USER MOD reduce.3.24.130724 H: found=0, std=0, add=876, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 875 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 19 LYS NZ :NH3+ -113:sc= 0.945 (180deg=-0.0689) USER MOD Set 1.2: A 90 CYS SG : rot 32:sc= 0.789 USER MOD Set 2.1: A 12 THR OG1 : rot 180:sc= -0.0106 USER MOD Set 2.2: A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.103 X(o=-0.1,f=-0.01) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -4.5 K(o=-4.5,f=-13!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN :FLIP amide:sc= -0.412 F(o=-1.1,f=-0.41) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HE2:sc= -2.98 K(o=-3,f=-7.4!) USER MOD Single : A 43 TYR OH : rot 23:sc= 1.33 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc=-0.000216 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 179:sc= 0.0832 (180deg=0.0829) USER MOD Single : A 56 SER OG : rot 140:sc= -2.48! USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.327 K(o=-0.33,f=-0.97) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= -0.22 K(o=-0.22,f=-1.9!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 CYS SG : rot 89:sc= -5.19! USER MOD Single : A 83 SER OG : rot -38:sc= 0.859 USER MOD Single : A 84 MET CE :methyl -159:sc= -4.79 (180deg=-6.56!) USER MOD Single : A 85 THR OG1 : rot -75:sc= 0.182 USER MOD Single : A 86 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0435) USER MOD Single : A 87 ASN : amide:sc= -0.0414 X(o=-0.041,f=-0.38) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 62:sc= 0.202 USER MOD Single : A 97 LYS NZ :NH3+ 153:sc= 0.0168 (180deg=-0.0376) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 98 N GLU A 7 15.079 2.064 -5.344 1.00 0.00 N ATOM 99 CA GLU A 7 16.184 1.454 -4.614 1.00 0.00 C ATOM 100 C GLU A 7 17.142 0.748 -5.568 1.00 0.00 C ATOM 101 O GLU A 7 16.717 0.021 -6.465 1.00 0.00 O ATOM 102 CB GLU A 7 15.654 0.461 -3.578 1.00 0.00 C ATOM 103 CG GLU A 7 16.748 -0.233 -2.784 1.00 0.00 C ATOM 104 CD GLU A 7 17.815 0.729 -2.297 1.00 0.00 C ATOM 105 OE1 GLU A 7 17.454 1.745 -1.667 1.00 0.00 O ATOM 106 OE2 GLU A 7 19.010 0.466 -2.547 1.00 0.00 O ATOM 0 HA GLU A 7 16.728 2.247 -4.101 1.00 0.00 H new ATOM 0 HB2 GLU A 7 14.994 0.987 -2.888 1.00 0.00 H new ATOM 0 HB3 GLU A 7 15.051 -0.292 -4.085 1.00 0.00 H new ATOM 0 HG2 GLU A 7 16.304 -0.741 -1.928 1.00 0.00 H new ATOM 0 HG3 GLU A 7 17.211 -1.000 -3.405 1.00 0.00 H new ATOM 113 N GLN A 8 18.438 0.968 -5.367 1.00 0.00 N ATOM 114 CA GLN A 8 19.456 0.354 -6.210 1.00 0.00 C ATOM 115 C GLN A 8 20.005 -0.914 -5.565 1.00 0.00 C ATOM 116 O GLN A 8 20.292 -0.939 -4.368 1.00 0.00 O ATOM 117 CB GLN A 8 20.595 1.341 -6.473 1.00 0.00 C ATOM 118 CG GLN A 8 20.256 2.399 -7.510 1.00 0.00 C ATOM 119 CD GLN A 8 21.048 3.677 -7.321 1.00 0.00 C ATOM 120 OE1 GLN A 8 20.808 4.437 -6.382 1.00 0.00 O ATOM 121 NE2 GLN A 8 22.000 3.922 -8.214 1.00 0.00 N ATOM 0 H GLN A 8 18.807 1.567 -4.628 1.00 0.00 H new ATOM 0 HA GLN A 8 18.992 0.085 -7.159 1.00 0.00 H new ATOM 0 HB2 GLN A 8 20.861 1.833 -5.538 1.00 0.00 H new ATOM 0 HB3 GLN A 8 21.474 0.788 -6.804 1.00 0.00 H new ATOM 0 HG2 GLN A 8 20.449 2.001 -8.506 1.00 0.00 H new ATOM 0 HG3 GLN A 8 19.191 2.625 -7.458 1.00 0.00 H new ATOM 0 HE21 GLN A 8 22.165 3.265 -8.977 1.00 0.00 H new ATOM 0 HE22 GLN A 8 22.566 4.767 -8.137 1.00 0.00 H new ATOM 130 N VAL A 9 20.149 -1.965 -6.365 1.00 0.00 N ATOM 131 CA VAL A 9 20.665 -3.237 -5.872 1.00 0.00 C ATOM 132 C VAL A 9 21.733 -3.796 -6.805 1.00 0.00 C ATOM 133 O VAL A 9 21.465 -4.083 -7.972 1.00 0.00 O ATOM 134 CB VAL A 9 19.540 -4.277 -5.717 1.00 0.00 C ATOM 135 CG1 VAL A 9 20.103 -5.607 -5.240 1.00 0.00 C ATOM 136 CG2 VAL A 9 18.472 -3.767 -4.761 1.00 0.00 C ATOM 0 H VAL A 9 19.916 -1.961 -7.358 1.00 0.00 H new ATOM 0 HA VAL A 9 21.106 -3.041 -4.895 1.00 0.00 H new ATOM 0 HB VAL A 9 19.078 -4.435 -6.692 1.00 0.00 H new ATOM 0 HG11 VAL A 9 19.293 -6.329 -5.136 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.828 -5.976 -5.965 1.00 0.00 H new ATOM 0 HG13 VAL A 9 20.592 -5.470 -4.276 1.00 0.00 H new ATOM 0 HG21 VAL A 9 17.685 -4.514 -4.663 1.00 0.00 H new ATOM 0 HG22 VAL A 9 18.918 -3.579 -3.784 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.047 -2.841 -5.150 1.00 0.00 H new ATOM 146 N HIS A 10 22.946 -3.949 -6.283 1.00 0.00 N ATOM 147 CA HIS A 10 24.056 -4.475 -7.069 1.00 0.00 C ATOM 148 C HIS A 10 23.971 -5.994 -7.181 1.00 0.00 C ATOM 149 O HIS A 10 24.046 -6.706 -6.178 1.00 0.00 O ATOM 150 CB HIS A 10 25.390 -4.072 -6.440 1.00 0.00 C ATOM 151 CG HIS A 10 25.447 -2.635 -6.023 1.00 0.00 C ATOM 152 ND1 HIS A 10 26.050 -2.212 -4.858 1.00 0.00 N ATOM 153 CD2 HIS A 10 24.971 -1.519 -6.624 1.00 0.00 C ATOM 154 CE1 HIS A 10 25.942 -0.900 -4.759 1.00 0.00 C ATOM 155 NE2 HIS A 10 25.292 -0.454 -5.819 1.00 0.00 N ATOM 0 H HIS A 10 23.185 -3.716 -5.319 1.00 0.00 H new ATOM 0 HA HIS A 10 23.992 -4.051 -8.071 1.00 0.00 H new ATOM 0 HB2 HIS A 10 25.577 -4.702 -5.570 1.00 0.00 H new ATOM 0 HB3 HIS A 10 26.192 -4.267 -7.152 1.00 0.00 H new ATOM 0 HD2 HIS A 10 24.438 -1.475 -7.562 1.00 0.00 H new ATOM 0 HE1 HIS A 10 26.321 -0.294 -3.949 1.00 0.00 H new ATOM 0 HE2 HIS A 10 25.066 0.522 -6.009 1.00 0.00 H new ATOM 163 N LEU A 11 23.813 -6.484 -8.405 1.00 0.00 N ATOM 164 CA LEU A 11 23.716 -7.920 -8.648 1.00 0.00 C ATOM 165 C LEU A 11 25.086 -8.583 -8.545 1.00 0.00 C ATOM 166 O LEU A 11 25.189 -9.801 -8.396 1.00 0.00 O ATOM 167 CB LEU A 11 23.112 -8.184 -10.029 1.00 0.00 C ATOM 168 CG LEU A 11 21.593 -8.358 -10.074 1.00 0.00 C ATOM 169 CD1 LEU A 11 20.902 -7.198 -9.375 1.00 0.00 C ATOM 170 CD2 LEU A 11 21.113 -8.478 -11.513 1.00 0.00 C ATOM 0 H LEU A 11 23.749 -5.909 -9.245 1.00 0.00 H new ATOM 0 HA LEU A 11 23.066 -8.350 -7.886 1.00 0.00 H new ATOM 0 HB2 LEU A 11 23.383 -7.358 -10.686 1.00 0.00 H new ATOM 0 HB3 LEU A 11 23.573 -9.082 -10.440 1.00 0.00 H new ATOM 0 HG LEU A 11 21.336 -9.277 -9.548 1.00 0.00 H new ATOM 0 HD11 LEU A 11 19.822 -7.339 -9.417 1.00 0.00 H new ATOM 0 HD12 LEU A 11 21.222 -7.158 -8.334 1.00 0.00 H new ATOM 0 HD13 LEU A 11 21.166 -6.264 -9.872 1.00 0.00 H new ATOM 0 HD21 LEU A 11 20.030 -8.601 -11.526 1.00 0.00 H new ATOM 0 HD22 LEU A 11 21.382 -7.576 -12.063 1.00 0.00 H new ATOM 0 HD23 LEU A 11 21.582 -9.343 -11.982 1.00 0.00 H new ATOM 182 N THR A 12 26.137 -7.773 -8.623 1.00 0.00 N ATOM 183 CA THR A 12 27.501 -8.280 -8.538 1.00 0.00 C ATOM 184 C THR A 12 28.408 -7.297 -7.806 1.00 0.00 C ATOM 185 O THR A 12 28.092 -6.113 -7.694 1.00 0.00 O ATOM 186 CB THR A 12 28.085 -8.559 -9.935 1.00 0.00 C ATOM 187 OG1 THR A 12 29.321 -9.272 -9.816 1.00 0.00 O ATOM 188 CG2 THR A 12 28.315 -7.261 -10.695 1.00 0.00 C ATOM 0 H THR A 12 26.070 -6.763 -8.745 1.00 0.00 H new ATOM 0 HA THR A 12 27.457 -9.215 -7.979 1.00 0.00 H new ATOM 0 HB THR A 12 27.368 -9.165 -10.489 1.00 0.00 H new ATOM 0 HG1 THR A 12 29.685 -9.447 -10.709 1.00 0.00 H new ATOM 0 HG21 THR A 12 28.728 -7.484 -11.679 1.00 0.00 H new ATOM 0 HG22 THR A 12 27.368 -6.734 -10.810 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.014 -6.634 -10.141 1.00 0.00 H new ATOM 196 N GLU A 13 29.537 -7.796 -7.312 1.00 0.00 N ATOM 197 CA GLU A 13 30.489 -6.960 -6.591 1.00 0.00 C ATOM 198 C GLU A 13 31.228 -6.028 -7.548 1.00 0.00 C ATOM 199 O GLU A 13 31.616 -4.920 -7.176 1.00 0.00 O ATOM 200 CB GLU A 13 31.494 -7.830 -5.833 1.00 0.00 C ATOM 201 CG GLU A 13 32.163 -7.115 -4.671 1.00 0.00 C ATOM 202 CD GLU A 13 31.250 -6.977 -3.468 1.00 0.00 C ATOM 203 OE1 GLU A 13 31.131 -7.952 -2.697 1.00 0.00 O ATOM 204 OE2 GLU A 13 30.656 -5.892 -3.297 1.00 0.00 O ATOM 0 H GLU A 13 29.814 -8.774 -7.398 1.00 0.00 H new ATOM 0 HA GLU A 13 29.932 -6.353 -5.877 1.00 0.00 H new ATOM 0 HB2 GLU A 13 30.984 -8.717 -5.458 1.00 0.00 H new ATOM 0 HB3 GLU A 13 32.261 -8.174 -6.527 1.00 0.00 H new ATOM 0 HG2 GLU A 13 33.060 -7.662 -4.381 1.00 0.00 H new ATOM 0 HG3 GLU A 13 32.484 -6.125 -4.995 1.00 0.00 H new ATOM 211 N ASP A 14 31.418 -6.485 -8.780 1.00 0.00 N ATOM 212 CA ASP A 14 32.109 -5.693 -9.791 1.00 0.00 C ATOM 213 C ASP A 14 31.262 -4.499 -10.219 1.00 0.00 C ATOM 214 O ASP A 14 31.776 -3.522 -10.761 1.00 0.00 O ATOM 215 CB ASP A 14 32.444 -6.559 -11.007 1.00 0.00 C ATOM 216 CG ASP A 14 33.531 -5.950 -11.870 1.00 0.00 C ATOM 217 OD1 ASP A 14 34.682 -5.851 -11.394 1.00 0.00 O ATOM 218 OD2 ASP A 14 33.232 -5.572 -13.022 1.00 0.00 O ATOM 0 H ASP A 14 31.103 -7.400 -9.103 1.00 0.00 H new ATOM 0 HA ASP A 14 33.035 -5.320 -9.354 1.00 0.00 H new ATOM 0 HB2 ASP A 14 32.762 -7.546 -10.670 1.00 0.00 H new ATOM 0 HB3 ASP A 14 31.545 -6.701 -11.607 1.00 0.00 H new ATOM 223 N GLY A 15 29.958 -4.587 -9.973 1.00 0.00 N ATOM 224 CA GLY A 15 29.060 -3.508 -10.340 1.00 0.00 C ATOM 225 C GLY A 15 28.582 -3.614 -11.775 1.00 0.00 C ATOM 226 O GLY A 15 27.766 -2.811 -12.226 1.00 0.00 O ATOM 0 H GLY A 15 29.508 -5.386 -9.526 1.00 0.00 H new ATOM 0 HA2 GLY A 15 28.199 -3.513 -9.672 1.00 0.00 H new ATOM 0 HA3 GLY A 15 29.567 -2.554 -10.199 1.00 0.00 H new ATOM 230 N GLY A 16 29.093 -4.608 -12.495 1.00 0.00 N ATOM 231 CA GLY A 16 28.703 -4.797 -13.880 1.00 0.00 C ATOM 232 C GLY A 16 27.199 -4.842 -14.058 1.00 0.00 C ATOM 233 O GLY A 16 26.666 -4.325 -15.040 1.00 0.00 O ATOM 0 H GLY A 16 29.770 -5.286 -12.144 1.00 0.00 H new ATOM 0 HA2 GLY A 16 29.113 -3.987 -14.483 1.00 0.00 H new ATOM 0 HA3 GLY A 16 29.138 -5.724 -14.253 1.00 0.00 H new ATOM 237 N VAL A 17 26.510 -5.464 -13.106 1.00 0.00 N ATOM 238 CA VAL A 17 25.058 -5.576 -13.162 1.00 0.00 C ATOM 239 C VAL A 17 24.414 -5.010 -11.901 1.00 0.00 C ATOM 240 O VAL A 17 24.777 -5.383 -10.785 1.00 0.00 O ATOM 241 CB VAL A 17 24.614 -7.040 -13.339 1.00 0.00 C ATOM 242 CG1 VAL A 17 23.117 -7.117 -13.600 1.00 0.00 C ATOM 243 CG2 VAL A 17 25.394 -7.700 -14.466 1.00 0.00 C ATOM 0 H VAL A 17 26.935 -5.898 -12.287 1.00 0.00 H new ATOM 0 HA VAL A 17 24.729 -4.998 -14.025 1.00 0.00 H new ATOM 0 HB VAL A 17 24.826 -7.580 -12.416 1.00 0.00 H new ATOM 0 HG11 VAL A 17 22.822 -8.159 -13.722 1.00 0.00 H new ATOM 0 HG12 VAL A 17 22.578 -6.684 -12.757 1.00 0.00 H new ATOM 0 HG13 VAL A 17 22.877 -6.563 -14.508 1.00 0.00 H new ATOM 0 HG21 VAL A 17 25.068 -8.734 -14.577 1.00 0.00 H new ATOM 0 HG22 VAL A 17 25.215 -7.161 -15.396 1.00 0.00 H new ATOM 0 HG23 VAL A 17 26.459 -7.679 -14.233 1.00 0.00 H new ATOM 253 N VAL A 18 23.456 -4.108 -12.086 1.00 0.00 N ATOM 254 CA VAL A 18 22.759 -3.491 -10.963 1.00 0.00 C ATOM 255 C VAL A 18 21.290 -3.253 -11.292 1.00 0.00 C ATOM 256 O VAL A 18 20.960 -2.487 -12.198 1.00 0.00 O ATOM 257 CB VAL A 18 23.409 -2.152 -10.568 1.00 0.00 C ATOM 258 CG1 VAL A 18 22.638 -1.500 -9.430 1.00 0.00 C ATOM 259 CG2 VAL A 18 24.866 -2.360 -10.184 1.00 0.00 C ATOM 0 H VAL A 18 23.144 -3.788 -13.003 1.00 0.00 H new ATOM 0 HA VAL A 18 22.832 -4.184 -10.125 1.00 0.00 H new ATOM 0 HB VAL A 18 23.375 -1.484 -11.429 1.00 0.00 H new ATOM 0 HG11 VAL A 18 23.112 -0.555 -9.164 1.00 0.00 H new ATOM 0 HG12 VAL A 18 21.611 -1.315 -9.745 1.00 0.00 H new ATOM 0 HG13 VAL A 18 22.638 -2.162 -8.564 1.00 0.00 H new ATOM 0 HG21 VAL A 18 25.310 -1.403 -9.908 1.00 0.00 H new ATOM 0 HG22 VAL A 18 24.925 -3.045 -9.338 1.00 0.00 H new ATOM 0 HG23 VAL A 18 25.409 -2.781 -11.030 1.00 0.00 H new ATOM 269 N LYS A 19 20.409 -3.915 -10.549 1.00 0.00 N ATOM 270 CA LYS A 19 18.973 -3.775 -10.758 1.00 0.00 C ATOM 271 C LYS A 19 18.389 -2.708 -9.837 1.00 0.00 C ATOM 272 O LYS A 19 18.905 -2.467 -8.745 1.00 0.00 O ATOM 273 CB LYS A 19 18.269 -5.112 -10.518 1.00 0.00 C ATOM 274 CG LYS A 19 16.767 -5.058 -10.741 1.00 0.00 C ATOM 275 CD LYS A 19 16.019 -4.795 -9.445 1.00 0.00 C ATOM 276 CE LYS A 19 15.698 -6.090 -8.715 1.00 0.00 C ATOM 277 NZ LYS A 19 14.585 -6.834 -9.369 1.00 0.00 N ATOM 0 H LYS A 19 20.665 -4.554 -9.796 1.00 0.00 H new ATOM 0 HA LYS A 19 18.811 -3.466 -11.791 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.699 -5.863 -11.180 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.465 -5.438 -9.496 1.00 0.00 H new ATOM 0 HG2 LYS A 19 16.533 -4.275 -11.462 1.00 0.00 H new ATOM 0 HG3 LYS A 19 16.428 -6.000 -11.173 1.00 0.00 H new ATOM 0 HD2 LYS A 19 16.619 -4.152 -8.801 1.00 0.00 H new ATOM 0 HD3 LYS A 19 15.095 -4.258 -9.659 1.00 0.00 H new ATOM 0 HE2 LYS A 19 16.587 -6.720 -8.684 1.00 0.00 H new ATOM 0 HE3 LYS A 19 15.429 -5.868 -7.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 13.757 -6.843 -8.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 14.335 -6.368 -10.