USER MOD reduce.3.24.130724 H: found=0, std=0, add=518, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 519 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 105 SER OG : rot 116:sc= 0.367 USER MOD Set 1.2: A 108 THR OG1 : rot -68:sc= -1.63! USER MOD Set 1.3: A 163 ASN : amide:sc= -0.992! C(o=-2.3!,f=-8.4!) USER MOD Set 2.1: A 116 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: A 160 HIS : no HD1:sc= -12.7! C(o=-13!,f=-14!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 MET CE :methyl -152:sc= -6.68! (180deg=-11.2!) USER MOD Single : A 109 THR OG1 : rot -27:sc= 0.412 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ -126:sc= -0.0324 (180deg=-0.469) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 CYS SG : rot 122:sc= -2.14 USER MOD Single : A 127 THR OG1 : rot 26:sc= 0.49 USER MOD Single : A 146 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.149) USER MOD Single : A 148 SER OG : rot 103:sc= 0.0776 USER MOD Single : A 150 SER OG : rot 14:sc= -2.73! USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 157 GLN : amide:sc= -0.175 X(o=-0.18,f=0.00071) USER MOD Single : A 158 LYS NZ :NH3+ 168:sc=-0.00223 (180deg=-0.279) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0113) USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 98 77.044 -6.435 2.898 1.00 0.00 N ATOM 2 CA LYS A 98 76.692 -5.215 2.115 1.00 0.00 C ATOM 3 C LYS A 98 75.339 -5.412 1.428 1.00 0.00 C ATOM 4 O LYS A 98 75.016 -6.490 0.972 1.00 0.00 O ATOM 5 CB LYS A 98 77.803 -5.069 1.069 1.00 0.00 C ATOM 6 CG LYS A 98 79.155 -5.464 1.678 1.00 0.00 C ATOM 7 CD LYS A 98 80.262 -5.262 0.640 1.00 0.00 C ATOM 8 CE LYS A 98 81.534 -5.979 1.101 1.00 0.00 C ATOM 9 NZ LYS A 98 82.603 -4.944 1.036 1.00 0.00 N ATOM 0 HA LYS A 98 76.612 -4.330 2.746 1.00 0.00 H new ATOM 0 HB2 LYS A 98 77.586 -5.699 0.206 1.00 0.00 H new ATOM 0 HB3 LYS A 98 77.843 -4.040 0.711 1.00 0.00 H new ATOM 0 HG2 LYS A 98 79.357 -4.861 2.563 1.00 0.00 H new ATOM 0 HG3 LYS A 98 79.130 -6.505 2.001 1.00 0.00 H new ATOM 0 HD2 LYS A 98 79.943 -5.651 -0.327 1.00 0.00 H new ATOM 0 HD3 LYS A 98 80.460 -4.198 0.506 1.00 0.00 H new ATOM 0 HE2 LYS A 98 81.423 -6.369 2.113 1.00 0.00 H new ATOM 0 HE3 LYS A 98 81.765 -6.827 0.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 83.507 -5.360 1.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 82.690 -4.596 0.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 82.359 -4.153 1.665 1.00 0.00 H new ATOM 23 N MET A 99 74.544 -4.380 1.346 1.00 0.00 N ATOM 24 CA MET A 99 73.216 -4.518 0.686 1.00 0.00 C ATOM 25 C MET A 99 73.054 -3.469 -0.414 1.00 0.00 C ATOM 26 O MET A 99 73.890 -2.605 -0.600 1.00 0.00 O ATOM 27 CB MET A 99 72.188 -4.273 1.790 1.00 0.00 C ATOM 28 CG MET A 99 72.379 -2.864 2.352 1.00 0.00 C ATOM 29 SD MET A 99 71.066 -2.488 3.544 1.00 0.00 S ATOM 30 CE MET A 99 69.665 -3.137 2.598 1.00 0.00 C ATOM 0 H MET A 99 74.756 -3.450 1.707 1.00 0.00 H new ATOM 0 HA MET A 99 73.098 -5.497 0.221 1.00 0.00 H new ATOM 0 HB2 MET A 99 71.178 -4.386 1.395 1.00 0.00 H new ATOM 0 HB3 MET A 99 72.305 -5.012 2.582 1.00 0.00 H new ATOM 0 HG2 MET A 99 73.353 -2.785 2.835 1.00 0.00 H new ATOM 0 HG3 MET A 99 72.365 -2.135 1.541 1.00 0.00 H new ATOM 0 HE1 MET A 99 68.759 -2.598 2.874 1.00 0.00 H new ATOM 0 HE2 MET A 99 69.854 -3.007 1.532 1.00 0.00 H new ATOM 0 HE3 MET A 99 69.538 -4.197 2.817 1.00 0.00 H new ATOM 40 N PHE A 100 71.974 -3.539 -1.136 1.00 0.00 N ATOM 41 CA PHE A 100 71.723 -2.556 -2.224 1.00 0.00 C ATOM 42 C PHE A 100 70.405 -1.831 -1.949 1.00 0.00 C ATOM 43 O PHE A 100 69.366 -2.444 -1.808 1.00 0.00 O ATOM 44 CB PHE A 100 71.636 -3.409 -3.490 1.00 0.00 C ATOM 45 CG PHE A 100 71.631 -2.537 -4.724 1.00 0.00 C ATOM 46 CD1 PHE A 100 70.641 -1.561 -4.905 1.00 0.00 C ATOM 47 CD2 PHE A 100 72.619 -2.716 -5.699 1.00 0.00 C ATOM 48 CE1 PHE A 100 70.643 -0.768 -6.059 1.00 0.00 C ATOM 49 CE2 PHE A 100 72.621 -1.922 -6.851 1.00 0.00 C ATOM 50 CZ PHE A 100 71.633 -0.949 -7.032 1.00 0.00 C ATOM 0 H PHE A 100 71.246 -4.243 -1.018 1.00 0.00 H new ATOM 0 HA PHE A 100 72.494 -1.790 -2.310 1.00 0.00 H new ATOM 0 HB2 PHE A 100 72.480 -4.098 -3.529 1.00 0.00 H new ATOM 0 HB3 PHE A 100 70.731 -4.016 -3.464 1.00 0.00 H new ATOM 0 HD1 PHE A 100 69.877 -1.421 -4.155 1.00 0.00 H new ATOM 0 HD2 PHE A 100 73.381 -3.469 -5.562 1.00 0.00 H new ATOM 0 HE1 PHE A 100 69.880 -0.016 -6.199 1.00 0.00 H new ATOM 0 HE2 PHE A 100 73.386 -2.061 -7.601 1.00 0.00 H new ATOM 0 HZ PHE A 100 71.634 -0.337 -7.922 1.00 0.00 H new ATOM 60 N ILE A 101 70.439 -0.532 -1.862 1.00 0.00 N ATOM 61 CA ILE A 101 69.187 0.228 -1.584 1.00 0.00 C ATOM 62 C ILE A 101 68.755 0.971 -2.845 1.00 0.00 C ATOM 63 O ILE A 101 69.240 2.045 -3.145 1.00 0.00 O ATOM 64 CB ILE A 101 69.544 1.209 -0.460 1.00 0.00 C ATOM 65 CG1 ILE A 101 70.536 0.556 0.512 1.00 0.00 C ATOM 66 CG2 ILE A 101 68.275 1.583 0.301 1.00 0.00 C ATOM 67 CD1 ILE A 101 70.002 -0.812 0.947 1.00 0.00 C ATOM 0 H ILE A 101 71.278 0.037 -1.971 1.00 0.00 H new ATOM 0 HA ILE A 101 68.360 -0.418 -1.290 1.00 0.00 H new ATOM 0 HB ILE A 101 69.998 2.100 -0.894 1.00 0.00 H new ATOM 0 HG12 ILE A 101 71.509 0.443 0.034 1.00 0.00 H new ATOM 0 HG13 ILE A 101 70.682 1.195 1.383 1.00 0.00 H new ATOM 0 HG21 ILE A 101 68.523 2.280 1.101 1.00 0.00 H new ATOM 0 HG22 ILE A 101 67.566 2.051 -0.382 1.00 0.00 H new ATOM 0 HG23 ILE A 101 67.829 0.685 0.728 1.00 0.00 H new ATOM 0 HD11 ILE A 101 70.707 -1.275 1.637 1.00 0.00 H new ATOM 0 HD12 ILE A 101 69.039 -0.686 1.442 1.00 0.00 H new ATOM 0 HD13 ILE A 101 69.879 -1.450 0.072 1.00 0.00 H new ATOM 79 N GLY A 102 67.851 0.401 -3.592 1.00 0.00 N ATOM 80 CA GLY A 102 67.399 1.068 -4.840 1.00 0.00 C ATOM 81 C GLY A 102 66.213 1.983 -4.533 1.00 0.00 C ATOM 82 O GLY A 102 65.083 1.545 -4.443 1.00 0.00 O ATOM 0 H GLY A 102 67.408 -0.496 -3.391 1.00 0.00 H new ATOM 0 HA2 GLY A 102 68.216 1.647 -5.271 1.00 0.00 H new ATOM 0 HA3 GLY A 102 67.113 0.321 -5.580 1.00 0.00 H new ATOM 86 N GLY A 103 66.464 3.253 -4.374 1.00 0.00 N ATOM 87 CA GLY A 103 65.358 4.204 -4.075 1.00 0.00 C ATOM 88 C GLY A 103 65.922 5.447 -3.386 1.00 0.00 C ATOM 89 O GLY A 103 65.303 6.017 -2.509 1.00 0.00 O ATOM 0 H GLY A 103 67.391 3.674 -4.439 1.00 0.00 H new ATOM 0 HA2 GLY A 103 64.849 4.486 -4.996 1.00 0.00 H new ATOM 0 HA3 GLY A 103 64.617 3.726 -3.435 1.00 0.00 H new ATOM 93 N LEU A 104 67.091 5.876 -3.776 1.00 0.00 N ATOM 94 CA LEU A 104 67.688 7.084 -3.143 1.00 0.00 C ATOM 95 C LEU A 104 67.273 8.338 -3.914 1.00 0.00 C ATOM 96 O LEU A 104 66.957 8.282 -5.085 1.00 0.00 O ATOM 97 CB LEU A 104 69.203 6.878 -3.237 1.00 0.00 C ATOM 98 CG LEU A 104 69.688 6.013 -2.069 1.00 0.00 C ATOM 99 CD1 LEU A 104 69.173 6.588 -0.748 1.00 0.00 C ATOM 100 CD2 LEU A 104 69.166 4.584 -2.243 1.00 0.00 C ATOM 0 H LEU A 104 67.657 5.442 -4.505 1.00 0.00 H new ATOM 0 HA LEU A 104 67.359 7.215 -2.112 1.00 0.00 H new ATOM 0 HB2 LEU A 104 69.455 6.400 -4.184 1.00 0.00 H new ATOM 0 HB3 LEU A 104 69.711 7.842 -3.222 1.00 0.00 H new ATOM 0 HG LEU A 104 70.778 6.005 -2.055 1.00 0.00 H new ATOM 0 HD11 LEU A 104 69.521 5.969 0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 104 69.547 7.604 -0.623 1.00 0.00 H new ATOM 0 HD13 LEU A 104 68.083 6.601 -0.757 1.00 0.00 H new ATOM 0 HD21 LEU A 104 69.510 3.967 -1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 104 68.076 4.594 -2.260 1.00 0.00 H new ATOM 0 HD23 LEU A 104 69.540 4.172 -3.180 1.00 0.00 H new ATOM 