USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 973 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 92 SER OG : rot 81:sc= 1.31 USER MOD Set 1.2: A 94 ASN : amide:sc= -2.5 K(o=-1.2,f=-4.6!) USER MOD Set 1.3: A 124 GLN : amide:sc= 0 X(o=-1.2,f=-1.3) USER MOD Set 2.1: A 20 CYS SG : rot 113:sc= -0.345 USER MOD Set 2.2: A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 73:sc= 0.954 USER MOD Single : A 25 ASN : amide:sc= 0.144 X(o=0.14,f=0) USER MOD Single : A 29 HIS : no HD1:sc= -0.127 X(o=-0.13,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= -0.0272 USER MOD Single : A 34 TYR OH : rot 130:sc= -0.122 USER MOD Single : A 38 HIS : no HD1:sc= -2.28 X(o=-2.3,f=-2.4) USER MOD Single : A 42 GLN : amide:sc= -0.564 K(o=-0.56,f=-1.2) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot -6:sc= -0.163 USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 59 GLN : amide:sc= -1.46 K(o=-1.5,f=-2) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.085 X(o=-0.085,f=-0.18) USER MOD Single : A 70 CYS SG : rot 68:sc= -1.25 USER MOD Single : A 71 TYR OH : rot 165:sc= -1.01 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot 55:sc= 0.173 USER MOD Single : A 102 THR OG1 : rot -43:sc= 0.908 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.584 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 170:sc= -0.992 USER MOD Single : A 109 SER OG : rot -30:sc= -2.78! USER MOD Single : A 117 THR OG1 : rot -78:sc= 1.07 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= -0.0216 K(o=-0.022,f=-0.56) USER MOD Single : A 126 ASN : amide:sc= -2.05 K(o=-2,f=-2.8) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc=-0.00521 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.261 K(o=-0.26,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 63 N VAL A 14 -6.157 7.256 -4.134 1.00 73.15 N ATOM 64 CA VAL A 14 -6.453 7.805 -2.816 1.00 60.44 C ATOM 65 C VAL A 14 -5.313 8.687 -2.320 1.00 51.02 C ATOM 66 O VAL A 14 -4.178 8.232 -2.180 1.00 30.02 O ATOM 67 CB VAL A 14 -6.708 6.687 -1.788 1.00 1.25 C ATOM 68 CG1 VAL A 14 -5.543 5.710 -1.761 1.00 62.40 C ATOM 69 CG2 VAL A 14 -6.949 7.279 -0.407 1.00 52.32 C ATOM 0 HA VAL A 14 -7.356 8.407 -2.918 1.00 60.44 H new ATOM 0 HB VAL A 14 -7.603 6.140 -2.086 1.00 1.25 H new ATOM 0 HG11 VAL A 14 -5.741 4.927 -1.029 1.00 62.40 H new ATOM 0 HG12 VAL A 14 -5.421 5.262 -2.747 1.00 62.40 H new ATOM 0 HG13 VAL A 14 -4.630 6.240 -1.488 1.00 62.40 H new ATOM 0 HG21 VAL A 14 -7.128 6.475 0.307 1.00 52.32 H new ATOM 0 HG22 VAL A 14 -6.074 7.851 -0.099 1.00 52.32 H new ATOM 0 HG23 VAL A 14 -7.819 7.935 -0.439 1.00 52.32 H new ATOM 79 N SER A 15 -5.623 9.952 -2.055 1.00 55.14 N ATOM 80 CA SER A 15 -4.624 10.900 -1.577 1.00 52.45 C ATOM 81 C SER A 15 -5.248 11.908 -0.617 1.00 4.43 C ATOM 82 O SER A 15 -6.413 12.279 -0.757 1.00 72.33 O ATOM 83 CB SER A 15 -3.981 11.633 -2.756 1.00 65.13 C ATOM 84 OG SER A 15 -2.602 11.321 -2.859 1.00 50.13 O ATOM 0 H SER A 15 -6.558 10.344 -2.163 1.00 55.14 H new ATOM 0 HA SER A 15 -3.856 10.342 -1.042 1.00 52.45 H new ATOM 0 HB2 SER A 15 -4.489 11.358 -3.680 1.00 65.13 H new ATOM 0 HB3 SER A 15 -4.106 12.709 -2.631 1.00 65.13 H new ATOM 0 HG SER A 15 -2.214 11.800 -3.621 1.00 50.13 H new ATOM 90 N VAL A 16 -4.462 12.349 0.361 1.00 62.03 N ATOM 91 CA VAL A 16 -4.935 13.315 1.345 1.00 24.12 C ATOM 92 C VAL A 16 -5.057 14.707 0.735 1.00 62.42 C ATOM 93 O VAL A 16 -4.087 15.252 0.209 1.00 53.03 O ATOM 94 CB VAL A 16 -3.994 13.381 2.563 1.00 11.31 C ATOM 95 CG1 VAL A 16 -2.572 13.692 2.123 1.00 24.01 C ATOM 96 CG2 VAL A 16 -4.490 14.415 3.563 1.00 44.43 C ATOM 0 H VAL A 16 -3.495 12.052 0.492 1.00 62.03 H new ATOM 0 HA VAL A 16 -5.919 12.978 1.672 1.00 24.12 H new ATOM 0 HB VAL A 16 -3.992 12.407 3.052 1.00 11.31 H new ATOM 0 HG11 VAL A 16 -1.922 13.735 2.997 1.00 24.01 H new ATOM 0 HG12 VAL A 16 -2.221 12.912 1.447 1.00 24.01 H new ATOM 0 HG13 VAL A 16 -2.552 14.653 1.609 1.00 24.01 H new ATOM 0 HG21 VAL A 16 -3.814 14.449 4.417 1.00 44.43 H new ATOM 0 HG22 VAL A 16 -4.523 15.395 3.087 1.00 44.43 H new ATOM 0 HG23 VAL A 16 -5.490 14.143 3.902 1.00 44.43 H new ATOM 106 N ALA A 17 -6.255 15.276 0.809 1.00 13.23 N ATOM 107 CA ALA A 17 -6.504 16.606 0.266 1.00 32.14 C ATOM 108 C ALA A 17 -5.864 17.683 1.136 1.00 20.41 C ATOM 109 O ALA A 17 -5.547 17.445 2.302 1.00 52.22 O ATOM 110 CB ALA A 17 -8.000 16.851 0.135 1.00 31.14 C ATOM 0 H ALA A 17 -7.069 14.837 1.240 1.00 13.23 H new ATOM 0 HA ALA A 17 -6.050 16.658 -0.724 1.00 32.14 H new ATOM 0 HB1 ALA A 17 -8.171 17.848 -0.272 1.00 31.14 H new ATOM 0 HB2 ALA A 17 -8.433 16.107 -0.533 1.00 31.14 H new ATOM 0 HB3 ALA A 17 -8.469 16.774 1.116 1.00 31.14 H new ATOM 116 N ASP A 18 -5.676 18.866 0.562 1.00 62.41 N ATOM 117 CA ASP A 18 -5.073 19.979 1.285 1.00 13.42 C ATOM 118 C ASP A 18 -5.858 20.290 2.556 1.00 52.22 C ATOM 119 O ASP A 18 -5.276 20.589 3.598 1.00 33.31 O ATOM 120 CB ASP A 18 -5.011 21.220 0.393 1.00 5.22 C ATOM 121 CG ASP A 18 -3.857 21.169 -0.590 1.00 35.12 C ATOM 122 OD1 ASP A 18 -2.719 20.894 -0.156 1.00 30.13 O ATOM 123 OD2 ASP A 18 -4.094 21.403 -1.793 1.00 64.23 O ATOM 0 H ASP A 18 -5.933 19.079 -0.402 1.00 62.41 H new ATOM 0 HA ASP A 18 -4.060 19.692 1.566 1.00 13.42 H new ATOM 0 HB2 ASP A 18 -5.948 21.317 -0.156 1.00 5.22 H new ATOM 0 HB3 ASP A 18 -4.914 22.108 1.017 1.00 5.22 H new ATOM 128 N GLU A 19 -7.182 20.219 2.460 1.00 72.10 N ATOM 129 CA GLU A 19 -8.046 20.495 3.602 1.00 70.22 C ATOM 130 C GLU A 19 -7.708 19.578 4.774 1.00 74.43 C ATOM 131 O GLU A 19 -7.677 20.011 5.926 1.00 13.11 O ATOM 132 CB GLU A 19 -9.515 20.322 3.212 1.00 74.14 C ATOM 133 CG GLU A 19 -9.847 18.935 2.686 1.00 5.13 C ATOM 134 CD GLU A 19 -10.875 18.963 1.573 1.00 51.35 C ATOM 135 OE1 GLU A 19 -10.699 19.753 0.621 1.00 21.33 O ATOM 136 OE2 GLU A 19 -11.857 18.195 1.653 1.00 44.13 O ATOM 0 H GLU A 19 -7.679 19.973 1.604 1.00 72.10 H new ATOM 0 HA GLU A 19 -7.879 21.527 3.910 1.00 70.22 H new ATOM 0 HB2 GLU A 19 -10.140 20.531 4.081 1.00 74.14 H new ATOM 0 HB3 GLU A 19 -9.769 21.060 2.451 1.00 74.14 H new ATOM 0 HG2 GLU A 19 -8.936 18.461 2.322 1.00 5.13 H new ATOM 0 HG3 GLU A 19 -10.220 18.320 3.505 1.00 5.13 H new ATOM 143 N CYS A 20 -7.457 18.309 4.471 1.00 41.02 N ATOM 144 CA CYS A 20 -7.123 17.329 5.498 1.00 2.24 C ATOM 145 C CYS A 20 -5.783 17.659 6.149 1.00 14.12 C ATOM 146 O CYS A 20 -5.647 17.614 7.372 1.00 72.51 O ATOM 147 CB CYS A 20 -7.079 15.924 4.897 1.00 31.44 C ATOM 148 SG CYS A 20 -8.705 15.161 4.684 1.00 44.20 S ATOM 0 H CYS A 20 -7.479 17.935 3.522 1.00 41.02 H new ATOM 0 HA CYS A 20 -7.897 17.364 6.264 1.00 2.24 H new ATOM 0 HB2 CYS A 20 -6.581 15.970 3.928 1.00 31.44 H new ATOM 0 HB3 CYS A 20 -6.471 15.285 5.538 1.00 31.44 H new ATOM 0 HG CYS A 20 -8.956 15.022 3.416 1.00 44.20 H new ATOM 154 N VAL A 21 -4.796 17.990 5.323 1.00 4.04 N ATOM 155 CA VAL A 21 -3.466 18.327 5.818 1.00 11.01 C ATOM 156 C VAL A 21 -3.518 19.525 6.760 1.00 25.41 C ATOM 157 O VAL A 21 -2.825 19.559 7.778 1.00 33.31 O ATOM 158 CB VAL A 21 -2.499 18.639 4.661 1.00 52.44 C ATOM 159 CG1 VAL A 21 -1.099 18.906 5.192 1.00 61.25 C ATOM 160 CG2 VAL A 21 -2.488 17.499 3.654 1.00 54.35 C ATOM 0 H VAL A 21 -4.892 18.032 4.308 1.00 4.04 H new ATOM 0 HA VAL A 21 -3.100 17.456 6.362 1.00 11.01 H new ATOM 0 HB VAL A 21 -2.846 19.539 4.153 1.00 52.44 H new ATOM 0 HG11 VAL A 21 -0.430 19.125 4.360 1.00 61.25 H new ATOM 0 HG12 VAL A 21 -1.124 19.758 5.871 1.00 61.25 H new ATOM 0 HG13 VAL A 21 -0.739 18.027 5.726 1.00 61.25 H new ATOM 0 HG21 VAL A 21 -1.799 17.736 2.843 1.00 54.35 H new ATOM 0 HG22 VAL A 21 -2.166 16.581 4.147 1.00 54.35 H new ATOM 0 HG23 VAL A 21 -3.491 17.361 3.250 1.00 54.35 H new ATOM 170 N THR A 22 -4.343 20.508 6.415 1.00 73.45 N ATOM 171 CA THR A 22 -4.485 21.708 7.228 1.00 13.14 C ATOM 172 C THR A 22 -5.208 21.404 8.536 1.00 72.14 C ATOM 173 O THR A 22 -4.836 21.909 9.594 1.00 43.41 O ATOM 174 CB THR A 22 -5.253 22.810 6.475 1.00 54.23 C ATOM 175 OG1 THR A 22 -4.806 22.878 5.116 1.00 4.03 O ATOM 176 CG2 THR A 22 -5.059 24.161 7.146 1.00 1.31 C ATOM 0 H THR A 22 -4.924 20.496 5.577 1.00 73.45 H new ATOM 0 HA THR A 22 -3.477 22.062 7.446 1.00 13.14 H new ATOM 0 HB THR A 22 -6.314 22.561 6.496 1.00 54.23 H new ATOM 0 HG1 THR A 22 -5.148 22.105 4.620 1.00 4.03 H new ATOM 0 HG21 THR A 22 -5.611 24.923 6.596 1.00 1.31 H new ATOM 0 HG22 THR A 22 -5.428 24.115 8.171 1.00 1.31 H new ATOM 0 HG23 THR A 22 -3.999 24.415 7.153 1.00 1.31 H new ATOM 184 N ALA A 23 -6.243 20.574 8.455 1.00 52.22 N ATOM 185 CA ALA A 23 -7.017 20.201 9.632 1.00 25.45 C ATOM 186 C ALA A 23 -6.139 19.503 10.667 1.00 53.14 C ATOM 187 O ALA A 23 -6.156 19.854 11.847 1.00 25.44 O ATOM 188 CB ALA A 23 -8.182 19.306 9.237 1.00 41.14 C ATOM 0 H ALA A 23 -6.565 20.147 7.586 1.00 52.22 H new ATOM 0 HA ALA A 23 -7.410 21.113 10.081 1.00 25.45 H new ATOM 0 HB1 ALA A 23 -8.751 19.036 10.127 1.00 41.14 H new ATOM 0 HB2 ALA A 23 -8.829 19.838 8.540 1.00 41.14 H new ATOM 0 HB3 ALA A 23 -7.801 18.402 8.761 1.00 41.14 H new ATOM 194 N LEU A 24 -5.375 18.514 10.217 1.00 50.24 N ATOM 195 CA LEU A 24 -4.491 17.766 11.104 1.00 43.33 C ATOM 196 C LEU A 24 -3.334 18.638 11.582 1.00 52.43 C ATOM 197 O LEU A 24 -2.920 18.558 12.737 1.00 2.01 O ATOM 198 CB LEU A 24 -3.949 16.527 10.389 1.00 24.04 C ATOM 199 CG LEU A 24 -3.282 16.771 9.035 1.00 71.30 C ATOM 200 CD1 LEU A 24 -1.791 17.012 9.210 1.00 41.33 C ATOM 201 CD2 LEU A 24 -3.528 15.595 8.100 1.00 0.24 C ATOM 0 H LEU A 24 -5.350 18.211 9.243 1.00 50.24 H new ATOM 0 HA LEU A 24 -5.069 17.453 11.973 1.00 43.33 H new ATOM 0 HB2 LEU A 24 -3.227 16.041 11.045 1.00 24.04 H new ATOM 0 HB3 LEU A 24 -4.771 15.826 10.245 1.00 24.04 H new ATOM 0 HG LEU A 24 -3.723 17.663 8.590 1.00 71.30 H new ATOM 0 HD11 LEU A 24 -1.333 17.184 8.236 1.00 41.33 H new ATOM 0 HD12 LEU A 24 -1.635 17.886 9.843 1.00 41.33 H new ATOM 0 HD13 LEU A 24 -1.334 16.140 9.677 1.00 41.33 H new ATOM 0 HD21 LEU A 24 -3.046 15.786 7.141 1.00 0.24 H new ATOM 0 HD22 LEU A 24 -3.114 14.688 8.540 1.00 0.24 H new ATOM 0 HD23 LEU A 24 -4.600 15.469 7.949 1.00 0.24 H new ATOM 213 N ASN A 25 -2.819 19.473 10.685 1.00 71.14 N ATOM 214 CA ASN A 25 -1.711 20.362 11.015 1.00 32.23 C ATOM 215 C ASN A 25 -2.071 21.266 12.191 1.00 71.45 C ATOM 216 O ASN A 25 -1.291 21.418 13.131 1.00 15.30 O ATOM 217 CB ASN A 25 -1.332 21.212 9.801 1.00 72.00 C ATOM 218 CG ASN A 25 -0.381 22.338 10.158 1.00 53.13 C ATOM 219 OD1 ASN A 25 0.775 22.102 10.507 1.00 64.32 O ATOM 220 ND2 ASN A 25 -0.866 23.571 10.072 1.00 52.44 N ATOM 0 H ASN A 25 -3.151 19.552 9.724 1.00 71.14 H new ATOM 0 HA ASN A 25 -0.857 19.747 11.300 1.00 32.23 H new ATOM 0 HB2 ASN A 25 -0.871 20.576 9.045 1.00 72.00 H new ATOM 0 HB3 ASN A 25 -2.236 21.630 9.357 1.00 72.00 H new ATOM 0 HD21 ASN A 25 -0.273 24.369 10.300 1.00 52.44 H new ATOM 0 HD22 ASN A 25 -1.831 23.720 9.778 1.00 52.44 H new ATOM 227 N ASP A 26 -3.257 21.862 12.130 1.00 63.33 N ATOM 228 CA ASP A 26 -3.721 22.749 13.189 1.00 15.34 C ATOM 229 C ASP A 26 -4.096 21.956 14.437 1.00 32.03 C ATOM 230 O ASP A 26 -3.847 22.393 15.562 1.00 73.12 O ATOM 231 CB ASP A 26 -4.922 23.566 12.710 1.00 52.24 C ATOM 232 CG ASP A 26 -4.691 24.189 11.347 1.00 54.21 C ATOM 233 OD1 ASP A 26 -3.516 24.417 10.990 1.00 54.14 O ATOM 234 OD2 ASP A 26 -5.686 24.448 10.637 1.00 25.12 O ATOM 0 H ASP A 26 -3.914 21.747 11.358 1.00 63.33 H new ATOM 0 HA ASP A 26 -2.907 23.428 13.442 1.00 15.34 H new ATOM 0 HB2 ASP A 26 -5.802 22.924 12.668 1.00 52.24 H new ATOM 0 HB3 ASP A 26 -5.135 24.352 13.434 1.00 52.24 H new ATOM 239 N LEU A 27 -4.696 20.789 14.232 1.00 75.10 N ATOM 240 CA LEU A 27 -5.107 19.934 15.341 1.00 50.14 C ATOM 241 C LEU A 27 -3.915 19.575 16.222 1.00 41.03 C ATOM 242 O LEU A 27 -4.041 19.474 17.442 1.00 23.32 O ATOM 243 CB LEU A 27 -5.766 18.660 14.811 1.00 73.43 C ATOM 244 CG LEU A 27 -6.690 17.927 15.784 1.00 12.23 C ATOM 245 CD1 LEU A 27 -8.124 18.407 15.622 1.00 34.54 C ATOM 246 CD2 LEU A 27 -6.602 16.423 15.574 1.00 61.41 C ATOM 0 H LEU A 27 -4.909 20.413 13.308 1.00 75.10 H new ATOM 0 HA LEU A 27 -5.828 20.485 15.944 1.00 50.14 H new ATOM 0 HB2 LEU A 27 -6.339 18.915 13.920 1.00 73.43 H new ATOM 0 HB3 LEU A 27 -4.981 17.972 14.499 1.00 73.43 H new ATOM 0 HG LEU A 27 -6.366 18.151 16.800 1.00 12.23 H new ATOM 0 HD11 LEU A 27 -8.767 17.874 16.322 1.00 34.54 H new ATOM 0 HD12 LEU A 27 -8.175 19.477 15.824 1.00 34.54 H new ATOM 0 HD13 LEU A 27 -8.459 18.214 14.603 1.00 34.54 H new ATOM 0 HD21 LEU A 27 -7.266 15.918 16.275 1.00 61.41 H new ATOM 0 HD22 LEU A 27 -6.899 16.180 14.554 1.00 61.41 H new ATOM 0 HD23 LEU A 27 -5.577 16.091 15.742 1.00 61.41 H new ATOM 258 N ARG A 28 -2.758 19.386 15.595 1.00 32.21 N ATOM 259 CA ARG A 28 -1.543 19.039 16.322 1.00 11.23 C ATOM 260 C ARG A 28 -1.150 20.154 17.287 1.00 14.04 C ATOM 261 O ARG A 28 -0.469 19.915 18.285 1.00 35.42 O ATOM 262 CB ARG A 28 -0.398 18.769 15.345 1.00 43.32 C ATOM 263 CG ARG A 28 0.442 19.998 15.036 1.00 11.22 C ATOM 264 CD ARG A 28 1.104 19.892 13.672 1.00 63.25 C ATOM 265 NE ARG A 28 2.518 19.542 13.775 1.00 5.03 N ATOM 266 CZ ARG A 28 3.451 20.377 14.220 1.00 63.13 C ATOM 267 NH1 ARG A 28 3.121 21.603 14.600 1.00 43.42 N ATOM 268 NH2 ARG A 28 4.717 19.985 14.285 1.00 44.01 N ATOM 0 H ARG A 28 -2.637 19.467 14.585 1.00 32.21 H new ATOM 0 HA ARG A 28 -1.740 18.135 16.899 1.00 11.23 H new ATOM 0 HB2 ARG A 28 0.247 17.994 15.759 1.00 43.32 H new ATOM 0 HB3 ARG A 28 -0.810 18.378 14.415 1.00 43.32 H new ATOM 0 HG2 ARG A 28 -0.187 20.887 15.068 1.00 11.22 H new ATOM 0 HG3 ARG A 28 1.206 20.120 15.804 1.00 11.22 H new ATOM 0 HD2 ARG A 28 0.587 19.140 13.076 1.00 63.25 H new ATOM 0 HD3 ARG A 28 1.003 20.841 13.145 1.00 63.25 H new ATOM 0 HE ARG A 28 2.805 18.606 13.490 1.00 5.03 H new ATOM 0 HH11 ARG A 28 2.149 21.908 14.551 1.00 43.42 H new ATOM 0 HH12 ARG A 28 3.839 22.242 14.941 1.00 43.42 H new ATOM 0 HH21 ARG A 28 4.975 19.042 13.993 1.00 44.01 H new ATOM 0 HH22 ARG A 28 5.433 20.627 14.627 1.00 44.01 H new ATOM 282 N HIS A 29 -1.584 21.373 16.983 1.00 42.30 N ATOM 283 CA