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 14.886 -7.811 -9.560 1.00 0.00 H new ATOM 291 N THR A 20 17.310 -2.073 -10.283 1.00 0.00 N ATOM 292 CA THR A 20 16.657 -1.033 -9.499 1.00 0.00 C ATOM 293 C THR A 20 15.174 -1.334 -9.313 1.00 0.00 C ATOM 294 O THR A 20 14.447 -1.541 -10.284 1.00 0.00 O ATOM 295 CB THR A 20 16.809 0.350 -10.161 1.00 0.00 C ATOM 296 OG1 THR A 20 18.173 0.562 -10.544 1.00 0.00 O ATOM 297 CG2 THR A 20 16.366 1.455 -9.215 1.00 0.00 C ATOM 0 H THR A 20 16.870 -2.261 -11.184 1.00 0.00 H new ATOM 0 HA THR A 20 17.147 -1.017 -8.526 1.00 0.00 H new ATOM 0 HB THR A 20 16.174 0.376 -11.047 1.00 0.00 H new ATOM 0 HG1 THR A 20 18.261 1.442 -10.966 1.00 0.00 H new ATOM 0 HG21 THR A 20 16.483 2.422 -9.705 1.00 0.00 H new ATOM 0 HG22 THR A 20 15.320 1.307 -8.948 1.00 0.00 H new ATOM 0 HG23 THR A 20 16.978 1.429 -8.313 1.00 0.00 H new ATOM 305 N ILE A 21 14.733 -1.356 -8.060 1.00 0.00 N ATOM 306 CA ILE A 21 13.335 -1.630 -7.748 1.00 0.00 C ATOM 307 C ILE A 21 12.450 -0.440 -8.101 1.00 0.00 C ATOM 308 O ILE A 21 12.452 0.578 -7.406 1.00 0.00 O ATOM 309 CB ILE A 21 13.148 -1.971 -6.257 1.00 0.00 C ATOM 310 CG1 ILE A 21 14.034 -3.156 -5.868 1.00 0.00 C ATOM 311 CG2 ILE A 21 11.686 -2.276 -5.964 1.00 0.00 C ATOM 312 CD1 ILE A 21 15.382 -2.747 -5.317 1.00 0.00 C ATOM 0 H ILE A 21 15.322 -1.188 -7.245 1.00 0.00 H new ATOM 0 HA ILE A 21 13.040 -2.490 -8.349 1.00 0.00 H new ATOM 0 HB ILE A 21 13.446 -1.108 -5.661 1.00 0.00 H new ATOM 0 HG12 ILE A 21 13.514 -3.759 -5.124 1.00 0.00 H new ATOM 0 HG13 ILE A 21 14.185 -3.789 -6.742 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.569 -2.515 -4.907 1.00 0.00 H new ATOM 0 HG22 ILE A 21 11.077 -1.406 -6.209 1.00 0.00 H new ATOM 0 HG23 ILE A 21 11.364 -3.126 -6.566 1.00 0.00 H new ATOM 0 HD11 ILE A 21 15.956 -3.638 -5.062 1.00 0.00 H new ATOM 0 HD12 ILE A 21 15.922 -2.169 -6.067 1.00 0.00 H new ATOM 0 HD13 ILE A 21 15.241 -2.139 -4.424 1.00 0.00 H new ATOM 324 N LEU A 22 11.691 -0.574 -9.183 1.00 0.00 N ATOM 325 CA LEU A 22 10.798 0.489 -9.628 1.00 0.00 C ATOM 326 C LEU A 22 9.356 0.194 -9.225 1.00 0.00 C ATOM 327 O LEU A 22 8.715 0.996 -8.546 1.00 0.00 O ATOM 328 CB LEU A 22 10.890 0.658 -11.146 1.00 0.00 C ATOM 329 CG LEU A 22 12.271 0.432 -11.763 1.00 0.00 C ATOM 330 CD1 LEU A 22 12.152 0.179 -13.258 1.00 0.00 C ATOM 331 CD2 LEU A 22 13.178 1.623 -11.492 1.00 0.00 C ATOM 0 H LEU A 22 11.676 -1.409 -9.768 1.00 0.00 H new ATOM 0 HA LEU A 22 11.109 1.416 -9.146 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.188 -0.034 -11.612 1.00 0.00 H new ATOM 0 HB3 LEU A 22 10.561 1.666 -11.400 1.00 0.00 H new ATOM 0 HG LEU A 22 12.715 -0.449 -11.300 1.00 0.00 H new ATOM 0 HD11 LEU A 22 13.144 0.020 -13.680 1.00 0.00 H new ATOM 0 HD12 LEU A 22 11.539 -0.706 -13.430 1.00 0.00 H new ATOM 0 HD13 LEU A 22 11.687 1.041 -13.737 1.00 0.00 H new ATOM 0 HD21 LEU A 22 14.156 1.444 -11.938 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.739 2.521 -11.927 1.00 0.00 H new ATOM 0 HD23 LEU A 22 13.289 1.758 -10.416 1.00 0.00 H new ATOM 343 N ARG A 23 8.855 -0.962 -9.646 1.00 0.00 N ATOM 344 CA ARG A 23 7.489 -1.363 -9.328 1.00 0.00 C ATOM 345 C ARG A 23 7.422 -2.854 -9.007 1.00 0.00 C ATOM 346 O ARG A 23 7.348 -3.691 -9.907 1.00 0.00 O ATOM 347 CB ARG A 23 6.555 -1.038 -10.494 1.00 0.00 C ATOM 348 CG ARG A 23 5.824 0.285 -10.339 1.00 0.00 C ATOM 349 CD ARG A 23 4.723 0.194 -9.293 1.00 0.00 C ATOM 350 NE ARG A 23 3.724 1.246 -9.458 1.00 0.00 N ATOM 351 CZ ARG A 23 2.800 1.531 -8.547 1.00 0.00 C ATOM 352 NH1 ARG A 23 2.749 0.846 -7.413 1.00 0.00 N ATOM 353 NH2 ARG A 23 1.924 2.503 -8.770 1.00 0.00 N ATOM 0 H ARG A 23 9.373 -1.637 -10.208 1.00 0.00 H new ATOM 0 HA ARG A 23 7.168 -0.805 -8.449 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.134 -1.017 -11.417 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.822 -1.838 -10.595 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.533 1.063 -10.056 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.394 0.579 -11.297 1.00 0.00 H new ATOM 0 HD2 ARG A 23 4.238 -0.780 -9.360 1.00 0.00 H new ATOM 0 HD3 ARG A 23 5.162 0.264 -8.298 1.00 0.00 H new ATOM 0 HE ARG A 23 3.736 1.792 -10.320 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.420 0.098 -7.238 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.039 1.067 -6.715 1.00 0.00 H new ATOM 0 HH21 ARG A 23 1.960 3.032 -9.641 1.00 0.00 H new ATOM 0 HH22 ARG A 23 1.215 2.721 -8.070 1.00 0.00 H new ATOM 367 N LYS A 24 7.448 -3.179 -7.719 1.00 0.00 N ATOM 368 CA LYS A 24 7.388 -4.567 -7.279 1.00 0.00 C ATOM 369 C LYS A 24 6.213 -5.294 -7.925 1.00 0.00 C ATOM 370 O LYS A 24 5.175 -4.693 -8.199 1.00 0.00 O ATOM 371 CB LYS A 24 7.268 -4.635 -5.755 1.00 0.00 C ATOM 372 CG LYS A 24 8.582 -4.404 -5.029 1.00 0.00 C ATOM 373 CD LYS A 24 9.279 -5.715 -4.706 1.00 0.00 C ATOM 374 CE LYS A 24 8.660 -6.390 -3.491 1.00 0.00 C ATOM 375 NZ LYS A 24 9.288 -5.930 -2.222 1.00 0.00 N ATOM 0 H LYS A 24 7.510 -2.499 -6.961 1.00 0.00 H new ATOM 0 HA LYS A 24 8.310 -5.060 -7.588 1.00 0.00 H new ATOM 0 HB2 LYS A 24 6.544 -3.891 -5.423 1.00 0.00 H new ATOM 0 HB3 LYS A 24 6.874 -5.612 -5.473 1.00 0.00 H new ATOM 0 HG2 LYS A 24 9.235 -3.786 -5.645 1.00 0.00 H new ATOM 0 HG3 LYS A 24 8.397 -3.852 -4.107 1.00 0.00 H new ATOM 0 HD2 LYS A 24 9.217 -6.383 -5.565 1.00 0.00 H new ATOM 0 HD3 LYS A 24 10.337 -5.530 -4.521 1.00 0.00 H new ATOM 0 HE2 LYS A 24 7.591 -6.180 -3.464 1.00 0.00 H new ATOM 0 HE3 LYS A 24 8.770 -7.471 -3.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 8.839 -6.413 -1.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 10.304 -6.153 -2.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 9.161 -4.902 -2.124 1.00 0.00 H new ATOM 389 N GLY A 25 6.384 -6.590 -8.165 1.00 0.00 N ATOM 390 CA GLY A 25 5.329 -7.377 -8.776 1.00 0.00 C ATOM 391 C GLY A 25 4.696 -8.353 -7.804 1.00 0.00 C ATOM 392 O GLY A 25 4.126 -7.948 -6.791 1.00 0.00 O ATOM 0 H GLY A 25 7.234 -7.109 -7.947 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.561 -6.709 -9.167 1.00 0.00 H new ATOM 0 HA3 GLY A 25 5.735 -7.927 -9.625 1.00 0.00 H new ATOM 396 N GLU A 26 4.795 -9.642 -8.113 1.00 0.00 N ATOM 397 CA GLU A 26 4.225 -10.678 -7.259 1.00 0.00 C ATOM 398 C GLU A 26 5.152 -10.987 -6.087 1.00 0.00 C ATOM 399 O GLU A 26 4.892 -10.586 -4.954 1.00 0.00 O ATOM 400 CB GLU A 26 3.965 -11.950 -8.068 1.00 0.00 C ATOM 401 CG GLU A 26 2.858 -11.801 -9.098 1.00 0.00 C ATOM 402 CD GLU A 26 1.508 -11.521 -8.468 1.00 0.00 C ATOM 403 OE1 GLU A 26 1.078 -12.316 -7.606 1.00 0.00 O ATOM 404 OE2 GLU A 26 0.881 -10.506 -8.836 1.00 0.00 O ATOM 0 H GLU A 26 5.264 -9.994 -8.948 1.00 0.00 H new ATOM 0 HA GLU A 26 3.279 -10.308 -6.864 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.885 -12.242 -8.575 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.707 -12.759 -7.384 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.110 -10.991 -9.782 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.795 -12.712 -9.693 1.00 0.00 H new ATOM 411 N GLY A 27 6.235 -11.705 -6.370 1.00 0.00 N ATOM 412 CA GLY A 27 7.184 -12.058 -5.330 1.00 0.00 C ATOM 413 C GLY A 27 7.045 -13.500 -4.883 1.00 0.00 C ATOM 414 O GLY A 27 6.160 -13.830 -4.095 1.00 0.00 O ATOM 0 H GLY A 27 6.472 -12.048 -7.301 1.00 0.00 H new ATOM 0 HA2 GLY A 27 8.197 -11.890 -5.695 1.00 0.00 H new ATOM 0 HA3 GLY A 27 7.041 -11.400 -4.473 1.00 0.00 H new ATOM 418 N GLY A 28 7.921 -14.362 -5.389 1.00 0.00 N ATOM 419 CA GLY A 28 7.874 -15.766 -5.027 1.00 0.00 C ATOM 420 C GLY A 28 8.258 -16.675 -6.178 1.00 0.00 C ATOM 421 O GLY A 28 8.110 -16.307 -7.343 1.00 0.00 O ATOM 0 H GLY A 28 8.663 -14.113 -6.043 1.00 0.00 H new ATOM 0 HA2 GLY A 28 8.546 -15.944 -4.188 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.869 -16.017 -4.689 1.00 0.00 H new ATOM 425 N GLU A 29 8.754 -17.864 -5.851 1.00 0.00 N ATOM 426 CA GLU A 29 9.162 -18.826 -6.868 1.00 0.00 C ATOM 427 C GLU A 29 8.000 -19.162 -7.798 1.00 0.00 C ATOM 428 O GLU A 29 8.199 -19.445 -8.978 1.00 0.00 O ATOM 429 CB GLU A 29 9.689 -20.104 -6.210 1.00 0.00 C ATOM 430 CG GLU A 29 8.789 -20.637 -5.108 1.00 0.00 C ATOM 431 CD GLU A 29 9.119 -22.066 -4.725 1.00 0.00 C ATOM 432 OE1 GLU A 29 10.105 -22.612 -5.265 1.00 0.00 O ATOM 433 OE2 GLU A 29 8.393 -22.640 -3.887 1.00 0.00 O ATOM 0 H GLU A 29 8.883 -18.184 -4.891 1.00 0.00 H new ATOM 0 HA GLU A 29 9.958 -18.374 -7.459 1.00 0.00 H new ATOM 0 HB2 GLU A 29 9.809 -20.873 -6.973 1.00 0.00 H new ATOM 0 HB3 GLU A 29 10.678 -19.908 -5.797 1.00 0.00 H new ATOM 0 HG2 GLU A 29 8.881 -19.999 -4.229 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.750 -20.583 -5.434 1.00 0.00 H new ATOM 440 N GLU A 30 6.787 -19.128 -7.255 1.00 0.00 N ATOM 441 CA GLU A 30 5.593 -19.429 -8.036 1.00 0.00 C ATOM 442 C GLU A 30 5.452 -18.464 -9.209 1.00 0.00 C ATOM 443 O GLU A 30 4.860 -18.799 -10.234 1.00 0.00 O ATOM 444 CB GLU A 30 4.347 -19.359 -7.151 1.00 0.00 C ATOM 445 CG GLU A 30 4.160 -18.015 -6.468 1.00 0.00 C ATOM 446 CD GLU A 30 3.430 -18.130 -5.144 1.00 0.00 C ATOM 447 OE1 GLU A 30 2.233 -18.485 -5.154 1.00 0.00 O ATOM 448 OE2 GLU A 30 4.058 -17.865 -4.097 1.00 0.00 O ATOM 0 H GLU A 30 6.605 -18.895 -6.279 1.00 0.00 H new ATOM 0 HA GLU A 30 5.694 -20.440 -8.430 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.468 -19.574 -7.758 1.00 0.00 H new ATOM 0 HB3 GLU A 30 4.407 -20.138 -6.391 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.135 -17.557 -6.302 1.00 0.00 H new ATOM 0 HG3 GLU A 30 3.604 -17.350 -7.129 1.00 0.00 H new ATOM 455 N ASN A 31 6.000 -17.264 -9.049 1.00 0.00 N ATOM 456 CA ASN A 31 5.934 -16.248 -10.094 1.00 0.00 C ATOM 457 C ASN A 31 7.297 -16.057 -10.753 1.00 0.00 C ATOM 458 O ASN A 31 7.542 -15.049 -11.416 1.00 0.00 O ATOM 459 CB ASN A 31 5.445 -14.920 -9.514 1.00 0.00 C ATOM 460 CG ASN A 31 5.994 -14.659 -8.124 1.00 0.00 C ATOM 461 OD1 ASN A 31 7.040 -14.029 -7.966 1.00 0.00 O ATOM 462 ND2 ASN A 31 5.289 -15.145 -7.109 1.00 0.00 N ATOM 0 H ASN A 31 6.495 -16.971 -8.206 1.00 0.00 H new ATOM 0 HA ASN A 31 5.228 -16.587 -10.852 1.00 0.00 H new ATOM 0 HB2 ASN A 31 5.740 -14.107 -10.177 1.00 0.00 H new ATOM 0 HB3 ASN A 31 4.356 -14.922 -9.477 1.00 0.00 H new ATOM 0 HD21 ASN A 31 5.609 -15.002 -6.151 1.00 0.00 H new ATOM 0 HD22 ASN A 31 4.428 -15.661 -7.287 1.00 0.00 H new ATOM 469 N ALA A 32 8.181 -17.032 -10.566 1.00 0.00 N ATOM 470 CA ALA A 32 9.518 -16.972 -11.143 1.00 0.00 C ATOM 471 C ALA A 32 9.641 -17.910 -12.339 1.00 0.00 C ATOM 472 O ALA A 32 8.955 -18.928 -12.434 1.00 0.00 O ATOM 473 CB ALA A 32 10.563 -17.315 -10.092 1.00 0.00 C ATOM 0 H ALA A 32 7.995 -17.873 -10.019 1.00 0.00 H new ATOM 0 HA ALA A 32 9.691 -15.954 -11.492 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.557 -17.266 -10.537 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.499 -16.603 -9.269 1.00 0.00 H new ATOM 0 HB3 ALA A 32 10.383 -18.322 -9.715 1.00 0.00 H new ATOM 479 N PRO A 33 10.536 -17.561 -13.276 1.00 0.00 N ATOM 480 CA PRO A 33 10.769 -18.359 -14.484 1.00 0.00 C ATOM 481 C PRO A 33 11.459 -19.684 -14.178 1.00 0.00 C ATOM 482 O PRO A 33 11.761 -19.988 -13.024 1.00 0.00 O ATOM 483 CB PRO A 33 11.679 -17.464 -15.329 1.00 0.00 C ATOM 484 CG PRO A 33 12.372 -16.588 -14.343 1.00 0.00 C ATOM 485 CD PRO A 33 11.388 -16.361 -13.228 1.00 0.00 C ATOM 0 HA PRO A 33 9.837 -18.632 -14.980 1.00 0.00 H new ATOM 0 HB2 PRO A 33 12.392 -18.055 -15.903 1.00 0.00 H new ATOM 0 HB3 PRO A 33 11.103 -16.877 -16.044 1.00 0.00 H new ATOM 0 HG2 PRO A 33 13.281 -17.061 -13.971 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.668 -15.644 -14.800 1.00 0.00 H new ATOM 0 HD2 PRO A 33 11.888 -16.261 -12.265 1.00 0.00 H new ATOM 0 HD3 PRO A 33 10.809 -15.450 -13.382 1.00 0.00 H new ATOM 493 N LYS A 34 11.708 -20.470 -15.220 1.00 0.00 N ATOM 494 CA LYS A 34 12.364 -21.763 -15.065 1.00 0.00 C ATOM 495 C LYS A 34 13.326 -22.027 -16.219 1.00 0.00 C ATOM 496 O LYS A 34 12.958 -21.910 -17.387 1.00 0.00 O ATOM 497 CB LYS A 34 11.322 -22.881 -14.990 1.00 0.00 C ATOM 498 CG LYS A 34 10.849 -23.178 -13.578 1.00 0.00 C ATOM 499 CD LYS A 34 11.935 -23.850 -12.755 1.00 0.00 C ATOM 500 CE LYS A 34 11.613 -23.813 -11.269 1.00 0.00 C ATOM 501 NZ LYS A 34 12.583 -24.611 -10.470 1.00 0.00 N ATOM 0 H LYS A 34 11.465 -20.234 -16.182 1.00 0.00 H new ATOM 0 HA LYS A 34 12.935 -21.744 -14.137 1.00 0.00 H new ATOM 0 HB2 LYS A 34 10.463 -22.607 -15.602 1.00 0.00 H new ATOM 0 HB3 LYS A 34 11.744 -23.789 -15.421 1.00 0.00 H new ATOM 0 HG2 LYS A 34 10.545 -22.251 -13.093 1.00 0.00 H new ATOM 0 HG3 LYS A 34 9.970 -23.821 -13.616 1.00 0.00 H new ATOM 0 HD2 LYS A 34 12.049 -24.885 -13.078 1.00 0.00 H new ATOM 0 HD3 LYS A 34 12.888 -23.353 -12.934 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.620 -22.780 -10.922 1.00 0.00 H new ATOM 0 HE3 LYS A 34 10.606 -24.197 -11.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 12.328 -24.560 -9.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 12.558 -25.602 -10.