112 N SER A 105 67.279 9.472 -3.269 1.00 0.00 N ATOM 113 CA SER A 105 66.894 10.727 -3.972 1.00 0.00 C ATOM 114 C SER A 105 68.062 11.218 -4.831 1.00 0.00 C ATOM 115 O SER A 105 69.056 10.536 -4.988 1.00 0.00 O ATOM 116 CB SER A 105 66.576 11.723 -2.855 1.00 0.00 C ATOM 117 OG SER A 105 67.439 12.848 -2.962 1.00 0.00 O ATOM 0 H SER A 105 67.533 9.583 -2.288 1.00 0.00 H new ATOM 0 HA SER A 105 66.044 10.592 -4.641 1.00 0.00 H new ATOM 0 HB2 SER A 105 65.536 12.042 -2.923 1.00 0.00 H new ATOM 0 HB3 SER A 105 66.701 11.247 -1.882 1.00 0.00 H new ATOM 0 HG SER A 105 66.910 13.648 -3.164 1.00 0.00 H new ATOM 123 N TRP A 106 67.956 12.391 -5.392 1.00 0.00 N ATOM 124 CA TRP A 106 69.069 12.908 -6.239 1.00 0.00 C ATOM 125 C TRP A 106 70.138 13.570 -5.366 1.00 0.00 C ATOM 126 O TRP A 106 71.260 13.769 -5.786 1.00 0.00 O ATOM 127 CB TRP A 106 68.423 13.936 -7.167 1.00 0.00 C ATOM 128 CG TRP A 106 67.964 13.258 -8.418 1.00 0.00 C ATOM 129 CD1 TRP A 106 67.683 11.940 -8.529 1.00 0.00 C ATOM 130 CD2 TRP A 106 67.730 13.840 -9.733 1.00 0.00 C ATOM 131 NE1 TRP A 106 67.290 11.674 -9.829 1.00 0.00 N ATOM 132 CE2 TRP A 106 67.303 12.814 -10.609 1.00 0.00 C ATOM 133 CE3 TRP A 106 67.845 15.145 -10.244 1.00 0.00 C ATOM 134 CZ2 TRP A 106 67.000 13.075 -11.946 1.00 0.00 C ATOM 135 CZ3 TRP A 106 67.541 15.410 -11.590 1.00 0.00 C ATOM 136 CH2 TRP A 106 67.120 14.377 -12.438 1.00 0.00 C ATOM 0 H TRP A 106 67.152 13.012 -5.302 1.00 0.00 H new ATOM 0 HA TRP A 106 69.563 12.112 -6.796 1.00 0.00 H new ATOM 0 HB2 TRP A 106 67.579 14.413 -6.668 1.00 0.00 H new ATOM 0 HB3 TRP A 106 69.137 14.724 -7.408 1.00 0.00 H new ATOM 0 HD1 TRP A 106 67.754 11.213 -7.733 1.00 0.00 H new ATOM 0 HE1 TRP A 106 67.024 10.750 -10.169 1.00 0.00 H new ATOM 0 HE3 TRP A 106 68.169 15.948 -9.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 66.675 12.276 -12.596 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 67.632 16.416 -11.973 1.00 0.00 H new ATOM 0 HH2 TRP A 106 66.888 14.587 -13.472 1.00 0.00 H new ATOM 147 N ASP A 107 69.799 13.909 -4.153 1.00 0.00 N ATOM 148 CA ASP A 107 70.798 14.555 -3.255 1.00 0.00 C ATOM 149 C ASP A 107 70.956 13.733 -1.975 1.00 0.00 C ATOM 150 O ASP A 107 71.231 14.262 -0.915 1.00 0.00 O ATOM 151 CB ASP A 107 70.219 15.935 -2.942 1.00 0.00 C ATOM 152 CG ASP A 107 68.782 15.785 -2.441 1.00 0.00 C ATOM 153 OD1 ASP A 107 67.923 15.469 -3.248 1.00 0.00 O ATOM 154 OD2 ASP A 107 68.562 15.991 -1.258 1.00 0.00 O ATOM 0 H ASP A 107 68.875 13.767 -3.745 1.00 0.00 H new ATOM 0 HA ASP A 107 71.784 14.626 -3.713 1.00 0.00 H new ATOM 0 HB2 ASP A 107 70.828 16.434 -2.188 1.00 0.00 H new ATOM 0 HB3 ASP A 107 70.241 16.561 -3.834 1.00 0.00 H new ATOM 159 N THR A 108 70.783 12.442 -2.066 1.00 0.00 N ATOM 160 CA THR A 108 70.921 11.585 -0.853 1.00 0.00 C ATOM 161 C THR A 108 72.397 11.383 -0.508 1.00 0.00 C ATOM 162 O THR A 108 73.254 11.379 -1.370 1.00 0.00 O ATOM 163 CB THR A 108 70.275 10.252 -1.231 1.00 0.00 C ATOM 164 OG1 THR A 108 69.042 10.495 -1.894 1.00 0.00 O ATOM 165 CG2 THR A 108 70.024 9.431 0.035 1.00 0.00 C ATOM 0 H THR A 108 70.553 11.944 -2.926 1.00 0.00 H new ATOM 0 HA THR A 108 70.450 12.035 0.021 1.00 0.00 H new ATOM 0 HB THR A 108 70.940 9.700 -1.895 1.00 0.00 H new ATOM 0 HG1 THR A 108 68.401 10.882 -1.261 1.00 0.00 H new ATOM 0 HG21 THR A 108 69.563 8.480 -0.233 1.00 0.00 H new ATOM 0 HG22 THR A 108 70.971 9.245 0.542 1.00 0.00 H new ATOM 0 HG23 THR A 108 69.359 9.982 0.700 1.00 0.00 H new ATOM 173 N THR A 109 72.698 11.211 0.748 1.00 0.00 N ATOM 174 CA THR A 109 74.116 11.005 1.159 1.00 0.00 C ATOM 175 C THR A 109 74.223 9.782 2.069 1.00 0.00 C ATOM 176 O THR A 109 73.314 9.469 2.810 1.00 0.00 O ATOM 177 CB THR A 109 74.491 12.267 1.934 1.00 0.00 C ATOM 178 OG1 THR A 109 73.811 12.269 3.184 1.00 0.00 O ATOM 179 CG2 THR A 109 74.092 13.503 1.127 1.00 0.00 C ATOM 0 H THR A 109 72.021 11.204 1.511 1.00 0.00 H new ATOM 0 HA THR A 109 74.772 10.836 0.305 1.00 0.00 H new ATOM 0 HB THR A 109 75.567 12.285 2.105 1.00 0.00 H new ATOM 0 HG1 THR A 109 72.981 11.753 3.106 1.00 0.00 H new ATOM 0 HG21 THR A 109 74.360 14.402 1.682 1.00 0.00 H new ATOM 0 HG22 THR A 109 74.615 13.497 0.170 1.00 0.00 H new ATOM 0 HG23 THR A 109 73.016 13.492 0.953 1.00 0.00 H new ATOM 187 N LYS A 110 75.328 9.096 2.033 1.00 0.00 N ATOM 188 CA LYS A 110 75.480 7.908 2.915 1.00 0.00 C ATOM 189 C LYS A 110 75.291 8.336 4.370 1.00 0.00 C ATOM 190 O LYS A 110 75.041 7.530 5.242 1.00 0.00 O ATOM 191 CB LYS A 110 76.904 7.404 2.674 1.00 0.00 C ATOM 192 CG LYS A 110 77.909 8.466 3.125 1.00 0.00 C ATOM 193 CD LYS A 110 78.542 9.120 1.896 1.00 0.00 C ATOM 194 CE LYS A 110 79.929 9.656 2.259 1.00 0.00 C ATOM 195 NZ LYS A 110 80.876 8.581 1.851 1.00 0.00 N ATOM 0 H LYS A 110 76.128 9.304 1.435 1.00 0.00 H new ATOM 0 HA LYS A 110 74.747 7.129 2.706 1.00 0.00 H new ATOM 0 HB2 LYS A 110 77.070 6.476 3.222 1.00 0.00 H new ATOM 0 HB3 LYS A 110 77.047 7.180 1.617 1.00 0.00 H new ATOM 0 HG2 LYS A 110 77.410 9.219 3.735 1.00 0.00 H new ATOM 0 HG3 LYS A 110 78.680 8.012 3.747 1.00 0.00 H new ATOM 0 HD2 LYS A 110 78.621 8.395 1.086 1.00 0.00 H new ATOM 0 HD3 LYS A 110 77.910 9.932 1.537 1.00 0.00 H new ATOM 0 HE2 LYS A 110 80.141 10.588 1.736 1.00 0.00 H new ATOM 0 HE3 LYS A 110 80.005 9.865 3.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 81.850 8.875 2.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 80.654 7.708 2.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 80.786 8.409 0.829 1.00 0.00 H new ATOM 209 N LYS A 111 75.399 9.611 4.630 1.00 0.00 N ATOM 210 CA LYS A 111 75.220 10.113 6.021 1.00 0.00 C ATOM 211 C LYS A 111 73.774 9.890 6.476 1.00 0.00 C ATOM 212 O LYS A 111 73.519 9.222 7.459 1.00 0.00 O ATOM 213 CB LYS A 111 75.532 11.607 5.941 1.00 0.00 C ATOM 214 CG LYS A 111 76.626 11.961 6.950 1.00 0.00 C ATOM 215 CD LYS A 111 77.018 13.430 6.782 1.00 0.00 C ATOM 216 CE LYS A 111 75.931 14.323 7.386 1.00 0.00 C ATOM 217 NZ LYS A 111 76.144 14.244 8.858 1.00 0.00 N ATOM 0 H LYS A 111 75.604 10.329 3.935 1.00 0.00 H new ATOM 0 HA LYS A 111 75.863 9.599 6.736 1.00 0.00 H new ATOM 0 HB2 LYS A 111 75.856 11.867 4.933 1.00 0.00 H new ATOM 0 HB3 LYS A 111 74.633 12.188 6.147 1.00 0.00 H new ATOM 0 HG2 LYS A 111 76.271 11.782 7.965 1.00 0.00 H new ATOM 0 HG3 LYS A 111 77.496 11.322 6.799 1.00 0.00 H new ATOM 0 HD2 LYS A 111 77.973 13.620 7.272 1.00 0.00 H new ATOM 0 HD3 LYS A 111 77.149 13.663 5.725 1.00 0.00 H new ATOM 0 HE2 LYS A 111 76.019 15.349 7.029 1.00 0.00 H new ATOM 0 HE3 LYS A 111 74.935 13.974 7.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 75.258 13.959 9.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 76.884 13.543 9.