USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1024 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 Single : A 8 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0166) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -170:sc= 0.215 (180deg=0.173) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.639 X(o=-0.64,f=-0.77) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -176:sc= -1.9 USER MOD Single : A 32 SER OG : rot 85:sc= 0.641 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.129 X(o=-0.13,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 140:sc= -0.384 (180deg=-1.52!) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 144:sc= -3.71 (180deg=-6.95!) USER MOD Single : A 42 TYR OH : rot -109:sc= 0.628 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 161:sc=-0.00182 (180deg=-0.124) USER MOD Single : A 49 LYS NZ :NH3+ -105:sc= 0 (180deg=-0.0612) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot -91:sc= -2.35 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.0341 X(o=-0.034,f=0) USER MOD Single : A 79 TYR OH : rot -126:sc= 0.0928 USER MOD Single : A 84 MET CE :methyl 141:sc= -2.32 (180deg=-5.73!) USER MOD Single : A 97 ASN : amide:sc= -7.06! C(o=-7.1!,f=-8.2!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -2.77 K(o=-2.8,f=-5.4!) USER MOD Single : A 106 SER OG : rot 180:sc= 0.00502 USER MOD Single : A 111 THR OG1 : rot -59:sc= 1.12 USER MOD Single : A 112 LYS NZ :NH3+ 156:sc=-0.000703 (180deg=-0.407) USER MOD Single : A 115 GLN : amide:sc= 1.15 K(o=1.1,f=-0.28) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot -160:sc= 0.453 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= -0.212 K(o=-0.21,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 8 3.045 -1.647 -26.807 1.00 0.00 N ATOM 2 CA LYS A 8 3.331 -2.878 -26.024 1.00 0.00 C ATOM 3 C LYS A 8 2.598 -2.863 -24.687 1.00 0.00 C ATOM 4 O LYS A 8 2.401 -1.805 -24.087 1.00 0.00 O ATOM 5 CB LYS A 8 4.840 -2.970 -25.796 1.00 0.00 C ATOM 6 CG LYS A 8 5.274 -4.260 -25.115 1.00 0.00 C ATOM 7 CD LYS A 8 6.183 -5.090 -26.010 1.00 0.00 C ATOM 8 CE LYS A 8 5.772 -6.553 -26.018 1.00 0.00 C ATOM 9 NZ LYS A 8 4.503 -6.769 -26.768 1.00 0.00 N ATOM 0 HA LYS A 8 2.980 -3.747 -26.582 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.350 -2.886 -26.756 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.160 -2.123 -25.189 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.794 -4.024 -24.186 1.00 0.00 H new ATOM 0 HG3 LYS A 8 4.394 -4.845 -24.848 1.00 0.00 H new ATOM 0 HD2 LYS A 8 6.152 -4.697 -27.026 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.213 -5.002 -25.665 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.565 -7.151 -26.467 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.652 -6.902 -24.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 4.336 -7.789 -26.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 3.712 -6.345 -26.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 4.573 -6.323 -27.705 1.00 0.00 H new ATOM 25 N MET A 9 2.195 -4.042 -24.224 1.00 0.00 N ATOM 26 CA MET A 9 1.483 -4.163 -22.956 1.00 0.00 C ATOM 27 C MET A 9 2.450 -4.468 -21.817 1.00 0.00 C ATOM 28 O MET A 9 3.444 -5.168 -22.004 1.00 0.00 O ATOM 29 CB MET A 9 0.422 -5.261 -23.048 1.00 0.00 C ATOM 30 CG MET A 9 -0.798 -4.860 -23.862 1.00 0.00 C ATOM 31 SD MET A 9 -2.180 -5.999 -23.649 1.00 0.00 S ATOM 32 CE MET A 9 -3.415 -4.905 -22.954 1.00 0.00 C ATOM 0 H MET A 9 2.349 -4.927 -24.707 1.00 0.00 H new ATOM 0 HA MET A 9 0.994 -3.211 -22.748 1.00 0.00 H new ATOM 0 HB2 MET A 9 0.869 -6.150 -23.492 1.00 0.00 H new ATOM 0 HB3 MET A 9 0.104 -5.533 -22.042 1.00 0.00 H new ATOM 0 HG2 MET A 9 -1.111 -3.857 -23.571 1.00 0.00 H new ATOM 0 HG3 MET A 9 -0.528 -4.816 -24.917 1.00 0.00 H new ATOM 0 HE1 MET A 9 -4.332 -5.464 -22.766 1.00 0.00 H new ATOM 0 HE2 MET A 9 -3.046 -4.488 -22.017 1.00 0.00 H new ATOM 0 HE3 MET A 9 -3.621 -4.096 -23.655 1.00 0.00 H new ATOM 42 N SER A 10 2.151 -3.936 -20.636 1.00 0.00 N ATOM 43 CA SER A 10 2.994 -4.150 -19.466 1.00 0.00 C ATOM 44 C SER A 10 2.297 -5.052 -18.452 1.00 0.00 C ATOM 45 O SER A 10 1.089 -5.272 -18.528 1.00 0.00 O ATOM 46 CB SER A 10 3.348 -2.812 -18.815 1.00 0.00 C ATOM 47 OG SER A 10 4.682 -2.812 -18.340 1.00 0.00 O ATOM 0 H SER A 10 1.331 -3.354 -20.464 1.00 0.00 H new ATOM 0 HA SER A 10 3.910 -4.641 -19.794 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.216 -2.007 -19.538 1.00 0.00 H new ATOM 0 HB3 SER A 10 2.665 -2.614 -17.989 1.00 0.00 H new ATOM 0 HG SER A 10 4.883 -1.945 -17.930 1.00 0.00 H new ATOM 53 N GLU A 11 3.068 -5.573 -17.503 1.00 0.00 N ATOM 54 CA GLU A 11 2.526 -6.452 -16.473 1.00 0.00 C ATOM 55 C GLU A 11 2.102 -5.652 -15.245 1.00 0.00 C ATOM 56 O GLU A 11 2.928 -5.312 -14.398 1.00 0.00 O ATOM 57 CB GLU A 11 3.561 -7.510 -16.081 1.00 0.00 C ATOM 58 CG GLU A 11 3.153 -8.926 -16.456 1.00 0.00 C ATOM 59 CD GLU A 11 3.363 -9.913 -15.324 1.00 0.00 C ATOM 60 OE1 GLU A 11 4.391 -9.803 -14.623 1.00 0.00 O ATOM 61 OE2 GLU A 11 2.500 -10.796 -15.139 1.00 0.00 O ATOM 0 H GLU A 11 4.071 -5.402 -17.426 1.00 0.00 H new ATOM 0 HA GLU A 11 1.646 -6.951 -16.879 1.00 0.00 H new ATOM 0 HB2 GLU A 11 4.510 -7.274 -16.563 1.00 0.00 H new ATOM 0 HB3 GLU A 11 3.729 -7.462 -15.005 1.00 0.00 H new ATOM 0 HG2 GLU A 11 2.103 -8.932 -16.748 1.00 0.00 H new ATOM 0 HG3 GLU A 11 3.728 -9.248 -17.325 1.00 0.00 H new ATOM 68 N LYS A 12 0.809 -5.353 -15.156 1.00 0.00 N ATOM 69 CA LYS A 12 0.277 -4.591 -14.034 1.00 0.00 C ATOM 70 C LYS A 12 -0.747 -5.408 -13.251 1.00 0.00 C ATOM 71 O LYS A 12 -1.574 -6.110 -13.834 1.00 0.00 O ATOM 72 CB LYS A 12 -0.362 -3.294 -14.533 1.00 0.00 C ATOM 73 CG LYS A 12 -1.488 -3.517 -15.532 1.00 0.00 C ATOM 74 CD LYS A 12 -2.791 -2.893 -15.056 1.00 0.00 C ATOM 75 CE LYS A 12 -3.992 -3.718 -15.486 1.00 0.00 C ATOM 76 NZ LYS A 12 -4.367 -4.731 -14.461 1.00 0.00 N ATOM 0 H LYS A 12 0.112 -5.627 -15.848 1.00 0.00 H new ATOM 0 HA LYS A 12 1.105 -4.350 -13.367 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -0.749 -2.737 -13.680 1.00 0.00 H new ATOM 0 HB3 LYS A 12 0.406 -2.674 -14.996 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -1.210 -3.090 -16.496 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.631 -4.586 -15.687 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -2.778 -2.805 -13.970 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -2.880 -1.883 -15.456 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -4.839 -3.057 -15.670 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.769 -4.220 -16.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -5.075 -5.381 -14.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.523 -5.269 -14.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -4.765 -4.252 -13.628 1.00 0.00 H new ATOM 90 N LEU A 13 -0.687 -5.307 -11.927 1.00 0.00 N ATOM 91 CA LEU A 13 -1.609 -6.032 -11.060 1.00 0.00 C ATOM 92 C LEU A 13 -2.956 -5.322 -10.987 1.00 0.00 C ATOM 93 O LEU A 13 -3.022 -4.093 -11.000 1.00 0.00 O ATOM 94 CB LEU A 13 -1.015 -6.172 -9.657 1.00 0.00 C ATOM 95 CG LEU A 13 -1.846 -7.007 -8.681 1.00 0.00 C ATOM 96 CD1 LEU A 13 -1.910 -8.456 -9.140 1.00 0.00 C ATOM 97 CD2 LEU A 13 -1.266 -6.918 -7.277 1.00 0.00 C ATOM 0 H LEU A 13 -0.009 -4.729 -11.431 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.765 -7.025 -11.482 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.025 -6.619 -9.742 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -0.880 -5.176 -9.235 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.860 -6.607 -8.661 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.505 -9.035 -8.434 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.369 -8.505 -10.127 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -0.902 -8.867 -9.188 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.869 -7.518 -6.595 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.243 -7.293 -7.282 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.270 -5.879 -6.947 1.00 0.00 H new ATOM 109 N ARG A 14 -4.031 -6.101 -10.912 1.00 0.00 N ATOM 110 CA ARG A 14 -5.376 -5.542 -10.839 1.00 0.00 C ATOM 111 C ARG A 14 -5.637 -4.916 -9.474 1.00 0.00 C ATOM 112 O ARG A 14 -5.927 -5.615 -8.503 1.00 0.00 O ATOM 113 CB ARG A 14 -6.421 -6.619 -11.125 1.00 0.00 C ATOM 114 CG ARG A 14 -6.134 -7.432 -12.376 1.00 0.00 C ATOM 115 CD ARG A 14 -7.074 -8.621 -12.499 1.00 0.00 C ATOM 116 NE ARG A 14 -6.379 -9.891 -12.307 1.00 0.00 N ATOM 117 CZ ARG A 14 -5.648 -10.486 -13.249 1.00 0.00 C ATOM 118 NH1 ARG A 14 -5.517 -9.929 -14.447 1.00 0.00 N ATOM 119 NH2 ARG A 14 -5.047 -11.638 -12.991 1.00 0.00 N ATOM 0 H ARG A 14 -3.997 -7.120 -10.900 1.00 0.00 H new ATOM 0 HA ARG A 14 -5.453 -4.762 -11.597 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -6.479 -7.293 -10.270 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -7.398 -6.147 -11.226 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -6.235 -6.796 -13.255 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -5.103 -7.784 -12.353 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -7.872 -8.530 -11.762 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -7.545 -8.611 -13.482 1.00 0.00 H new ATOM 0 HE ARG A 14 -6.458 -10.349 -11.399 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -5.977 -9.042 -14.650 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -4.956 -10.389 -15.165 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -5.144 -12.069 -12.072 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -4.487 -12.094 -13.712 1.00 0.00 H new ATOM 133 N ILE A 15 -5.533 -3.597 -9.411 1.00 0.00 N ATOM 134 CA ILE A 15 -5.757 -2.865 -8.172 1.00 0.00 C ATOM 135 C ILE A 15 -6.497 -1.559 -8.439 1.00 0.00 C ATOM 136 O ILE A 15 -6.188 -0.846 -9.394 1.00 0.00 O ATOM 137 CB ILE A 15 -4.423 -2.561 -7.467 1.00 0.00 C ATOM 138 CG1 ILE A 15 -3.637 -3.854 -7.247 1.00 0.00 C ATOM 139 CG2 ILE A 15 -4.662 -1.847 -6.144 1.00 0.00 C ATOM 140 CD1 ILE