HIS A 29 -1.278 22.525 17.823 1.00 4.44 C ATOM 284 C HIS A 29 -2.397 22.777 18.829 1.00 21.03 C ATOM 285 O HIS A 29 -2.507 23.866 19.392 1.00 11.42 O ATOM 286 CB HIS A 29 -1.062 23.769 16.961 1.00 11.40 C ATOM 287 CG HIS A 29 0.287 24.395 17.138 1.00 24.41 C ATOM 288 ND1 HIS A 29 0.471 25.749 17.320 1.00 24.01 N ATOM 289 CD2 HIS A 29 1.523 23.842 17.162 1.00 32.02 C ATOM 290 CE1 HIS A 29 1.762 26.003 17.447 1.00 73.33 C ATOM 291 NE2 HIS A 29 2.422 24.862 17.355 1.00 15.20 N ATOM 0 H HIS A 29 -2.149 21.588 16.161 1.00 42.30 H new ATOM 0 HA HIS A 29 -0.361 22.309 18.372 1.00 4.44 H new ATOM 0 HB2 HIS A 29 -1.194 23.502 15.913 1.00 11.40 H new ATOM 0 HB3 HIS A 29 -1.829 24.505 17.202 1.00 11.40 H new ATOM 0 HD2 HIS A 29 1.758 22.794 17.050 1.00 32.02 H new ATOM 0 HE1 HIS A 29 2.202 26.977 17.600 1.00 73.33 H new ATOM 0 HE2 HIS A 29 3.435 24.756 17.417 1.00 15.20 H new ATOM 299 N LYS A 30 -3.226 21.763 19.050 1.00 32.42 N ATOM 300 CA LYS A 30 -4.337 21.872 19.988 1.00 11.21 C ATOM 301 C LYS A 30 -5.321 22.949 19.543 1.00 51.25 C ATOM 302 O LYS A 30 -5.749 23.783 20.341 1.00 2.01 O ATOM 303 CB LYS A 30 -3.817 22.191 21.392 1.00 60.13 C ATOM 304 CG LYS A 30 -4.825 21.910 22.492 1.00 13.23 C ATOM 305 CD LYS A 30 -4.605 22.814 23.694 1.00 73.11 C ATOM 306 CE LYS A 30 -3.281 22.517 24.380 1.00 63.52 C ATOM 307 NZ LYS A 30 -2.360 23.686 24.338 1.00 64.10 N ATOM 0 H LYS A 30 -3.149 20.855 18.592 1.00 32.42 H new ATOM 0 HA LYS A 30 -4.857 20.915 20.008 1.00 11.21 H new ATOM 0 HB2 LYS A 30 -2.916 21.606 21.578 1.00 60.13 H new ATOM 0 HB3 LYS A 30 -3.529 23.242 21.434 1.00 60.13 H new ATOM 0 HG2 LYS A 30 -5.835 22.054 22.107 1.00 13.23 H new ATOM 0 HG3 LYS A 30 -4.747 20.867 22.800 1.00 13.23 H new ATOM 0 HD2 LYS A 30 -4.625 23.856 23.375 1.00 73.11 H new ATOM 0 HD3 LYS A 30 -5.421 22.682 24.404 1.00 73.11 H new ATOM 0 HE2 LYS A 30 -3.464 22.236 25.417 1.00 63.52 H new ATOM 0 HE3 LYS A 30 -2.806 21.663 23.898 1.00 63.52 H new ATOM 0 HZ1 LYS A 30 -1.469 23.443 24.816 1.00 64.10 H new ATOM 0 HZ2 LYS A 30 -2.164 23.939 23.348 1.00 64.10 H new ATOM 0 HZ3 LYS A 30 -2.803 24.494 24.820 1.00 64.10 H new ATOM 321 N LYS A 31 -5.678 22.925 18.263 1.00 41.22 N ATOM 322 CA LYS A 31 -6.614 23.897 17.711 1.00 41.33 C ATOM 323 C LYS A 31 -8.041 23.593 18.156 1.00 64.41 C ATOM 324 O LYS A 31 -8.873 24.493 18.263 1.00 31.02 O ATOM 325 CB LYS A 31 -6.535 23.901 16.182 1.00 30.23 C ATOM 326 CG LYS A 31 -7.161 22.676 15.538 1.00 22.12 C ATOM 327 CD LYS A 31 -8.560 22.970 15.024 1.00 32.31 C ATOM 328 CE LYS A 31 -8.523 23.780 13.737 1.00 24.42 C ATOM 329 NZ LYS A 31 -9.650 23.430 12.829 1.00 42.51 N ATOM 0 H LYS A 31 -5.333 22.242 17.588 1.00 41.22 H new ATOM 0 HA LYS A 31 -6.338 24.883 18.086 1.00 41.33 H new ATOM 0 HB2 LYS A 31 -7.032 24.794 15.803 1.00 30.23 H new ATOM 0 HB3 LYS A 31 -5.489 23.965 15.881 1.00 30.23 H new ATOM 0 HG2 LYS A 31 -6.534 22.336 14.714 1.00 22.12 H new ATOM 0 HG3 LYS A 31 -7.202 21.863 16.263 1.00 22.12 H new ATOM 0 HD2 LYS A 31 -9.089 22.033 14.850 1.00 32.31 H new ATOM 0 HD3 LYS A 31 -9.120 23.516 15.783 1.00 32.31 H new ATOM 0 HE2 LYS A 31 -8.565 24.843 13.975 1.00 24.42 H new ATOM 0 HE3 LYS A 31 -7.577 23.606 13.225 1.00 24.42 H new ATOM 0 HZ1 LYS A 31 -9.589 24.003 11.963 1.00 42.51 H new ATOM 0 HZ2 LYS A 31 -9.596 22.422 12.581 1.00 42.51 H new ATOM 0 HZ3 LYS A 31 -10.553 23.620 13.308 1.00 42.51 H new ATOM 343 N SER A 32 -8.315 22.318 18.415 1.00 15.20 N ATOM 344 CA SER A 32 -9.642 21.895 18.847 1.00 74.23 C ATOM 345 C SER A 32 -9.553 20.683 19.770 1.00 43.35 C ATOM 346 O SER A 32 -9.674 20.807 20.988 1.00 10.33 O ATOM 347 CB SER A 32 -10.515 21.563 17.634 1.00 4.22 C ATOM 348 OG SER A 32 -11.551 22.516 17.476 1.00 54.11 O ATOM 0 H SER A 32 -7.636 21.561 18.333 1.00 15.20 H new ATOM 0 HA SER A 32 -10.096 22.718 19.399 1.00 74.23 H new ATOM 0 HB2 SER A 32 -9.899 21.538 16.735 1.00 4.22 H new ATOM 0 HB3 SER A 32 -10.946 20.569 17.753 1.00 4.22 H new ATOM 0 HG SER A 32 -12.093 22.283 16.694 1.00 54.11 H new ATOM 354 N ARG A 33 -9.339 19.512 19.179 1.00 74.01 N ATOM 355 CA ARG A 33 -9.235 18.277 19.947 1.00 45.04 C ATOM 356 C ARG A 33 -8.854 17.107 19.044 1.00 21.34 C ATOM 357 O ARG A 33 -7.740 16.588 19.121 1.00 71.34 O ATOM 358 CB ARG A 33 -10.556 17.979 20.656 1.00 35.13 C ATOM 359 CG ARG A 33 -10.459 16.860 21.681 1.00 40.23 C ATOM 360 CD ARG A 33 -9.984 17.379 23.029 1.00 41.32 C ATOM 361 NE ARG A 33 -10.680 16.735 24.140 1.00 64.25 N ATOM 362 CZ ARG A 33 -10.565 17.125 25.404 1.00 55.50 C ATOM 363 NH1 ARG A 33 -9.788 18.153 25.716 1.00 23.23 N ATOM 364 NH2 ARG A 33 -11.231 16.488 26.359 1.00 3.31 N ATOM 0 H ARG A 33 -9.234 19.393 18.171 1.00 74.01 H new ATOM 0 HA ARG A 33 -8.452 18.408 20.694 1.00 45.04 H new ATOM 0 HB2 ARG A 33 -10.905 18.885 21.152 1.00 35.13 H new ATOM 0 HB3 ARG A 33 -11.306 17.714 19.911 1.00 35.13 H new ATOM 0 HG2 ARG A 33 -11.433 16.385 21.796 1.00 40.23 H new ATOM 0 HG3 ARG A 33 -9.771 16.095 21.322 1.00 40.23 H new ATOM 0 HD2 ARG A 33 -8.912 17.209 23.126 1.00 41.32 H new ATOM 0 HD3 ARG A 33 -10.141 18.456 23.078 1.00 41.32 H new ATOM 0 HE ARG A 33 -11.288 15.942 23.934 1.00 64.25 H new ATOM 0 HH11 ARG A 33 -9.277 18.646 24.984 1.00 23.23 H new ATOM 0 HH12 ARG A 33 -9.702 18.450 26.688 1.00 23.23 H new ATOM 0 HH21 ARG A 33 -11.832 15.698 26.122 1.00 3.31 H new ATOM 0 HH22 ARG A 33 -11.142 16.788 27.330 1.00 3.31 H new ATOM 378 N TYR A 34 -9.786 16.696 18.192 1.00 52.41 N ATOM 379 CA TYR A 34 -9.550 15.586 17.277 1.00 21.33 C ATOM 380 C TYR A 34 -10.245 15.824 15.940 1.00 31.52 C ATOM 381 O TYR A 34 -11.234 16.552 15.862 1.00 12.33 O ATOM 382 CB TYR A 34 -10.042 14.276 17.895 1.00 71.43 C ATOM 383 CG TYR A 34 -11.498 14.307 18.302 1.00 41.51 C ATOM 384 CD1 TYR A 34 -12.505 14.095 17.369 1.00 72.43 C ATOM 385 CD2 TYR A 34 -11.866 14.551 19.619 1.00 12.41 C ATOM 386 CE1 TYR A 34 -13.837 14.123 17.736 1.00 42.41 C ATOM 387 CE2 TYR A 34 -13.195 14.581 19.996 1.00 70.45 C ATOM 388 CZ TYR A 34 -14.177 14.366 19.050 1.00 5.34 C ATOM 389 OH TYR A 34 -15.501 14.396 19.421 1.00 34.01 O ATOM 0 H TYR A 34 -10.713 17.115 18.116 1.00 52.41 H new ATOM 0 HA TYR A 34 -8.477 15.516 17.100 1.00 21.33 H new ATOM 0 HB2 TYR A 34 -9.891 13.467 17.180 1.00 71.43 H new ATOM 0 HB3 TYR A 34 -9.434 14.046 18.770 1.00 71.43 H new ATOM 0 HD1 TYR A 34 -12.242 13.905 16.339 1.00 72.43 H new ATOM 0 HD2 TYR A 34 -11.100 14.720 20.361 1.00 12.41 H new ATOM 0 HE1 TYR A 34 -14.607 13.955 16.998 1.00 42.41 H new ATOM 0 HE2 TYR A 34 -13.464 14.771 21.025 1.00 70.45 H new ATOM 0 HH TYR A 34 -15.635 13.821 20.203 1.00 34.01 H new ATOM 399 N VAL A 35 -9.720 15.202 14.889 1.00 50.21 N ATOM 400 CA VAL A 35 -10.290 15.344 13.554 1.00 23.42 C ATOM 401 C VAL A 35 -10.484 13.984 12.893 1.00 63.23 C ATOM 402 O VAL A 35 -9.565 13.164 12.854 1.00 14.44 O ATOM 403 CB VAL A 35 -9.398 16.218 12.653 1.00 3.11 C ATOM 404 CG1 VAL A 35 -8.022 15.589 12.492 1.00 51.34 C ATOM 405 CG2 VAL A 35 -10.057 16.433 11.299 1.00 31.01 C ATOM 0 H VAL A 35 -8.901 14.595 14.936 1.00 50.21 H new ATOM 0 HA VAL A 35 -11.259 15.829 13.673 1.00 23.42 H new ATOM 0 HB VAL A 35 -9.273 17.191 13.129 1.00 3.11 H new ATOM 0 HG11 VAL A 35 -7.406 16.221 11.852 1.00 51.34 H new ATOM 0 HG12 VAL A 35 -7.550 15.492 13.470 1.00 51.34 H new ATOM 0 HG13 VAL A 35 -8.123 14.603 12.039 1.00 51.34 H new ATOM 0 HG21 VAL A 35 -9.413 17.053 10.675 1.00 31.01 H new ATOM 0 HG22 VAL A 35 -10.214 15.470 10.814 1.00 31.01 H new ATOM 0 HG23 VAL A 35 -11.017 16.931 11.436 1.00 31.01 H new ATOM 415 N ILE A 36 -11.684 13.751 12.373 1.00 50.04 N ATOM 416 CA ILE A 36 -11.998 12.491 11.711 1.00 61.21 C ATOM 417 C ILE A 36 -12.273 12.703 10.226 1.00 12.31 C ATOM 418 O ILE A 36 -13.149 13.483 9.852 1.00 21.23 O ATOM 419 CB ILE A 36 -13.218 11.805 12.355 1.00 43.44 C ATOM 420 CG1 ILE A 36 -13.070 11.778 13.877 1.00 0.03 C ATOM 421 CG2 ILE A 36 -13.383 10.395 11.808 1.00 42.54 C ATOM 422 CD1 ILE A 36 -14.235 11.124 14.586 1.00 74.32 C ATOM 0 H ILE A 36 -12.455 14.418 12.397 1.00 50.04 H new ATOM 0 HA ILE A 36 -11.126 11.848 11.828 1.00 61.21 H new ATOM 0 HB ILE A 36 -14.112 12.377 12.106 1.00 43.44 H new ATOM 0 HG12 ILE A 36 -12.154 11.247 14.135 1.00 0.03 H new ATOM 0 HG13 ILE A 36 -12.960 12.799 14.241 1.00 0.03 H new ATOM 0 HG21 ILE A 36 -14.249 9.924 12.273 1.00 42.54 H new ATOM 0 HG22 ILE A 36 -13.529 10.438 10.729 1.00 42.54 H new ATOM 0 HG23 ILE A 36 -12.489 9.812 12.030 1.00 42.54 H new ATOM 0 HD11 ILE A 36 -14.062 11.141 15.662 1.00 74.32 H new ATOM 0 HD12 ILE A 36 -15.152 11.668 14.358 1.00 74.32 H new ATOM 0 HD13 ILE A 36 -14.332 10.092 14.250 1.00 74.32 H new ATOM 434 N MET A 37 -11.520 12.003 9.384 1.00 32.12 N ATOM 435 CA MET A 37 -11.685 12.113 7.939 1.00 34.45 C ATOM 436 C MET A 37 -11.857 10.736 7.306 1.00 62.33 C ATOM 437 O MET A 37 -11.428 9.726 7.865 1.00 5.11 O ATOM 438 CB MET A 37 -10.482 12.826 7.320 1.00 71.12 C ATOM 439 CG MET A 37 -10.060 14.074 8.077 1.00 43.50 C ATOM 440 SD MET A 37 -8.712 13.763 9.233 1.00 22.13 S ATOM 441 CE MET A 37 -7.291 14.064 8.186 1.00 64.45 C ATOM 0 H MET A 37 -10.790 11.354 9.677 1.00 32.12 H new ATOM 0 HA MET A 37 -12.584 12.698 7.744 1.00 34.45 H new ATOM 0 HB2 MET A 37 -9.641 12.134 7.280 1.00 71.12 H new ATOM 0 HB3 MET A 37 -10.721 13.098 6.292 1.00 71.12 H new ATOM 0 HG2 MET A 37 -9.753 14.840 7.365 1.00 43.50 H new ATOM 0 HG3 MET A 37 -10.917 14.471 8.622 1.00 43.50 H new ATOM 0 HE1 MET A 37 -6.377 13.911 8.760 1.00 64.45 H new ATOM 0 HE2 MET A 37 -7.309 13.375 7.342 1.00 64.45 H new ATOM 0 HE3 MET A 37 -7.321 15.089 7.818 1.00 64.45 H new ATOM 451 N HIS A 38 -12.487 10.702 6.136 1.00 61.12 N ATOM 452 CA HIS A 38 -12.715 9.448 5.426 1.00 4.11 C ATOM 453 C HIS A 38 -12.317 9.574 3.959 1.00 44.54 C ATOM 454 O HIS A 38 -12.101 10.678 3.457 1.00 1.21 O ATOM 455 CB HIS A 38 -14.183 9.035 5.535 1.00 42.43 C ATOM 456 CG HIS A 38 -15.100 9.854 4.679 1.00 61.22 C ATOM 457 ND1 HIS A 38 -15.973 9.299 3.767 1.00 44.24 N ATOM 458 CD2 HIS A 38 -15.278 11.193 4.601 1.00 12.34 C ATOM 459 CE1 HIS A 38 -16.647 10.262 3.164 1.00 42.21 C ATOM 460 NE2 HIS A 38 -16.244 11.421 3.653 1.00 55.42 N ATOM 0 H HIS A 38 -12.849 11.528 5.659 1.00 61.12 H new ATOM 0 HA HIS A 38 -12.094 8.680 5.888 1.00 4.11 H new ATOM 0 HB2 HIS A 38 -14.279 7.986 5.255 1.00 42.43 H new ATOM 0 HB3 HIS A 38 -14.499 9.118 6.575 1.00 42.43 H new ATOM 0 HD2 HIS A 38 -14.757 11.943 5.178 1.00 12.34 H new ATOM 0 HE1 HIS A 38 -17.399 10.125 2.401 1.00 42.21 H new ATOM 0 HE2 HIS A 38 -16.594 12.337 3.372 1.00 55.42 H new ATOM 468 N ILE A 39 -12.221 8.438 3.277 1.00 42.14 N ATOM 469 CA ILE A 39 -11.849 8.423 1.867 1.00 31.43 C ATOM 470 C ILE A 39 -13.069 8.625 0.975 1.00 61.22 C ATOM 471 O ILE A 39 -14.078 7.935 1.119 1.00 73.31 O ATOM 472 CB ILE A 39 -11.158 7.101 1.482 1.00 53.32 C ATOM 473 CG1 ILE A 39 -10.058 6.763 2.490 1.00 70.33 C ATOM 474 CG2 ILE A 39 -10.585 7.194 0.075 1.00 35.34 C ATOM 475 CD1 ILE A 39 -9.311 5.488 2.164 1.00 53.23 C ATOM 0 H ILE A 39 -12.395 7.516 3.677 1.00 42.14 H new ATOM 0 HA ILE A 39 -11.151 9.246 1.715 1.00 31.43 H new ATOM 0 HB ILE A 39 -11.899 6.302 1.500 1.00 53.32 H new ATOM 0 HG12 ILE A 39 -9.349 7.590 2.532 1.00 70.33 H new ATOM 0 HG13 ILE A 39 -10.501 6.672 3.482 1.00 70.33 H new ATOM 0 HG21 ILE A 39 -10.100 6.253 -0.183 1.00 35.34 H new ATOM 0 HG22 ILE A 39 -11.389 7.394 -0.633 1.00 35.34 H new ATOM 0 HG23 ILE A 39 -9.855 8.002 0.032 1.00 35.34 H new ATOM 0 HD11 ILE A 39 -8.546 5.311 2.920 1.00 53.23 H new ATOM 0 HD12 ILE A 39 -10.009 4.651 2.150 1.00 53.23 H new ATOM 0 HD13 ILE A 39 -8.839 5.583 1.186 1.00 53.23 H new ATOM 487 N VAL A 40 -12.968 9.575 0.051 1.00 73.24 N ATOM 488 CA VAL A 40 -14.062 9.866 -0.868 1.00 51.43 C ATOM 489 C VAL A 40 -13.695 9.485 -2.298 1.00 52.21 C ATOM 490 O VAL A 40 -12.651 9.888 -2.810 1.00 43.23 O ATOM 491 CB VAL A 40 -14.446 11.358 -0.829 1.00 31.54 C ATOM 492 CG1 VAL A 40 -15.697 11.609 -1.657 1.00 44.32 C ATOM 493 CG2 VAL A 40 -14.646 11.818 0.607 1.00 34.44 C ATOM 0 H VAL A 40 -12.140 10.156 -0.081 1.00 73.24 H new ATOM 0 HA VAL A 40 -14.915 9.270 -0.543 1.00 51.43 H new ATOM 0 HB VAL A 40 -13.631 11.937 -1.262 1.00 31.54 H new ATOM 0 HG11 VAL A 40 -15.953 12.668 -1.618 1.00 44.32 H new ATOM 0 HG12 VAL A 40 -15.513 11.318 -2.691 1.00 44.32 H new ATOM 0 HG13 VAL A 40 -16.523 11.021 -1.256 1.00 44.32 H new ATOM 0 HG21 VAL A 40 -14.917 12.874 0.616 1.00 34.44 H new ATOM 0 HG22 VAL A 40 -15.443 11.235 1.068 1.00 34.44 H new ATOM 0 HG23 VAL A 40 -13.722 11.675 1.167 1.00 34.44 H new ATOM 503 N ASP A 41 -14.561 8.707 -2.937 1.00 70.35 N ATOM 504 CA ASP A 41 -14.329 8.272 -4.310 1.00 33.30 C ATOM 505 C ASP A 41 -13.063 7.427 -4.406 1.00 23.12 C ATOM 506 O ASP A 41 -12.526 7.218 -5.493 1.00 74.34 O ATOM 507 CB ASP A 41 -14.222 9.481 -5.240 1.00 0.32 C ATOM 508 CG ASP A 41 -15.236 9.438 -6.366 1.00 61.40 C ATOM 509 OD1 ASP A 41 -16.424 9.722 -6.106 1.00 24.11 O ATOM 510 OD2 ASP A 41 -14.842 9.118 -7.507 1.00 40.25 O ATOM 0 H ASP A 41 -15.430 8.364 -2.527 1.00 70.35 H new ATOM 0 HA ASP A 41 -15.177 7.660 -4.619 1.00 33.30 H new ATOM 0 HB2 ASP A 41 -14.364 10.394 -4.662 1.00 0.32 H new ATOM 0 HB3 ASP A 41 -13.218 9.524 -5.661 1.00 0.32 H new ATOM 515 N GLN A 42 -12.590 6.946 -3.260 1.00 74.34 N ATOM 516 CA GLN A 42 -11.386 6.125 -3.216 1.00 3.51 C ATOM 517 C GLN A 42 -10.255 6.775 -4.007 1.00 11.33 C ATOM 518 O GLN A 42 -9.415 6.088 -4.589 1.00 14.41 O ATOM 519 CB GLN A 42 -11.674 4.729 -3.769 1.00 24.31 C ATOM 520 CG GLN A 42 -12.965 4.121 -3.245 1.00 50.33 C ATOM 521 CD GLN A 42 -13.132 2.669 -3.648 1.00 13.32 C ATOM 522 OE1 GLN A 42 -12.351 2.138 -4.437 1.00 63.10 O ATOM 523 NE2 GLN A 42 -14.155 2.019 -3.106 1.00 31.41 N ATOM 0 H GLN A 42 -13.022 7.111 -2.351 1.00 74.34 H new ATOM 0 HA GLN A 42 -11.074 6.038 -2.175 1.00 3.51 H new ATOM 0 HB2 GLN A 42 -11.722 4.781 -4.857 1.00 24.31 H new ATOM 0 HB3 GLN A 42 -10.843 4.069 -3.518 1.00 24.31 H new ATOM 0 HG2 GLN A 42 -12.983 4.197 -2.158 1.00 50.33 H new ATOM 0 HG3 GLN A 42 -13.811 4.697 -3.618 1.00 50.33 H new ATOM 0 HE21 GLN A 42 -14.778 