.735 1.00 6.28 H new ATOM 0 HG23 VAL A 84 11.782 2.717 4.276 1.00 6.28 H new ATOM 1266 N LYS A 85 14.203 -1.659 3.863 1.00 8.82 N ATOM 1267 CA LYS A 85 14.848 -2.931 4.135 1.00 10.03 C ATOM 1268 C LYS A 85 16.341 -2.725 4.198 1.00 10.02 C ATOM 1269 O LYS A 85 16.879 -1.913 3.463 1.00 9.25 O ATOM 1270 CB LYS A 85 14.548 -3.945 3.028 1.00 10.75 C ATOM 1271 CG LYS A 85 13.077 -4.076 2.711 1.00 10.58 C ATOM 1272 CD LYS A 85 12.320 -4.680 3.871 1.00 11.03 C ATOM 1273 CE LYS A 85 10.856 -4.304 3.819 1.00 10.50 C ATOM 1274 NZ LYS A 85 10.067 -5.039 4.840 1.00 11.02 N1+ ATOM 0 H LYS A 85 14.673 -1.105 3.147 1.00 8.82 H new ATOM 0 HA LYS A 85 14.467 -3.313 5.082 1.00 10.03 H new ATOM 0 HB2 LYS A 85 15.081 -3.652 2.124 1.00 10.75 H new ATOM 0 HB3 LYS A 85 14.935 -4.920 3.325 1.00 10.75 H new ATOM 0 HG2 LYS A 85 12.664 -3.095 2.475 1.00 10.58 H new ATOM 0 HG3 LYS A 85 12.947 -4.698 1.825 1.00 10.58 H new ATOM 0 HD2 LYS A 85 12.421 -5.765 3.850 1.00 11.03 H new ATOM 0 HD3 LYS A 85 12.754 -4.337 4.810 1.00 11.03 H new ATOM 0 HE2 LYS A 85 10.749 -3.231 3.979 1.00 10.50 H new ATOM 0 HE3 LYS A 85 10.459 -4.520 2.827 1.00 10.50 H new ATOM 0 HZ1 LYS A 85 9.335 -5.608 4.369 1.00 11.02 H new ATOM 0 HZ2 LYS A 85 10.697 -5.665 5.381 1.00 11.02 H new ATOM 0 HZ3 LYS A 85 9.616 -4.360 5.485 1.00 11.02 H new ATOM 1288 N LEU A 86 17.011 -3.436 5.068 1.00 10.96 N ATOM 1289 CA LEU A 86 18.464 -3.429 5.051 1.00 11.21 C ATOM 1290 C LEU A 86 18.967 -4.309 3.913 1.00 11.85 C ATOM 1291 O LEU A 86 18.298 -5.264 3.514 1.00 12.43 O ATOM 1292 CB LEU A 86 19.071 -3.873 6.387 1.00 12.08 C ATOM 1293 CG LEU A 86 19.003 -2.841 7.518 1.00 11.90 C ATOM 1294 CD1 LEU A 86 17.584 -2.693 8.045 1.00 11.97 C ATOM 1295 CD2 LEU A 86 19.953 -3.225 8.638 1.00 12.76 C ATOM 0 H LEU A 86 16.589 -4.021 5.789 1.00 10.96 H new ATOM 0 HA LEU A 86 18.787 -2.401 4.890 1.00 11.21 H new ATOM 0 HB2 LEU A 86 18.561 -4.779 6.714 1.00 12.08 H new ATOM 0 HB3 LEU A 86 20.116 -4.137 6.222 1.00 12.08 H new ATOM 0 HG LEU A 86 19.309 -1.876 7.115 1.00 11.90 H new ATOM 0 HD11 LEU A 86 17.569 -1.954 8.846 1.00 11.97 H new ATOM 0 HD12 LEU A 86 16.928 -2.367 7.238 1.00 11.97 H new ATOM 0 HD13 LEU A 86 17.237 -3.652 8.429 1.00 11.97 H new ATOM 0 HD21 LEU A 86 19.895 -2.484 9.435 1.00 12.76 H new ATOM 0 HD22 LEU A 86 19.675 -4.203 9.031 1.00 12.76 H new ATOM 0 HD23 LEU A 86 20.972 -3.265 8.253 1.00 12.76 H new ATOM 1307 N GLY A 87 20.137 -3.982 3.385 1.00 11.89 N ATOM 1308 CA GLY A 87 20.698 -4.764 2.302 1.00 12.65 C ATOM 1309 C GLY A 87 22.090 -4.315 1.916 1.00 12.97 C ATOM 1310 O GLY A 87 22.378 -4.109 0.737 1.00 13.25 O ATOM 0 H GLY A 87 20.707 -3.191 3.686 1.00 11.89 H new ATOM 0 HA2 GLY A 87 20.728 -5.813 2.595 1.00 12.65 H new ATOM 0 HA3 GLY A 87 20.044 -4.694 1.433 1.00 12.65 H new ATOM 1314 N ARG A 88 22.952 -4.159 2.911 1.00 13.08 N ATOM 1315 CA ARG A 88 24.316 -3.686 2.686 1.00 13.46 C ATOM 1316 C ARG A 88 25.118 -4.673 1.836 1.00 14.71 C ATOM 1317 O ARG A 88 24.906 -5.885 1.904 1.00 15.30 O ATOM 1318 CB ARG A 88 25.021 -3.459 4.019 1.00 13.18 C ATOM 1319 CG ARG A 88 25.402 -4.730 4.750 1.00 13.67 C ATOM 1320 CD ARG A 88 26.067 -4.404 6.061 1.00 14.20 C ATOM 1321 NE ARG A 88 26.325 -5.591 6.867 1.00 14.90 N ATOM 1322 CZ ARG A 88 27.408 -5.753 7.625 1.00 15.63 C ATOM 1323 NH1 ARG A 88 28.363 -4.829 7.638 1.00 15.77 N1+ ATOM 1324 NH2 ARG A 88 27.545 -6.850 8.353 1.00 16.35 N ATOM 0 H ARG A 88 22.732 -4.354 3.888 1.00 13.08 H new ATOM 0 HA ARG A 88 24.255 -2.743 2.143 1.00 13.46 H new ATOM 0 HB2 ARG A 88 25.922 -2.871 3.844 1.00 13.18 H new ATOM 0 HB3 ARG A 88 24.372 -2.865 4.663 1.00 13.18 H new ATOM 0 HG2 ARG A 88 24.513 -5.335 4.927 1.00 13.67 H new ATOM 0 HG3 ARG A 88 26.075 -5.325 4.132 1.00 13.67 H new ATOM 0 HD2 ARG A 88 27.008 -3.888 5.869 1.00 14.20 H new ATOM 0 HD3 ARG A 88 25.435 -3.717 6.624 1.00 14.20 H new ATOM 0 HE ARG A 88 25.635 -6.342 6.849 1.00 14.90 H new ATOM 0 HH11 ARG A 88 28.269 -3.990 7.065 1.00 15.77 H new ATOM 0 HH12 ARG A 88 29.190 -4.959 8.221 1.00 15.77 H new ATOM 0 HH21 ARG A 88 26.822 -7.569 8.333 1.00 16.35 H new ATOM 0 HH22 ARG A 88 28.374 -6.976 8.934 1.00 16.35 H new ATOM 1338 N LEU A 89 26.030 -4.145 1.031 1.00 15.20 N ATOM 1339 CA LEU A 89 26.872 -4.971 0.177 1.00 16.46 C ATOM 1340 C LEU A 89 28.241 -4.317 0.019 1.00 16.93 C ATOM 1341 O LEU A 89 28.477 -3.561 -0.927 1.00 16.94 O ATOM 1342 CB LEU A 89 26.202 -5.143 -1.192 1.00 16.92 C ATOM 1343 CG LEU A 89 26.987 -5.966 -2.217 1.00 17.63 C ATOM 1344 CD1 LEU A 89 27.183 -7.392 -1.734 1.00 18.22 C ATOM 1345 CD2 LEU A 89 26.273 -5.949 -3.558 1.00 17.91 C ATOM 0 H LEU A 89 26.206 -3.143 0.952 1.00 15.20 H new ATOM 0 HA LEU A 89 27.003 -5.953 0.632 1.00 16.46 H new ATOM 0 HB2 LEU A 89 25.230 -5.613 -1.044 1.00 16.92 H new ATOM 0 HB3 LEU A 89 26.017 -4.154 -1.612 1.00 16.92 H new ATOM 0 HG LEU A 89 27.972 -5.515 -2.338 1.00 17.63 H new ATOM 0 HD11 LEU A 89 27.743 -7.955 -2.480 1.00 18.22 H new ATOM 0 HD12 LEU A 89 27.735 -7.385 -0.794 1.00 18.22 H new ATOM 0 HD13 LEU A 89 26.211 -7.861 -1.580 1.00 18.22 H new ATOM 0 HD21 LEU A 89 26.840 -6.537 -4.280 1.00 17.91 H new ATOM 0 HD22 LEU A 89 25.276 -6.376 -3.445 1.00 17.91 H new ATOM 0 HD23 LEU A 89 26.190 -4.922 -3.913 1.00 17.91 H new ATOM 1357 N GLY A 90 29.136 -4.588 0.962 1.00 17.39 N ATOM 1358 CA GLY A 90 30.429 -3.930 0.964 1.00 17.91 C ATOM 1359 C GLY A 90 30.318 -2.637 1.723 1.00 17.35 C ATOM 1360 O GLY A 90 31.290 -1.902 1.926 1.00 17.38 O ATOM 0 H GLY A 90 28.990 -5.250 1.724 1.00 17.39 H new ATOM 0 HA2 GLY A 90 31.179 -4.574 1.424 1.00 17.91 H new ATOM 0 HA3 GLY A 90 30.756 -3.740 -0.058 1.00 17.91 H new ATOM 1364 N SER A 91 29.092 -2.370 2.104 1.00 16.99 N ATOM 1365 CA SER A 91 28.730 -1.230 2.894 1.00 16.48 C ATOM 1366 C SER A 91 28.294 -1.701 4.273 1.00 15.54 C ATOM 1367 O SER A 91 28.153 -2.897 4.528 1.00 15.66 O ATOM 1368 CB SER A 91 27.586 -0.506 2.184 1.00 16.77 C ATOM 1369 OG SER A 91 26.573 -1.417 1.783 1.00 17.11 O ATOM 0 H SER A 91 28.298 -2.962 1.862 1.00 16.99 H new ATOM 0 HA SER A 91 29.573 -0.550 3.011 1.00 16.48 H new ATOM 0 HB2 SER A 91 27.160 0.246 2.848 1.00 16.77 H new ATOM 0 HB3 SER A 91 27.971 0.021 1.311 1.00 16.77 H new ATOM 0 HG SER A 91 25.863 -0.931 1.314 1.00 17.11 H new ATOM 1375 N THR A 92 28.123 -0.742 5.152 1.00 14.73 N ATOM 1376 CA THR A 92 27.588 -0.960 6.476 1.00 13.85 C ATOM 1377 C THR A 92 26.074 -1.009 6.391 1.00 13.26 C ATOM 1378 O THR A 92 25.504 -0.605 5.386 1.00 13.32 O ATOM 1379 CB THR A 92 28.023 0.187 7.407 1.00 13.23 C ATOM 1380 OG1 THR A 92 29.443 0.355 7.343 1.00 13.97 O ATOM 1381 CG2 THR A 92 27.604 -0.045 8.849 1.00 12.68 C ATOM 0 H THR A 92 28.357 0.233 4.963 1.00 14.73 H new ATOM 0 HA THR A 92 27.964 -1.901 6.877 1.00 13.85 H new ATOM 0 HB THR A 92 27.521 1.090 7.060 1.00 13.23 H new ATOM 0 HG1 THR A 92 29.713 1.087 7.936 1.00 13.97 H new ATOM 0 HG21 THR A 92 27.935 0.792 9.463 1.00 12.68 H new ATOM 0 HG22 THR A 92 26.519 -0.128 8.904 1.00 12.68 H new ATOM 0 HG23 THR A 92 28.058 -0.966 9.216 1.00 12.68 H new ATOM 1389 N GLU A 93 25.441 -1.517 7.434 1.00 12.87 N ATOM 1390 CA GLU A 93 23.996 -1.696 7.448 1.00 12.37 C ATOM 1391 C GLU A 93 23.267 -0.397 7.181 1.00 11.13 C ATOM 1392 O GLU A 93 23.205 0.487 8.033 1.00 10.78 O ATOM 1393 CB GLU A 93 23.528 -2.312 8.760 1.00 13.03 C ATOM 1394 CG GLU A 93 23.567 -3.824 8.747 1.00 13.80 C ATOM 1395 CD GLU A 93 23.562 -4.421 10.141 1.00 14.57 C ATOM 1396 OE1 GLU A 93 22.463 -4.582 10.711 1.00 14.92 O1- ATOM 1397 OE2 GLU A 93 24.644 -4.734 10.673 1.00 14.94 O ATOM 0 H GLU A 93 25.908 -1.816 8.290 1.00 12.87 H new ATOM 0 HA GLU A 93 23.753 -2.386 6.640 1.00 12.37 H new ATOM 0 HB2 GLU A 93 24.155 -1.944 9.572 1.00 13.03 H new ATOM 0 HB3 GLU A 93 22.510 -1.982 8.968 1.00 13.03 H new ATOM 0 HG2 GLU A 93 22.708 -4.201 8.192 1.00 13.80 H new ATOM 0 HG3 GLU A 93 24.460 -4.156 8.217 1.00 13.80 H new ATOM 1404 N ARG A 94 22.712 -0.308 5.992 1.00 10.57 N ATOM 1405 CA ARG A 94 21.984 0.876 5.565 1.00 9.39 C ATOM 1406 C ARG A 94 20.584 0.470 5.134 1.00 8.96 C ATOM 1407 O ARG A 94 20.319 -0.712 4.900 1.00 9.64 O ATOM 1408 CB ARG A 94 22.698 1.583 4.400 1.00 9.13 C ATOM 1409 CG ARG A 94 24.188 1.832 4.619 1.00 9.07 C ATOM 1410 CD ARG A 94 24.472 2.601 5.905 1.00 9.14 C ATOM 1411 NE ARG A 94 25.900 2.831 6.110 1.00 9.49 N ATOM 1412 CZ ARG A 94 26.406 3.454 7.173 1.00 9.84 C ATOM 1413 NH1 ARG A 94 25.612 3.815 8.175 1.00 9.96 N1+ ATOM 1414 NH2 ARG A 94 27.709 3.689 7.246 1.00 10.27 N ATOM 0 H ARG A 94 22.750 -1.050 5.293 1.00 10.57 H new ATOM 0 HA ARG A 94 21.935 1.573 6.402 1.00 9.39 H new ATOM 0 HB2 ARG A 94 22.573 0.984 3.498 1.00 9.13 H new ATOM 0 HB3 ARG A 94 22.207 2.539 4.218 1.00 9.13 H new ATOM 0 HG2 ARG A 94 24.712 0.876 4.648 1.00 9.07 H new ATOM 0 HG3 ARG A 94 24.588 2.389 3.771 1.00 9.07 H new ATOM 0 HD2 ARG A 94 23.953 3.559 5.875 1.00 9.14 H new ATOM 0 HD3 ARG A 94 24.070 2.047 6.753 1.00 9.14 H new ATOM 0 HE ARG A 94 26.548 2.495 5.397 1.00 9.49 H new ATOM 0 HH11 ARG A 94 24.613 3.615 8.131 1.00 9.96 H new ATOM 0 HH12 ARG A 94 26.002 4.292 8.988 1.00 9.96 H new ATOM 0 HH21 ARG A 94 28.324 3.393 6.488 1.00 10.27 H new ATOM 0 HH22 ARG A 94 28.096 4.166 8.060 1.00 10.27 H new ATOM 1428 N LEU A 95 19.695 1.440 5.060 1.00 7.97 N ATOM 1429 CA LEU A 95 18.337 1.206 4.631 1.00 7.54 C ATOM 1430 C LEU A 95 18.256 1.308 3.110 1.00 6.99 C ATOM 1431 O LEU A 95 18.445 2.375 2.537 1.00 6.27 O ATOM 1432 CB LEU A 95 17.437 2.263 5.276 1.00 6.93 C ATOM 1433 CG LEU A 95 17.482 2.353 6.812 1.00 7.79 C ATOM 1434 CD1 LEU A 95 17.377 0.978 7.449 1.00 8.88 C ATOM 1435 CD2 LEU A 95 18.726 3.083 7.309 1.00 7.89 C ATOM 0 H LEU A 95 19.897 2.412 5.296 1.00 7.97 H new ATOM 0 HA LEU A 95 18.012 0.210 4.932 1.00 7.54 H new ATOM 0 HB2 LEU A 95 17.707 3.237 4.868 1.00 6.93 H new ATOM 0 HB3 LEU A 95 16.408 2.066 4.975 1.00 6.93 H new ATOM 0 HG LEU A 95 16.615 2.939 7.117 1.00 7.79 H new ATOM 0 HD11 LEU A 95 17.412 1.076 8.534 1.00 8.88 H new ATOM 0 HD12 LEU A 95 16.436 0.513 7.157 1.00 8.88 H new ATOM 0 HD13 LEU A 95 18.208 0.357 7.114 1.00 8.88 H new