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 76.439 15.175 9.217 1.00 0.00 H new ATOM 231 N ASP A 112 72.822 10.443 5.769 1.00 0.00 N ATOM 232 CA ASP A 112 71.398 10.253 6.175 1.00 0.00 C ATOM 233 C ASP A 112 70.988 8.788 5.988 1.00 0.00 C ATOM 234 O ASP A 112 70.329 8.207 6.825 1.00 0.00 O ATOM 235 CB ASP A 112 70.586 11.171 5.255 1.00 0.00 C ATOM 236 CG ASP A 112 70.407 10.514 3.885 1.00 0.00 C ATOM 237 OD1 ASP A 112 71.308 10.630 3.074 1.00 0.00 O ATOM 238 OD2 ASP A 112 69.372 9.905 3.673 1.00 0.00 O ATOM 0 H ASP A 112 72.967 11.013 4.936 1.00 0.00 H new ATOM 0 HA ASP A 112 71.233 10.495 7.225 1.00 0.00 H new ATOM 0 HB2 ASP A 112 69.612 11.375 5.699 1.00 0.00 H new ATOM 0 HB3 ASP A 112 71.093 12.129 5.144 1.00 0.00 H new ATOM 243 N LEU A 113 71.381 8.186 4.898 1.00 0.00 N ATOM 244 CA LEU A 113 71.018 6.759 4.665 1.00 0.00 C ATOM 245 C LEU A 113 71.599 5.890 5.782 1.00 0.00 C ATOM 246 O LEU A 113 70.915 5.076 6.369 1.00 0.00 O ATOM 247 CB LEU A 113 71.648 6.406 3.315 1.00 0.00 C ATOM 248 CG LEU A 113 71.112 5.059 2.833 1.00 0.00 C ATOM 249 CD1 LEU A 113 69.604 5.165 2.606 1.00 0.00 C ATOM 250 CD2 LEU A 113 71.801 4.681 1.520 1.00 0.00 C ATOM 0 H LEU A 113 71.936 8.620 4.161 1.00 0.00 H new ATOM 0 HA LEU A 113 69.941 6.594 4.660 1.00 0.00 H new ATOM 0 HB2 LEU A 113 71.421 7.181 2.583 1.00 0.00 H new ATOM 0 HB3 LEU A 113 72.733 6.364 3.409 1.00 0.00 H new ATOM 0 HG LEU A 113 71.313 4.295 3.583 1.00 0.00 H new ATOM 0 HD11 LEU A 113 69.219 4.205 2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 113 69.114 5.439 3.540 1.00 0.00 H new ATOM 0 HD13 LEU A 113 69.402 5.927 1.854 1.00 0.00 H new ATOM 0 HD21 LEU A 113 71.421 3.720 1.173 1.00 0.00 H new ATOM 0 HD22 LEU A 113 71.597 5.444 0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 113 72.877 4.609 1.681 1.00 0.00 H new ATOM 262 N LYS A 114 72.855 6.065 6.086 1.00 0.00 N ATOM 263 CA LYS A 114 73.474 5.257 7.172 1.00 0.00 C ATOM 264 C LYS A 114 72.712 5.479 8.480 1.00 0.00 C ATOM 265 O LYS A 114 72.611 4.596 9.308 1.00 0.00 O ATOM 266 CB LYS A 114 74.904 5.780 7.288 1.00 0.00 C ATOM 267 CG LYS A 114 75.696 4.904 8.261 1.00 0.00 C ATOM 268 CD LYS A 114 77.188 5.009 7.943 1.00 0.00 C ATOM 269 CE LYS A 114 77.578 6.483 7.813 1.00 0.00 C ATOM 270 NZ LYS A 114 79.039 6.470 7.527 1.00 0.00 N ATOM 0 H LYS A 114 73.478 6.731 5.630 1.00 0.00 H new ATOM 0 HA LYS A 114 73.451 4.187 6.963 1.00 0.00 H new ATOM 0 HB2 LYS A 114 75.383 5.778 6.309 1.00 0.00 H new ATOM 0 HB3 LYS A 114 74.897 6.813 7.637 1.00 0.00 H new ATOM 0 HG2 LYS A 114 75.509 5.221 9.287 1.00 0.00 H new ATOM 0 HG3 LYS A 114 75.369 3.867 8.183 1.00 0.00 H new ATOM 0 HD2 LYS A 114 77.773 4.535 8.731 1.00 0.00 H new ATOM 0 HD3 LYS A 114 77.412 4.479 7.017 1.00 0.00 H new ATOM 0 HE2 LYS A 114 77.023 6.969 7.011 1.00 0.00 H new ATOM 0 HE3 LYS A 114 77.360 7.032 8.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 79.381 7.447 7.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 79.542 6.007 8.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 79.216 5.947 6.646 1.00 0.00 H new ATOM 284 N ASP A 115 72.173 6.654 8.672 1.00 0.00 N ATOM 285 CA ASP A 115 71.418 6.926 9.929 1.00 0.00 C ATOM 286 C ASP A 115 70.030 6.306 9.853 1.00 0.00 C ATOM 287 O ASP A 115 69.654 5.529 10.709 1.00 0.00 O ATOM 288 CB ASP A 115 71.333 8.449 10.036 1.00 0.00 C ATOM 289 CG ASP A 115 72.728 9.023 10.287 1.00 0.00 C ATOM 290 OD1 ASP A 115 73.540 8.322 10.868 1.00 0.00 O ATOM 291 OD2 ASP A 115 72.961 10.155 9.895 1.00 0.00 O ATOM 0 H ASP A 115 72.223 7.433 8.016 1.00 0.00 H new ATOM 0 HA ASP A 115 71.908 6.495 10.802 1.00 0.00 H new ATOM 0 HB2 ASP A 115 70.917 8.866 9.119 1.00 0.00 H new ATOM 0 HB3 ASP A 115 70.661 8.730 10.847 1.00 0.00 H new ATOM 296 N TYR A 116 69.267 6.610 8.839 1.00 0.00 N ATOM 297 CA TYR A 116 67.923 5.984 8.748 1.00 0.00 C ATOM 298 C TYR A 116 68.079 4.492 9.004 1.00 0.00 C ATOM 299 O TYR A 116 67.204 3.839 9.536 1.00 0.00 O ATOM 300 CB TYR A 116 67.439 6.213 7.322 1.00 0.00 C ATOM 301 CG TYR A 116 66.204 5.374 7.102 1.00 0.00 C ATOM 302 CD1 TYR A 116 64.960 5.849 7.528 1.00 0.00 C ATOM 303 CD2 TYR A 116 66.303 4.122 6.485 1.00 0.00 C ATOM 304 CE1 TYR A 116 63.812 5.074 7.334 1.00 0.00 C ATOM 305 CE2 TYR A 116 65.155 3.346 6.290 1.00 0.00 C ATOM 306 CZ TYR A 116 63.909 3.822 6.713 1.00 0.00 C ATOM 307 OH TYR A 116 62.776 3.057 6.520 1.00 0.00 O ATOM 0 H TYR A 116 69.511 7.252 8.085 1.00 0.00 H new ATOM 0 HA TYR A 116 67.220 6.401 9.469 1.00 0.00 H new ATOM 0 HB2 TYR A 116 67.215 7.268 7.161 1.00 0.00 H new ATOM 0 HB3 TYR A 116 68.216 5.940 6.608 1.00 0.00 H new ATOM 0 HD1 TYR A 116 64.886 6.814 8.007 1.00 0.00 H new ATOM 0 HD2 TYR A 116 67.265 3.755 6.159 1.00 0.00 H new ATOM 0 HE1 TYR A 116 62.851 5.441 7.663 1.00 0.00 H new ATOM 0 HE2 TYR A 116 65.231 2.380 5.813 1.00 0.00 H new ATOM 0 HH TYR A 116 62.000 3.645 6.409 1.00 0.00 H new ATOM 317 N PHE A 117 69.206 3.951 8.622 1.00 0.00 N ATOM 318 CA PHE A 117 69.438 2.502 8.837 1.00 0.00 C ATOM 319 C PHE A 117 70.101 2.252 10.195 1.00 0.00 C ATOM 320 O PHE A 117 70.094 1.148 10.703 1.00 0.00 O ATOM 321 CB PHE A 117 70.334 2.054 7.685 1.00 0.00 C ATOM 322 CG PHE A 117 69.478 1.836 6.461 1.00 0.00 C ATOM 323 CD1 PHE A 117 68.366 0.990 6.533 1.00 0.00 C ATOM 324 CD2 PHE A 117 69.796 2.474 5.257 1.00 0.00 C ATOM 325 CE1 PHE A 117 67.568 0.782 5.403 1.00 0.00 C ATOM 326 CE2 PHE A 117 68.999 2.267 4.125 1.00 0.00 C ATOM 327 CZ PHE A 117 67.886 1.422 4.198 1.00 0.00 C ATOM 0 H PHE A 117 69.971 4.453 8.172 1.00 0.00 H new ATOM 0 HA PHE A 117 68.505 1.939 8.851 1.00 0.00 H new ATOM 0 HB2 PHE A 117 71.096 2.807 7.484 1.00 0.00 H new ATOM 0 HB3 PHE A 117 70.857 1.135 7.949 1.00 0.00 H new ATOM 0 HD1 PHE A 117 68.123 0.497 7.463 1.00 0.00 H new ATOM 0 HD2 PHE A 117 70.656 3.126 5.201 1.00 0.00 H new ATOM 0 HE1 PHE A 117 66.709 0.130 5.459 1.00 0.00 H new ATOM 0 HE2 PHE A 117 69.243 2.759 3.195 1.00 0.00 H new ATOM 0 HZ PHE A 117 67.271 1.263 3.324 1.00 0.00 H new ATOM 337 N SER A 118 70.653 3.263 10.801 1.00 0.00 N ATOM 338 CA SER A 118 71.277 3.059 12.137 1.00 0.00 C ATOM 339 C SER A 118 70.194 2.592 13.114 1.00 0.00 C ATOM 340 O SER A 118 70.474 2.078 14.178 1.00 0.00 O ATOM 341 CB SER A 118 71.821 4.428 12.543 1.00 0.00 C ATOM 342 OG SER A 118 72.231 4.385 13.903 1.00 0.00 O ATOM 0 H SER A 118 70.700 4.214 10.434 1.00 0.00 H new ATOM 0 HA SER A 118 72.069 2.310 12.131 1.00 0.00 H new ATOM 0 HB2 SER A 118 72.662 4.702 11.906 1.00 0.00 H new ATOM 0 HB3 SER A 118 71.056 5.192 12.406 1.00 0.00 H new ATOM 0 HG SER A 118 72.582 5.261 14.167 1.00 0.00 H new ATOM 348 N LYS A 119 68.952 2.766 12.740 1.00 0.00 N ATOM 349 CA LYS A 119 67.823 2.335 13.614 1.00 0.00 C ATOM 350 C LYS A 119 67.709 0.812 13.600 1.00 0.00 C ATOM 351 O LYS A 119 67.093 0.213 14.459 1.00 0.00 O ATOM 352 CB LYS A 119 66.581 2.950 12.972 1.00 0.00 C ATOM 353 CG LYS A 119 65.865 3.844 13.982 1.00 0.00 C ATOM 354 CD LYS A 119 64.805 3.026 14.725 1.00 0.00 C ATOM 355 CE LYS A 119 64.118 3.904 15.772 1.00 0.00 C ATOM 356 NZ LYS A 119 62.667 3.828 15.445 1.00 0.00 N ATOM 0 H LYS A 119 68.671 3.193 11.857 1.00 0.00 H new ATOM 0 HA LYS A 119 67.956 2.647 14.650 1.00 0.00 H new ATOM 0 HB2 LYS A 119 66.864 3.531 12.095 1.00 0.00 H new ATOM 0 HB3 LYS A 119 65.910 2.162 12.630 1.00 0.00 H new ATOM 0 HG2 LYS A 119 66.583 4.258 14.690 1.00 0.00 H new ATOM 0 HG3 LYS A 119 65.398 4.686 13.472 1.00 0.00 H new ATOM 0 HD2 LYS A 119 64.069 2.640 14.020 1.00 0.00 H new ATOM 0 HD3 LYS A 119 65.268 2.164 15.206 1.00 0.00 H new ATOM 0 HE2 LYS A 119 64.315 3.542 16.781 1.00 0.00 H new ATOM 0 HE3 LYS A 119 64.480 4.931 15.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 62.128 4.406 16.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 62.509 4.185 14.