2.499 -2.456 1.00 31.41 H new ATOM 0 HE22 GLN A 42 -14.318 1.040 -3.339 1.00 31.41 H new ATOM 532 N LYS A 43 -10.239 8.104 -4.024 1.00 75.21 N ATOM 533 CA LYS A 43 -9.212 8.848 -4.743 1.00 1.15 C ATOM 534 C LYS A 43 -8.820 10.109 -3.979 1.00 45.13 C ATOM 535 O LYS A 43 -7.641 10.453 -3.894 1.00 64.10 O ATOM 536 CB LYS A 43 -9.707 9.220 -6.142 1.00 62.42 C ATOM 537 CG LYS A 43 -8.867 8.628 -7.261 1.00 72.11 C ATOM 538 CD LYS A 43 -9.288 9.166 -8.618 1.00 71.04 C ATOM 539 CE LYS A 43 -8.913 8.208 -9.739 1.00 21.24 C ATOM 540 NZ LYS A 43 -9.812 8.352 -10.917 1.00 14.35 N ATOM 0 H LYS A 43 -10.926 8.688 -3.548 1.00 75.21 H new ATOM 0 HA LYS A 43 -8.333 8.210 -4.834 1.00 1.15 H new ATOM 0 HB2 LYS A 43 -10.737 8.883 -6.255 1.00 62.42 H new ATOM 0 HB3 LYS A 43 -9.714 10.306 -6.239 1.00 62.42 H new ATOM 0 HG2 LYS A 43 -7.815 8.857 -7.088 1.00 72.11 H new ATOM 0 HG3 LYS A 43 -8.962 7.542 -7.253 1.00 72.11 H new ATOM 0 HD2 LYS A 43 -10.365 9.333 -8.626 1.00 71.04 H new ATOM 0 HD3 LYS A 43 -8.814 10.132 -8.790 1.00 71.04 H new ATOM 0 HE2 LYS A 43 -7.883 8.392 -10.044 1.00 21.24 H new ATOM 0 HE3 LYS A 43 -8.958 7.183 -9.371 1.00 21.24 H new ATOM 0 HZ1 LYS A 43 -9.523 7.682 -11.658 1.00 14.35 H new ATOM 0 HZ2 LYS A 43 -10.792 8.152 -10.632 1.00 14.35 H new ATOM 0 HZ3 LYS A 43 -9.750 9.323 -11.285 1.00 14.35 H new ATOM 554 N SER A 44 -9.815 10.794 -3.425 1.00 21.42 N ATOM 555 CA SER A 44 -9.573 12.018 -2.670 1.00 74.14 C ATOM 556 C SER A 44 -10.170 11.919 -1.269 1.00 43.35 C ATOM 557 O SER A 44 -11.351 11.614 -1.106 1.00 74.23 O ATOM 558 CB SER A 44 -10.167 13.221 -3.406 1.00 70.20 C ATOM 559 OG SER A 44 -9.155 13.972 -4.055 1.00 35.31 O ATOM 0 H SER A 44 -10.796 10.522 -3.485 1.00 21.42 H new ATOM 0 HA SER A 44 -8.495 12.153 -2.578 1.00 74.14 H new ATOM 0 HB2 SER A 44 -10.897 12.879 -4.139 1.00 70.20 H new ATOM 0 HB3 SER A 44 -10.700 13.857 -2.699 1.00 70.20 H new ATOM 0 HG SER A 44 -9.560 14.734 -4.519 1.00 35.31 H new ATOM 565 N ILE A 45 -9.343 12.180 -0.262 1.00 75.01 N ATOM 566 CA ILE A 45 -9.788 12.122 1.125 1.00 74.23 C ATOM 567 C ILE A 45 -10.477 13.419 1.536 1.00 60.20 C ATOM 568 O ILE A 45 -9.959 14.510 1.300 1.00 14.00 O ATOM 569 CB ILE A 45 -8.613 11.852 2.082 1.00 23.03 C ATOM 570 CG1 ILE A 45 -7.866 10.584 1.663 1.00 2.11 C ATOM 571 CG2 ILE A 45 -9.113 11.730 3.514 1.00 60.31 C ATOM 572 CD1 ILE A 45 -6.628 10.311 2.489 1.00 33.10 C ATOM 0 H ILE A 45 -8.362 12.433 -0.381 1.00 75.01 H new ATOM 0 HA ILE A 45 -10.499 11.298 1.194 1.00 74.23 H new ATOM 0 HB ILE A 45 -7.921 12.693 2.030 1.00 23.03 H new ATOM 0 HG12 ILE A 45 -8.541 9.732 1.742 1.00 2.11 H new ATOM 0 HG13 ILE A 45 -7.582 10.669 0.614 1.00 2.11 H new ATOM 0 HG21 ILE A 45 -8.270 11.539 4.179 1.00 60.31 H new ATOM 0 HG22 ILE A 45 -9.604 12.657 3.808 1.00 60.31 H new ATOM 0 HG23 ILE A 45 -9.823 10.906 3.583 1.00 60.31 H new ATOM 0 HD11 ILE A 45 -6.149 9.397 2.136 1.00 33.10 H new ATOM 0 HD12 ILE A 45 -5.934 11.146 2.391 1.00 33.10 H new ATOM 0 HD13 ILE A 45 -6.908 10.193 3.536 1.00 33.10 H new ATOM 584 N ALA A 46 -11.647 13.291 2.154 1.00 44.10 N ATOM 585 CA ALA A 46 -12.405 14.453 2.602 1.00 24.30 C ATOM 586 C ALA A 46 -12.830 14.302 4.058 1.00 34.15 C ATOM 587 O ALA A 46 -12.922 13.189 4.577 1.00 52.10 O ATOM 588 CB ALA A 46 -13.622 14.664 1.713 1.00 24.44 C ATOM 0 H ALA A 46 -12.090 12.395 2.356 1.00 44.10 H new ATOM 0 HA ALA A 46 -11.760 15.328 2.528 1.00 24.30 H new ATOM 0 HB1 ALA A 46 -14.179 15.535 2.059 1.00 24.44 H new ATOM 0 HB2 ALA A 46 -13.298 14.825 0.685 1.00 24.44 H new ATOM 0 HB3 ALA A 46 -14.262 13.783 1.757 1.00 24.44 H new ATOM 594 N VAL A 47 -13.089 15.429 4.714 1.00 21.14 N ATOM 595 CA VAL A 47 -13.506 15.422 6.112 1.00 65.24 C ATOM 596 C VAL A 47 -14.980 15.056 6.244 1.00 43.53 C ATOM 597 O VAL A 47 -15.817 15.516 5.467 1.00 60.13 O ATOM 598 CB VAL A 47 -13.266 16.791 6.776 1.00 63.33 C ATOM 599 CG1 VAL A 47 -11.776 17.064 6.912 1.00 3.44 C ATOM 600 CG2 VAL A 47 -13.948 17.894 5.982 1.00 52.42 C ATOM 0 H VAL A 47 -13.017 16.358 4.300 1.00 21.14 H new ATOM 0 HA VAL A 47 -12.902 14.670 6.619 1.00 65.24 H new ATOM 0 HB VAL A 47 -13.700 16.772 7.776 1.00 63.33 H new ATOM 0 HG11 VAL A 47 -11.626 18.035 7.383 1.00 3.44 H new ATOM 0 HG12 VAL A 47 -11.319 16.288 7.526 1.00 3.44 H new ATOM 0 HG13 VAL A 47 -11.315 17.064 5.925 1.00 3.44 H new ATOM 0 HG21 VAL A 47 -13.768 18.854 6.465 1.00 52.42 H new ATOM 0 HG22 VAL A 47 -13.545 17.916 4.970 1.00 52.42 H new ATOM 0 HG23 VAL A 47 -15.020 17.703 5.941 1.00 52.42 H new ATOM 610 N LYS A 48 -15.291 14.227 7.234 1.00 75.24 N ATOM 611 CA LYS A 48 -16.665 13.800 7.471 1.00 73.45 C ATOM 612 C LYS A 48 -17.251 14.503 8.691 1.00 22.40 C ATOM 613 O LYS A 48 -18.394 14.961 8.668 1.00 4.12 O ATOM 614 CB LYS A 48 -16.723 12.283 7.666 1.00 71.12 C ATOM 615 CG LYS A 48 -18.083 11.681 7.357 1.00 12.33 C ATOM 616 CD LYS A 48 -18.388 11.726 5.869 1.00 32.14 C ATOM 617 CE LYS A 48 -19.880 11.873 5.610 1.00 22.24 C ATOM 618 NZ LYS A 48 -20.158 12.808 4.485 1.00 21.22 N ATOM 0 H LYS A 48 -14.610 13.837 7.886 1.00 75.24 H new ATOM 0 HA LYS A 48 -17.259 14.071 6.598 1.00 73.45 H new ATOM 0 HB2 LYS A 48 -15.974 11.814 7.028 1.00 71.12 H new ATOM 0 HB3 LYS A 48 -16.456 12.047 8.696 1.00 71.12 H new ATOM 0 HG2 LYS A 48 -18.112 10.648 7.704 1.00 12.33 H new ATOM 0 HG3 LYS A 48 -18.855 12.223 7.904 1.00 12.33 H new ATOM 0 HD2 LYS A 48 -17.854 12.560 5.412 1.00 32.14 H new ATOM 0 HD3 LYS A 48 -18.023 10.815 5.394 1.00 32.14 H new ATOM 0 HE2 LYS A 48 -20.307 10.896 5.384 1.00 22.24 H new ATOM 0 HE3 LYS A 48 -20.371 12.235 6.513 1.00 22.24 H new ATOM 0 HZ1 LYS A 48 -21.185 12.881 4.340 1.00 21.22 H new ATOM 0 HZ2 LYS A 48 -19.773 13.747 4.711 1.00 21.22 H new ATOM 0 HZ3 LYS A 48 -19.711 12.450 3.617 1.00 21.22 H new ATOM 632 N THR A 49 -16.460 14.586 9.757 1.00 72.24 N ATOM 633 CA THR A 49 -16.900 15.233 10.986 1.00 0.10 C ATOM 634 C THR A 49 -15.713 15.592 11.873 1.00 15.22 C ATOM 635 O THR A 49 -14.927 14.725 12.254 1.00 22.04 O ATOM 636 CB THR A 49 -17.866 14.334 11.780 1.00 73.22 C ATOM 637 OG1 THR A 49 -19.076 14.140 11.039 1.00 51.44 O ATOM 638 CG2 THR A 49 -18.188 14.948 13.134 1.00 61.20 C ATOM 0 H THR A 49 -15.511 14.213 9.793 1.00 72.24 H new ATOM 0 HA THR A 49 -17.421 16.145 10.694 1.00 0.10 H new ATOM 0 HB THR A 49 -17.381 13.371 11.941 1.00 73.22 H new ATOM 0 HG1 THR A 49 -19.057 14.695 10.231 1.00 51.44 H new ATOM 0 HG21 THR A 49 -18.872 14.295 13.676 1.00 61.20 H new ATOM 0 HG22 THR A 49 -17.269 15.067 13.707 1.00 61.20 H new ATOM 0 HG23 THR A 49 -18.655 15.923 12.990 1.00 61.20 H new ATOM 646 N ILE A 50 -15.591 16.875 12.199 1.00 61.42 N ATOM 647 CA ILE A 50 -14.501 17.347 13.043 1.00 23.01 C ATOM 648 C ILE A 50 -14.956 17.510 14.489 1.00 31.43 C ATOM 649 O ILE A 50 -16.108 17.852 14.754 1.00 44.43 O ATOM 650 CB ILE A 50 -13.940 18.690 12.539 1.00 22.12 C ATOM 651 CG1 ILE A 50 -12.682 19.069 13.324 1.00 71.21 C ATOM 652 CG2 ILE A 50 -14.993 19.781 12.657 1.00 50.41 C ATOM 653 CD1 ILE A 50 -11.737 19.965 12.555 1.00 53.51 C ATOM 0 H ILE A 50 -16.233 17.605 11.891 1.00 61.42 H new ATOM 0 HA ILE A 50 -13.715 16.593 12.995 1.00 23.01 H new ATOM 0 HB ILE A 50 -13.671 18.583 11.488 1.00 22.12 H new ATOM 0 HG12 ILE A 50 -12.976 19.571 14.246 1.00 71.21 H new ATOM 0 HG13 ILE A 50 -12.155 18.159 13.611 1.00 71.21 H new ATOM 0 HG21 ILE A 50 -14.582 20.724 12.297 1.00 50.41 H new ATOM 0 HG22 ILE A 50 -15.864 19.513 12.058 1.00 50.41 H new ATOM 0 HG23 ILE A 50 -15.289 19.889 13.700 1.00 50.41 H new ATOM 0 HD11 ILE A 50 -10.868 20.193 13.173 1.00 53.51 H new ATOM 0 HD12 ILE A 50 -11.413 19.458 11.646 1.00 53.51 H new ATOM 0 HD13 ILE A 50 -12.248 20.891 12.291 1.00 53.51 H new ATOM 665 N GLY A 51 -14.042 17.262 15.423 1.00 14.42 N ATOM 666 CA GLY A 51 -14.369 17.388 16.832 1.00 44.43 C ATOM 667 C GLY A 51 -14.124 18.788 17.361 1.00 64.44 C ATOM 668 O GLY A 51 -14.266 19.767 16.630 1.00 14.52 O ATOM 0 H GLY A 51 -13.082 16.976 15.229 1.00 14.42 H new ATOM 0 HA2 GLY A 51 -15.415 17.123 16.984 1.00 44.43 H new ATOM 0 HA3 GLY A 51 -13.774 16.677 17.405 1.00 44.43 H new ATOM 672 N GLU A 52 -13.755 18.881 18.635 1.00 53.14 N ATOM 673 CA GLU A 52 -13.493 20.172 19.260 1.00 21.35 C ATOM 674 C GLU A 52 -13.077 19.995 20.718 1.00 0.00 C ATOM 675 O GLU A 52 -12.254 20.750 21.236 1.00 52.53 O ATOM 676 CB GLU A 52 -14.732 21.065 19.177 1.00 11.41 C ATOM 677 CG GLU A 52 -16.011 20.375 19.620 1.00 12.22 C ATOM 678 CD GLU A 52 -17.027 20.254 18.501 1.00 63.03 C ATOM 679 OE1 GLU A 52 -16.877 19.341 17.661 1.00 11.51 O ATOM 680 OE2 GLU A 52 -17.970 21.071 18.464 1.00 72.13 O ATOM 0 H GLU A 52 -13.631 18.079 19.253 1.00 53.14 H new ATOM 0 HA GLU A 52 -12.674 20.649 18.721 1.00 21.35 H new ATOM 0 HB2 GLU A 52 -14.574 21.949 19.794 1.00 11.41 H new ATOM 0 HB3 GLU A 52 -14.852 21.410 18.150 1.00 11.41 H new ATOM 0 HG2 GLU A 52 -15.771 19.381 19.997 1.00 12.22 H new ATOM 0 HG3 GLU A 52 -16.452 20.932 20.447 1.00 12.22 H new ATOM 687 N ARG A 53 -13.652 18.993 21.374 1.00 72.50 N ATOM 688 CA ARG A 53 -13.343 18.717 22.772 1.00 53.11 C ATOM 689 C ARG A 53 -14.019 17.430 23.235 1.00 74.23 C ATOM 690 O ARG A 53 -13.456 16.668 24.020 1.00 51.33 O ATOM 691 CB ARG A 53 -13.788 19.885 23.654 1.00 0.02 C ATOM 692 CG ARG A 53 -12.644 20.780 24.102 1.00 51.21 C ATOM 693 CD ARG A 53 -12.962 22.249 23.869 1.00 31.12 C ATOM 694 NE ARG A 53 -14.296 22.603 24.348 1.00 23.32 N ATOM 695 CZ ARG A 53 -14.900 23.750 24.060 1.00 43.02 C ATOM 696 NH1 ARG A 53 -14.293 24.650 23.298 1.00 24.51 N ATOM 697 NH2 ARG A 53 -16.114 23.999 24.533 1.00 10.32 N ATOM 0 H ARG A 53 -14.335 18.358 20.960 1.00 72.50 H new ATOM 0 HA ARG A 53 -12.264 18.592 22.862 1.00 53.11 H new ATOM 0 HB2 ARG A 53 -14.515 20.485 23.108 1.00 0.02 H new ATOM 0 HB3 ARG A 53 -14.296 19.492 24.534 1.00 0.02 H new ATOM 0 HG2 ARG A 53 -12.443 20.613 25.160 1.00 51.21 H new ATOM 0 HG3 ARG A 53 -11.737 20.512 23.560 1.00 51.21 H new ATOM 0 HD2 ARG A 53 -12.219 22.865 24.376 1.00 31.12 H new ATOM 0 HD3 ARG A 53 -12.888 22.471 22.805 1.00 31.12 H new ATOM 0 HE ARG A 53 -14.791 21.932 24.936 1.00 23.32 H new ATOM 0 HH11 ARG A 53 -13.360 24.462 22.932 1.00 24.51 H new ATOM 0 HH12 ARG A 53 -14.759 25.530 23.078 1.00 24.51 H new ATOM 0 HH21 ARG A 53 -16.585 23.309 25.119 1.00 10.32 H new ATOM 0 HH22 ARG A 53 -16.577 24.880 24.311 1.00 10.32 H new ATOM 711 N GLY A 54 -15.232 17.194 22.742 1.00 21.05 N ATOM 712 CA GLY A 54 -15.965 15.999 23.117 1.00 30.11 C ATOM 713 C GLY A 54 -17.321 15.915 22.444 1.00 45.42 C ATOM 714 O GLY A 54 -18.354 16.075 23.092 1.00 10.04 O ATOM 0 H GLY A 54 -15.719 17.809 22.090 1.00 21.05 H new ATOM 0 HA2 GLY A 54 -15.378 15.119 22.855 1.00 30.11 H new ATOM 0 HA3 GLY A 54 -16.098 15.983 24.199 1.00 30.11 H new ATOM 718 N ALA A 55 -17.317 15.666 21.138 1.00 3.14 N ATOM 719 CA ALA A 55 -18.555 15.561 20.377 1.00 13.51 C ATOM 720 C ALA A 55 -19.527 14.590 21.040 1.00 44.35 C ATOM 721 O ALA A 55 -19.123 13.730 21.821 1.00 43.31 O ATOM 722 CB ALA A 55 -18.262 15.126 18.949 1.00 22.31 C ATOM 0 H ALA A 55 -16.470 15.533 20.586 1.00 3.14 H new ATOM 0 HA ALA A 55 -19.024 16.545 20.356 1.00 13.51 H new ATOM 0 HB1 ALA A 55 -19.196 15.052 18.392 1.00 22.31 H new ATOM 0 HB2 ALA A 55 -17.612 15.859 18.471 1.00 22.31 H new ATOM 0 HB3 ALA A 55 -17.767 14.155 18.959 1.00 22.31 H new ATOM 728 N ASN A 56 -20.809 14.735 20.722 1.00 31.32 N ATOM 729 CA ASN A 56 -21.838 13.870 21.288 1.00 15.42 C ATOM 730 C ASN A 56 -21.747 12.463 20.707 1.00 22.31 C ATOM 731 O ASN A 56 -21.308 12.275 19.572 1.00 54.41 O ATOM 732 CB ASN A 56 -23.227 14.455 21.022 1.00 33.41 C ATOM 733 CG ASN A 56 -24.142 14.343 22.227 1.00 60.04 C ATOM 734 OD1 ASN A 56 -24.669 13.271 22.522 1.00 32.53 O ATOM 735 ND2 ASN A 56 -24.334 15.454 22.928 1.00 35.01 N ATOM 0 H ASN A 56 -21.160 15.442 20.076 1.00 31.32 H new ATOM 0 HA ASN A 56 -21.675 13.810 22.364 1.00 15.42 H new ATOM 0 HB2 ASN A 56 -23.129 15.503 20.740 1.00 33.41 H new ATOM 0 HB3 ASN A 56 -23.680 13.938 20.176 1.00 33.41 H new ATOM 0 HD21 ASN A 56 -24.940 15.441 23.749 1.00 35.01 H new ATOM 0 HD22 ASN A 56 -23.876 16.321 22.646 1.00 35.01 H new ATOM 742 N PHE A 57 -22.164 11.476 21.493 1.00 20.31 N ATOM 743 CA PHE A 57 -22.129 10.085 21.057 1.00 21.53 C ATOM 744 C PHE A 57 -23.089 9.855 19.894 1.00 62.33 C ATOM 745 O PHE A 57 -22.822 9.044 19.006 1.00 54.51 O ATOM 746 CB PHE A 57 -22.486 9.155 22.219 1.00 61.10 C ATOM 747 CG PHE A 57 -21.288 8.551 22.894 1.00 65.15 C ATOM 748 CD1 PHE A 57 -20.503 7.617 22.236 1.00 41.53 C ATOM 749 CD2 PHE A 57 -20.946 8.916 24.186 1.00 50.33 C ATOM 750 CE1 PHE A 57 -19.399 7.060 22.853 1.00 31.04 C ATOM 751 CE2 PHE A 57 -19.843 8.363 24.808 1.00 33.43 C ATOM 752 CZ PHE A 57 -19.070 7.432 24.142 1.00 43.41 C ATOM 0 H PHE A 57 -22.530 11.614 22.435 1.00 20.31 H new ATOM 0 HA PHE A 57 -21.117 9.862 20.719 1.00 21.53 H new ATOM 0 HB2 PHE A 57 -23.065 9.713 22.955 1.00 61.10 H new ATOM 0 HB3 PHE A 57 -23.127 8.354 21.849 1.00 61.10 H new ATOM 0 HD1 PHE A 57 -20.757 7.321 21.229 1.00 41.53 H new ATOM 0 HD2 PHE A 57 -21.548 9.641 24.713 1.00 50.33 H new ATOM 0 HE1 PHE A 57 -18.794 6.335 22.328 1.00 31.04 H new ATOM 0 HE2 PHE A 57 -19.585 8.659 25.814 1.00 33.43 H new ATOM 0 HZ PHE A 57 -18.210 6.996 24.628 1.00 43.41 H new ATOM 762 N ASP A 58 -24.206 10.573 19.906 1.00 73.10 N ATOM 763 CA ASP A 58 -25.207 10.449 18.852 1.00 23.32 C ATOM 764 C ASP A 58 -24.661 10.959 17.522 1.00 13.42 C ATOM 765 O ASP A 58 -24.798 10.301 16.491 1.00 15.43 O ATOM 766 CB ASP A 58 -26.473 11.220 19.228 1.00 21.32 C ATOM 767 CG ASP A 58 -27.315 10.485 20.253 1.00 52.43 C ATOM 768 OD1 ASP A 58 -26.746 10.007 21.256 1.00 21.41 O ATOM 769 OD2 ASP A 58 -28.544 10.390 20.052 1.00 42.13 O ATOM 0 H ASP A 58 -24.442 11.247 20.634 1.00 73.10 H new ATOM 0 HA ASP A 58 -25.454 9.393 18.742 1.00 23.32 H new ATOM 0 HB2 ASP A 58 -26.196 12.197 19.623 1.00 21.32 H new ATOM 0 HB3 ASP A 58 -27.068 11.395 18.332 1.00 21.32 H new ATOM 774 N GLN A 59 -24.044 12.136 17.554 1.00 10.02 N ATOM 775 CA GLN A 59 -23.480 12.735 16.350 1.00 0.25 C ATOM 776 C GLN A 59 -22.203 12.015 15.931 1.00 23.11 C ATOM 777 O GLN A 59 -21.935 11.847 14.741 1.00 24.12 O ATOM 778 CB GLN A 59 -23.190 14.219 16.582 1.00 52.23 C ATOM 779 CG GLN A 59 -22.105 14.473 17.615 1.00 10.44 C ATOM 780 CD GLN A 59 -21.835 15.950 17.827 1.00 0.10 C ATOM 781 OE1 GLN A 59 -20.803 16.471 17.403 1.00 53.33 O ATOM 782 NE2 GLN A 59 -22.763 16.633 18.486 1.00 14.41 N ATOM 0 H GLN A 59 -23.922 12.693 18.400 1.00 10.02 H new ATOM 0 HA GLN A 59 -24.211 12.636 15.548 1.00 0.25 H new ATOM 0 HB2 GLN A 59 -22.894 14.675 15.637 1.00 52.23 H new ATOM 0 HB3 GLN A 59 -24.107 14.714 16.901 1.00 52.23 H new ATOM 0 HG2 GLN A 59 -22.398 14.021 18.563 1.00 10.44 H new ATOM 0 HG3 GLN A 59 -21.185 13.981 17.299 1.00 10.44 H new ATOM 0 HE21 GLN A 59 -23.603 16.161 18.820 1.00 14.41 H new ATOM 0 HE22 GLN A 59 -22.636 17.630 18.659 1.00 14.41 H new ATOM 791 N PHE A 60 -21.417 11.592 16.916 1.00 74.50 N ATOM 792 CA PHE A 60 -20.167 10.890 16.649 1.00 10.31 C ATOM 793 C PHE A 60 -20.425 9.581 15.909 1.00 0.00 C ATOM 794 O PHE A 60 -19.791 9.295 14.893 1.00 70.11 O ATOM 795 CB PHE A 60 -19.424 10.612 17.958 1.00 75.24 C ATOM 796 CG PHE A 60 -18.221 9.729 17.788 1.00 40.32 C ATOM 797 CD1 PHE A 60 -16.987 10.272 17.468 1.00 1.25 C ATOM 798 CD2 PHE A 60 -18.324 8.357 17.947 1.00 70.20 C ATOM 799 CE1 PHE A 60 -15.877 9.463 17.312 1.00 73.01 C ATOM 800 CE2 PHE A 60 -17.218 7.543 17.792 1.00 20.31 C ATOM 801 CZ PHE A 60 -15.993 8.096 17.473 1.00 54.21 C ATOM 0 H PHE A 60 -21.624 11.723 17.906 1.00 74.50 H new ATOM 0 HA PHE A 60 -19.549 11.528 16.017 1.00 10.31 H new ATOM 0 HB2 PHE A 60 -19.110 11.559 18.397 1.00 75.24 H new ATOM 0 HB3 PHE A 60 -20.111 10.145 18.664 1.00 75.24 H new ATOM 0 HD1 PHE A 60 -16.891 11.340 17.339 1.00 1.25 H new ATOM 0 HD2 PHE A 60 -19.279 7.918 18.195 1.00 70.20 H new ATOM 0 HE1 PHE A 60 -14.920 9.899 17.065 1.00 73.01 H new ATOM 0 HE2 PHE A 60 -17.311 6.475 17.920 1.00 20.31 H new ATOM 0 HZ PHE A 60 -15.128 7.461 17.350 1.00 54.21 H new ATOM 811 N ILE A 61 -21.359 8.790 16.426 1.00 10.24 N ATOM 812 CA ILE A 61 -21.701 7.512 15.815 1.00 33.01 C ATOM 813 C ILE A 61 -22.460 7.713 14.508 1.00 43.55 C ATOM 814 O ILE A 61 -22.245 6.989 13.537 1.00 60.34 O ATOM 815 CB ILE A 61 -22.553 6.646 16.761 1.00 33.43 C ATOM 816 CG1 ILE A 61 -21.779 6.342 18.046 1.00 53.21 C ATOM 817 CG2 ILE A 61 -22.968 5.356 16.069 1.00 21.22 C ATOM 818 CD1 ILE A 61 -20.548 5.492 17.823 1.00 51.20 C ATOM 0 H ILE A 61 -21.892 9.012 17.267 1.00 10.24 H new ATOM 0 HA ILE A 61 -20.761 6.998 15.612 1.00 33.01 H new ATOM 0 HB ILE A 61 -23.454 7.200 17.024 1.00 33.43 H new ATOM 0 HG12 ILE A 61 -21.482 7.281 18.513 1.00 53.21 H new ATOM 0 HG13 ILE A 61 -22.440 5.833 18.747 1.00 53.21 H new ATOM 0 HG21 ILE A 61 -23.570 4.755 16.751 1.00 21.22 H new ATOM 0 HG22 ILE A 61 -23.553 5.592 15.180 1.00 21.22 H new ATOM 0 HG23 ILE A 61 -22.079 4.796 15.780 1.00 21.22 H new ATOM 0 HD11 ILE A 61 -20.049 5.317 18.776 1.00 51.20 H new ATOM 0 HD12 ILE A 61 -20.839 4.537 17.385 1.00 51.20 H new ATOM 0 HD13 ILE A 61 -19.867 6.009 17.147 1.00 51.20 H new ATOM 830 N GLU A 62 -23.346 8.704 14.490 1.00 0.24 N ATOM 831 CA GLU A 62 -24.135 9.001 13.301 1.00 54.40 C ATOM 832 C GLU A 62 -23.232 9.337 12.118 1.00 2.21 C ATOM 833 O GLU A 62 -23.489 8.920 10.989 1.00 3.22 O ATOM 834 CB GLU A 62 -25.091 10.165 13.574 1.00 42.25 C ATOM 835 CG GLU A 62 -26.424 9.733 14.160 1.00 54.43 C ATOM 836 CD GLU A 62 -27.214 10.895 14.732 1.00 62.04 C ATOM 837 OE1 GLU A 62 -27.148 11.999 14.152 1.00 44.15 O ATOM 838 OE2 GLU A 62 -27.897 10.700 15.758 1.00 0.45 O ATOM 0 H GLU A 62 -23.535 9.314 15.285 1.00 0.24 H new ATOM 0 HA GLU A 62 -24.716 8.113 13.051 1.00 54.40 H new ATOM 0 HB2 GLU A 62 -24.612 10.864 14.259 1.00 42.25 H new ATOM 0 HB3 GLU A 62 -25.270 10.703 12.643 1.00 42.25 H new ATOM 0 HG2 GLU A 62 -27.015 9.243 13.386 1.00 54.43 H new ATOM 0 HG3 GLU A 62 -26.250 8.996 14.944 1.00 54.43 H new ATOM 845 N ALA A 63 -22.173 10.094 12.386 1.00 1.32 N ATOM 846 CA ALA A 63 -21.230 10.485 11.345 1.00 12.35 C ATOM 847 C ALA A 63 -20.317 9.324 10.967 1.00 32.03 C ATOM 848 O ALA A 63 -20.202 8.970 9.794 1.00 43.15 O ATOM 849 CB ALA A 63 -20.406 11.680 11.802 1.00 51.22 C ATOM 0 H ALA A 63 -21.947 10.449 13.315 1.00 1.32 H new ATOM 0 HA ALA A 63 -21.800 10.767 10.460 1.00 12.35 H new ATOM 0 HB1 ALA A 63 -19.706 11.962 11.015 1.00 51.22 H new ATOM 0 HB2 ALA A 63 -21.069 12.519 12.015 1.00 51.22 H new ATOM 0 HB3 ALA A 63 -19.852 11.417 12.703 1.00 51.22 H new ATOM 855 N ILE A 64 -19.671 8.736 11.968 1.00 64.31 N ATOM 856 CA ILE A 64 -18.768 7.614 11.739 1.00 13.11 C ATOM 857 C ILE A 64 -19.529 6.389 11.243 1.00 42.23 C ATOM 858 O ILE A 64 -20.656 6.132 11.666 1.00 51.25 O ATOM 859 CB ILE A 64 -17.997 7.242 13.019 1.00 32.32 C ATOM 860 CG1 ILE A 64 -17.188 8.440 13.520 1.00 31.12 C ATOM 861 CG2 ILE A 64 -17.086 6.051 12.761 1.00 30.02 C ATOM 862 CD1 ILE A 64 -16.092 8.869 12.570 1.00 54.03 C ATOM 0 H ILE A 64 -19.756 9.017 12.945 1.00 64.31 H new ATOM 0 HA ILE A 64 -18.057 7.931 10.976 1.00 13.11 H new ATOM 0 HB ILE A 64 -18.715 6.965 13.791 1.00 32.32 H new ATOM 0 HG12 ILE A 64 -17.863 9.280 13.686 1.00 31.12 H new ATOM 0 HG13 ILE A 64 -16.745 8.191 14.484 1.00 31.12 H new ATOM 0 HG21 ILE A 64 -16.548 5.800 13.675 1.00 30.02 H new ATOM 0 HG22 ILE A 64 -17.685 5.196 12.446 1.00 30.02 H new ATOM 0 HG23 ILE A 64 -16.372 6.302 11.977 1.00 30.02 H new ATOM 0 HD11 ILE A 64 -15.560 9.723 12.990 1.00 54.03 H new ATOM 0 HD12 ILE A 64 -15.395 8.044 12.422 1.00 54.03 H new ATOM 0 HD13 ILE A 64 -16.530 9.150 11.612 1.00 54.03 H new ATOM 874 N ASP A 65 -18.904 5.636 10.345 1.00 61.34 N ATOM 875 CA ASP A 65 -19.520 4.435 9.792 1.00 12.01 C ATOM 876 C ASP A 65 -18.540 3.266 9.804 1.00 11.24 C ATOM 877 O ASP A 65 -17.555 3.260 9.066 1.00 3.13 O ATOM 878 CB ASP A 65 -20.005 4.695 8.365 1.00 0.30 C ATOM 879 CG ASP A 65 -21.427 5.220 8.323 1.00 21.41 C ATOM 880 OD1 ASP A 65 -21.621 6.429 8.568 1.00 32.22 O ATOM 881 OD2 ASP A 65 -22.345 4.421 8.044 1.00 32.14 O ATOM 0 H ASP A 65 -17.971 5.836 9.984 1.00 61.34 H new ATOM 0 HA ASP A 65 -20.375 4.175 10.416 1.00 12.01 H new ATOM 0 HB2 ASP A 65 -19.341 5.414 7.884 1.00 0.30 H new ATOM 0 HB3 ASP A 65 -19.945 3.771 7.790 1.00 0.30 H new ATOM 886 N LYS A 66 -18.816 2.278 10.648 1.00 33.15 N ATOM 887 CA LYS A 66 -17.960 1.103 10.758 1.00 31.21 C ATOM 888 C LYS A 66 -18.003 0.277 9.476 1.00 30.14 C ATOM 889 O LYS A 66 -18.823 -0.630 9.339 1.00 41.24 O ATOM 890 CB LYS A 66 -18.391 0.241 11.947 1.00 12.32 C ATOM 891 CG LYS A 66 -17.581 -1.035 12.099 1.00 12.53 C ATOM 892 CD LYS A 66 -18.456 -2.270 11.968 1.00 14.32 C ATOM 893 CE LYS A 66 -17.640 -3.492 11.576 1.00 15.11 C ATOM 894 NZ LYS A 66 -18.054 -4.703 12.338 1.00 1.42 N ATOM 0 H LYS A 66 -19.627 2.268 11.267 1.00 33.15 H new ATOM 0 HA LYS A 66 -16.937 1.444 10.916 1.00 31.21 H new ATOM 0 HB2 LYS A 66 -18.303 0.828 12.861 1.00 12.32 H new ATOM 0 HB3 LYS A 66 -19.444 -0.018 11.834 1.00 12.32 H new ATOM 0 HG2 LYS A 66 -16.797 -1.062 11.342 1.00 12.53 H new ATOM 0 HG3 LYS A 66 -17.087 -1.040 13.070 1.00 12.53 H new ATOM 0 HD2 LYS A 66 -18.965 -2.459 12.913 1.00 14.32 H new ATOM 0 HD3 LYS A 66 -19.229 -2.092 11.220 1.00 14.32 H new ATOM 0 HE2 LYS A 66 -17.755 -3.678 10.508 1.00 15.11 H new ATOM 0 HE3 LYS A 66 -16.583 -3.295 11.754 1.00 15.11 H new ATOM 0 HZ1 LYS A 66 -17.474 -5.514 12.042 1.00 1.42 H new ATOM 0 HZ2 LYS A 66 -17.921 -4.535 13.356 1.00 1.42 H new ATOM 0 HZ3 LYS A 66 -19.056 -4.906 12.149 1.00 1.42 H new ATOM 908 N ASN A 67 -17.114 0.596 8.542 1.00 44.31 N ATOM 909 CA ASN A 67 -17.050 -0.117 7.272 1.00 62.44 C ATOM 910 C ASN A 67 -15.931 0.435 6.393 1.00 74.30 C ATOM 911 O ASN A 67 -14.901 -0.212 6.201 1.00 13.43 O ATOM 912 CB ASN A 67 -18.388 -0.015 6.537 1.00 13.34 C ATOM 913 CG ASN A 67 -19.093 -1.353 6.431 1.00 73.04 C ATOM 914 OD1 ASN A 67 -20.168 -1.548 6.998 1.00 13.12 O ATOM 915 ND2 ASN A 67 -18.489 -2.283 5.701 1.00 71.35 N ATOM 0 H ASN A 67 -16.428 1.344 8.641 1.00 44.31 H new ATOM 0 HA ASN A 67 -16.838 -1.165 7.484 1.00 62.44 H new ATOM 0 HB2 ASN A 67 -19.033 0.692 7.059 1.00 13.34 H new ATOM 0 HB3 ASN A 67 -18.220 0.385 5.537 1.00 13.34 H new ATOM 0 HD21 ASN A 67 -18.916 -3.203 5.593 1.00 71.35 H new ATOM 0 HD22 ASN A 67 -17.598 -2.077 5.249 1.00 71.35 H new ATOM 922 N VAL A 68 -16.142 1.635 5.861 1.00 25.15 N ATOM 923 CA VAL A 68 -15.151 2.276 5.005 1.00 70.44 C ATOM 924 C VAL A 68 -13.919 2.689 5.802 1.00 14.13 C ATOM 925 O VAL A 68 -13.981 2.922 7.010 1.00 65.13 O ATOM 926 CB VAL A 68 -15.735 3.516 4.302 1.00 23.04 C ATOM 927 CG1 VAL A 68 -16.747 3.104 3.244 1.00 2.03 C ATOM 928 CG2 VAL A 68 -16.366 4.455 5.319 1.00 50.32 C ATOM 0 H VAL A 68 -16.990 2.182 6.008 1.00 25.15 H new ATOM 0 HA VAL A 68 -14.862 1.543 4.252 1.00 70.44 H new ATOM 0 HB VAL A 68 -14.923 4.047 3.805 1.00 23.04 H new ATOM 0 HG11 VAL A 68 -17.148 3.994 2.759 1.00 2.03 H new ATOM 0 HG12 VAL A 68 -16.260 2.473 2.500 1.00 2.03 H new ATOM 0 HG13 VAL A 68 -17.559 2.549 3.714 1.00 2.03 H new ATOM 0 HG21 VAL A 68 -16.774 5.326 4.806 1.00 50.32 H new ATOM 0 HG22 VAL A 68 -17.167 3.936 5.846 1.00 50.32 H new ATOM 0 HG23 VAL A 68 -15.610 4.777 6.035 1.00 50.32 H new ATOM 938 N PRO A 69 -12.773 2.784 5.113 1.00 24.12 N ATOM 939 CA PRO A 69 -11.504 3.171 5.737 1.00 22.12 C ATOM 940 C PRO A 69 -11.487 4.637 6.156 1.00 34.02 C ATOM 941 O PRO A 69 -11.567 5.534 5.315 1.00 31.54 O ATOM 942 CB PRO A 69 -10.474 2.919 4.633 1.00 31.31 C ATOM 943 CG PRO A 69 -11.245 3.030 3.363 1.00 32.33 C ATOM 944 CD PRO A 69 -12.626 2.521 3.672 1.00 72.03 C ATOM 0 HA PRO A 69 -11.313 2.611 6.653 1.00 22.12 H new ATOM 0 HB2 PRO A 69 -9.666 3.650 4.671 1.00 31.31 H new ATOM 0 HB3 PRO A 69 -10.018 1.934 4.734 1.00 31.31 H new ATOM 0 HG2 PRO A 69 -11.278 4.063 3.015 1.00 32.33 H new ATOM 0 HG3 PRO A 69 -10.780 2.442 2.572 1.00 32.33 H new ATOM 0 HD2 PRO A 69 -13.386 3.042 3.089 1.00 72.03 H new ATOM 0 HD3 PRO A 69 -12.723 1.459 3.446 1.00 72.03 H new ATOM 952 N CYS A 70 -11.383 4.874 7.459 1.00 32.10 N ATOM 953 CA CYS A 70 -11.357 6.232 7.989 1.00 4.44 C ATOM 954 C CYS A 70 -10.223 6.401 8.996 1.00 71.11 C ATOM 955 O CYS A 70 -9.764 5.430 9.598 1.00 34.11 O ATOM 956 CB CYS A 70 -12.695 6.571 8.648 1.00 5.23 C ATOM 957 SG CYS A 70 -14.133 6.273 7.594 1.00 21.32 S ATOM 0 H CYS A 70 -11.315 4.143 8.167 1.00 32.10 H new ATOM 0 HA CYS A 70 -11.186 6.916 7.158 1.00 4.44 H new ATOM 0 HB2 CYS A 70 -12.798 5.983 9.560 1.00 5.23 H new ATOM 0 HB3 CYS A 70 -12.686 7.620 8.945 1.00 5.23 H new ATOM 0 HG CYS A 70 -14.267 4.995 7.394 1.00 21.32 H new ATOM 963 N TYR A 71 -9.775 7.639 9.172 1.00 22.21 N ATOM 964 CA TYR A 71 -8.692 7.934 10.103 1.00 42.44 C ATOM 965 C TYR A 71 -9.081 9.065 11.050 1.00 31.33 C ATOM 966 O TYR A 71 -9.552 10.117 10.619 1.00 23.12 O ATOM 967 CB TYR A 71 -7.422 8.310 9.337 1.00 0.11 C ATOM 968 CG TYR A 71 -7.108 7.377 8.190 1.00 71.14 C ATOM 969 CD1 TYR A 71 -7.673 7.572 6.935 1.00 0.32 C ATOM 970 CD2 TYR A 71 -6.248 6.299 8.360 1.00 43.32 C ATOM 971 CE1 TYR A 71 -7.390 6.722 5.884 1.00 62.10 C ATOM 972 CE2 TYR A 71 -5.958 5.445 7.314 1.00 63.20 C ATOM 973 CZ TYR A 71 -6.531 5.660 6.078 1.00 32.02 C ATOM 974 OH TYR A 71 -6.246 4.810 5.034 1.00 1.12 O ATOM 0 H TYR A 71 -10.145 8.454 8.683 1.00 22.21 H new ATOM 0 HA TYR A 71 -8.501 7.039 10.694 1.00 42.44 H new ATOM 0 HB2 TYR A 71 -7.527 9.324 8.951 1.00 0.11 H new ATOM 0 HB3 TYR A 71 -6.580 8.318 10.029 1.00 0.11 H new ATOM 0 HD1 TYR A 71 -8.345 8.403 6.779 1.00 0.32 H new ATOM 0 HD2 TYR A 71 -5.799 6.126 9.327 1.00 43.32 H new ATOM 0 HE1 TYR A 71 -7.839 6.888 4.916 1.00 62.10 H new ATOM 0 HE2 TYR A 71 -5.286 4.613 7.463 1.00 63.20 H new ATOM 0 HH TYR A 71 -5.459 4.270 5.257 1.00 1.12 H new ATOM 984 N ALA A 72 -8.880 8.839 12.344 1.00 31.45 N ATOM 985 CA ALA A 72 -9.207 9.838 13.354 1.00 22.33 C ATOM 986 C ALA A 72 -7.999 10.144 14.234 1.00 55.52 C ATOM 987 O ALA A 72 -7.421 9.247 14.845 1.00 20.22 O ATOM 988 CB ALA A 72 -10.376 9.365 14.206 1.00 61.14 C ATOM 0 H ALA A 72 -8.492 7.973 12.718 1.00 31.45 H new ATOM 0 HA ALA A 72 -9.493 10.756 12.842 1.00 22.33 H new ATOM 0 HB1 ALA A 72 -10.609 10.121 14.956 1.00 61.14 H new ATOM 0 HB2 ALA A 72 -11.247 9.203 13.571 1.00 61.14 H new ATOM 0 HB3 ALA A 72 -10.110 8.432 14.702 1.00 61.14 H new ATOM 994 N ALA A 73 -7.624 11.418 14.292 1.00 11.02 N ATOM 995 CA ALA A 73 -6.486 11.843 15.098 1.00 32.20 C ATOM 996 C ALA A 73 -6.945 12.594 16.343 1.00 33.23 C ATOM 997 O ALA A 73 -7.776 13.499 16.264 1.00 44.34 O ATOM 998 CB ALA A 73 -5.549 12.711 14.272 1.00 61.25 C ATOM 0 H ALA A 73 -8.092 12.173 13.791 1.00 11.02 H new ATOM 0 HA ALA A 73 -5.948 10.952 15.421 1.00 32.20 H new ATOM 0 HB1 ALA A 73 -4.704 13.021 14.887 1.00 61.25 H new ATOM 0 HB2 ALA A 73 -5.186 12.142 13.416 1.00 61.25 H new ATOM 0 HB3 ALA A 73 -6.085 13.593 13.921 1.00 61.25 H new ATOM 1004 N PHE A 74 -6.400 12.212 17.494 1.00 74.45 N ATOM 1005 CA PHE A 74 -6.756 12.848 18.757 1.00 44.05 C ATOM 1006 C PHE A 74 -5.514 13.385 19.463 1.00 53.21 C ATOM 1007 O PHE A 74 -4.542 12.659 19.670 1.00 2.21 O ATOM 1008 CB PHE A 74 -7.484 11.855 19.665 1.00 1.41 C ATOM 1009 CG PHE A 74 -7.698 12.366 21.061 1.00 5.14 C ATOM 1010 CD1 PHE A 74 -8.159 13.655 21.279 1.00 62.51 C ATOM 1011 CD2 PHE A 74 -7.438 11.558 22.156 1.00 23.13 C ATOM 1012 CE1 PHE A 74 -8.355 14.127 22.563 1.00 54.13 C ATOM 1013 CE2 PHE A 74 -7.633 12.025 23.443 1.00 62.15 C ATOM 1014 CZ PHE A 74 -8.093 13.311 23.646 1.00 73.13 C ATOM 0 H PHE A 74 -5.710 11.465 17.578 1.00 74.45 H new ATOM 0 HA PHE A 74 -7.420 13.685 18.540 1.00 44.05 H new ATOM 0 HB2 PHE A 74 -8.450 11.612 19.223 1.00 1.41 H new ATOM 0 HB3 PHE A 74 -6.912 10.928 19.709 1.00 1.41 H new ATOM 0 HD1 PHE A 74 -8.367 14.297 20.436 1.00 62.51 H new ATOM 0 HD2 PHE A 74 -7.079 10.551 22.003 1.00 23.13 H new ATOM 0 HE1 PHE A 74 -8.713 15.134 22.720 1.00 54.13 H new ATOM 0 HE2 PHE A 74 -7.426 11.385 24.288 1.00 62.15 H new ATOM 0 HZ PHE A 74 -8.248 13.678 24.650 1.00 73.13 H new ATOM 1024 N ASP A 75 -5.556 14.661 19.830 1.00 45.35 N ATOM 1025 CA ASP