ATOM 0 HD21 LEU A 95 18.714 3.122 8.398 1.00 7.89 H new ATOM 0 HD22 LEU A 95 19.617 2.552 6.975 1.00 7.89 H new ATOM 0 HD23 LEU A 95 18.737 4.097 6.910 1.00 7.89 H new ATOM 1447 N LEU A 96 17.974 0.187 2.465 1.00 7.59 N ATOM 1448 CA LEU A 96 17.922 0.126 1.013 1.00 7.52 C ATOM 1449 C LEU A 96 16.521 0.431 0.514 1.00 6.76 C ATOM 1450 O LEU A 96 15.542 -0.170 0.965 1.00 6.96 O ATOM 1451 CB LEU A 96 18.355 -1.263 0.514 1.00 8.83 C ATOM 1452 CG LEU A 96 19.856 -1.457 0.267 1.00 9.65 C ATOM 1453 CD1 LEU A 96 20.347 -0.517 -0.822 1.00 9.37 C ATOM 1454 CD2 LEU A 96 20.655 -1.262 1.549 1.00 9.78 C ATOM 0 H LEU A 96 17.776 -0.700 2.929 1.00 7.59 H new ATOM 0 HA LEU A 96 18.609 0.876 0.621 1.00 7.52 H new ATOM 0 HB2 LEU A 96 18.029 -2.005 1.242 1.00 8.83 H new ATOM 0 HB3 LEU A 96 17.825 -1.474 -0.415 1.00 8.83 H new ATOM 0 HG LEU A 96 20.010 -2.482 -0.069 1.00 9.65 H new ATOM 0 HD11 LEU A 96 21.414 -0.671 -0.982 1.00 9.37 H new ATOM 0 HD12 LEU A 96 19.809 -0.720 -1.748 1.00 9.37 H new ATOM 0 HD13 LEU A 96 20.171 0.515 -0.519 1.00 9.37 H new ATOM 0 HD21 LEU A 96 21.715 -1.406 1.342 1.00 9.78 H new ATOM 0 HD22 LEU A 96 20.493 -0.253 1.929 1.00 9.78 H new ATOM 0 HD23 LEU A 96 20.329 -1.987 2.295 1.00 9.78 H new ATOM 1466 N VAL A 97 16.451 1.343 -0.440 1.00 6.13 N ATOM 1467 CA VAL A 97 15.194 1.777 -1.034 1.00 5.45 C ATOM 1468 C VAL A 97 15.404 2.007 -2.518 1.00 5.86 C ATOM 1469 O VAL A 97 16.537 2.175 -2.953 1.00 6.40 O ATOM 1470 CB VAL A 97 14.691 3.096 -0.404 1.00 4.23 C ATOM 1471 CG1 VAL A 97 14.387 2.925 1.078 1.00 4.19 C ATOM 1472 CG2 VAL A 97 15.712 4.201 -0.626 1.00 4.01 C ATOM 0 H VAL A 97 17.271 1.808 -0.829 1.00 6.13 H new ATOM 0 HA VAL A 97 14.451 1.000 -0.855 1.00 5.45 H new ATOM 0 HB VAL A 97 13.759 3.375 -0.895 1.00 4.23 H new ATOM 0 HG11 VAL A 97 14.036 3.872 1.489 1.00 4.19 H new ATOM 0 HG12 VAL A 97 13.616 2.165 1.206 1.00 4.19 H new ATOM 0 HG13 VAL A 97 15.292 2.615 1.602 1.00 4.19 H new ATOM 0 HG21 VAL A 97 15.349 5.127 -0.179 1.00 4.01 H new ATOM 0 HG22 VAL A 97 16.658 3.921 -0.163 1.00 4.01 H new ATOM 0 HG23 VAL A 97 15.861 4.349 -1.696 1.00 4.01 H new ATOM 1482 N PRO A 98 14.337 2.008 -3.324 1.00 5.92 N ATOM 1483 CA PRO A 98 14.435 2.385 -4.736 1.00 6.55 C ATOM 1484 C PRO A 98 15.075 3.767 -4.898 1.00 6.22 C ATOM 1485 O PRO A 98 14.686 4.714 -4.213 1.00 5.29 O ATOM 1486 CB PRO A 98 12.974 2.385 -5.196 1.00 6.53 C ATOM 1487 CG PRO A 98 12.314 1.411 -4.292 1.00 6.39 C ATOM 1488 CD PRO A 98 12.960 1.631 -2.952 1.00 5.71 C ATOM 0 HA PRO A 98 15.064 1.712 -5.318 1.00 6.55 H new ATOM 0 HB2 PRO A 98 12.528 3.376 -5.109 1.00 6.53 H new ATOM 0 HB3 PRO A 98 12.884 2.085 -6.240 1.00 6.53 H new ATOM 0 HG2 PRO A 98 11.238 1.581 -4.245 1.00 6.39 H new ATOM 0 HG3 PRO A 98 12.460 0.388 -4.638 1.00 6.39 H new ATOM 0 HD2 PRO A 98 12.462 2.418 -2.385 1.00 5.71 H new ATOM 0 HD3 PRO A 98 12.937 0.731 -2.337 1.00 5.71 H new ATOM 1496 N SER A 99 16.065 3.877 -5.772 1.00 7.21 N ATOM 1497 CA SER A 99 16.803 5.121 -5.959 1.00 7.37 C ATOM 1498 C SER A 99 15.883 6.293 -6.325 1.00 7.21 C ATOM 1499 O SER A 99 16.199 7.447 -6.029 1.00 7.21 O ATOM 1500 CB SER A 99 17.874 4.938 -7.046 1.00 8.73 C ATOM 1501 OG SER A 99 18.768 6.037 -7.080 1.00 9.29 O ATOM 0 H SER A 99 16.379 3.112 -6.369 1.00 7.21 H new ATOM 0 HA SER A 99 17.278 5.363 -5.008 1.00 7.37 H new ATOM 0 HB2 SER A 99 18.431 4.020 -6.860 1.00 8.73 H new ATOM 0 HB3 SER A 99 17.393 4.828 -8.018 1.00 8.73 H new ATOM 0 HG SER A 99 19.352 6.008 -6.294 1.00 9.29 H new ATOM 1507 N GLU A 100 14.738 6.010 -6.928 1.00 7.31 N ATOM 1508 CA GLU A 100 13.811 7.072 -7.313 1.00 7.41 C ATOM 1509 C GLU A 100 12.810 7.376 -6.202 1.00 6.33 C ATOM 1510 O GLU A 100 11.917 8.204 -6.385 1.00 6.56 O ATOM 1511 CB GLU A 100 13.070 6.704 -8.597 1.00 8.22 C ATOM 1512 CG GLU A 100 13.991 6.464 -9.777 1.00 9.47 C ATOM 1513 CD GLU A 100 13.238 6.051 -11.019 1.00 10.34 C ATOM 1514 OE1 GLU A 100 12.952 4.847 -11.175 1.00 10.65 O1- ATOM 1515 OE2 GLU A 100 12.931 6.929 -11.852 1.00 10.86 O ATOM 0 H GLU A 100 14.428 5.067 -7.161 1.00 7.31 H new ATOM 0 HA GLU A 100 14.403 7.970 -7.489 1.00 7.41 H new ATOM 0 HB2 GLU A 100 12.477 5.807 -8.421 1.00 8.22 H new ATOM 0 HB3 GLU A 100 12.373 7.504 -8.847 1.00 8.22 H new ATOM 0 HG2 GLU A 100 14.557 7.372 -9.984 1.00 9.47 H new ATOM 0 HG3 GLU A 100 14.714 5.690 -9.519 1.00 9.47 H new ATOM 1522 N ALA A 101 12.956 6.744 -5.053 1.00 5.34 N ATOM 1523 CA ALA A 101 12.016 6.962 -3.961 1.00 4.45 C ATOM 1524 C ALA A 101 12.344 8.248 -3.217 1.00 4.45 C ATOM 1525 O ALA A 101 11.451 9.011 -2.838 1.00 4.62 O ATOM 1526 CB ALA A 101 12.019 5.781 -3.005 1.00 3.75 C ATOM 0 H ALA A 101 13.705 6.083 -4.849 1.00 5.34 H new ATOM 0 HA ALA A 101 11.018 7.056 -4.388 1.00 4.45 H new ATOM 0 HB1 ALA A 101 11.310 5.965 -2.197 1.00 3.75 H new ATOM 0 HB2 ALA A 101 11.731 4.877 -3.542 1.00 3.75 H new ATOM 0 HB3 ALA A 101 13.018 5.652 -2.589 1.00 3.75 H new ATOM 1532 N LEU A 102 13.632 8.497 -3.041 1.00 4.73 N ATOM 1533 CA LEU A 102 14.085 9.622 -2.248 1.00 5.07 C ATOM 1534 C LEU A 102 14.040 10.930 -3.024 1.00 6.33 C ATOM 1535 O LEU A 102 14.017 10.946 -4.256 1.00 6.97 O ATOM 1536 CB LEU A 102 15.479 9.351 -1.671 1.00 4.90 C ATOM 1537 CG LEU A 102 16.556 8.924 -2.676 1.00 5.36 C ATOM 1538 CD1 LEU A 102 17.142 10.129 -3.395 1.00 6.64 C ATOM 1539 CD2 LEU A 102 17.654 8.150 -1.969 1.00 4.98 C ATOM 0 H LEU A 102 14.382 7.932 -3.439 1.00 4.73 H new ATOM 0 HA LEU A 102 13.391 9.736 -1.415 1.00 5.07 H new ATOM 0 HB2 LEU A 102 15.822 10.253 -1.164 1.00 4.90 H new ATOM 0 HB3 LEU A 102 15.391 8.573 -0.912 1.00 4.90 H new ATOM 0 HG LEU A 102 16.089 8.279 -3.421 1.00 5.36 H new ATOM 0 HD11 LEU A 102 17.903 9.797 -4.101 1.00 6.64 H new ATOM 0 HD12 LEU A 102 16.351 10.652 -3.933 1.00 6.64 H new ATOM 0 HD13 LEU A 102 17.593 10.803 -2.667 1.00 6.64 H new ATOM 0 HD21 LEU A 102 18.413 7.852 -2.692 1.00 4.98 H new ATOM 0 HD22 LEU A 102 18.109 8.780 -1.205 1.00 4.98 H new ATOM 0 HD23 LEU A 102 17.230 7.261 -1.502 1.00 4.98 H new ATOM 1551 N ILE A 103 14.011 12.016 -2.284 1.00 6.87 N ATOM 1552 CA ILE A 103 13.995 13.355 -2.843 1.00 8.18 C ATOM 1553 C ILE A 103 15.362 13.993 -2.651 1.00 8.75 C ATOM 1554 O ILE A 103 15.893 14.008 -1.544 1.00 8.67 O ATOM 1555 CB ILE A 103 12.929 14.248 -2.146 1.00 8.80 C ATOM 1556 CG1 ILE A 103 11.497 13.910 -2.594 1.00 8.52 C ATOM 1557 CG2 ILE A 103 13.213 15.725 -2.391 1.00 10.20 C ATOM 1558 CD1 ILE A 103 11.054 12.495 -2.287 1.00 8.14 C ATOM 0 H ILE A 103 13.998 11.997 -1.264 1.00 6.87 H new ATOM 0 HA ILE A 103 13.747 13.277 -3.902 1.00 8.18 H new ATOM 0 HB ILE A 103 12.999 14.040 -1.078 1.00 8.80 H new ATOM 0 HG12 ILE A 103 10.807 14.604 -2.114 1.00 8.52 H new ATOM 0 HG13 ILE A 103 11.419 14.075 -3.669 1.00 8.52 H new ATOM 0 HG21 ILE A 103 12.454 16.329 -1.894 1.00 10.20 H new ATOM 0 HG22 ILE A 103 14.196 15.977 -1.993 1.00 10.20 H new ATOM 0 HG23 ILE A 103 13.193 15.927 -3.462 1.00 10.20 H new ATOM 0 HD11 ILE A 103 10.033 12.349 -2.639 1.00 8.14 H new ATOM 0 HD12 ILE A 103 11.715 11.789 -2.790 1.00 8.14 H new ATOM 0 HD13 ILE A 103 11.095 12.326 -1.211 1.00 8.14 H new ATOM 1570 N ARG A 104 15.945 14.499 -3.713 1.00 9.50 N ATOM 1571 CA ARG A 104 17.173 15.255 -3.571 1.00 10.25 C ATOM 1572 C ARG A 104 16.898 16.748 -3.603 1.00 11.48 C ATOM 1573 O ARG A 104 16.309 17.266 -4.554 1.00 12.12 O ATOM 1574 CB ARG A 104 18.221 14.865 -4.614 1.00 10.50 C ATOM 1575 CG ARG A 104 19.165 13.772 -4.139 1.00 9.82 C ATOM 1576 CD ARG A 104 20.047 14.280 -3.010 1.00 9.98 C ATOM 1577 NE ARG A 104 20.963 13.262 -2.501 1.00 10.43 N ATOM 1578 CZ ARG A 104 22.196 13.526 -2.071 1.00 10.83 C ATOM 1579 NH1 ARG A 104 22.678 14.762 -2.147 1.00 10.83 N1+ ATOM 1580 NH2 ARG A 104 22.948 12.557 -1.561 1.00 11.42 N ATOM 0 H ARG A 104 15.599 14.405 -4.668 1.00 9.50 H new ATOM 0 HA ARG A 104 17.591 15.004 -2.596 1.00 10.25 H new ATOM 0 HB2 ARG A 104 17.715 14.530 -5.520 1.00 10.50 H new ATOM 0 HB3 ARG A 104 18.803 15.747 -4.882 1.00 10.50 H new ATOM 0 HG2 ARG A 104 18.591 12.910 -3.799 1.00 9.82 H new ATOM 0 HG3 ARG A 104 19.786 13.434 -4.969 1.00 9.82 H new ATOM 0 HD2 ARG A 104 20.623 15.136 -3.363 1.00 9.98 H new ATOM 0 HD3 ARG A 104 19.416 14.634 -2.195 1.00 9.98 H new ATOM 0 HE ARG A 104 20.640 12.295 -2.473 1.00 10.43 H new ATOM 0 HH11 ARG A 104 22.104 15.510 -2.535 1.00 10.83 H new ATOM 0 HH12 ARG A 104 23.622 14.962 -1.817 1.00 10.83 H new ATOM 0 HH21 ARG A 104 22.582 11.607 -1.498 1.00 11.42 H new ATOM 0 HH22 ARG A 104 23.892 12.763 -1.233 1.00 11.42 H new ATOM 1594 N THR A 105 17.325 17.429 -2.554 1.00 11.91 N ATOM 1595 CA THR A 105 17.155 18.864 -2.442 1.00 13.15 C ATOM 1596 C THR A 105 18.310 19.454 -1.642 1.00 13.72 C ATOM 1597 O THR A 105 18.828 18.810 -0.727 1.00 13.20 O ATOM 1598 CB THR A 105 15.804 19.219 -1.774 1.00 13.31 C ATOM 1599 OG1 THR A 105 15.672 20.640 -1.641 1.00 14.61 O ATOM 1600 CG2 THR A 105 15.676 18.564 -0.407 1.00 12.61 C ATOM 0 H THR A 105 17.798 17.002 -1.758 1.00 11.91 H new ATOM 0 HA THR A 105 17.152 19.290 -3.445 1.00 13.15 H new ATOM 0 HB THR A 105 15.008 18.840 -2.414 1.00 13.31 H new ATOM 0 HG1 THR A 105 14.813 20.851 -1.219 1.00 14.61 H new ATOM 0 HG21 THR A 105 14.717 18.832 0.037 1.00 12.61 H new ATOM 0 HG22 THR A 105 15.736 17.481 -0.515 1.00 12.61 H new ATOM 0 HG23 THR A 105 16.484 18.909 0.239 1.00 12.61 H new ATOM 1608 N GLY A 106 18.733 20.656 -2.014 1.00 14.84 N ATOM 1609 CA GLY A 106 19.817 21.322 -1.314 1.00 15.52 C ATOM 1610 C GLY A 106 21.050 20.449 -1.199 1.00 14.91 C ATOM 1611 O GLY A 106 21.595 19.995 -2.206 1.00 14.86 O ATOM 0 H GLY A 106 18.342 21.185 -2.793 1.00 14.84 H new ATOM 0 HA2 GLY A 106 20.074 22.242 -1.839 1.00 15.52 H new ATOM 0 HA3 GLY A 106 19.482 21.607 -0.317 1.00 15.52 H new ATOM 1615 N ALA A 107 21.479 20.201 0.026 1.00 14.57 N ATOM 1616 CA ALA A 107 22.614 19.329 0.275 1.00 14.09 C ATOM 1617 C ALA A 107 22.206 18.149 1.145 1.00 12.88 C ATOM 1618 O ALA A 107 22.963 17.702 2.009 1.00 12.64 O ATOM 1619 CB ALA A 107 23.761 20.106 0.910 1.00 14.99 C ATOM 0 H ALA A 107 21.056 20.593 0.867 1.00 14.57 H new ATOM 0 