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 62.349 2.840 15.504 1.00 0.00 H new ATOM 370 N PHE A 120 68.300 0.186 12.623 1.00 0.00 N ATOM 371 CA PHE A 120 68.234 -1.297 12.533 1.00 0.00 C ATOM 372 C PHE A 120 69.404 -1.905 13.304 1.00 0.00 C ATOM 373 O PHE A 120 69.227 -2.672 14.231 1.00 0.00 O ATOM 374 CB PHE A 120 68.372 -1.607 11.040 1.00 0.00 C ATOM 375 CG PHE A 120 67.247 -0.970 10.249 1.00 0.00 C ATOM 376 CD1 PHE A 120 67.276 0.403 9.951 1.00 0.00 C ATOM 377 CD2 PHE A 120 66.188 -1.759 9.781 1.00 0.00 C ATOM 378 CE1 PHE A 120 66.251 0.978 9.191 1.00 0.00 C ATOM 379 CE2 PHE A 120 65.167 -1.181 9.017 1.00 0.00 C ATOM 380 CZ PHE A 120 65.201 0.187 8.722 1.00 0.00 C ATOM 0 H PHE A 120 68.829 0.641 11.879 1.00 0.00 H new ATOM 0 HA PHE A 120 67.313 -1.703 12.952 1.00 0.00 H new ATOM 0 HB2 PHE A 120 69.331 -1.240 10.675 1.00 0.00 H new ATOM 0 HB3 PHE A 120 68.364 -2.686 10.886 1.00 0.00 H new ATOM 0 HD1 PHE A 120 68.090 1.015 10.309 1.00 0.00 H new ATOM 0 HD2 PHE A 120 66.159 -2.814 10.010 1.00 0.00 H new ATOM 0 HE1 PHE A 120 66.273 2.034 8.967 1.00 0.00 H new ATOM 0 HE2 PHE A 120 64.353 -1.791 8.655 1.00 0.00 H new ATOM 0 HZ PHE A 120 64.414 0.631 8.131 1.00 0.00 H new ATOM 390 N GLY A 121 70.597 -1.555 12.925 1.00 0.00 N ATOM 391 CA GLY A 121 71.803 -2.087 13.619 1.00 0.00 C ATOM 392 C GLY A 121 72.970 -1.129 13.379 1.00 0.00 C ATOM 393 O GLY A 121 72.779 0.005 12.985 1.00 0.00 O ATOM 0 H GLY A 121 70.793 -0.915 12.155 1.00 0.00 H new ATOM 0 HA2 GLY A 121 71.610 -2.188 14.687 1.00 0.00 H new ATOM 0 HA3 GLY A 121 72.047 -3.081 13.244 1.00 0.00 H new ATOM 397 N GLU A 122 74.177 -1.566 13.605 1.00 0.00 N ATOM 398 CA GLU A 122 75.343 -0.665 13.377 1.00 0.00 C ATOM 399 C GLU A 122 75.850 -0.818 11.941 1.00 0.00 C ATOM 400 O GLU A 122 75.993 -1.913 11.440 1.00 0.00 O ATOM 401 CB GLU A 122 76.410 -1.123 14.374 1.00 0.00 C ATOM 402 CG GLU A 122 76.115 -0.523 15.750 1.00 0.00 C ATOM 403 CD GLU A 122 77.246 -0.881 16.716 1.00 0.00 C ATOM 404 OE1 GLU A 122 78.326 -1.193 16.244 1.00 0.00 O ATOM 405 OE2 GLU A 122 77.013 -0.835 17.913 1.00 0.00 O ATOM 0 H GLU A 122 74.407 -2.503 13.936 1.00 0.00 H new ATOM 0 HA GLU A 122 75.085 0.385 13.517 1.00 0.00 H new ATOM 0 HB2 GLU A 122 76.422 -2.211 14.435 1.00 0.00 H new ATOM 0 HB3 GLU A 122 77.398 -0.812 14.034 1.00 0.00 H new ATOM 0 HG2 GLU A 122 76.017 0.560 15.673 1.00 0.00 H new ATOM 0 HG3 GLU A 122 75.166 -0.903 16.128 1.00 0.00 H new ATOM 412 N VAL A 123 76.127 0.270 11.278 1.00 0.00 N ATOM 413 CA VAL A 123 76.632 0.183 9.877 1.00 0.00 C ATOM 414 C VAL A 123 78.101 0.576 9.808 1.00 0.00 C ATOM 415 O VAL A 123 78.515 1.596 10.324 1.00 0.00 O ATOM 416 CB VAL A 123 75.761 1.156 9.064 1.00 0.00 C ATOM 417 CG1 VAL A 123 76.574 1.788 7.928 1.00 0.00 C ATOM 418 CG2 VAL A 123 74.611 0.376 8.439 1.00 0.00 C ATOM 0 H VAL A 123 76.026 1.216 11.645 1.00 0.00 H new ATOM 0 HA VAL A 123 76.567 -0.832 9.486 1.00 0.00 H new ATOM 0 HB VAL A 123 75.396 1.938 9.729 1.00 0.00 H new ATOM 0 HG11 VAL A 123 75.940 2.473 7.365 1.00 0.00 H new ATOM 0 HG12 VAL A 123 77.419 2.336 8.346 1.00 0.00 H new ATOM 0 HG13 VAL A 123 76.942 1.005 7.265 1.00 0.00 H new ATOM 0 HG21 VAL A 123 73.984 1.054 7.859 1.00 0.00 H new ATOM 0 HG22 VAL A 123 75.010 -0.399 7.784 1.00 0.00 H new ATOM 0 HG23 VAL A 123 74.014 -0.086 9.226 1.00 0.00 H new ATOM 428 N VAL A 124 78.880 -0.213 9.133 1.00 0.00 N ATOM 429 CA VAL A 124 80.312 0.120 8.977 1.00 0.00 C ATOM 430 C VAL A 124 80.453 0.976 7.729 1.00 0.00 C ATOM 431 O VAL A 124 81.381 1.750 7.591 1.00 0.00 O ATOM 432 CB VAL A 124 81.027 -1.223 8.788 1.00 0.00 C ATOM 433 CG1 VAL A 124 82.283 -1.030 7.927 1.00 0.00 C ATOM 434 CG2 VAL A 124 81.428 -1.785 10.154 1.00 0.00 C ATOM 0 H VAL A 124 78.583 -1.078 8.681 1.00 0.00 H new ATOM 0 HA VAL A 124 80.726 0.664 9.826 1.00 0.00 H new ATOM 0 HB VAL A 124 80.353 -1.919 8.289 1.00 0.00 H new ATOM 0 HG11 VAL A 124 82.786 -1.988 7.797 1.00 0.00 H new ATOM 0 HG12 VAL A 124 81.998 -0.634 6.952 1.00 0.00 H new ATOM 0 HG13 VAL A 124 82.958 -0.330 8.420 1.00 0.00 H new ATOM 0 HG21 VAL A 124 81.936 -2.740 10.020 1.00 0.00 H new ATOM 0 HG22 VAL A 124 82.098 -1.085 10.653 1.00 0.00 H new ATOM 0 HG23 VAL A 124 80.536 -1.931 10.763 1.00 0.00 H new ATOM 444 N ASP A 125 79.547 0.827 6.802 1.00 0.00 N ATOM 445 CA ASP A 125 79.662 1.625 5.560 1.00 0.00 C ATOM 446 C ASP A 125 78.295 1.959 4.951 1.00 0.00 C ATOM 447 O ASP A 125 77.288 1.350 5.254 1.00 0.00 O ATOM 448 CB ASP A 125 80.471 0.751 4.603 1.00 0.00 C ATOM 449 CG ASP A 125 81.939 1.181 4.634 1.00 0.00 C ATOM 450 OD1 ASP A 125 82.233 2.166 5.292 1.00 0.00 O ATOM 451 OD2 ASP A 125 82.743 0.519 3.999 1.00 0.00 O ATOM 0 H ASP A 125 78.746 0.197 6.853 1.00 0.00 H new ATOM 0 HA ASP A 125 80.135 2.587 5.759 1.00 0.00 H new ATOM 0 HB2 ASP A 125 80.382 -0.297 4.888 1.00 0.00 H new ATOM 0 HB3 ASP A 125 80.076 0.840 3.591 1.00 0.00 H new ATOM 456 N CYS A 126 78.281 2.928 4.074 1.00 0.00 N ATOM 457 CA CYS A 126 77.023 3.348 3.387 1.00 0.00 C ATOM 458 C CYS A 126 77.405 4.207 2.192 1.00 0.00 C ATOM 459 O CYS A 126 78.375 4.939 2.233 1.00 0.00 O ATOM 460 CB CYS A 126 76.236 4.154 4.421 1.00 0.00 C ATOM 461 SG CYS A 126 74.524 4.340 3.866 1.00 0.00 S ATOM 0 H CYS A 126 79.108 3.458 3.799 1.00 0.00 H new ATOM 0 HA CYS A 126 76.426 2.511 3.026 1.00 0.00 H new ATOM 0 HB2 CYS A 126 76.263 3.651 5.387 1.00 0.00 H new ATOM 0 HB3 CYS A 126 76.693 5.134 4.559 1.00 0.00 H new ATOM 0 HG CYS A 126 73.722 3.843 4.760 1.00 0.00 H new ATOM 467 N THR A 127 76.697 4.099 1.106 1.00 0.00 N ATOM 468 CA THR A 127 77.096 4.886 -0.084 1.00 0.00 C ATOM 469 C THR A 127 75.894 5.240 -0.972 1.00 0.00 C ATOM 470 O THR A 127 74.799 4.740 -0.799 1.00 0.00 O ATOM 471 CB THR A 127 78.058 3.930 -0.801 1.00 0.00 C ATOM 472 OG1 THR A 127 79.388 4.192 -0.377 1.00 0.00 O ATOM 473 CG2 THR A 127 77.962 4.106 -2.312 1.00 0.00 C ATOM 0 H THR A 127 75.873 3.509 0.993 1.00 0.00 H new ATOM 0 HA THR A 127 77.539 5.849 0.169 1.00 0.00 H new ATOM 0 HB THR A 127 77.784 2.905 -0.551 1.00 0.00 H new ATOM 0 HG1 THR A 127 79.374 4.584 0.521 1.00 0.00 H new ATOM 0 HG21 THR A 127 78.652 3.419 -2.803 1.00 0.00 H new ATOM 0 HG22 THR A 127 76.944 3.893 -2.639 1.00 0.00 H new ATOM 0 HG23 THR A 127 78.221 5.131 -2.576 1.00 0.00 H new ATOM 481 N LEU A 128 76.123 6.084 -1.942 1.00 0.00 N ATOM 482 CA LEU A 128 75.046 6.475 -2.894 1.00 0.00 C ATOM 483 C LEU A 128 75.506 6.115 -4.308 1.00 0.00 C ATOM 484 O LEU A 128 76.665 6.262 -4.641 1.00 0.00 O ATOM 485 CB LEU A 128 74.896 7.995 -2.734 1.00 0.00 C ATOM 486 CG LEU A 128 74.305 8.605 -4.013 1.00 0.00 C ATOM 487 CD1 LEU A 128 72.852 8.158 -4.175 1.00 0.00 C ATOM 488 CD2 LEU A 128 74.356 10.132 -3.921 1.00 0.00 C ATOM 0 H LEU A 128 77.026 6.525 -2.117 1.00 0.00 H new ATOM 0 HA LEU A 128 74.097 5.971 -2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 128 74.251 8.217 -1.884 1.00 0.00 H new ATOM 0 HB3 LEU A 128 75.867 8.444 -2.523 1.00 0.00 H new ATOM 0 HG LEU A 128 74.886 8.269 -4.872 1.00 0.00 H new ATOM 0 HD11 LEU A 128 72.437 8.593 -5.084 1.00 0.00 H new ATOM 0 HD12 LEU A 128 72.811 7.071 -4.242 1.00 0.00 H new ATOM 0 HD13 LEU A 128 72.271 8.491 -3.315 1.00 0.00 H new ATOM 0 HD21 LEU A 128 73.937 10.565 -4.829 1.00 0.00 H new ATOM 0 HD22 LEU A 128 73.777 10.464 -3.059 1.00 0.00 H new ATOM 0 HD23 LEU A 128 75.391 10.455 -3.809 1.00 0.00 H new ATOM 673 N PHE A 140 69.795 5.483 -6.799 1.00 0.00 N ATOM 674 CA PHE A 140 70.015 4.281 -5.940 1.00 0.00 C ATOM 675 C PHE A 140 71.407 4.310 -5.320 1.00 0.00 C ATOM 676 O PHE A 140 72.315 4.911 -5.848 1.00 0.00 O ATOM 677 CB PHE A 140 69.831 3.067 -6.858 1.00 0.00 C ATOM 678 CG PHE A 140 71.059 2.840 -7.704 1.00 0.00 C ATOM 679 CD1 PHE A 140 71.232 3.567 -8.882 1.00 0.00 C ATOM 680 CD2 PHE A 140 72.012 1.888 -7.320 1.00 0.00 C ATOM 681 CE1 PHE A 140 72.359 3.347 -9.683 1.00 0.00 C