A 75 -4.435 15.297 20.513 1.00 31.01 C ATOM 1026 C ASP A 75 -4.658 15.313 22.022 1.00 3.12 C ATOM 1027 O ASP A 75 -5.670 15.821 22.506 1.00 62.04 O ATOM 1028 CB ASP A 75 -4.239 16.724 19.999 1.00 54.03 C ATOM 1029 CG ASP A 75 -2.853 17.261 20.294 1.00 23.21 C ATOM 1030 OD1 ASP A 75 -1.867 16.556 19.992 1.00 5.22 O ATOM 1031 OD2 ASP A 75 -2.754 18.386 20.826 1.00 25.14 O ATOM 0 H ASP A 75 -6.354 15.275 19.666 1.00 45.35 H new ATOM 0 HA ASP A 75 -3.536 14.717 20.302 1.00 31.01 H new ATOM 0 HB2 ASP A 75 -4.413 16.746 18.923 1.00 54.03 H new ATOM 0 HB3 ASP A 75 -4.983 17.377 20.456 1.00 54.03 H new ATOM 1036 N PHE A 76 -3.706 14.753 22.762 1.00 71.15 N ATOM 1037 CA PHE A 76 -3.799 14.701 24.216 1.00 70.11 C ATOM 1038 C PHE A 76 -2.467 15.075 24.860 1.00 52.33 C ATOM 1039 O PHE A 76 -1.413 14.583 24.459 1.00 0.22 O ATOM 1040 CB PHE A 76 -4.223 13.303 24.671 1.00 15.23 C ATOM 1041 CG PHE A 76 -4.912 13.291 26.006 1.00 30.02 C ATOM 1042 CD1 PHE A 76 -6.108 13.966 26.190 1.00 50.13 C ATOM 1043 CD2 PHE A 76 -4.364 12.604 27.077 1.00 4.12 C ATOM 1044 CE1 PHE A 76 -6.743 13.957 27.417 1.00 11.01 C ATOM 1045 CE2 PHE A 76 -4.994 12.591 28.307 1.00 54.20 C ATOM 1046 CZ PHE A 76 -6.186 13.268 28.477 1.00 74.23 C ATOM 0 H PHE A 76 -2.861 14.329 22.378 1.00 71.15 H new ATOM 0 HA PHE A 76 -4.551 15.423 24.533 1.00 70.11 H new ATOM 0 HB2 PHE A 76 -4.889 12.873 23.923 1.00 15.23 H new ATOM 0 HB3 PHE A 76 -3.342 12.663 24.720 1.00 15.23 H new ATOM 0 HD1 PHE A 76 -6.549 14.505 25.365 1.00 50.13 H new ATOM 0 HD2 PHE A 76 -3.433 12.072 26.949 1.00 4.12 H new ATOM 0 HE1 PHE A 76 -7.674 14.488 27.547 1.00 11.01 H new ATOM 0 HE2 PHE A 76 -4.555 12.052 29.134 1.00 54.20 H new ATOM 0 HZ PHE A 76 -6.682 13.259 29.437 1.00 74.23 H new ATOM 1056 N GLU A 77 -2.525 15.950 25.859 1.00 30.12 N ATOM 1057 CA GLU A 77 -1.323 16.391 26.557 1.00 14.44 C ATOM 1058 C GLU A 77 -0.992 15.455 27.716 1.00 14.22 C ATOM 1059 O GLU A 77 -1.886 14.889 28.346 1.00 13.51 O ATOM 1060 CB GLU A 77 -1.504 17.819 27.077 1.00 51.43 C ATOM 1061 CG GLU A 77 -2.755 18.007 27.918 1.00 11.24 C ATOM 1062 CD GLU A 77 -2.567 19.028 29.023 1.00 1.44 C ATOM 1063 OE1 GLU A 77 -1.638 18.855 29.840 1.00 14.32 O ATOM 1064 OE2 GLU A 77 -3.349 20.001 29.071 1.00 43.22 O ATOM 0 H GLU A 77 -3.390 16.367 26.203 1.00 30.12 H new ATOM 0 HA GLU A 77 -0.495 16.371 25.849 1.00 14.44 H new ATOM 0 HB2 GLU A 77 -0.632 18.093 27.671 1.00 51.43 H new ATOM 0 HB3 GLU A 77 -1.540 18.503 26.229 1.00 51.43 H new ATOM 0 HG2 GLU A 77 -3.577 18.321 27.275 1.00 11.24 H new ATOM 0 HG3 GLU A 77 -3.041 17.051 28.357 1.00 11.24 H new ATOM 1167 N ARG A 85 3.800 18.526 28.009 1.00 74.41 N ATOM 1168 CA ARG A 85 4.060 17.661 26.865 1.00 65.34 C ATOM 1169 C ARG A 85 2.782 17.410 26.070 1.00 43.44 C ATOM 1170 O ARG A 85 1.685 17.395 26.628 1.00 62.00 O ATOM 1171 CB ARG A 85 4.654 16.329 27.329 1.00 13.43 C ATOM 1172 CG ARG A 85 5.684 15.754 26.371 1.00 12.01 C ATOM 1173 CD ARG A 85 6.898 16.661 26.248 1.00 52.43 C ATOM 1174 NE ARG A 85 6.829 17.510 25.061 1.00 74.21 N ATOM 1175 CZ ARG A 85 7.779 18.373 24.718 1.00 74.40 C ATOM 1176 NH1 ARG A 85 8.865 18.500 25.467 1.00 11.14 N ATOM 1177 NH2 ARG A 85 7.643 19.110 23.623 1.00 63.41 N ATOM 0 HA ARG A 85 4.777 18.165 26.217 1.00 65.34 H new ATOM 0 HB2 ARG A 85 5.117 16.468 28.306 1.00 13.43 H new ATOM 0 HB3 ARG A 85 3.848 15.607 27.458 1.00 13.43 H new ATOM 0 HG2 ARG A 85 5.997 14.770 26.720 1.00 12.01 H new ATOM 0 HG3 ARG A 85 5.231 15.615 25.389 1.00 12.01 H new ATOM 0 HD2 ARG A 85 6.975 17.287 27.137 1.00 52.43 H new ATOM 0 HD3 ARG A 85 7.802 16.053 26.207 1.00 52.43 H new ATOM 0 HE ARG A 85 6.006 17.436 24.463 1.00 74.21 H new ATOM 0 HH11 ARG A 85 8.973 17.934 26.309 1.00 11.14 H new ATOM 0 HH12 ARG A 85 9.593 19.163 25.201 1.00 11.14 H new ATOM 0 HH21 ARG A 85 6.809 19.014 23.044 1.00 63.41 H new ATOM 0 HH22 ARG A 85 8.373 19.772 23.360 1.00 63.41 H new ATOM 1191 N ASP A 86 2.932 17.216 24.764 1.00 24.42 N ATOM 1192 CA ASP A 86 1.791 16.966 23.892 1.00 34.41 C ATOM 1193 C ASP A 86 2.053 15.769 22.983 1.00 32.22 C ATOM 1194 O ASP A 86 3.128 15.645 22.397 1.00 62.52 O ATOM 1195 CB ASP A 86 1.484 18.205 23.049 1.00 25.42 C ATOM 1196 CG ASP A 86 2.561 18.485 22.019 1.00 23.35 C ATOM 1197 OD1 ASP A 86 3.751 18.512 22.398 1.00 12.40 O ATOM 1198 OD2 ASP A 86 2.214 18.677 20.835 1.00 4.21 O ATOM 0 H ASP A 86 3.833 17.227 24.286 1.00 24.42 H new ATOM 0 HA ASP A 86 0.929 16.741 24.520 1.00 34.41 H new ATOM 0 HB2 ASP A 86 0.528 18.069 22.543 1.00 25.42 H new ATOM 0 HB3 ASP A 86 1.378 19.070 23.704 1.00 25.42 H new ATOM 1203 N LYS A 87 1.063 14.889 22.872 1.00 43.25 N ATOM 1204 CA LYS A 87 1.185 13.702 22.034 1.00 24.33 C ATOM 1205 C LYS A 87 -0.110 13.437 21.274 1.00 61.33 C ATOM 1206 O LYS A 87 -1.192 13.407 21.861 1.00 20.34 O ATOM 1207 CB LYS A 87 1.545 12.485 22.889 1.00 23.54 C ATOM 1208 CG LYS A 87 3.041 12.271 23.044 1.00 21.03 C ATOM 1209 CD LYS A 87 3.568 11.264 22.036 1.00 61.02 C ATOM 1210 CE LYS A 87 4.320 11.949 20.905 1.00 24.12 C ATOM 1211 NZ LYS A 87 5.788 11.716 20.995 1.00 65.33 N ATOM 0 H LYS A 87 0.167 14.976 23.352 1.00 43.25 H new ATOM 0 HA LYS A 87 1.980 13.879 21.310 1.00 24.33 H new ATOM 0 HB2 LYS A 87 1.099 12.601 23.877 1.00 23.54 H new ATOM 0 HB3 LYS A 87 1.103 11.594 22.442 1.00 23.54 H new ATOM 0 HG2 LYS A 87 3.560 13.221 22.916 1.00 21.03 H new ATOM 0 HG3 LYS A 87 3.257 11.923 24.054 1.00 21.03 H new ATOM 0 HD2 LYS A 87 4.229 10.557 22.538 1.00 61.02 H new ATOM 0 HD3 LYS A 87 2.738 10.689 21.626 1.00 61.02 H new ATOM 0 HE2 LYS A 87 3.952 11.580 19.948 1.00 24.12 H new ATOM 0 HE3 LYS A 87 4.120 13.020 20.932 1.00 24.12 H new ATOM 0 HZ1 LYS A 87 6.265 12.199 20.207 1.00 65.33 H new ATOM 0 HZ2 LYS A 87 6.144 12.091 21.897 1.00 65.33 H new ATOM 0 HZ3 LYS A 87 5.981 10.695 20.944 1.00 65.33 H new ATOM 1225 N LEU A 88 0.007 13.244 19.965 1.00 62.44 N ATOM 1226 CA LEU A 88 -1.155 12.979 19.123 1.00 1.13 C ATOM 1227 C LEU A 88 -1.168 11.528 18.653 1.00 11.04 C ATOM 1228 O LEU A 88 -0.133 10.979 18.274 1.00 32.11 O ATOM 1229 CB LEU A 88 -1.159 13.918 17.916 1.00 54.22 C ATOM 1230 CG LEU A 88 -2.527 14.447 17.482 1.00 61.13 C ATOM 1231 CD1 LEU A 88 -2.368 15.642 16.555 1.00 5.22 C ATOM 1232 CD2 LEU A 88 -3.333 13.348 16.804 1.00 2.21 C ATOM 0 H LEU A 88 0.895 13.266 19.463 1.00 62.44 H new ATOM 0 HA LEU A 88 -2.051 13.157 19.717 1.00 1.13 H new ATOM 0 HB2 LEU A 88 -0.517 14.770 18.141 1.00 54.22 H new ATOM 0 HB3 LEU A 88 -0.710 13.395 17.072 1.00 54.22 H new ATOM 0 HG LEU A 88 -3.068 14.772 18.371 1.00 61.13 H new ATOM 0 HD11 LEU A 88 -3.352 16.005 16.257 1.00 5.22 H new ATOM 0 HD12 LEU A 88 -1.831 16.436 17.074 1.00 5.22 H new ATOM 0 HD13 LEU A 88 -1.808 15.343 15.669 1.00 5.22 H new ATOM 0 HD21 LEU A 88 -4.303 13.742 16.502 1.00 2.21 H new ATOM 0 HD22 LEU A 88 -2.796 12.993 15.925 1.00 2.21 H new ATOM 0 HD23 LEU A 88 -3.478 12.521 17.499 1.00 2.21 H new ATOM 1244 N ILE A 89 -2.346 10.914 18.679 1.00 20.23 N ATOM 1245 CA ILE A 89 -2.494 9.528 18.253 1.00 61.12 C ATOM 1246 C ILE A 89 -3.370 9.426 17.009 1.00 41.02 C ATOM 1247 O ILE A 89 -4.279 10.233 16.808 1.00 22.13 O ATOM 1248 CB ILE A 89 -3.102 8.657 19.368 1.00 14.52 C ATOM 1249 CG1 ILE A 89 -2.347 8.872 20.682 1.00 74.14 C ATOM 1250 CG2 ILE A 89 -3.075 7.190 18.969 1.00 73.32 C ATOM 1251 CD1 ILE A 89 -2.948 9.951 21.555 1.00 52.34 C ATOM 0 H ILE A 89 -3.212 11.354 18.991 1.00 20.23 H new ATOM 0 HA ILE A 89 -1.494 9.161 18.022 1.00 61.12 H new ATOM 0 HB ILE A 89 -4.141 8.954 19.515 1.00 14.52 H new ATOM 0 HG12 ILE A 89 -2.328 7.935 21.238 1.00 74.14 H new ATOM 0 HG13 ILE A 89 -1.312 9.131 20.459 1.00 74.14 H new ATOM 0 HG21 ILE A 89 -3.508 6.588 19.768 1.00 73.32 H new ATOM 0 HG22 ILE A 89 -3.653 7.051 18.055 1.00 73.32 H new ATOM 0 HG23 ILE A 89 -2.045 6.878 18.798 1.00 73.32 H new ATOM 0 HD11 ILE A 89 -2.362 10.048 22.469 1.00 52.34 H new ATOM 0 HD12 ILE A 89 -2.942 10.899 21.017 1.00 52.34 H new ATOM 0 HD13 ILE A 89 -3.974 9.684 21.809 1.00 52.34 H new ATOM 1263 N LEU A 90 -3.092 8.429 16.177 1.00 71.44 N ATOM 1264 CA LEU A 90 -3.856 8.219 14.952 1.00 72.13 C ATOM 1265 C LEU A 90 -4.460 6.819 14.919 1.00 21.54 C ATOM 1266 O LEU A 90 -3.740 5.821 14.958 1.00 65.54 O ATOM 1267 CB LEU A 90 -2.963 8.430 13.728 1.00 52.02 C ATOM 1268 CG LEU A 90 -3.673 8.873 12.448 1.00 44.42 C ATOM 1269 CD1 LEU A 90 -4.645 7.803 11.978 1.00 61.50 C ATOM 1270 CD2 LEU A 90 -4.396 10.194 12.669 1.00 34.51 C ATOM 0 H LEU A 90 -2.343 7.753 16.328 1.00 71.44 H new ATOM 0 HA LEU A 90 -4.668 8.945 14.932 1.00 72.13 H new ATOM 0 HB2 LEU A 90 -2.208 9.176 13.978 1.00 52.02 H new ATOM 0 HB3 LEU A 90 -2.435 7.499 13.523 1.00 52.02 H new ATOM 0 HG LEU A 90 -2.922 9.018 11.671 1.00 44.42 H new ATOM 0 HD11 LEU A 90 -5.140 8.137 11.066 1.00 61.50 H new ATOM 0 HD12 LEU A 90 -4.101 6.880 11.778 1.00 61.50 H new ATOM 0 HD13 LEU A 90 -5.392 7.624 12.752 1.00 61.50 H new ATOM 0 HD21 LEU A 90 -4.896 10.494 11.748 1.00 34.51 H new ATOM 0 HD22 LEU A 90 -5.136 10.076 13.461 1.00 34.51 H new ATOM 0 HD23 LEU A 90 -3.675 10.959 12.957 1.00 34.51 H new ATOM 1282 N ILE A 91 -5.785 6.753 14.847 1.00 61.40 N ATOM 1283 CA ILE A 91 -6.485 5.475 14.806 1.00 24.40 C ATOM 1284 C ILE A 91 -7.176 5.269 13.462 1.00 2.14 C ATOM 1285 O ILE A 91 -8.005 6.080 13.049 1.00 65.34 O ATOM 1286 CB ILE A 91 -7.532 5.370 15.931 1.00 62.25 C ATOM 1287 CG1 ILE A 91 -6.862 5.531 17.297 1.00 75.00 C ATOM 1288 CG2 ILE A 91 -8.266 4.040 15.848 1.00 32.00 C ATOM 1289 CD1 ILE A 91 -7.633 6.422 18.246 1.00 72.11 C ATOM 0 H ILE A 91 -6.395 7.570 14.816 1.00 61.40 H new ATOM 0 HA ILE A 91 -5.733 4.699 14.947 1.00 24.40 H new ATOM 0 HB ILE A 91 -8.259 6.172 15.807 1.00 62.25 H new ATOM 0 HG12 ILE A 91 -6.741 4.548 17.752 1.00 75.00 H new ATOM 0 HG13 ILE A 91 -5.862 5.942 17.156 1.00 75.00 H new ATOM 0 HG21 ILE A 91 -9.003 3.980 16.649 1.00 32.00 H new ATOM 0 HG22 ILE A 91 -8.770 3.962 14.885 1.00 32.00 H new ATOM 0 HG23 ILE A 91 -7.552 3.223 15.950 1.00 32.00 H new ATOM 0 HD11 ILE A 91 -7.100 6.491 19.194 1.00 72.11 H new ATOM 0 HD12 ILE A 91 -7.731 7.417 17.812 1.00 72.11 H new ATOM 0 HD13 ILE A 91 -8.624 6.001 18.416 1.00 72.11 H new ATOM 1301 N SER A 92 -6.830 4.178 12.786 1.00 12.21 N ATOM 1302 CA SER A 92 -7.416 3.866 11.488 1.00 41.34 C ATOM 1303 C SER A 92 -8.503 2.804 11.623 1.00 40.41 C ATOM 1304 O SER A 92 -8.349 1.834 12.365 1.00 40.23 O ATOM 1305 CB SER A 92 -6.334 3.384 10.519 1.00 11.40 C ATOM 1306 OG SER A 92 -6.804 3.396 9.182 1.00 14.03 O ATOM 0 H SER A 92 -6.147 3.496 13.116 1.00 12.21 H new ATOM 0 HA SER A 92 -7.869 4.776 11.094 1.00 41.34 H new ATOM 0 HB2 SER A 92 -5.455 4.022 10.604 1.00 11.40 H new ATOM 0 HB3 SER A 92 -6.023 2.375 10.789 1.00 11.40 H new ATOM 0 HG SER A 92 -6.747 4.306 8.823 1.00 14.03 H new ATOM 1312 N TRP A 93 -9.601 2.996 10.901 1.00 11.21 N ATOM 1313 CA TRP A 93 -10.715 2.055 10.940 1.00 40.40 C ATOM 1314 C TRP A 93 -10.681 1.122 9.735 1.00 73.11 C ATOM 1315 O TRP A 93 -10.682 1.572 8.590 1.00 72.31 O ATOM 1316 CB TRP A 93 -12.045 2.810 10.980 1.00 71.55 C ATOM 1317 CG TRP A 93 -13.031 2.224 11.944 1.00 35.11 C ATOM 1318 CD1 TRP A 93 -13.454 0.926 11.997 1.00 13.45 C ATOM 1319 CD2 TRP A 93 -13.719 2.916 12.992 1.00 34.51 C ATOM 1320 NE1 TRP A 93 -14.364 0.770 13.016 1.00 64.34 N ATOM 1321 CE2 TRP A 93 -14.543 1.975 13.642 1.00 63.15 C ATOM 1322 CE3 TRP A 93 -13.718 4.237 13.447 1.00 74.14 C ATOM 1323 CZ2 TRP A 93 -15.356 2.316 14.719 1.00 50.32 C ATOM 1324 CZ3 TRP A 93 -14.526 4.574 14.516 1.00 54.23 C ATOM 1325 CH2 TRP A 93 -15.335 3.617 15.143 1.00 54.33 C ATOM 0 H TRP A 93 -9.744 3.794 10.282 1.00 11.21 H new ATOM 0 HA TRP A 93 -10.620 1.453 11.844 1.00 40.40 H new ATOM 0 HB2 TRP A 93 -11.857 3.849 11.250 1.00 71.55 H new ATOM 0 HB3 TRP A 93 -12.482 2.815 9.982 1.00 71.55 H new ATOM 0 HD1 TRP A 93 -13.123 0.139 11.336 1.00 13.45 H new ATOM 0 HE1 TRP A 93 -14.830 -0.102 13.265 1.00 64.34 H new ATOM 0 HE3 TRP A 93 -13.097 4.982 12.972 1.00 74.14 H new ATOM 0 HZ2 TRP A 93 -15.981 1.580 15.203 1.00 50.32 H new ATOM 0 HZ3 TRP A 93 -14.534 5.593 14.875 1.00 54.23 H new ATOM 0 HH2 TRP A 93 -15.954 3.912 15.977 1.00 54.33 H new ATOM 1336 N ASN A 94 -10.652 -0.180 10.001 1.00 41.01 N ATOM 1337 CA ASN A 94 -10.618 -1.177 8.937 1.00 43.21 C ATOM 1338 C ASN A 94 -10.751 -2.586 9.507 1.00 55.31 C ATOM 1339 O ASN A 94 -9.764 -3.278 9.756 1.00 11.32 O ATOM 1340 CB ASN A 94 -9.317 -1.058 8.140 1.00 22.32 C ATOM 1341 CG ASN A 94 -8.104 -0.889 9.035 1.00 13.41 C ATOM 1342 OD1 ASN A 94 -7.464 -1.866 9.423 1.00 3.41 O ATOM 1343 ND2 ASN A 94 -7.784 0.357 9.367 1.00 21.42 N ATOM 0 H ASN A 94 -10.651 -0.569 10.944 1.00 41.01 H new ATOM 0 HA ASN A 94 -11.462 -0.992 8.273 1.00 43.21 H new ATOM 0 HB2 ASN A 94 -9.189 -1.948 7.523 1.00 22.32 H new ATOM 0 HB3 ASN A 94 -9.386 -0.207 7.462 1.00 22.32 H new ATOM 0 HD21 ASN A 94 -6.979 0.534 9.967 1.00 21.42 H new ATOM 0 HD22 ASN A 94 -8.344 1.137 9.022 1.00 21.42 H new ATOM 1350 N PRO A 95 -12.002 -3.022 9.718 1.00 30.21 N ATOM 1351 CA PRO A 95 -12.295 -4.352 10.260 1.00 73.42 C ATOM 1352 C PRO A 95 -11.969 -5.466 9.271 1.00 60.05 C ATOM 1353 O PRO A 95 -12.342 -5.398 8.099 1.00 13.13 O ATOM 1354 CB PRO A 95 -13.801 -4.301 10.530 1.00 71.41 C ATOM 1355 CG PRO A 95 -14.321 -3.272 9.586 1.00 24.32 C ATOM 1356 CD PRO A 95 -13.226 -2.251 9.444 1.00 51.02 C ATOM 0 HA PRO A 95 -11.697 -4.573 11.144 1.00 73.42 H new ATOM 0 HB2 PRO A 95 -14.268 -5.270 10.355 1.00 71.41 H new ATOM 0 HB3 PRO A 95 -14.009 -4.030 11.565 1.00 71.41 H new ATOM 0 HG2 PRO A 95 -14.568 -3.716 8.622 1.00 24.32 H new ATOM 0 HG3 PRO A 95 -15.233 -2.815 9.970 1.00 24.32 H new ATOM 0 HD2 PRO A 95 -13.211 -1.815 8.445 1.00 51.02 H new ATOM 0 HD3 PRO A 95 -13.349 -1.429 10.149 1.00 51.02 H new ATOM 1364 N ASP A 96 -11.271 -6.490 9.749 1.00 71.11 N ATOM 1365 CA ASP A 96 -10.896 -7.620 8.906 1.00 2.34 C ATOM 1366 C ASP A 96 -12.131 -8.281 8.303 1.00 62.41 C ATOM 1367 O ASP A 96 -12.053 -8.928 7.258 1.00 21.04 O ATOM 1368 CB ASP A 96 -10.097 -8.643 9.715 1.00 72.31 C ATOM 1369 CG ASP A 96 -10.944 -9.345 10.759 1.00 