A 15 -2.239 -3.631 -6.715 1.00 0.00 C ATOM 0 H ILE A 15 -5.293 -3.008 -10.209 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.367 -3.494 -7.524 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.837 -1.900 -8.106 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.185 -4.488 -6.550 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.575 -4.397 -8.190 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.705 -1.642 -5.663 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -5.185 -0.908 -6.326 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -5.267 -2.479 -5.494 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.742 -4.592 -6.584 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.673 -3.023 -7.421 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.293 -3.116 -5.756 1.00 0.00 H new ATOM 152 N LYS A 16 -7.476 -1.248 -7.594 1.00 0.00 N ATOM 153 CA LYS A 16 -8.255 -0.025 -7.749 1.00 0.00 C ATOM 154 C LYS A 16 -8.749 0.480 -6.399 1.00 0.00 C ATOM 155 O LYS A 16 -9.565 -0.167 -5.743 1.00 0.00 O ATOM 156 CB LYS A 16 -9.441 -0.262 -8.685 1.00 0.00 C ATOM 157 CG LYS A 16 -10.194 -1.554 -8.404 1.00 0.00 C ATOM 158 CD LYS A 16 -10.410 -2.366 -9.671 1.00 0.00 C ATOM 159 CE LYS A 16 -11.836 -2.883 -9.768 1.00 0.00 C ATOM 160 NZ LYS A 16 -12.138 -3.884 -8.708 1.00 0.00 N ATOM 0 H LYS A 16 -7.748 -1.824 -6.798 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.606 0.735 -8.185 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.132 0.577 -8.601 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -9.083 -0.277 -9.714 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.637 -2.150 -7.681 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -11.158 -1.322 -7.952 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.186 -1.750 -10.542 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -9.716 -3.206 -9.688 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.531 -2.047 -9.687 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -11.993 -3.334 -10.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -13.120 -4.211 -8.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -11.492 -4.694 -8.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -12.014 -3.447 -7.772 1.00 0.00 H new ATOM 174 N VAL A 17 -8.248 1.640 -5.990 1.00 0.00 N ATOM 175 CA VAL A 17 -8.637 2.234 -4.716 1.00 0.00 C ATOM 176 C VAL A 17 -9.481 3.485 -4.933 1.00 0.00 C ATOM 177 O VAL A 17 -8.969 4.530 -5.332 1.00 0.00 O ATOM 178 CB VAL A 17 -7.408 2.603 -3.860 1.00 0.00 C ATOM 179 CG1 VAL A 17 -7.803 2.734 -2.399 1.00 0.00 C ATOM 180 CG2 VAL A 17 -6.298 1.573 -4.025 1.00 0.00 C ATOM 0 H VAL A 17 -7.572 2.188 -6.522 1.00 0.00 H new ATOM 0 HA VAL A 17 -9.223 1.484 -4.186 1.00 0.00 H new ATOM 0 HB VAL A 17 -7.028 3.564 -4.206 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.926 2.995 -1.807 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.556 3.515 -2.294 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.211 1.787 -2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -5.444 1.857 -3.411 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.661 0.594 -3.711 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.994 1.530 -5.071 1.00 0.00 H new ATOM 190 N ASP A 18 -10.778 3.371 -4.668 1.00 0.00 N ATOM 191 CA ASP A 18 -11.693 4.494 -4.836 1.00 0.00 C ATOM 192 C ASP A 18 -12.654 4.599 -3.657 1.00 0.00 C ATOM 193 O ASP A 18 -13.784 5.068 -3.805 1.00 0.00 O ATOM 194 CB ASP A 18 -12.480 4.346 -6.139 1.00 0.00 C ATOM 195 CG ASP A 18 -12.664 5.669 -6.857 1.00 0.00 C ATOM 196 OD1 ASP A 18 -11.721 6.106 -7.549 1.00 0.00 O ATOM 197 OD2 ASP A 18 -13.752 6.268 -6.726 1.00 0.00 O ATOM 0 H ASP A 18 -11.219 2.513 -4.336 1.00 0.00 H new ATOM 0 HA ASP A 18 -11.100 5.408 -4.878 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -11.961 3.648 -6.796 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -13.457 3.914 -5.923 1.00 0.00 H new ATOM 202 N ASP A 19 -12.202 4.163 -2.485 1.00 0.00 N ATOM 203 CA ASP A 19 -13.026 4.212 -1.284 1.00 0.00 C ATOM 204 C ASP A 19 -12.233 4.757 -0.101 1.00 0.00 C ATOM 205 O ASP A 19 -11.071 4.401 0.098 1.00 0.00 O ATOM 206 CB ASP A 19 -13.566 2.820 -0.953 1.00 0.00 C ATOM 207 CG ASP A 19 -14.849 2.873 -0.147 1.00 0.00 C ATOM 208 OD1 ASP A 19 -14.834 3.464 0.954 1.00 0.00 O ATOM 209 OD2 ASP A 19 -15.868 2.325 -0.616 1.00 0.00 O ATOM 0 H ASP A 19 -11.271 3.772 -2.342 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.863 4.883 -1.476 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -13.744 2.273 -1.879 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.812 2.264 -0.395 1.00 0.00 H new ATOM 214 N VAL A 20 -12.867 5.624 0.682 1.00 0.00 N ATOM 215 CA VAL A 20 -12.221 6.218 1.845 1.00 0.00 C ATOM 216 C VAL A 20 -13.241 6.563 2.924 1.00 0.00 C ATOM 217 O VAL A 20 -14.103 7.419 2.727 1.00 0.00 O ATOM 218 CB VAL A 20 -11.442 7.492 1.465 1.00 0.00 C ATOM 219 CG1 VAL A 20 -10.614 7.984 2.643 1.00 0.00 C ATOM 220 CG2 VAL A 20 -10.559 7.235 0.254 1.00 0.00 C ATOM 0 H VAL A 20 -13.828 5.930 0.531 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.523 5.476 2.233 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.159 8.271 1.205 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.071 8.884 2.355 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -11.273 8.210 3.482 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.904 7.211 2.937 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.016 8.145 -0.000 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.848 6.441 0.484 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -11.179 6.934 -0.591 1.00 0.00 H new ATOM 230 N LYS A 21 -13.137 5.890 4.066 1.00 0.00 N ATOM 231 CA LYS A 21 -14.051 6.126 5.177 1.00 0.00 C ATOM 232 C LYS A 21 -13.419 7.049 6.215 1.00 0.00 C ATOM 233 O LYS A 21 -12.515 6.648 6.948 1.00 0.00 O ATOM 234 CB LYS A 21 -14.450 4.798 5.827 1.00 0.00 C ATOM 235 CG LYS A 21 -15.899 4.413 5.580 1.00 0.00 C ATOM 236 CD LYS A 21 -16.189 2.997 6.053 1.00 0.00 C ATOM 237 CE LYS A 21 -17.552 2.896 6.720 1.00 0.00 C ATOM 238 NZ LYS A 21 -18.379 1.809 6.129 1.00 0.00 N ATOM 0 H LYS A 21 -12.429 5.178 4.246 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.945 6.612 4.785 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -13.803 4.008 5.447 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -14.278 4.862 6.901 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.555 5.112 6.098 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.122 4.495 4.516 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.147 2.314 5.205 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -15.416 2.682 6.754 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -17.422 2.714 7.787 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -18.076 3.846 6.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -19.300 1.773 6.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.525 1.995 5.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.891 0.898 6.247 1.00 0.00 H new ATOM 252 N ILE A 22 -13.900 8.286 6.270 1.00 0.00 N ATOM 253 CA ILE A 22 -13.383 9.267 7.214 1.00 0.00 C ATOM 254 C ILE A 22 -13.852 8.964 8.634 1.00 0.00 C ATOM 255 O ILE A 22 -14.992 9.253 8.997 1.00 0.00 O ATOM 256 CB ILE A 22 -13.821 10.695 6.839 1.00 0.00 C ATOM 257 CG1 ILE A 22 -13.606 10.948 5.345 1.00 0.00 C ATOM 258 CG2 ILE A 22 -13.059 11.714 7.668 1.00 0.00 C ATOM 259 CD1 ILE A 22 -12.172 10.759 4.901 1.00 0.00 C ATOM 0 H ILE A 22 -14.649 8.633 5.670 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.296 9.204 7.169 1.00 0.00 H new ATOM 0 HB ILE A 22 -14.885 10.799 7.053 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -14.246 10.275 4.775 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -13.921 11.964 5.108 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.378 12.719 7.393 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -13.261 11.546 8.726 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -11.990 11.609 7.481 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -12.093 10.955 3.832 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.529 11.451 5.445 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.859 9.735 5.106 1.00 0.00 H new ATOM 271 N ASN A 23 -12.964 8.383 9.434 1.00 0.00 N ATOM 272 CA ASN A 23 -13.289 8.045 10.816 1.00 0.00 C ATOM 273 C ASN A 23 -12.796 9.132 11.770 1.00 0.00 C ATOM 274 O ASN A 23 -11.730 9.711 11.563 1.00 0.00 O ATOM 275 CB ASN A 23 -12.670 6.697 11.193 1.00 0.00 C ATOM 276 CG ASN A 23 -13.573 5.879 12.094 1.00 0.00 C ATOM 277 OD1 ASN A 23 -14.744 5.658 11.784 1.00 0.00 O ATOM 278 ND2 ASN A 23 -13.033 5.424 13.218 1.00 0.00 N ATOM 0 H ASN A 23 -12.016 8.137 9.150 1.00 0.00 H new ATOM 0 HA ASN A 23 -14.373 7.974 10.903 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -12.457 6.131 10.286 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.717 6.865 11.694 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -13.593 4.867 13.864 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -12.058 5.631 13.436 1.00 0.00 H new ATOM 285 N PRO A 24 -13.567 9.423 12.832 1.00 0.00 N ATOM 286 CA PRO A 24 -13.200 10.448 13.817 1.00 0.00 C ATOM 287 C PRO A 24 -11.801 10.234 14.386 1.00 0.00 C ATOM 288 O PRO A 24 -11.172 11.171 14.878 1.00 0.00 O ATOM 289 CB PRO A 24 -14.253 10.284 14.915 1.00 0.00 C ATOM 290 CG PRO A 24 -15.424 9.668 14.231 1.00 0.00 C ATOM 291 CD PRO A 24 -14.856 8.782 13.157 1.00 0.00 C ATOM 0 HA PRO A 24 -13.178 11.444 13.375 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -13.887 9.649 15.722 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -14.515 11.245 15.359 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -16.028 9.093 14.933 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -16.073 10.432 13.804 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -14.719 7.760 13.510 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -15.511 8.734 12.287 1.00 0.00 H new ATOM 299 N LYS A 25 -11.320 8.997 14.323 1.00 0.00 N ATOM 300 CA LYS A 25 -9.997 8.665 14.839 1.00 0.00 C ATOM 301 C LYS A 25 -8.947 8.709 13.732 1.00 0.00 C ATOM 302 O LYS A 25 -7.796 9.079 13.971 1.00 0.00 O ATOM 303 CB LYS A 25 -10.012 7.279 15.486 1.00 0.00 C ATOM 304 CG LYS A 25 -10.473 7.290 16.934 1.00 0.00 C ATOM 305 CD LYS A 25 -9.451 7.958 17.841 1.00 0.00 C ATOM 306 CE LYS A 25 -8.442 6.956 18.381 1.00 0.00 C ATOM 307 NZ LYS A 25 -8.567 6.783 19.855 1.00 0.00 N ATOM 0 H LYS A 25 -11.826 8.208 13.920 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.734 9.409 15.591 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.666 6.625 14.910 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.010 6.852 15.435 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.425 7.815 17.009 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.645 6.267 17.270 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.929 8.739 17.288 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.963 8.443 18.672 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -8.586 5.994 17.889 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.433 7.290 18.