HA ALA A 107 22.961 18.937 -0.681 1.00 14.09 H new ATOM 0 HB1 ALA A 107 24.601 19.434 1.088 1.00 14.99 H new ATOM 0 HB2 ALA A 107 24.073 20.907 0.240 1.00 14.99 H new ATOM 0 HB3 ALA A 107 23.431 20.533 1.857 1.00 14.99 H new ATOM 1625 N ARG A 108 21.000 17.655 0.912 1.00 12.19 N ATOM 1626 CA ARG A 108 20.438 16.586 1.722 1.00 11.09 C ATOM 1627 C ARG A 108 19.494 15.714 0.905 1.00 10.26 C ATOM 1628 O ARG A 108 19.257 15.974 -0.275 1.00 10.63 O ATOM 1629 CB ARG A 108 19.695 17.186 2.902 1.00 11.48 C ATOM 1630 CG ARG A 108 18.789 18.320 2.498 1.00 12.49 C ATOM 1631 CD ARG A 108 18.117 18.922 3.707 1.00 12.62 C ATOM 1632 NE ARG A 108 17.291 20.077 3.356 1.00 13.67 N ATOM 1633 CZ ARG A 108 16.385 20.635 4.160 1.00 14.22 C ATOM 1634 NH1 ARG A 108 16.169 20.155 5.380 1.00 13.92 N1+ ATOM 1635 NH2 ARG A 108 15.693 21.684 3.738 1.00 15.20 N ATOM 0 H ARG A 108 20.388 17.980 0.163 1.00 12.19 H new ATOM 0 HA ARG A 108 21.253 15.957 2.079 1.00 11.09 H new ATOM 0 HB2 ARG A 108 19.105 16.409 3.388 1.00 11.48 H new ATOM 0 HB3 ARG A 108 20.416 17.545 3.636 1.00 11.48 H new ATOM 0 HG2 ARG A 108 19.365 19.085 1.978 1.00 12.49 H new ATOM 0 HG3 ARG A 108 18.035 17.958 1.799 1.00 12.49 H new ATOM 0 HD2 ARG A 108 17.498 18.167 4.191 1.00 12.62 H new ATOM 0 HD3 ARG A 108 18.875 19.224 4.430 1.00 12.62 H new ATOM 0 HE ARG A 108 17.417 20.485 2.430 1.00 13.67 H new ATOM 0 HH11 ARG A 108 16.699 19.350 5.712 1.00 13.92 H new ATOM 0 HH12 ARG A 108 15.473 20.592 5.984 1.00 13.92 H new ATOM 0 HH21 ARG A 108 15.855 22.059 2.804 1.00 15.20 H new ATOM 0 HH22 ARG A 108 14.999 22.116 4.348 1.00 15.20 H new ATOM 1649 N THR A 109 18.959 14.679 1.534 1.00 9.26 N ATOM 1650 CA THR A 109 17.950 13.847 0.906 1.00 8.38 C ATOM 1651 C THR A 109 16.694 13.807 1.772 1.00 8.15 C ATOM 1652 O THR A 109 16.771 13.870 2.998 1.00 8.42 O ATOM 1653 CB THR A 109 18.467 12.413 0.668 1.00 7.38 C ATOM 1654 OG1 THR A 109 19.765 12.460 0.067 1.00 7.95 O ATOM 1655 CG2 THR A 109 17.521 11.641 -0.235 1.00 6.64 C ATOM 0 H THR A 109 19.209 14.396 2.482 1.00 9.26 H new ATOM 0 HA THR A 109 17.712 14.285 -0.063 1.00 8.38 H new ATOM 0 HB THR A 109 18.524 11.905 1.631 1.00 7.38 H new ATOM 0 HG1 THR A 109 20.436 12.157 0.714 1.00 7.95 H new ATOM 0 HG21 THR A 109 17.906 10.633 -0.389 1.00 6.64 H new ATOM 0 HG22 THR A 109 16.537 11.586 0.231 1.00 6.64 H new ATOM 0 HG23 THR A 109 17.440 12.149 -1.196 1.00 6.64 H new ATOM 1663 N ILE A 110 15.545 13.734 1.132 1.00 7.89 N ATOM 1664 CA ILE A 110 14.277 13.662 1.839 1.00 7.87 C ATOM 1665 C ILE A 110 13.532 12.409 1.397 1.00 6.75 C ATOM 1666 O ILE A 110 13.740 11.927 0.290 1.00 6.24 O ATOM 1667 CB ILE A 110 13.400 14.907 1.556 1.00 9.02 C ATOM 1668 CG1 ILE A 110 14.165 16.207 1.831 1.00 10.20 C ATOM 1669 CG2 ILE A 110 12.118 14.868 2.370 1.00 9.31 C ATOM 1670 CD1 ILE A 110 14.591 16.385 3.272 1.00 10.55 C ATOM 0 H ILE A 110 15.460 13.723 0.116 1.00 7.89 H new ATOM 0 HA ILE A 110 14.481 13.628 2.909 1.00 7.87 H new ATOM 0 HB ILE A 110 13.139 14.885 0.498 1.00 9.02 H new ATOM 0 HG12 ILE A 110 15.051 16.235 1.196 1.00 10.20 H new ATOM 0 HG13 ILE A 110 13.539 17.051 1.542 1.00 10.20 H new ATOM 0 HG21 ILE A 110 11.521 15.754 2.152 1.00 9.31 H new ATOM 0 HG22 ILE A 110 11.550 13.975 2.111 1.00 9.31 H new ATOM 0 HG23 ILE A 110 12.362 14.847 3.432 1.00 9.31 H new ATOM 0 HD11 ILE A 110 15.125 17.329 3.379 1.00 10.55 H new ATOM 0 HD12 ILE A 110 13.710 16.392 3.914 1.00 10.55 H new ATOM 0 HD13 ILE A 110 15.245 15.563 3.562 1.00 10.55 H new ATOM 1682 N ALA A 111 12.695 11.865 2.255 1.00 6.58 N ATOM 1683 CA ALA A 111 11.891 10.714 1.891 1.00 5.74 C ATOM 1684 C ALA A 111 10.426 10.974 2.188 1.00 6.51 C ATOM 1685 O ALA A 111 10.080 11.442 3.267 1.00 7.39 O ATOM 1686 CB ALA A 111 12.371 9.478 2.629 1.00 5.00 C ATOM 0 H ALA A 111 12.553 12.199 3.208 1.00 6.58 H new ATOM 0 HA ALA A 111 12.000 10.541 0.820 1.00 5.74 H new ATOM 0 HB1 ALA A 111 11.757 8.623 2.345 1.00 5.00 H new ATOM 0 HB2 ALA A 111 13.411 9.280 2.370 1.00 5.00 H new ATOM 0 HB3 ALA A 111 12.290 9.641 3.704 1.00 5.00 H new ATOM 1692 N MET A 112 9.575 10.695 1.220 1.00 6.37 N ATOM 1693 CA MET A 112 8.140 10.827 1.409 1.00 7.19 C ATOM 1694 C MET A 112 7.581 9.526 1.972 1.00 6.90 C ATOM 1695 O MET A 112 7.373 8.556 1.240 1.00 6.29 O ATOM 1696 CB MET A 112 7.461 11.160 0.082 1.00 7.48 C ATOM 1697 CG MET A 112 7.774 12.553 -0.441 1.00 8.19 C ATOM 1698 SD MET A 112 7.107 12.838 -2.092 1.00 8.85 S ATOM 1699 CE MET A 112 5.386 12.417 -1.830 1.00 8.24 C ATOM 0 H MET A 112 9.851 10.375 0.292 1.00 6.37 H new ATOM 0 HA MET A 112 7.944 11.637 2.111 1.00 7.19 H new ATOM 0 HB2 MET A 112 7.765 10.426 -0.664 1.00 7.48 H new ATOM 0 HB3 MET A 112 6.382 11.063 0.203 1.00 7.48 H new ATOM 0 HG2 MET A 112 7.366 13.295 0.245 1.00 8.19 H new ATOM 0 HG3 MET A 112 8.854 12.696 -0.460 1.00 8.19 H new ATOM 0 HE1 MET A 112 4.835 12.542 -2.762 1.00 8.24 H new ATOM 0 HE2 MET A 112 5.311 11.381 -1.500 1.00 8.24 H new ATOM 0 HE3 MET A 112 4.963 13.072 -1.068 1.00 8.24 H new ATOM 1709 N VAL A 113 7.352 9.512 3.277 1.00 7.60 N ATOM 1710 CA VAL A 113 6.933 8.309 3.967 1.00 7.75 C ATOM 1711 C VAL A 113 5.419 8.140 3.900 1.00 8.59 C ATOM 1712 O VAL A 113 4.663 9.101 4.061 1.00 9.48 O ATOM 1713 CB VAL A 113 7.406 8.314 5.442 1.00 8.42 C ATOM 1714 CG1 VAL A 113 6.644 9.329 6.281 1.00 9.69 C ATOM 1715 CG2 VAL A 113 7.296 6.925 6.046 1.00 8.72 C ATOM 0 H VAL A 113 7.451 10.329 3.880 1.00 7.60 H new ATOM 0 HA VAL A 113 7.399 7.463 3.461 1.00 7.75 H new ATOM 0 HB VAL A 113 8.454 8.613 5.446 1.00 8.42 H new ATOM 0 HG11 VAL A 113 7.008 9.299 7.308 1.00 9.69 H new ATOM 0 HG12 VAL A 113 6.797 10.328 5.871 1.00 9.69 H new ATOM 0 HG13 VAL A 113 5.581 9.089 6.265 1.00 9.69 H new ATOM 0 HG21 VAL A 113 7.633 6.951 7.082 1.00 8.72 H new ATOM 0 HG22 VAL A 113 6.258 6.594 6.010 1.00 8.72 H new ATOM 0 HG23 VAL A 113 7.918 6.232 5.480 1.00 8.72 H new ATOM 1725 N ALA A 114 4.992 6.918 3.641 1.00 8.43 N ATOM 1726 CA ALA A 114 3.581 6.596 3.576 1.00 9.31 C ATOM 1727 C ALA A 114 3.075 6.184 4.946 1.00 10.44 C ATOM 1728 O ALA A 114 3.196 5.024 5.344 1.00 10.70 O ATOM 1729 CB ALA A 114 3.337 5.491 2.566 1.00 8.96 C ATOM 0 H ALA A 114 5.611 6.125 3.471 1.00 8.43 H new ATOM 0 HA ALA A 114 3.034 7.483 3.255 1.00 9.31 H new ATOM 0 HB1 ALA A 114 2.272 5.261 2.529 1.00 8.96 H new ATOM 0 HB2 ALA A 114 3.672 5.817 1.582 1.00 8.96 H new ATOM 0 HB3 ALA A 114 3.891 4.600 2.861 1.00 8.96 H new ATOM 1735 N LYS A 115 2.536 7.144 5.671 1.00 11.26 N ATOM 1736 CA LYS A 115 2.009 6.887 6.996 1.00 12.43 C ATOM 1737 C LYS A 115 0.771 6.011 6.921 1.00 13.26 C ATOM 1738 O LYS A 115 -0.060 6.164 6.024 1.00 13.19 O ATOM 1739 CB LYS A 115 1.661 8.199 7.700 1.00 13.13 C ATOM 1740 CG LYS A 115 2.863 8.976 8.199 1.00 13.19 C ATOM 1741 CD LYS A 115 2.433 10.288 8.830 1.00 14.08 C ATOM 1742 CE LYS A 115 3.574 10.955 9.577 1.00 14.36 C ATOM 1743 NZ LYS A 115 3.219 12.332 10.013 1.00 14.88 N1+ ATOM 0 H LYS A 115 2.451 8.113 5.363 1.00 11.26 H new ATOM 0 HA LYS A 115 2.779 6.367 7.567 1.00 12.43 H new ATOM 0 HB2 LYS A 115 1.096 8.828 7.012 1.00 13.13 H new ATOM 0 HB3 LYS A 115 1.007 7.982 8.544 1.00 13.13 H new ATOM 0 HG2 LYS A 115 3.410 8.379 8.928 1.00 13.19 H new ATOM 0 HG3 LYS A 115 3.544 9.172 7.371 1.00 13.19 H new ATOM 0 HD2 LYS A 115 2.064 10.960 8.055 1.00 14.08 H new ATOM 0 HD3 LYS A 115 1.606 10.107 9.516 1.00 14.08 H new ATOM 0 HE2 LYS A 115 3.838 10.355 10.448 1.00 14.36 H new ATOM 0 HE3 LYS A 115 4.455 10.992 8.936 1.00 14.36 H new ATOM 0 HZ1 LYS A 115 4.055 12.791 10.429 1.00 14.88 H new ATOM 0 HZ2 LYS A 115 2.894 12.883 9.193 1.00 14.88 H new ATOM 0 HZ3 LYS A 115 2.460 12.287 10.723 1.00 14.88 H new ATOM 1757 N GLY A 116 0.644 5.103 7.881 1.00 14.15 N ATOM 1758 CA GLY A 116 -0.553 4.292 7.985 1.00 15.10 C ATOM 1759 C GLY A 116 -1.747 5.130 8.388 1.00 16.02 C ATOM 1760 O GLY A 116 -2.881 4.655 8.404 1.00 16.92 O ATOM 0 H GLY A 116 1.351 4.914 8.591 1.00 14.15 H new ATOM 0 HA2 GLY A 116 -0.751 3.807 7.029 1.00 15.10 H new ATOM 0 HA3 GLY A 116 -0.397 3.500 8.718 1.00 15.10 H new ATOM 1764 N GLU A 117 -1.473 6.392 8.703 1.00 15.88 N ATOM 1765 CA GLU A 117 -2.503 7.345 9.076 1.00 16.82 C ATOM 1766 C GLU A 117 -3.203 7.884 7.834 1.00 16.56 C ATOM 1767 O GLU A 117 -4.149 8.666 7.920 1.00 17.25 O ATOM 1768 CB GLU A 117 -1.886 8.481 9.886 1.00 17.04 C ATOM 1769 CG GLU A 117 -1.042 7.963 11.027 1.00 17.42 C ATOM 1770 CD GLU A 117 -0.682 9.025 12.042 1.00 17.95 C ATOM 1771 OE1 GLU A 117 -1.499 9.281 12.948 1.00 18.56 O ATOM 1772 OE2 GLU A 117 0.406 9.625 11.922 1.00 17.82 O1- ATOM 0 H GLU A 117 -0.529 6.779 8.706 1.00 15.88 H new ATOM 0 HA GLU A 117 -3.248 6.842 9.692 1.00 16.82 H new ATOM 0 HB2 GLU A 117 -1.273 9.102 9.233 1.00 17.04 H new ATOM 0 HB3 GLU A 117 -2.678 9.118 10.280 1.00 17.04 H new ATOM 0 HG2 GLU A 117 -1.579 7.159 11.530 1.00 17.42 H new ATOM 0 HG3 GLU A 117 -0.126 7.531 10.624 1.00 17.42 H new ATOM 1779 N GLY A 118 -2.718 7.450 6.678 1.00 15.62 N ATOM 1780 CA GLY A 118 -3.337 7.809 5.418 1.00 15.41 C ATOM 1781 C GLY A 118 -2.562 8.863 4.653 1.00 14.71 C ATOM 1782 O GLY A 118 -2.702 8.979 3.435 1.00 14.71 O ATOM 0 H GLY A 118 -1.898 6.849 6.591 1.00 15.62 H new ATOM 0 HA2 GLY A 118 -3.432 6.916 4.800 1.00 15.41 H new ATOM 0 HA3 GLY A 118 -4.346 8.175 5.607 1.00 15.41 H new ATOM 1786 N GLY A 119 -1.728 9.610 5.358 1.00 14.19 N ATOM 1787 CA GLY A 119 -1.049 10.728 4.755 1.00 13.68 C ATOM 1788 C GLY A 119 0.388 10.418 4.413 1.00 12.53 C ATOM 1789 O GLY A 119 0.888 9.328 4.697 1.00 12.20 O ATOM 0 H GLY A 119 -1.511 9.458 6.343 1.00 14.19 H new ATOM 0 HA2 GLY A 119 -1.578 11.025 3.849 1.00 13.68 H new ATOM 0 HA3 GLY A 119 -1.081 11.578 5.436 1.00 13.68 H new ATOM 1793 N PHE A 120 1.053 11.387 3.816 1.00 12.03 N ATOM 1794 CA PHE A 120 2.417 11.224 3.356 1.00 10.94 C ATOM 1795 C PHE A 120 3.264 12.383 3.855 1.00 11.32 C ATOM 1796 O PHE A 120 2.954 13.543 3.577 1.00 11.97 O ATOM 1797 CB PHE A 120 2.440 11.178 1.832 1.00 10.11 C ATOM 1798 CG PHE A 120 1.750 9.981 1.242 1.00 9.82 C ATOM 1799 CD1 PHE A 120 0.396 10.014 0.958 1.00 9.99 C ATOM 