50.43 C ATOM 1370 OD1 ASP A 96 -11.821 -10.145 10.371 1.00 43.40 O ATOM 1371 OD2 ASP A 96 -10.731 -9.093 11.963 1.00 3.24 O ATOM 0 H ASP A 96 -10.953 -6.561 10.716 1.00 71.11 H new ATOM 0 HA ASP A 96 -10.274 -7.246 8.093 1.00 2.34 H new ATOM 0 HB2 ASP A 96 -9.671 -9.384 9.039 1.00 72.31 H new ATOM 0 HB3 ASP A 96 -9.262 -8.142 10.205 1.00 72.31 H new ATOM 1376 N SER A 97 -13.269 -8.116 8.968 1.00 14.14 N ATOM 1377 CA SER A 97 -14.520 -8.701 8.500 1.00 33.25 C ATOM 1378 C SER A 97 -15.360 -7.666 7.758 1.00 61.44 C ATOM 1379 O SER A 97 -16.543 -7.881 7.498 1.00 12.12 O ATOM 1380 CB SER A 97 -15.315 -9.269 9.679 1.00 43.55 C ATOM 1381 OG SER A 97 -14.903 -10.590 9.982 1.00 2.02 O ATOM 0 H SER A 97 -13.351 -7.582 9.833 1.00 14.14 H new ATOM 0 HA SER A 97 -14.278 -9.510 7.810 1.00 33.25 H new ATOM 0 HB2 SER A 97 -15.179 -8.633 10.554 1.00 43.55 H new ATOM 0 HB3 SER A 97 -16.379 -9.262 9.442 1.00 43.55 H new ATOM 0 HG SER A 97 -13.934 -10.605 10.131 1.00 2.02 H new ATOM 1387 N GLY A 98 -14.737 -6.542 7.418 1.00 53.32 N ATOM 1388 CA GLY A 98 -15.441 -5.489 6.708 1.00 31.43 C ATOM 1389 C GLY A 98 -15.532 -5.755 5.219 1.00 74.22 C ATOM 1390 O GLY A 98 -16.229 -6.673 4.787 1.00 62.31 O ATOM 0 H GLY A 98 -13.758 -6.341 7.621 1.00 53.32 H new ATOM 0 HA2 GLY A 98 -16.446 -5.388 7.118 1.00 31.43 H new ATOM 0 HA3 GLY A 98 -14.932 -4.540 6.874 1.00 31.43 H new ATOM 1394 N ALA A 99 -14.829 -4.949 4.431 1.00 5.32 N ATOM 1395 CA ALA A 99 -14.833 -5.102 2.982 1.00 50.44 C ATOM 1396 C ALA A 99 -13.413 -5.203 2.436 1.00 63.21 C ATOM 1397 O ALA A 99 -12.444 -4.804 3.082 1.00 43.11 O ATOM 1398 CB ALA A 99 -15.569 -3.940 2.331 1.00 42.24 C ATOM 0 H ALA A 99 -14.249 -4.183 4.772 1.00 5.32 H new ATOM 0 HA ALA A 99 -15.353 -6.029 2.741 1.00 50.44 H new ATOM 0 HB1 ALA A 99 -15.564 -4.067 1.248 1.00 42.24 H new ATOM 0 HB2 ALA A 99 -16.598 -3.915 2.689 1.00 42.24 H new ATOM 0 HB3 ALA A 99 -15.072 -3.005 2.589 1.00 42.24 H new ATOM 1404 N PRO A 100 -13.284 -5.751 1.218 1.00 5.33 N ATOM 1405 CA PRO A 100 -11.985 -5.918 0.559 1.00 1.41 C ATOM 1406 C PRO A 100 -11.376 -4.586 0.133 1.00 61.24 C ATOM 1407 O PRO A 100 -10.201 -4.320 0.388 1.00 73.23 O ATOM 1408 CB PRO A 100 -12.317 -6.771 -0.667 1.00 63.14 C ATOM 1409 CG PRO A 100 -13.753 -6.491 -0.947 1.00 1.42 C ATOM 1410 CD PRO A 100 -14.395 -6.248 0.391 1.00 74.40 C ATOM 0 HA PRO A 100 -11.246 -6.369 1.222 1.00 1.41 H new ATOM 0 HB2 PRO A 100 -11.689 -6.504 -1.517 1.00 63.14 H new ATOM 0 HB3 PRO A 100 -12.152 -7.830 -0.469 1.00 63.14 H new ATOM 0 HG2 PRO A 100 -13.862 -5.622 -1.596 1.00 1.42 H new ATOM 0 HG3 PRO A 100 -14.222 -7.332 -1.458 1.00 1.42 H new ATOM 0 HD2 PRO A 100 -15.202 -5.519 0.323 1.00 74.40 H new ATOM 0 HD3 PRO A 100 -14.825 -7.161 0.802 1.00 74.40 H new ATOM 1418 N ARG A 101 -12.182 -3.753 -0.517 1.00 70.24 N ATOM 1419 CA ARG A 101 -11.722 -2.450 -0.980 1.00 4.52 C ATOM 1420 C ARG A 101 -11.347 -1.556 0.199 1.00 43.11 C ATOM 1421 O ARG A 101 -10.405 -0.766 0.119 1.00 21.44 O ATOM 1422 CB ARG A 101 -12.804 -1.772 -1.823 1.00 64.40 C ATOM 1423 CG ARG A 101 -12.272 -1.132 -3.095 1.00 15.31 C ATOM 1424 CD ARG A 101 -12.295 -2.107 -4.261 1.00 64.23 C ATOM 1425 NE ARG A 101 -13.656 -2.411 -4.695 1.00 44.11 N ATOM 1426 CZ ARG A 101 -13.947 -2.971 -5.864 1.00 4.11 C ATOM 1427 NH1 ARG A 101 -12.977 -3.287 -6.711 1.00 60.10 N ATOM 1428 NH2 ARG A 101 -15.210 -3.216 -6.187 1.00 60.32 N ATOM 0 H ARG A 101 -13.157 -3.958 -0.735 1.00 70.24 H new ATOM 0 HA ARG A 101 -10.835 -2.604 -1.595 1.00 4.52 H new ATOM 0 HB2 ARG A 101 -13.562 -2.509 -2.087 1.00 64.40 H new ATOM 0 HB3 ARG A 101 -13.297 -1.009 -1.221 1.00 64.40 H new ATOM 0 HG2 ARG A 101 -12.871 -0.255 -3.341 1.00 15.31 H new ATOM 0 HG3 ARG A 101 -11.252 -0.785 -2.930 1.00 15.31 H new ATOM 0 HD2 ARG A 101 -11.734 -1.687 -5.096 1.00 64.23 H new ATOM 0 HD3 ARG A 101 -11.792 -3.030 -3.972 1.00 64.23 H new ATOM 0 HE ARG A 101 -14.425 -2.181 -4.066 1.00 44.11 H new ATOM 0 HH11 ARG A 101 -12.005 -3.100 -6.466 1.00 60.10 H new ATOM 0 HH12 ARG A 101 -13.203 -3.717 -7.608 1.00 60.10 H new ATOM 0 HH21 ARG A 101 -15.959 -2.974 -5.538 1.00 60.32 H new ATOM 0 HH22 ARG A 101 -15.433 -3.646 -7.085 1.00 60.32 H new ATOM 1442 N THR A 102 -12.091 -1.685 1.293 1.00 22.11 N ATOM 1443 CA THR A 102 -11.838 -0.889 2.487 1.00 13.05 C ATOM 1444 C THR A 102 -10.472 -1.209 3.083 1.00 50.11 C ATOM 1445 O THR A 102 -9.713 -0.308 3.442 1.00 33.44 O ATOM 1446 CB THR A 102 -12.920 -1.124 3.558 1.00 32.14 C ATOM 1447 OG1 THR A 102 -12.793 -2.443 4.102 1.00 2.32 O ATOM 1448 CG2 THR A 102 -14.312 -0.945 2.970 1.00 3.14 C ATOM 0 H THR A 102 -12.874 -2.334 1.377 1.00 22.11 H new ATOM 0 HA THR A 102 -11.861 0.157 2.180 1.00 13.05 H new ATOM 0 HB THR A 102 -12.780 -0.389 4.351 1.00 32.14 H new ATOM 0 HG1 THR A 102 -12.624 -3.081 3.377 1.00 2.32 H new ATOM 0 HG21 THR A 102 -15.059 -1.116 3.745 1.00 3.14 H new ATOM 0 HG22 THR A 102 -14.416 0.069 2.583 1.00 3.14 H new ATOM 0 HG23 THR A 102 -14.459 -1.659 2.160 1.00 3.14 H new ATOM 1456 N LYS A 103 -10.163 -2.497 3.184 1.00 20.21 N ATOM 1457 CA LYS A 103 -8.886 -2.937 3.734 1.00 34.43 C ATOM 1458 C LYS A 103 -7.736 -2.564 2.805 1.00 62.20 C ATOM 1459 O LYS A 103 -6.645 -2.220 3.260 1.00 54.33 O ATOM 1460 CB LYS A 103 -8.901 -4.450 3.963 1.00 21.43 C ATOM 1461 CG LYS A 103 -9.336 -4.850 5.363 1.00 42.42 C ATOM 1462 CD LYS A 103 -8.261 -5.657 6.072 1.00 73.14 C ATOM 1463 CE LYS A 103 -7.361 -4.767 6.915 1.00 31.52 C ATOM 1464 NZ LYS A 103 -5.929 -5.158 6.799 1.00 62.11 N ATOM 0 H LYS A 103 -10.780 -3.255 2.892 1.00 20.21 H new ATOM 0 HA LYS A 103 -8.736 -2.432 4.689 1.00 34.43 H new ATOM 0 HB2 LYS A 103 -9.571 -4.912 3.238 1.00 21.43 H new ATOM 0 HB3 LYS A 103 -7.904 -4.847 3.774 1.00 21.43 H new ATOM 0 HG2 LYS A 103 -9.563 -3.956 5.944 1.00 42.42 H new ATOM 0 HG3 LYS A 103 -10.254 -5.435 5.306 1.00 42.42 H new ATOM 0 HD2 LYS A 103 -8.729 -6.409 6.707 1.00 73.14 H new ATOM 0 HD3 LYS A 103 -7.660 -6.191 5.336 1.00 73.14 H new ATOM 0 HE2 LYS A 103 -7.481 -3.730 6.603 1.00 31.52 H new ATOM 0 HE3 LYS A 103 -7.669 -4.823 7.959 1.00 31.52 H new ATOM 0 HZ1 LYS A 103 -5.348 -4.528 7.388 1.00 62.11 H new ATOM 0 HZ2 LYS A 103 -5.810 -6.140 7.121 1.00 62.11 H new ATOM 0 HZ3 LYS A 103 -5.627 -5.080 5.807 1.00 62.11 H new ATOM 1478 N MET A 104 -7.987 -2.634 1.502 1.00 52.12 N ATOM 1479 CA MET A 104 -6.972 -2.300 0.509 1.00 32.52 C ATOM 1480 C MET A 104 -6.710 -0.798 0.483 1.00 14.00 C ATOM 1481 O MET A 104 -5.560 -0.358 0.482 1.00 1.03 O ATOM 1482 CB MET A 104 -7.408 -2.778 -0.877 1.00 61.33 C ATOM 1483 CG MET A 104 -6.897 -4.166 -1.230 1.00 42.33 C ATOM 1484 SD MET A 104 -8.005 -5.052 -2.343 1.00 10.13 S ATOM 1485 CE MET A 104 -6.967 -5.218 -3.793 1.00 72.10 C ATOM 0 H MET A 104 -8.884 -2.919 1.109 1.00 52.12 H new ATOM 0 HA MET A 104 -6.048 -2.807 0.786 1.00 32.52 H new ATOM 0 HB2 MET A 104 -8.497 -2.777 -0.927 1.00 61.33 H new ATOM 0 HB3 MET A 104 -7.054 -2.068 -1.625 1.00 61.33 H new ATOM 0 HG2 MET A 104 -5.915 -4.080 -1.694 1.00 42.33 H new ATOM 0 HG3 MET A 104 -6.768 -4.745 -0.315 1.00 42.33 H new ATOM 0 HE1 MET A 104 -7.514 -5.748 -4.573 1.00 72.10 H new ATOM 0 HE2 MET A 104 -6.686 -4.229 -4.154 1.00 72.10 H new ATOM 0 HE3 MET A 104 -6.069 -5.779 -3.535 1.00 72.10 H new ATOM 1495 N LEU A 105 -7.784 -0.015 0.461 1.00 25.32 N ATOM 1496 CA LEU A 105 -7.670 1.439 0.435 1.00 64.23 C ATOM 1497 C LEU A 105 -6.823 1.940 1.601 1.00 55.14 C ATOM 1498 O LEU A 105 -6.155 2.969 1.499 1.00 61.15 O ATOM 1499 CB LEU A 105 -9.058 2.080 0.484 1.00 24.23 C ATOM 1500 CG LEU A 105 -9.586 2.640 -0.837 1.00 21.31 C ATOM 1501 CD1 LEU A 105 -11.075 2.933 -0.735 1.00 63.11 C ATOM 1502 CD2 LEU A 105 -8.819 3.894 -1.229 1.00 51.22 C ATOM 0 H LEU A 105 -8.743 -0.363 0.461 1.00 25.32 H new ATOM 0 HA LEU A 105 -7.178 1.724 -0.495 1.00 64.23 H new ATOM 0 HB2 LEU A 105 -9.767 1.337 0.850 1.00 24.23 H new ATOM 0 HB3 LEU A 105 -9.037 2.888 1.216 1.00 24.23 H new ATOM 0 HG LEU A 105 -9.437 1.890 -1.614 1.00 21.31 H new ATOM 0 HD11 LEU A 105 -11.433 3.331 -1.684 1.00 63.11 H new ATOM 0 HD12 LEU A 105 -11.612 2.013 -0.501 1.00 63.11 H new ATOM 0 HD13 LEU A 105 -11.249 3.665 0.054 1.00 63.11 H new ATOM 0 HD21 LEU A 105 -9.208 4.279 -2.172 1.00 51.22 H new ATOM 0 HD22 LEU A 105 -8.936 4.650 -0.452 1.00 51.22 H new ATOM 0 HD23 LEU A 105 -7.762 3.653 -1.344 1.00 51.22 H new ATOM 1514 N TYR A 106 -6.856 1.205 2.707 1.00 42.51 N ATOM 1515 CA TYR A 106 -6.092 1.575 3.893 1.00 52.44 C ATOM 1516 C TYR A 106 -4.601 1.646 3.580 1.00 64.21 C ATOM 1517 O TYR A 106 -3.907 2.567 4.011 1.00 53.12 O ATOM 1518 CB TYR A 106 -6.342 0.571 5.019 1.00 4.43 C ATOM 1519 CG TYR A 106 -5.417 0.747 6.203 1.00 51.42 C ATOM 1520 CD1 TYR A 106 -5.346 1.959 6.879 1.00 4.20 C ATOM 1521 CD2 TYR A 106 -4.615 -0.297 6.644 1.00 24.31 C ATOM 1522 CE1 TYR A 106 -4.502 2.125 7.960 1.00 30.04 C ATOM 1523 CE2 TYR A 106 -3.769 -0.141 7.725 1.00 33.04 C ATOM 1524 CZ TYR A 106 -3.716 1.072 8.380 1.00 33.11 C ATOM 1525 OH TYR A 106 -2.874 1.232 9.457 1.00 74.03 O ATOM 0 H TYR A 106 -7.403 0.350 2.807 1.00 42.51 H new ATOM 0 HA TYR A 106 -6.424 2.562 4.215 1.00 52.44 H new ATOM 0 HB2 TYR A 106 -7.374 0.666 5.357 1.00 4.43 H new ATOM 0 HB3 TYR A 106 -6.227 -0.439 4.626 1.00 4.43 H new ATOM 0 HD1 TYR A 106 -5.961 2.785 6.554 1.00 4.20 H new ATOM 0 HD2 TYR A 106 -4.653 -1.248 6.133 1.00 24.31 H new ATOM 0 HE1 TYR A 106 -4.458 3.074 8.474 1.00 30.04 H new ATOM 0 HE2 TYR A 106 -3.153 -0.964 8.055 1.00 33.04 H new ATOM 0 HH TYR A 106 -2.392 0.395 9.623 1.00 74.03 H new ATOM 1535 N SER A 107 -4.114 0.665 2.826 1.00 3.12 N ATOM 1536 CA SER A 107 -2.704 0.612 2.457 1.00 0.42 C ATOM 1537 C SER A 107 -2.386 1.642 1.377 1.00 75.43 C ATOM 1538 O SER A 107 -1.303 2.226 1.360 1.00 54.32 O ATOM 1539 CB SER A 107 -2.335 -0.789 1.967 1.00 74.04 C ATOM 1540 OG SER A 107 -1.243 -0.743 1.065 1.00 2.14 O ATOM 0 H SER A 107 -4.675 -0.104 2.459 1.00 3.12 H new ATOM 0 HA SER A 107 -2.113 0.846 3.343 1.00 0.42 H new ATOM 0 HB2 SER A 107 -2.081 -1.420 2.819 1.00 74.04 H new ATOM 0 HB3 SER A 107 -3.196 -1.245 1.478 1.00 74.04 H new ATOM 0 HG SER A 107 -1.026 -1.651 0.768 1.00 2.14 H new ATOM 1546 N SER A 108 -3.340 1.858 0.476 1.00 65.54 N ATOM 1547 CA SER A 108 -3.161 2.813 -0.611 1.00 54.05 C ATOM 1548 C SER A 108 -3.090 4.239 -0.075 1.00 13.42 C ATOM 1549 O SER A 108 -2.494 5.119 -0.696 1.00 52.10 O ATOM 1550 CB SER A 108 -4.307 2.691 -1.618 1.00 42.44 C ATOM 1551 OG SER A 108 -4.041 3.448 -2.787 1.00 13.13 O ATOM 0 H SER A 108 -4.244 1.385 0.478 1.00 65.54 H new ATOM 0 HA SER A 108 -2.220 2.585 -1.112 1.00 54.05 H new ATOM 0 HB2 SER A 108 -4.452 1.644 -1.884 1.00 42.44 H new ATOM 0 HB3 SER A 108 -5.235 3.035 -1.161 1.00 42.44 H new ATOM 0 HG SER A 108 -4.703 3.229 -3.476 1.00 13.13 H new ATOM 1557 N SER A 109 -3.703 4.460 1.084 1.00 51.32 N ATOM 1558 CA SER A 109 -3.713 5.780 1.704 1.00 55.23 C ATOM 1559 C SER A 109 -2.666 5.869 2.809 1.00 2.32 C ATOM 1560 O SER A 109 -2.185 6.954 3.138 1.00 14.11 O ATOM 1561 CB SER A 109 -5.100 6.089 2.273 1.00 64.31 C ATOM 1562 OG SER A 109 -5.426 7.458 2.107 1.00 23.25 O ATOM 0 H SER A 109 -4.199 3.742 1.612 1.00 51.32 H new ATOM 0 HA SER A 109 -3.470 6.516 0.938 1.00 55.23 H new ATOM 0 HB2 SER A 109 -5.847 5.471 1.775 1.00 64.31 H new ATOM 0 HB3 SER A 109 -5.128 5.831 3.332 1.00 64.31 H new ATOM 0 HG SER A 109 -4.606 7.994 2.126 1.00 23.25 H new ATOM 1568 N ARG A 110 -2.317 4.721 3.379 1.00 63.51 N ATOM 1569 CA ARG A 110 -1.327 4.668 4.448 1.00 32.33 C ATOM 1570 C ARG A 110 -0.001 5.269 3.992 1.00 20.11 C ATOM 1571 O ARG A 110 0.671 5.965 4.753 1.00 11.24 O ATOM 1572 CB ARG A 110 -1.114 3.223 4.904 1.00 15.13 C ATOM 1573 CG ARG A 110 -1.635 2.944 6.305 1.00 61.42 C ATOM 1574 CD ARG A 110 -0.674 2.065 7.091 1.00 12.41 C ATOM 1575 NE ARG A 110 -0.603 2.454 8.497 1.00 1.40 N ATOM 1576 CZ ARG A 110 0.406 2.132 9.298 1.00 3.24 C ATOM 1577 NH1 ARG A 110 1.424 1.420 8.835 1.00 70.12 N ATOM 1578 NH2 ARG A 110 0.399 2.523 10.566 1.00 1.24 N ATOM 0 H ARG A 110 -2.705 3.814 3.118 1.00 63.51 H new ATOM 0 HA ARG A 110 -1.703 5.255 5.286 1.00 32.33 H new ATOM 0 HB2 ARG A 110 -1.608 2.552 4.201 1.00 15.13 H new ATOM 0 HB3 ARG A 110 -0.049 2.993 4.869 1.00 15.13 H new ATOM 0 HG2 ARG A 110 -1.784 3.886 6.833 1.00 61.42 H new ATOM 0 HG3 ARG A 110 -2.608 2.456 6.242 1.00 61.42 H new ATOM 0 HD2 ARG A 110 -0.992 1.025 7.018 1.00 12.41 H new ATOM 0 HD3 ARG A 110 0.320 2.127 6.647 1.00 12.41 H new ATOM 0 HE ARG A 110 -1.370 3.003 8.885 1.00 1.40 H new ATOM 0 HH11 ARG A 110 1.434 1.118 7.861 1.00 70.12 H new ATOM 0 HH12 ARG A 110 2.197 1.174 9.453 1.00 70.12 H new ATOM 0 HH21 ARG A 110 -0.382 3.071 10.926 1.00 1.24 H new ATOM 0 HH22 ARG A 110 1.175 2.275 11.180 1.00 1.24 H new ATOM 1592 N ASP A 111 0.369 4.995 2.746 1.00 24.42 N ATOM 1593 CA ASP A 111 1.615 5.509 2.188 1.00 32.51 C ATOM 1594 C ASP A 111 1.622 7.034 2.188 1.00 34.01 C ATOM 1595 O ASP A 111 2.626 7.660 2.524 1.00 24.02 O ATOM 1596 CB ASP A 111 1.815 4.985 0.765 1.00 50.21 C ATOM 1597 CG ASP A 111 3.251 4.580 0.494 1.00 55.34 C ATOM 1598 OD1 ASP A 111 4.068 5.469 0.176 1.00 4.54 O ATOM 1599 OD2 ASP A 111 3.556 3.374 0.599 1.00 4.32 O ATOM 0 H ASP A 111 -0.176 4.420 2.103 1.00 24.42 H new ATOM 0 HA ASP A 111 2.436 5.160 2.814 1.00 32.51 H new ATOM 0 HB2 ASP A 111 1.162 4.128 0.601 1.00 50.21 H new ATOM 0 HB3 ASP A 111 1.517 5.754 0.052 1.00 50.21 H new ATOM 1604 N ALA A 112 0.494 7.626 1.808 1.00 70.32 N ATOM 1605 CA ALA A 112 0.370 9.077 1.765 1.00 51.42 C ATOM 1606 C ALA A 112 0.132 9.650 3.158 1.00 25.53 C ATOM 1607 O ALA A 112 0.413 10.821 3.416 1.00 55.14 O ATOM 1608 CB ALA A 112 -0.757 9.483 0.827 1.00 50.25 C ATOM 0 H ALA A 112 -0.347 7.122 1.526 1.00 70.32 H new ATOM 0 HA ALA A 112 1.308 9.485 1.388 1.00 51.42 H new ATOM 0 HB1 ALA A 112 -0.838 10.570 0.805 1.00 50.25 H new ATOM 0 HB2 ALA A 112 -0.546 9.114 -0.177 1.00 50.25 H new ATOM 0 HB3 ALA A 112 -1.696 9.056 1.180 1.00 50.25 H new ATOM 1614 N LEU A 113 -0.386 8.817 4.054 1.00 22.31 N ATOM 1615 CA LEU A 113 -0.662 9.240 5.423 1.00 42.24 C ATOM 1616 C LEU A 113 0.593 