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.862 6.093 20.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.404 7.696 20.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.522 6.440 20.085 1.00 0.00 H new ATOM 321 N TYR A 26 -9.346 8.328 12.522 1.00 0.00 N ATOM 322 CA TYR A 26 -8.431 8.324 11.385 1.00 0.00 C ATOM 323 C TYR A 26 -9.166 8.001 10.089 1.00 0.00 C ATOM 324 O TYR A 26 -10.274 7.462 10.107 1.00 0.00 O ATOM 325 CB TYR A 26 -7.309 7.310 11.612 1.00 0.00 C ATOM 326 CG TYR A 26 -7.799 5.958 12.082 1.00 0.00 C ATOM 327 CD1 TYR A 26 -8.588 5.161 11.264 1.00 0.00 C ATOM 328 CD2 TYR A 26 -7.471 5.479 13.345 1.00 0.00 C ATOM 329 CE1 TYR A 26 -9.039 3.926 11.690 1.00 0.00 C ATOM 330 CE2 TYR A 26 -7.916 4.245 13.778 1.00 0.00 C ATOM 331 CZ TYR A 26 -8.699 3.472 12.947 1.00 0.00 C ATOM 332 OH TYR A 26 -9.145 2.243 13.374 1.00 0.00 O ATOM 0 H TYR A 26 -10.293 8.019 12.304 1.00 0.00 H new ATOM 0 HA TYR A 26 -8.002 9.322 11.296 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.753 7.183 10.683 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.612 7.711 12.348 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -8.854 5.512 10.278 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -6.858 6.082 13.999 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.654 3.320 11.042 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -7.652 3.888 14.762 1.00 0.00 H new ATOM 0 HH TYR A 26 -8.816 2.073 14.281 1.00 0.00 H new ATOM 342 N VAL A 27 -8.542 8.333 8.963 1.00 0.00 N ATOM 343 CA VAL A 27 -9.133 8.080 7.654 1.00 0.00 C ATOM 344 C VAL A 27 -8.597 6.784 7.053 1.00 0.00 C ATOM 345 O VAL A 27 -7.385 6.587 6.959 1.00 0.00 O ATOM 346 CB VAL A 27 -8.854 9.238 6.676 1.00 0.00 C ATOM 347 CG1 VAL A 27 -9.684 9.084 5.412 1.00 0.00 C ATOM 348 CG2 VAL A 27 -9.125 10.582 7.343 1.00 0.00 C ATOM 0 H VAL A 27 -7.625 8.779 8.931 1.00 0.00 H new ATOM 0 HA VAL A 27 -10.209 7.993 7.804 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.801 9.204 6.396 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.472 9.911 4.735 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.433 8.142 4.924 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.743 9.088 5.670 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.922 11.386 6.636 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -10.168 10.629 7.657 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -8.479 10.693 8.214 1.00 0.00 H new ATOM 358 N LEU A 28 -9.507 5.902 6.648 1.00 0.00 N ATOM 359 CA LEU A 28 -9.122 4.625 6.058 1.00 0.00 C ATOM 360 C LEU A 28 -9.241 4.663 4.538 1.00 0.00 C ATOM 361 O LEU A 28 -9.950 5.502 3.980 1.00 0.00 O ATOM 362 CB LEU A 28 -9.990 3.497 6.622 1.00 0.00 C ATOM 363 CG LEU A 28 -9.925 3.324 8.141 1.00 0.00 C ATOM 364 CD1 LEU A 28 -10.634 2.046 8.563 1.00 0.00 C ATOM 365 CD2 LEU A 28 -8.480 3.315 8.615 1.00 0.00 C ATOM 0 H LEU A 28 -10.514 6.049 6.718 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.079 4.437 6.315 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.026 3.680 6.337 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.691 2.560 6.152 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.434 4.168 8.606 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.578 1.939 9.646 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -11.679 2.092 8.257 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.154 1.190 8.089 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.453 3.191 9.698 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.947 2.490 8.142 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.003 4.257 8.346 1.00 0.00 H new ATOM 377 N TYR A 29 -8.543 3.748 3.874 1.00 0.00 N ATOM 378 CA TYR A 29 -8.567 3.671 2.418 1.00 0.00 C ATOM 379 C TYR A 29 -8.981 2.277 1.957 1.00 0.00 C ATOM 380 O TYR A 29 -8.354 1.283 2.318 1.00 0.00 O ATOM 381 CB TYR A 29 -7.192 4.022 1.845 1.00 0.00 C ATOM 382 CG TYR A 29 -6.969 5.507 1.671 1.00 0.00 C ATOM 383 CD1 TYR A 29 -6.547 6.296 2.733 1.00 0.00 C ATOM 384 CD2 TYR A 29 -7.179 6.118 0.442 1.00 0.00 C ATOM 385 CE1 TYR A 29 -6.342 7.653 2.576 1.00 0.00 C ATOM 386 CE2 TYR A 29 -6.974 7.475 0.275 1.00 0.00 C ATOM 387 CZ TYR A 29 -6.557 8.238 1.346 1.00 0.00 C ATOM 388 OH TYR A 29 -6.350 9.591 1.187 1.00 0.00 O ATOM 0 H TYR A 29 -7.952 3.048 4.322 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.300 4.390 2.052 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.421 3.622 2.503 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -7.074 3.530 0.880 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.376 5.841 3.698 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -7.508 5.523 -0.397 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -6.015 8.253 3.412 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -7.139 7.935 -0.688 1.00 0.00 H new ATOM 0 HH TYR A 29 -6.606 9.857 0.279 1.00 0.00 H new ATOM 398 N GLY A 30 -10.042 2.213 1.158 1.00 0.00 N ATOM 399 CA GLY A 30 -10.519 0.934 0.666 1.00 0.00 C ATOM 400 C GLY A 30 -9.841 0.516 -0.623 1.00 0.00 C ATOM 401 O GLY A 30 -10.214 0.974 -1.703 1.00 0.00 O ATOM 0 H GLY A 30 -10.578 3.022 0.844 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.350 0.171 1.425 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -11.596 0.990 0.505 1.00 0.00 H new ATOM 405 N VAL A 31 -8.847 -0.358 -0.509 1.00 0.00 N ATOM 406 CA VAL A 31 -8.115 -0.840 -1.676 1.00 0.00 C ATOM 407 C VAL A 31 -8.810 -2.049 -2.288 1.00 0.00 C ATOM 408 O VAL A 31 -8.825 -3.134 -1.706 1.00 0.00 O ATOM 409 CB VAL A 31 -6.666 -1.219 -1.313 1.00 0.00 C ATOM 410 CG1 VAL A 31 -5.881 -1.599 -2.561 1.00 0.00 C ATOM 411 CG2 VAL A 31 -5.986 -0.078 -0.571 1.00 0.00 C ATOM 0 H VAL A 31 -8.529 -0.747 0.379 1.00 0.00 H new ATOM 0 HA VAL A 31 -8.095 -0.027 -2.402 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.692 -2.086 -0.653 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.861 -1.863 -2.283 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -6.357 -2.452 -3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.862 -0.755 -3.250 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.964 -0.363 -0.323 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.971 0.810 -1.203 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.535 0.138 0.345 1.00 0.00 H new ATOM 421 N SER A 32 -9.391 -1.851 -3.467 1.00 0.00 N ATOM 422 CA SER A 32 -10.098 -2.923 -4.161 1.00 0.00 C ATOM 423 C SER A 32 -9.134 -3.793 -4.960 1.00 0.00 C ATOM 424 O SER A 32 -8.255 -3.286 -5.658 1.00 0.00 O ATOM 425 CB SER A 32 -11.166 -2.341 -5.089 1.00 0.00 C ATOM 426 OG SER A 32 -11.760 -1.186 -4.522 1.00 0.00 O ATOM 0 H SER A 32 -9.387 -0.959 -3.962 1.00 0.00 H new ATOM 0 HA SER A 32 -10.579 -3.548 -3.408 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.719 -2.089 -6.050 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.933 -3.091 -5.281 1.00 0.00 H new ATOM 0 HG SER A 32 -11.215 -0.400 -4.735 1.00 0.00 H new ATOM 432 N THR A 33 -9.305 -5.107 -4.852 1.00 0.00 N ATOM 433 CA THR A 33 -8.452 -6.051 -5.564 1.00 0.00 C ATOM 434 C THR A 33 -9.207 -7.348 -5.851 1.00 0.00 C ATOM 435 O THR A 33 -10.232 -7.625 -5.229 1.00 0.00 O ATOM 436 CB THR A 33 -7.195 -6.346 -4.744 1.00 0.00 C ATOM 437 OG1 THR A 33 -7.528 -6.605 -3.392 1.00 0.00 O ATOM 438 CG2 THR A 33 -6.194 -5.210 -4.760 1.00 0.00 C ATOM 0 H THR A 33 -10.027 -5.542 -4.278 1.00 0.00 H new ATOM 0 HA THR A 33 -8.160 -5.603 -6.514 1.00 0.00 H new ATOM 0 HB THR A 33 -6.740 -7.219 -5.212 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.711 -6.793 -2.884 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.325 -5.482 -4.160 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.880 -5.016 -5.786 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.655 -4.313 -4.346 1.00 0.00 H new ATOM 446 N PRO A 34 -8.710 -8.163 -6.803 1.00 0.00 N ATOM 447 CA PRO A 34 -9.342 -9.431 -7.169 1.00 0.00 C ATOM 448 C PRO A 34 -9.868 -10.196 -5.958 1.00 0.00 C ATOM 449 O PRO A 34 -10.870 -10.905 -6.045 1.00 0.00 O ATOM 450 CB PRO A 34 -8.204 -10.194 -7.838 1.00 0.00 C ATOM 451 CG PRO A 34 -7.373 -9.135 -8.476 1.00 0.00 C ATOM 452 CD PRO A 34 -7.492 -7.911 -7.600 1.00 0.00 C ATOM 0 HA PRO A 34 -10.217 -9.289 -7.804 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -7.628 -10.767 -7.111 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.580 -10.902 -8.576 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.334 -9.454 -8.558 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.722 -8.924 -9.487 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.616 -7.788 -6.963 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -7.584 -7.002 -8.194 1.00 0.00 H new ATOM 460 N ASN A 35 -9.190 -10.034 -4.828 1.00 0.00 N ATOM 461 CA ASN A 35 -9.594 -10.698 -3.596 1.00 0.00 C ATOM 462 C ASN A 35 -10.774 -9.969 -2.964 1.00 0.00 C ATOM 463 O ASN A 35 -11.814 -10.569 -2.692 1.00 0.00 O ATOM 464 CB ASN A 35 -8.422 -10.755 -2.613 1.00 0.00 C ATOM 465 CG ASN A 35 -7.712 -12.095 -2.637 1.00 0.00 C ATOM 466 OD1 ASN A 35 -7.352 -12.638 -1.593 1.00 0.00 O ATOM 467 ND2 ASN A 35 -7.505 -12.634 -3.833 1.00 0.00 N ATOM 0 H ASN A 35 -8.359 -9.449 -4.740 1.00 0.00 H new ATOM 0 HA ASN A 35 -9.899 -11.717 -3.836 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -7.710 -9.965 -2.854 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -8.787 -10.558 -1.605 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -7.030 -13.533 -3.912 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -7.821 -12.149 -4.673 1.00 0.00 H new ATOM 474 N LYS A 36 -10.604 -8.666 -2.741 1.00 0.00 N ATOM 475 CA LYS A 36 -11.652 -7.836 -2.146 1.00 0.00 C ATOM 476 C LYS A 36 -11.092 -6.488 -1.704 1.00 0.00 C ATOM 477 O LYS A 36 -9.909 -6.202 -1.895 1.00 0.00 O ATOM 478 CB LYS A 36 -12.298 -8.543 -0.950 1.00 0.00 C ATOM 479 CG LYS A 36 -11.298 -9.218 -0.024 1.00 0.00 C ATOM 480 CD LYS A 36 -11.748 -10.619 0.361 1.00 0.00 C ATOM 481 CE LYS A 36 -13.079 -10.594 1.094 1.00 0.00 C ATOM 482 NZ LYS A 36 -14.219 -10.903 0.188 1.00 0.00 N ATOM 0 H LYS A 36 -9.747 -8.160 -2.964 1.00 0.00 H new ATOM 0 HA LYS A 36 -12.413 -7.670 -2.909 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.875 -7.816 -0.379 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -13.001 -9.291 -1.318 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -10.325 -9.269 -0.513 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.171 -8.616 0.876 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -11.836 -11.233 -0.535 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.992 -11.084 0.993 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -13.058 -11.317 1.910 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -13.228 -9.612 1.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -14.901 -11.512 0.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -14.687 -10.018 -0.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -13.867 -11.395 -0.658 1.00 0.00 H new ATOM 496 N ARG A 37 -11.950 -5.663 -1.111 1.00 0.00 N ATOM 497 CA ARG A 37 -11.544 -4.345 -0.639 1.00 0.00 C ATOM 498 C ARG A 37 -10.849 -4.445 0.716 1.00 0.00 C ATOM 499 O ARG A 37 -11.322 -5.136 1.618 1.00 0.00 O ATOM 500 CB ARG A 37 -12.760 -3.419 -0.540 1.00 0.00 C ATOM 501 CG ARG A 37 -12.759 -2.301 -1.570 1.00 0.00 C ATOM 502 CD ARG A 37 -13.366 -1.026 -1.008 1.00 0.00 C ATOM 503 NE ARG A 37 -14.678 -1.262 -0.411 1.00 0.00 N ATOM 504 CZ ARG A 37 -15.780 -1.502 -1.116 1.00 0.00 C ATOM 505 NH1 ARG A 37 -15.732 -1.542 -2.442 1.00 0.00 N ATOM 506 NH2 ARG A 37 -16.934 -1.704 -0.495 1.00 0.00 N ATOM 0 H ARG A 37 -12.932 -5.885 -0.946 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.839 -3.928 -1.358 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -13.668 -4.011 -0.659 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -12.793 -2.982 0.458 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -11.737 -2.106 -1.896 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -13.320 -2.615 -2.450 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -12.696 -0.606 -0.258 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.457 -0.287 -1.804 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.754 -1.242 0.606 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -14.847 -1.388 -2.925 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -16.580 -1.726 -2.978 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -16.977 -1.675 0.524 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -17.779 -1.888 -1.036 1.00 0.00 H new ATOM 520 N LEU A 38 -9.723 -3.751 0.852 1.00 0.00 N ATOM 521 CA LEU A 38 -8.964 -3.764 2.098 1.00 0.00 C ATOM 522 C LEU A 38 -8.811 -2.353 2.657 1.00 0.00 C ATOM 523 O LEU A 38 -8.238 -1.476 2.011 1.00 0.00 O ATOM 524 CB LEU A 38 -7.588 -4.396 1.872 1.00 0.00 C ATOM 525 CG LEU A 38 -7.404 -5.784 2.491 1.00 0.00 C ATOM 526 CD1 LEU A 38 -6.561 -6.667 1.584 1.00 0.00 C ATOM 527 CD2 LEU A 38 -6.770 -5.671 3.868 1.00 0.00 C ATOM 0 H LEU A 38 -9.317 -3.173 0.116 1.00 0.00 H new ATOM 0 HA LEU A 38 -9.513 -4.361 2.826 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.409 -4.467 0.799 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.827 -3.730 2.279 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.385 -6.246 2.600 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.441 -7.649 2.041 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.055 -6.774 0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.581 -6.212 1.441 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.646 -6.666 4.294 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.796 -5.189 3.782 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.413 -5.076 4.517 1.00 0.00 H new ATOM 539 N TYR A 39 -9.329 -2.141 3.864 1.00 0.00 N ATOM 540 CA TYR A 39 -9.251 -0.838 4.514 1.00 0.00 C ATOM 541 C TYR A 39 -7.914 -0.661 5.225 1.00 0.00 C ATOM 542 O TYR A 39 -7.620 -1.357 6.197 1.00 0.00 O ATOM 543 CB TYR A 39 -10.397 -0.674 5.513 1.00 0.00 C ATOM 544 CG TYR A 39 -11.740 -0.425 4.863 1.00 0.00 C ATOM 545 CD1 TYR A 39 -11.871 0.485 3.822 1.00 0.00 C ATOM 546 CD2 TYR A 39 -12.876 -1.099 5.292 1.00 0.00 C ATOM 547 CE1 TYR A 39 -13.096 0.715 3.226 1.00 0.00 C ATOM 548 CE2 TYR A 39 -14.105 -0.875 4.701 1.00 0.00 C ATOM 549 CZ TYR A 39 -14.210 0.033 3.669 1.00 0.00 C ATOM 550 OH TYR A 39 -15.431 0.260 3.078 1.00 0.00 O ATOM 0 H TYR A 39 -9.808 -2.856 4.411 1.00 0.00 H new ATOM 0 HA TYR A 39 -9.336 -0.072 3.743 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -10.462 -1.571 6.128 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -10.168 0.155 6.182 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -11.001 1.022 3.473 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -12.798 -1.810 6.101 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -13.181 1.425 2.417 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -14.978 -1.408 5.046 1.00 0.00 H new ATOM 0 HH TYR A 39 -16.111 -0.301 3.506 1.00 0.00 H new ATOM 560 N LYS A 40 -7.108 0.276 4.737 1.00 0.00 N ATOM 561 CA LYS A 40 -5.803 0.546 5.327 1.00 0.00 C ATOM 562 C LYS A 40 -5.603 2.044 5.536 1.00 0.00 C ATOM 563 O LYS A 40 -6.433 2.855 5.127 1.00 0.00 O ATOM 564 CB LYS A 40 -4.690 -0.011 4.437 1.00 0.00 C ATOM 565 CG LYS A 40 -3.496 -0.540 5.216 1.00 0.00 C ATOM 566 CD LYS A 40 -3.404 -2.057 5.140 1.00 0.00 C ATOM 567 CE LYS A 40 -3.214 -2.535 3.710 1.00 0.00 C ATOM 568 NZ LYS A 40 -4.436 -3.202 3.181 1.00 0.00 N ATOM 0 H LYS A 40 -7.336 0.861 3.934 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.761 0.052 6.298 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.096 -0.813 3.821 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -4.352 0.772 3.758 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -2.580 -0.099 4.822 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -3.576 -0.232 6.258 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.572 -2.403 5.753 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -4.310 -2.498 5.554 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -2.959 -1.687 3.074 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -2.374 -3.229 3.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -4.545 -2.977 2.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -4.348 -4.232 3.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -5.270 -2.864 3.703 1.00 0.00 H new ATOM 582 N ARG A 41 -4.495 2.403 6.177 1.00 0.00 N ATOM 583 CA ARG A 41 -4.186 3.803 6.442 1.00 0.00 C ATOM 584 C ARG A 41 -2.976 4.258 5.631 1.00 0.00 C ATOM 585 O ARG A 41 -2.134 3.445 5.247 1.00 0.00 O ATOM 586 CB ARG A 41 -3.921 4.012 7.936 1.00 0.00 C ATOM 587 CG ARG A 41 -5.077 4.667 8.673 1.00 0.00 C ATOM 588 CD ARG A 41 -4.596 5.784 9.587 1.00 0.00 C ATOM 589 NE ARG A 41 -4.505 7.062 8.885 1.00 0.00 N ATOM 590 CZ ARG A 41 -3.874 8.130 9.371 1.00 0.00 C ATOM 591 NH1 ARG A 41 -3.282 8.077 10.557 1.00 0.00 N ATOM 592 NH2 ARG A 41 -3.836 9.253 8.667 1.00 0.00 N ATOM 0 H ARG A 41 -3.797 1.744 6.522 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.046 4.402 6.143 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.707 3.048 8.397 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.029 4.627 8.056 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.789 5.067 7.952 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.606 3.917 9.261 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -5.279 5.881 10.431 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.619 5.524 9.995 1.00 0.00 H new ATOM 0 HE ARG A 41 -4.950 7.141 7.971 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.308 7.215 11.102 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.800 8.898 10.924 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -4.290 9.298 7.755 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -3.353 10.071 9.038 1.00 0.00 H new ATOM 606 N TYR A 42 -2.892 5.560 5.378 1.00 0.00 N ATOM 607 CA TYR A 42 -1.781 6.121 4.616 1.00 0.00 C ATOM 608 C TYR A 42 -0.450 5.785 5.281 1.00 0.00 C ATOM 609 O TYR A 42 0.464 5.263 4.639 1.00 0.00 O ATOM 610 CB TYR A 42 -1.935 7.638 4.494 1.00 0.00 C ATOM 611 CG TYR A 42 -0.892 8.283 3.608 1.00 0.00 C ATOM 612 CD1 TYR A 42 -0.919 8.107 2.230 1.00 0.00 C ATOM 613 CD2 TYR A 42 0.116 9.069 4.149 1.00 0.00 C ATOM 614 CE1 TYR A 42 0.030 8.696 1.417 1.00 0.00 C ATOM 615 CE2 TYR A 42 1.070 9.661 3.344 1.00 0.00 C ATOM 616 CZ TYR A 42 1.022 9.472 1.979 1.00 0.00 C ATOM 617 OH TYR A 42 1.970 10.060 1.173 1.00 0.00 O ATOM 0 H TYR A 42 -3.579 6.246 5.689 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.793 5.682 3.619 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -2.925 7.864 4.099 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.880 8.082 5.488 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -1.695 