1800 CD2 PHE A 120 2.459 8.821 0.969 1.00 9.56 C ATOM 1801 CE1 PHE A 120 -0.240 8.914 0.417 1.00 9.89 C ATOM 1802 CE2 PHE A 120 1.829 7.719 0.427 1.00 9.49 C ATOM 1803 CZ PHE A 120 0.472 7.767 0.154 1.00 9.66 C ATOM 0 H PHE A 120 0.662 12.312 3.636 1.00 12.03 H new ATOM 0 HA PHE A 120 2.824 10.291 3.746 1.00 10.94 H new ATOM 0 HB2 PHE A 120 1.970 12.082 1.445 1.00 10.11 H new ATOM 0 HB3 PHE A 120 3.476 11.189 1.495 1.00 10.11 H new ATOM 0 HD1 PHE A 120 -0.170 10.911 1.162 1.00 9.99 H new ATOM 0 HD2 PHE A 120 3.517 8.779 1.183 1.00 9.56 H new ATOM 0 HE1 PHE A 120 -1.297 8.954 0.200 1.00 9.89 H new ATOM 0 HE2 PHE A 120 2.392 6.822 0.216 1.00 9.49 H new ATOM 0 HZ PHE A 120 -0.026 6.905 -0.265 1.00 9.66 H new ATOM 1813 N ASP A 121 4.323 12.086 4.590 1.00 11.05 N ATOM 1814 CA ASP A 121 5.143 13.141 5.165 1.00 11.56 C ATOM 1815 C ASP A 121 6.600 12.996 4.765 1.00 10.58 C ATOM 1816 O ASP A 121 7.091 11.887 4.574 1.00 9.55 O ATOM 1817 CB ASP A 121 5.010 13.183 6.690 1.00 12.35 C ATOM 1818 CG ASP A 121 3.858 14.050 7.153 1.00 13.39 C ATOM 1819 OD1 ASP A 121 3.953 15.286 7.025 1.00 13.91 O1- ATOM 1820 OD2 ASP A 121 2.840 13.499 7.628 1.00 13.79 O ATOM 0 H ASP A 121 4.633 11.137 4.801 1.00 11.05 H new ATOM 0 HA ASP A 121 4.775 14.085 4.764 1.00 11.56 H new ATOM 0 HB2 ASP A 121 4.871 12.170 7.066 1.00 12.35 H new ATOM 0 HB3 ASP A 121 5.938 13.558 7.121 1.00 12.35 H new ATOM 1825 N PRO A 122 7.311 14.118 4.628 1.00 10.99 N ATOM 1826 CA PRO A 122 8.716 14.118 4.254 1.00 10.31 C ATOM 1827 C PRO A 122 9.642 13.945 5.456 1.00 10.40 C ATOM 1828 O PRO A 122 9.447 14.553 6.512 1.00 11.44 O ATOM 1829 CB PRO A 122 8.885 15.498 3.628 1.00 11.13 C ATOM 1830 CG PRO A 122 7.914 16.373 4.347 1.00 12.35 C ATOM 1831 CD PRO A 122 6.790 15.486 4.815 1.00 12.29 C ATOM 0 HA PRO A 122 8.976 13.292 3.593 1.00 10.31 H new ATOM 0 HB2 PRO A 122 9.906 15.862 3.746 1.00 11.13 H new ATOM 0 HB3 PRO A 122 8.677 15.474 2.558 1.00 11.13 H new ATOM 0 HG2 PRO A 122 8.393 16.868 5.192 1.00 12.35 H new ATOM 0 HG3 PRO A 122 7.539 17.157 3.689 1.00 12.35 H new ATOM 0 HD2 PRO A 122 6.538 15.678 5.858 1.00 12.29 H new ATOM 0 HD3 PRO A 122 5.883 15.651 4.233 1.00 12.29 H new ATOM 1839 N VAL A 123 10.632 13.087 5.293 1.00 9.36 N ATOM 1840 CA VAL A 123 11.619 12.837 6.328 1.00 9.43 C ATOM 1841 C VAL A 123 13.017 13.150 5.800 1.00 9.05 C ATOM 1842 O VAL A 123 13.385 12.721 4.707 1.00 8.18 O ATOM 1843 CB VAL A 123 11.562 11.366 6.818 1.00 8.79 C ATOM 1844 CG1 VAL A 123 11.960 10.408 5.726 1.00 7.90 C ATOM 1845 CG2 VAL A 123 12.414 11.168 8.063 1.00 9.39 C ATOM 0 H VAL A 123 10.775 12.544 4.441 1.00 9.36 H new ATOM 0 HA VAL A 123 11.392 13.487 7.173 1.00 9.43 H new ATOM 0 HB VAL A 123 10.528 11.148 7.085 1.00 8.79 H new ATOM 0 HG11 VAL A 123 11.909 9.386 6.102 1.00 7.90 H new ATOM 0 HG12 VAL A 123 11.281 10.518 4.881 1.00 7.90 H new ATOM 0 HG13 VAL A 123 12.978 10.626 5.404 1.00 7.90 H new ATOM 0 HG21 VAL A 123 12.354 10.128 8.383 1.00 9.39 H new ATOM 0 HG22 VAL A 123 13.450 11.420 7.838 1.00 9.39 H new ATOM 0 HG23 VAL A 123 12.048 11.815 8.861 1.00 9.39 H new ATOM 1855 N GLU A 124 13.774 13.930 6.549 1.00 9.85 N ATOM 1856 CA GLU A 124 15.145 14.230 6.175 1.00 9.72 C ATOM 1857 C GLU A 124 16.036 13.018 6.438 1.00 8.90 C ATOM 1858 O GLU A 124 16.194 12.581 7.583 1.00 9.21 O ATOM 1859 CB GLU A 124 15.660 15.450 6.941 1.00 10.96 C ATOM 1860 CG GLU A 124 17.023 15.933 6.473 1.00 11.07 C ATOM 1861 CD GLU A 124 17.531 17.109 7.279 1.00 12.34 C ATOM 1862 OE1 GLU A 124 18.198 16.887 8.311 1.00 12.93 O1- ATOM 1863 OE2 GLU A 124 17.272 18.264 6.885 1.00 12.83 O ATOM 0 H GLU A 124 13.465 14.367 7.417 1.00 9.85 H new ATOM 0 HA GLU A 124 15.172 14.462 5.110 1.00 9.72 H new ATOM 0 HB2 GLU A 124 14.941 16.263 6.838 1.00 10.96 H new ATOM 0 HB3 GLU A 124 15.715 15.206 8.002 1.00 10.96 H new ATOM 0 HG2 GLU A 124 17.738 15.114 6.542 1.00 11.07 H new ATOM 0 HG3 GLU A 124 16.963 16.216 5.422 1.00 11.07 H new ATOM 1870 N VAL A 125 16.608 12.480 5.373 1.00 8.03 N ATOM 1871 CA VAL A 125 17.423 11.276 5.459 1.00 7.30 C ATOM 1872 C VAL A 125 18.771 11.485 4.788 1.00 7.38 C ATOM 1873 O VAL A 125 18.980 12.467 4.079 1.00 7.84 O ATOM 1874 CB VAL A 125 16.721 10.071 4.795 1.00 6.19 C ATOM 1875 CG1 VAL A 125 15.468 9.691 5.560 1.00 6.15 C ATOM 1876 CG2 VAL A 125 16.390 10.369 3.339 1.00 5.62 C ATOM 0 H VAL A 125 16.522 12.861 4.431 1.00 8.03 H new ATOM 0 HA VAL A 125 17.568 11.066 6.519 1.00 7.30 H new ATOM 0 HB VAL A 125 17.408 9.225 4.821 1.00 6.19 H new ATOM 0 HG11 VAL A 125 14.990 8.840 5.075 1.00 6.15 H new ATOM 0 HG12 VAL A 125 15.733 9.424 6.583 1.00 6.15 H new ATOM 0 HG13 VAL A 125 14.779 10.536 5.573 1.00 6.15 H new ATOM 0 HG21 VAL A 125 15.896 9.505 2.894 1.00 5.62 H new ATOM 0 HG22 VAL A 125 15.727 11.233 3.286 1.00 5.62 H new ATOM 0 HG23 VAL A 125 17.309 10.583 2.793 1.00 5.62 H new ATOM 1886 N LYS A 126 19.687 10.561 5.023 1.00 7.21 N ATOM 1887 CA LYS A 126 20.971 10.583 4.357 1.00 7.44 C ATOM 1888 C LYS A 126 21.013 9.491 3.303 1.00 6.77 C ATOM 1889 O LYS A 126 20.694 8.342 3.590 1.00 6.29 O ATOM 1890 CB LYS A 126 22.117 10.423 5.358 1.00 8.03 C ATOM 1891 CG LYS A 126 23.472 10.278 4.702 1.00 8.46 C ATOM 1892 CD LYS A 126 24.581 10.161 5.727 1.00 9.06 C ATOM 1893 CE LYS A 126 24.665 11.390 6.625 1.00 9.72 C ATOM 1894 NZ LYS A 126 25.722 11.250 7.659 1.00 10.39 N1+ ATOM 0 H LYS A 126 19.561 9.785 5.673 1.00 7.21 H new ATOM 0 HA LYS A 126 21.099 11.551 3.872 1.00 7.44 H new ATOM 0 HB2 LYS A 126 22.133 11.288 6.021 1.00 8.03 H new ATOM 0 HB3 LYS A 126 21.927 9.548 5.980 1.00 8.03 H new ATOM 0 HG2 LYS A 126 23.474 9.396 4.062 1.00 8.46 H new ATOM 0 HG3 LYS A 126 23.659 11.139 4.060 1.00 8.46 H new ATOM 0 HD2 LYS A 126 24.415 9.275 6.340 1.00 9.06 H new ATOM 0 HD3 LYS A 126 25.533 10.021 5.216 1.00 9.06 H new ATOM 0 HE2 LYS A 126 24.867 12.271 6.016 1.00 9.72 H new ATOM 0 HE3 LYS A 126 23.702 11.552 7.110 1.00 9.72 H new ATOM 0 HZ1 LYS A 126 26.079 12.191 7.921 1.00 10.39 H new ATOM 0 HZ2 LYS A 126 25.325 10.784 8.500 1.00 10.39 H new ATOM 0 HZ3 LYS A 126 26.503 10.677 7.281 1.00 10.39 H new ATOM 1908 N ALA A 127 21.402 9.844 2.093 1.00 7.04 N ATOM 1909 CA ALA A 127 21.344 8.908 0.983 1.00 6.78 C ATOM 1910 C ALA A 127 22.519 9.056 0.032 1.00 7.69 C ATOM 1911 O ALA A 127 22.560 10.000 -0.755 1.00 8.30 O ATOM 1912 CB ALA A 127 20.053 9.110 0.218 1.00 6.34 C ATOM 0 H ALA A 127 21.761 10.768 1.852 1.00 7.04 H new ATOM 0 HA ALA A 127 21.389 7.904 1.405 1.00 6.78 H new ATOM 0 HB1 ALA A 127 20.010 8.408 -0.615 1.00 6.34 H new ATOM 0 HB2 ALA A 127 19.206 8.938 0.882 1.00 6.34 H new ATOM 0 HB3 ALA A 127 20.013 10.130 -0.165 1.00 6.34 H new ATOM 1918 N GLY A 128 23.482 8.155 0.085 1.00 8.00 N ATOM 1919 CA GLY A 128 24.450 8.143 -0.984 1.00 8.94 C ATOM 1920 C GLY A 128 25.102 6.799 -1.225 1.00 9.46 C ATOM 1921 O GLY A 128 26.283 6.607 -0.930 1.00 10.10 O ATOM 0 H GLY A 128 23.610 7.457 0.818 1.00 8.00 H new ATOM 0 HA2 GLY A 128 23.961 8.466 -1.903 1.00 8.94 H new ATOM 0 HA3 GLY A 128 25.227 8.875 -0.762 1.00 8.94 H new ATOM 1925 N ALA A 129 24.334 5.868 -1.759 1.00 9.37 N ATOM 1926 CA ALA A 129 24.855 4.766 -2.539 1.00 10.27 C ATOM 1927 C ALA A 129 23.825 4.372 -3.581 1.00 10.12 C ATOM 1928 O ALA A 129 22.656 4.728 -3.445 1.00 9.18 O ATOM 1929 CB ALA A 129 25.231 3.589 -1.674 1.00 10.61 C ATOM 0 H ALA A 129 23.319 5.857 -1.661 1.00 9.37 H new ATOM 0 HA ALA A 129 25.771 5.089 -3.033 1.00 10.27 H new ATOM 0 HB1 ALA A 129 25.617 2.785 -2.301 1.00 10.61 H new ATOM 0 HB2 ALA A 129 25.997 3.892 -0.960 1.00 10.61 H new ATOM 0 HB3 ALA A 129 24.351 3.238 -1.135 1.00 10.61 H new ATOM 1935 N THR A 130 24.228 3.641 -4.599 1.00 11.12 N ATOM 1936 CA THR A 130 23.267 3.071 -5.526 1.00 11.19 C ATOM 1937 C THR A 130 23.663 1.644 -5.867 1.00 12.15 C ATOM 1938 O THR A 130 24.775 1.388 -6.325 1.00 13.17 O ATOM 1939 CB THR A 130 23.162 3.886 -6.821 1.00 11.72 C ATOM 1940 OG1 THR A 130 23.040 5.282 -6.520 1.00 11.18 O ATOM 1941 CG2 THR A 130 21.970 3.440 -7.652 1.00 11.68 C ATOM 0 H THR A 130 25.204 3.428 -4.806 1.00 11.12 H new ATOM 0 HA THR A 130 22.294 3.088 -5.036 1.00 11.19 H new ATOM 0 HB THR A 130 24.071 3.717 -7.397 1.00 11.72 H new ATOM 0 HG1 THR A 130 22.975 5.792 -7.354 1.00 11.18 H new ATOM 0 HG21 THR A 130 21.920 4.034 -8.564 1.00 11.68 H new ATOM 0 HG22 THR A 130 22.080 2.387 -7.911 1.00 11.68 H new ATOM 0 HG23 THR A 130 21.054 3.578 -7.078 1.00 11.68 H new ATOM 1949 N ALA A 131 22.750 0.721 -5.644 1.00 11.92 N ATOM 1950 CA ALA A 131 23.037 -0.684 -5.842 1.00 12.91 C ATOM 1951 C ALA A 131 21.834 -1.427 -6.409 1.00 12.98 C ATOM 1952 O ALA A 131 20.815 -1.585 -5.732 1.00 12.19 O ATOM 1953 CB ALA A 131 23.489 -1.315 -4.533 1.00 12.87 C ATOM 0 H ALA A 131 21.802 0.919 -5.325 1.00 11.92 H new ATOM 0 HA ALA A 131 23.843 -0.764 -6.571 1.00 12.91 H new ATOM 0 HB1 ALA A 131 23.702 -2.372 -4.693 1.00 12.87 H new ATOM 0 HB2 ALA A 131 24.389 -0.813 -4.179 1.00 12.87 H new ATOM 0 HB3 ALA A 131 22.700 -1.213 -3.788 1.00 12.87 H new ATOM 1959 N GLY A 132 21.955 -1.860 -7.658 1.00 14.01 N ATOM 1960 CA GLY A 132 20.906 -2.640 -8.288 1.00 14.34 C ATOM 1961 C GLY A 132 19.620 -1.858 -8.469 1.00 13.47 C ATOM 1962 O GLY A 132 18.533 -2.363 -8.188 1.00 13.23 O ATOM 0 H GLY A 132 22.767 -1.683 -8.250 1.00 14.01 H new ATOM 0 HA2 GLY A 132 21.253 -2.989 -9.260 1.00 14.34 H new ATOM 0 HA3 GLY A 132 20.706 -3.525 -7.684 1.00 14.34 H new ATOM 1966 N GLY A 133 19.745 -0.617 -8.926 1.00 13.12 N ATOM 1967 CA GLY A 133 18.576 0.214 -9.150 1.00 12.40 C ATOM 1968 C GLY A 133 17.997 0.756 -7.858 1.00 10.98 C ATOM 1969 O GLY A 133 16.918 1.352 -7.850 1.00 10.30 O ATOM 0 H GLY A 133 20.636 -0.171 -9.146 1.00 13.12 H new ATOM 0 HA2 GLY A 133 18.844 1.045 -9.802 1.00 12.40 H new ATOM 0 HA3 GLY A 133 17.815 -0.367 -9.671 1.00 12.40 H new ATOM 1973 N GLN A 134 18.712 0.555 -6.765 1.00 10.62 N ATOM 1974 CA GLN A 134 18.266 1.033 -5.470 1.00 9.33 C ATOM 1975 C GLN A 134 19.293 1.982 -4.897 1.00 8.96 C ATOM 1976 O GLN A 134 20.417 2.041 -5.382 1.00 9.81 O ATOM 1977 CB GLN A 134 18.026 -0.118 -4.488 1.00 9.38 C