9.146 6.285 1.00 14.02 C ATOM 1617 O LEU A 113 0.700 9.809 7.317 1.00 24.42 O ATOM 1618 CB LEU A 113 -1.776 8.384 6.027 1.00 1.14 C ATOM 1619 CG LEU A 113 -3.182 8.983 5.983 1.00 50.31 C ATOM 1620 CD1 LEU A 113 -4.232 7.884 6.013 1.00 30.42 C ATOM 1621 CD2 LEU A 113 -3.386 9.950 7.140 1.00 54.41 C ATOM 0 H LEU A 113 -0.623 7.845 3.857 1.00 22.31 H new ATOM 0 HA LEU A 113 -0.986 10.281 5.398 1.00 42.24 H new ATOM 0 HB2 LEU A 113 -1.794 7.427 5.506 1.00 1.14 H new ATOM 0 HB3 LEU A 113 -1.524 8.176 7.067 1.00 1.14 H new ATOM 0 HG LEU A 113 -3.291 9.536 5.050 1.00 50.31 H new ATOM 0 HD11 LEU A 113 -5.226 8.330 5.981 1.00 30.42 H new ATOM 0 HD12 LEU A 113 -4.099 7.230 5.151 1.00 30.42 H new ATOM 0 HD13 LEU A 113 -4.124 7.303 6.929 1.00 30.42 H new ATOM 0 HD21 LEU A 113 -4.392 10.367 7.093 1.00 54.41 H new ATOM 0 HD22 LEU A 113 -3.256 9.420 8.084 1.00 54.41 H new ATOM 0 HD23 LEU A 113 -2.656 10.756 7.073 1.00 54.41 H new ATOM 1633 N VAL A 114 1.540 8.320 5.854 1.00 24.42 N ATOM 1634 CA VAL A 114 2.789 8.141 6.585 1.00 43.00 C ATOM 1635 C VAL A 114 3.498 9.474 6.796 1.00 13.34 C ATOM 1636 O VAL A 114 3.816 9.865 7.920 1.00 41.23 O ATOM 1637 CB VAL A 114 3.739 7.179 5.847 1.00 40.03 C ATOM 1638 CG1 VAL A 114 5.190 7.532 6.138 1.00 15.21 C ATOM 1639 CG2 VAL A 114 3.444 5.738 6.235 1.00 62.03 C ATOM 0 H VAL A 114 1.467 7.764 5.002 1.00 24.42 H new ATOM 0 HA VAL A 114 2.530 7.713 7.553 1.00 43.00 H new ATOM 0 HB VAL A 114 3.573 7.284 4.775 1.00 40.03 H new ATOM 0 HG11 VAL A 114 5.846 6.841 5.608 1.00 15.21 H new ATOM 0 HG12 VAL A 114 5.390 8.550 5.805 1.00 15.21 H new ATOM 0 HG13 VAL A 114 5.375 7.457 7.210 1.00 15.21 H new ATOM 0 HG21 VAL A 114 4.124 5.072 5.704 1.00 62.03 H new ATOM 0 HG22 VAL A 114 3.580 5.615 7.309 1.00 62.03 H new ATOM 0 HG23 VAL A 114 2.416 5.493 5.969 1.00 62.03 H new ATOM 1649 N PRO A 115 3.751 10.191 5.692 1.00 41.44 N ATOM 1650 CA PRO A 115 4.424 11.493 5.730 1.00 51.32 C ATOM 1651 C PRO A 115 3.552 12.578 6.353 1.00 41.34 C ATOM 1652 O PRO A 115 4.052 13.478 7.030 1.00 34.41 O ATOM 1653 CB PRO A 115 4.687 11.800 4.253 1.00 15.34 C ATOM 1654 CG PRO A 115 3.644 11.034 3.516 1.00 74.33 C ATOM 1655 CD PRO A 115 3.400 9.787 4.320 1.00 73.20 C ATOM 0 HA PRO A 115 5.326 11.468 6.341 1.00 51.32 H new ATOM 0 HB2 PRO A 115 4.611 12.868 4.051 1.00 15.34 H new ATOM 0 HB3 PRO A 115 5.689 11.490 3.957 1.00 15.34 H new ATOM 0 HG2 PRO A 115 2.729 11.618 3.415 1.00 74.33 H new ATOM 0 HG3 PRO A 115 3.979 10.789 2.508 1.00 74.33 H new ATOM 0 HD2 PRO A 115 2.362 9.461 4.250 1.00 73.20 H new ATOM 0 HD3 PRO A 115 4.019 8.959 3.974 1.00 73.20 H new ATOM 1663 N LEU A 116 2.247 12.488 6.120 1.00 44.41 N ATOM 1664 CA LEU A 116 1.305 13.463 6.659 1.00 61.20 C ATOM 1665 C LEU A 116 1.244 13.377 8.181 1.00 75.44 C ATOM 1666 O LEU A 116 1.314 14.391 8.875 1.00 41.53 O ATOM 1667 CB LEU A 116 -0.087 13.237 6.067 1.00 33.33 C ATOM 1668 CG LEU A 116 -0.543 14.250 5.016 1.00 24.23 C ATOM 1669 CD1 LEU A 116 -0.650 15.639 5.625 1.00 1.15 C ATOM 1670 CD2 LEU A 116 0.414 14.257 3.833 1.00 71.22 C ATOM 0 H LEU A 116 1.817 11.750 5.562 1.00 44.41 H new ATOM 0 HA LEU A 116 1.652 14.459 6.384 1.00 61.20 H new ATOM 0 HB2 LEU A 116 -0.113 12.243 5.620 1.00 33.33 H new ATOM 0 HB3 LEU A 116 -0.811 13.238 6.882 1.00 33.33 H new ATOM 0 HG LEU A 116 -1.530 13.955 4.659 1.00 24.23 H new ATOM 0 HD11 LEU A 116 -0.976 16.347 4.862 1.00 1.15 H new ATOM 0 HD12 LEU A 116 -1.374 15.624 6.439 1.00 1.15 H new ATOM 0 HD13 LEU A 116 0.323 15.943 6.010 1.00 1.15 H new ATOM 0 HD21 LEU A 116 0.074 14.983 3.095 1.00 71.22 H new ATOM 0 HD22 LEU A 116 1.413 14.527 4.175 1.00 71.22 H new ATOM 0 HD23 LEU A 116 0.441 13.266 3.381 1.00 71.22 H new ATOM 1682 N THR A 117 1.113 12.157 8.695 1.00 45.45 N ATOM 1683 CA THR A 117 1.044 11.938 10.134 1.00 73.04 C ATOM 1684 C THR A 117 2.411 11.573 10.701 1.00 13.11 C ATOM 1685 O THR A 117 2.599 10.480 11.235 1.00 12.52 O ATOM 1686 CB THR A 117 0.041 10.823 10.484 1.00 73.41 C ATOM 1687 OG1 THR A 117 0.458 9.586 9.895 1.00 21.22 O ATOM 1688 CG2 THR A 117 -1.355 11.177 9.995 1.00 54.22 C ATOM 0 H THR A 117 1.053 11.306 8.135 1.00 45.45 H new ATOM 0 HA THR A 117 0.707 12.873 10.581 1.00 73.04 H new ATOM 0 HB THR A 117 0.013 10.718 11.569 1.00 73.41 H new ATOM 0 HG1 THR A 117 0.224 9.582 8.943 1.00 21.22 H new ATOM 0 HG21 THR A 117 -2.046 10.374 10.254 1.00 54.22 H new ATOM 0 HG22 THR A 117 -1.682 12.103 10.467 1.00 54.22 H new ATOM 0 HG23 THR A 117 -1.339 11.307 8.913 1.00 54.22 H new ATOM 1696 N GLN A 118 3.361 12.495 10.582 1.00 32.22 N ATOM 1697 CA GLN A 118 4.711 12.269 11.084 1.00 30.51 C ATOM 1698 C GLN A 118 4.802 12.599 12.570 1.00 33.23 C ATOM 1699 O GLN A 118 4.502 13.717 12.987 1.00 30.45 O ATOM 1700 CB GLN A 118 5.717 13.112 10.300 1.00 44.13 C ATOM 1701 CG GLN A 118 7.124 12.536 10.299 1.00 4.43 C ATOM 1702 CD GLN A 118 8.193 13.607 10.402 1.00 70.34 C ATOM 1703 OE1 GLN A 118 8.497 14.292 9.425 1.00 62.13 O ATOM 1704 NE2 GLN A 118 8.770 13.757 11.588 1.00 35.44 N ATOM 0 H GLN A 118 3.221 13.405 10.143 1.00 32.22 H new ATOM 0 HA GLN A 118 4.949 11.214 10.950 1.00 30.51 H new ATOM 0 HB2 GLN A 118 5.373 13.209 9.270 1.00 44.13 H new ATOM 0 HB3 GLN A 118 5.745 14.116 10.723 1.00 44.13 H new ATOM 0 HG2 GLN A 118 7.229 11.842 11.133 1.00 4.43 H new ATOM 0 HG3 GLN A 118 7.277 11.962 9.385 1.00 4.43 H new ATOM 0 HE21 GLN A 118 8.487 13.168 12.371 1.00 35.44 H new ATOM 0 HE22 GLN A 118 9.496 14.462 11.716 1.00 35.44 H new ATOM 1713 N GLY A 119 5.217 11.617 13.365 1.00 3.45 N ATOM 1714 CA GLY A 119 5.339 11.824 14.797 1.00 65.23 C ATOM 1715 C GLY A 119 4.083 11.431 15.548 1.00 0.44 C ATOM 1716 O GLY A 119 3.878 11.848 16.689 1.00 74.42 O ATOM 0 H GLY A 119 5.471 10.683 13.044 1.00 3.45 H new ATOM 0 HA2 GLY A 119 6.181 11.244 15.175 1.00 65.23 H new ATOM 0 HA3 GLY A 119 5.562 12.873 14.992 1.00 65.23 H new ATOM 1720 N PHE A 120 3.239 10.629 14.908 1.00 13.24 N ATOM 1721 CA PHE A 120 1.994 10.183 15.523 1.00 71.31 C ATOM 1722 C PHE A 120 1.851 8.667 15.422 1.00 32.11 C ATOM 1723 O PHE A 120 2.029 8.087 14.352 1.00 65.33 O ATOM 1724 CB PHE A 120 0.798 10.865 14.856 1.00 73.33 C ATOM 1725 CG PHE A 120 0.975 12.345 14.677 1.00 13.53 C ATOM 1726 CD1 PHE A 120 1.464 13.128 15.711 1.00 30.42 C ATOM 1727 CD2 PHE A 120 0.652 12.955 13.476 1.00 44.33 C ATOM 1728 CE1 PHE A 120 1.627 14.490 15.550 1.00 50.52 C ATOM 1729 CE2 PHE A 120 0.814 14.318 13.308 1.00 33.13 C ATOM 1730 CZ PHE A 120 1.303 15.086 14.347 1.00 53.25 C ATOM 0 H PHE A 120 3.394 10.275 13.964 1.00 13.24 H new ATOM 0 HA PHE A 120 2.019 10.459 16.577 1.00 71.31 H new ATOM 0 HB2 PHE A 120 0.626 10.407 13.882 1.00 73.33 H new ATOM 0 HB3 PHE A 120 -0.094 10.684 15.455 1.00 73.33 H new ATOM 0 HD1 PHE A 120 1.721 12.668 16.654 1.00 30.42 H new ATOM 0 HD2 PHE A 120 0.269 12.359 12.661 1.00 44.33 H new ATOM 0 HE1 PHE A 120 2.008 15.089 16.364 1.00 50.52 H new ATOM 0 HE2 PHE A 120 0.559 14.781 12.366 1.00 33.13 H new ATOM 0 HZ PHE A 120 1.432 16.151 14.219 1.00 53.25 H new ATOM 1740 N GLN A 121 1.528 8.033 16.545 1.00 40.01 N ATOM 1741 CA GLN A 121 1.362 6.585 16.583 1.00 23.14 C ATOM 1742 C GLN A 121 0.131 6.157 15.792 1.00 33.33 C ATOM 1743 O GLN A 121 -1.000 6.319 16.249 1.00 51.44 O ATOM 1744 CB GLN A 121 1.247 6.102 18.030 1.00 31.13 C ATOM 1745 CG GLN A 121 2.571 6.096 18.777 1.00 61.20 C ATOM 1746 CD GLN A 121 3.437 4.904 18.420 1.00 60.13 C ATOM 1747 OE1 GLN A 121 3.211 3.792 18.898 1.00 1.13 O ATOM 1748 NE2 GLN A 121 4.436 5.130 17.574 1.00 34.40 N ATOM 0 H GLN A 121 1.376 8.499 17.440 1.00 40.01 H new ATOM 0 HA GLN A 121 2.241 6.132 16.125 1.00 23.14 H new ATOM 0 HB2 GLN A 121 0.542 6.741 18.562 1.00 31.13 H new ATOM 0 HB3 GLN A 121 0.832 5.094 18.036 1.00 31.13 H new ATOM 0 HG2 GLN A 121 3.114 7.014 18.554 1.00 61.20 H new ATOM 0 HG3 GLN A 121 2.379 6.092 19.850 1.00 61.20 H new ATOM 0 HE21 GLN A 121 4.587 6.068 17.202 1.00 34.40 H new ATOM 0 HE22 GLN A 121 5.052 4.366 17.296 1.00 34.40 H new ATOM 1757 N GLY A 122 0.359 5.608 14.603 1.00 54.45 N ATOM 1758 CA GLY A 122 -0.742 5.166 13.767 1.00 70.24 C ATOM 1759 C GLY A 122 -1.010 3.680 13.900 1.00 72.11 C ATOM 1760 O GLY A 122 -0.154 2.857 13.576 1.00 63.50 O ATOM 0 H GLY A 122 1.286 5.461 14.204 1.00 54.45 H new ATOM 0 HA2 GLY A 122 -1.642 5.720 14.034 1.00 70.24 H new ATOM 0 HA3 GLY A 122 -0.521 5.400 12.726 1.00 70.24 H new ATOM 1764 N ILE A 123 -2.201 3.336 14.379 1.00 23.21 N ATOM 1765 CA ILE A 123 -2.578 1.939 14.555 1.00 72.11 C ATOM 1766 C ILE A 123 -3.954 1.662 13.958 1.00 0.03 C ATOM 1767 O ILE A 123 -4.877 2.463 14.104 1.00 4.21 O ATOM 1768 CB ILE A 123 -2.587 1.541 16.043 1.00 63.03 C ATOM 1769 CG1 ILE A 123 -1.264 1.932 16.705 1.00 31.22 C ATOM 1770 CG2 ILE A 123 -2.838 0.048 16.190 1.00 34.21 C ATOM 1771 CD1 ILE A 123 -1.392 3.086 17.675 1.00 62.30 C ATOM 0 H ILE A 123 -2.921 4.005 14.652 1.00 23.21 H new ATOM 0 HA ILE A 123 -1.830 1.342 14.032 1.00 72.11 H new ATOM 0 HB ILE A 123 -3.394 2.076 16.543 1.00 63.03 H new ATOM 0 HG12 ILE A 123 -0.861 1.067 17.233 1.00 31.22 H new ATOM 0 HG13 ILE A 123 -0.544 2.197 15.931 1.00 31.22 H new ATOM 0 HG21 ILE A 123 -2.841 -0.218 17.247 1.00 34.21 H new ATOM 0 HG22 ILE A 123 -3.803 -0.204 15.749 1.00 34.21 H new ATOM 0 HG23 ILE A 123 -2.050 -0.505 15.679 1.00 34.21 H new ATOM 0 HD11 ILE A 123 -0.416 3.309 18.106 1.00 62.30 H new ATOM 0 HD12 ILE A 123 -1.765 3.964 17.148 1.00 62.30 H new ATOM 0 HD13 ILE A 123 -2.087 2.817 18.470 1.00 62.30 H new ATOM 1783 N GLN A 124 -4.084 0.522 13.288 1.00 65.32 N ATOM 1784 CA GLN A 124 -5.348 0.139 12.670 1.00 24.21 C ATOM 1785 C GLN A 124 -6.121 -0.824 13.565 1.00 51.00 C ATOM 1786 O GLN A 124 -5.665 -1.933 13.841 1.00 63.04 O ATOM 1787 CB GLN A 124 -5.098 -0.504 11.305 1.00 72.23 C ATOM 1788 CG GLN A 124 -4.081 -1.633 11.341 1.00 62.24 C ATOM 1789 CD GLN A 124 -4.611 -2.916 10.732 1.00 33.42 C ATOM 1790 OE1 GLN A 124 -5.599 -3.479 11.205 1.00 72.10 O ATOM 1791 NE2 GLN A 124 -3.956 -3.387 9.677 1.00 13.41 N ATOM 0 H GLN A 124 -3.330 -0.153 13.159 1.00 65.32 H new ATOM 0 HA GLN A 124 -5.946 1.040 12.535 1.00 24.21 H new ATOM 0 HB2 GLN A 124 -6.041 -0.888 10.915 1.00 72.23 H new ATOM 0 HB3 GLN A 124 -4.754 0.262 10.610 1.00 72.23 H new ATOM 0 HG2 GLN A 124 -3.183 -1.325 10.805 1.00 62.24 H new ATOM 0 HG3 GLN A 124 -3.788 -1.820 12.374 1.00 62.24 H new ATOM 0 HE21 GLN A 124 -3.142 -2.888 9.318 1.00 13.41 H new ATOM 0 HE22 GLN A 124 -4.267 -4.247 9.226 1.00 13.41 H new ATOM 1800 N ALA A 125 -7.294 -0.392 14.016 1.00 52.21 N ATOM 1801 CA ALA A 125 -8.132 -1.216 14.878 1.00 22.03 C ATOM 1802 C ALA A 125 -9.611 -0.933 14.640 1.00 11.00 C ATOM 1803 O ALA A 125 -10.044 0.218 14.665 1.00 12.11 O ATOM 1804 CB ALA A 125 -7.776 -0.982 16.339 1.00 33.12 C ATOM 0 H ALA A 125 -7.686 0.524 13.799 1.00 52.21 H new ATOM 0 HA ALA A 125 -7.946 -2.262 14.632 1.00 22.03 H new ATOM 0 HB1 ALA A 125 -8.409 -1.604 16.972 1.00 33.12 H new ATOM 0 HB2 ALA A 125 -6.731 -1.242 16.505 1.00 33.12 H new ATOM 0 HB3 ALA A 125 -7.933 0.068 16.588 1.00 33.12 H new ATOM 1810 N ASN A 126 -10.381 -1.991 14.408 1.00 14.01 N ATOM 1811 CA ASN A 126 -11.813 -1.855 14.164 1.00 62.42 C ATOM 1812 C ASN A 126 -12.610 -2.124 15.437 1.00 42.22 C ATOM 1813 O ASN A 126 -12.112 -2.751 16.372 1.00 13.12 O ATOM 1814 CB ASN A 126 -12.256 -2.817 13.059 1.00 10.30 C ATOM 1815 CG ASN A 126 -12.473 -4.227 13.572 1.00 25.14 C ATOM 1816 OD1 ASN A 126 -13.598 -4.624 13.874 1.00 12.22 O ATOM 1817 ND2 ASN A 126 -11.392 -4.992 13.674 1.00 43.00 N ATOM 0 H ASN A 126 -10.038 -2.951 14.384 1.00 14.01 H new ATOM 0 HA ASN A 126 -12.007 -0.831 13.845 1.00 62.42 H new ATOM 0 HB2 ASN A 126 -13.179 -2.450 12.611 1.00 10.30 H new ATOM 0 HB3 ASN A 126 -11.503 -2.832 12.271 1.00 10.30 H new ATOM 0 HD21 ASN A 126 -11.475 -5.950 14.014 1.00 43.00 H new ATOM 0 HD22 ASN A 126 -10.478 -4.621 13.412 1.00 43.00 H new ATOM 1824 N ASP A 127 -13.849 -1.645 15.464 1.00 22.53 N ATOM 1825 CA ASP A 127 -14.716 -1.835 16.621 1.00 0.13 C ATOM 1826 C ASP A 127 -14.143 -1.135 17.850 1.00 32.40 C ATOM 1827 O ASP A 127 -13.261 -0.285 17.737 1.00 12.23 O ATOM 1828 CB ASP A 127 -14.901 -3.326 16.908 1.00 53.21 C ATOM 1829 CG ASP A 127 -16.331 -3.671 17.277 1.00 24.04 C ATOM 1830 OD1 ASP A 127 -16.867 -3.048 18.217 1.00 0.20 O ATOM 1831 OD2 ASP A 127 -16.912 -4.565 16.628 1.00 74.14 O ATOM 0 H ASP A 127 -14.275 -1.123 14.698 1.00 22.53 H new ATOM 0 HA ASP A 127 -15.686 -1.394 16.393 1.00 0.13 H new ATOM 0 HB2 ASP A 127 -14.606 -3.901 16.030 1.00 53.21 H new ATOM 0 HB3 ASP A 127 -14.238 -3.622 17.721 1.00 53.21 H new ATOM 1836 N ALA A 128 -14.652 -1.499 19.023 1.00 61.33 N ATOM 1837 CA ALA A 128 -14.190 -0.908 20.272 1.00 15.53 C ATOM 1838 C ALA A 128 -12.673 -0.997 20.394 1.00 11.44 C ATOM 1839 O ALA A 128 -12.047 -0.183 21.073 1.00 4.20 O ATOM 1840 CB ALA A 128 -14.858 -1.589 21.457 1.00 32.33 C ATOM 0 H ALA A 128 -15.384 -2.200 19.134 1.00 61.33 H new ATOM 0 HA ALA A 128 -14.466 0.146 20.270 1.00 15.53 H new ATOM 0 HB1 ALA A 128 -14.503 -1.137 22.384 1.00 32.33 H new ATOM 0 HB2 ALA A 128 -15.939 -1.468 21.385 1.00 32.33 H new ATOM 0 HB3 ALA A 128 -14.611 -2.651 21.453 1.00 32.33 H new ATOM 1846 N SER A 129 -12.088 -1.991 19.734 1.00 51.43 N ATOM 1847 CA SER A 129 -10.644 -2.189 19.772 1.00 1.53 C ATOM 1848 C SER A 129 -9.913 -0.963 19.232 1.00 30.02 C ATOM 1849 O SER A 129 -8.756 -0.717 19.570 1.00 21.50 O ATOM 1850 CB SER A 129 -10.256 -3.426 18.961 1.00 23.45 C ATOM 1851 OG SER A 129 -9.891 -4.500 19.812 1.00 11.52 O ATOM 0 H SER A 129 -12.592 -2.672 19.166 1.00 51.43 H new ATOM 0 HA SER A 129 -10.350 -2.338 20.811 1.00 1.53 H new ATOM 0 HB2 SER A 129 -11.091 -3.727 18.328 1.00 23.45 H new ATOM 0 HB3 SER A 129 -9.425 -3.184 18.298 1.00 23.45 H new ATOM 0 HG SER A 129 -9.649 -5.279 19.270 1.00 11.52 H new ATOM 1857 N GLY A 130 -10.599 -0.196 18.390 1.00 62.34 N ATOM 1858 CA GLY A 130 -10.000 0.994 17.815 1.00 11.43 C ATOM 1859 C GLY A 130 -10.314 2.244 18.614 1.00 42.01 C ATOM 1860 O GLY A 130 -9.584 3.234 18.544 1.00 12.02 O ATOM 0 H GLY A 130 -11.559 -0.378 18.096 1.00 62.34 H new ATOM 