7.500 1.787 1.00 0.00 H new ATOM 0 HD2 TYR A 42 0.155 9.220 5.218 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -0.005 8.550 0.348 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.849 10.268 3.781 1.00 0.00 H new ATOM 0 HH TYR A 42 2.833 9.614 1.304 1.00 0.00 H new ATOM 627 N SER A 43 -0.353 6.078 6.574 1.00 0.00 N ATOM 628 CA SER A 43 0.860 5.797 7.329 1.00 0.00 C ATOM 629 C SER A 43 1.189 4.308 7.281 1.00 0.00 C ATOM 630 O SER A 43 2.349 3.913 7.390 1.00 0.00 O ATOM 631 CB SER A 43 0.701 6.252 8.782 1.00 0.00 C ATOM 632 OG SER A 43 1.877 6.890 9.248 1.00 0.00 O ATOM 0 H SER A 43 -1.100 6.509 7.119 1.00 0.00 H new ATOM 0 HA SER A 43 1.682 6.350 6.874 1.00 0.00 H new ATOM 0 HB2 SER A 43 -0.144 6.936 8.862 1.00 0.00 H new ATOM 0 HB3 SER A 43 0.475 5.392 9.413 1.00 0.00 H new ATOM 0 HG SER A 43 1.749 7.173 10.178 1.00 0.00 H new ATOM 638 N GLU A 44 0.155 3.488 7.110 1.00 0.00 N ATOM 639 CA GLU A 44 0.330 2.042 7.039 1.00 0.00 C ATOM 640 C GLU A 44 1.240 1.672 5.874 1.00 0.00 C ATOM 641 O GLU A 44 2.161 0.868 6.023 1.00 0.00 O ATOM 642 CB GLU A 44 -1.025 1.349 6.887 1.00 0.00 C ATOM 643 CG GLU A 44 -1.088 -0.016 7.554 1.00 0.00 C ATOM 644 CD GLU A 44 -1.959 -0.020 8.795 1.00 0.00 C ATOM 645 OE1 GLU A 44 -3.195 -0.136 8.652 1.00 0.00 O ATOM 646 OE2 GLU A 44 -1.407 0.096 9.909 1.00 0.00 O ATOM 0 H GLU A 44 -0.811 3.801 7.018 1.00 0.00 H new ATOM 0 HA GLU A 44 0.795 1.706 7.966 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.800 1.988 7.311 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.249 1.237 5.826 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.473 -0.746 6.842 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.080 -0.332 7.821 1.00 0.00 H new ATOM 653 N PHE A 45 0.981 2.270 4.715 1.00 0.00 N ATOM 654 CA PHE A 45 1.784 2.009 3.525 1.00 0.00 C ATOM 655 C PHE A 45 3.244 2.354 3.785 1.00 0.00 C ATOM 656 O PHE A 45 4.132 1.524 3.591 1.00 0.00 O ATOM 657 CB PHE A 45 1.255 2.817 2.337 1.00 0.00 C ATOM 658 CG PHE A 45 0.417 2.010 1.387 1.00 0.00 C ATOM 659 CD1 PHE A 45 -0.951 1.894 1.576 1.00 0.00 C ATOM 660 CD2 PHE A 45 0.998 1.368 0.304 1.00 0.00 C ATOM 661 CE1 PHE A 45 -1.724 1.153 0.702 1.00 0.00 C ATOM 662 CE2 PHE A 45 0.230 0.626 -0.573 1.00 0.00 C ATOM 663 CZ PHE A 45 -1.133 0.518 -0.373 1.00 0.00 C ATOM 0 H PHE A 45 0.223 2.938 4.575 1.00 0.00 H new ATOM 0 HA PHE A 45 1.712 0.948 3.286 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.663 3.652 2.711 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.098 3.242 1.793 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.418 2.388 2.415 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.063 1.449 0.144 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.789 1.071 0.859 1.00 0.00 H new ATOM 0 HE2 PHE A 45 0.694 0.131 -1.413 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.735 -0.062 -1.056 1.00 0.00 H new ATOM 673 N TRP A 46 3.485 3.579 4.239 1.00 0.00 N ATOM 674 CA TRP A 46 4.840 4.019 4.540 1.00 0.00 C ATOM 675 C TRP A 46 5.444 3.149 5.638 1.00 0.00 C ATOM 676 O TRP A 46 6.660 2.966 5.705 1.00 0.00 O ATOM 677 CB TRP A 46 4.845 5.489 4.970 1.00 0.00 C ATOM 678 CG TRP A 46 6.189 5.970 5.429 1.00 0.00 C ATOM 679 CD1 TRP A 46 6.661 5.984 6.709 1.00 0.00 C ATOM 680 CD2 TRP A 46 7.235 6.503 4.608 1.00 0.00 C ATOM 681 NE1 TRP A 46 7.937 6.493 6.736 1.00 0.00 N ATOM 682 CE2 TRP A 46 8.311 6.819 5.459 1.00 0.00 C ATOM 683 CE3 TRP A 46 7.366 6.744 3.238 1.00 0.00 C ATOM 684 CZ2 TRP A 46 9.502 7.363 4.983 1.00 0.00 C ATOM 685 CZ3 TRP A 46 8.548 7.283 2.766 1.00 0.00 C ATOM 686 CH2 TRP A 46 9.603 7.587 3.636 1.00 0.00 C ATOM 0 H TRP A 46 2.764 4.281 4.406 1.00 0.00 H new ATOM 0 HA TRP A 46 5.444 3.920 3.638 1.00 0.00 H new ATOM 0 HB2 TRP A 46 4.512 6.105 4.135 1.00 0.00 H new ATOM 0 HB3 TRP A 46 4.123 5.627 5.775 1.00 0.00 H new ATOM 0 HD1 TRP A 46 6.112 5.645 7.575 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.512 6.609 7.571 1.00 0.00 H new ATOM 0 HE3 TRP A 46 6.558 6.513 2.560 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.316 7.599 5.652 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 8.660 7.473 1.709 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.514 8.006 3.236 1.00 0.00 H new ATOM 697 N LYS A 47 4.581 2.611 6.496 1.00 0.00 N ATOM 698 CA LYS A 47 5.021 1.755 7.590 1.00 0.00 C ATOM 699 C LYS A 47 5.617 0.455 7.058 1.00 0.00 C ATOM 700 O LYS A 47 6.426 -0.182 7.729 1.00 0.00 O ATOM 701 CB LYS A 47 3.851 1.452 8.531 1.00 0.00 C ATOM 702 CG LYS A 47 4.027 2.032 9.926 1.00 0.00 C ATOM 703 CD LYS A 47 3.772 0.991 11.005 1.00 0.00 C ATOM 704 CE LYS A 47 2.425 1.201 11.677 1.00 0.00 C ATOM 705 NZ LYS A 47 1.294 0.854 10.774 1.00 0.00 N ATOM 0 H LYS A 47 3.572 2.754 6.453 1.00 0.00 H new ATOM 0 HA LYS A 47 5.795 2.285 8.146 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.933 1.847 8.095 1.00 0.00 H new ATOM 0 HB3 LYS A 47 3.728 0.372 8.608 1.00 0.00 H new ATOM 0 HG2 LYS A 47 5.038 2.425 10.032 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.343 2.870 10.060 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.809 -0.006 10.566 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.564 1.039 11.753 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.370 0.591 12.579 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.334 2.241 11.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.435 0.697 11.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.132 1.634 10.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.524 -0.012 10.246 1.00 0.00 H new ATOM 719 N LEU A 48 5.212 0.065 5.851 1.00 0.00 N ATOM 720 CA LEU A 48 5.713 -1.160 5.235 1.00 0.00 C ATOM 721 C LEU A 48 6.960 -0.883 4.397 1.00 0.00 C ATOM 722 O LEU A 48 7.782 -1.773 4.175 1.00 0.00 O ATOM 723 CB LEU A 48 4.627 -1.795 4.362 1.00 0.00 C ATOM 724 CG LEU A 48 5.084 -2.983 3.510 1.00 0.00 C ATOM 725 CD1 LEU A 48 5.422 -4.174 4.392 1.00 0.00 C ATOM 726 CD2 LEU A 48 4.014 -3.354 2.494 1.00 0.00 C ATOM 0 H LEU A 48 4.540 0.579 5.282 1.00 0.00 H new ATOM 0 HA LEU A 48 5.983 -1.853 6.032 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.812 -2.124 5.007 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.222 -1.029 3.701 1.00 0.00 H new ATOM 0 HG LEU A 48 5.984 -2.692 2.969 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.745 -5.008 3.769 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.224 -3.902 5.078 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.540 -4.467 4.962 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.356 -4.200 1.898 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.096 -3.625 3.015 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.822 -2.503 1.840 1.00 0.00 H new ATOM 738 N LYS A 49 7.089 0.353 3.927 1.00 0.00 N ATOM 739 CA LYS A 49 8.228 0.751 3.104 1.00 0.00 C ATOM 740 C LYS A 49 9.552 0.543 3.838 1.00 0.00 C ATOM 741 O LYS A 49 10.319 -0.363 3.511 1.00 0.00 O ATOM 742 CB LYS A 49 8.088 2.216 2.687 1.00 0.00 C ATOM 743 CG LYS A 49 8.307 2.449 1.201 1.00 0.00 C ATOM 744 CD LYS A 49 8.597 3.912 0.902 1.00 0.00 C ATOM 745 CE LYS A 49 9.884 4.371 1.566 1.00 0.00 C ATOM 746 NZ LYS A 49 10.641 5.326 0.710 1.00 0.00 N ATOM 0 H LYS A 49 6.417 1.100 4.102 1.00 0.00 H new ATOM 0 HA LYS A 49 8.234 0.119 2.216 1.00 0.00 H new ATOM 0 HB2 LYS A 49 7.093 2.569 2.959 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.804 2.815 3.250 1.00 0.00 H new ATOM 0 HG2 LYS A 49 9.138 1.834 0.854 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.423 2.132 0.648 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.671 4.057 -0.176 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.767 4.527 1.250 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.651 4.844 2.520 1.00 0.00 H new ATOM 0 HE3 LYS A 49 10.509 3.505 1.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.461 4.842 0.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 10.022 5.679 -0.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.970 6.125 1.288 1.00 0.00 H new ATOM 760 N THR A 50 9.817 1.399 4.823 1.00 0.00 N ATOM 761 CA THR A 50 11.054 1.330 5.602 1.00 0.00 C ATOM 762 C THR A 50 11.395 -0.106 6.002 1.00 0.00 C ATOM 763 O THR A 50 12.568 -0.467 6.102 1.00 0.00 O ATOM 764 CB THR A 50 10.947 2.214 6.852 1.00 0.00 C ATOM 765 OG1 THR A 50 11.846 1.779 7.859 1.00 0.00 O ATOM 766 CG2 THR A 50 9.558 2.242 7.457 1.00 0.00 C ATOM 0 H THR A 50 9.189 2.152 5.102 1.00 0.00 H new ATOM 0 HA THR A 50 11.861 1.698 4.968 1.00 0.00 H new ATOM 0 HB THR A 50 11.195 3.219 6.509 1.00 0.00 H new ATOM 0 HG1 THR A 50 11.761 2.358 8.645 1.00 0.00 H new ATOM 0 HG21 THR A 50 9.557 2.886 8.336 1.00 0.00 H new ATOM 0 HG22 THR A 50 8.850 2.628 6.724 1.00 0.00 H new ATOM 0 HG23 THR A 50 9.267 1.232 7.747 1.00 0.00 H new ATOM 774 N ARG A 51 10.371 -0.920 6.223 1.00 0.00 N ATOM 775 CA ARG A 51 10.582 -2.313 6.603 1.00 0.00 C ATOM 776 C ARG A 51 11.319 -3.056 5.498 1.00 0.00 C ATOM 777 O ARG A 51 12.416 -3.572 5.703 1.00 0.00 O ATOM 778 CB ARG A 51 9.248 -3.003 6.888 1.00 0.00 C ATOM 779 CG ARG A 51 8.332 -2.202 7.794 1.00 0.00 C ATOM 780 CD ARG A 51 8.880 -2.109 9.210 1.00 0.00 C ATOM 781 NE ARG A 51 8.012 -2.775 10.179 1.00 0.00 N ATOM 782 CZ ARG A 51 8.095 -4.068 10.490 1.00 0.00 C ATOM 783 NH1 ARG A 51 9.006 -4.843 9.914 1.00 0.00 N ATOM 784 NH2 ARG A 51 7.265 -4.587 11.385 1.00 0.00 N ATOM 0 H ARG A 51 9.392 -0.644 6.147 1.00 0.00 H new ATOM 0 HA ARG A 51 11.186 -2.330 7.510 1.00 0.00 H new ATOM 0 HB2 ARG A 51 8.737 -3.192 5.944 1.00 0.00 H new ATOM 0 HB3 ARG A 51 9.441 -3.973 7.346 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.204 -1.199 7.387 1.00 0.00 H new ATOM 0 HG3 ARG A 51 7.346 -2.665 7.815 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.873 -2.558 9.244 1.00 0.00 H new ATOM 0 HD3 ARG A 51 8.994 -1.061 9.486 1.00 0.00 H new ATOM 0 HE ARG A 51 7.299 -2.215 10.646 1.00 0.00 H new ATOM 0 HH11 ARG A 51 9.650 -4.450 9.227 1.00 0.00 H new ATOM 0 HH12 ARG A 51 9.062 -5.832 10.158 1.00 