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 13.541 -24.229 -10.605 1.00 0.00 H new ATOM 515 N LYS A 35 14.561 -22.385 -15.883 1.00 0.00 N ATOM 516 CA LYS A 35 15.576 -22.668 -16.890 1.00 0.00 C ATOM 517 C LYS A 35 15.097 -23.745 -17.858 1.00 0.00 C ATOM 518 O LYS A 35 14.546 -24.765 -17.445 1.00 0.00 O ATOM 519 CB LYS A 35 16.878 -23.113 -16.220 1.00 0.00 C ATOM 520 CG LYS A 35 17.753 -21.959 -15.764 1.00 0.00 C ATOM 521 CD LYS A 35 17.091 -21.162 -14.653 1.00 0.00 C ATOM 522 CE LYS A 35 18.121 -20.489 -13.759 1.00 0.00 C ATOM 523 NZ LYS A 35 18.804 -19.362 -14.452 1.00 0.00 N ATOM 0 H LYS A 35 14.883 -22.486 -14.920 1.00 0.00 H new ATOM 0 HA LYS A 35 15.758 -21.753 -17.453 1.00 0.00 H new ATOM 0 HB2 LYS A 35 16.639 -23.738 -15.360 1.00 0.00 H new ATOM 0 HB3 LYS A 35 17.442 -23.732 -16.917 1.00 0.00 H new ATOM 0 HG2 LYS A 35 18.711 -22.344 -15.416 1.00 0.00 H new ATOM 0 HG3 LYS A 35 17.961 -21.303 -16.609 1.00 0.00 H new ATOM 0 HD2 LYS A 35 16.435 -20.407 -15.087 1.00 0.00 H new ATOM 0 HD3 LYS A 35 16.464 -21.822 -14.054 1.00 0.00 H new ATOM 0 HE2 LYS A 35 17.633 -20.119 -12.857 1.00 0.00 H new ATOM 0 HE3 LYS A 35 18.862 -21.223 -13.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 19.498 -18.929 -13.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 19.291 -19.719 -15.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 18.100 -18.649 -14.732 1.00 0.00 H new ATOM 537 N GLY A 36 15.311 -23.512 -19.150 1.00 0.00 N ATOM 538 CA GLY A 36 14.895 -24.471 -20.156 1.00 0.00 C ATOM 539 C GLY A 36 13.393 -24.486 -20.358 1.00 0.00 C ATOM 540 O GLY A 36 12.778 -25.550 -20.414 1.00 0.00 O ATOM 0 H GLY A 36 15.765 -22.676 -19.517 1.00 0.00 H new ATOM 0 HA2 GLY A 36 15.383 -24.235 -21.102 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.229 -25.467 -19.864 1.00 0.00 H new ATOM 544 N ASN A 37 12.801 -23.301 -20.466 1.00 0.00 N ATOM 545 CA ASN A 37 11.360 -23.182 -20.660 1.00 0.00 C ATOM 546 C ASN A 37 11.003 -21.828 -21.266 1.00 0.00 C ATOM 547 O ASN A 37 11.646 -20.819 -20.977 1.00 0.00 O ATOM 548 CB ASN A 37 10.628 -23.366 -19.329 1.00 0.00 C ATOM 549 CG ASN A 37 10.263 -24.814 -19.066 1.00 0.00 C ATOM 550 OD1 ASN A 37 9.607 -25.444 -20.034 1.00 0.00 O flip ATOM 551 ND2 ASN A 37 10.567 -25.360 -18.005 1.00 0.00 N flip ATOM 0 H ASN A 37 13.296 -22.410 -20.423 1.00 0.00 H new ATOM 0 HA ASN A 37 11.046 -23.964 -21.351 1.00 0.00 H new ATOM 0 HB2 ASN A 37 11.257 -22.999 -18.518 1.00 0.00 H new ATOM 0 HB3 ASN A 37 9.722 -22.760 -19.329 1.00 0.00 H new ATOM 0 HD21 ASN A 37 11.071 -24.837 -17.289 1.00 0.00 H new ATOM 0 HD22 ASN A 37 10.315 -26.335 -17.842 1.00 0.00 H new ATOM 558 N GLU A 38 9.975 -21.815 -22.108 1.00 0.00 N ATOM 559 CA GLU A 38 9.533 -20.585 -22.755 1.00 0.00 C ATOM 560 C GLU A 38 9.217 -19.510 -21.720 1.00 0.00 C ATOM 561 O GLU A 38 8.465 -19.745 -20.774 1.00 0.00 O ATOM 562 CB GLU A 38 8.300 -20.853 -23.622 1.00 0.00 C ATOM 563 CG GLU A 38 8.120 -19.850 -24.749 1.00 0.00 C ATOM 564 CD GLU A 38 7.129 -20.321 -25.796 1.00 0.00 C ATOM 565 OE1 GLU A 38 7.504 -21.172 -26.629 1.00 0.00 O ATOM 566 OE2 GLU A 38 5.977 -19.839 -25.781 1.00 0.00 O ATOM 0 H GLU A 38 9.433 -22.642 -22.358 1.00 0.00 H new ATOM 0 HA GLU A 38 10.343 -20.227 -23.390 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.375 -21.854 -24.046 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.412 -20.840 -22.990 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.781 -18.900 -24.335 1.00 0.00 H new ATOM 0 HG3 GLU A 38 9.084 -19.665 -25.223 1.00 0.00 H new ATOM 573 N VAL A 39 9.796 -18.328 -21.907 1.00 0.00 N ATOM 574 CA VAL A 39 9.577 -17.215 -20.991 1.00 0.00 C ATOM 575 C VAL A 39 9.354 -15.913 -21.752 1.00 0.00 C ATOM 576 O VAL A 39 10.217 -15.468 -22.510 1.00 0.00 O ATOM 577 CB VAL A 39 10.766 -17.038 -20.028 1.00 0.00 C ATOM 578 CG1 VAL A 39 10.720 -18.084 -18.925 1.00 0.00 C ATOM 579 CG2 VAL A 39 12.082 -17.110 -20.788 1.00 0.00 C ATOM 0 H VAL A 39 10.421 -18.117 -22.685 1.00 0.00 H new ATOM 0 HA VAL A 39 8.684 -17.452 -20.413 1.00 0.00 H new ATOM 0 HB VAL A 39 10.693 -16.054 -19.565 1.00 0.00 H new ATOM 0 HG11 VAL A 39 11.568 -17.943 -18.254 1.00 0.00 H new ATOM 0 HG12 VAL A 39 9.792 -17.980 -18.363 1.00 0.00 H new ATOM 0 HG13 VAL A 39 10.767 -19.080 -19.366 1.00 0.00 H new ATOM 0 HG21 VAL A 39 12.911 -16.983 -20.092 1.00 0.00 H new ATOM 0 HG22 VAL A 39 12.166 -18.079 -21.279 1.00 0.00 H new ATOM 0 HG23 VAL A 39 12.113 -16.319 -21.538 1.00 0.00 H new ATOM 589 N THR A 40 8.191 -15.304 -21.544 1.00 0.00 N ATOM 590 CA THR A 40 7.854 -14.052 -22.211 1.00 0.00 C ATOM 591 C THR A 40 8.036 -12.864 -21.273 1.00 0.00 C ATOM 592 O THR A 40 7.448 -12.818 -20.192 1.00 0.00 O ATOM 593 CB THR A 40 6.404 -14.065 -22.730 1.00 0.00 C ATOM 594 OG1 THR A 40 6.219 -15.153 -23.642 1.00 0.00 O ATOM 595 CG2 THR A 40 6.065 -12.754 -23.422 1.00 0.00 C ATOM 0 H THR A 40 7.466 -15.657 -20.919 1.00 0.00 H new ATOM 0 HA THR A 40 8.534 -13.951 -23.057 1.00 0.00 H new ATOM 0 HB THR A 40 5.738 -14.190 -21.876 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.294 -15.155 -23.966 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.036 -12.787 -23.780 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.178 -11.931 -22.717 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.738 -12.603 -24.266 1.00 0.00 H new ATOM 603 N VAL A 41 8.853 -11.904 -21.694 1.00 0.00 N ATOM 604 CA VAL A 41 9.110 -10.714 -20.892 1.00 0.00 C ATOM 605 C VAL A 41 9.243 -9.476 -21.773 1.00 0.00 C ATOM 606 O VAL A 41 9.258 -9.573 -23.000 1.00 0.00 O ATOM 607 CB VAL A 41 10.390 -10.871 -20.050 1.00 0.00 C ATOM 608 CG1 VAL A 41 10.290 -12.093 -19.150 1.00 0.00 C ATOM 609 CG2 VAL A 41 11.613 -10.959 -20.950 1.00 0.00 C ATOM 0 H VAL A 41 9.348 -11.927 -22.586 1.00 0.00 H new ATOM 0 HA VAL A 41 8.257 -10.592 -20.224 1.00 0.00 H new ATOM 0 HB VAL A 41 10.498 -9.991 -19.416 1.00 0.00 H new ATOM 0 HG11 VAL A 41 11.203 -12.188 -18.563 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.437 -11.983 -18.480 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.158 -12.985 -19.762 1.00 0.00 H new ATOM 0 HG21 VAL A 41 12.508 -11.070 -20.338 1.00 0.00 H new ATOM 0 HG22 VAL A 41 11.517 -11.820 -21.611 1.00 0.00 H new ATOM 0 HG23 VAL A 41 11.692 -10.050 -21.547 1.00 0.00 H new ATOM 619 N HIS A 42 9.340 -8.312 -21.138 1.00 0.00 N ATOM 620 CA HIS A 42 9.474 -7.054 -21.863 1.00 0.00 C ATOM 621 C HIS A 42 10.692 -6.274 -21.379 1.00 0.00 C ATOM 622 O HIS A 42 10.958 -6.202 -20.179 1.00 0.00 O ATOM 623 CB HIS A 42 8.211 -6.208 -21.695 1.00 0.00 C ATOM 624 CG HIS A 42 8.317 -4.846 -22.309 1.00 0.00 C ATOM 625 ND1 HIS A 42 9.020 -3.811 -21.728 1.00 0.00 N ATOM 626 CD2 HIS A 42 7.806 -4.351 -23.460 1.00 0.00 C ATOM 627 CE1 HIS A 42 8.935 -2.739 -22.495 1.00 0.00 C ATOM 628 NE2 HIS A 42 8.204 -3.040 -23.553 1.00 0.00 N ATOM 0 H HIS A 42 9.328 -8.214 -20.123 1.00 0.00 H new ATOM 0 HA HIS A 42 9.610 -7.285 -22.920 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.368 -6.735 -22.143 1.00 0.00 H new ATOM 0 HB3 HIS A 42 7.993 -6.103 -20.632 1.00 0.00 H new ATOM 0 HD1 HIS A 42 9.526 -3.865 -20.844 1.00 0.00 H new ATOM 0 HD2 HIS A 42 7.198 -4.887 -24.173 1.00 0.00 H new ATOM 0 HE1 HIS A 42 9.387 -1.779 -22.292 1.00 0.00 H new ATOM 636 N TYR A 43 11.428 -5.692 -22.319 1.00 0.00 N ATOM 637 CA TYR A 43 12.620 -4.920 -21.988 1.00 0.00 C ATOM 638 C TYR A 43 12.823 -3.779 -22.980 1.00 0.00 C ATOM 639 O TYR A 43 12.200 -3.746 -24.042 1.00 0.00 O ATOM 640 CB TYR A 43 13.853 -5.826 -21.977 1.00 0.00 C ATOM 641 CG TYR A 43 14.087 -6.546 -23.285 1.00 0.00 C ATOM 642 CD1 TYR A 43 13.405 -7.718 -23.588 1.00 0.00 C ATOM 643 CD2 TYR A 43 14.992 -6.055 -24.219 1.00 0.00 C ATOM 644 CE1 TYR A 43 13.617 -8.380 -24.782 1.00 0.00 C ATOM 645 CE2 TYR A 43 15.209 -6.709 -25.416 1.00 0.00 C ATOM 646 CZ TYR A 43 14.519 -7.871 -25.693 1.00 0.00 C ATOM 647 OH TYR A 43 14.733 -8.527 -26.884 1.00 0.00 O ATOM 0 H TYR A 43 11.220 -5.740 -23.316 1.00 0.00 H new ATOM 0 HA TYR A 43 12.481 -4.493 -20.995 1.00 0.00 H new ATOM 0 HB2 TYR A 43 14.732 -5.226 -21.740 1.00 0.00 H new ATOM 0 HB3 TYR A 43 13.745 -6.563 -21.181 1.00 0.00 H new ATOM 0 HD1 TYR A 43 12.697 -8.119 -22.878 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.535 -5.146 -24.005 1.00 0.00 H new ATOM 0 HE1 TYR A 43 13.080 -9.291 -25.001 1.00 0.00 H new ATOM 0 HE2 TYR A 43 15.915 -6.313 -26.131 1.00 0.00 H new ATOM 0 HH TYR A 43 13.952 -9.079 -27.098 1.00 0.00 H new ATOM 657 N VAL A 44 13.699 -2.845 -22.626 1.00 0.00 N ATOM 658 CA VAL A 44 13.987 -1.702 -23.484 1.00 0.00 C ATOM 659 C VAL A 44 15.420 -1.217 -23.291 1.00 0.00 C ATOM 660 O VAL A 44 15.831 -0.891 -22.179 1.00 0.00 O ATOM 661 CB VAL A 44 13.020 -0.535 -23.209 1.00 0.00 C ATOM 662 CG1 VAL A 44 13.363 0.661 -24.084 1.00 0.00 C ATOM 663 CG2 VAL A 44 11.580 -0.974 -23.431 1.00 0.00 C ATOM 0 H VAL A 44 14.222 -2.857 -21.750 1.00 0.00 H new ATOM 0 HA VAL A 44 13.855 -2.038 -24.513 1.00 0.00 H new ATOM 0 HB VAL A 44 13.128 -0.234 -22.167 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.669 1.475 -23.876 1.00 0.00 H new ATOM 0 HG12 VAL A 44 14.381 0.988 -23.871 1.00 0.00 H new ATOM 0 HG13 VAL A 44 13.285 0.378 -25.134 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.910 -0.138 -23.232 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.455 -1.302 -24.463 1.00 0.00 H new ATOM 0 HG23 VAL A 44 11.343 -1.797 -22.757 1.00 0.00 H new ATOM 673 N GLY A 45 16.175 -1.170 -24.384 1.00 0.00 N ATOM 674 CA GLY A 45 17.554 -0.722 -24.314 1.00 0.00 C ATOM 675 C GLY A 45 17.687 0.777 -24.499 1.00 0.00 C ATOM 676 O GLY A 45 17.016 1.368 -25.346 1.00 0.00 O ATOM 0 H GLY A 45 15.857 -1.434 -25.316 1.00 0.00 H new ATOM 0 HA2 GLY A 45 17.976 -1.005 -23.350 1.00 0.00 H new ATOM 0 HA3 GLY A 45 18.138 -1.233 -25.080 1.00 0.00 H new ATOM 680 N LYS A 46 18.554 1.394 -23.705 1.00 0.00 N ATOM 681 CA LYS A 46 18.774 2.834 -23.783 1.00 0.00 C ATOM 682 C LYS A 46 20.186 3.194 -23.333 1.00 0.00 C ATOM 683 O LYS A 46 20.693 2.650 -22.351 1.00 0.00 O ATOM 684 CB LYS A 46 17.748 3.575 -22.923 1.00 0.00 C ATOM 685 CG LYS A 46 18.067 3.548 -21.438 1.00 0.00 C ATOM 686 CD LYS A 46 18.797 4.807 -21.002 1.00 0.00 C ATOM 687 CE LYS A 46 18.482 5.162 -19.557 1.00 0.00 C ATOM 688 NZ LYS A 46 17.167 5.849 -19.428 1.00 0.00 N ATOM 0 H LYS A 46 19.117 0.920 -22.999 1.00 0.00 H new ATOM 0 HA LYS A 46 18.655 3.139 -24.823 1.00 0.00 H new ATOM 0 HB2 LYS A 46 17.689 4.612 -23.255 1.00 0.00 H new ATOM 0 HB3 LYS A 46 16.765 3.133 -23.083 1.00 0.00 H new ATOM 0 HG2 LYS A 46 17.143 3.446 -20.868 1.00 0.00 H new ATOM 0 HG3 LYS A 46 18.679 2.675 -21.212 1.00 0.00 H new ATOM 0 HD2 LYS A 46 19.871 4.664 -21.117 1.00 0.00 H new ATOM 0 HD3 LYS A 46 18.515 5.636 -21.651 1.00 0.00 H new ATOM 0 HE2 LYS A 46 18.478 4.255 -18.953 1.00 0.00 H new ATOM 0 HE3 LYS A 46 19.268 5.805 -19.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 16.989 6.074 -18.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 17.178 6.728 -19.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 16.413 5.226 -19.782 1.00 0.00 H new ATOM 702 N LEU A 47 20.815 4.115 -24.055 1.00 0.00 N ATOM 703 CA LEU A 47 22.169 4.549 -23.728 1.00 0.00 C ATOM 704 C LEU A 47 22.147 5.858 -22.945 1.00 0.00 C ATOM 705 O LEU A 47 21.278 6.703 -23.155 1.00 0.00 O ATOM 706 CB LEU A 47 22.993 4.720 -25.006 1.00 0.00 C ATOM 707 CG LEU A 47 23.778 3.492 -25.468 1.00 0.00 C ATOM 708 CD1 LEU A 47 23.660 3.318 -26.974 1.00 0.00 C ATOM 709 CD2 LEU A 47 25.239 3.607 -25.056 1.00 0.00 C ATOM 0 H LEU A 47 20.410 4.575 -24.870 1.00 0.00 H new ATOM 0 HA LEU A 47 22.630 3.782 -23.105 1.00 0.00 H new ATOM 0 HB2 LEU A 47 22.321 5.020 -25.810 1.00 0.00 H new ATOM 0 HB3 LEU A 47 23.695 5.540 -24.855 1.00 0.00 H new ATOM 0 HG LEU A 47 23.353 2.611 -24.987 1.00 0.00 H new ATOM 0 HD11 LEU A 47 24.225 2.439 -27.284 1.00 0.00 H new ATOM 0 HD12 LEU A 47 22.612 3.189 -27.244 1.00 0.00 H new ATOM 0 HD13 LEU A 47 24.058 4.201 -27.475 1.00 0.00 H new ATOM 0 HD21 LEU A 47 25.783 2.724 -25.393 1.00 0.00 H new ATOM 0 HD22 LEU A 47 25.676 4.497 -25.509 1.00 0.00 H new ATOM 0 HD23 LEU A 47 25.306 3.682 -23.971 1.00 0.00 H new ATOM 721 N GLU A 48 23.110 6.018 -22.043 1.00 0.00 N ATOM 722 CA GLU A 48 23.201 7.224 -21.229 1.00 0.00 C ATOM 723 C GLU A 48 24.116 8.255 -21.884 1.00 0.00 C ATOM 724 O GLU A 48 24.006 9.453 -21.624 1.00 0.00 O ATOM 725 CB GLU A 48 23.717 6.885 -19.829 1.00 0.00 C ATOM 726 CG GLU A 48 25.006 6.079 -19.834 1.00 0.00 C ATOM 727 CD GLU A 48 25.785 6.216 -18.541 1.00 0.00 C ATOM 728 OE1 GLU A 48 25.182 6.627 -17.527 1.00 0.00 O ATOM 729 OE2 GLU A 48 26.996 5.913 -18.542 1.00 0.00 O ATOM 0 H GLU A 48 23.838 5.328 -21.858 1.00 0.00 H new ATOM 0 HA GLU A 48 22.201 7.651 -21.146 1.00 0.00 H new ATOM 0 HB2 GLU A 48 23.879 7.811 -19.277 1.00 0.00 H new ATOM 0 HB3 GLU A 48 22.950 6.325 -19.294 1.00 0.00 H new ATOM 0 HG2 GLU A 48 24.772 5.028 -20.003 1.00 0.00 H new ATOM 0 HG3 GLU A 48 25.630 6.405 -20.666 1.00 0.00 H new ATOM 736 N SER A 49 25.020 7.779 -22.735 1.00 0.00 N ATOM 737 CA SER A 49 25.957 8.657 -23.425 1.00 0.00 C ATOM 738 C SER A 49 25.220 9.618 -24.353 1.00 0.00 C ATOM 739 O SER A 49 25.612 10.775 -24.505 1.00 0.00 O ATOM 740 CB SER A 49 26.968 7.832 -24.224 1.00 0.00 C ATOM 741 OG SER A 49 26.312 6.955 -25.124 1.00 0.00 O ATOM 