0 HA2 GLY A 130 -8.919 0.863 17.760 1.00 11.43 H new ATOM 0 HA3 GLY A 130 -10.358 1.120 16.793 1.00 11.43 H new ATOM 1864 N LEU A 131 -11.403 2.201 19.374 1.00 64.43 N ATOM 1865 CA LEU A 131 -11.813 3.339 20.188 1.00 0.13 C ATOM 1866 C LEU A 131 -11.528 3.083 21.665 1.00 41.22 C ATOM 1867 O LEU A 131 -12.167 3.666 22.541 1.00 41.32 O ATOM 1868 CB LEU A 131 -13.302 3.625 19.987 1.00 51.22 C ATOM 1869 CG LEU A 131 -13.834 3.442 18.565 1.00 34.11 C ATOM 1870 CD1 LEU A 131 -15.313 3.790 18.500 1.00 74.11 C ATOM 1871 CD2 LEU A 131 -13.041 4.293 17.585 1.00 64.14 C ATOM 0 H LEU A 131 -12.018 1.390 19.443 1.00 64.43 H new ATOM 0 HA LEU A 131 -11.236 4.208 19.871 1.00 0.13 H new ATOM 0 HB2 LEU A 131 -13.870 2.975 20.652 1.00 51.22 H new ATOM 0 HB3 LEU A 131 -13.500 4.651 20.299 1.00 51.22 H new ATOM 0 HG LEU A 131 -13.715 2.395 18.285 1.00 34.11 H new ATOM 0 HD11 LEU A 131 -15.674 3.654 17.481 1.00 74.11 H new ATOM 0 HD12 LEU A 131 -15.870 3.138 19.173 1.00 74.11 H new ATOM 0 HD13 LEU A 131 -15.456 4.828 18.800 1.00 74.11 H new ATOM 0 HD21 LEU A 131 -13.434 4.150 16.578 1.00 64.14 H new ATOM 0 HD22 LEU A 131 -13.128 5.344 17.862 1.00 64.14 H new ATOM 0 HD23 LEU A 131 -11.992 3.996 17.611 1.00 64.14 H new ATOM 1883 N ASP A 132 -10.564 2.210 21.933 1.00 62.41 N ATOM 1884 CA ASP A 132 -10.191 1.879 23.303 1.00 33.35 C ATOM 1885 C ASP A 132 -9.342 2.987 23.918 1.00 24.42 C ATOM 1886 O ASP A 132 -8.130 3.043 23.708 1.00 23.24 O ATOM 1887 CB ASP A 132 -9.429 0.553 23.342 1.00 43.54 C ATOM 1888 CG ASP A 132 -10.310 -0.610 23.752 1.00 41.11 C ATOM 1889 OD1 ASP A 132 -11.546 -0.499 23.608 1.00 45.45 O ATOM 1890 OD2 ASP A 132 -9.764 -1.632 24.217 1.00 62.25 O ATOM 0 H ASP A 132 -10.026 1.718 21.219 1.00 62.41 H new ATOM 0 HA ASP A 132 -11.105 1.780 23.888 1.00 33.35 H new ATOM 0 HB2 ASP A 132 -9.003 0.353 22.359 1.00 43.54 H new ATOM 0 HB3 ASP A 132 -8.595 0.637 24.039 1.00 43.54 H new ATOM 1895 N PHE A 133 -9.986 3.867 24.677 1.00 25.03 N ATOM 1896 CA PHE A 133 -9.290 4.975 25.321 1.00 45.00 C ATOM 1897 C PHE A 133 -8.083 4.475 26.110 1.00 61.34 C ATOM 1898 O PHE A 133 -7.032 5.115 26.128 1.00 71.33 O ATOM 1899 CB PHE A 133 -10.241 5.733 26.249 1.00 32.42 C ATOM 1900 CG PHE A 133 -11.201 6.629 25.521 1.00 14.22 C ATOM 1901 CD1 PHE A 133 -10.736 7.618 24.669 1.00 74.42 C ATOM 1902 CD2 PHE A 133 -12.569 6.483 25.689 1.00 50.23 C ATOM 1903 CE1 PHE A 133 -11.618 8.444 23.998 1.00 1.43 C ATOM 1904 CE2 PHE A 133 -13.455 7.307 25.021 1.00 74.25 C ATOM 1905 CZ PHE A 133 -12.979 8.288 24.173 1.00 10.04 C ATOM 0 H PHE A 133 -10.989 3.835 24.861 1.00 25.03 H new ATOM 0 HA PHE A 133 -8.938 5.651 24.542 1.00 45.00 H new ATOM 0 HB2 PHE A 133 -10.806 5.014 26.843 1.00 32.42 H new ATOM 0 HB3 PHE A 133 -9.655 6.332 26.946 1.00 32.42 H new ATOM 0 HD1 PHE A 133 -9.673 7.745 24.528 1.00 74.42 H new ATOM 0 HD2 PHE A 133 -12.947 5.717 26.349 1.00 50.23 H new ATOM 0 HE1 PHE A 133 -11.243 9.211 23.337 1.00 1.43 H new ATOM 0 HE2 PHE A 133 -14.519 7.184 25.162 1.00 74.25 H new ATOM 0 HZ PHE A 133 -13.670 8.931 23.648 1.00 10.04 H new ATOM 1915 N GLU A 134 -8.243 3.327 26.760 1.00 33.35 N ATOM 1916 CA GLU A 134 -7.168 2.741 27.552 1.00 3.30 C ATOM 1917 C GLU A 134 -5.962 2.417 26.675 1.00 25.04 C ATOM 1918 O GLU A 134 -4.816 2.566 27.099 1.00 0.11 O ATOM 1919 CB GLU A 134 -7.655 1.474 28.257 1.00 30.22 C ATOM 1920 CG GLU A 134 -8.730 1.732 29.300 1.00 45.31 C ATOM 1921 CD GLU A 134 -8.497 0.957 30.582 1.00 61.40 C ATOM 1922 OE1 GLU A 134 -7.485 1.224 31.263 1.00 51.42 O ATOM 1923 OE2 GLU A 134 -9.328 0.082 30.904 1.00 22.42 O ATOM 0 H GLU A 134 -9.107 2.784 26.754 1.00 33.35 H new ATOM 0 HA GLU A 134 -6.865 3.471 28.303 1.00 3.30 H new ATOM 0 HB2 GLU A 134 -8.043 0.780 27.511 1.00 30.22 H new ATOM 0 HB3 GLU A 134 -6.806 0.986 28.736 1.00 30.22 H new ATOM 0 HG2 GLU A 134 -8.764 2.798 29.525 1.00 45.31 H new ATOM 0 HG3 GLU A 134 -9.703 1.462 28.888 1.00 45.31 H new ATOM 1930 N GLU A 135 -6.229 1.972 25.452 1.00 52.25 N ATOM 1931 CA GLU A 135 -5.166 1.625 24.516 1.00 41.41 C ATOM 1932 C GLU A 135 -4.405 2.871 24.071 1.00 54.14 C ATOM 1933 O GLU A 135 -3.187 2.837 23.895 1.00 51.43 O ATOM 1934 CB GLU A 135 -5.744 0.904 23.297 1.00 53.45 C ATOM 1935 CG GLU A 135 -4.830 -0.171 22.735 1.00 63.21 C ATOM 1936 CD GLU A 135 -5.301 -1.572 23.072 1.00 33.31 C ATOM 1937 OE1 GLU A 135 -4.938 -2.077 24.155 1.00 40.21 O ATOM 1938 OE2 GLU A 135 -6.034 -2.164 22.252 1.00 35.22 O ATOM 0 H GLU A 135 -7.172 1.843 25.086 1.00 52.25 H new ATOM 0 HA GLU A 135 -4.471 0.959 25.027 1.00 41.41 H new ATOM 0 HB2 GLU A 135 -6.697 0.452 23.571 1.00 53.45 H new ATOM 0 HB3 GLU A 135 -5.952 1.637 22.517 1.00 53.45 H new ATOM 0 HG2 GLU A 135 -4.771 -0.062 21.652 1.00 63.21 H new ATOM 0 HG3 GLU A 135 -3.823 -0.027 23.125 1.00 63.21 H new ATOM 1945 N ILE A 136 -5.133 3.968 23.890 1.00 41.12 N ATOM 1946 CA ILE A 136 -4.528 5.224 23.466 1.00 44.43 C ATOM 1947 C ILE A 136 -3.636 5.802 24.560 1.00 63.24 C ATOM 1948 O ILE A 136 -2.504 6.212 24.300 1.00 15.03 O ATOM 1949 CB ILE A 136 -5.598 6.266 23.088 1.00 24.23 C ATOM 1950 CG1 ILE A 136 -6.479 5.736 21.955 1.00 0.14 C ATOM 1951 CG2 ILE A 136 -4.941 7.578 22.687 1.00 50.14 C ATOM 1952 CD1 ILE A 136 -7.717 6.571 21.712 1.00 63.11 C ATOM 0 H ILE A 136 -6.142 4.012 24.030 1.00 41.12 H new ATOM 0 HA ILE A 136 -3.923 5.001 22.587 1.00 44.43 H new ATOM 0 HB ILE A 136 -6.229 6.450 23.958 1.00 24.23 H new ATOM 0 HG12 ILE A 136 -5.892 5.696 21.038 1.00 0.14 H new ATOM 0 HG13 ILE A 136 -6.779 4.714 22.187 1.00 0.14 H new ATOM 0 HG21 ILE A 136 -5.710 8.304 22.423 1.00 50.14 H new ATOM 0 HG22 ILE A 136 -4.352 7.960 23.521 1.00 50.14 H new ATOM 0 HG23 ILE A 136 -4.289 7.411 21.829 1.00 50.14 H new ATOM 0 HD11 ILE A 136 -8.294 6.137 20.896 1.00 63.11 H new ATOM 0 HD12 ILE A 136 -8.326 6.591 22.616 1.00 63.11 H new ATOM 0 HD13 ILE A 136 -7.424 7.588 21.449 1.00 63.11 H new ATOM 1964 N SER A 137 -4.152 5.829 25.784 1.00 74.31 N ATOM 1965 CA SER A 137 -3.404 6.358 26.918 1.00 22.41 C ATOM 1966 C SER A 137 -2.183 5.492 27.214 1.00 31.35 C ATOM 1967 O SER A 137 -1.119 6.000 27.569 1.00 72.13 O ATOM 1968 CB SER A 137 -4.300 6.436 28.156 1.00 41.54 C ATOM 1969 OG SER A 137 -4.072 5.338 29.021 1.00 4.24 O ATOM 0 H SER A 137 -5.086 5.490 26.016 1.00 74.31 H new ATOM 0 HA SER A 137 -3.064 7.361 26.661 1.00 22.41 H new ATOM 0 HB2 SER A 137 -4.109 7.368 28.688 1.00 41.54 H new ATOM 0 HB3 SER A 137 -5.346 6.451 27.851 1.00 41.54 H new ATOM 0 HG SER A 137 -4.655 5.412 29.805 1.00 4.24 H new ATOM 1975 N ARG A 138 -2.345 4.181 27.067 1.00 74.11 N ATOM 1976 CA ARG A 138 -1.258 3.243 27.320 1.00 51.23 C ATOM 1977 C ARG A 138 -0.171 3.372 26.257 1.00 3.31 C ATOM 1978 O ARG A 138 1.019 3.267 26.555 1.00 44.04 O ATOM 1979 CB ARG A 138 -1.790 1.809 27.349 1.00 25.02 C ATOM 1980 CG ARG A 138 -0.802 0.805 27.920 1.00 4.05 C ATOM 1981 CD ARG A 138 -0.022 0.102 26.820 1.00 51.51 C ATOM 1982 NE ARG A 138 -0.197 -1.347 26.865 1.00 40.31 N ATOM 1983 CZ ARG A 138 0.286 -2.116 27.834 1.00 4.53 C ATOM 1984 NH1 ARG A 138 0.970 -1.576 28.834 1.00 63.21 N ATOM 1985 NH2 ARG A 138 0.086 -3.427 27.805 1.00 13.12 N ATOM 0 H ARG A 138 -3.219 3.744 26.774 1.00 74.11 H new ATOM 0 HA ARG A 138 -0.824 3.482 28.291 1.00 51.23 H new ATOM 0 HB2 ARG A 138 -2.705 1.782 27.940 1.00 25.02 H new ATOM 0 HB3 ARG A 138 -2.056 1.508 26.336 1.00 25.02 H new ATOM 0 HG2 ARG A 138 -0.109 1.315 28.589 1.00 4.05 H new ATOM 0 HG3 ARG A 138 -1.337 0.066 28.517 1.00 4.05 H new ATOM 0 HD2 ARG A 138 -0.347 0.476 25.849 1.00 51.51 H new ATOM 0 HD3 ARG A 138 1.037 0.342 26.916 1.00 51.51 H new ATOM 0 HE ARG A 138 -0.719 -1.793 26.111 1.00 40.31 H new ATOM 0 HH11 ARG A 138 1.126 -0.568 28.860 1.00 63.21 H new ATOM 0 HH12 ARG A 138 1.340 -2.168 29.577 1.00 63.21 H new ATOM 0 HH21 ARG A 138 -0.439 -3.846 27.038 1.00 13.12 H new ATOM 0 HH22 ARG A 138 0.458 -4.016 28.550 1.00 13.12 H new ATOM 1999 N LYS A 139 -0.588 3.601 25.016 1.00 25.52 N ATOM 2000 CA LYS A 139 0.349 3.745 23.908 1.00 23.13 C ATOM 2001 C LYS A 139 1.172 5.021 24.055 1.00 64.25 C ATOM 2002 O LYS A 139 2.397 4.998 23.935 1.00 44.45 O ATOM 2003 CB LYS A 139 -0.403 3.761 22.576 1.00 73.21 C ATOM 2004 CG LYS A 139 -0.896 2.392 22.139 1.00 13.05 C ATOM 2005 CD LYS A 139 0.215 1.578 21.498 1.00 34.41 C ATOM 2006 CE LYS A 139 -0.300 0.763 20.321 1.00 3.10 C ATOM 2007 NZ LYS A 139 0.236 -0.626 20.332 1.00 60.34 N ATOM 0 H LYS A 139 -1.569 3.691 24.752 1.00 25.52 H new ATOM 0 HA LYS A 139 1.027 2.892 23.925 1.00 23.13 H new ATOM 0 HB2 LYS A 139 -1.255 4.436 22.658 1.00 73.21 H new ATOM 0 HB3 LYS A 139 0.251 4.166 21.804 1.00 73.21 H new ATOM 0 HG2 LYS A 139 -1.291 1.854 23.001 1.00 13.05 H new ATOM 0 HG3 LYS A 139 -1.717 2.509 21.432 1.00 13.05 H new ATOM 0 HD2 LYS A 139 1.008 2.245 21.161 1.00 34.41 H new ATOM 0 HD3 LYS A 139 0.653 0.911 22.240 1.00 34.41 H new ATOM 0 HE2 LYS A 139 -1.389 0.732 20.349 1.00 3.10 H new ATOM 0 HE3 LYS A 139 -0.019 1.253 19.389 1.00 3.10 H new ATOM 0 HZ1 LYS A 139 -0.138 -1.149 19.515 1.00 60.34 H new ATOM 0 HZ2 LYS A 139 1.274 -0.598 20.279 1.00 60.34 H new ATOM 0 HZ3 LYS A 139 -0.053 -1.103 21.210 1.00 60.34 H new ATOM 2021 N VAL A 140 0.492 6.132 24.316 1.00 54.33 N ATOM 2022 CA VAL A 140 1.160 7.417 24.481 1.00 2.31 C ATOM 2023 C VAL A 140 2.005 7.438 25.750 1.00 14.23 C ATOM 2024 O VAL A 140 3.095 8.009 25.775 1.00 42.03 O ATOM 2025 CB VAL A 140 0.146 8.575 24.533 1.00 11.24 C ATOM 2026 CG1 VAL A 140 -0.828 8.381 25.686 1.00 61.44 C ATOM 2027 CG2 VAL A 140 0.867 9.909 24.653 1.00 13.42 C ATOM 0 H VAL A 140 -0.522 6.168 24.418 1.00 54.33 H new ATOM 0 HA VAL A 140 1.808 7.550 23.614 1.00 2.31 H new ATOM 0 HB VAL A 140 -0.424 8.578 23.604 1.00 11.24 H new ATOM 0 HG11 VAL A 140 -1.537 9.209 25.707 1.00 61.44 H new ATOM 0 HG12 VAL A 140 -1.368 7.444 25.552 1.00 61.44 H new ATOM 0 HG13 VAL A 140 -0.277 8.351 26.626 1.00 61.44 H new ATOM 0 HG21 VAL A 140 0.135 10.716 24.688 1.00 13.42 H new ATOM 0 HG22 VAL A 140 1.463 9.919 25.565 1.00 13.42 H new ATOM 0 HG23 VAL A 140 1.520 10.049 23.791 1.00 13.42 H new ATOM 2037 N LYS A 141 1.494 6.811 26.804 1.00 13.25 N ATOM 2038 CA LYS A 141 2.200 6.755 28.079 1.00 45.05 C ATOM 2039 C LYS A 141 3.490 5.950 27.951 1.00 73.05 C ATOM 2040 O LYS A 141 4.487 6.249 28.607 1.00 21.12 O ATOM 2041 CB LYS A 141 1.305 6.137 29.155 1.00 64.21 C ATOM 2042 CG LYS A 141 1.991 5.984 30.502 1.00 54.31 C ATOM 2043 CD LYS A 141 1.173 5.122 31.449 1.00 63.32 C ATOM 2044 CE LYS A 141 -0.004 5.891 32.028 1.00 52.12 C ATOM 2045 NZ LYS A 141 -1.235 5.055 32.092 1.00 10.43 N ATOM 0 H LYS A 141 0.592 6.334 26.801 1.00 13.25 H new ATOM 0 HA LYS A 141 2.455 7.774 28.370 1.00 45.05 H new ATOM 0 HB2 LYS A 141 0.417 6.757 29.277 1.00 64.21 H new ATOM 0 HB3 LYS A 141 0.966 5.158 28.816 1.00 64.21 H new ATOM 0 HG2 LYS A 141 2.976 5.538 30.361 1.00 54.31 H new ATOM 0 HG3 LYS A 141 2.147 6.967 30.946 1.00 54.31 H new ATOM 0 HD2 LYS A 141 0.808 4.242 30.919 1.00 63.32 H new ATOM 0 HD3 LYS A 141 1.809 4.765 32.259 1.00 63.32 H new ATOM 0 HE2 LYS A 141 0.249 6.243 33.028 1.00 52.12 H new ATOM 0 HE3 LYS A 141 -0.196 6.774 31.419 1.00 52.12 H new ATOM 0 HZ1 LYS A 141 -2.015 5.615 32.492 1.00 10.43 H new ATOM 0 HZ2 LYS A 141 -1.491 4.740 31.134 1.00 10.43 H new ATOM 0 HZ3 LYS A 141 -1.060 4.225 32.694 1.00 10.43 H new ATOM 2059 N SER A 142 3.462 4.929 27.100 1.00 24.32 N ATOM 2060 CA SER A 142 4.629 4.079 26.888 1.00 54.40 C ATOM 2061 C SER A 142 5.570 4.697 25.859 1.00 62.35 C ATOM 2062 O SER A 142 6.789 4.555 25.953 1.00 53.55 O ATOM 2063 CB SER A 142 4.194 2.686 26.428 1.00 43.41 C ATOM 2064 OG SER A 142 5.196 1.723 26.704 1.00 62.13 O ATOM 0 H SER A 142 2.645 4.670 26.547 1.00 24.32 H new ATOM 0 HA SER A 142 5.162 3.991 27.835 1.00 54.40 H new ATOM 0 HB2 SER A 142 3.268 2.406 26.930 1.00 43.41 H new ATOM 0 HB3 SER A 142 3.985 2.701 25.358 1.00 43.41 H new ATOM 0 HG SER A 142 4.894 0.841 26.402 1.00 62.13 H new ATOM 2070 N ASN A 143 4.995 5.382 24.876 1.00 70.04 N ATOM 2071 CA ASN A 143 5.782 6.021 23.827 1.00 12.22 C ATOM 2072 C ASN A 143 6.552 4.984 23.016 1.00 71.41 C ATOM 2073 O ASN A 143 7.774 5.061 22.890 1.00 1.34 O ATOM 2074 CB ASN A 143 6.754 7.033 24.436 1.00 44.41 C ATOM 2075 CG ASN A 143 6.079 7.960 25.428 1.00 34.12 C ATOM 2076 OD1 ASN A 143 5.825 7.584 26.573 1.00 64.43 O ATOM 2077 ND2 ASN A 143 5.783 9.179 24.992 1.00 33.14 N ATOM 0 H ASN A 143 3.987 5.509 24.784 1.00 70.04 H new ATOM 0 HA ASN A 143 5.096 6.542 23.159 1.00 12.22 H new ATOM 0 HB2 ASN A 143 7.564 6.500 24.934 1.00 44.41 H new ATOM 0 HB3 ASN A 143 7.205 7.625 23.639 1.00 44.41 H new ATOM 0 HD21 ASN A 143 5.327 9.846 25.614 1.00 33.14 H new ATOM 0 HD22 ASN A 143 6.012 9.448 24.035 1.00 33.14 H new ATOM 2084 N ARG A 144 5.828 4.014 22.467 1.00 61.32 N ATOM 2085 CA ARG A 144 6.443 2.960 21.668 1.00 12.31 C ATOM 2086 C ARG A 144 5.642 2.706 20.395 1.00 74.23 C ATOM 2087 O ARG A 144 5.274 1.569 20.098 1.00 51.12 O ATOM 2088 CB ARG A 144 6.550 1.670 22.483 1.00 74.24 C ATOM 2089 CG ARG A 144 7.473 0.633 21.863 1.00 13.21 C ATOM 2090 CD ARG A 144 8.077 -0.277 22.921 1.00 63.14 C ATOM 2091 NE ARG A 144 9.022 0.433 23.779 1.00 71.12 N ATOM 2092 CZ ARG A 144 10.210 0.861 23.368 1.00 63.35 C ATOM 2093 NH1 ARG A 144 10.597 0.652 22.117 1.00 63.23 N ATOM 2094 NH2 ARG A 144 11.014 1.499 24.208 1.00 2.40 N ATOM 0 H ARG A 144 4.815 3.936 22.561 1.00 61.32 H new ATOM 0 HA ARG A 144 7.444 3.288 21.387 1.00 12.31 H new ATOM 0 HB2 ARG A 144 6.908 1.911 23.484 1.00 74.24 H new ATOM 0 HB3 ARG A 144 5.556 1.238 22.596 1.00 74.24 H new ATOM 0 HG2 ARG A 144 6.917 0.035 21.141 1.00 13.21 H new ATOM 0 HG3 ARG A 144 8.270 1.135 21.315 1.00 13.21 H new ATOM 0 HD2 ARG A 144 7.280 -0.701 23.532 1.00 63.14 H new ATOM 0 HD3 ARG A 144 8.584 -1.111 22.435 1.00 63.14 H new ATOM 0 HE ARG A 144 8.755 0.610 24.747 1.00 71.12 H new ATOM 0 HH11 ARG A 144 9.982 0.162 21.468 1.00 63.23 H new ATOM 0 HH12 ARG A 144 11.510 0.982 21.804 1.00 63.23 H new ATOM 0 HH21 ARG A 144 10.720 1.661 25.171 1.00 2.40 H new ATOM 0 HH22 ARG A 144 11.926 1.827 23.891 1.00 2.40 H new