ATOM 1978 CG GLN A 134 16.814 -0.975 -4.807 1.00 9.89 C ATOM 1979 CD GLN A 134 16.599 -2.069 -3.780 1.00 10.08 C ATOM 1980 OE1 GLN A 134 17.551 -2.582 -3.188 1.00 10.39 O ATOM 1981 NE2 GLN A 134 15.349 -2.433 -3.551 1.00 10.17 N ATOM 0 H GLN A 134 19.605 0.063 -6.750 1.00 10.62 H new ATOM 0 HA GLN A 134 17.318 1.550 -5.616 1.00 9.33 H new ATOM 0 HB2 GLN A 134 18.911 -0.754 -4.470 1.00 9.38 H new ATOM 0 HB3 GLN A 134 17.910 0.294 -3.486 1.00 9.38 H new ATOM 0 HG2 GLN A 134 15.927 -0.343 -4.853 1.00 9.89 H new ATOM 0 HG3 GLN A 134 16.938 -1.424 -5.793 1.00 9.89 H new ATOM 0 HE21 GLN A 134 14.586 -1.986 -4.060 1.00 10.17 H new ATOM 0 HE22 GLN A 134 15.147 -3.161 -2.865 1.00 10.17 H new ATOM 1990 N SER A 135 18.924 2.702 -3.868 1.00 7.82 N ATOM 1991 CA SER A 135 19.851 3.580 -3.202 1.00 7.56 C ATOM 1992 C SER A 135 19.999 3.198 -1.740 1.00 7.12 C ATOM 1993 O SER A 135 19.110 2.572 -1.159 1.00 6.78 O ATOM 1994 CB SER A 135 19.433 5.044 -3.347 1.00 6.91 C ATOM 1995 OG SER A 135 19.765 5.547 -4.631 1.00 6.85 O ATOM 0 H SER A 135 17.984 2.697 -3.472 1.00 7.82 H new ATOM 0 HA SER A 135 20.823 3.466 -3.683 1.00 7.56 H new ATOM 0 HB2 SER A 135 18.359 5.136 -3.184 1.00 6.91 H new ATOM 0 HB3 SER A 135 19.925 5.643 -2.580 1.00 6.91 H new ATOM 0 HG SER A 135 20.735 5.496 -4.762 1.00 6.85 H new ATOM 2001 N GLU A 136 21.124 3.554 -1.157 1.00 7.39 N ATOM 2002 CA GLU A 136 21.347 3.307 0.263 1.00 7.25 C ATOM 2003 C GLU A 136 21.033 4.544 1.087 1.00 6.42 C ATOM 2004 O GLU A 136 21.720 5.565 1.004 1.00 6.54 O ATOM 2005 CB GLU A 136 22.787 2.879 0.527 1.00 8.31 C ATOM 2006 CG GLU A 136 23.128 1.510 -0.038 1.00 9.31 C ATOM 2007 CD GLU A 136 24.394 0.920 0.560 1.00 10.29 C ATOM 2008 OE1 GLU A 136 25.392 1.661 0.691 1.00 10.79 O1- ATOM 2009 OE2 GLU A 136 24.397 -0.276 0.922 1.00 10.69 O ATOM 0 H GLU A 136 21.898 4.013 -1.636 1.00 7.39 H new ATOM 0 HA GLU A 136 20.676 2.500 0.559 1.00 7.25 H new ATOM 0 HB2 GLU A 136 23.462 3.619 0.097 1.00 8.31 H new ATOM 0 HB3 GLU A 136 22.964 2.873 1.602 1.00 8.31 H new ATOM 0 HG2 GLU A 136 22.296 0.830 0.144 1.00 9.31 H new ATOM 0 HG3 GLU A 136 23.245 1.588 -1.119 1.00 9.31 H new ATOM 2016 N ILE A 137 19.963 4.450 1.856 1.00 5.86 N ATOM 2017 CA ILE A 137 19.656 5.443 2.863 1.00 5.49 C ATOM 2018 C ILE A 137 20.514 5.165 4.076 1.00 6.25 C ATOM 2019 O ILE A 137 20.242 4.249 4.852 1.00 6.73 O ATOM 2020 CB ILE A 137 18.161 5.430 3.262 1.00 4.93 C ATOM 2021 CG1 ILE A 137 17.290 5.826 2.074 1.00 4.16 C ATOM 2022 CG2 ILE A 137 17.904 6.357 4.444 1.00 5.24 C ATOM 2023 CD1 ILE A 137 17.608 7.197 1.531 1.00 4.21 C ATOM 0 H ILE A 137 19.288 3.687 1.799 1.00 5.86 H new ATOM 0 HA ILE A 137 19.866 6.431 2.453 1.00 5.49 H new ATOM 0 HB ILE A 137 17.899 4.416 3.564 1.00 4.93 H new ATOM 0 HG12 ILE A 137 17.415 5.090 1.280 1.00 4.16 H new ATOM 0 HG13 ILE A 137 16.243 5.796 2.374 1.00 4.16 H new ATOM 0 HG21 ILE A 137 16.846 6.330 4.705 1.00 5.24 H new ATOM 0 HG22 ILE A 137 18.497 6.030 5.298 1.00 5.24 H new ATOM 0 HG23 ILE A 137 18.185 7.375 4.176 1.00 5.24 H new ATOM 0 HD11 ILE A 137 16.952 7.416 0.688 1.00 4.21 H new ATOM 0 HD12 ILE A 137 17.456 7.942 2.312 1.00 4.21 H new ATOM 0 HD13 ILE A 137 18.646 7.225 1.200 1.00 4.21 H new ATOM 2035 N LEU A 138 21.573 5.940 4.200 1.00 6.60 N ATOM 2036 CA LEU A 138 22.561 5.729 5.241 1.00 7.40 C ATOM 2037 C LEU A 138 21.945 5.974 6.604 1.00 7.59 C ATOM 2038 O LEU A 138 22.074 5.163 7.518 1.00 8.21 O ATOM 2039 CB LEU A 138 23.769 6.657 5.052 1.00 7.87 C ATOM 2040 CG LEU A 138 24.679 6.392 3.843 1.00 8.31 C ATOM 2041 CD1 LEU A 138 24.276 5.134 3.089 1.00 7.93 C ATOM 2042 CD2 LEU A 138 24.673 7.603 2.926 1.00 8.79 C ATOM 0 H LEU A 138 21.773 6.730 3.586 1.00 6.60 H new ATOM 0 HA LEU A 138 22.902 4.696 5.175 1.00 7.40 H new ATOM 0 HB2 LEU A 138 23.400 7.680 4.979 1.00 7.87 H new ATOM 0 HB3 LEU A 138 24.380 6.602 5.953 1.00 7.87 H new ATOM 0 HG LEU A 138 25.691 6.224 4.210 1.00 8.31 H new ATOM 0 HD11 LEU A 138 24.947 4.986 2.243 1.00 7.93 H new ATOM 0 HD12 LEU A 138 24.339 4.274 3.756 1.00 7.93 H new ATOM 0 HD13 LEU A 138 23.253 5.239 2.727 1.00 7.93 H new ATOM 0 HD21 LEU A 138 25.319 7.413 2.069 1.00 8.79 H new ATOM 0 HD22 LEU A 138 23.657 7.792 2.580 1.00 8.79 H new ATOM 0 HD23 LEU A 138 25.039 8.474 3.471 1.00 8.79 H new ATOM 2054 N GLU A 139 21.273 7.104 6.726 1.00 7.31 N ATOM 2055 CA GLU A 139 20.687 7.506 7.989 1.00 7.84 C ATOM 2056 C GLU A 139 19.319 8.126 7.778 1.00 7.45 C ATOM 2057 O GLU A 139 18.977 8.529 6.667 1.00 6.77 O ATOM 2058 CB GLU A 139 21.607 8.492 8.709 1.00 8.66 C ATOM 2059 CG GLU A 139 22.820 7.839 9.354 1.00 9.21 C ATOM 2060 CD GLU A 139 23.761 8.842 9.984 1.00 9.98 C ATOM 2061 OE1 GLU A 139 24.631 9.377 9.268 1.00 10.28 O1- ATOM 2062 OE2 GLU A 139 23.638 9.101 11.199 1.00 10.44 O ATOM 0 H GLU A 139 21.120 7.761 5.961 1.00 7.31 H new ATOM 0 HA GLU A 139 20.568 6.616 8.607 1.00 7.84 H new ATOM 0 HB2 GLU A 139 21.946 9.244 7.997 1.00 8.66 H new ATOM 0 HB3 GLU A 139 21.036 9.014 9.477 1.00 8.66 H new ATOM 0 HG2 GLU A 139 22.486 7.134 10.115 1.00 9.21 H new ATOM 0 HG3 GLU A 139 23.360 7.264 8.602 1.00 9.21 H new ATOM 2069 N GLY A 140 18.539 8.203 8.846 1.00 8.06 N ATOM 2070 CA GLY A 140 17.262 8.874 8.777 1.00 8.05 C ATOM 2071 C GLY A 140 16.086 7.951 9.022 1.00 8.05 C ATOM 2072 O GLY A 140 15.320 8.154 9.966 1.00 8.87 O ATOM 0 H GLY A 140 18.770 7.812 9.759 1.00 8.06 H new ATOM 0 HA2 GLY A 140 17.242 9.679 9.512 1.00 8.05 H new ATOM 0 HA3 GLY A 140 17.154 9.335 7.795 1.00 8.05 H new ATOM 2076 N LEU A 141 15.943 6.926 8.189 1.00 7.34 N ATOM 2077 CA LEU A 141 14.774 6.051 8.254 1.00 7.46 C ATOM 2078 C LEU A 141 15.080 4.713 8.919 1.00 8.16 C ATOM 2079 O LEU A 141 16.183 4.491 9.418 1.00 8.50 O ATOM 2080 CB LEU A 141 14.187 5.818 6.861 1.00 6.40 C ATOM 2081 CG LEU A 141 13.282 6.933 6.336 1.00 6.03 C ATOM 2082 CD1 LEU A 141 12.854 6.635 4.910 1.00 5.58 C ATOM 2083 CD2 LEU A 141 12.062 7.097 7.235 1.00 6.58 C ATOM 0 H LEU A 141 16.617 6.680 7.464 1.00 7.34 H new ATOM 0 HA LEU A 141 14.039 6.565 8.873 1.00 7.46 H new ATOM 0 HB2 LEU A 141 15.008 5.678 6.158 1.00 6.40 H new ATOM 0 HB3 LEU A 141 13.618 4.888 6.876 1.00 6.40 H new ATOM 0 HG LEU A 141 13.842 7.868 6.343 1.00 6.03 H new ATOM 0 HD11 LEU A 141 12.210 7.437 4.548 1.00 5.58 H new ATOM 0 HD12 LEU A 141 13.736 6.562 4.273 1.00 5.58 H new ATOM 0 HD13 LEU A 141 12.309 5.692 4.883 1.00 5.58 H new ATOM 0 HD21 LEU A 141 11.429 7.895 6.847 1.00 6.58 H new ATOM 0 HD22 LEU A 141 11.498 6.164 7.257 1.00 6.58 H new ATOM 0 HD23 LEU A 141 12.385 7.349 8.245 1.00 6.58 H new ATOM 2095 N LYS A 142 14.089 3.831 8.908 1.00 8.54 N ATOM 2096 CA LYS A 142 14.185 2.531 9.553 1.00 9.51 C ATOM 2097 C LYS A 142 13.334 1.523 8.798 1.00 9.48 C ATOM 2098 O LYS A 142 12.410 1.890 8.074 1.00 8.97 O ATOM 2099 CB LYS A 142 13.672 2.649 10.990 1.00 10.71 C ATOM 2100 CG LYS A 142 13.777 1.363 11.796 1.00 11.83 C ATOM 2101 CD LYS A 142 13.169 1.514 13.181 1.00 12.89 C ATOM 2102 CE LYS A 142 13.926 2.529 14.024 1.00 13.50 C ATOM 2103 NZ LYS A 142 13.344 2.660 15.385 1.00 14.15 N1+ ATOM 0 H LYS A 142 13.194 3.999 8.449 1.00 8.54 H new ATOM 0 HA LYS A 142 15.223 2.199 9.554 1.00 9.51 H new ATOM 0 HB2 LYS A 142 14.232 3.432 11.501 1.00 10.71 H new ATOM 0 HB3 LYS A 142 12.629 2.966 10.967 1.00 10.71 H new ATOM 0 HG2 LYS A 142 13.272 0.558 11.263 1.00 11.83 H new ATOM 0 HG3 LYS A 142 14.825 1.076 11.888 1.00 11.83 H new ATOM 0 HD2 LYS A 142 12.128 1.823 13.089 1.00 12.89 H new ATOM 0 HD3 LYS A 142 13.172 0.548 13.686 1.00 12.89 H new ATOM 0 HE2 LYS A 142 14.971 2.229 14.103 1.00 13.50 H new ATOM 0 HE3 LYS A 142 13.910 3.499 13.527 1.00 13.50 H new ATOM 0 HZ1 LYS A 142 13.887 3.361 15.929 1.00 14.15 H new ATOM 0 HZ2 LYS A 142 12.354 2.971 15.311 1.00 14.15 H new ATOM 0 HZ3 LYS A 142 13.383 1.740 15.869 1.00 14.15 H new ATOM 2117 N ALA A 143 13.668 0.252 8.965 1.00 10.19 N ATOM 2118 CA ALA A 143 12.928 -0.826 8.334 1.00 10.49 C ATOM 2119 C ALA A 143 11.557 -0.952 8.962 1.00 11.20 C ATOM 2120 O ALA A 143 11.431 -1.110 10.177 1.00 12.12 O ATOM 2121 CB ALA A 143 13.676 -2.135 8.444 1.00 11.37 C ATOM 0 H ALA A 143 14.453 -0.058 9.537 1.00 10.19 H new ATOM 0 HA ALA A 143 12.815 -0.589 7.276 1.00 10.49 H new ATOM 0 HB1 ALA A 143 13.099 -2.925 7.963 1.00 11.37 H new ATOM 0 HB2 ALA A 143 14.645 -2.043 7.953 1.00 11.37 H new ATOM 0 HB3 ALA A 143 13.824 -2.382 9.495 1.00 11.37 H new ATOM 2127 N GLY A 144 10.542 -0.911 8.125 1.00 10.88 N ATOM 2128 CA GLY A 144 9.182 -0.806 8.607 1.00 11.54 C ATOM 2129 C GLY A 144 8.569 0.507 8.179 1.00 10.82 C ATOM 2130 O GLY A 144 7.368 0.727 8.316 1.00 11.32 O ATOM 0 H GLY A 144 10.633 -0.949 7.110 1.00 10.88 H new ATOM 0 HA2 GLY A 144 8.588 -1.634 8.221 1.00 11.54 H new ATOM 0 HA3 GLY A 144 9.168 -0.883 9.694 1.00 11.54 H new ATOM 2134 N GLN A 145 9.419 1.381 7.658 1.00 9.74 N ATOM 2135 CA GLN A 145 8.983 2.658 7.118 1.00 9.10 C ATOM 2136 C GLN A 145 8.925 2.545 5.603 1.00 8.05 C ATOM 2137 O GLN A 145 9.922 2.232 4.969 1.00 7.35 O ATOM 2138 CB GLN A 145 9.972 3.766 7.504 1.00 8.76 C ATOM 2139 CG GLN A 145 10.178 3.935 9.004 1.00 9.88 C ATOM 2140 CD GLN A 145 8.898 4.266 9.743 1.00 10.75 C ATOM 2141 OE1 GLN A 145 8.184 3.375 10.203 1.00 11.13 O ATOM 2142 NE2 GLN A 145 8.604 5.550 9.871 1.00 11.24 N ATOM 0 H GLN A 145 10.425 1.225 7.599 1.00 9.74 H new ATOM 0 HA GLN A 145 8.002 2.908 7.522 1.00 9.10 H new ATOM 0 HB2 GLN A 145 10.935 3.554 7.040 1.00 8.76 H new ATOM 0 HB3 GLN A 145 9.619 4.711 7.090 1.00 8.76 H new ATOM 0 HG2 GLN A 145 10.600 3.017 9.413 1.00 9.88 H new ATOM 0 HG3 GLN A 145 10.907 4.727 9.178 1.00 9.88 H new ATOM 0 HE21 GLN A 145 9.223 6.257 9.475 1.00 11.24 H new ATOM 0 HE22 GLN A 145 7.758 5.833 10.366 1.00 11.24 H new ATOM 2151 N GLN A 146 7.762 2.752 5.024 1.00 8.12 N ATOM 2152 CA GLN A 146 7.625 2.639 3.581 1.00 7.34 C ATOM 2153 C GLN A 146 7.489 4.006 2.958 1.00 6.41 C ATOM 2154 O GLN A 146 6.751 4.865 3.435 1.00 6.79 O ATOM 2155 CB GLN A 146 6.426 1.782 3.205 1.00 8.14 C ATOM 2156 CG GLN A 146 5.153 2.325 3.759 1.00 9.01 C ATOM 2157 CD GLN A 146 3.931 1.573 3.282 1.00 