0 H SER A 49 25.123 6.790 -22.963 1.00 0.00 H new ATOM 0 HA SER A 49 26.488 9.242 -22.674 1.00 0.00 H new ATOM 0 HB2 SER A 49 27.630 8.498 -24.778 1.00 0.00 H new ATOM 0 HB3 SER A 49 27.593 7.257 -23.541 1.00 0.00 H new ATOM 0 HG SER A 49 26.979 6.440 -25.624 1.00 0.00 H new ATOM 747 N SER A 50 24.150 9.128 -24.971 1.00 0.00 N ATOM 748 CA SER A 50 23.359 9.941 -25.888 1.00 0.00 C ATOM 749 C SER A 50 21.938 10.124 -25.363 1.00 0.00 C ATOM 750 O SER A 50 21.256 11.088 -25.710 1.00 0.00 O ATOM 751 CB SER A 50 23.323 9.295 -27.274 1.00 0.00 C ATOM 752 OG SER A 50 22.889 10.219 -28.257 1.00 0.00 O ATOM 0 H SER A 50 23.811 8.173 -24.854 1.00 0.00 H new ATOM 0 HA SER A 50 23.829 10.921 -25.964 1.00 0.00 H new ATOM 0 HB2 SER A 50 24.315 8.925 -27.532 1.00 0.00 H new ATOM 0 HB3 SER A 50 22.655 8.434 -27.260 1.00 0.00 H new ATOM 0 HG SER A 50 22.876 9.782 -29.134 1.00 0.00 H new ATOM 758 N GLY A 51 21.498 9.191 -24.524 1.00 0.00 N ATOM 759 CA GLY A 51 20.161 9.267 -23.965 1.00 0.00 C ATOM 760 C GLY A 51 19.103 8.754 -24.921 1.00 0.00 C ATOM 761 O GLY A 51 17.915 9.028 -24.749 1.00 0.00 O ATOM 0 H GLY A 51 22.044 8.384 -24.222 1.00 0.00 H new ATOM 0 HA2 GLY A 51 20.123 8.689 -23.042 1.00 0.00 H new ATOM 0 HA3 GLY A 51 19.938 10.301 -23.703 1.00 0.00 H new ATOM 765 N LYS A 52 19.533 8.009 -25.933 1.00 0.00 N ATOM 766 CA LYS A 52 18.615 7.456 -26.922 1.00 0.00 C ATOM 767 C LYS A 52 18.166 6.054 -26.523 1.00 0.00 C ATOM 768 O LYS A 52 18.771 5.420 -25.659 1.00 0.00 O ATOM 769 CB LYS A 52 19.279 7.419 -28.300 1.00 0.00 C ATOM 770 CG LYS A 52 19.059 8.681 -29.115 1.00 0.00 C ATOM 771 CD LYS A 52 19.578 9.911 -28.389 1.00 0.00 C ATOM 772 CE LYS A 52 18.450 10.676 -27.712 1.00 0.00 C ATOM 773 NZ LYS A 52 18.810 12.101 -27.476 1.00 0.00 N ATOM 0 H LYS A 52 20.513 7.774 -26.090 1.00 0.00 H new ATOM 0 HA LYS A 52 17.737 8.100 -26.967 1.00 0.00 H new ATOM 0 HB2 LYS A 52 20.350 7.260 -28.174 1.00 0.00 H new ATOM 0 HB3 LYS A 52 18.894 6.565 -28.857 1.00 0.00 H new ATOM 0 HG2 LYS A 52 19.562 8.586 -30.077 1.00 0.00 H new ATOM 0 HG3 LYS A 52 17.996 8.801 -29.322 1.00 0.00 H new ATOM 0 HD2 LYS A 52 20.314 9.611 -27.643 1.00 0.00 H new ATOM 0 HD3 LYS A 52 20.089 10.564 -29.097 1.00 0.00 H new ATOM 0 HE2 LYS A 52 17.554 10.625 -28.331 1.00 0.00 H new ATOM 0 HE3 LYS A 52 18.208 10.200 -26.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 18.010 12.592 -27.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 19.640 12.151 -26.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 19.033 12.558 -28.383 1.00 0.00 H new ATOM 787 N VAL A 53 17.103 5.574 -27.161 1.00 0.00 N ATOM 788 CA VAL A 53 16.575 4.246 -26.875 1.00 0.00 C ATOM 789 C VAL A 53 16.620 3.358 -28.114 1.00 0.00 C ATOM 790 O VAL A 53 16.069 3.704 -29.159 1.00 0.00 O ATOM 791 CB VAL A 53 15.125 4.316 -26.360 1.00 0.00 C ATOM 792 CG1 VAL A 53 14.651 2.943 -25.909 1.00 0.00 C ATOM 793 CG2 VAL A 53 15.011 5.327 -25.229 1.00 0.00 C ATOM 0 H VAL A 53 16.591 6.086 -27.880 1.00 0.00 H new ATOM 0 HA VAL A 53 17.208 3.815 -26.099 1.00 0.00 H new ATOM 0 HB VAL A 53 14.483 4.644 -27.177 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.625 3.013 -25.549 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.694 2.249 -26.749 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.294 2.582 -25.106 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.980 5.364 -24.877 1.00 0.00 H new ATOM 0 HG22 VAL A 53 15.664 5.030 -24.409 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.307 6.312 -25.590 1.00 0.00 H new ATOM 803 N PHE A 54 17.279 2.211 -27.989 1.00 0.00 N ATOM 804 CA PHE A 54 17.397 1.273 -29.099 1.00 0.00 C ATOM 805 C PHE A 54 16.890 -0.110 -28.699 1.00 0.00 C ATOM 806 O PHE A 54 16.991 -0.508 -27.538 1.00 0.00 O ATOM 807 CB PHE A 54 18.852 1.180 -29.564 1.00 0.00 C ATOM 808 CG PHE A 54 19.739 0.433 -28.610 1.00 0.00 C ATOM 809 CD1 PHE A 54 19.877 -0.942 -28.703 1.00 0.00 C ATOM 810 CD2 PHE A 54 20.436 1.107 -27.620 1.00 0.00 C ATOM 811 CE1 PHE A 54 20.693 -1.632 -27.827 1.00 0.00 C ATOM 812 CE2 PHE A 54 21.254 0.422 -26.741 1.00 0.00 C ATOM 813 CZ PHE A 54 21.382 -0.949 -26.844 1.00 0.00 C ATOM 0 H PHE A 54 17.739 1.909 -27.130 1.00 0.00 H new ATOM 0 HA PHE A 54 16.783 1.642 -29.920 1.00 0.00 H new ATOM 0 HB2 PHE A 54 18.884 0.690 -30.537 1.00 0.00 H new ATOM 0 HB3 PHE A 54 19.246 2.187 -29.702 1.00 0.00 H new ATOM 0 HD1 PHE A 54 19.340 -1.481 -29.469 1.00 0.00 H new ATOM 0 HD2 PHE A 54 20.339 2.179 -27.534 1.00 0.00 H new ATOM 0 HE1 PHE A 54 20.792 -2.704 -27.911 1.00 0.00 H new ATOM 0 HE2 PHE A 54 21.793 0.959 -25.974 1.00 0.00 H new ATOM 0 HZ PHE A 54 22.020 -1.486 -26.157 1.00 0.00 H new ATOM 823 N ASP A 55 16.344 -0.836 -29.668 1.00 0.00 N ATOM 824 CA ASP A 55 15.820 -2.174 -29.418 1.00 0.00 C ATOM 825 C ASP A 55 14.846 -2.166 -28.244 1.00 0.00 C ATOM 826 O ASP A 55 15.148 -2.689 -27.171 1.00 0.00 O ATOM 827 CB ASP A 55 16.966 -3.149 -29.140 1.00 0.00 C ATOM 828 CG ASP A 55 16.578 -4.590 -29.408 1.00 0.00 C ATOM 829 OD1 ASP A 55 15.369 -4.899 -29.350 1.00 0.00 O ATOM 830 OD2 ASP A 55 17.482 -5.409 -29.675 1.00 0.00 O ATOM 0 H ASP A 55 16.253 -0.521 -30.634 1.00 0.00 H new ATOM 0 HA ASP A 55 15.283 -2.500 -30.309 1.00 0.00 H new ATOM 0 HB2 ASP A 55 17.822 -2.885 -29.760 1.00 0.00 H new ATOM 0 HB3 ASP A 55 17.281 -3.048 -28.102 1.00 0.00 H new ATOM 835 N SER A 56 13.678 -1.569 -28.455 1.00 0.00 N ATOM 836 CA SER A 56 12.661 -1.489 -27.413 1.00 0.00 C ATOM 837 C SER A 56 11.437 -2.322 -27.782 1.00 0.00 C ATOM 838 O SER A 56 11.005 -2.333 -28.935 1.00 0.00 O ATOM 839 CB SER A 56 12.251 -0.033 -27.183 1.00 0.00 C ATOM 840 OG SER A 56 13.339 0.846 -27.411 1.00 0.00 O ATOM 0 H SER A 56 13.412 -1.133 -29.338 1.00 0.00 H new ATOM 0 HA SER A 56 13.086 -1.889 -26.493 1.00 0.00 H new ATOM 0 HB2 SER A 56 11.426 0.225 -27.847 1.00 0.00 H new ATOM 0 HB3 SER A 56 11.889 0.089 -26.162 1.00 0.00 H new ATOM 0 HG SER A 56 13.020 1.647 -27.878 1.00 0.00 H new ATOM 846 N SER A 57 10.884 -3.018 -26.795 1.00 0.00 N ATOM 847 CA SER A 57 9.712 -3.858 -27.016 1.00 0.00 C ATOM 848 C SER A 57 8.431 -3.033 -26.944 1.00 0.00 C ATOM 849 O SER A 57 7.401 -3.415 -27.500 1.00 0.00 O ATOM 850 CB SER A 57 9.665 -4.985 -25.983 1.00 0.00 C ATOM 851 OG SER A 57 10.554 -6.032 -26.329 1.00 0.00 O ATOM 0 H SER A 57 11.228 -3.017 -25.835 1.00 0.00 H new ATOM 0 HA SER A 57 9.789 -4.291 -28.013 1.00 0.00 H new ATOM 0 HB2 SER A 57 9.926 -4.593 -25.000 1.00 0.00 H new ATOM 0 HB3 SER A 57 8.650 -5.375 -25.912 1.00 0.00 H new ATOM 0 HG SER A 57 10.506 -6.739 -25.652 1.00 0.00 H new ATOM 857 N ARG A 58 8.503 -1.899 -26.254 1.00 0.00 N ATOM 858 CA ARG A 58 7.350 -1.019 -26.107 1.00 0.00 C ATOM 859 C ARG A 58 7.126 -0.200 -27.375 1.00 0.00 C ATOM 860 O ARG A 58 5.992 0.134 -27.717 1.00 0.00 O ATOM 861 CB ARG A 58 7.542 -0.086 -24.911 1.00 0.00 C ATOM 862 CG ARG A 58 8.838 0.707 -24.960 1.00 0.00 C ATOM 863 CD ARG A 58 8.923 1.708 -23.818 1.00 0.00 C ATOM 864 NE ARG A 58 8.183 2.933 -24.108 1.00 0.00 N ATOM 865 CZ ARG A 58 8.196 4.003 -23.321 1.00 0.00 C ATOM 866 NH1 ARG A 58 8.907 3.999 -22.202 1.00 0.00 N ATOM 867 NH2 ARG A 58 7.497 5.081 -23.654 1.00 0.00 N ATOM 0 H ARG A 58 9.348 -1.568 -25.788 1.00 0.00 H new ATOM 0 HA ARG A 58 6.471 -1.640 -25.936 1.00 0.00 H new ATOM 0 HB2 ARG A 58 6.703 0.608 -24.864 1.00 0.00 H new ATOM 0 HB3 ARG A 58 7.521 -0.675 -23.994 1.00 0.00 H new ATOM 0 HG2 ARG A 58 9.686 0.024 -24.910 1.00 0.00 H new ATOM 0 HG3 ARG A 58 8.908 1.233 -25.912 1.00 0.00 H new ATOM 0 HD2 ARG A 58 8.530 1.254 -22.908 1.00 0.00 H new ATOM 0 HD3 ARG A 58 9.968 1.952 -23.627 1.00 0.00 H new ATOM 0 HE ARG A 58 7.626 2.969 -24.962 1.00 0.00 H new ATOM 0 HH11 ARG A 58 9.446 3.173 -21.943 1.00 0.00 H new ATOM 0 HH12 ARG A 58 8.915 4.822 -21.600 1.00 0.00 H new ATOM 0 HH21 ARG A 58 6.949 5.088 -24.515 1.00 0.00 H new ATOM 0 HH22 ARG A 58 7.507 5.902 -23.049 1.00 0.00 H new ATOM 881 N GLU A 59 8.216 0.120 -28.066 1.00 0.00 N ATOM 882 CA GLU A 59 8.138 0.902 -29.295 1.00 0.00 C ATOM 883 C GLU A 59 7.132 0.290 -30.266 1.00 0.00 C ATOM 884 O GLU A 59 6.452 1.003 -31.004 1.00 0.00 O ATOM 885 CB GLU A 59 9.514 0.990 -29.957 1.00 0.00 C ATOM 886 CG GLU A 59 9.635 2.126 -30.959 1.00 0.00 C ATOM 887 CD GLU A 59 10.818 1.956 -31.893 1.00 0.00 C ATOM 888 OE1 GLU A 59 10.844 0.959 -32.643 1.00 0.00 O ATOM 889 OE2 GLU A 59 11.717 2.823 -31.874 1.00 0.00 O ATOM 0 H GLU A 59 9.162 -0.150 -27.796 1.00 0.00 H new ATOM 0 HA GLU A 59 7.802 1.906 -29.036 1.00 0.00 H new ATOM 0 HB2 GLU A 59 10.272 1.116 -29.184 1.00 0.00 H new ATOM 0 HB3 GLU A 59 9.726 0.047 -30.462 1.00 0.00 H new ATOM 0 HG2 GLU A 59 8.719 2.187 -31.546 1.00 0.00 H new ATOM 0 HG3 GLU A 59 9.733 3.070 -30.423 1.00 0.00 H new ATOM 896 N ARG A 60 7.044 -1.036 -30.260 1.00 0.00 N ATOM 897 CA ARG A 60 6.123 -1.745 -31.140 1.00 0.00 C ATOM 898 C ARG A 60 4.911 -2.253 -30.365 1.00 0.00 C ATOM 899 O ARG A 60 3.914 -2.668 -30.954 1.00 0.00 O ATOM 900 CB ARG A 60 6.834 -2.917 -31.820 1.00 0.00 C ATOM 901 CG ARG A 60 7.346 -3.966 -30.847 1.00 0.00 C ATOM 902 CD ARG A 60 8.333 -4.911 -31.515 1.00 0.00 C ATOM 903 NE ARG A 60 7.658 -5.963 -32.269 1.00 0.00 N ATOM 904 CZ ARG A 60 8.265 -6.726 -33.172 1.00 0.00 C ATOM 905 NH1 ARG A 60 9.554 -6.553 -33.431 1.00 0.00 N ATOM 906 NH2 ARG A 60 7.583 -7.663 -33.818 1.00 0.00 N ATOM 0 H ARG A 60 7.599 -1.641 -29.655 1.00 0.00 H new ATOM 0 HA ARG A 60 5.778 -1.046 -31.902 1.00 0.00 H new ATOM 0 HB2 ARG A 60 6.147 -3.390 -32.522 1.00 0.00 H new ATOM 0 HB3 ARG A 60 7.672 -2.534 -32.402 1.00 0.00 H new ATOM 0 HG2 ARG A 60 7.826 -3.475 -30.001 1.00 0.00 H new ATOM 0 HG3 ARG A 60 6.506 -4.536 -30.450 1.00 0.00 H new ATOM 0 HD2 ARG A 60 8.981 -4.345 -32.184 1.00 0.00 H new ATOM 0 HD3 ARG A 60 8.973 -5.362 -30.757 1.00 0.00 H new ATOM 0 HE ARG A 60 6.666 -6.121 -32.093 1.00 0.00 H new ATOM 0 HH11 ARG A 60 10.081 -5.833 -32.937 1.00 0.00 H new ATOM 0 HH12 ARG A 60 10.018 -7.140 -34.124 1.00 0.00 H new ATOM 0 HH21 ARG A 60 6.591 -7.799 -33.622 1.00 0.00 H new ATOM 0 HH22 ARG A 60 8.050 -8.248 -34.511 1.00 0.00 H new ATOM 920 N ASN A 61 5.005 -2.216 -29.040 1.00 0.00 N ATOM 921 CA ASN A 61 3.917 -2.673 -28.183 1.00 0.00 C ATOM 922 C ASN A 61 3.659 -4.164 -28.381 1.00 0.00 C ATOM 923 O ASN A 61 2.520 -4.586 -28.583 1.00 0.00 O ATOM 924 CB ASN A 61 2.642 -1.880 -28.477 1.00 0.00 C ATOM 925 CG ASN A 61 2.916 -0.405 -28.696 1.00 0.00 C ATOM 926 OD1 ASN A 61 3.330 0.304 -27.779 1.00 0.00 O ATOM 927 ND2 ASN A 61 2.685 0.064 -29.917 1.00 0.00 N ATOM 0 H ASN A 61 5.823 -1.874 -28.536 1.00 0.00 H new ATOM 0 HA ASN A 61 4.209 -2.507 -27.146 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.157 -2.292 -29.362 1.00 0.00 H new ATOM 0 HB3 ASN A 61 1.945 -1.998 -27.648 1.00 0.00 H new ATOM 0 HD21 ASN A 61 2.851 1.049 -30.125 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.342 -0.561 -30.647 1.00 0.00 H new ATOM 934 N VAL A 62 4.724 -4.957 -28.320 1.00 0.00 N ATOM 935 CA VAL A 62 4.613 -6.400 -28.491 1.00 0.00 C ATOM 936 C VAL A 62 5.555 -7.139 -27.546 1.00 0.00 C ATOM 937 O VAL A 62 6.732 -6.803 -27.415 1.00 0.00 O ATOM 938 CB VAL A 62 4.925 -6.820 -29.940 1.00 0.00 C ATOM 939 CG1 VAL A 62 4.787 -8.326 -30.101 1.00 0.00 C ATOM 940 CG2 VAL A 62 4.015 -6.086 -30.913 1.00 0.00 C ATOM 0 H VAL A 62 5.674 -4.624 -28.153 1.00 0.00 H new ATOM 0 HA VAL A 62 3.583 -6.668 -28.257 1.00 0.00 H new ATOM 0 HB VAL A 62 5.956 -6.548 -30.166 1.00 0.00 H new ATOM 0 HG11 VAL A 62 5.011 -8.604 -31.131 1.00 0.00 H new ATOM 0 HG12 VAL A 62 5.483 -8.829 -29.430 1.00 0.00 H new ATOM 0 HG13 VAL A 62 3.768 -8.626 -29.858 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.248 -6.394 -31.932 1.00 0.00 H new ATOM 0 HG22 VAL A 62 2.975 -6.326 -30.690 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.168 -5.011 -30.815 1.00 0.00 H new ATOM 950 N PRO A 63 5.026 -8.170 -26.871 1.00 0.00 N ATOM 951 CA PRO A 63 5.802 -8.979 -25.926 1.00 0.00 C ATOM 952 C PRO A 63 6.845 -9.845 -26.625 1.00 0.00 C ATOM 953 O PRO A 63 6.608 -10.358 -27.719 1.00 0.00 O ATOM 954 CB PRO A 63 4.742 -9.856 -25.256 1.00 0.00 C ATOM 955 CG PRO A 63 3.637 -9.943 -26.251 1.00 0.00 C ATOM 956 CD PRO A 63 3.630 -8.626 -26.977 1.00 0.00 C ATOM 0 HA PRO A 63 6.367 -8.361 -25.228 1.00 0.00 H new ATOM 0 HB2 PRO A 63 5.138 -10.843 -25.017 1.00 0.00 H new ATOM 0 HB3 PRO A 63 4.398 -9.416 -24.320 1.00 0.00 H new ATOM 0 HG2 PRO A 63 3.799 -10.769 -26.943 1.00 0.00 H new ATOM 0 HG3 PRO A 63 2.681 -10.122 -25.758 1.00 0.00 H new ATOM 0 HD2 PRO A 63 3.323 -8.742 -28.016 1.00 0.00 H new ATOM 0 HD3 PRO A 63 2.940 -7.918 -26.518 1.00 0.00 H new ATOM 964 N PHE A 64 8.000 -10.003 -25.987 1.00 0.00 N ATOM 965 CA PHE A 64 9.080 -10.806 -26.548 1.00 0.00 C ATOM 966 C PHE A 64 9.211 -12.134 -25.808 1.00 0.00 C ATOM 967 O PHE A 64 9.311 -12.168 -24.582 1.00 0.00 O ATOM 968 CB PHE A 64 10.402 -10.039 -26.481 1.00 0.00 C ATOM 969 CG PHE A 64 11.141 -10.002 -27.789 1.00 0.00 C ATOM 970 CD1 PHE A 64 10.519 -9.541 -28.938 1.00 0.00 C ATOM 971 CD2 PHE A 64 12.456 -10.429 -27.869 1.00 0.00 C ATOM 972 CE1 PHE A 64 11.196 -9.505 -30.143 1.00 0.00 C ATOM 973 CE2 PHE A 64 13.138 -10.396 -29.071 1.00 0.00 C ATOM 974 CZ PHE A 64 12.507 -9.934 -30.209 1.00 0.00 C ATOM 0 H PHE A 64 8.212 -9.585 -25.081 1.00 0.00 H new ATOM 0 HA PHE A 64 8.841 -11.014 -27.591 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.204 -9.018 -26.156 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.040 -10.496 -25.725 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.493 -9.206 -28.892 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.954 -10.792 -26.982 1.00 0.00 H new ATOM 0 HE1 PHE A 64 10.700 -9.142 -31.031 1.00 0.00 H new ATOM 0 HE2 PHE A 64 14.163 -10.731 -29.120 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.038 -9.908 -31.149 1.00 0.00 H new ATOM 984 N LYS A 65 9.209 -13.227 -26.563 1.00 0.00 N ATOM 985 CA LYS A 65 9.329 -14.559 -25.982 1.00 0.00 C ATOM 986 C LYS A 65 10.715 -15.143 -26.238 1.00 0.00 C ATOM 987 O LYS A 65 11.268 -14.999 -27.328 1.00 0.00 O ATOM 988 CB LYS A 65 8.258 -15.488 -26.559 1.00 0.00 C ATOM 989 CG LYS A 65 8.396 -15.720 -28.054 1.00 0.00 C ATOM 990 CD LYS A 65 8.677 -17.180 -28.368 1.00 0.00 C ATOM 991 CE LYS A 65 9.561 -17.325 -29.597 1.00 0.00 C ATOM 992 NZ LYS A 65 8.807 -17.868 -30.761 1.00 0.00 N ATOM 0 H LYS A 65 9.126 -13.217 -27.580 1.00 0.00 H new ATOM 0 HA LYS A 65 9.185 -14.472 -24.905 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.306 -16.448 -26.045 1.00 0.00 H new ATOM 0 HB3 LYS A 65 7.274 -15.066 -26.355 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.481 -15.408 -28.558 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.203 -15.101 -28.446 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.161 -17.651 -27.512 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.736 -17.706 -28.531 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.982 -16.354 -29.858 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.398 -17.984 -29.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.444 -17.952 -31.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.426 -18.806 -30.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.024 -17.226 -30.997 1.00 0.00 H new ATOM 1006 N PHE A 66 11.270 -15.803 -25.227 1.00 0.00 N ATOM 1007 CA PHE A 66 12.591 -16.408 -25.343 1.00 0.00 C ATOM 1008 C PHE A 66 12.767 -17.531 -24.324 1.00 0.00 C ATOM 1009 O PHE A 66 11.895 -17.766 -23.487 1.00 0.00 O ATOM 1010 CB PHE A 66 13.680 -15.351 -25.147 1.00 0.00 C ATOM 1011 CG PHE A 66 13.868 -14.944 -23.713 1.00 0.00 C ATOM 1012 CD1 PHE A 66 12.841 -14.334 -23.012 1.00 0.00 C ATOM 1013 CD2 PHE A 66 15.073 -15.173 -23.067 1.00 0.00 C ATOM 1014 CE1 PHE A 66 13.013 -13.958 -21.693 1.00 0.00 C ATOM 1015 CE2 PHE A 66 15.250 -14.800 -21.748 1.00 0.00 C ATOM 1016 CZ PHE A 66 14.218 -14.192 -21.060 1.00 0.00 C ATOM 0 H PHE A 66 10.825 -15.932 -24.318 1.00 0.00 H new ATOM 0 HA PHE A 66 12.682 -16.831 -26.343 1.00 0.00 H new ATOM 0 HB2 PHE A 66 14.623 -15.736 -25.534 1.00 0.00 H new ATOM 0 HB3 PHE A 66 13.430 -14.469 -25.737 1.00 0.00 H new ATOM 0 HD1 PHE A 66 11.896 -14.150 -23.501 1.00 0.00 H new ATOM 0 HD2 PHE A 66 15.883 -15.648 -23.601 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.205 -13.481 -21.158 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.194 -14.984 -21.256 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.353 -13.900 -20.029 1.00 0.00 H new ATOM 1026 N HIS A 67 13.901 -18.220 -24.402 1.00 0.00 N ATOM 1027 CA HIS A 67 14.192 -19.318 -23.487 1.00 0.00 C ATOM 1028 C HIS A 67 15.284 -18.926 -22.497 1.00 0.00 C ATOM 1029 O HIS A 67 16.445 -18.755 -22.873 1.00 0.00 O ATOM 1030 CB HIS A 67 14.618 -20.562 -24.268 1.00 0.00 C ATOM 1031 CG HIS A 67 13.504 -21.193 -25.045 1.00 0.00 C ATOM 1032 ND1 HIS A 67 12.928 -22.396 -24.693 1.00 0.00 N ATOM 1033 CD2 HIS A 67 12.857 -20.780 -26.160 1.00 0.00 C ATOM 1034 CE1 HIS A 67 11.978 -22.696 -25.560 1.00 0.00 C ATOM 1035 NE2 HIS A 67 11.914 -21.732 -26.460 1.00 0.00 N ATOM 0 H HIS A 67 14.633 -18.038 -25.089 1.00 0.00 H new ATOM 0 HA HIS A 67 13.283 -19.542 -22.928 1.00 0.00 H new ATOM 0 HB2 HIS A 67 15.421 -20.293 -24.954 1.00 0.00 H new ATOM 0 HB3 HIS A 67 15.026 -21.296 -23.572 1.00 0.00 H new ATOM 0 HD2 HIS A 67 13.047 -19.871 -26.711 1.00 0.00 H new ATOM 0 HE1 HIS A 67 11.358 -23.580 -25.537 1.00 0.00 H new ATOM 0 HE2 HIS A 67 11.269 -21.700 -27.250 1.00 0.00 H new ATOM 1043 N LEU A 68 14.905 -18.782 -21.232 1.00 0.00 N ATOM 1044 CA LEU A 68 15.852 -18.409 -20.187 1.00 0.00 C ATOM 1045 C LEU A 68 16.718 -19.598 -19.786 1.00 0.00 C ATOM 1046 O LEU A 68 16.228 -20.718 -19.649 1.00 0.00 O ATOM 1047 CB LEU A 68 15.107 -17.871 -18.964 1.00 0.00 C ATOM 1048 CG LEU A 68 15.867 -17.924 -17.638 1.00 0.00 C ATOM 1049 CD1 LEU A 68 17.137 -17.091 -17.717 1.00 0.00 C ATOM 1050 CD2 LEU A 68 14.982 -17.444 -16.497 1.00 0.00 C ATOM 0 H LEU A 68 13.948 -18.918 -20.905 1.00 0.00 H new ATOM 0 HA LEU A 68 16.501 -17.628 -20.582 1.00 0.00 H new ATOM 0 HB2 LEU A 68 14.829 -16.835 -19.159 1.00 0.00 H new ATOM 0 HB3 LEU A 68 14.180 -18.434 -18.851 1.00 0.00 H new ATOM 0 HG LEU A 68 16.148 -18.959 -17.443 1.00 0.00 H new ATOM 0 HD11 LEU A 68 17.665 -17.141 -16.764 1.00 0.00 H new ATOM 0 HD12 LEU A 68 17.779 -17.480 -18.508 1.00 0.00 H new ATOM 0 HD13 LEU A 68 16.879 -16.055 -17.935 1.00 0.00 H new ATOM 0 HD21 LEU A 68 15.539 -17.488 -15.561 1.00 0.00 H new ATOM 0 HD22 LEU A 68 14.671 -16.417 -16.686 1.00 0.00 H new ATOM 0 HD23 LEU A 68 14.102 -18.083 -16.426 1.00 0.00 H new ATOM 1062 N GLY A 69 18.011 -19.347 -19.598 1.00 0.00 N ATOM 1063 CA GLY A 69 18.924 -20.406 -19.213 1.00 0.00 C ATOM 1064 C GLY A 69 19.832 -20.831 -20.350 1.00 0.00 C ATOM 1065 O GLY A 69 20.411 -21.917 -20.317 1.00 0.00 O ATOM 0 H GLY A 69 18.441 -18.429 -19.706 1.00 0.00 H new ATOM 0 HA2 GLY A 69 19.532 -20.070 -18.373 1.00 0.00 H new ATOM 0 HA3 GLY A 69 18.352 -21.267 -18.868 1.00 0.00 H new ATOM 1069 N GLN A 70 19.955 -19.975 -21.358 1.00 0.00 N ATOM 1070 CA GLN A 70 20.797 -20.269 -22.512 1.00 0.00 C ATOM 1071 C GLN A 70 21.772 -19.127 -22.780 1.00 0.00 C ATOM 1072 O GLN A 70 21.630 -18.035 -22.232 1.00 0.00 O ATOM 1073 CB GLN A 70 19.934 -20.520 -23.749 1.00 0.00 C ATOM 1074 CG GLN A 70 18.831 -21.541 -23.525 1.00 0.00 C ATOM 1075 CD GLN A 70 18.374 -22.199 -24.812 1.00 0.00 C ATOM 1076 OE1 GLN A 70 19.113 -22.246 -25.795 1.00 0.00 O ATOM 1077 NE2 GLN A 70 17.150 -22.713 -24.812 1.00 0.00 N ATOM 0 H GLN A 70 19.483 -19.072 -21.400 1.00 0.00 H new ATOM 0 HA GLN A 70 21.372 -21.168 -22.291 1.00 0.00 H new ATOM 0 HB2 GLN A 70 19.487 -19.578 -24.067 1.00 0.00 H new ATOM 0 HB3 GLN A 70 20.573 -20.860 -24.564 1.00 0.00 H new ATOM 0 HG2 GLN A 70 19.185 -22.307 -22.836 1.00 0.00 H new ATOM 0 HG3 GLN A 70 17.980 -21.053 -23.049 1.00 0.00 H new ATOM 0 HE21 GLN A 70 16.571 -22.652 -23.974 1.00 0.00 H new ATOM 0 HE22 GLN A 70 16.788 -23.169 -25.650 1.00 0.00 H new ATOM 1086 N GLY A 71 22.763 -19.388 -23.627 1.00 0.00 N ATOM 1087 CA GLY A 71 23.747 -18.372 -23.953 1.00 0.00 C ATOM 1088 C GLY A 71 23.207 -17.326 -24.907 1.00 0.00 C ATOM 1089 O GLY A 71 23.894 -16.358 -25.230 1.00 0.00 O ATOM 0 H GLY A 71 22.902 -20.285 -24.093 1.00 0.00 H new ATOM 0 HA2 GLY A 71 24.080 -17.886 -23.036 1.00 0.00 H new ATOM 0 HA3 GLY A 71 24.622 -18.847 -24.397 1.00 0.00 H new ATOM 1093 N GLU A 72 21.972 -17.521 -25.359 1.00 0.00 N ATOM 1094 CA GLU A 72 21.342 -16.587 -26.285 1.00 0.00 C ATOM 1095 C GLU A 72 21.426 -15.158 -25.757 1.00 0.00 C ATOM 1096 O GLU A 72 21.485 -14.201 -26.529 1.00 0.00 O ATOM 1097 CB GLU A 72 19.879 -16.972 -26.515 1.00 0.00 C ATOM 1098 CG GLU A 72 19.690 -18.037 -27.583 1.00 0.00 C ATOM 1099 CD GLU A 72 19.626 -17.455 -28.982 1.00 0.00 C ATOM 1100 OE1 GLU A 72 20.505 -16.638 -29.326 1.00 0.00 O ATOM 1101 OE2 GLU A 72 18.696 -17.818 -29.732 1.00 0.00 O ATOM 0 H GLU A 72 21.389 -18.316 -25.099 1.00 0.00 H new ATOM 0 HA GLU A 72 21.877 -16.638 -27.233 1.00 0.00 H new ATOM 0 HB2 GLU A 72 19.455 -17.331 -25.577 1.00 0.00 H new ATOM 0 HB3 GLU A 72 19.318 -16.081 -26.799 1.00 0.00 H new ATOM 0 HG2 GLU A 72 20.511 -18.751 -27.528 1.00 0.00 H new ATOM 0 HG3 GLU A 72 18.773 -18.590 -27.381 1.00 0.00 H new ATOM 1108 N VAL A 73 21.430 -15.021 -24.435 1.00 0.00 N ATOM 1109 CA VAL A 73 21.508 -13.710 -23.802 1.00 0.00 C ATOM 1110 C VAL A 73 22.748 -13.596 -22.923 1.00 0.00 C ATOM 1111 O VAL A 73 23.293 -14.602 -22.468 1.00 0.00 O ATOM 1112 CB VAL A 73 20.259 -13.424 -22.947 1.00 0.00 C ATOM 1113 CG1 VAL A 73 19.067 -13.099 -23.834 1.00 0.00 C ATOM 1114 CG2 VAL A 73 19.952 -14.607 -22.041 1.00 0.00 C ATOM 0 H VAL A 73 21.380 -15.802 -23.781 1.00 0.00 H new ATOM 0 HA VAL A 73 21.566 -12.975 -24.605 1.00 0.00 H new ATOM 0 HB VAL A 73 20.461 -12.556 -22.319 1.00 0.00 H new ATOM 0 HG11 VAL A 73 18.194 -12.900 -23.212 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.291 -12.219 -24.437 1.00 0.00 H new ATOM 0 HG13 VAL A 73 18.860 -13.945 -24.490 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.067 -14.388 -21.444 1.00 0.00 H new ATOM 0 HG22 VAL A 73 19.770 -15.493 -22.649 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.799 -14.789 -21.380 1.00 0.00 H new ATOM 1124 N ILE A 74 23.189 -12.364 -22.689 1.00 0.00 N ATOM 1125 CA ILE A 74 24.365 -12.119 -21.863 1.00 0.00 C ATOM 1126 C ILE A 74 24.066 -12.377 -20.390 1.00 0.00 C ATOM 1127 O ILE A 74 22.906 -12.438 -19.982 1.00 0.00 O ATOM 1128 CB ILE A 74 24.877 -10.676 -22.026 1.00 0.00 C ATOM 1129 CG1 ILE A 74 23.779 -9.677 -21.652 1.00 0.00 C ATOM 1130 CG2 ILE A 74 25.351 -10.440 -23.453 1.00 0.00 C ATOM 1131 CD1 ILE A 74 24.284 -8.262 -21.478 1.00 0.00 C ATOM 0 H ILE A 74 22.750 -11.521 -23.059 1.00 0.00 H new ATOM 0 HA ILE A 74 25.137 -12.810 -22.201 1.00 0.00 H new ATOM 0 HB ILE A 74 25.722 -10.528 -21.354 1.00 0.00 H new ATOM 0 HG12 ILE A 74 23.011 -9.688 -22.425 1.00 0.00 H new ATOM 0 HG13 ILE A 74 23.304 -10.001 -20.726 1.00 0.00 H new ATOM 0 HG21 ILE A 74 25.710 -9.416 -23.552 1.00 0.00 H new ATOM 0 HG22 ILE A 74 26.160 -11.132 -23.687 1.00 0.00 H new ATOM 0 HG23 ILE A 74 24.523 -10.603 -24.143 1.00 0.00 H new ATOM 0 HD11 ILE A 74 23.452 -7.609 -21.214 1.00 0.00 H new ATOM 0 HD12 ILE A 74 25.031 -8.237 -20.685 1.00 0.00 H new ATOM 0 HD13 ILE A 74 24.733 -7.919 -22.410 1.00 0.00 H new ATOM 1143 N LYS A 75 25.120 -12.525 -19.595 1.00 0.00 N ATOM 1144 CA LYS A 75 24.973 -12.773 -18.166 1.00 0.00 C ATOM 1145 C LYS A 75 24.081 -11.717 -17.520 1.00 0.00 C ATOM 1146 O LYS A 75 23.423 -11.978 -16.514 1.00 0.00 O ATOM 1147 CB LYS A 75 26.343 -12.784 -17.485 1.00 0.00 C ATOM 1148 CG LYS A 75 26.689 -14.113 -16.835 1.00 0.00 C ATOM 1149 CD LYS A 75 27.998 -14.670 -17.368 1.00 0.00 C ATOM 1150 CE LYS A 75 28.200 -16.118 -16.946 1.00 0.00 C ATOM 1151 NZ LYS A 75 28.394 -16.244 -15.475 1.00 0.00 N ATOM 0 H LYS A 75 26.087 -12.477 -19.917 1.00 0.00 H new ATOM 0 HA LYS A 75 24.503 -13.748 -18.039 1.00 0.00 H new ATOM 0 HB2 LYS A 75 27.108 -12.540 -18.222 1.00 0.00 H new ATOM 0 HB3 LYS A 75 26.369 -12.001 -16.727 1.00 0.00 H new ATOM 0 HG2 LYS A 75 26.761 -13.983 -15.755 1.00 0.00 H new ATOM 0 HG3 LYS A 75 25.887 -14.828 -17.018 1.00 0.00 H new ATOM 0 HD2 LYS A 75 28.008 -14.602 -18.456 1.00 0.00 H new ATOM 0 HD3 LYS A 75 28.828 -14.064 -17.004 1.00 0.00 H new ATOM 0 HE2 LYS A 75 27.336 -16.709 -17.251 1.00 0.00 H new ATOM 0 HE3 LYS A 75 29.067 -16.530 -17.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 28.528 -17.245 -15.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 29.233 -15.701 -15.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 27.556 -15.874 -14.981 1.00 0.00 H new ATOM 1165 N GLY A 76 24.063 -10.524 -18.107 1.00 0.00 N ATOM 1166 CA GLY A 76 23.248 -9.448 -17.575 1.00 0.00 C ATOM 1167 C GLY A 76 21.772 -9.790 -17.563 1.00 0.00 C ATOM 1168 O GLY A 76 21.108 -9.668 -16.534 1.00 0.00 O ATOM 0 H GLY A 76 24.598 -10.284 -18.941 1.00 0.00 H new ATOM 0 HA2 GLY A 76 23.573 -9.218 -16.560 1.00 0.00 H new ATOM 0 HA3 GLY A 76 23.405 -8.549 -18.171 1.00 0.00 H new ATOM 1172 N TRP A 77 21.256 -10.219 -18.710 1.00 0.00 N ATOM 1173 CA TRP A 77 19.848 -10.578 -18.827 1.00 0.00 C ATOM 1174 C TRP A 77 19.555 -11.880 -18.089 1.00 0.00 C ATOM 1175 O TRP A 77 18.500 -12.030 -17.471 1.00 0.00 O ATOM 1176 CB TRP A 77 19.456 -10.713 -20.299 1.00 0.00 C ATOM 1177 CG TRP A 77 20.031 -9.637 -21.169 1.00 0.00 C ATOM 1178 CD1 TRP A 77 20.464 -9.767 -22.457 1.00 0.00 C ATOM 1179 CD2 TRP A 77 20.238 -8.266 -20.811 1.00 0.00 C ATOM 1180 NE1 TRP A 77 20.927 -8.560 -22.922 1.00 0.00 N ATOM 1181 CE2 TRP A 77 20.798 -7.623 -21.932 1.00 0.00 C ATOM 1182 CE3 TRP A 77 20.002 -7.518 -19.654 1.00 0.00 C ATOM 1183 CZ2 TRP A 77 21.127 -6.270 -21.926 1.00 0.00 C ATOM 1184 CZ3 TRP A 77 20.328 -6.176 -19.650 1.00 0.00 C ATOM 1185 CH2 TRP A 77 20.885 -5.562 -20.780 1.00 0.00 C ATOM 0 H TRP A 77 21.792 -10.326 -19.571 1.00 0.00 H new ATOM 0 HA TRP A 77 19.257 -9.783 -18.372 1.00 0.00 H new ATOM 0 HB2 TRP A 77 19.787 -11.684 -20.668 1.00 0.00 H new ATOM 0 HB3 TRP A 77 18.369 -10.694 -20.381 1.00 0.00 H new ATOM 0 HD1 TRP A 77 20.445 -10.684 -23.027 1.00 0.00 H new ATOM 0 HE1 TRP A 77 21.305 -8.390 -23.854 1.00 0.00 H new ATOM 0 HE3 TRP A 77 19.572 -7.982 -18.778 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 21.558 -5.796 -22.