0.00 H new ATOM 0 HH21 ARG A 51 6.565 -3.997 11.834 1.00 0.00 H new ATOM 0 HH22 ARG A 51 7.327 -5.577 11.624 1.00 0.00 H new ATOM 798 N LEU A 52 10.702 -3.099 4.323 1.00 0.00 N ATOM 799 CA LEU A 52 11.289 -3.772 3.167 1.00 0.00 C ATOM 800 C LEU A 52 12.741 -3.346 2.958 1.00 0.00 C ATOM 801 O LEU A 52 13.562 -4.123 2.473 1.00 0.00 O ATOM 802 CB LEU A 52 10.478 -3.464 1.906 1.00 0.00 C ATOM 803 CG LEU A 52 8.994 -3.823 1.981 1.00 0.00 C ATOM 804 CD1 LEU A 52 8.214 -3.093 0.899 1.00 0.00 C ATOM 805 CD2 LEU A 52 8.804 -5.327 1.856 1.00 0.00 C ATOM 0 H LEU A 52 9.792 -2.675 4.144 1.00 0.00 H new ATOM 0 HA LEU A 52 11.268 -4.845 3.360 1.00 0.00 H new ATOM 0 HB2 LEU A 52 10.567 -2.400 1.687 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.923 -4.000 1.068 1.00 0.00 H new ATOM 0 HG LEU A 52 8.611 -3.508 2.951 1.00 0.00 H new ATOM 0 HD11 LEU A 52 7.160 -3.360 0.967 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.325 -2.017 1.034 1.00 0.00 H new ATOM 0 HD13 LEU A 52 8.598 -3.377 -0.081 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.742 -5.565 1.911 1.00 0.00 H new ATOM 0 HD22 LEU A 52 9.203 -5.666 0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.331 -5.829 2.667 1.00 0.00 H new ATOM 817 N GLU A 53 13.045 -2.105 3.321 1.00 0.00 N ATOM 818 CA GLU A 53 14.394 -1.572 3.168 1.00 0.00 C ATOM 819 C GLU A 53 15.405 -2.384 3.973 1.00 0.00 C ATOM 820 O GLU A 53 16.437 -2.801 3.447 1.00 0.00 O ATOM 821 CB GLU A 53 14.439 -0.106 3.604 1.00 0.00 C ATOM 822 CG GLU A 53 13.440 0.776 2.874 1.00 0.00 C ATOM 823 CD GLU A 53 13.874 2.228 2.824 1.00 0.00 C ATOM 824 OE1 GLU A 53 15.066 2.482 2.549 1.00 0.00 O ATOM 825 OE2 GLU A 53 13.022 3.112 3.058 1.00 0.00 O ATOM 0 H GLU A 53 12.376 -1.449 3.723 1.00 0.00 H new ATOM 0 HA GLU A 53 14.662 -1.642 2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 53 14.247 -0.048 4.675 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.444 0.283 3.438 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.307 0.405 1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.471 0.707 3.368 1.00 0.00 H new ATOM 832 N ARG A 54 15.105 -2.602 5.248 1.00 0.00 N ATOM 833 CA ARG A 54 15.996 -3.363 6.122 1.00 0.00 C ATOM 834 C ARG A 54 15.658 -4.851 6.102 1.00 0.00 C ATOM 835 O ARG A 54 16.499 -5.691 6.423 1.00 0.00 O ATOM 836 CB ARG A 54 15.926 -2.832 7.555 1.00 0.00 C ATOM 837 CG ARG A 54 14.513 -2.554 8.044 1.00 0.00 C ATOM 838 CD ARG A 54 14.500 -2.220 9.527 1.00 0.00 C ATOM 839 NE ARG A 54 13.416 -1.301 9.874 1.00 0.00 N ATOM 840 CZ ARG A 54 12.208 -1.692 10.279 1.00 0.00 C ATOM 841 NH1 ARG A 54 11.912 -2.983 10.370 1.00 0.00 N ATOM 842 NH2 ARG A 54 11.291 -0.786 10.590 1.00 0.00 N ATOM 0 H ARG A 54 14.255 -2.265 5.700 1.00 0.00 H new ATOM 0 HA ARG A 54 17.011 -3.239 5.745 1.00 0.00 H new ATOM 0 HB2 ARG A 54 16.395 -3.555 8.223 1.00 0.00 H new ATOM 0 HB3 ARG A 54 16.509 -1.913 7.620 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.086 -1.726 7.478 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.884 -3.424 7.859 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.395 -3.139 10.104 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.455 -1.775 9.807 1.00 0.00 H new ATOM 0 HE ARG A 54 13.596 -0.300 9.802 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.612 -3.685 10.129 1.00 0.00 H new ATOM 0 HH12 ARG A 54 10.985 -3.273 10.681 1.00 0.00 H new ATOM 0 HH21 ARG A 54 11.511 0.207 10.519 1.00 0.00 H new ATOM 0 HH22 ARG A 54 10.366 -1.083 10.900 1.00 0.00 H new ATOM 856 N ASP A 55 14.427 -5.171 5.724 1.00 0.00 N ATOM 857 CA ASP A 55 13.983 -6.559 5.660 1.00 0.00 C ATOM 858 C ASP A 55 14.507 -7.229 4.398 1.00 0.00 C ATOM 859 O ASP A 55 14.949 -8.377 4.425 1.00 0.00 O ATOM 860 CB ASP A 55 12.455 -6.633 5.697 1.00 0.00 C ATOM 861 CG ASP A 55 11.917 -6.766 7.108 1.00 0.00 C ATOM 862 OD1 ASP A 55 11.665 -5.723 7.748 1.00 0.00 O ATOM 863 OD2 ASP A 55 11.748 -7.912 7.573 1.00 0.00 O ATOM 0 H ASP A 55 13.718 -4.489 5.457 1.00 0.00 H new ATOM 0 HA ASP A 55 14.381 -7.086 6.527 1.00 0.00 H new ATOM 0 HB2 ASP A 55 12.039 -5.737 5.235 1.00 0.00 H new ATOM 0 HB3 ASP A 55 12.121 -7.483 5.102 1.00 0.00 H new ATOM 868 N VAL A 56 14.462 -6.494 3.293 1.00 0.00 N ATOM 869 CA VAL A 56 14.939 -7.002 2.015 1.00 0.00 C ATOM 870 C VAL A 56 16.409 -6.660 1.822 1.00 0.00 C ATOM 871 O VAL A 56 17.147 -7.387 1.156 1.00 0.00 O ATOM 872 CB VAL A 56 14.132 -6.414 0.844 1.00 0.00 C ATOM 873 CG1 VAL A 56 14.546 -7.060 -0.468 1.00 0.00 C ATOM 874 CG2 VAL A 56 12.642 -6.580 1.089 1.00 0.00 C ATOM 0 H VAL A 56 14.099 -5.542 3.258 1.00 0.00 H new ATOM 0 HA VAL A 56 14.810 -8.084 2.026 1.00 0.00 H new ATOM 0 HB VAL A 56 14.346 -5.347 0.775 1.00 0.00 H new ATOM 0 HG11 VAL A 56 13.964 -6.631 -1.284 1.00 0.00 H new ATOM 0 HG12 VAL A 56 15.606 -6.879 -0.644 1.00 0.00 H new ATOM 0 HG13 VAL A 56 14.365 -8.134 -0.418 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.086 -6.159 0.251 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.405 -7.640 1.186 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.364 -6.061 2.006 1.00 0.00 H new ATOM 884 N GLY A 57 16.824 -5.544 2.408 1.00 0.00 N ATOM 885 CA GLY A 57 18.204 -5.112 2.291 1.00 0.00 C ATOM 886 C GLY A 57 18.424 -4.184 1.112 1.00 0.00 C ATOM 887 O GLY A 57 19.472 -3.547 1.005 1.00 0.00 O ATOM 0 H GLY A 57 16.229 -4.929 2.963 1.00 0.00 H new ATOM 0 HA2 GLY A 57 18.502 -4.605 3.209 1.00 0.00 H new ATOM 0 HA3 GLY A 57 18.847 -5.986 2.187 1.00 0.00 H new ATOM 891 N SER A 58 17.436 -4.106 0.224 1.00 0.00 N ATOM 892 CA SER A 58 17.530 -3.248 -0.950 1.00 0.00 C ATOM 893 C SER A 58 16.663 -2.005 -0.785 1.00 0.00 C ATOM 894 O SER A 58 15.783 -1.960 0.074 1.00 0.00 O ATOM 895 CB SER A 58 17.108 -4.018 -2.203 1.00 0.00 C ATOM 896 OG SER A 58 18.229 -4.598 -2.847 1.00 0.00 O ATOM 0 H SER A 58 16.562 -4.627 0.297 1.00 0.00 H new ATOM 0 HA SER A 58 18.568 -2.932 -1.058 1.00 0.00 H new ATOM 0 HB2 SER A 58 16.397 -4.798 -1.932 1.00 0.00 H new ATOM 0 HB3 SER A 58 16.597 -3.346 -2.892 1.00 0.00 H new ATOM 0 HG SER A 58 17.932 -5.086 -3.644 1.00 0.00 H new ATOM 902 N THR A 59 16.917 -0.998 -1.615 1.00 0.00 N ATOM 903 CA THR A 59 16.159 0.245 -1.561 1.00 0.00 C ATOM 904 C THR A 59 14.824 0.096 -2.287 1.00 0.00 C ATOM 905 O THR A 59 14.663 -0.779 -3.137 1.00 0.00 O ATOM 906 CB THR A 59 16.968 1.390 -2.176 1.00 0.00 C ATOM 907 OG1 THR A 59 16.370 2.640 -1.881 1.00 0.00 O ATOM 908 CG2 THR A 59 17.104 1.293 -3.681 1.00 0.00 C ATOM 0 H THR A 59 17.642 -1.019 -2.332 1.00 0.00 H new ATOM 0 HA THR A 59 15.959 0.477 -0.515 1.00 0.00 H new ATOM 0 HB THR A 59 17.961 1.309 -1.733 1.00 0.00 H new ATOM 0 HG1 THR A 59 16.902 3.360 -2.281 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.689 2.136 -4.049 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.607 0.362 -3.942 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.114 1.311 -4.138 1.00 0.00 H new ATOM 916 N ILE A 60 13.872 0.956 -1.946 1.00 0.00 N ATOM 917 CA ILE A 60 12.553 0.917 -2.566 1.00 0.00 C ATOM 918 C ILE A 60 12.391 2.046 -3.586 1.00 0.00 C ATOM 919 O ILE A 60 12.607 3.215 -3.265 1.00 0.00 O ATOM 920 CB ILE A 60 11.432 1.007 -1.507 1.00 0.00 C ATOM 921 CG1 ILE A 60 10.081 0.664 -2.134 1.00 0.00 C ATOM 922 CG2 ILE A 60 11.395 2.390 -0.869 1.00 0.00 C ATOM 923 CD1 ILE A 60 9.631 -0.754 -1.855 1.00 0.00 C ATOM 0 H ILE A 60 13.988 1.688 -1.245 1.00 0.00 H new ATOM 0 HA ILE A 60 12.468 -0.039 -3.082 1.00 0.00 H new ATOM 0 HB ILE A 60 11.644 0.282 -0.721 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.328 1.357 -1.758 1.00 0.00 H new ATOM 0 HG13 ILE A 60 10.141 0.813 -3.212 1.00 0.00 H new ATOM 0 HG21 ILE A 60 10.597 2.427 -0.127 1.00 0.00 H new ATOM 0 HG22 ILE A 60 12.350 2.593 -0.385 1.00 0.00 H new ATOM 0 HG23 ILE A 60 11.211 3.141 -1.638 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.665 -0.929 -2.329 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.364 -1.454 -2.256 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.539 -0.901 -0.779 1.00 0.00 H new ATOM 935 N PRO A 61 12.017 1.714 -4.836 1.00 0.00 N ATOM 936 CA PRO A 61 11.839 2.701 -5.899 1.00 0.00 C ATOM 937 C PRO A 61 10.436 3.306 -5.926 1.00 0.00 C ATOM 938 O PRO A 61 9.932 3.671 -6.989 1.00 0.00 O ATOM 939 CB PRO A 61 12.084 1.872 -7.154 1.00 0.00 C ATOM 940 CG PRO A 61 11.561 0.516 -6.810 1.00 0.00 C ATOM 941 CD PRO A 61 11.749 0.344 -5.320 1.00 0.00 C ATOM 0 HA PRO A 61 12.501 3.559 -5.780 1.00 0.00 H new ATOM 0 HB2 PRO A 61 11.564 2.292 -8.015 1.00 0.00 H new ATOM 0 HB3 PRO A 61 13.144 1.837 -7.407 1.00 0.00 H new ATOM 0 HG2 PRO A 61 10.509 0.427 -7.080 1.00 0.00 H new ATOM 0 HG3 PRO A 61 12.098 -0.257 -7.360 1.00 0.00 H new ATOM 0 HD2 PRO A 61 10.860 -0.079 -4.851 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.578 -0.328 -5.097 1.00 0.00 H new ATOM 949 N TYR A 62 9.809 3.410 -4.759 1.00 0.00 N ATOM 950 CA TYR A 62 8.467 3.971 -4.663 1.00 0.00 C ATOM 951 C TYR A 62 8.514 5.403 -4.137 1.00 0.00 C ATOM 952 O TYR A 62 9.326 5.730 -3.273 1.00 0.00 O ATOM 953 CB TYR A 62 7.597 3.111 -3.748 1.00 0.00 C ATOM 954 CG TYR A 62 7.217 1.776 -4.348 1.00 0.00 C ATOM 955 CD1 TYR A 62 6.775 1.683 -5.662 1.00 0.00 C ATOM 956 CD2 TYR A 62 7.301 0.608 -3.601 1.00 0.00 C ATOM 957 CE1 TYR A 62 6.426 0.465 -6.212 1.00 0.00 C ATOM 958 CE2 TYR A 62 6.954 -0.614 -4.144 1.00 0.00 C ATOM 959 CZ TYR A 62 6.517 -0.680 -5.449 1.00 0.00 C ATOM 960 OH TYR A 62 6.170 -1.896 -5.992 1.00 0.00 O ATOM 0 H TYR A 62 10.208 3.114 -3.868 1.00 0.00 H new ATOM 0 HA TYR A 62 8.032 3.982 -5.662 1.00 0.00 H new ATOM 0 HB2 TYR A 62 8.128 2.940 -2.812 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.688 3.661 -3.503 1.00 0.00 H new ATOM 0 HD1 TYR A 62 6.703 2.577 -6.263 1.00 0.00 H new ATOM 0 HD2 TYR A 62 7.644 0.656 -2.578 1.00 0.00 H new ATOM 0 HE1 TYR A 62 6.083 0.410 -7.235 1.00 0.00 H new ATOM 0 HE2 TYR A 62 7.025 -1.512 -3.549 1.00 0.00 H new ATOM 0 HH TYR A 62 5.221 -2.071 -5.822 1.00 0.00 H new ATOM 970 N ASP A 63 7.636 6.250 -4.664 1.00 0.00 N ATOM 971 CA ASP A 63 7.576 7.646 -4.244 1.00 0.00 C ATOM 972 C ASP A 63 6.524 7.839 -3.157 1.00 0.00 C ATOM 973 O ASP A 63 5.325 7.726 -3.412 1.00 0.00 O ATOM 974 CB ASP A 63 7.263 8.547 -5.441 1.00 0.00 C ATOM 975 CG ASP A 63 6.062 8.065 -6.230 1.00 0.00 C ATOM 976 OD1 ASP A 63 6.233 7.171 -7.085 1.00 0.00 O ATOM 977 OD2 ASP A 63 4.949 8.583 -5.994 1.00 0.00 O ATOM 0 H ASP A 63 6.957 5.995 -5.381 1.00 0.00 H new ATOM 0 HA ASP A 63 8.549 7.921 -3.837 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.079 9.562 -5.090 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.132 8.589 -6.097 1.00 0.00 H new ATOM 982 N PHE A 64 6.981 8.125 -1.941 1.00 0.00 N ATOM 983 CA PHE A 64 6.076 8.329 -0.815 1.00 0.00 C ATOM 984 C PHE A 64 6.562 9.469 0.080 1.00 0.00 C ATOM 985 O PHE A 64 7.409 9.266 0.950 1.00 0.00 O ATOM 986 CB PHE A 64 5.958 7.042 0.003 1.00 0.00 C ATOM 987 CG PHE A 64 4.739 6.996 0.880 1.00 0.00 C ATOM 988 CD1 PHE A 64 4.583 7.899 1.920 1.00 0.00 C ATOM 989 CD2 PHE A 64 3.750 6.051 0.663 1.00 0.00 C ATOM 990 CE1 PHE A 64 3.463 7.858 2.728 1.00 0.00 C ATOM 991 CE2 PHE A 64 2.627 6.005 1.467 1.00 0.00 C ATOM 992 CZ PHE A 64 2.483 6.910 2.501 1.00 0.00 C ATOM 0 H PHE A 64 7.970 8.220 -1.711 1.00 0.00 H new ATOM 0 HA PHE A 64 5.097 8.597 -1.211 1.00 0.00 H new ATOM 0 HB2 PHE A 64 5.939 6.190 -0.677 1.00 0.00 H new ATOM 0 HB3 PHE A 64 6.847 6.934 0.625 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.345 8.643 2.101 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.858 5.342 -0.144 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.353 8.566 3.536 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.863 5.263 1.287 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.606 6.877 3.131 1.00 0.00 H new ATOM 1002 N PRO A 65 6.028 10.688 -0.118 1.00 0.00 N ATOM 1003 CA PRO A 65 6.415 11.856 0.679 1.00 0.00 C ATOM 1004 C PRO A 65 5.890 11.778 2.110 1.00 0.00 C ATOM 1005 O PRO A 65 4.680 11.745 2.338 1.00 0.00 O ATOM 1006 CB PRO A 65 5.765 13.025 -0.064 1.00 0.00 C ATOM 1007 CG PRO A 65 4.599 12.423 -0.766 1.00 0.00 C ATOM 1008 CD PRO A 65 5.010 11.024 -1.133 1.00 0.00 C ATOM 0 HA PRO A 65 7.497 11.944 0.775 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.451 13.808 0.626 1.00 0.00 H new ATOM 0 HB3 PRO A 65 6.460 13.482 -0.769 1.00 0.00 H new ATOM 0 HG2 PRO A 65 3.719 12.415 -0.123 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.339 12.999 -1.654 1.00 0.00 H new ATOM 0 HD2 PRO A 65 4.166 10.335 -1.098 1.00 0.00 H new ATOM 0 HD3 PRO A 65 5.419 10.977 -2.142 1.00 0.00 H new ATOM 1016 N GLU A 66 6.809 11.750 3.071 1.00 0.00 N ATOM 1017 CA GLU A 66 6.438 11.677 4.480 1.00 0.00 C ATOM 1018 C GLU A 66 5.696 12.936 4.915 1.00 0.00 C ATOM 1019 O GLU A 66 5.488 13.852 4.120 1.00 0.00 O ATOM 1020 CB GLU A 66 7.684 11.482 5.347 1.00 0.00 C ATOM 1021 CG GLU A 66 8.062 10.024 5.550 1.00 0.00 C ATOM 1022 CD GLU A 66 8.523 9.734 6.965 1.00 0.00 C ATOM 1023 OE1 GLU A 66 7.681 9.784 7.885 1.00 0.00 O ATOM 1024 OE2 GLU A 66 9.726 9.455 7.152 1.00 0.00 O ATOM 0 H GLU A 66 7.814 11.777 2.900 1.00 0.00 H new ATOM 0 HA GLU A 66 5.774 10.823 4.610 1.00 0.00 H new ATOM 0 HB2 GLU A 66 8.522 12.005 4.887 1.00 0.00 H new ATOM 0 HB3 GLU A 66 7.515 11.944 6.320 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.204 9.394 5.315 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.855 9.757 4.851 1.00 0.00 H new ATOM 1031 N LYS A 67 5.299 12.974 6.183 1.00 0.00 N ATOM 1032 CA LYS A 67 4.581 14.121 6.726 1.00 0.00 C ATOM 1033 C LYS A 67 5.445 14.879 7.731 1.00 0.00 C ATOM 1034 O LYS A 67 5.329 14.675 8.939 1.00 0.00 O ATOM 1035 CB LYS A 67 3.280 13.666 7.391 1.00 0.00 C ATOM 1036 CG LYS A 67 2.052 13.845 6.513 1.00 0.00 C ATOM 1037 CD LYS A 67 0.781 13.915 7.342 1.00 0.00 C ATOM 1038 CE LYS A 67 0.668 15.240 8.080 1.00 0.00 C ATOM 1039 NZ LYS A 67 -0.122 15.113 9.336 1.00 0.00 N ATOM 0 H LYS A 67 5.463 12.223 6.854 1.00 0.00 H new ATOM 0 HA LYS A 67 4.343 14.793 5.902 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.370 12.615 7.665 1.00 0.00 H new ATOM 0 HB3 LYS A 67 3.140 14.225 8.316 1.00 0.00 H new ATOM 0 HG2 LYS A 67 2.154 14.756 5.924 1.00 0.00 H new ATOM 0 HG3 LYS A 67 1.983 13.016 5.808 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -0.085 13.784 6.693 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.768 13.095 8.060 1.00 0.00 H new ATOM 0 HE2 LYS A 67 1.666 15.610 8.315 1.00 0.00 H new ATOM 0 HE3 LYS A 67 0.199 15.978 7.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.175 16.038 9.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -1.082 14.784 9.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 0.339 14.428 9.968 1.00 0.00 H new ATOM 1053 N PRO A 68 6.327 15.767 7.243 1.00 0.00 N ATOM 1054 CA PRO A 68 7.212 16.555 8.104 1.00 0.00 C ATOM 1055 C PRO A 68 6.474 17.680 8.820 1.00 0.00 C ATOM 1056 O PRO A 68 5.470 18.193 8.323 1.00 0.00 O ATOM 1057 CB PRO A 68 8.236 17.126 7.124 1.00 0.00 C ATOM 1058 CG PRO A 68 7.503 17.223 5.831 1.00 0.00 C ATOM 1059 CD PRO A 68 6.532 16.072 5.813 1.00 0.00 C ATOM 0 HA PRO A 68 7.651 15.953 8.900 1.00 0.00 H new ATOM 0 HB2 PRO A 68 8.596 18.102 7.450 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.108 16.477 7.038 1.00 0.00 H new ATOM 0 HG2 PRO A 68 6.979 18.176 5.751 1.00 0.00 H new ATOM 0 HG3 PRO A 68 8.191 17.165 4.988 1.00 0.00 H new ATOM 0 HD2 PRO A 68 5.597 16.344 5.323 1.00 0.00 H new ATOM 0 HD3 PRO A 68 6.936 15.215 5.274 1.00 0.00 H new ATOM 1067 N GLY A 69 6.976 18.061 9.990 1.00 0.00 N ATOM 1068 CA GLY A 69 6.352 19.123 10.755 1.00 0.00 C ATOM 1069 C GLY A 69 5.529 18.596 11.915 1.00 0.00 C ATOM 1070 O GLY A 69 4.317 18.415 11.794 1.00 0.00 O ATOM 0 H GLY A 69 7.805 17.652 10.422 1.00 0.00 H new ATOM 0 HA2 GLY A 69 7.123 19.794 11.135 1.00 0.00 H new ATOM 0 HA3 GLY A 69 5.712 19.712 10.098 1.00 0.00 H new ATOM 1074 N VAL A 70 6.189 18.350 13.042 1.00 0.00 N ATOM 1075 CA VAL A 70 5.511 17.841 14.228 1.00 0.00 C ATOM 1076 C VAL A 70 4.435 18.816 14.705 1.00 0.00 C ATOM 1077 O VAL A 70 3.247 18.613 14.453 1.00 0.00 O ATOM 1078 CB VAL A 70 6.511 17.575 15.373 1.00 0.00 C ATOM 1079 CG1 VAL A 70 5.787 17.124 16.634 1.00 0.00 C ATOM 1080 CG2 VAL A 70 7.543 16.540 14.947 1.00 0.00 C ATOM 0 H VAL A 70 7.192 18.495 13.159 1.00 0.00 H new ATOM 0 HA VAL A 70 5.038 16.899 13.950 1.00 0.00 H new ATOM 0 HB VAL A 70 7.028 18.508 15.598 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.514 16.943 17.426 1.00 0.00 H new ATOM 0 HG12 VAL A 70 5.091 17.900 16.951 1.00 0.00 H new ATOM 0 HG13 VAL A 70 5.237 16.205 16.429 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.241 16.364 15.766 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.039 15.607 14.692 1.00 0.00 H new ATOM 0 HG23 VAL A 70 8.089 16.907 14.078 1.00 0.00 H new ATOM 1090 N LEU A 71 4.858 19.872 15.393 1.00 0.00 N ATOM 1091 CA LEU A 71 3.928 20.874 15.901 1.00 0.00 C ATOM 1092 C LEU A 71 3.891 22.094 14.985 1.00 0.00 C ATOM 1093 O LEU A 71 4.279 23.194 15.381 1.00 0.00 O ATOM 1094 CB LEU A 71 4.324 21.292 17.319 1.00 0.00 C ATOM 1095 CG LEU A 71 3.154 21.643 18.240 1.00 0.00 C ATOM 1096 CD1 LEU A 71 2.467 22.915 17.770 1.00 0.00 C ATOM 1097 CD2 LEU A 71 2.163 20.491 18.302 1.00 0.00 C ATOM 0 H LEU A 71 5.837 20.056 15.611 1.00 0.00 H new ATOM 0 HA LEU A 71 2.931 20.433 15.926 1.00 0.00 H new ATOM 0 HB2 LEU A 71 4.895 20.483 17.774 1.00 0.00 H new ATOM 0 HB3 LEU A 71 4.988 22.154 17.255 1.00 0.00 H new ATOM 0 HG LEU A 71 3.544 21.816 19.243 1.00 0.00 H new ATOM 0 HD11 LEU A 71 1.638 23.148 18.437 1.00 0.00 H new ATOM 0 HD12 LEU A 71 3.181 23.738 17.777 1.00 0.00 H new ATOM 0 HD13 LEU A 71 2.089 22.772 16.758 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.337 20.757 18.961 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.779 20.288 17.303 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.662 19.602 18.687 1.00 0.00 H new ATOM 1109 N ASP A 72 3.421 21.891 13.758 1.00 0.00 N ATOM 1110 CA ASP A 72 3.333 22.974 12.785 1.00 0.00 C ATOM 1111 C ASP A 72 1.880 23.259 12.419 1.00 0.00 C ATOM 1112 O ASP A 72 1.116 22.345 12.109 1.00 0.00 O ATOM 1113 CB ASP A 72 4.127 22.622 11.525 1.00 0.00 C ATOM 1114 CG ASP A 72 5.590 23.000 11.639 1.00 0.00 C ATOM 1115 OD1 ASP A 72 5.877 24.173 11.959 1.00 0.00 O ATOM 1116 OD2 ASP A 72 6.450 22.125 11.408 1.00 0.00 O ATOM 0 H ASP A 72 3.096 20.987 13.414 1.00 0.00 H new ATOM 0 HA ASP A 72 3.759 23.870 13.237 1.00 0.00 H new ATOM 0 HB2 ASP A 72 4.045 21.552 11.334 1.00 0.00 H new ATOM 0 HB3 ASP A 72 3.688 23.133 10.668 1.00 0.00 H new ATOM 1121 N ARG A 73 1.505 24.533 12.458 1.00 0.00 N ATOM 1122 CA ARG A 73 0.142 24.941 12.132 1.00 0.00 C ATOM 1123 C ARG A 73 0.110 25.793 10.865 1.00 0.00 C ATOM 1124 O ARG A 73 -0.888 25.813 10.145 1.00 0.00 O ATOM 1125 CB ARG A 73 -0.471 25.718 13.298 1.00 0.00 C ATOM 1126 CG ARG A 73 -0.747 24.860 14.522 1.00 0.00 C ATOM 1127 CD ARG A 73 -0.692 25.679 15.801 1.00 0.00 C ATOM 1128 NE ARG A 73 -1.655 26.777 15.789 1.00 0.00 N ATOM 1129 CZ ARG A 73 -1.721 27.715 16.732 1.00 0.00 C ATOM 1130 NH1 ARG A 73 -0.882 27.693 17.760 1.00 0.00 N ATOM 1131 NH2 ARG A 73 -2.626 28.679 16.644 1.00 0.00 N ATOM 0 H ARG A 73 2.125 25.302 12.712 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.445 24.040 11.953 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.202 26.529 13.577 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.403 26.177 12.968 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -1.729 24.396 14.428 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -0.016 24.053 14.574 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -0.891 25.032 16.655 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.313 26.080 15.932 1.00 0.00 H new ATOM 0 HE ARG A 73 -2.315 26.828 15.013 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.182 26.955 17.831 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.937 28.414 18.479 