ATOM 682 CE2 PHE A 140 73.142 1.666 -8.117 1.00 0.00 C ATOM 683 CZ PHE A 140 73.315 2.396 -9.301 1.00 0.00 C ATOM 0 HA PHE A 140 69.313 4.246 -5.107 1.00 0.00 H new ATOM 0 HB2 PHE A 140 69.629 2.180 -6.258 1.00 0.00 H new ATOM 0 HB3 PHE A 140 68.965 3.221 -7.501 1.00 0.00 H new ATOM 0 HD1 PHE A 140 70.496 4.300 -9.176 1.00 0.00 H new ATOM 0 HD2 PHE A 140 71.875 1.325 -6.409 1.00 0.00 H new ATOM 0 HE1 PHE A 140 72.492 3.910 -10.595 1.00 0.00 H new ATOM 0 HE2 PHE A 140 73.878 0.934 -7.820 1.00 0.00 H new ATOM 0 HZ PHE A 140 74.184 2.226 -9.919 1.00 0.00 H new ATOM 693 N GLY A 141 71.571 3.674 -4.188 1.00 0.00 N ATOM 694 CA GLY A 141 72.900 3.668 -3.513 1.00 0.00 C ATOM 695 C GLY A 141 73.090 2.343 -2.774 1.00 0.00 C ATOM 696 O GLY A 141 72.390 1.382 -3.022 1.00 0.00 O ATOM 0 H GLY A 141 70.838 3.157 -3.702 1.00 0.00 H new ATOM 0 HA2 GLY A 141 73.694 3.804 -4.248 1.00 0.00 H new ATOM 0 HA3 GLY A 141 72.968 4.500 -2.813 1.00 0.00 H new ATOM 700 N PHE A 142 74.036 2.276 -1.877 1.00 0.00 N ATOM 701 CA PHE A 142 74.263 0.998 -1.144 1.00 0.00 C ATOM 702 C PHE A 142 74.329 1.227 0.368 1.00 0.00 C ATOM 703 O PHE A 142 74.364 2.342 0.848 1.00 0.00 O ATOM 704 CB PHE A 142 75.613 0.481 -1.641 1.00 0.00 C ATOM 705 CG PHE A 142 75.445 -0.234 -2.956 1.00 0.00 C ATOM 706 CD1 PHE A 142 75.045 0.474 -4.095 1.00 0.00 C ATOM 707 CD2 PHE A 142 75.696 -1.607 -3.035 1.00 0.00 C ATOM 708 CE1 PHE A 142 74.893 -0.192 -5.314 1.00 0.00 C ATOM 709 CE2 PHE A 142 75.545 -2.275 -4.258 1.00 0.00 C ATOM 710 CZ PHE A 142 75.142 -1.564 -5.397 1.00 0.00 C ATOM 0 H PHE A 142 74.657 3.044 -1.621 1.00 0.00 H new ATOM 0 HA PHE A 142 73.450 0.295 -1.324 1.00 0.00 H new ATOM 0 HB2 PHE A 142 76.308 1.312 -1.757 1.00 0.00 H new ATOM 0 HB3 PHE A 142 76.045 -0.196 -0.904 1.00 0.00 H new ATOM 0 HD1 PHE A 142 74.854 1.535 -4.032 1.00 0.00 H new ATOM 0 HD2 PHE A 142 76.006 -2.152 -2.155 1.00 0.00 H new ATOM 0 HE1 PHE A 142 74.583 0.354 -6.192 1.00 0.00 H new ATOM 0 HE2 PHE A 142 75.739 -3.336 -4.323 1.00 0.00 H new ATOM 0 HZ PHE A 142 75.024 -2.078 -6.340 1.00 0.00 H new ATOM 720 N VAL A 143 74.367 0.155 1.109 1.00 0.00 N ATOM 721 CA VAL A 143 74.457 0.246 2.592 1.00 0.00 C ATOM 722 C VAL A 143 75.283 -0.938 3.090 1.00 0.00 C ATOM 723 O VAL A 143 75.240 -2.010 2.525 1.00 0.00 O ATOM 724 CB VAL A 143 73.010 0.162 3.095 1.00 0.00 C ATOM 725 CG1 VAL A 143 72.986 -0.318 4.549 1.00 0.00 C ATOM 726 CG2 VAL A 143 72.363 1.547 3.008 1.00 0.00 C ATOM 0 H VAL A 143 74.339 -0.796 0.742 1.00 0.00 H new ATOM 0 HA VAL A 143 74.932 1.162 2.944 1.00 0.00 H new ATOM 0 HB VAL A 143 72.457 -0.545 2.477 1.00 0.00 H new ATOM 0 HG11 VAL A 143 71.954 -0.374 4.897 1.00 0.00 H new ATOM 0 HG12 VAL A 143 73.445 -1.304 4.614 1.00 0.00 H new ATOM 0 HG13 VAL A 143 73.541 0.383 5.173 1.00 0.00 H new ATOM 0 HG21 VAL A 143 71.335 1.491 3.365 1.00 0.00 H new ATOM 0 HG22 VAL A 143 72.923 2.250 3.625 1.00 0.00 H new ATOM 0 HG23 VAL A 143 72.370 1.887 1.973 1.00 0.00 H new ATOM 736 N LEU A 144 76.046 -0.758 4.124 1.00 0.00 N ATOM 737 CA LEU A 144 76.872 -1.886 4.622 1.00 0.00 C ATOM 738 C LEU A 144 76.684 -2.042 6.130 1.00 0.00 C ATOM 739 O LEU A 144 77.167 -1.251 6.915 1.00 0.00 O ATOM 740 CB LEU A 144 78.303 -1.488 4.270 1.00 0.00 C ATOM 741 CG LEU A 144 78.731 -2.219 2.993 1.00 0.00 C ATOM 742 CD1 LEU A 144 77.930 -1.691 1.796 1.00 0.00 C ATOM 743 CD2 LEU A 144 80.224 -1.985 2.749 1.00 0.00 C ATOM 0 H LEU A 144 76.134 0.115 4.644 1.00 0.00 H new ATOM 0 HA LEU A 144 76.603 -2.846 4.182 1.00 0.00 H new ATOM 0 HB2 LEU A 144 78.368 -0.410 4.125 1.00 0.00 H new ATOM 0 HB3 LEU A 144 78.975 -1.740 5.090 1.00 0.00 H new ATOM 0 HG LEU A 144 78.541 -3.286 3.110 1.00 0.00 H new ATOM 0 HD11 LEU A 144 78.239 -2.215 0.892 1.00 0.00 H new ATOM 0 HD12 LEU A 144 76.867 -1.859 1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 144 78.114 -0.623 1.678 1.00 0.00 H new ATOM 0 HD21 LEU A 144 80.530 -2.504 1.841 1.00 0.00 H new ATOM 0 HD22 LEU A 144 80.411 -0.917 2.637 1.00 0.00 H new ATOM 0 HD23 LEU A 144 80.795 -2.367 3.595 1.00 0.00 H new ATOM 755 N PHE A 145 75.964 -3.053 6.536 1.00 0.00 N ATOM 756 CA PHE A 145 75.718 -3.261 7.990 1.00 0.00 C ATOM 757 C PHE A 145 76.929 -3.900 8.665 1.00 0.00 C ATOM 758 O PHE A 145 77.830 -4.398 8.019 1.00 0.00 O ATOM 759 CB PHE A 145 74.513 -4.198 8.057 1.00 0.00 C ATOM 760 CG PHE A 145 73.246 -3.382 8.012 1.00 0.00 C ATOM 761 CD1 PHE A 145 72.902 -2.562 9.092 1.00 0.00 C ATOM 762 CD2 PHE A 145 72.417 -3.441 6.886 1.00 0.00 C ATOM 763 CE1 PHE A 145 71.729 -1.800 9.047 1.00 0.00 C ATOM 764 CE2 PHE A 145 71.244 -2.681 6.841 1.00 0.00 C ATOM 765 CZ PHE A 145 70.899 -1.860 7.921 1.00 0.00 C ATOM 0 H PHE A 145 75.535 -3.745 5.921 1.00 0.00 H new ATOM 0 HA PHE A 145 75.539 -2.319 8.508 1.00 0.00 H new ATOM 0 HB2 PHE A 145 74.537 -4.900 7.224 1.00 0.00 H new ATOM 0 HB3 PHE A 145 74.547 -4.788 8.973 1.00 0.00 H new ATOM 0 HD1 PHE A 145 73.542 -2.517 9.961 1.00 0.00 H new ATOM 0 HD2 PHE A 145 72.683 -4.073 6.052 1.00 0.00 H new ATOM 0 HE1 PHE A 145 71.464 -1.166 9.880 1.00 0.00 H new ATOM 0 HE2 PHE A 145 70.604 -2.728 5.972 1.00 0.00 H new ATOM 0 HZ PHE A 145 69.993 -1.273 7.886 1.00 0.00 H new ATOM 775 N LYS A 146 76.950 -3.881 9.966 1.00 0.00 N ATOM 776 CA LYS A 146 78.093 -4.479 10.712 1.00 0.00 C ATOM 777 C LYS A 146 77.929 -5.999 10.812 1.00 0.00 C ATOM 778 O LYS A 146 78.898 -6.732 10.836 1.00 0.00 O ATOM 779 CB LYS A 146 78.025 -3.839 12.100 1.00 0.00 C ATOM 780 CG LYS A 146 79.113 -4.437 12.997 1.00 0.00 C ATOM 781 CD LYS A 146 79.405 -3.477 14.153 1.00 0.00 C ATOM 782 CE LYS A 146 79.590 -4.273 15.447 1.00 0.00 C ATOM 783 NZ LYS A 146 80.892 -4.979 15.284 1.00 0.00 N ATOM 0 H LYS A 146 76.220 -3.474 10.551 1.00 0.00 H new ATOM 0 HA LYS A 146 79.049 -4.299 10.221 1.00 0.00 H new ATOM 0 HB2 LYS A 146 78.158 -2.760 12.021 1.00 0.00 H new ATOM 0 HB3 LYS A 146 77.043 -4.008 12.541 1.00 0.00 H new ATOM 0 HG2 LYS A 146 78.789 -5.403 13.385 1.00 0.00 H new ATOM 0 HG3 LYS A 146 80.020 -4.614 12.419 1.00 0.00 H new ATOM 0 HD2 LYS A 146 80.303 -2.897 13.939 1.00 0.00 H new ATOM 0 HD3 LYS A 146 78.586 -2.767 14.265 1.00 0.00 H new ATOM 0 HE2 LYS A 146 79.604 -3.615 16.316 1.00 0.00 H new ATOM 0 HE3 LYS A 146 78.774 -4.980 15.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 81.220 -5.321 16.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 80.771 -5.787 14.