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 20.151 -5.590 -18.761 1.00 0.00 H new ATOM 0 HH2 TRP A 77 21.128 -4.510 -20.746 1.00 0.00 H new ATOM 1196 N ASP A 78 20.493 -12.817 -18.157 1.00 0.00 N ATOM 1197 CA ASP A 78 20.335 -14.106 -17.493 1.00 0.00 C ATOM 1198 C ASP A 78 20.253 -13.932 -15.980 1.00 0.00 C ATOM 1199 O ASP A 78 19.378 -14.501 -15.326 1.00 0.00 O ATOM 1200 CB ASP A 78 21.498 -15.033 -17.849 1.00 0.00 C ATOM 1201 CG ASP A 78 21.405 -16.375 -17.149 1.00 0.00 C ATOM 1202 OD1 ASP A 78 20.453 -17.130 -17.437 1.00 0.00 O ATOM 1203 OD2 ASP A 78 22.285 -16.670 -16.314 1.00 0.00 O ATOM 0 H ASP A 78 21.371 -12.709 -18.665 1.00 0.00 H new ATOM 0 HA ASP A 78 19.404 -14.553 -17.840 1.00 0.00 H new ATOM 0 HB2 ASP A 78 21.517 -15.190 -18.928 1.00 0.00 H new ATOM 0 HB3 ASP A 78 22.438 -14.551 -17.581 1.00 0.00 H new ATOM 1208 N ILE A 79 21.170 -13.143 -15.430 1.00 0.00 N ATOM 1209 CA ILE A 79 21.201 -12.894 -13.994 1.00 0.00 C ATOM 1210 C ILE A 79 19.973 -12.108 -13.546 1.00 0.00 C ATOM 1211 O ILE A 79 19.319 -12.465 -12.565 1.00 0.00 O ATOM 1212 CB ILE A 79 22.468 -12.122 -13.583 1.00 0.00 C ATOM 1213 CG1 ILE A 79 23.713 -12.981 -13.816 1.00 0.00 C ATOM 1214 CG2 ILE A 79 22.379 -11.693 -12.126 1.00 0.00 C ATOM 1215 CD1 ILE A 79 24.983 -12.175 -13.976 1.00 0.00 C ATOM 0 H ILE A 79 21.901 -12.665 -15.957 1.00 0.00 H new ATOM 0 HA ILE A 79 21.205 -13.868 -13.505 1.00 0.00 H new ATOM 0 HB ILE A 79 22.546 -11.227 -14.200 1.00 0.00 H new ATOM 0 HG12 ILE A 79 23.832 -13.668 -12.979 1.00 0.00 H new ATOM 0 HG13 ILE A 79 23.563 -13.589 -14.708 1.00 0.00 H new ATOM 0 HG21 ILE A 79 23.282 -11.149 -11.851 1.00 0.00 H new ATOM 0 HG22 ILE A 79 21.511 -11.048 -11.989 1.00 0.00 H new ATOM 0 HG23 ILE A 79 22.280 -12.574 -11.493 1.00 0.00 H new ATOM 0 HD11 ILE A 79 25.824 -12.849 -14.138 1.00 0.00 H new ATOM 0 HD12 ILE A 79 24.884 -11.506 -14.831 1.00 0.00 H new ATOM 0 HD13 ILE A 79 25.157 -11.588 -13.074 1.00 0.00 H new ATOM 1227 N CYS A 80 19.665 -11.039 -14.271 1.00 0.00 N ATOM 1228 CA CYS A 80 18.514 -10.202 -13.949 1.00 0.00 C ATOM 1229 C CYS A 80 17.215 -10.990 -14.079 1.00 0.00 C ATOM 1230 O CYS A 80 16.421 -11.059 -13.141 1.00 0.00 O ATOM 1231 CB CYS A 80 18.476 -8.977 -14.864 1.00 0.00 C ATOM 1232 SG CYS A 80 19.789 -7.776 -14.544 1.00 0.00 S ATOM 0 H CYS A 80 20.196 -10.731 -15.086 1.00 0.00 H new ATOM 0 HA CYS A 80 18.614 -9.871 -12.915 1.00 0.00 H new ATOM 0 HB2 CYS A 80 18.546 -9.308 -15.900 1.00 0.00 H new ATOM 0 HB3 CYS A 80 17.511 -8.483 -14.752 1.00 0.00 H new ATOM 0 HG CYS A 80 20.836 -8.078 -15.254 1.00 0.00 H new ATOM 1238 N VAL A 81 17.005 -11.584 -15.250 1.00 0.00 N ATOM 1239 CA VAL A 81 15.802 -12.368 -15.504 1.00 0.00 C ATOM 1240 C VAL A 81 15.652 -13.491 -14.485 1.00 0.00 C ATOM 1241 O VAL A 81 14.543 -13.818 -14.064 1.00 0.00 O ATOM 1242 CB VAL A 81 15.815 -12.972 -16.921 1.00 0.00 C ATOM 1243 CG1 VAL A 81 14.702 -13.998 -17.074 1.00 0.00 C ATOM 1244 CG2 VAL A 81 15.690 -11.877 -17.969 1.00 0.00 C ATOM 0 H VAL A 81 17.652 -11.537 -16.037 1.00 0.00 H new ATOM 0 HA VAL A 81 14.956 -11.687 -15.415 1.00 0.00 H new ATOM 0 HB VAL A 81 16.768 -13.479 -17.072 1.00 0.00 H new ATOM 0 HG11 VAL A 81 14.727 -14.414 -18.081 1.00 0.00 H new ATOM 0 HG12 VAL A 81 14.842 -14.798 -16.347 1.00 0.00 H new ATOM 0 HG13 VAL A 81 13.738 -13.518 -16.903 1.00 0.00 H new ATOM 0 HG21 VAL A 81 15.701 -12.322 -18.964 1.00 0.00 H new ATOM 0 HG22 VAL A 81 14.754 -11.339 -17.823 1.00 0.00 H new ATOM 0 HG23 VAL A 81 16.526 -11.184 -17.873 1.00 0.00 H new ATOM 1254 N ALA A 82 16.777 -14.080 -14.092 1.00 0.00 N ATOM 1255 CA ALA A 82 16.772 -15.166 -13.120 1.00 0.00 C ATOM 1256 C ALA A 82 16.712 -14.627 -11.695 1.00 0.00 C ATOM 1257 O ALA A 82 16.786 -15.387 -10.730 1.00 0.00 O ATOM 1258 CB ALA A 82 18.001 -16.044 -13.303 1.00 0.00 C ATOM 0 H ALA A 82 17.704 -13.823 -14.432 1.00 0.00 H new ATOM 0 HA ALA A 82 15.880 -15.769 -13.290 1.00 0.00 H new ATOM 0 HB1 ALA A 82 17.984 -16.851 -12.570 1.00 0.00 H new ATOM 0 HB2 ALA A 82 18.000 -16.466 -14.308 1.00 0.00 H new ATOM 0 HB3 ALA A 82 18.901 -15.445 -13.162 1.00 0.00 H new ATOM 1264 N SER A 83 16.577 -13.310 -11.570 1.00 0.00 N ATOM 1265 CA SER A 83 16.511 -12.669 -10.262 1.00 0.00 C ATOM 1266 C SER A 83 15.309 -11.734 -10.175 1.00 0.00 C ATOM 1267 O SER A 83 15.256 -10.851 -9.320 1.00 0.00 O ATOM 1268 CB SER A 83 17.799 -11.889 -9.988 1.00 0.00 C ATOM 1269 OG SER A 83 17.801 -11.353 -8.677 1.00 0.00 O ATOM 0 H SER A 83 16.511 -12.667 -12.359 1.00 0.00 H new ATOM 0 HA SER A 83 16.398 -13.448 -9.508 1.00 0.00 H new ATOM 0 HB2 SER A 83 18.660 -12.545 -10.117 1.00 0.00 H new ATOM 0 HB3 SER A 83 17.901 -11.083 -10.714 1.00 0.00 H new ATOM 0 HG SER A 83 16.900 -11.042 -8.449 1.00 0.00 H new ATOM 1275 N MET A 84 14.344 -11.937 -11.067 1.00 0.00 N ATOM 1276 CA MET A 84 13.141 -11.113 -11.091 1.00 0.00 C ATOM 1277 C MET A 84 11.891 -11.973 -10.927 1.00 0.00 C ATOM 1278 O MET A 84 11.941 -13.194 -11.075 1.00 0.00 O ATOM 1279 CB MET A 84 13.063 -10.324 -12.399 1.00 0.00 C ATOM 1280 CG MET A 84 12.552 -11.142 -13.574 1.00 0.00 C ATOM 1281 SD MET A 84 12.533 -10.208 -15.116 1.00 0.00 S ATOM 1282 CE MET A 84 11.637 -8.741 -14.612 1.00 0.00 C ATOM 0 H MET A 84 14.372 -12.664 -11.782 1.00 0.00 H new ATOM 0 HA MET A 84 13.193 -10.414 -10.256 1.00 0.00 H new ATOM 0 HB2 MET A 84 12.410 -9.463 -12.256 1.00 0.00 H new ATOM 0 HB3 MET A 84 14.053 -9.937 -12.640 1.00 0.00 H new ATOM 0 HG2 MET A 84 13.179 -12.025 -13.697 1.00 0.00 H new ATOM 0 HG3 MET A 84 11.544 -11.495 -13.355 1.00 0.00 H new ATOM 0 HE1 MET A 84 11.220 -8.250 -15.491 1.00 0.00 H new ATOM 0 HE2 MET A 84 10.830 -9.022 -13.936 1.00 0.00 H new ATOM 0 HE3 MET A 84 12.316 -8.057 -14.102 1.00 0.00 H new ATOM 1292 N THR A 85 10.770 -11.327 -10.621 1.00 0.00 N ATOM 1293 CA THR A 85 9.508 -12.032 -10.436 1.00 0.00 C ATOM 1294 C THR A 85 8.474 -11.588 -11.464 1.00 0.00 C ATOM 1295 O THR A 85 8.666 -10.593 -12.164 1.00 0.00 O ATOM 1296 CB THR A 85 8.940 -11.804 -9.022 1.00 0.00 C ATOM 1297 OG1 THR A 85 8.981 -10.410 -8.696 1.00 0.00 O ATOM 1298 CG2 THR A 85 9.727 -12.596 -7.989 1.00 0.00 C ATOM 0 H THR A 85 10.711 -10.316 -10.496 1.00 0.00 H new ATOM 0 HA THR A 85 9.716 -13.094 -10.570 1.00 0.00 H new ATOM 0 HB THR A 85 7.906 -12.148 -9.010 1.00 0.00 H new ATOM 0 HG1 THR A 85 9.903 -10.148 -8.493 1.00 0.00 H new ATOM 0 HG21 THR A 85 9.308 -12.419 -6.998 1.00 0.00 H new ATOM 0 HG22 THR A 85 9.668 -13.659 -8.224 1.00 0.00 H new ATOM 0 HG23 THR A 85 10.770 -12.278 -8.004 1.00 0.00 H new ATOM 1306 N LYS A 86 7.377 -12.331 -11.552 1.00 0.00 N ATOM 1307 CA LYS A 86 6.310 -12.014 -12.494 1.00 0.00 C ATOM 1308 C LYS A 86 5.673 -10.668 -12.161 1.00 0.00 C ATOM 1309 O LYS A 86 5.520 -10.316 -10.993 1.00 0.00 O ATOM 1310 CB LYS A 86 5.244 -13.112 -12.478 1.00 0.00 C ATOM 1311 CG LYS A 86 4.320 -13.081 -13.683 1.00 0.00 C ATOM 1312 CD LYS A 86 3.887 -14.479 -14.090 1.00 0.00 C ATOM 1313 CE LYS A 86 2.533 -14.837 -13.497 1.00 0.00 C ATOM 1314 NZ LYS A 86 2.627 -15.135 -12.041 1.00 0.00 N ATOM 0 H LYS A 86 7.203 -13.158 -10.982 1.00 0.00 H new ATOM 0 HA LYS A 86 6.746 -11.954 -13.491 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.736 -14.084 -12.433 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.648 -13.014 -11.571 1.00 0.00 H new ATOM 0 HG2 LYS A 86 3.441 -12.479 -13.453 1.00 0.00 H new ATOM 0 HG3 LYS A 86 4.827 -12.598 -14.519 1.00 0.00 H new ATOM 0 HD2 LYS A 86 3.838 -14.544 -15.177 1.00 0.00 H new ATOM 0 HD3 LYS A 86 4.633 -15.203 -13.761 1.00 0.00 H new ATOM 0 HE2 LYS A 86 1.838 -14.012 -13.655 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.125 -15.702 -14.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 1.706 -15.472 -11.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 3.346 -15.869 -11.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 2.895 -14.272 -11.527 1.00 0.00 H new ATOM 1328 N ASN A 87 5.303 -9.922 -13.197 1.00 0.00 N ATOM 1329 CA ASN A 87 4.681 -8.616 -13.014 1.00 0.00 C ATOM 1330 C ASN A 87 5.607 -7.675 -12.249 1.00 0.00 C ATOM 1331 O ASN A 87 5.151 -6.753 -11.575 1.00 0.00 O ATOM 1332 CB ASN A 87 3.353 -8.760 -12.269 1.00 0.00 C ATOM 1333 CG ASN A 87 2.190 -9.023 -13.206 1.00 0.00 C ATOM 1334 OD1 ASN A 87 2.033 -8.349 -14.224 1.00 0.00 O ATOM 1335 ND2 ASN A 87 1.367 -10.009 -12.865 1.00 0.00 N ATOM 0 H ASN A 87 5.423 -10.199 -14.171 1.00 0.00 H new ATOM 0 HA ASN A 87 4.492 -8.190 -13.999 1.00 0.00 H new ATOM 0 HB2 ASN A 87 3.429 -9.576 -11.551 1.00 0.00 H new ATOM 0 HB3 ASN A 87 3.159 -7.851 -11.699 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.567 -10.233 -13.457 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.536 -10.542 -12.012 1.00 0.00 H new ATOM 1342 N GLU A 88 6.910 -7.916 -12.361 1.00 0.00 N ATOM 1343 CA GLU A 88 7.900 -7.090 -11.679 1.00 0.00 C ATOM 1344 C GLU A 88 8.602 -6.159 -12.663 1.00 0.00 C ATOM 1345 O GLU A 88 9.282 -6.610 -13.585 1.00 0.00 O ATOM 1346 CB GLU A 88 8.929 -7.971 -10.969 1.00 0.00 C ATOM 1347 CG GLU A 88 9.912 -7.189 -10.112 1.00 0.00 C ATOM 1348 CD GLU A 88 9.930 -7.657 -8.670 1.00 0.00 C ATOM 1349 OE1 GLU A 88 9.060 -7.215 -7.892 1.00 0.00 O ATOM 1350 OE2 GLU A 88 10.814 -8.467 -8.321 1.00 0.00 O ATOM 0 H GLU A 88 7.304 -8.675 -12.917 1.00 0.00 H new ATOM 0 HA GLU A 88 7.381 -6.482 -10.938 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.406 -8.692 -10.341 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.483 -8.541 -11.715 1.00 0.00 H new ATOM 0 HG2 GLU A 88 10.912 -7.285 -10.534 1.00 0.00 H new ATOM 0 HG3 GLU A 88 9.653 -6.131 -10.143 1.00 0.00 H new ATOM 1357 N LYS A 89 8.434 -4.857 -12.460 1.00 0.00 N ATOM 1358 CA LYS A 89 9.051 -3.861 -13.328 1.00 0.00 C ATOM 1359 C LYS A 89 10.284 -3.253 -12.667 1.00 0.00 C ATOM 1360 O LYS A 89 10.173 -2.499 -11.699 1.00 0.00 O ATOM 1361 CB LYS A 89 8.046 -2.758 -13.668 1.00 0.00 C ATOM 1362 CG LYS A 89 8.376 -2.007 -14.946 1.00 0.00 C ATOM 1363 CD LYS A 89 7.349 -0.927 -15.240 1.00 0.00 C ATOM 1364 CE LYS A 89 7.892 0.108 -16.214 1.00 0.00 C ATOM 1365 NZ LYS A 89 6.853 1.103 -16.601 1.00 0.00 N ATOM 0 H LYS A 89 7.875 -4.466 -11.701 1.00 0.00 H new ATOM 0 HA LYS A 89 9.360 -4.358 -14.247 1.00 0.00 H new ATOM 0 HB2 LYS A 89 7.053 -3.199 -13.762 1.00 0.00 H new ATOM 0 HB3 LYS A 89 8.003 -2.049 -12.841 1.00 0.00 H new ATOM 0 HG2 LYS A 89 9.365 -1.556 -14.859 1.00 0.00 H new ATOM 0 HG3 LYS A 89 8.417 -2.707 -15.780 1.00 0.00 H new ATOM 0 HD2 LYS A 89 6.450 -1.382 -15.655 1.00 0.00 H new ATOM 0 HD3 LYS A 89 7.059 -0.437 -14.311 1.00 0.00 H new ATOM 0 HE2 LYS A 89 8.739 0.624 -15.761 1.00 0.00 H new ATOM 0 HE3 LYS A 89 8.265 -0.394 -17.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 7.262 1.791 -17.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 6.056 0.614 -17.