9.89 C ATOM 2158 OE1 GLN A 146 3.348 1.906 2.249 1.00 10.17 O ATOM 2159 NE2 GLN A 146 3.536 0.550 4.020 1.00 10.49 N ATOM 0 H GLN A 146 6.905 2.997 5.520 1.00 8.12 H new ATOM 0 HA GLN A 146 8.525 2.156 3.200 1.00 7.34 H new ATOM 0 HB2 GLN A 146 6.351 1.720 2.119 1.00 8.14 H new ATOM 0 HB3 GLN A 146 6.577 0.767 3.572 1.00 8.14 H new ATOM 0 HG2 GLN A 146 5.193 2.289 4.848 1.00 9.01 H new ATOM 0 HG3 GLN A 146 5.060 3.374 3.478 1.00 9.01 H new ATOM 0 HE21 GLN A 146 4.046 0.306 4.869 1.00 10.49 H new ATOM 0 HE22 GLN A 146 2.721 0.004 3.741 1.00 10.49 H new ATOM 2168 N VAL A 147 8.220 4.186 1.888 1.00 5.45 N ATOM 2169 CA VAL A 147 8.282 5.452 1.188 1.00 4.76 C ATOM 2170 C VAL A 147 7.750 5.281 -0.219 1.00 4.67 C ATOM 2171 O VAL A 147 7.909 4.217 -0.817 1.00 4.76 O ATOM 2172 CB VAL A 147 9.724 5.999 1.132 1.00 3.89 C ATOM 2173 CG1 VAL A 147 10.190 6.397 2.523 1.00 4.21 C ATOM 2174 CG2 VAL A 147 10.680 4.969 0.528 1.00 3.49 C ATOM 0 H VAL A 147 8.795 3.454 1.471 1.00 5.45 H new ATOM 0 HA VAL A 147 7.670 6.169 1.735 1.00 4.76 H new ATOM 0 HB VAL A 147 9.727 6.881 0.491 1.00 3.89 H new ATOM 0 HG11 VAL A 147 11.209 6.781 2.469 1.00 4.21 H new ATOM 0 HG12 VAL A 147 9.531 7.169 2.920 1.00 4.21 H new ATOM 0 HG13 VAL A 147 10.165 5.526 3.178 1.00 4.21 H new ATOM 0 HG21 VAL A 147 11.689 5.381 0.501 1.00 3.49 H new ATOM 0 HG22 VAL A 147 10.673 4.065 1.137 1.00 3.49 H new ATOM 0 HG23 VAL A 147 10.360 4.726 -0.485 1.00 3.49 H new ATOM 2184 N VAL A 148 7.100 6.312 -0.733 1.00 4.95 N ATOM 2185 CA VAL A 148 6.542 6.253 -2.069 1.00 5.28 C ATOM 2186 C VAL A 148 7.657 6.238 -3.105 1.00 4.93 C ATOM 2187 O VAL A 148 8.525 7.111 -3.124 1.00 4.74 O ATOM 2188 CB VAL A 148 5.559 7.414 -2.343 1.00 6.08 C ATOM 2189 CG1 VAL A 148 6.214 8.764 -2.105 1.00 6.56 C ATOM 2190 CG2 VAL A 148 5.012 7.325 -3.758 1.00 6.56 C ATOM 0 H VAL A 148 6.947 7.195 -0.246 1.00 4.95 H new ATOM 0 HA VAL A 148 5.972 5.327 -2.145 1.00 5.28 H new ATOM 0 HB VAL A 148 4.729 7.321 -1.642 1.00 6.08 H new ATOM 0 HG11 VAL A 148 5.495 9.558 -2.307 1.00 6.56 H new ATOM 0 HG12 VAL A 148 6.546 8.830 -1.069 1.00 6.56 H new ATOM 0 HG13 VAL A 148 7.072 8.874 -2.768 1.00 6.56 H new ATOM 0 HG21 VAL A 148 4.322 8.150 -3.934 1.00 6.56 H new ATOM 0 HG22 VAL A 148 5.835 7.382 -4.470 1.00 6.56 H new ATOM 0 HG23 VAL A 148 4.487 6.379 -3.886 1.00 6.56 H new ATOM 2200 N VAL A 149 7.635 5.227 -3.952 1.00 5.25 N ATOM 2201 CA VAL A 149 8.701 5.013 -4.908 1.00 5.51 C ATOM 2202 C VAL A 149 8.247 5.405 -6.304 1.00 6.47 C ATOM 2203 O VAL A 149 9.005 5.310 -7.274 1.00 6.99 O ATOM 2204 CB VAL A 149 9.169 3.545 -4.858 1.00 5.65 C ATOM 2205 CG1 VAL A 149 9.364 3.136 -3.414 1.00 5.29 C ATOM 2206 CG2 VAL A 149 8.191 2.595 -5.531 1.00 6.22 C ATOM 0 H VAL A 149 6.885 4.537 -3.996 1.00 5.25 H new ATOM 0 HA VAL A 149 9.549 5.646 -4.646 1.00 5.51 H new ATOM 0 HB VAL A 149 10.108 3.479 -5.408 1.00 5.65 H new ATOM 0 HG11 VAL A 149 9.695 2.098 -3.371 1.00 5.29 H new ATOM 0 HG12 VAL A 149 10.116 3.776 -2.953 1.00 5.29 H new ATOM 0 HG13 VAL A 149 8.421 3.238 -2.876 1.00 5.29 H new ATOM 0 HG21 VAL A 149 8.571 1.575 -5.466 1.00 6.22 H new ATOM 0 HG22 VAL A 149 7.224 2.654 -5.032 1.00 6.22 H new ATOM 0 HG23 VAL A 149 8.076 2.873 -6.579 1.00 6.22 H new ATOM 2216 N SER A 150 6.994 5.856 -6.369 1.00 6.89 N ATOM 2217 CA SER A 150 6.378 6.379 -7.586 1.00 7.82 C ATOM 2218 C SER A 150 6.084 5.268 -8.593 1.00 8.09 C ATOM 2219 O SER A 150 4.930 5.083 -8.987 1.00 8.72 O ATOM 2220 CB SER A 150 7.254 7.464 -8.225 1.00 8.62 C ATOM 2221 OG SER A 150 6.536 8.193 -9.204 1.00 9.06 O ATOM 0 H SER A 150 6.369 5.868 -5.563 1.00 6.89 H new ATOM 0 HA SER A 150 5.427 6.828 -7.298 1.00 7.82 H new ATOM 0 HB2 SER A 150 7.615 8.144 -7.454 1.00 8.62 H new ATOM 0 HB3 SER A 150 8.131 7.005 -8.681 1.00 8.62 H new ATOM 0 HG SER A 150 6.572 9.149 -8.991 1.00 9.06 H new ATOM 2227 N GLY A 151 7.122 4.527 -8.978 1.00 7.84 N ATOM 2228 CA GLY A 151 6.993 3.500 -9.996 1.00 8.31 C ATOM 2229 C GLY A 151 6.017 2.402 -9.623 1.00 8.50 C ATOM 2230 O GLY A 151 5.602 2.289 -8.464 1.00 8.43 O ATOM 0 H GLY A 151 8.063 4.624 -8.595 1.00 7.84 H new ATOM 0 HA2 GLY A 151 6.670 3.962 -10.929 1.00 8.31 H new ATOM 0 HA3 GLY A 151 7.972 3.058 -10.182 1.00 8.31 H new ATOM 2234 N GLN A 152 5.659 1.581 -10.598 1.00 8.97 N ATOM 2235 CA GLN A 152 4.678 0.538 -10.375 1.00 9.41 C ATOM 2236 C GLN A 152 5.345 -0.764 -9.948 1.00 9.73 C ATOM 2237 O GLN A 152 5.728 -1.589 -10.779 1.00 9.97 O ATOM 2238 CB GLN A 152 3.820 0.308 -11.623 1.00 10.01 C ATOM 2239 CG GLN A 152 2.771 -0.778 -11.437 1.00 10.63 C ATOM 2240 CD GLN A 152 1.965 -1.045 -12.690 1.00 11.38 C ATOM 2241 OE1 GLN A 152 0.915 -0.446 -12.909 1.00 11.71 O ATOM 2242 NE2 GLN A 152 2.447 -1.954 -13.517 1.00 11.84 N ATOM 0 H GLN A 152 6.033 1.619 -11.546 1.00 8.97 H new ATOM 0 HA GLN A 152 4.027 0.872 -9.567 1.00 9.41 H new ATOM 0 HB2 GLN A 152 3.324 1.241 -11.892 1.00 10.01 H new ATOM 0 HB3 GLN A 152 4.468 0.039 -12.457 1.00 10.01 H new ATOM 0 HG2 GLN A 152 3.262 -1.700 -11.125 1.00 10.63 H new ATOM 0 HG3 GLN A 152 2.095 -0.488 -10.632 1.00 10.63 H new ATOM 0 HE21 GLN A 152 3.323 -2.429 -13.298 1.00 11.84 H new ATOM 0 HE22 GLN A 152 1.944 -2.181 -14.375 1.00 11.84 H new ATOM 2251 N PHE A 153 5.501 -0.934 -8.648 1.00 9.95 N ATOM 2252 CA PHE A 153 5.941 -2.205 -8.095 1.00 10.47 C ATOM 2253 C PHE A 153 4.724 -3.074 -7.813 1.00 10.93 C ATOM 2254 O PHE A 153 3.617 -2.554 -7.648 1.00 11.34 O ATOM 2255 CB PHE A 153 6.752 -1.984 -6.813 1.00 10.62 C ATOM 2256 CG PHE A 153 8.149 -1.479 -7.053 1.00 11.04 C ATOM 2257 CD1 PHE A 153 8.370 -0.255 -7.666 1.00 11.27 C ATOM 2258 CD2 PHE A 153 9.245 -2.236 -6.668 1.00 11.41 C ATOM 2259 CE1 PHE A 153 9.654 0.204 -7.887 1.00 11.87 C ATOM 2260 CE2 PHE A 153 10.531 -1.782 -6.886 1.00 12.02 C ATOM 2261 CZ PHE A 153 10.736 -0.562 -7.498 1.00 12.24 C ATOM 0 H PHE A 153 5.330 -0.207 -7.953 1.00 9.95 H new ATOM 0 HA PHE A 153 6.586 -2.708 -8.816 1.00 10.47 H new ATOM 0 HB2 PHE A 153 6.223 -1.272 -6.179 1.00 10.62 H new ATOM 0 HB3 PHE A 153 6.806 -2.923 -6.263 1.00 10.62 H new ATOM 0 HD1 PHE A 153 7.528 0.347 -7.974 1.00 11.27 H new ATOM 0 HD2 PHE A 153 9.091 -3.193 -6.192 1.00 11.41 H new ATOM 0 HE1 PHE A 153 9.812 1.160 -8.363 1.00 11.87 H new ATOM 0 HE2 PHE A 153 11.375 -2.381 -6.578 1.00 12.02 H new ATOM 0 HZ PHE A 153 11.741 -0.207 -7.673 1.00 12.24 H new ATOM 2271 N LEU A 154 4.906 -4.386 -7.775 1.00 11.05 N ATOM 2272 CA LEU A 154 3.789 -5.294 -7.531 1.00 11.63 C ATOM 2273 C LEU A 154 3.357 -5.265 -6.067 1.00 11.39 C ATOM 2274 O LEU A 154 3.776 -6.091 -5.256 1.00 11.57 O ATOM 2275 CB LEU A 154 4.068 -6.747 -7.997 1.00 12.16 C ATOM 2276 CG LEU A 154 5.532 -7.258 -8.001 1.00 12.68 C ATOM 2277 CD1 LEU A 154 6.305 -6.711 -9.191 1.00 13.16 C ATOM 2278 CD2 LEU A 154 6.258 -6.934 -6.700 1.00 13.04 C ATOM 0 H LEU A 154 5.807 -4.845 -7.908 1.00 11.05 H new ATOM 0 HA LEU A 154 2.965 -4.926 -8.143 1.00 11.63 H new ATOM 0 HB2 LEU A 154 3.486 -7.415 -7.362 1.00 12.16 H new ATOM 0 HB3 LEU A 154 3.679 -6.850 -9.010 1.00 12.16 H new ATOM 0 HG LEU A 154 5.483 -8.343 -8.089 1.00 12.68 H new ATOM 0 HD11 LEU A 154 7.328 -7.088 -9.165 1.00 13.16 H new ATOM 0 HD12 LEU A 154 5.824 -7.031 -10.115 1.00 13.16 H new ATOM 0 HD13 LEU A 154 6.318 -5.622 -9.147 1.00 13.16 H new ATOM 0 HD21 LEU A 154 7.279 -7.311 -6.750 1.00 13.04 H new ATOM 0 HD22 LEU A 154 6.277 -5.854 -6.553 1.00 13.04 H new ATOM 0 HD23 LEU A 154 5.738 -7.405 -5.866 1.00 13.04 H new ATOM 2290 N ILE A 155 2.503 -4.301 -5.743 1.00 11.17 N ATOM 2291 CA ILE A 155 1.990 -4.148 -4.393 1.00 11.08 C ATOM 2292 C ILE A 155 0.838 -3.127 -4.376 1.00 10.31 C ATOM 2293 O ILE A 155 0.785 -2.214 -3.551 1.00 9.93 O ATOM 2294 CB ILE A 155 3.132 -3.743 -3.419 1.00 11.39 C ATOM 2295 CG1 ILE A 155 2.648 -3.748 -1.968 1.00 11.61 C ATOM 2296 CG2 ILE A 155 3.722 -2.386 -3.788 1.00 11.66 C ATOM 2297 CD1 ILE A 155 2.132 -5.095 -1.509 1.00 11.95 C ATOM 0 H ILE A 155 2.151 -3.610 -6.405 1.00 11.17 H new ATOM 0 HA ILE A 155 1.593 -5.104 -4.052 1.00 11.08 H new ATOM 0 HB ILE A 155 3.922 -4.488 -3.514 1.00 11.39 H new ATOM 0 HG12 ILE A 155 3.468 -3.441 -1.319 1.00 11.61 H new ATOM 0 HG13 ILE A 155 1.857 -3.007 -1.854 1.00 11.61 H new ATOM 0 HG21 ILE A 155 4.518 -2.133 -3.087 1.00 11.66 H new ATOM 0 HG22 ILE A 155 4.128 -2.429 -4.799 1.00 11.66 H new ATOM 0 HG23 ILE A 155 2.942 -1.626 -3.742 1.00 11.66 H new ATOM 0 HD11 ILE A 155 1.806 -5.025 -0.471 1.00 11.95 H new ATOM 0 HD12 ILE A 155 1.291 -5.395 -2.134 1.00 11.95 H new ATOM 0 HD13 ILE A 155 2.927 -5.836 -1.590 1.00 11.95 H new ATOM 2309 N ASP A 156 -0.105 -3.305 -5.294 1.00 10.31 N ATOM 2310 CA ASP A 156 -1.225 -2.373 -5.440 1.00 9.81 C ATOM 2311 C ASP A 156 -2.137 -2.406 -4.213 1.00 9.63 C ATOM 2312 O ASP A 156 -2.785 -1.422 -3.863 1.00 9.09 O ATOM 2313 CB ASP A 156 -2.030 -2.701 -6.704 1.00 10.26 C ATOM 2314 CG ASP A 156 -2.680 -4.068 -6.657 1.00 10.68 C ATOM 2315 OD1 ASP A 156 -1.987 -5.066 -6.937 1.00 11.22 O ATOM 2316 OD2 ASP A 156 -3.885 -4.148 -6.343 1.00 10.64 O1- ATOM 0 H ASP A 156 -0.119 -4.086 -5.950 1.00 10.31 H new ATOM 0 HA ASP A 156 -0.814 -1.367 -5.530 1.00 9.81 H new ATOM 0 HB2 ASP A 156 -2.801 -1.943 -6.843 1.00 10.26 H new ATOM 0 HB3 ASP A 156 -1.371 -2.648 -7.571 1.00 10.26 H new ATOM 2321 N SER A 157 -2.145 -3.573 -3.565 1.00 10.26 N ATOM 2322 CA SER A 157 -3.071 -3.903 -2.484 1.00 10.38 C ATOM 2323 C SER A 157 -3.022 -2.907 -1.332 1.00 9.63 C ATOM 2324 O SER A 157 -4.037 -2.634 -0.694 1.00 9.37 O ATOM 2325 CB SER A 157 -2.741 -5.300 -1.970 1.00 11.42 C ATOM 2326 OG SER A 157 -2.673 -6.222 -3.044 1.00 11.90 O ATOM 0 H SER A 157 -1.495 -4.328 -3.783 1.00 10.26 H new ATOM 0 HA SER A 157 -4.082 -3.861 -2.889 1.00 10.38 H new ATOM 0 HB2 SER A 157 -1.790 -5.283 -1.438 1.00 11.42 H new ATOM 0 HB3 SER A 157 -3.500 -5.620 -1.256 1.00 11.42 H new ATOM 0 HG SER A 157 -2.459 -7.113 -2.697 1.00 11.90 H new ATOM 2332 N GLU A 158 -1.827 -2.381 -1.070 1.00 9.47 N ATOM 2333 CA GLU A 158 -1.609 -1.474 0.052 1.00 9.00 C ATOM 2334 C GLU A 158 -2.270 -0.133 -0.207 1.00 8.03 C ATOM 2335 O GLU A 158 -2.614 0.598 0.718 1.00 7.69 O ATOM 2336 CB GLU A 158 -0.113 -1.279 0.294 1.00 9.38 C ATOM 2337 CG GLU A 158 0.631 -2.570 0.590 1.00 10.19 C ATOM 2338 CD GLU A 158 -0.009 -3.384 1.695 1.00 10.79 C ATOM 2339 OE1 GLU A 158 -0.325 -2.815 2.760 1.00 11.17 O1- ATOM 2340 OE2 GLU A 158 -0.198 -4.604 1.502 1.00 11.06 O ATOM 0 H GLU A 158 -0.991 -2.570 -1.624 1.00 9.47 H new ATOM 0 HA GLU A 158 -2.057 -1.918 0.941 1.00 9.00 H new ATOM 0 HB2 GLU A 158 0.330 -0.808 -0.584 1.00 9.38 H new ATOM 0 HB3 GLU A 158 0.024 -0.591 1.128 1.00 9.38 H new ATOM 0 HG2 GLU A 158 0.677 -3.172 -0.317 1.00 10.19 H new ATOM 0 HG3 GLU A 158 1.658 -2.335 0.868 1.00 10.19 H new ATOM 2347 N ALA A 159 -2.431 0.185 -1.488 1.00 7.82 N ATOM 2348 CA ALA A 159 -3.058 1.427 -1.906 1.00 7.20 C ATOM 2349 C ALA A 159 -4.571 1.283 -1.874 1.00 7.12 C ATOM 2350 O ALA A 159 -5.302 2.273 -1.867 1.00 6.81 O ATOM 2351 CB ALA A 159 -2.588 1.816 -3.299 1.00 7.44 C ATOM 0 H ALA A 159 -2.131 -0.410 -2.260 1.00 7.82 H new ATOM 0 HA ALA A 159 -2.768 2.218 -1.214 1.00 7.20 H new ATOM 0 HB1 ALA A 159 -3.067 2.749 -3.597 1.00 7.44 H new ATOM 0 HB2 ALA A 159 -1.506 1.949 -3.294 1.00 7.44 H new ATOM 0 HB3 ALA A 159 -2.854 1.030 -4.005 1.00 7.44 H new ATOM 2357 N SER A 160 -5.026 0.037 -1.880 1.00 7.72 N ATOM 2358 CA SER A 160 -6.437 -0.271 -1.736 1.00 8.04 C ATOM 2359 C SER A 160 -6.829 -0.245 -0.264 1.00 7.99 C ATOM 2360 O SER A 160 -7.851 0.331 0.111 1.00 8.08 O ATOM 2361 CB SER A 160 -6.731 -1.642 -2.341 1.00 8.99 C ATOM 2362 OG SER A 160 -6.336 -1.686 -3.698 1.00 9.64 O ATOM 0 H SER A 160 -4.428 -0.783 -1.984 1.00 7.72 H new ATOM 0 HA SER A 160 -7.024 0.480 -2.265 1.00 8.04 H new ATOM 0 HB2 SER A 160 -6.204 -2.413 -1.779 1.00 8.99 H new ATOM 0 HB3 SER A 160 -7.796 -1.860 -2.260 1.00 8.99 H new ATOM 0 HG SER A 160 -6.531 -2.573 -4.067 1.00 9.64 H new ATOM 2368 N LEU A 161 -5.991 -0.864 0.564 1.00 8.10 N ATOM 2369 CA LEU A 161 -6.233 -0.937 1.995 1.00 8.40 C ATOM 2370 C LEU A 161 -6.128 0.438 2.638 1.00 7.89 C ATOM 2371 O LEU A 161 -6.832 0.735 3.601 1.00 8.18 O ATOM 2372 CB LEU A 161 -5.250 -1.905 2.652 1.00 9.04 C ATOM 2373 CG LEU A 161 -5.366 -3.362 2.196 1.00 9.80 C ATOM 2374 CD1 LEU A 161 -4.253 -4.201 2.803 1.00 10.57 C ATOM 2375 CD2 LEU A 161 -6.724 -3.931 2.574 1.00 10.37 C ATOM 0 H LEU A 161 -5.133 -1.324 0.261 1.00 8.10 H new ATOM 0 HA LEU A 161 -7.247 -1.307 2.148 1.00 8.40 H new ATOM 0 HB2 LEU A 161 -4.236 -1.558 2.453 1.00 9.04 H new ATOM 0 HB3 LEU A 161 -5.394 -1.867 3.732 1.00 9.04 H new ATOM 0 HG LEU A 161 -5.268 -3.391 1.111 1.00 9.80 H new ATOM 0 HD11 LEU A 161 -4.352 -5.233 2.468 1.00 10.57 H new ATOM 0 HD12 LEU A 161 -3.287 -3.807 2.487 1.00 10.57 H new ATOM 0 HD13 LEU A 161 -4.321 -4.164 3.890 1.00 10.57 H new ATOM 0 HD21 LEU A 161 -6.789 -4.967 2.242 1.00 10.37 H new ATOM 0 HD22 LEU A 161 -6.848 -3.888 3.656 1.00 10.37 H new ATOM 0 HD23 LEU A 161 -7.510 -3.347 2.095 1.00 10.37 H new ATOM 2387 N ARG A 162 -5.244 1.274 2.117 1.00 7.38 N ATOM 2388 CA ARG A 162 -5.157 2.651 2.555 1.00 7.17 C ATOM 2389 C ARG A 162 -6.114 3.500 1.718 1.00 6.87 C ATOM 2390 O ARG A 162 -6.610 3.048 0.686 1.00 6.95 O ATOM 2391 CB ARG A 162 -3.717 3.147 2.403 1.00 7.15 C ATOM 2392 CG ARG A 162 -3.392 3.675 1.020 1.00 7.34 C ATOM 2393 CD ARG A 162 -1.901 3.919 0.848 1.00 7.40 C ATOM 2394 NE ARG A 162 -1.606 4.588 -0.417 1.00 7.84 N ATOM 2395 CZ ARG A 162 -0.547 4.324 -1.181 1.00 8.24 C ATOM 2396 NH1 ARG A 162 0.337 3.401 -0.814 1.00 8.25 N1+ ATOM 2397 NH2 ARG A 162 -0.378 4.989 -2.317 1.00 8.90 N ATOM 0 H ARG A 162 -4.577 1.019 1.389 1.00 7.38 H new ATOM 0 HA ARG A 162 -5.439 2.730 3.605 1.00 7.17 H new ATOM 0 HB2 ARG A 162 -3.535 3.935 3.134 1.00 7.15 H new ATOM 0 HB3 ARG A 162 -3.035 2.330 2.639 1.00 7.15 H new ATOM 0 HG2 ARG A 162 -3.733 2.963 0.269 1.00 7.34 H new ATOM 0 HG3 ARG A 162 -3.935 4.604 0.848 1.00 7.34 H new ATOM 0 HD2 ARG A 162 -1.534 4.526 1.675 1.00 7.40 H new ATOM 0 HD3 ARG A 162 -1.369 2.968 0.890 1.00 7.40 H new ATOM 0 HE ARG A 162 -2.255 5.306 -0.737 1.00 7.84 H new ATOM 0 HH11 ARG A 162 0.207 2.889 0.058 1.00 8.25 H new ATOM 0 HH12 ARG A 162 1.145 3.205 -1.405 1.00 8.25 H new ATOM 0 HH21 ARG A 162 -1.056 5.696 -2.600 1.00 8.90 H new ATOM 0 HH22 ARG A 162 0.430 4.793 -2.907 1.00 8.90 H new ATOM 2411 N GLY A 163 -6.378 4.720 2.166 1.00 6.89 N ATOM 2412 CA GLY A 163 -7.274 5.600 1.437 1.00 7.01 C ATOM 2413 C GLY A 163 -6.607 6.238 0.234 1.00 6.68 C ATOM 2414 O GLY A 163 -6.492 7.460 0.174 1.00 7.15 O ATOM 0 H GLY A 163 -5.989 5.117 3.021 1.00 6.89 H new ATOM 0 HA2 GLY A 163 -8.146 5.035 1.108 1.00 7.01 H new ATOM 0 HA3 GLY A 163 -7.635 6.381 2.106 1.00 7.01 H new ATOM 2418 N THR A 164 -6.176 5.391 -0.713 1.00 6.17 N ATOM 2419 CA THR A 164 -5.476 5.813 -1.933 1.00 6.16 C ATOM 2420 C THR A 164 -4.397 6.864 -1.655 1.00 6.65 C ATOM 2421 O THR A 164 -3.258 6.522 -1.326 1.00 7.09 O ATOM 2422 CB THR A 164 -6.454 6.331 -3.010 1.00 6.38 C ATOM 2423 OG1 THR A 164 -7.795 6.334 -2.505 1.00 6.86 O ATOM 2424 CG2 THR A 164 -6.380 5.465 -4.256 1.00 6.23 C ATOM 0 H THR A 164 -6.306 4.381 -0.651 1.00 6.17 H new ATOM 0 HA THR A 164 -4.983 4.920 -2.316 1.00 6.16 H new ATOM 0 HB THR A 164 -6.168 7.350 -3.269 1.00 6.38 H new ATOM 0 HG1 THR A 164 -8.387 5.887 -3.146 1.00 6.86 H new ATOM 0 HG21 THR A 164 -7.076 5.844 -5.005 1.00 6.23 H new ATOM 0 HG22 THR A 164 -5.367 5.490 -4.657 1.00 6.23 H new ATOM 0 HG23 THR A 164 -6.645 4.439 -4.002 1.00 6.23 H new ATOM 2432 N VAL A 165 -4.763 8.131 -1.782 1.00 6.89 N ATOM 2433 CA VAL A 165 -3.871 9.234 -1.462 1.00 7.69 C ATOM 2434 C VAL A 165 -4.635 10.225 -0.597 1.00 7.93 C ATOM 2435 O VAL A 165 -5.189 11.208 -1.094 1.00 8.39 O ATOM 2436 CB VAL A 165 -3.334 9.944 -2.729 1.00 8.39 C ATOM 2437 CG1 VAL A 165 -2.343 11.040 -2.357 1.00 9.20 C ATOM 2438 CG2 VAL A 165 -2.688 8.947 -3.679 1.00 8.56 C ATOM 0 H VAL A 165 -5.684 8.422 -2.109 1.00 6.89 H new ATOM 0 HA VAL A 165 -3.004 8.838 -0.933 1.00 7.69 H new ATOM 0 HB VAL A 165 -4.181 10.403 -3.238 1.00 8.39 H new ATOM 0 HG11 VAL A 165 -1.979 11.525 -3.263 1.00 9.20 H new ATOM 0 HG12 VAL A 165 -2.837 11.778 -1.724 1.00 9.20 H new ATOM 0 HG13 VAL A 165 -1.503 10.603 -1.817 1.00 9.20 H new ATOM 0 HG21 VAL A 165 -2.319 9.471 -4.561 1.00 8.56 H new ATOM 0 HG22 VAL A 165 -1.857 8.452 -3.177 1.00 8.56 H new ATOM 0 HG23 VAL A 165 -3.425 8.203 -3.981 1.00 8.56 H new ATOM 2448 N ALA A 166 -4.688 9.934 0.693 1.00 7.88 N ATOM 2449 CA ALA A 166 -5.503 10.701 1.616 1.00 8.33 C ATOM 2450 C ALA A 166 -4.976 12.119 1.782 1.00 8.94 C ATOM 2451 O ALA A 166 -3.961 12.351 2.441 1.00 9.11 O ATOM 2452 CB ALA A 166 -5.589 10.000 2.963 1.00 8.31 C ATOM 0 H ALA A 166 -4.172 9.167 1.125 1.00 7.88 H new ATOM 0 HA ALA A 166 -6.506 10.769 1.194 1.00 8.33 H new ATOM 0 HB1 ALA A 166 -6.204 10.590 3.642 1.00 8.31 H new ATOM 0 HB2 ALA A 166 -6.036 9.014 2.832 1.00 8.31 H new ATOM 0 HB3 ALA A 166 -4.588 9.892 3.381 1.00 8.31 H new ATOM 2458 N ARG A 167 -5.667 13.055 1.149 1.00 9.50 N ATOM 2459 CA ARG A 167 -5.389 14.471 1.310 1.00 10.31 C ATOM 2460 C ARG A 167 -5.826 14.919 2.705 1.00 10.80 C ATOM 2461 O ARG A 167 -6.961 15.336 2.912 1.00 11.13 O ATOM 2462 CB ARG A 167 -6.076 15.261 0.166 1.00 10.89 C ATOM 2463 CG ARG A 167 -6.637 16.640 0.519 1.00 11.67 C ATOM 2464 CD ARG A 167 -5.638 17.520 1.243 1.00 12.28 C ATOM 2465 NE ARG A 167 -6.138 18.882 1.409 1.00 13.07 N ATOM 2466 CZ ARG A 167 -5.461 19.973 1.064 1.00 13.78 C ATOM 2467 NH1 ARG A 167 -4.248 19.872 0.536 1.00 13.81 N1+ ATOM 2468 NH2 ARG A 167 -5.999 21.171 1.252 1.00 14.58 N ATOM 0 H ARG A 167 -6.436 12.853 0.510 1.00 9.50 H new ATOM 0 HA ARG A 167 -4.320 14.672 1.236 1.00 10.31 H new ATOM 0 HB2 ARG A 167 -5.355 15.384 -0.642 1.00 10.89 H new ATOM 0 HB3 ARG A 167 -6.892 14.652 -0.225 1.00 10.89 H new ATOM 0 HG2 ARG A 167 -6.958 17.140 -0.395 1.00 11.67 H new ATOM 0 HG3 ARG A 167 -7.523 16.517 1.142 1.00 11.67 H new ATOM 0 HD2 ARG A 167 -5.417 17.092 2.221 1.00 12.28 H new ATOM 0 HD3 ARG A 167 -4.701 17.542 0.686 1.00 12.28 H new ATOM 0 HE ARG A 167 -7.066 19.004 1.815 1.00 13.07 H new ATOM 0 HH11 ARG A 167 -3.829 18.953 0.392 1.00 13.81 H new ATOM 0 HH12 ARG A 167 -3.734 20.713 0.274 1.00 13.81 H new ATOM 0 HH21 ARG A 167 -6.930 21.254 1.660 1.00 14.58 H new ATOM 0 HH22 ARG A 167 -5.482 22.010 0.988 1.00 14.58 H new ATOM 2482 N MET A 168 -4.900 14.781 3.653 1.00 11.01 N ATOM 2483 CA MET A 168 -5.083 15.186 5.045 1.00 11.55 C ATOM 2484 C MET A 168 -3.782 15.038 5.812 1.00 11.86 C ATOM 2485 O MET A 168 -2.829 14.434 5.321 1.00 11.94 O ATOM 2486 CB MET A 168 -6.141 14.328 5.737 1.00 11.57 C ATOM 2487 CG MET A 168 -7.551 14.814 5.518 1.00 11.64 C ATOM 2488 SD MET A 168 -8.766 13.489 5.640 1.00 11.27 S ATOM 2489 CE MET A 168 -8.275 12.471 4.250 1.00 10.38 C ATOM 0 H MET A 168 -3.982 14.376 3.470 1.00 11.01 H new ATOM 0 HA MET A 168 -5.406 16.227 5.039 1.00 11.55 H new ATOM 0 HB2 MET A 168 -6.059 13.303 5.375 1.00 11.57 H new ATOM 0 HB3 MET A 168 -5.935 14.306 6.807 1.00 11.57 H new ATOM 0 HG2 MET A 168 -7.784 15.585 6.253 1.00 11.64 H new ATOM 0 HG3 MET A 168 -7.623 15.279 4.535 1.00 11.64 H new ATOM 0 HE1 MET A 168 -9.085 12.434 3.522 1.00 10.38 H new ATOM 0 HE2 MET A 168 -7.387 12.897 3.783 1.00 10.38 H new ATOM 0 HE3 MET A 168 -8.054 11.462 4.598 1.00 10.38 H new ATOM 2499 N GLN A 169 -3.752 15.594 7.009 1.00 12.22 N ATOM 2500 CA GLN A 169 -2.670 15.347 7.945 1.00 12.70 C ATOM 2501 C GLN A 169 -3.272 14.833 9.242 1.00 12.99 C ATOM 2502 O GLN A 169 -4.461 14.510 9.280 1.00 13.33 O ATOM 2503 CB GLN A 169 -1.850 16.618 8.196 1.00 13.10 C ATOM 2504 CG GLN A 169 -1.139 17.139 6.957 1.00 13.81 C ATOM 2505 CD GLN A 169 -0.300 18.373 7.233 1.00 14.46 C ATOM 2506 OE1 GLN A 169 -0.728 19.184 8.187 1.00 14.64 O flip ATOM 2507 NE2 GLN A 169 0.724 18.597 6.584 1.00 14.99 N flip ATOM 0 H GLN A 169 -4.472 16.226 7.359 1.00 12.22 H new ATOM 0 HA GLN A 169 -1.989 14.605 7.527 1.00 12.70 H new ATOM 0 HB2 GLN A 169 -2.510 17.396 8.580 1.00 13.10 H new ATOM 0 HB3 GLN A 169 -1.111 16.416 8.971 1.00 13.10 H new ATOM 0 HG2 GLN A 169 -0.500 16.354 6.554 1.00 