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 81.595 -4.323 14.888 1.00 0.00 H new ATOM 797 N GLU A 147 76.716 -6.481 10.877 1.00 0.00 N ATOM 798 CA GLU A 147 76.511 -7.956 10.984 1.00 0.00 C ATOM 799 C GLU A 147 75.278 -8.390 10.182 1.00 0.00 C ATOM 800 O GLU A 147 74.345 -7.633 9.996 1.00 0.00 O ATOM 801 CB GLU A 147 76.302 -8.219 12.477 1.00 0.00 C ATOM 802 CG GLU A 147 75.406 -7.130 13.076 1.00 0.00 C ATOM 803 CD GLU A 147 74.419 -7.759 14.059 1.00 0.00 C ATOM 804 OE1 GLU A 147 74.755 -8.781 14.634 1.00 0.00 O ATOM 805 OE2 GLU A 147 73.342 -7.208 14.220 1.00 0.00 O ATOM 0 H GLU A 147 75.863 -5.922 10.861 1.00 0.00 H new ATOM 0 HA GLU A 147 77.356 -8.517 10.583 1.00 0.00 H new ATOM 0 HB2 GLU A 147 75.846 -9.198 12.623 1.00 0.00 H new ATOM 0 HB3 GLU A 147 77.263 -8.235 12.991 1.00 0.00 H new ATOM 0 HG2 GLU A 147 76.015 -6.383 13.585 1.00 0.00 H new ATOM 0 HG3 GLU A 147 74.865 -6.613 12.283 1.00 0.00 H new ATOM 812 N SER A 148 75.267 -9.607 9.709 1.00 0.00 N ATOM 813 CA SER A 148 74.095 -10.089 8.925 1.00 0.00 C ATOM 814 C SER A 148 72.804 -9.812 9.695 1.00 0.00 C ATOM 815 O SER A 148 71.805 -9.410 9.131 1.00 0.00 O ATOM 816 CB SER A 148 74.311 -11.593 8.766 1.00 0.00 C ATOM 817 OG SER A 148 75.693 -11.849 8.550 1.00 0.00 O ATOM 0 H SER A 148 76.018 -10.287 9.832 1.00 0.00 H new ATOM 0 HA SER A 148 74.008 -9.589 7.960 1.00 0.00 H new ATOM 0 HB2 SER A 148 73.967 -12.118 9.657 1.00 0.00 H new ATOM 0 HB3 SER A 148 73.724 -11.970 7.928 1.00 0.00 H new ATOM 0 HG SER A 148 76.096 -12.186 9.377 1.00 0.00 H new ATOM 823 N GLU A 149 72.817 -10.025 10.982 1.00 0.00 N ATOM 824 CA GLU A 149 71.592 -9.774 11.790 1.00 0.00 C ATOM 825 C GLU A 149 71.012 -8.398 11.455 1.00 0.00 C ATOM 826 O GLU A 149 69.907 -8.285 10.962 1.00 0.00 O ATOM 827 CB GLU A 149 72.056 -9.820 13.245 1.00 0.00 C ATOM 828 CG GLU A 149 71.063 -10.640 14.071 1.00 0.00 C ATOM 829 CD GLU A 149 71.765 -11.189 15.314 1.00 0.00 C ATOM 830 OE1 GLU A 149 72.485 -12.165 15.181 1.00 0.00 O ATOM 831 OE2 GLU A 149 71.570 -10.625 16.377 1.00 0.00 O ATOM 0 H GLU A 149 73.623 -10.362 11.508 1.00 0.00 H new ATOM 0 HA GLU A 149 70.810 -10.507 11.591 1.00 0.00 H new ATOM 0 HB2 GLU A 149 73.050 -10.263 13.307 1.00 0.00 H new ATOM 0 HB3 GLU A 149 72.132 -8.809 13.646 1.00 0.00 H new ATOM 0 HG2 GLU A 149 70.216 -10.019 14.363 1.00 0.00 H new ATOM 0 HG3 GLU A 149 70.666 -11.460 13.473 1.00 0.00 H new ATOM 838 N SER A 150 71.746 -7.351 11.717 1.00 0.00 N ATOM 839 CA SER A 150 71.229 -5.988 11.408 1.00 0.00 C ATOM 840 C SER A 150 70.667 -5.953 9.985 1.00 0.00 C ATOM 841 O SER A 150 69.683 -5.292 9.709 1.00 0.00 O ATOM 842 CB SER A 150 72.438 -5.056 11.533 1.00 0.00 C ATOM 843 OG SER A 150 73.577 -5.669 10.941 1.00 0.00 O ATOM 0 H SER A 150 72.678 -7.380 12.130 1.00 0.00 H new ATOM 0 HA SER A 150 70.423 -5.691 12.079 1.00 0.00 H new ATOM 0 HB2 SER A 150 72.229 -4.105 11.043 1.00 0.00 H new ATOM 0 HB3 SER A 150 72.634 -4.838 12.583 1.00 0.00 H new ATOM 0 HG SER A 150 73.292 -6.434 10.399 1.00 0.00 H new ATOM 849 N VAL A 151 71.279 -6.663 9.077 1.00 0.00 N ATOM 850 CA VAL A 151 70.772 -6.666 7.676 1.00 0.00 C ATOM 851 C VAL A 151 69.420 -7.382 7.600 1.00 0.00 C ATOM 852 O VAL A 151 68.456 -6.849 7.089 1.00 0.00 O ATOM 853 CB VAL A 151 71.825 -7.418 6.865 1.00 0.00 C ATOM 854 CG1 VAL A 151 71.598 -7.156 5.376 1.00 0.00 C ATOM 855 CG2 VAL A 151 73.221 -6.927 7.257 1.00 0.00 C ATOM 0 H VAL A 151 72.104 -7.239 9.244 1.00 0.00 H new ATOM 0 HA VAL A 151 70.617 -5.656 7.297 1.00 0.00 H new ATOM 0 HB VAL A 151 71.745 -8.486 7.068 1.00 0.00 H new ATOM 0 HG11 VAL A 151 72.348 -7.691 4.794 1.00 0.00 H new ATOM 0 HG12 VAL A 151 70.604 -7.502 5.093 1.00 0.00 H new ATOM 0 HG13 VAL A 151 71.680 -6.087 5.178 1.00 0.00 H new ATOM 0 HG21 VAL A 151 73.972 -7.464 6.678 1.00 0.00 H new ATOM 0 HG22 VAL A 151 73.302 -5.859 7.054 1.00 0.00 H new ATOM 0 HG23 VAL A 151 73.385 -7.107 8.319 1.00 0.00 H new ATOM 865 N ASP A 152 69.335 -8.584 8.104 1.00 0.00 N ATOM 866 CA ASP A 152 68.036 -9.315 8.052 1.00 0.00 C ATOM 867 C ASP A 152 66.950 -8.494 8.757 1.00 0.00 C ATOM 868 O ASP A 152 65.801 -8.491 8.360 1.00 0.00 O ATOM 869 CB ASP A 152 68.296 -10.651 8.770 1.00 0.00 C ATOM 870 CG ASP A 152 67.942 -10.545 10.260 1.00 0.00 C ATOM 871 OD1 ASP A 152 66.762 -10.533 10.568 1.00 0.00 O ATOM 872 OD2 ASP A 152 68.857 -10.478 11.062 1.00 0.00 O ATOM 0 H ASP A 152 70.103 -9.088 8.547 1.00 0.00 H new ATOM 0 HA ASP A 152 67.685 -9.482 7.034 1.00 0.00 H new ATOM 0 HB2 ASP A 152 67.704 -11.440 8.306 1.00 0.00 H new ATOM 0 HB3 ASP A 152 69.344 -10.931 8.659 1.00 0.00 H new ATOM 877 N LYS A 153 67.310 -7.798 9.801 1.00 0.00 N ATOM 878 CA LYS A 153 66.305 -6.976 10.535 1.00 0.00 C ATOM 879 C LYS A 153 65.800 -5.840 9.643 1.00 0.00 C ATOM 880 O LYS A 153 64.655 -5.443 9.719 1.00 0.00 O ATOM 881 CB LYS A 153 67.054 -6.415 11.743 1.00 0.00 C ATOM 882 CG LYS A 153 66.415 -6.945 13.030 1.00 0.00 C ATOM 883 CD LYS A 153 67.488 -7.602 13.899 1.00 0.00 C ATOM 884 CE LYS A 153 66.826 -8.568 14.885 1.00 0.00 C ATOM 885 NZ LYS A 153 66.957 -9.910 14.255 1.00 0.00 N ATOM 0 H LYS A 153 68.257 -7.763 10.178 1.00 0.00 H new ATOM 0 HA LYS A 153 65.434 -7.559 10.832 1.00 0.00 H new ATOM 0 HB2 LYS A 153 68.104 -6.704 11.700 1.00 0.00 H new ATOM 0 HB3 LYS A 153 67.022 -5.326 11.730 1.00 0.00 H new ATOM 0 HG2 LYS A 153 65.939 -6.130 13.575 1.00 0.00 H new ATOM 0 HG3 LYS A 153 65.634 -7.666 12.790 1.00 0.00 H new ATOM 0 HD2 LYS A 153 68.201 -8.137 13.272 1.00 0.00 H new ATOM 0 HD3 LYS A 153 68.049 -6.840 14.441 1.00 0.00 H new ATOM 0 HE2 LYS A 153 67.318 -8.539 15.857 1.00 0.00 H new ATOM 0 HE3 LYS A 153 65.780 -8.309 15.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 66.526 -10.627 14.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 66.473 -9.910 13.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 67.964 -10.132 14.117 1.00 0.00 H new ATOM 899 N VAL A 154 66.642 -5.309 8.797 1.00 0.00 N ATOM 900 CA VAL A 154 66.194 -4.198 7.909 1.00 0.00 C ATOM 901 C VAL A 154 65.588 -4.759 6.619 1.00 0.00 C ATOM 902 O VAL A 154 64.847 -4.087 5.929 1.00 0.00 O ATOM 903 CB VAL A 154 67.460 -3.379 7.620 1.00 0.00 C ATOM 904 CG1 VAL A 154 68.351 -4.115 6.616 1.00 0.00 C ATOM 905 CG2 VAL A 154 67.063 -2.022 7.041 1.00 0.00 C ATOM 0 H VAL A 154 67.615 -5.594 8.683 1.00 0.00 H new ATOM 0 HA VAL A 154 65.420 -3.585 8.371 1.00 0.00 H new ATOM 0 HB VAL A 154 68.012 -3.241 8.550 1.00 0.00 H new ATOM 0 HG11 VAL A 154 69.245 -3.523 6.420 1.00 0.00 H new ATOM 0 HG12 VAL A 154 68.639 -5.083 7.027 1.00 0.00 H new ATOM 0 HG13 VAL A 154 67.804 -4.264 5.685 1.00 0.00 H new ATOM 0 HG21 VAL A 154 67.960 -1.438 6.835 1.00 0.00 H new ATOM 0 HG22 VAL A 154 66.506 -2.170 6.116 1.00 0.00 H new ATOM 0 HG23 VAL A 154 66.440 -1.488 7.759 1.00 0.00 H new ATOM 915 N MET A 155 65.888 -5.987 6.294 1.00 0.00 N ATOM 916 CA MET A 155 65.317 -6.585 5.055 1.00 0.00 C ATOM 917 C MET A 155 63.975 -7.250 5.367 1.00 0.00 C ATOM 918 O MET A 155 63.125 -7.384 4.510 1.00 0.00 O ATOM 919 CB MET A 155 66.338 -7.628 4.600 1.00 0.00 C ATOM 920 CG MET A 155 65.834 -8.310 3.326 1.00 0.00 C ATOM 921 SD MET A 155 67.106 -9.434 2.697 1.00 0.00 S ATOM 922 CE MET A 155 66.017 -10.447 1.665 1.00 0.00 C ATOM 0 H MET A 155 66.502 -6.600 6.831 1.00 0.00 H new ATOM 0 HA MET A 155 65.135 -5.837 4.283 1.00 0.00 H new ATOM 0 HB2 MET A 155 67.302 -7.153 4.415 1.00 0.00 H new ATOM 0 HB3 MET A 155 66.493 -8.368 5.385 1.00 0.00 H new ATOM 0 HG2 MET A 155 64.917 -8.862 3.535 1.00 0.00 H new ATOM 0 HG3 MET A 155 65.591 -7.561 2.572 1.00 0.00 H new ATOM 0 HE1 MET A 155 66.602 -11.222 1.170 1.00 0.00 H new ATOM 0 HE2 MET A 155 65.253 -10.911 2.289 1.00 0.00 H new ATOM 0 HE3 MET A 155 65.539 -9.818 0.914 1.00 0.00 H new ATOM 932 N ASP A 156 63.776 -7.664 6.589 1.00 0.00 N ATOM 933 CA ASP A 156 62.485 -8.314 6.950 1.00 0.00 C ATOM 934 C ASP A 156 61.320 -7.417 6.521 1.00 0.00 C ATOM 935 O ASP A 156 60.261 -7.889 6.155 1.00 0.00 O ATOM 936 CB ASP A 156 62.529 -8.475 8.474 1.00 0.00 C ATOM 937 CG ASP A 156 62.214 -7.139 9.152 1.00 0.00 C ATOM 938 OD1 ASP A 156 62.693 -6.125 8.671 1.00 0.00 O ATOM 939 OD2 ASP A 156 61.500 -7.153 10.141 1.00 0.00 O ATOM 0 H ASP A 156 64.450 -7.580 7.350 1.00 0.00 H new ATOM 0 HA ASP A 156 62.344 -9.275 6.456 1.00 0.00 H new ATOM 0 HB2 ASP A 156 61.809 -9.230 8.789 1.00 0.00 H new ATOM 0 HB3 ASP A 156 63.514 -8.825 8.782 1.00 0.00 H new ATOM 944 N GLN A 157 61.513 -6.126 6.554 1.00 0.00 N ATOM 945 CA GLN A 157 60.423 -5.196 6.140 