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 6.515 1.600 -15.752 1.00 0.00 H new ATOM 1379 N CYS A 90 11.457 -3.585 -13.195 1.00 0.00 N ATOM 1380 CA CYS A 90 12.711 -3.070 -12.656 1.00 0.00 C ATOM 1381 C CYS A 90 13.711 -2.795 -13.775 1.00 0.00 C ATOM 1382 O CYS A 90 13.731 -3.493 -14.789 1.00 0.00 O ATOM 1383 CB CYS A 90 13.306 -4.063 -11.657 1.00 0.00 C ATOM 1384 SG CYS A 90 13.359 -5.769 -12.253 1.00 0.00 S ATOM 0 H CYS A 90 11.566 -4.208 -13.995 1.00 0.00 H new ATOM 0 HA CYS A 90 12.500 -2.132 -12.143 1.00 0.00 H new ATOM 0 HB2 CYS A 90 14.318 -3.746 -11.405 1.00 0.00 H new ATOM 0 HB3 CYS A 90 12.723 -4.029 -10.737 1.00 0.00 H new ATOM 0 HG CYS A 90 13.528 -5.773 -13.542 1.00 0.00 H new ATOM 1390 N SER A 91 14.538 -1.773 -13.583 1.00 0.00 N ATOM 1391 CA SER A 91 15.537 -1.401 -14.579 1.00 0.00 C ATOM 1392 C SER A 91 16.943 -1.728 -14.085 1.00 0.00 C ATOM 1393 O SER A 91 17.296 -1.437 -12.942 1.00 0.00 O ATOM 1394 CB SER A 91 15.433 0.090 -14.905 1.00 0.00 C ATOM 1395 OG SER A 91 16.574 0.537 -15.617 1.00 0.00 O ATOM 0 H SER A 91 14.537 -1.188 -12.748 1.00 0.00 H new ATOM 0 HA SER A 91 15.344 -1.977 -15.484 1.00 0.00 H new ATOM 0 HB2 SER A 91 14.536 0.275 -15.496 1.00 0.00 H new ATOM 0 HB3 SER A 91 15.329 0.661 -13.982 1.00 0.00 H new ATOM 0 HG SER A 91 16.483 1.492 -15.815 1.00 0.00 H new ATOM 1401 N VAL A 92 17.743 -2.336 -14.955 1.00 0.00 N ATOM 1402 CA VAL A 92 19.112 -2.702 -14.610 1.00 0.00 C ATOM 1403 C VAL A 92 20.109 -2.076 -15.578 1.00 0.00 C ATOM 1404 O VAL A 92 19.855 -1.993 -16.780 1.00 0.00 O ATOM 1405 CB VAL A 92 19.301 -4.230 -14.612 1.00 0.00 C ATOM 1406 CG1 VAL A 92 18.190 -4.907 -13.824 1.00 0.00 C ATOM 1407 CG2 VAL A 92 19.353 -4.758 -16.038 1.00 0.00 C ATOM 0 H VAL A 92 17.467 -2.586 -15.905 1.00 0.00 H new ATOM 0 HA VAL A 92 19.298 -2.321 -13.606 1.00 0.00 H new ATOM 0 HB VAL A 92 20.250 -4.462 -14.128 1.00 0.00 H new ATOM 0 HG11 VAL A 92 18.341 -5.986 -13.837 1.00 0.00 H new ATOM 0 HG12 VAL A 92 18.205 -4.551 -12.794 1.00 0.00 H new ATOM 0 HG13 VAL A 92 17.227 -4.670 -14.276 1.00 0.00 H new ATOM 0 HG21 VAL A 92 19.487 -5.840 -16.021 1.00 0.00 H new ATOM 0 HG22 VAL A 92 18.422 -4.516 -16.550 1.00 0.00 H new ATOM 0 HG23 VAL A 92 20.188 -4.297 -16.566 1.00 0.00 H new ATOM 1417 N ARG A 93 21.246 -1.637 -15.046 1.00 0.00 N ATOM 1418 CA ARG A 93 22.282 -1.017 -15.863 1.00 0.00 C ATOM 1419 C ARG A 93 23.436 -1.986 -16.105 1.00 0.00 C ATOM 1420 O ARG A 93 23.907 -2.651 -15.181 1.00 0.00 O ATOM 1421 CB ARG A 93 22.802 0.253 -15.188 1.00 0.00 C ATOM 1422 CG ARG A 93 24.008 0.863 -15.884 1.00 0.00 C ATOM 1423 CD ARG A 93 24.336 2.239 -15.326 1.00 0.00 C ATOM 1424 NE ARG A 93 24.924 2.162 -13.991 1.00 0.00 N ATOM 1425 CZ ARG A 93 25.030 3.203 -13.174 1.00 0.00 C ATOM 1426 NH1 ARG A 93 24.589 4.395 -13.552 1.00 0.00 N ATOM 1427 NH2 ARG A 93 25.577 3.053 -11.974 1.00 0.00 N ATOM 0 H ARG A 93 21.472 -1.699 -14.053 1.00 0.00 H new ATOM 0 HA ARG A 93 21.842 -0.755 -16.825 1.00 0.00 H new ATOM 0 HB2 ARG A 93 22.000 0.991 -15.155 1.00 0.00 H new ATOM 0 HB3 ARG A 93 23.067 0.023 -14.156 1.00 0.00 H new ATOM 0 HG2 ARG A 93 24.869 0.206 -15.764 1.00 0.00 H new ATOM 0 HG3 ARG A 93 23.812 0.940 -16.953 1.00 0.00 H new ATOM 0 HD2 ARG A 93 25.027 2.747 -15.998 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.428 2.841 -15.288 1.00 0.00 H new ATOM 0 HE ARG A 93 25.272 1.259 -13.669 1.00 0.00 H new ATOM 0 HH11 ARG A 93 24.167 4.514 -14.473 1.00 0.00 H new ATOM 0 HH12 ARG A 93 24.672 5.193 -12.922 1.00 0.00 H new ATOM 0 HH21 ARG A 93 25.916 2.137 -11.679 1.00 0.00 H new ATOM 0 HH22 ARG A 93 25.658 3.853 -11.347 1.00 0.00 H new ATOM 1441 N LEU A 94 23.886 -2.063 -17.353 1.00 0.00 N ATOM 1442 CA LEU A 94 24.984 -2.951 -17.717 1.00 0.00 C ATOM 1443 C LEU A 94 26.256 -2.157 -17.999 1.00 0.00 C ATOM 1444 O LEU A 94 26.258 -1.243 -18.825 1.00 0.00 O ATOM 1445 CB LEU A 94 24.607 -3.785 -18.942 1.00 0.00 C ATOM 1446 CG LEU A 94 23.779 -5.041 -18.670 1.00 0.00 C ATOM 1447 CD1 LEU A 94 24.654 -6.143 -18.092 1.00 0.00 C ATOM 1448 CD2 LEU A 94 22.625 -4.726 -17.729 1.00 0.00 C ATOM 0 H LEU A 94 23.507 -1.521 -18.130 1.00 0.00 H new ATOM 0 HA LEU A 94 25.173 -3.618 -16.876 1.00 0.00 H new ATOM 0 HB2 LEU A 94 24.051 -3.150 -19.632 1.00 0.00 H new ATOM 0 HB3 LEU A 94 25.524 -4.082 -19.451 1.00 0.00 H new ATOM 0 HG LEU A 94 23.366 -5.392 -19.616 1.00 0.00 H new ATOM 0 HD11 LEU A 94 24.047 -7.029 -17.905 1.00 0.00 H new ATOM 0 HD12 LEU A 94 25.446 -6.388 -18.800 1.00 0.00 H new ATOM 0 HD13 LEU A 94 25.097 -5.803 -17.156 1.00 0.00 H new ATOM 0 HD21 LEU A 94 22.047 -5.632 -17.547 1.00 0.00 H new ATOM 0 HD22 LEU A 94 23.018 -4.350 -16.784 1.00 0.00 H new ATOM 0 HD23 LEU A 94 21.983 -3.970 -18.181 1.00 0.00 H new ATOM 1460 N ASP A 95 27.335 -2.513 -17.311 1.00 0.00 N ATOM 1461 CA ASP A 95 28.614 -1.836 -17.491 1.00 0.00 C ATOM 1462 C ASP A 95 29.311 -2.320 -18.759 1.00 0.00 C ATOM 1463 O ASP A 95 28.752 -3.103 -19.527 1.00 0.00 O ATOM 1464 CB ASP A 95 29.514 -2.072 -16.277 1.00 0.00 C ATOM 1465 CG ASP A 95 30.406 -0.883 -15.978 1.00 0.00 C ATOM 1466 OD1 ASP A 95 29.965 0.016 -15.231 1.00 0.00 O ATOM 1467 OD2 ASP A 95 31.544 -0.851 -16.490 1.00 0.00 O ATOM 0 H ASP A 95 27.350 -3.266 -16.624 1.00 0.00 H new ATOM 0 HA ASP A 95 28.422 -0.768 -17.589 1.00 0.00 H new ATOM 0 HB2 ASP A 95 28.895 -2.286 -15.406 1.00 0.00 H new ATOM 0 HB3 ASP A 95 30.133 -2.952 -16.453 1.00 0.00 H new ATOM 1472 N SER A 96 30.535 -1.847 -18.972 1.00 0.00 N ATOM 1473 CA SER A 96 31.307 -2.227 -20.149 1.00 0.00 C ATOM 1474 C SER A 96 32.003 -3.567 -19.933 1.00 0.00 C ATOM 1475 O SER A 96 33.224 -3.672 -20.054 1.00 0.00 O ATOM 1476 CB SER A 96 32.341 -1.148 -20.477 1.00 0.00 C ATOM 1477 OG SER A 96 33.258 -0.980 -19.409 1.00 0.00 O ATOM 0 H SER A 96 31.013 -1.200 -18.345 1.00 0.00 H new ATOM 0 HA SER A 96 30.619 -2.327 -20.988 1.00 0.00 H new ATOM 0 HB2 SER A 96 32.880 -1.420 -21.384 1.00 0.00 H new ATOM 0 HB3 SER A 96 31.835 -0.204 -20.678 1.00 0.00 H new ATOM 0 HG SER A 96 33.748 -1.816 -19.264 1.00 0.00 H new ATOM 1483 N LYS A 97 31.218 -4.589 -19.612 1.00 0.00 N ATOM 1484 CA LYS A 97 31.756 -5.924 -19.380 1.00 0.00 C ATOM 1485 C LYS A 97 30.725 -6.994 -19.724 1.00 0.00 C ATOM 1486 O LYS A 97 30.896 -7.750 -20.681 1.00 0.00 O ATOM 1487 CB LYS A 97 32.194 -6.073 -17.921 1.00 0.00 C ATOM 1488 CG LYS A 97 32.747 -7.448 -17.589 1.00 0.00 C ATOM 1489 CD LYS A 97 33.213 -7.529 -16.145 1.00 0.00 C ATOM 1490 CE LYS A 97 34.634 -7.010 -15.988 1.00 0.00 C ATOM 1491 NZ LYS A 97 35.242 -7.441 -14.699 1.00 0.00 N ATOM 0 H LYS A 97 30.206 -4.518 -19.506 1.00 0.00 H new ATOM 0 HA LYS A 97 32.622 -6.057 -20.029 1.00 0.00 H new ATOM 0 HB2 LYS A 97 32.953 -5.322 -17.700 1.00 0.00 H new ATOM 0 HB3 LYS A 97 31.343 -5.867 -17.272 1.00 0.00 H new ATOM 0 HG2 LYS A 97 31.980 -8.202 -17.768 1.00 0.00 H new ATOM 0 HG3 LYS A 97 33.580 -7.676 -18.254 1.00 0.00 H new ATOM 0 HD2 LYS A 97 32.541 -6.950 -15.512 1.00 0.00 H new ATOM 0 HD3 LYS A 97 33.162 -8.563 -15.803 1.00 0.00 H new ATOM 0 HE2 LYS A 97 35.245 -7.369 -16.816 1.00 0.00 H new ATOM 0 HE3 LYS A 97 34.631 -5.921 -16.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 36.276 -7.487 -14.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 34.997 -6.758 -13.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 34.878 -8.380 -14.440 1.00 0.00 H new ATOM 1505 N TYR A 98 29.654 -7.052 -18.940 1.00 0.00 N ATOM 1506 CA TYR A 98 28.596 -8.030 -19.162 1.00 0.00 C ATOM 1507 C TYR A 98 27.775 -7.673 -20.397 1.00 0.00 C ATOM 1508 O TYR A 98 27.122 -8.530 -20.991 1.00 0.00 O ATOM 1509 CB TYR A 98 27.684 -8.113 -17.936 1.00 0.00 C ATOM 1510 CG TYR A 98 28.386 -8.611 -16.693 1.00 0.00 C ATOM 1511 CD1 TYR A 98 29.094 -7.740 -15.875 1.00 0.00 C ATOM 1512 CD2 TYR A 98 28.338 -9.953 -16.335 1.00 0.00 C ATOM 1513 CE1 TYR A 98 29.737 -8.191 -14.738 1.00 0.00 C ATOM 1514 CE2 TYR A 98 28.977 -10.412 -15.200 1.00 0.00 C ATOM 1515 CZ TYR A 98 29.675 -9.528 -14.405 1.00 0.00 C ATOM 1516 OH TYR A 98 30.313 -9.981 -13.273 1.00 0.00 O ATOM 0 H TYR A 98 29.496 -6.433 -18.145 1.00 0.00 H new ATOM 0 HA TYR A 98 29.062 -9.001 -19.326 1.00 0.00 H new ATOM 0 HB2 TYR A 98 27.266 -7.126 -17.737 1.00 0.00 H new ATOM 0 HB3 TYR A 98 26.847 -8.774 -18.160 1.00 0.00 H new ATOM 0 HD1 TYR A 98 29.143 -6.692 -16.132 1.00 0.00 H new ATOM 0 HD2 TYR A 98 27.792 -10.649 -16.955 1.00 0.00 H new ATOM 0 HE1 TYR A 98 30.285 -7.501 -14.114 1.00 0.00 H new ATOM 0 HE2 TYR A 98 28.930 -11.458 -14.936 1.00 0.00 H new ATOM 0 HH TYR A 98 30.171 -10.946 -13.181 1.00 0.00 H new ATOM 1526 N GLY A 99 27.814 -6.400 -20.779 1.00 0.00 N ATOM 1527 CA GLY A 99 27.071 -5.951 -21.941 1.00 0.00 C ATOM 1528 C GLY A 99 27.976 -5.483 -23.063 1.00 0.00 C ATOM 1529 O GLY A 99 28.382 -4.321 -23.099 1.00 0.00 O ATOM 0 H GLY A 99 28.347 -5.672 -20.304 1.00 0.00 H new ATOM 0 HA2 GLY A 99 26.441 -6.764 -22.302 1.00 0.00 H new ATOM 0 HA3 GLY A 99 26.406 -5.137 -21.651 1.00 0.00 H new ATOM 1533 N TYR A 100 28.296 -6.389 -23.981 1.00 0.00 N ATOM 1534 CA TYR A 100 29.163 -6.063 -25.107 1.00 0.00 C ATOM 1535 C TYR A 100 30.461 -5.422 -24.627 1.00 0.00 C ATOM 1536 O TYR A 100 31.019 -4.550 -25.292 1.00 0.00 O ATOM 1537 CB TYR A 100 28.444 -5.123 -26.076 1.00 0.00 C ATOM 1538 CG TYR A 100 27.016 -5.526 -26.364 1.00 0.00 C ATOM 1539 CD1 TYR A 100 26.727 -6.739 -26.978 1.00 0.00 C ATOM 1540 CD2 TYR A 100 25.956 -4.695 -26.024 1.00 0.00 C ATOM 1541 CE1 TYR A 100 25.423 -7.111 -27.245 1.00 0.00 C ATOM 1542 CE2 TYR A 100 24.650 -5.060 -26.285 1.00 0.00 C ATOM 1543 CZ TYR A 100 24.388 -6.269 -26.896 1.00 0.00 C ATOM 1544 OH TYR A 100 23.088 -6.636 -27.159 1.00 0.00 O ATOM 0 H TYR A 100 27.968 -7.355 -23.967 1.00 0.00 H new ATOM 0 HA TYR A 100 29.407 -6.990 -25.625 1.00 0.00 H new ATOM 0 HB2 TYR A 100 28.452 -4.114 -25.663 1.00 0.00 H new ATOM 0 HB3 TYR A 100 28.999 -5.088 -27.014 1.00 0.00 H new ATOM 0 HD1 TYR A 100 27.535 -7.402 -27.251 1.00 0.00 H new ATOM 0 HD2 TYR A 100 26.157 -3.747 -25.547 1.00 0.00 H new ATOM 0 HE1 TYR A 100 25.216 -8.056 -27.724 1.00 0.00 H new ATOM 0 HE2 TYR A 100 23.838 -4.402 -26.012 1.00 0.00 H new ATOM 0 HH TYR A 100 22.480 -5.932 -26.850 1.00 0.00 H new ATOM 1642 N ILE A 109 27.052 0.467 -30.248 1.00 0.00 N ATOM 1643 CA ILE A 109 27.589 0.360 -28.898 1.00 0.00 C ATOM 1644 C ILE A 109 29.071 0.000 -28.923 1.00 0.00 C ATOM 1645 O ILE A 109 29.451 -1.171 -28.918 1.00 0.00 O ATOM 1646 CB ILE A 109 26.830 -0.695 -28.071 1.00 0.00 C ATOM 1647 CG1 ILE A 109 25.337 -0.363 -28.028 1.00 0.00 C ATOM 1648 CG2 ILE A 109 27.402 -0.777 -26.664 1.00 0.00 C ATOM 1649 CD1 ILE A 109 24.480 -1.501 -27.521 1.00 0.00 C ATOM 0 HA ILE A 109 27.462 1.336 -28.430 1.00 0.00 H new ATOM 0 HB ILE A 109 26.953 -1.667 -28.548 1.00 0.00 H new ATOM 0 HG12 ILE A 109 25.185 0.508 -27.390 1.00 0.00 H new ATOM 0 HG13 ILE A 109 25.005 -0.087 -29.029 1.00 0.00 H new ATOM 0 HG21 ILE A 109 26.855 -1.527 -26.092 1.00 0.00 H new ATOM 0 HG22 ILE A 109 28.455 -1.056 -26.715 1.00 0.00 H new ATOM 0 HG23 ILE A 109 27.307 0.193 -26.175 1.00 0.00 H new ATOM 0 HD11 ILE A 109 23.434 -1.195 -27.517 1.00 0.00 H new ATOM 0 HD12 ILE A 109 24.603 -2.367 -28.172 1.00 0.00 H new ATOM 0 HD13 ILE A 109 24.785 -1.763 -26.508 1.00 0.00 H new ATOM 1661 N PRO A 110 29.930 1.030 -28.949 1.00 0.00 N ATOM 1662 CA PRO A 110 31.384 0.848 -28.973 1.00 0.00 C ATOM 1663 C PRO A 110 31.922 0.306 -27.653 1.00 0.00 C ATOM 1664 O PRO A 110 31.350 0.548 -26.592 1.00 0.00 O ATOM 1665 CB PRO A 110 31.915 2.261 -29.226 1.00 0.00 C ATOM 1666 CG PRO A 110 30.848 3.164 -28.710 1.00 0.00 C ATOM 1667 CD PRO A 110 29.547 2.452 -28.956 1.00 0.00 C ATOM 0 HA PRO A 110 31.691 0.122 -29.725 1.00 0.00 H new ATOM 0 HB2 PRO A 110 32.860 2.428 -28.708 1.00 0.00 H new ATOM 0 HB3 PRO A 110 32.099 2.431 -30.287 1.00 0.00 H new ATOM 0 HG2 PRO A 110 30.988 3.366 -27.648 1.00 0.00 H new ATOM 0 HG3 PRO A 110 30.869 4.126 -29.223 1.00 0.00 H new ATOM 0 HD2 PRO A 110 28.814 2.675 -28.180 1.00 0.00 H new ATOM 0 HD3 PRO A 110 29.103 2.744 -29.908 1.00 0.00 H new ATOM 1675 N GLY A 111 33.027 -0.430 -27.727 1.00 0.00 N ATOM 1676 CA GLY A 111 33.624 -0.995 -26.531 1.00 0.00 C ATOM 1677 C GLY A 111 33.868 0.047 -25.458 1.00 0.00 C ATOM 1678 O GLY A 111 34.002 1.234 -25.754 1.00 0.00 O ATOM 0 H GLY A 111 33.519 -0.645 -28.594 1.00 0.00 H new ATOM 0 HA2 GLY A 111 32.971 -1.773 -26.136 1.00 0.00 H new ATOM 0 HA3 GLY A 111 34.569 -1.473 -26.791 1.00 0.00 H new ATOM 1682 N ASN A 112 33.924 -0.397 -24.206 1.00 0.00 N ATOM 1683 CA ASN A 112 34.150 0.507 -23.084 1.00 0.00 C ATOM 1684 C ASN A 112 33.075 1.587 -23.030 1.00 0.00 C ATOM 1685 O ASN A 112 33.350 2.764 -23.262 1.00 0.00 O ATOM 1686 CB ASN A 112 35.533 1.153 -23.194 1.00 0.00 C ATOM 1687 CG ASN A 112 36.639 0.239 -22.702 1.00 0.00 C ATOM 1688 OD1 ASN A 112 37.250 0.490 -21.663 1.00 0.00 O ATOM 1689 ND2 ASN A 112 36.901 -0.828 -23.448 1.00 0.00 N ATOM 0 H ASN A 112 33.816 -1.377 -23.943 1.00 0.00 H new ATOM 0 HA ASN A 112 34.100 -0.076 -22.164 1.00 0.00 H new ATOM 0 HB2 ASN A 112 35.723 1.423 -24.233 1.00 0.00 H new ATOM 0 HB3 ASN A 112 35.546 2.078 -22.617 1.00 0.00 H new ATOM 0 HD21 ASN A 112 37.634 -1.479 -23.167 1.00 0.00 H new ATOM 0 HD22 ASN A 112 36.369 -0.996 -24.302 1.00 0.00 H new ATOM 1696 N SER A 113 31.848 1.179 -22.720 1.00 0.00 N ATOM 1697 CA SER A 113 30.730 2.111 -22.639 1.00 0.00 C ATOM 1698 C SER A 113 29.600 1.531 -21.794 1.00 0.00 C ATOM 1699 O SER A 113 29.203 0.379 -21.973 1.00 0.00 O ATOM 1700 CB SER A 113 30.215 2.446 -24.039 1.00 0.00 C ATOM 1701 OG SER A 113 29.602 3.724 -24.065 1.00 0.00 O ATOM 0 H SER A 113 31.603 0.209 -22.521 1.00 0.00 H new ATOM 0 HA SER A 113 31.085 3.025 -22.162 1.00 0.00 H new ATOM 0 HB2 SER A 113 31.041 2.421 -24.749 1.00 0.00 H new ATOM 0 HB3 SER A 113 29.498 1.689 -24.357 1.00 0.00 H new ATOM 0 HG SER A 113 29.283 3.915 -24.972 1.00 0.00 H new ATOM 1707 N VAL A 114 29.084 2.337 -20.871 1.00 0.00 N ATOM 1708 CA VAL A 114 27.999 1.906 -19.999 1.00 0.00 C ATOM 1709 C VAL A 114 26.642 2.140 -20.653 1.00 0.00 C ATOM 1710 O VAL A 114 26.445 3.126 -21.364 1.00 0.00 O ATOM 1711 CB VAL A 114 28.039 2.643 -18.647 1.00 0.00 C ATOM 1712 CG1 VAL A 114 26.877 2.208 -17.767 1.00 0.00 C ATOM 1713 CG2 VAL A 114 29.368 2.401 -17.948 1.00 0.00 C ATOM 0 H VAL A 114 29.401 3.293 -20.708 1.00 0.00 H new ATOM 0 HA VAL A 114 28.137 0.839 -19.827 1.00 0.00 H new ATOM 0 HB VAL A 114 27.942 3.713 -18.833 1.00 0.00 H new ATOM 0 HG11 VAL A 114 26.922 2.739 -16.816 1.00 0.00 H new ATOM 