13.81 H new ATOM 0 HG3 GLN A 169 -1.878 17.372 6.191 1.00 13.81 H new ATOM 0 HE21 GLN A 169 1.019 17.946 5.857 1.00 14.99 H new ATOM 0 HE22 GLN A 169 1.276 19.433 6.775 1.00 14.99 H new ATOM 2516 N GLU A 170 -2.484 14.752 10.298 1.00 13.03 N ATOM 2517 CA GLU A 170 -3.000 14.301 11.567 1.00 13.47 C ATOM 2518 C GLU A 170 -3.582 15.482 12.337 1.00 13.57 C ATOM 2519 O GLU A 170 -4.093 16.440 11.749 1.00 13.95 O ATOM 2520 CB GLU A 170 -1.900 13.614 12.387 1.00 14.04 C ATOM 2521 CG GLU A 170 -1.201 12.475 11.661 1.00 14.40 C ATOM 2522 CD GLU A 170 -0.044 12.945 10.804 1.00 14.65 C ATOM 2523 OE1 GLU A 170 1.066 13.137 11.337 1.00 14.64 O ATOM 2524 OE2 GLU A 170 -0.241 13.116 9.581 1.00 15.01 O1- ATOM 0 H GLU A 170 -1.493 14.992 10.298 1.00 13.03 H new ATOM 0 HA GLU A 170 -3.790 13.572 11.385 1.00 13.47 H new ATOM 0 HB2 GLU A 170 -1.157 14.358 12.673 1.00 14.04 H new ATOM 0 HB3 GLU A 170 -2.336 13.229 13.309 1.00 14.04 H new ATOM 0 HG2 GLU A 170 -0.836 11.754 12.393 1.00 14.40 H new ATOM 0 HG3 GLU A 170 -1.923 11.953 11.033 1.00 14.40 H new ATOM 2531 N THR A 171 -3.477 15.389 13.659 1.00 13.39 N ATOM 2532 CA THR A 171 -3.904 16.432 14.598 1.00 13.67 C ATOM 2533 C THR A 171 -5.339 16.900 14.358 1.00 13.64 C ATOM 2534 O THR A 171 -5.679 18.049 14.642 1.00 13.80 O ATOM 2535 CB THR A 171 -2.947 17.647 14.580 1.00 13.90 C ATOM 2536 OG1 THR A 171 -2.846 18.204 13.262 1.00 13.68 O ATOM 2537 CG2 THR A 171 -1.560 17.248 15.068 1.00 14.25 C ATOM 0 H THR A 171 -3.084 14.569 14.122 1.00 13.39 H new ATOM 0 HA THR A 171 -3.869 15.968 15.584 1.00 13.67 H new ATOM 0 HB THR A 171 -3.361 18.400 15.251 1.00 13.90 H new ATOM 0 HG1 THR A 171 -3.580 17.866 12.707 1.00 13.68 H new ATOM 0 HG21 THR A 171 -0.903 18.117 15.047 1.00 14.25 H new ATOM 0 HG22 THR A 171 -1.628 16.869 16.088 1.00 14.25 H new ATOM 0 HG23 THR A 171 -1.155 16.472 14.419 1.00 14.25 H new ATOM 2545 N THR A 172 -6.179 16.001 13.863 1.00 13.61 N ATOM 2546 CA THR A 172 -7.555 16.331 13.549 1.00 13.78 C ATOM 2547 C THR A 172 -8.424 16.338 14.809 1.00 14.39 C ATOM 2548 O THR A 172 -8.833 17.403 15.273 1.00 14.89 O ATOM 2549 CB THR A 172 -8.121 15.330 12.525 1.00 13.53 C ATOM 2550 OG1 THR A 172 -7.203 15.189 11.432 1.00 13.57 O ATOM 2551 CG2 THR A 172 -9.469 15.793 12.000 1.00 13.88 C ATOM 0 H THR A 172 -5.925 15.032 13.671 1.00 13.61 H new ATOM 0 HA THR A 172 -7.571 17.333 13.119 1.00 13.78 H new ATOM 0 HB THR A 172 -8.256 14.369 13.022 1.00 13.53 H new ATOM 0 HG1 THR A 172 -7.564 14.550 10.782 1.00 13.57 H new ATOM 0 HG21 THR A 172 -9.847 15.069 11.279 1.00 13.88 H new ATOM 0 HG22 THR A 172 -10.172 15.880 12.829 1.00 13.88 H new ATOM 0 HG23 THR A 172 -9.357 16.763 11.515 1.00 13.88 H new ATOM 2559 N SER A 173 -8.680 15.152 15.363 1.00 14.50 N ATOM 2560 CA SER A 173 -9.527 14.998 16.548 1.00 15.21 C ATOM 2561 C SER A 173 -10.965 15.467 16.268 1.00 15.64 C ATOM 2562 O SER A 173 -11.294 15.894 15.158 1.00 15.85 O ATOM 2563 CB SER A 173 -8.929 15.760 17.743 1.00 15.46 C ATOM 2564 OG SER A 173 -9.613 15.456 18.953 1.00 15.55 O ATOM 0 H SER A 173 -8.307 14.273 15.004 1.00 14.50 H new ATOM 0 HA SER A 173 -9.565 13.938 16.799 1.00 15.21 H new ATOM 0 HB2 SER A 173 -7.874 15.505 17.847 1.00 15.46 H new ATOM 0 HB3 SER A 173 -8.981 16.832 17.554 1.00 15.46 H new ATOM 0 HG SER A 173 -9.207 15.955 19.692 1.00 15.55 H new ATOM 2570 N GLY A 174 -11.820 15.371 17.276 1.00 15.94 N ATOM 2571 CA GLY A 174 -13.205 15.773 17.123 1.00 16.51 C ATOM 2572 C GLY A 174 -14.128 14.582 16.977 1.00 16.95 C ATOM 2573 O GLY A 174 -15.308 14.650 17.327 1.00 17.54 O ATOM 0 H GLY A 174 -11.578 15.020 18.203 1.00 15.94 H new ATOM 0 HA2 GLY A 174 -13.509 16.363 17.987 1.00 16.51 H new ATOM 0 HA3 GLY A 174 -13.301 16.416 16.248 1.00 16.51 H new ATOM 2577 N LEU A 175 -13.587 13.491 16.458 1.00 16.81 N ATOM 2578 CA LEU A 175 -14.339 12.257 16.285 1.00 17.34 C ATOM 2579 C LEU A 175 -13.811 11.201 17.247 1.00 17.70 C ATOM 2580 O LEU A 175 -13.001 11.500 18.129 1.00 17.85 O ATOM 2581 CB LEU A 175 -14.226 11.749 14.838 1.00 17.29 C ATOM 2582 CG LEU A 175 -14.999 12.547 13.780 1.00 17.29 C ATOM 2583 CD1 LEU A 175 -14.323 13.879 13.484 1.00 17.42 C ATOM 2584 CD2 LEU A 175 -15.143 11.729 12.505 1.00 17.14 C ATOM 0 H LEU A 175 -12.618 13.435 16.146 1.00 16.81 H new ATOM 0 HA LEU A 175 -15.390 12.454 16.499 1.00 17.34 H new ATOM 0 HB2 LEU A 175 -13.172 11.740 14.559 1.00 17.29 H new ATOM 0 HB3 LEU A 175 -14.572 10.716 14.809 1.00 17.29 H new ATOM 0 HG LEU A 175 -15.991 12.760 14.178 1.00 17.29 H new ATOM 0 HD11 LEU A 175 -14.897 14.419 12.730 1.00 17.42 H new ATOM 0 HD12 LEU A 175 -14.274 14.473 14.397 1.00 17.42 H new ATOM 0 HD13 LEU A 175 -13.314 13.700 13.113 1.00 17.42 H new ATOM 0 HD21 LEU A 175 -15.693 12.307 11.762 1.00 17.14 H new ATOM 0 HD22 LEU A 175 -14.155 11.485 12.116 1.00 17.14 H new ATOM 0 HD23 LEU A 175 -15.684 10.808 12.723 1.00 17.14 H new ATOM 2596 N GLU A 176 -14.285 9.971 17.085 1.00 17.97 N ATOM 2597 CA GLU A 176 -13.801 8.852 17.879 1.00 18.46 C ATOM 2598 C GLU A 176 -12.520 8.288 17.260 1.00 18.48 C ATOM 2599 O GLU A 176 -11.417 8.674 17.638 1.00 18.35 O ATOM 2600 CB GLU A 176 -14.878 7.767 17.974 1.00 18.91 C ATOM 2601 CG GLU A 176 -14.481 6.589 18.848 1.00 19.00 C ATOM 2602 CD GLU A 176 -15.543 5.514 18.892 1.00 19.35 C ATOM 2603 OE1 GLU A 176 -15.699 4.782 17.893 1.00 19.40 O1- ATOM 2604 OE2 GLU A 176 -16.242 5.406 19.919 1.00 19.67 O ATOM 0 H GLU A 176 -15.007 9.725 16.408 1.00 17.97 H new ATOM 0 HA GLU A 176 -13.575 9.201 18.887 1.00 18.46 H new ATOM 0 HB2 GLU A 176 -15.793 8.209 18.368 1.00 18.91 H new ATOM 0 HB3 GLU A 176 -15.106 7.404 16.972 1.00 18.91 H new ATOM 0 HG2 GLU A 176 -13.551 6.161 18.474 1.00 19.00 H new ATOM 0 HG3 GLU A 176 -14.285 6.942 19.860 1.00 19.00 H new ATOM 2611 N VAL A 177 -12.669 7.389 16.294 1.00 18.75 N ATOM 2612 CA VAL A 177 -11.521 6.771 15.645 1.00 18.92 C ATOM 2613 C VAL A 177 -11.921 6.228 14.267 1.00 19.38 C ATOM 2614 O VAL A 177 -11.675 5.074 13.918 1.00 19.52 O ATOM 2615 CB VAL A 177 -10.900 5.661 16.539 1.00 18.88 C ATOM 2616 CG1 VAL A 177 -11.867 4.503 16.760 1.00 19.38 C ATOM 2617 CG2 VAL A 177 -9.577 5.168 15.966 1.00 18.51 C ATOM 0 H VAL A 177 -13.573 7.073 15.944 1.00 18.75 H new ATOM 0 HA VAL A 177 -10.754 7.531 15.500 1.00 18.92 H new ATOM 0 HB VAL A 177 -10.700 6.107 17.513 1.00 18.88 H new ATOM 0 HG11 VAL A 177 -11.394 3.749 17.390 1.00 19.38 H new ATOM 0 HG12 VAL A 177 -12.769 4.871 17.249 1.00 19.38 H new ATOM 0 HG13 VAL A 177 -12.130 4.060 15.799 1.00 19.38 H new ATOM 0 HG21 VAL A 177 -9.167 4.392 16.613 1.00 18.51 H new ATOM 0 HG22 VAL A 177 -9.742 4.759 14.969 1.00 18.51 H new ATOM 0 HG23 VAL A 177 -8.874 5.999 15.906 1.00 18.51 H new ATOM 2627 N LEU A 178 -12.548 7.087 13.477 1.00 19.73 N ATOM 2628 CA LEU A 178 -12.999 6.715 12.142 1.00 20.29 C ATOM 2629 C LEU A 178 -11.848 6.809 11.145 1.00 20.67 C ATOM 2630 O LEU A 178 -11.758 7.761 10.369 1.00 20.64 O ATOM 2631 CB LEU A 178 -14.159 7.617 11.691 1.00 20.68 C ATOM 2632 CG LEU A 178 -15.518 7.379 12.372 1.00 20.91 C ATOM 2633 CD1 LEU A 178 -15.929 5.917 12.266 1.00 20.95 C ATOM 2634 CD2 LEU A 178 -15.495 7.829 13.826 1.00 21.15 C ATOM 0 H LEU A 178 -12.757 8.051 13.738 1.00 19.73 H new ATOM 0 HA LEU A 178 -13.352 5.684 12.177 1.00 20.29 H new ATOM 0 HB2 LEU A 178 -13.870 8.654 11.859 1.00 20.68 H new ATOM 0 HB3 LEU A 178 -14.290 7.493 10.616 1.00 20.68 H new ATOM 0 HG LEU A 178 -16.260 7.982 11.849 1.00 20.91 H new ATOM 0 HD11 LEU A 178 -16.893 5.774 12.755 1.00 20.95 H new ATOM 0 HD12 LEU A 178 -16.009 5.637 11.216 1.00 20.95 H new ATOM 0 HD13 LEU A 178 -15.179 5.292 12.752 1.00 20.95 H new ATOM 0 HD21 LEU A 178 -16.470 7.647 14.279 1.00 21.15 H new ATOM 0 HD22 LEU A 178 -14.733 7.269 14.368 1.00 21.15 H new ATOM 0 HD23 LEU A 178 -15.265 8.893 13.874 1.00 21.15 H new ATOM 2646 N PHE A 179 -10.958 5.826 11.189 1.00 21.16 N ATOM 2647 CA PHE A 179 -9.804 5.792 10.299 1.00 21.69 C ATOM 2648 C PHE A 179 -9.710 4.438 9.605 1.00 22.01 C ATOM 2649 O PHE A 179 -8.710 3.726 9.743 1.00 22.11 O ATOM 2650 CB PHE A 179 -8.512 6.080 11.075 1.00 22.17 C ATOM 2651 CG PHE A 179 -8.458 7.456 11.680 1.00 22.45 C ATOM 2652 CD1 PHE A 179 -8.132 8.559 10.906 1.00 22.38 C ATOM 2653 CD2 PHE A 179 -8.734 7.646 13.026 1.00 22.88 C ATOM 2654 CE1 PHE A 179 -8.084 9.823 11.460 1.00 22.75 C ATOM 2655 CE2 PHE A 179 -8.689 8.908 13.586 1.00 23.25 C ATOM 2656 CZ PHE A 179 -8.347 9.999 12.797 1.00 23.19 C ATOM 0 H PHE A 179 -11.014 5.038 11.835 1.00 21.16 H new ATOM 0 HA PHE A 179 -9.932 6.567 9.543 1.00 21.69 H new ATOM 0 HB2 PHE A 179 -8.404 5.340 11.868 1.00 22.17 H new ATOM 0 HB3 PHE A 179 -7.662 5.955 10.405 1.00 22.17 H new ATOM 0 HD1 PHE A 179 -7.913 8.428 9.857 1.00 22.38 H new ATOM 0 HD2 PHE A 179 -8.987 6.797 13.644 1.00 22.88 H new ATOM 0 HE1 PHE A 179 -7.839 10.674 10.842 1.00 22.75 H new ATOM 0 HE2 PHE A 179 -8.919 9.046 14.632 1.00 23.25 H new ATOM 0 HZ PHE A 179 -8.288 10.985 13.234 1.00 23.19 H new ATOM 2666 N GLN A 180 -10.768 4.093 8.870 1.00 22.29 N ATOM 2667 CA GLN A 180 -10.856 2.826 8.146 1.00 22.74 C ATOM 2668 C GLN A 180 -10.626 1.637 9.076 1.00 22.89 C ATOM 2669 O GLN A 180 -11.411 1.473 10.036 1.00 22.88 O ATOM 2670 CB GLN A 180 -9.854 2.795 6.984 1.00 23.08 C ATOM 2671 CG GLN A 180 -10.138 3.828 5.903 1.00 23.17 C ATOM 2672 CD GLN A 180 -9.157 3.748 4.747 1.00 23.36 C ATOM 2673 OE1 GLN A 180 -7.992 3.393 4.925 1.00 23.45 O ATOM 2674 NE2 GLN A 180 -9.625 4.068 3.553 1.00 23.52 N ATOM 2675 OXT GLN A 180 -9.661 0.873 8.853 1.00 23.12 O ATOM 0 H GLN A 180 -11.590 4.687 8.760 1.00 22.29 H new ATOM 0 HA GLN A 180 -11.865 2.747 7.741 1.00 22.74 H new ATOM 0 HB2 GLN A 180 -8.851 2.960 7.377 1.00 23.08 H new ATOM 0 HB3 GLN A 180 -9.862 1.801 6.536 1.00 23.08 H new ATOM 0 HG2 GLN A 180 -11.151 3.685 5.526 1.00 23.17 H new ATOM 0 HG3 GLN A 180 -10.099 4.826 6.340 1.00 23.17 H new ATOM 0 HE21 GLN A 180 -10.597 4.358 3.447 1.00 23.52 H new ATOM 0 HE22 GLN A 180 -9.014 4.025 2.737 1.00 23.52 H new TER 2684 GLN A 180 HETATM 2685 AG AG A 200 -29.705 17.282 4.170 1.00 9.75 AG