1.00 0.00 C ATOM 946 C GLN A 157 60.977 -4.160 5.161 1.00 0.00 C ATOM 947 O GLN A 157 61.443 -3.112 5.557 1.00 0.00 O ATOM 948 CB GLN A 157 59.961 -4.518 7.431 1.00 0.00 C ATOM 949 CG GLN A 157 58.583 -5.053 7.823 1.00 0.00 C ATOM 950 CD GLN A 157 58.742 -6.151 8.876 1.00 0.00 C ATOM 951 OE1 GLN A 157 58.619 -7.322 8.573 1.00 0.00 O ATOM 952 NE2 GLN A 157 59.012 -5.822 10.110 1.00 0.00 N ATOM 0 H GLN A 157 62.379 -5.675 6.850 1.00 0.00 H new ATOM 0 HA GLN A 157 59.603 -5.712 5.641 1.00 0.00 H new ATOM 0 HB2 GLN A 157 60.677 -4.708 8.230 1.00 0.00 H new ATOM 0 HB3 GLN A 157 59.917 -3.438 7.292 1.00 0.00 H new ATOM 0 HG2 GLN A 157 57.966 -4.245 8.215 1.00 0.00 H new ATOM 0 HG3 GLN A 157 58.071 -5.448 6.945 1.00 0.00 H new ATOM 0 HE21 GLN A 157 59.115 -4.840 10.365 1.00 0.00 H new ATOM 0 HE22 GLN A 157 59.120 -6.547 10.819 1.00 0.00 H new ATOM 961 N LYS A 158 60.939 -4.444 3.886 1.00 0.00 N ATOM 962 CA LYS A 158 61.479 -3.468 2.894 1.00 0.00 C ATOM 963 C LYS A 158 60.438 -2.411 2.545 1.00 0.00 C ATOM 964 O LYS A 158 60.568 -1.699 1.570 1.00 0.00 O ATOM 965 CB LYS A 158 61.854 -4.299 1.665 1.00 0.00 C ATOM 966 CG LYS A 158 60.591 -4.650 0.876 1.00 0.00 C ATOM 967 CD LYS A 158 60.675 -6.101 0.398 1.00 0.00 C ATOM 968 CE LYS A 158 61.032 -6.127 -1.090 1.00 0.00 C ATOM 969 NZ LYS A 158 62.476 -5.768 -1.145 1.00 0.00 N ATOM 0 H LYS A 158 60.560 -5.304 3.490 1.00 0.00 H new ATOM 0 HA LYS A 158 62.339 -2.927 3.289 1.00 0.00 H new ATOM 0 HB2 LYS A 158 62.546 -3.741 1.034 1.00 0.00 H new ATOM 0 HB3 LYS A 158 62.367 -5.210 1.973 1.00 0.00 H new ATOM 0 HG2 LYS A 158 59.709 -4.512 1.501 1.00 0.00 H new ATOM 0 HG3 LYS A 158 60.485 -3.980 0.023 1.00 0.00 H new ATOM 0 HD2 LYS A 158 61.427 -6.642 0.973 1.00 0.00 H new ATOM 0 HD3 LYS A 158 59.723 -6.606 0.564 1.00 0.00 H new ATOM 0 HE2 LYS A 158 60.853 -7.112 -1.522 1.00 0.00 H new ATOM 0 HE3 LYS A 158 60.427 -5.417 -1.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 62.845 -5.960 -2.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 62.591 -4.758 -0.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 63.001 -6.335 -0.449 1.00 0.00 H new ATOM 983 N GLU A 159 59.436 -2.262 3.358 1.00 0.00 N ATOM 984 CA GLU A 159 58.437 -1.203 3.089 1.00 0.00 C ATOM 985 C GLU A 159 58.964 0.051 3.755 1.00 0.00 C ATOM 986 O GLU A 159 58.416 0.561 4.712 1.00 0.00 O ATOM 987 CB GLU A 159 57.158 -1.663 3.759 1.00 0.00 C ATOM 988 CG GLU A 159 56.237 -2.314 2.725 1.00 0.00 C ATOM 989 CD GLU A 159 55.003 -2.884 3.425 1.00 0.00 C ATOM 990 OE1 GLU A 159 54.111 -2.111 3.733 1.00 0.00 O ATOM 991 OE2 GLU A 159 54.970 -4.084 3.642 1.00 0.00 O ATOM 0 H GLU A 159 59.267 -2.825 4.192 1.00 0.00 H new ATOM 0 HA GLU A 159 58.259 -1.013 2.031 1.00 0.00 H new ATOM 0 HB2 GLU A 159 57.388 -2.373 4.553 1.00 0.00 H new ATOM 0 HB3 GLU A 159 56.655 -0.815 4.225 1.00 0.00 H new ATOM 0 HG2 GLU A 159 55.937 -1.580 1.977 1.00 0.00 H new ATOM 0 HG3 GLU A 159 56.768 -3.107 2.198 1.00 0.00 H new ATOM 998 N HIS A 160 60.071 0.502 3.269 1.00 0.00 N ATOM 999 CA HIS A 160 60.737 1.686 3.863 1.00 0.00 C ATOM 1000 C HIS A 160 60.199 2.982 3.257 1.00 0.00 C ATOM 1001 O HIS A 160 59.225 2.991 2.533 1.00 0.00 O ATOM 1002 CB HIS A 160 62.208 1.532 3.488 1.00 0.00 C ATOM 1003 CG HIS A 160 62.804 0.352 4.198 1.00 0.00 C ATOM 1004 ND1 HIS A 160 64.155 0.313 4.551 1.00 0.00 N ATOM 1005 CD2 HIS A 160 62.269 -0.846 4.617 1.00 0.00 C ATOM 1006 CE1 HIS A 160 64.387 -0.869 5.150 1.00 0.00 C ATOM 1007 NE2 HIS A 160 63.276 -1.585 5.204 1.00 0.00 N ATOM 0 H HIS A 160 60.556 0.095 2.469 1.00 0.00 H new ATOM 0 HA HIS A 160 60.569 1.739 4.939 1.00 0.00 H new ATOM 0 HB2 HIS A 160 62.304 1.403 2.410 1.00 0.00 H new ATOM 0 HB3 HIS A 160 62.754 2.438 3.751 1.00 0.00 H new ATOM 0 HD2 HIS A 160 61.240 -1.154 4.506 1.00 0.00 H new ATOM 0 HE1 HIS A 160 65.345 -1.188 5.533 1.00 0.00 H new ATOM 0 HE2 HIS A 160 63.181 -2.517 5.607 1.00 0.00 H new ATOM 1015 N LYS A 161 60.849 4.074 3.550 1.00 0.00 N ATOM 1016 CA LYS A 161 60.419 5.392 3.005 1.00 0.00 C ATOM 1017 C LYS A 161 61.329 6.484 3.568 1.00 0.00 C ATOM 1018 O LYS A 161 60.905 7.328 4.333 1.00 0.00 O ATOM 1019 CB LYS A 161 58.981 5.586 3.490 1.00 0.00 C ATOM 1020 CG LYS A 161 58.459 6.943 3.011 1.00 0.00 C ATOM 1021 CD LYS A 161 57.055 6.772 2.427 1.00 0.00 C ATOM 1022 CE LYS A 161 56.157 6.071 3.450 1.00 0.00 C ATOM 1023 NZ LYS A 161 55.090 5.422 2.640 1.00 0.00 N ATOM 0 H LYS A 161 61.671 4.109 4.152 1.00 0.00 H new ATOM 0 HA LYS A 161 60.477 5.437 1.917 1.00 0.00 H new ATOM 0 HB2 LYS A 161 58.347 4.786 3.109 1.00 0.00 H new ATOM 0 HB3 LYS A 161 58.943 5.533 4.578 1.00 0.00 H new ATOM 0 HG2 LYS A 161 58.436 7.649 3.841 1.00 0.00 H new ATOM 0 HG3 LYS A 161 59.130 7.358 2.258 1.00 0.00 H new ATOM 0 HD2 LYS A 161 56.637 7.745 2.167 1.00 0.00 H new ATOM 0 HD3 LYS A 161 57.101 6.188 1.508 1.00 0.00 H new ATOM 0 HE2 LYS A 161 56.716 5.336 4.029 1.00 0.00 H new ATOM 0 HE3 LYS A 161 55.736 6.783 4.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 54.433 4.920 3.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 54.571 6.147 2.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 55.520 4.745 1.978 1.00 0.00 H new ATOM 1037 N LEU A 162 62.582 6.465 3.205 1.00 0.00 N ATOM 1038 CA LEU A 162 63.526 7.493 3.729 1.00 0.00 C ATOM 1039 C LEU A 162 63.771 8.567 2.673 1.00 0.00 C ATOM 1040 O LEU A 162 63.574 8.351 1.495 1.00 0.00 O ATOM 1041 CB LEU A 162 64.816 6.728 4.038 1.00 0.00 C ATOM 1042 CG LEU A 162 65.355 6.078 2.762 1.00 0.00 C ATOM 1043 CD1 LEU A 162 66.636 6.794 2.327 1.00 0.00 C ATOM 1044 CD2 LEU A 162 65.664 4.604 3.035 1.00 0.00 C ATOM 0 H LEU A 162 62.993 5.782 2.568 1.00 0.00 H new ATOM 0 HA LEU A 162 63.138 8.002 4.612 1.00 0.00 H new ATOM 0 HB2 LEU A 162 65.561 7.407 4.453 1.00 0.00 H new ATOM 0 HB3 LEU A 162 64.625 5.965 4.792 1.00 0.00 H new ATOM 0 HG LEU A 162 64.609 6.155 1.971 1.00 0.00 H new ATOM 0 HD11 LEU A 162 67.021 6.331 1.418 1.00 0.00 H new ATOM 0 HD12 LEU A 162 66.418 7.845 2.135 1.00 0.00 H new ATOM 0 HD13 LEU A 162 67.383 6.716 3.117 1.00 0.00 H new ATOM 0 HD21 LEU A 162 66.048 4.139 2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 162 66.411 4.529 3.825 1.00 0.00 H new ATOM 0 HD23 LEU A 162 64.753 4.093 3.347 1.00 0.00 H new ATOM 1056 N ASN A 163 64.191 9.732 3.085 1.00 0.00 N ATOM 1057 CA ASN A 163 64.433 10.819 2.099 1.00 0.00 C ATOM 1058 C ASN A 163 63.136 11.123 1.347 1.00 0.00 C ATOM 1059 O ASN A 163 63.138 11.765 0.315 1.00 0.00 O ATOM 1060 CB ASN A 163 65.494 10.262 1.148 1.00 0.00 C ATOM 1061 CG ASN A 163 66.745 11.140 1.205 1.00 0.00 C ATOM 1062 OD1 ASN A 163 67.260 11.552 0.184 1.00 0.00 O ATOM 1063 ND2 ASN A 163 67.259 11.446 2.365 1.00 0.00 N ATOM 0 H ASN A 163 64.376 9.976 4.058 1.00 0.00 H new ATOM 0 HA ASN A 163 64.762 11.748 2.566 1.00 0.00 H new ATOM 0 HB2 ASN A 163 65.743 9.238 1.425 1.00 0.00 H new ATOM 0 HB3 ASN A 163 65.105 10.231 0.130 1.00 0.00 H new ATOM 0 HD21 ASN A 163 68.093 12.031 2.415 1.00 0.00 H new ATOM 0 HD22 ASN A 163 66.827 11.100 3.222 1.00 0.00 H new ATOM 1070 N GLY A 164 62.027 10.661 1.859 1.00 0.00 N ATOM 1071 CA GLY A 164 60.726 10.914 1.181 1.00 0.00 C ATOM 1072 C GLY A 164 60.551 9.921 0.033 1.00 0.00 C ATOM 1073 O GLY A 164 59.796 10.152 -0.890 1.00 0.00 O ATOM 0 H GLY A 164 61.967 10.118 2.720 1.00 0.00 H new ATOM 0 HA2 GLY A 164 59.907 10.812 1.893 1.00 0.00 H new ATOM 0 HA3 GLY A 164 60.694 11.935 0.801 1.00 0.00 H new ATOM 1077 N LYS A 165 61.247 8.816 0.078 1.00 0.00 N ATOM 1078 CA LYS A 165 61.118 7.816 -1.019 1.00 0.00 C ATOM 1079 C LYS A 165 61.373 6.400 -0.494 1.00 0.00 C ATOM 1080 O LYS A 165 62.183 6.188 0.390 1.00 0.00 O ATOM 1081 CB LYS A 165 62.194 8.207 -2.035 1.00 0.00 C ATOM 1082 CG LYS A 165 61.622 8.104 -3.449 1.00 0.00 C ATOM 1083 CD LYS A 165 62.635 7.405 -4.358 1.00 0.00 C ATOM 1084 CE LYS A 165 63.319 8.441 -5.253 1.00 0.00 C ATOM 1085 NZ LYS A 165 62.354 8.690 -6.359 1.00 0.00 N ATOM 0 H LYS A 165 61.896 8.564 0.824 1.00 0.00 H new ATOM 0 HA LYS A 165 60.118 7.814 -1.453 1.00 0.00 H new ATOM 0 HB2 LYS A 165 62.538 9.224 -1.844 1.00 0.00 H new ATOM 0 HB3 LYS A 165 63.060 7.553 -1.933 1.00 0.00 H new ATOM 0 HG2 LYS A 165 60.685 7.547 -3.434 1.00 0.00 H new ATOM 0 HG3 LYS A 165 61.396 9.098 -3.835 1.00 0.00 H new ATOM 0 HD2 LYS A 165 63.378 6.881 -3.757 1.00 0.00 H new ATOM 0 HD3 LYS A 165 62.134 6.655 -4.970 1.00 0.00 H new ATOM 0 HE2 LYS A 165 63.534 9.357 -4.703 1.00 0.00 H new ATOM 0 HE3 LYS A 165 64.269 8.067 -5.