0 HG12 VAL A 114 25.936 2.438 -18.267 1.00 0.00 H new ATOM 0 HG13 VAL A 114 26.939 1.135 -17.586 1.00 0.00 H new ATOM 0 HG21 VAL A 114 29.379 2.929 -16.994 1.00 0.00 H new ATOM 0 HG22 VAL A 114 29.498 1.333 -17.773 1.00 0.00 H new ATOM 0 HG23 VAL A 114 30.181 2.767 -18.575 1.00 0.00 H new ATOM 1723 N LEU A 115 25.708 1.227 -20.408 1.00 0.00 N ATOM 1724 CA LEU A 115 24.367 1.333 -20.972 1.00 0.00 C ATOM 1725 C LEU A 115 23.316 0.865 -19.971 1.00 0.00 C ATOM 1726 O LEU A 115 23.613 0.091 -19.061 1.00 0.00 O ATOM 1727 CB LEU A 115 24.267 0.510 -22.257 1.00 0.00 C ATOM 1728 CG LEU A 115 25.520 0.476 -23.133 1.00 0.00 C ATOM 1729 CD1 LEU A 115 26.418 -0.685 -22.735 1.00 0.00 C ATOM 1730 CD2 LEU A 115 25.141 0.380 -24.603 1.00 0.00 C ATOM 0 H LEU A 115 25.855 0.405 -19.822 1.00 0.00 H new ATOM 0 HA LEU A 115 24.179 2.381 -21.204 1.00 0.00 H new ATOM 0 HB2 LEU A 115 24.008 -0.514 -21.989 1.00 0.00 H new ATOM 0 HB3 LEU A 115 23.443 0.902 -22.852 1.00 0.00 H new ATOM 0 HG LEU A 115 26.071 1.404 -22.981 1.00 0.00 H new ATOM 0 HD11 LEU A 115 27.305 -0.693 -23.369 1.00 0.00 H new ATOM 0 HD12 LEU A 115 26.718 -0.572 -21.693 1.00 0.00 H new ATOM 0 HD13 LEU A 115 25.876 -1.623 -22.857 1.00 0.00 H new ATOM 0 HD21 LEU A 115 26.045 0.357 -25.211 1.00 0.00 H new ATOM 0 HD22 LEU A 115 24.567 -0.531 -24.772 1.00 0.00 H new ATOM 0 HD23 LEU A 115 24.539 1.245 -24.881 1.00 0.00 H new ATOM 1742 N ILE A 116 22.087 1.338 -20.147 1.00 0.00 N ATOM 1743 CA ILE A 116 20.991 0.965 -19.261 1.00 0.00 C ATOM 1744 C ILE A 116 19.940 0.146 -20.002 1.00 0.00 C ATOM 1745 O ILE A 116 19.639 0.410 -21.166 1.00 0.00 O ATOM 1746 CB ILE A 116 20.319 2.206 -18.644 1.00 0.00 C ATOM 1747 CG1 ILE A 116 21.324 2.990 -17.798 1.00 0.00 C ATOM 1748 CG2 ILE A 116 19.118 1.795 -17.805 1.00 0.00 C ATOM 1749 CD1 ILE A 116 22.163 3.960 -18.600 1.00 0.00 C ATOM 0 H ILE A 116 21.825 1.980 -20.895 1.00 0.00 H new ATOM 0 HA ILE A 116 21.422 0.361 -18.462 1.00 0.00 H new ATOM 0 HB ILE A 116 19.971 2.851 -19.450 1.00 0.00 H new ATOM 0 HG12 ILE A 116 20.786 3.540 -17.026 1.00 0.00 H new ATOM 0 HG13 ILE A 116 21.983 2.288 -17.288 1.00 0.00 H new ATOM 0 HG21 ILE A 116 18.653 2.683 -17.375 1.00 0.00 H new ATOM 0 HG22 ILE A 116 18.395 1.276 -18.434 1.00 0.00 H new ATOM 0 HG23 ILE A 116 19.444 1.132 -17.003 1.00 0.00 H new ATOM 0 HD11 ILE A 116 22.853 4.480 -17.935 1.00 0.00 H new ATOM 0 HD12 ILE A 116 22.729 3.414 -19.355 1.00 0.00 H new ATOM 0 HD13 ILE A 116 21.513 4.686 -19.089 1.00 0.00 H new ATOM 1761 N PHE A 117 19.382 -0.847 -19.318 1.00 0.00 N ATOM 1762 CA PHE A 117 18.362 -1.705 -19.911 1.00 0.00 C ATOM 1763 C PHE A 117 17.256 -2.009 -18.905 1.00 0.00 C ATOM 1764 O PHE A 117 17.525 -2.406 -17.772 1.00 0.00 O ATOM 1765 CB PHE A 117 18.988 -3.010 -20.407 1.00 0.00 C ATOM 1766 CG PHE A 117 19.338 -2.989 -21.868 1.00 0.00 C ATOM 1767 CD1 PHE A 117 20.421 -2.255 -22.324 1.00 0.00 C ATOM 1768 CD2 PHE A 117 18.584 -3.704 -22.784 1.00 0.00 C ATOM 1769 CE1 PHE A 117 20.746 -2.234 -23.667 1.00 0.00 C ATOM 1770 CE2 PHE A 117 18.904 -3.687 -24.129 1.00 0.00 C ATOM 1771 CZ PHE A 117 19.986 -2.951 -24.571 1.00 0.00 C ATOM 0 H PHE A 117 19.618 -1.078 -18.353 1.00 0.00 H new ATOM 0 HA PHE A 117 17.924 -1.175 -20.757 1.00 0.00 H new ATOM 0 HB2 PHE A 117 19.889 -3.214 -19.829 1.00 0.00 H new ATOM 0 HB3 PHE A 117 18.295 -3.830 -20.219 1.00 0.00 H new ATOM 0 HD1 PHE A 117 21.018 -1.693 -21.622 1.00 0.00 H new ATOM 0 HD2 PHE A 117 17.737 -4.281 -22.444 1.00 0.00 H new ATOM 0 HE1 PHE A 117 21.593 -1.658 -24.009 1.00 0.00 H new ATOM 0 HE2 PHE A 117 18.308 -4.249 -24.833 1.00 0.00 H new ATOM 0 HZ PHE A 117 20.237 -2.936 -25.621 1.00 0.00 H new ATOM 1781 N GLU A 118 16.010 -1.818 -19.329 1.00 0.00 N ATOM 1782 CA GLU A 118 14.863 -2.071 -18.465 1.00 0.00 C ATOM 1783 C GLU A 118 14.334 -3.489 -18.662 1.00 0.00 C ATOM 1784 O GLU A 118 14.315 -4.005 -19.780 1.00 0.00 O ATOM 1785 CB GLU A 118 13.752 -1.057 -18.746 1.00 0.00 C ATOM 1786 CG GLU A 118 12.529 -1.233 -17.861 1.00 0.00 C ATOM 1787 CD GLU A 118 11.790 0.069 -17.621 1.00 0.00 C ATOM 1788 OE1 GLU A 118 11.385 0.712 -18.613 1.00 0.00 O ATOM 1789 OE2 GLU A 118 11.617 0.446 -16.443 1.00 0.00 O ATOM 0 H GLU A 118 15.770 -1.489 -20.264 1.00 0.00 H new ATOM 0 HA GLU A 118 15.190 -1.965 -17.431 1.00 0.00 H new ATOM 0 HB2 GLU A 118 14.147 -0.050 -18.609 1.00 0.00 H new ATOM 0 HB3 GLU A 118 13.450 -1.142 -19.790 1.00 0.00 H new ATOM 0 HG2 GLU A 118 11.851 -1.951 -18.323 1.00 0.00 H new ATOM 0 HG3 GLU A 118 12.836 -1.654 -16.904 1.00 0.00 H new ATOM 1796 N ILE A 119 13.908 -4.112 -17.570 1.00 0.00 N ATOM 1797 CA ILE A 119 13.379 -5.469 -17.623 1.00 0.00 C ATOM 1798 C ILE A 119 12.045 -5.569 -16.889 1.00 0.00 C ATOM 1799 O ILE A 119 11.854 -4.951 -15.843 1.00 0.00 O ATOM 1800 CB ILE A 119 14.365 -6.482 -17.011 1.00 0.00 C ATOM 1801 CG1 ILE A 119 15.756 -6.306 -17.622 1.00 0.00 C ATOM 1802 CG2 ILE A 119 13.864 -7.903 -17.222 1.00 0.00 C ATOM 1803 CD1 ILE A 119 16.786 -7.266 -17.069 1.00 0.00 C ATOM 0 H ILE A 119 13.919 -3.699 -16.637 1.00 0.00 H new ATOM 0 HA ILE A 119 13.231 -5.708 -18.676 1.00 0.00 H new ATOM 0 HB ILE A 119 14.434 -6.297 -15.939 1.00 0.00 H new ATOM 0 HG12 ILE A 119 15.689 -6.440 -18.702 1.00 0.00 H new ATOM 0 HG13 ILE A 119 16.093 -5.284 -17.448 1.00 0.00 H new ATOM 0 HG21 ILE A 119 14.572 -8.607 -16.784 1.00 0.00 H new ATOM 0 HG22 ILE A 119 12.892 -8.021 -16.744 1.00 0.00 H new ATOM 0 HG23 ILE A 119 13.769 -8.101 -18.290 1.00 0.00 H new ATOM 0 HD11 ILE A 119 17.748 -7.083 -17.548 1.00 0.00 H new ATOM 0 HD12 ILE A 119 16.882 -7.117 -15.994 1.00 0.00 H new ATOM 0 HD13 ILE A 119 16.471 -8.291 -17.267 1.00 0.00 H new ATOM 1815 N GLU A 120 11.127 -6.352 -17.446 1.00 0.00 N ATOM 1816 CA GLU A 120 9.811 -6.533 -16.844 1.00 0.00 C ATOM 1817 C GLU A 120 9.249 -7.914 -17.169 1.00 0.00 C ATOM 1818 O GLU A 120 9.037 -8.252 -18.335 1.00 0.00 O ATOM 1819 CB GLU A 120 8.848 -5.450 -17.334 1.00 0.00 C ATOM 1820 CG GLU A 120 7.417 -5.649 -16.864 1.00 0.00 C ATOM 1821 CD GLU A 120 6.512 -4.493 -17.242 1.00 0.00 C ATOM 1822 OE1 GLU A 120 7.008 -3.528 -17.861 1.00 0.00 O ATOM 1823 OE2 GLU A 120 5.307 -4.554 -16.920 1.00 0.00 O ATOM 0 H GLU A 120 11.270 -6.871 -18.312 1.00 0.00 H new ATOM 0 HA GLU A 120 9.920 -6.450 -15.763 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.202 -4.478 -16.990 1.00 0.00 H new ATOM 0 HB3 GLU A 120 8.864 -5.428 -18.424 1.00 0.00 H new ATOM 0 HG2 GLU A 120 7.022 -6.570 -17.294 1.00 0.00 H new ATOM 0 HG3 GLU A 120 7.408 -5.773 -15.781 1.00 0.00 H new ATOM 1830 N LEU A 121 9.010 -8.708 -16.132 1.00 0.00 N ATOM 1831 CA LEU A 121 8.473 -10.053 -16.305 1.00 0.00 C ATOM 1832 C LEU A 121 6.972 -10.009 -16.577 1.00 0.00 C ATOM 1833 O LEU A 121 6.199 -9.505 -15.763 1.00 0.00 O ATOM 1834 CB LEU A 121 8.753 -10.900 -15.063 1.00 0.00 C ATOM 1835 CG LEU A 121 8.817 -12.412 -15.282 1.00 0.00 C ATOM 1836 CD1 LEU A 121 9.252 -13.118 -14.007 1.00 0.00 C ATOM 1837 CD2 LEU A 121 7.469 -12.940 -15.752 1.00 0.00 C ATOM 0 H LEU A 121 9.180 -8.444 -15.162 1.00 0.00 H new ATOM 0 HA LEU A 121 8.967 -10.507 -17.164 1.00 0.00 H new ATOM 0 HB2 LEU A 121 9.700 -10.575 -14.632 1.00 0.00 H new ATOM 0 HB3 LEU A 121 7.979 -10.693 -14.324 1.00 0.00 H new ATOM 0 HG LEU A 121 9.556 -12.617 -16.057 1.00 0.00 H new ATOM 0 HD11 LEU A 121 9.292 -14.193 -14.182 1.00 0.00 H new ATOM 0 HD12 LEU A 121 10.239 -12.761 -13.712 1.00 0.00 H new ATOM 0 HD13 LEU A 121 8.537 -12.906 -13.212 1.00 0.00 H new ATOM 0 HD21 LEU A 121 7.533 -14.018 -15.903 1.00 0.00 H new ATOM 0 HD22 LEU A 121 6.711 -12.723 -14.999 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.197 -12.458 -16.691 1.00 0.00 H new ATOM 1849 N ILE A 122 6.568 -10.543 -17.725 1.00 0.00 N ATOM 1850 CA ILE A 122 5.160 -10.567 -18.102 1.00 0.00 C ATOM 1851 C ILE A 122 4.524 -11.912 -17.764 1.00 0.00 C ATOM 1852 O ILE A 122 3.555 -11.979 -17.008 1.00 0.00 O ATOM 1853 CB ILE A 122 4.975 -10.287 -19.605 1.00 0.00 C ATOM 1854 CG1 ILE A 122 5.681 -8.987 -19.994 1.00 0.00 C ATOM 1855 CG2 ILE A 122 3.495 -10.217 -19.952 1.00 0.00 C ATOM 1856 CD1 ILE A 122 5.669 -8.715 -21.482 1.00 0.00 C ATOM 0 H ILE A 122 7.196 -10.965 -18.410 1.00 0.00 H new ATOM 0 HA ILE A 122 4.666 -9.780 -17.531 1.00 0.00 H new ATOM 0 HB ILE A 122 5.423 -11.105 -20.170 1.00 0.00 H new ATOM 0 HG12 ILE A 122 5.203 -8.155 -19.477 1.00 0.00 H new ATOM 0 HG13 ILE A 122 6.714 -9.026 -19.648 1.00 0.00 H new ATOM 0 HG21 ILE A 122 3.380 -10.019 -21.018 1.00 0.00 H new ATOM 0 HG22 ILE A 122 3.018 -11.166 -19.706 1.00 0.00 H new ATOM 0 HG23 ILE A 122 3.025 -9.416 -19.381 1.00 0.00 H new ATOM 0 HD11 ILE A 122 6.187 -7.778 -21.685 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.173 -9.528 -22.005 1.00 0.00 H new ATOM 0 HD13 ILE A 122 4.639 -8.643 -21.830 1.00 0.00 H new ATOM 1868 N SER A 123 5.078 -12.980 -18.329 1.00 0.00 N ATOM 1869 CA SER A 123 4.563 -14.324 -18.090 1.00 0.00 C ATOM 1870 C SER A 123 5.493 -15.375 -18.687 1.00 0.00 C ATOM 1871 O SER A 123 6.349 -15.066 -19.516 1.00 0.00 O ATOM 1872 CB SER A 123 3.162 -14.469 -18.685 1.00 0.00 C ATOM 1873 OG SER A 123 3.224 -14.803 -20.060 1.00 0.00 O ATOM 0 H SER A 123 5.883 -12.941 -18.955 1.00 0.00 H new ATOM 0 HA SER A 123 4.510 -14.481 -17.013 1.00 0.00 H new ATOM 0 HB2 SER A 123 2.612 -15.240 -18.145 1.00 0.00 H new ATOM 0 HB3 SER A 123 2.612 -13.537 -18.558 1.00 0.00 H new ATOM 0 HG SER A 123 2.315 -14.892 -20.416 1.00 0.00 H new ATOM 1879 N PHE A 124 5.320 -16.621 -18.258 1.00 0.00 N ATOM 1880 CA PHE A 124 6.143 -17.720 -18.749 1.00 0.00 C ATOM 1881 C PHE A 124 5.370 -19.035 -18.718 1.00 0.00 C ATOM 1882 O PHE A 124 4.375 -19.166 -18.004 1.00 0.00 O ATOM 1883 CB PHE A 124 7.417 -17.845 -17.910 1.00 0.00 C ATOM 1884 CG PHE A 124 7.169 -17.779 -16.430 1.00 0.00 C ATOM 1885 CD1 PHE A 124 6.880 -18.928 -15.711 1.00 0.00 C ATOM 1886 CD2 PHE A 124 7.225 -16.569 -15.758 1.00 0.00 C ATOM 1887 CE1 PHE A 124 6.652 -18.871 -14.349 1.00 0.00 C ATOM 1888 CE2 PHE A 124 6.998 -16.506 -14.396 1.00 0.00 C ATOM 1889 CZ PHE A 124 6.710 -17.658 -13.691 1.00 0.00 C ATOM 0 H PHE A 124 4.617 -16.895 -17.571 1.00 0.00 H new ATOM 0 HA PHE A 124 6.415 -17.503 -19.782 1.00 0.00 H new ATOM 0 HB2 PHE A 124 7.907 -18.790 -18.146 1.00 0.00 H new ATOM 0 HB3 PHE A 124 8.107 -17.049 -18.191 1.00 0.00 H new ATOM 0 HD1 PHE A 124 6.832 -19.879 -16.221 1.00 0.00 H new ATOM 0 HD2 PHE A 124 7.449 -15.665 -16.304 1.00 0.00 H new ATOM 0 HE1 PHE A 124 6.429 -19.774 -13.800 1.00 0.00 H new ATOM 0 HE2 PHE A 124 7.046 -15.557 -13.884 1.00 0.00 H new ATOM 0 HZ PHE A 124 6.530 -17.611 -12.627 1.00 0.00 H new ATOM 1899 N ARG A 125 5.834 -20.006 -19.497 1.00 0.00 N ATOM 1900 CA ARG A 125 5.186 -21.311 -19.561 1.00 0.00 C ATOM 1901 C ARG A 125 6.049 -22.310 -20.324 1.00 0.00 C ATOM 1902 O ARG A 125 7.153 -21.985 -20.760 1.00 0.00 O ATOM 1903 CB ARG A 125 3.815 -21.190 -20.229 1.00 0.00 C ATOM 1904 CG ARG A 125 3.881 -21.119 -21.746 1.00 0.00 C ATOM 1905 CD ARG A 125 4.592 -19.860 -22.214 1.00 0.00 C ATOM 1906 NE ARG A 125 4.211 -19.489 -23.574 1.00 0.00 N ATOM 1907 CZ ARG A 125 3.022 -18.991 -23.894 1.00 0.00 C ATOM 1908 NH1 ARG A 125 2.103 -18.805 -22.956 1.00 0.00 N ATOM 1909 NH2 ARG A 125 2.749 -18.678 -25.155 1.00 0.00 N ATOM 0 H ARG A 125 6.657 -19.914 -20.093 1.00 0.00 H new ATOM 0 HA ARG A 125 5.056 -21.675 -18.542 1.00 0.00 H new ATOM 0 HB2 ARG A 125 3.203 -22.044 -19.940 1.00 0.00 H new ATOM 0 HB3 ARG A 125 3.315 -20.297 -19.853 1.00 0.00 H new ATOM 0 HG2 ARG A 125 4.402 -21.996 -22.130 1.00 0.00 H new ATOM 0 HG3 ARG A 125 2.872 -21.142 -22.157 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.359 -19.039 -21.536 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.670 -20.015 -22.169 1.00 0.00 H new ATOM 0 HE ARG A 125 4.895 -19.619 -24.319 1.00 0.00 H new ATOM 0 HH11 ARG A 125 2.309 -19.045 -21.986 1.00 0.00 H new ATOM 0 HH12 ARG A 125 1.191 -18.422 -23.205 1.00 0.00 H new ATOM 0 HH21 ARG A 125 3.453 -18.820 -25.880 1.00 0.00 H new ATOM 0 HH22 ARG A 125 1.835 -18.296 -25.399 1.00 0.00 H new ATOM 1923 N GLU A 126 5.539 -23.528 -20.481 1.00 0.00 N ATOM 1924 CA GLU A 126 6.265 -24.575 -21.190 1.00 0.00 C ATOM 1925 C GLU A 126 5.788 -24.684 -22.636 1.00 0.00 C ATOM 1926 O GLU A 126 5.608 -25.783 -23.159 1.00 0.00 O ATOM 1927 CB GLU A 126 6.089 -25.919 -20.481 1.00 0.00 C ATOM 1928 CG GLU A 126 6.414 -25.871 -18.997 1.00 0.00 C ATOM 1929 CD GLU A 126 6.326 -27.233 -18.337 1.00 0.00 C ATOM 1930 OE1 GLU A 126 5.196 -27.702 -18.092 1.00 0.00 O ATOM 1931 OE2 GLU A 126 7.390 -27.829 -18.064 1.00 0.00 O ATOM 0 H GLU A 126 4.626 -23.814 -20.127 1.00 0.00 H new ATOM 0 HA GLU A 126 7.322 -24.310 -21.193 1.00 0.00 H new ATOM 0 HB2 GLU A 126 5.060 -26.256 -20.608 1.00 0.00 H new ATOM 0 HB3 GLU A 126 6.728 -26.660 -20.961 1.00 0.00 H new ATOM 0 HG2 GLU A 126 7.418 -25.470 -18.862 1.00 0.00 H new ATOM 0 HG3 GLU A 126 5.727 -25.186 -18.500 1.00 0.00 H new