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 62.819 9.242 -7.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 62.030 7.782 -6.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 61.538 9.221 -5.994 1.00 0.00 H new ATOM 1099 N VAL A 166 60.699 5.428 -1.047 1.00 0.00 N ATOM 1100 CA VAL A 166 60.913 4.023 -0.601 1.00 0.00 C ATOM 1101 C VAL A 166 62.221 3.500 -1.203 1.00 0.00 C ATOM 1102 O VAL A 166 62.874 4.186 -1.965 1.00 0.00 O ATOM 1103 CB VAL A 166 59.713 3.246 -1.146 1.00 0.00 C ATOM 1104 CG1 VAL A 166 59.798 1.787 -0.695 1.00 0.00 C ATOM 1105 CG2 VAL A 166 58.421 3.869 -0.610 1.00 0.00 C ATOM 0 H VAL A 166 60.009 5.547 -1.789 1.00 0.00 H new ATOM 0 HA VAL A 166 60.990 3.926 0.482 1.00 0.00 H new ATOM 0 HB VAL A 166 59.717 3.289 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 166 58.942 1.235 -1.084 1.00 0.00 H new ATOM 0 HG12 VAL A 166 60.719 1.342 -1.073 1.00 0.00 H new ATOM 0 HG13 VAL A 166 59.794 1.742 0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 166 57.564 3.318 -0.996 1.00 0.00 H new ATOM 0 HG22 VAL A 166 58.420 3.824 0.479 1.00 0.00 H new ATOM 0 HG23 VAL A 166 58.358 4.909 -0.931 1.00 0.00 H new ATOM 1115 N ILE A 167 62.620 2.305 -0.869 1.00 0.00 N ATOM 1116 CA ILE A 167 63.900 1.777 -1.434 1.00 0.00 C ATOM 1117 C ILE A 167 63.807 0.281 -1.732 1.00 0.00 C ATOM 1118 O ILE A 167 62.912 -0.408 -1.284 1.00 0.00 O ATOM 1119 CB ILE A 167 64.972 2.013 -0.360 1.00 0.00 C ATOM 1120 CG1 ILE A 167 64.341 1.985 1.036 1.00 0.00 C ATOM 1121 CG2 ILE A 167 65.650 3.361 -0.592 1.00 0.00 C ATOM 1122 CD1 ILE A 167 65.338 1.394 2.032 1.00 0.00 C ATOM 0 H ILE A 167 62.125 1.675 -0.238 1.00 0.00 H new ATOM 0 HA ILE A 167 64.133 2.279 -2.373 1.00 0.00 H new ATOM 0 HB ILE A 167 65.716 1.219 -0.427 1.00 0.00 H new ATOM 0 HG12 ILE A 167 64.060 2.993 1.341 1.00 0.00 H new ATOM 0 HG13 ILE A 167 63.428 1.390 1.022 1.00 0.00 H new ATOM 0 HG21 ILE A 167 66.409 3.523 0.173 1.00 0.00 H new ATOM 0 HG22 ILE A 167 66.119 3.368 -1.576 1.00 0.00 H new ATOM 0 HG23 ILE A 167 64.906 4.156 -0.539 1.00 0.00 H new ATOM 0 HD11 ILE A 167 64.891 1.373 3.026 1.00 0.00 H new ATOM 0 HD12 ILE A 167 65.597 0.379 1.729 1.00 0.00 H new ATOM 0 HD13 ILE A 167 66.239 2.007 2.052 1.00 0.00 H new ATOM 1134 N ASP A 168 64.757 -0.220 -2.472 1.00 0.00 N ATOM 1135 CA ASP A 168 64.782 -1.669 -2.799 1.00 0.00 C ATOM 1136 C ASP A 168 66.029 -2.287 -2.164 1.00 0.00 C ATOM 1137 O ASP A 168 67.051 -2.427 -2.806 1.00 0.00 O ATOM 1138 CB ASP A 168 64.858 -1.732 -4.325 1.00 0.00 C ATOM 1139 CG ASP A 168 64.964 -3.190 -4.774 1.00 0.00 C ATOM 1140 OD1 ASP A 168 64.570 -4.055 -4.010 1.00 0.00 O ATOM 1141 OD2 ASP A 168 65.437 -3.418 -5.875 1.00 0.00 O ATOM 0 H ASP A 168 65.525 0.322 -2.868 1.00 0.00 H new ATOM 0 HA ASP A 168 63.913 -2.212 -2.427 1.00 0.00 H new ATOM 0 HB2 ASP A 168 63.973 -1.270 -4.763 1.00 0.00 H new ATOM 0 HB3 ASP A 168 65.721 -1.168 -4.680 1.00 0.00 H new ATOM 1146 N PRO A 169 65.903 -2.609 -0.905 1.00 0.00 N ATOM 1147 CA PRO A 169 67.036 -3.191 -0.146 1.00 0.00 C ATOM 1148 C PRO A 169 67.297 -4.639 -0.567 1.00 0.00 C ATOM 1149 O PRO A 169 66.398 -5.456 -0.620 1.00 0.00 O ATOM 1150 CB PRO A 169 66.570 -3.120 1.305 1.00 0.00 C ATOM 1151 CG PRO A 169 65.075 -3.102 1.235 1.00 0.00 C ATOM 1152 CD PRO A 169 64.700 -2.463 -0.078 1.00 0.00 C ATOM 0 HA PRO A 169 67.974 -2.662 -0.317 1.00 0.00 H new ATOM 0 HB2 PRO A 169 66.927 -3.977 1.876 1.00 0.00 H new ATOM 0 HB3 PRO A 169 66.952 -2.226 1.798 1.00 0.00 H new ATOM 0 HG2 PRO A 169 64.674 -4.114 1.299 1.00 0.00 H new ATOM 0 HG3 PRO A 169 64.657 -2.540 2.070 1.00 0.00 H new ATOM 0 HD2 PRO A 169 63.842 -2.959 -0.532 1.00 0.00 H new ATOM 0 HD3 PRO A 169 64.430 -1.415 0.052 1.00 0.00 H new ATOM 1160 N LYS A 170 68.527 -4.957 -0.861 1.00 0.00 N ATOM 1161 CA LYS A 170 68.868 -6.346 -1.274 1.00 0.00 C ATOM 1162 C LYS A 170 70.294 -6.678 -0.860 1.00 0.00 C ATOM 1163 O LYS A 170 70.902 -5.988 -0.066 1.00 0.00 O ATOM 1164 CB LYS A 170 68.777 -6.354 -2.792 1.00 0.00 C ATOM 1165 CG LYS A 170 67.653 -7.291 -3.238 1.00 0.00 C ATOM 1166 CD LYS A 170 66.908 -6.669 -4.421 1.00 0.00 C ATOM 1167 CE LYS A 170 65.825 -7.634 -4.909 1.00 0.00 C ATOM 1168 NZ LYS A 170 66.339 -8.173 -6.199 1.00 0.00 N ATOM 0 H LYS A 170 69.315 -4.310 -0.833 1.00 0.00 H new ATOM 0 HA LYS A 170 68.202 -7.075 -0.813 1.00 0.00 H new ATOM 0 HB2 LYS A 170 68.589 -5.345 -3.160 1.00 0.00 H new ATOM 0 HB3 LYS A 170 69.725 -6.678 -3.221 1.00 0.00 H new ATOM 0 HG2 LYS A 170 68.064 -8.260 -3.522 1.00 0.00 H new ATOM 0 HG3 LYS A 170 66.963 -7.467 -2.413 1.00 0.00 H new ATOM 0 HD2 LYS A 170 66.458 -5.722 -4.123 1.00 0.00 H new ATOM 0 HD3 LYS A 170 67.606 -6.450 -5.229 1.00 0.00 H new ATOM 0 HE2 LYS A 170 65.655 -8.433 -4.188 1.00 0.00 H new ATOM 0 HE3 LYS A 170 64.873 -7.121 -5.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 65.649 -8.843 -6.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 66.485 -7.391 -6.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 67.242 -8.662 -6.036 1.00 0.00 H new ATOM 1182 N ARG A 171 70.837 -7.724 -1.406 1.00 0.00 N ATOM 1183 CA ARG A 171 72.231 -8.092 -1.059 1.00 0.00 C ATOM 1184 C ARG A 171 73.207 -7.425 -2.030 1.00 0.00 C ATOM 1185 O ARG A 171 72.826 -6.609 -2.844 1.00 0.00 O ATOM 1186 CB ARG A 171 72.288 -9.615 -1.179 1.00 0.00 C ATOM 1187 CG ARG A 171 72.821 -10.205 0.128 1.00 0.00 C ATOM 1188 CD ARG A 171 73.354 -11.617 -0.127 1.00 0.00 C ATOM 1189 NE ARG A 171 72.342 -12.525 0.480 1.00 0.00 N ATOM 1190 CZ ARG A 171 71.596 -13.274 -0.283 1.00 0.00 C ATOM 1191 NH1 ARG A 171 70.587 -12.752 -0.926 1.00 0.00 N ATOM 1192 NH2 ARG A 171 71.859 -14.547 -0.404 1.00 0.00 N ATOM 0 H ARG A 171 70.377 -8.339 -2.077 1.00 0.00 H new ATOM 0 HA ARG A 171 72.511 -7.762 -0.058 1.00 0.00 H new ATOM 0 HB2 ARG A 171 71.296 -10.012 -1.393 1.00 0.00 H new ATOM 0 HB3 ARG A 171 72.932 -9.902 -2.010 1.00 0.00 H new ATOM 0 HG2 ARG A 171 73.614 -9.573 0.528 1.00 0.00 H new ATOM 0 HG3 ARG A 171 72.029 -10.234 0.876 1.00 0.00 H new ATOM 0 HD2 ARG A 171 73.468 -11.809 -1.194 1.00 0.00 H new ATOM 0 HD3 ARG A 171 74.334 -11.757 0.329 1.00 0.00 H new ATOM 0 HE ARG A 171 72.232 -12.561 1.493 1.00 0.00 H new ATOM 0 HH11 ARG A 171 70.382 -11.757 -0.832 1.00 0.00 H new ATOM 0 HH12 ARG A 171 70.004 -13.339 -1.523 1.00 0.00 H new ATOM 0 HH21 ARG A 171 72.648 -14.955 0.098 1.00 0.00 H new ATOM 0 HH22 ARG A 171 71.276 -15.134 -1.001 1.00 0.00 H new