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -3.271 28.702 15.854 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -2.677 29.398 17.366 1.00 0.00 H new ATOM 1145 N ARG A 74 1.207 26.498 10.602 1.00 0.00 N ATOM 1146 CA ARG A 74 1.304 27.359 9.424 1.00 0.00 C ATOM 1147 C ARG A 74 0.914 26.609 8.151 1.00 0.00 C ATOM 1148 O ARG A 74 -0.031 26.995 7.462 1.00 0.00 O ATOM 1149 CB ARG A 74 2.722 27.926 9.281 1.00 0.00 C ATOM 1150 CG ARG A 74 3.821 26.981 9.747 1.00 0.00 C ATOM 1151 CD ARG A 74 4.458 27.460 11.042 1.00 0.00 C ATOM 1152 NE ARG A 74 5.730 28.141 10.808 1.00 0.00 N ATOM 1153 CZ ARG A 74 6.884 27.510 10.602 1.00 0.00 C ATOM 1154 NH1 ARG A 74 6.929 26.183 10.591 1.00 0.00 N ATOM 1155 NH2 ARG A 74 7.994 28.206 10.404 1.00 0.00 N ATOM 0 H ARG A 74 2.042 26.491 11.188 1.00 0.00 H new ATOM 0 HA ARG A 74 0.604 28.183 9.564 1.00 0.00 H new ATOM 0 HB2 ARG A 74 2.896 28.180 8.235 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.790 28.853 9.850 1.00 0.00 H new ATOM 0 HG2 ARG A 74 3.407 25.983 9.892 1.00 0.00 H new ATOM 0 HG3 ARG A 74 4.584 26.900 8.973 1.00 0.00 H new ATOM 0 HD2 ARG A 74 3.774 28.136 11.554 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.619 26.609 11.703 1.00 0.00 H new ATOM 0 HE ARG A 74 5.734 29.161 10.802 1.00 0.00 H new ATOM 0 HH11 ARG A 74 6.077 25.643 10.741 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.816 25.704 10.433 1.00 0.00 H new ATOM 0 HH21 ARG A 74 7.964 29.226 10.409 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.878 27.722 10.246 1.00 0.00 H new ATOM 1169 N TRP A 75 1.646 25.544 7.840 1.00 0.00 N ATOM 1170 CA TRP A 75 1.373 24.752 6.647 1.00 0.00 C ATOM 1171 C TRP A 75 0.817 23.379 7.013 1.00 0.00 C ATOM 1172 O TRP A 75 1.110 22.384 6.352 1.00 0.00 O ATOM 1173 CB TRP A 75 2.647 24.594 5.816 1.00 0.00 C ATOM 1174 CG TRP A 75 3.832 24.147 6.618 1.00 0.00 C ATOM 1175 CD1 TRP A 75 3.863 23.151 7.551 1.00 0.00 C ATOM 1176 CD2 TRP A 75 5.158 24.682 6.557 1.00 0.00 C ATOM 1177 NE1 TRP A 75 5.128 23.035 8.074 1.00 0.00 N ATOM 1178 CE2 TRP A 75 5.941 23.963 7.480 1.00 0.00 C ATOM 1179 CE3 TRP A 75 5.761 25.700 5.811 1.00 0.00 C ATOM 1180 CZ2 TRP A 75 7.294 24.230 7.676 1.00 0.00 C ATOM 1181 CZ3 TRP A 75 7.104 25.962 6.006 1.00 0.00 C ATOM 1182 CH2 TRP A 75 7.857 25.230 6.932 1.00 0.00 C ATOM 0 H TRP A 75 2.432 25.210 8.397 1.00 0.00 H new ATOM 0 HA TRP A 75 0.622 25.278 6.058 1.00 0.00 H new ATOM 0 HB2 TRP A 75 2.465 23.873 5.019 1.00 0.00 H new ATOM 0 HB3 TRP A 75 2.880 25.545 5.338 1.00 0.00 H new ATOM 0 HD1 TRP A 75 3.017 22.543 7.836 1.00 0.00 H new ATOM 0 HE1 TRP A 75 5.415 22.366 8.789 1.00 0.00 H new ATOM 0 HE3 TRP A 75 5.188 26.271 5.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 7.877 23.668 8.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 7.581 26.745 5.434 1.00 0.00 H new ATOM 0 HH2 TRP A 75 8.904 25.460 7.061 1.00 0.00 H new ATOM 1193 N GLN A 76 0.013 23.334 8.070 1.00 0.00 N ATOM 1194 CA GLN A 76 -0.584 22.082 8.522 1.00 0.00 C ATOM 1195 C GLN A 76 -1.629 21.585 7.528 1.00 0.00 C ATOM 1196 O GLN A 76 -2.009 22.300 6.601 1.00 0.00 O ATOM 1197 CB GLN A 76 -1.219 22.265 9.901 1.00 0.00 C ATOM 1198 CG GLN A 76 -2.410 23.212 9.905 1.00 0.00 C ATOM 1199 CD GLN A 76 -3.688 22.541 10.366 1.00 0.00 C ATOM 1200 OE1 GLN A 76 -4.645 22.411 9.602 1.00 0.00 O ATOM 1201 NE2 GLN A 76 -3.712 22.111 11.622 1.00 0.00 N ATOM 0 H GLN A 76 -0.240 24.149 8.629 1.00 0.00 H new ATOM 0 HA GLN A 76 0.207 21.335 8.590 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -1.538 21.293 10.276 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -0.464 22.641 10.592 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.194 24.059 10.556 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -2.555 23.611 8.901 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -2.896 22.239 12.221 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -4.546 21.652 11.988 1.00 0.00 H new ATOM 1210 N ARG A 77 -2.090 20.355 7.728 1.00 0.00 N ATOM 1211 CA ARG A 77 -3.093 19.759 6.852 1.00 0.00 C ATOM 1212 C ARG A 77 -3.979 18.785 7.623 1.00 0.00 C ATOM 1213 O ARG A 77 -3.489 17.975 8.410 1.00 0.00 O ATOM 1214 CB ARG A 77 -2.416 19.038 5.684 1.00 0.00 C ATOM 1215 CG ARG A 77 -1.465 19.922 4.894 1.00 0.00 C ATOM 1216 CD ARG A 77 -0.801 19.159 3.758 1.00 0.00 C ATOM 1217 NE ARG A 77 0.657 19.172 3.868 1.00 0.00 N ATOM 1218 CZ ARG A 77 1.356 18.308 4.600 1.00 0.00 C ATOM 1219 NH1 ARG A 77 0.739 17.360 5.294 1.00 0.00 N ATOM 1220 NH2 ARG A 77 2.679 18.394 4.641 1.00 0.00 N ATOM 0 H ARG A 77 -1.785 19.750 8.490 1.00 0.00 H new ATOM 0 HA ARG A 77 -3.720 20.560 6.461 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -1.866 18.179 6.068 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -3.183 18.652 5.012 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -2.011 20.774 4.490 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -0.700 20.321 5.561 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -1.155 18.128 3.758 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -1.097 19.598 2.805 1.00 0.00 H new ATOM 0 HE ARG A 77 1.170 19.887 3.352 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -0.278 17.290 5.269 1.00 0.00 H new ATOM 0 HH12 ARG A 77 1.282 16.702 5.853 1.00 0.00 H new ATOM 0 HH21 ARG A 77 3.159 19.122 4.112 1.00 0.00 H new ATOM 0 HH22 ARG A 77 3.216 17.732 5.202 1.00 0.00 H new ATOM 1234 N ARG A 78 -5.285 18.870 7.392 1.00 0.00 N ATOM 1235 CA ARG A 78 -6.238 17.996 8.066 1.00 0.00 C ATOM 1236 C ARG A 78 -6.225 16.600 7.450 1.00 0.00 C ATOM 1237 O ARG A 78 -6.342 16.445 6.235 1.00 0.00 O ATOM 1238 CB ARG A 78 -7.647 18.589 7.992 1.00 0.00 C ATOM 1239 CG ARG A 78 -8.405 18.522 9.307 1.00 0.00 C ATOM 1240 CD ARG A 78 -7.765 19.408 10.365 1.00 0.00 C ATOM 1241 NE ARG A 78 -8.139 19.002 11.718 1.00 0.00 N ATOM 1242 CZ ARG A 78 -7.448 19.329 12.808 1.00 0.00 C ATOM 1243 NH1 ARG A 78 -6.347 20.064 12.710 1.00 0.00 N ATOM 1244 NH2 ARG A 78 -7.858 18.918 14.000 1.00 0.00 N ATOM 0 H ARG A 78 -5.707 19.535 6.744 1.00 0.00 H new ATOM 0 HA ARG A 78 -5.942 17.914 9.112 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -7.578 19.629 7.675 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.215 18.060 7.227 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -9.438 18.831 9.149 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -8.431 17.491 9.661 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -6.681 19.370 10.262 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -8.065 20.443 10.201 1.00 0.00 H new ATOM 0 HE ARG A 78 -8.979 18.435 11.834 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -6.026 20.382 11.796 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -5.822 20.311 13.549 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -8.702 18.352 14.082 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -7.329 19.168 14.835 1.00 0.00 H new ATOM 1258 N TYR A 79 -6.080 15.587 8.299 1.00 0.00 N ATOM 1259 CA TYR A 79 -6.050 14.204 7.840 1.00 0.00 C ATOM 1260 C TYR A 79 -7.377 13.811 7.197 1.00 0.00 C ATOM 1261 O TYR A 79 -7.418 12.960 6.307 1.00 0.00 O ATOM 1262 CB TYR A 79 -5.734 13.264 9.007 1.00 0.00 C ATOM 1263 CG TYR A 79 -6.847 13.164 10.027 1.00 0.00 C ATOM 1264 CD1 TYR A 79 -6.997 14.130 11.016 1.00 0.00 C ATOM 1265 CD2 TYR A 79 -7.747 12.107 10.001 1.00 0.00 C ATOM 1266 CE1 TYR A 79 -8.013 14.042 11.950 1.00 0.00 C ATOM 1267 CE2 TYR A 79 -8.766 12.012 10.931 1.00 0.00 C ATOM 1268 CZ TYR A 79 -8.894 12.982 11.902 1.00 0.00 C ATOM 1269 OH TYR A 79 -9.906 12.892 12.830 1.00 0.00 O ATOM 0 H TYR A 79 -5.982 15.699 9.308 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.266 14.115 7.088 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -5.523 12.269 8.614 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -4.827 13.609 9.504 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -6.309 14.962 11.055 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -7.649 11.346 9.241 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -8.116 14.799 12.713 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.457 11.183 10.897 1.00 0.00 H new ATOM 0 HH TYR A 79 -9.865 12.020 13.275 1.00 0.00 H new ATOM 1279 N ASP A 80 -8.460 14.433 7.653 1.00 0.00 N ATOM 1280 CA ASP A 80 -9.787 14.145 7.123 1.00 0.00 C ATOM 1281 C ASP A 80 -10.178 15.149 6.042 1.00 0.00 C ATOM 1282 O ASP A 80 -11.362 15.412 5.826 1.00 0.00 O ATOM 1283 CB ASP A 80 -10.822 14.161 8.249 1.00 0.00 C ATOM 1284 CG ASP A 80 -10.747 15.421 9.088 1.00 0.00 C ATOM 1285 OD1 ASP A 80 -9.692 15.655 9.716 1.00 0.00 O ATOM 1286 OD2 ASP A 80 -11.742 16.176 9.117 1.00 0.00 O ATOM 0 H ASP A 80 -8.444 15.140 8.388 1.00 0.00 H new ATOM 0 HA ASP A 80 -9.761 13.152 6.674 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -11.821 14.072 7.822 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -10.671 13.292 8.890 1.00 0.00 H new ATOM 1291 N ASP A 81 -9.180 15.704 5.362 1.00 0.00 N ATOM 1292 CA ASP A 81 -9.424 16.674 4.300 1.00 0.00 C ATOM 1293 C ASP A 81 -9.494 15.979 2.940 1.00 0.00 C ATOM 1294 O ASP A 81 -8.556 15.289 2.542 1.00 0.00 O ATOM 1295 CB ASP A 81 -8.320 17.732 4.288 1.00 0.00 C ATOM 1296 CG ASP A 81 -8.841 19.106 3.910 1.00 0.00 C ATOM 1297 OD1 ASP A 81 -9.478 19.226 2.843 1.00 0.00 O ATOM 1298 OD2 ASP A 81 -8.610 20.061 4.681 1.00 0.00 O ATOM 0 H ASP A 81 -8.195 15.499 5.527 1.00 0.00 H new ATOM 0 HA ASP A 81 -10.381 17.159 4.492 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.856 17.781 5.273 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.543 17.435 3.584 1.00 0.00 H new ATOM 1303 N PRO A 82 -10.609 16.149 2.205 1.00 0.00 N ATOM 1304 CA PRO A 82 -10.785 15.529 0.886 1.00 0.00 C ATOM 1305 C PRO A 82 -9.760 16.028 -0.127 1.00 0.00 C ATOM 1306 O PRO A 82 -9.358 15.293 -1.030 1.00 0.00 O ATOM 1307 CB PRO A 82 -12.199 15.949 0.469 1.00 0.00 C ATOM 1308 CG PRO A 82 -12.504 17.153 1.293 1.00 0.00 C ATOM 1309 CD PRO A 82 -11.781 16.953 2.594 1.00 0.00 C ATOM 0 HA PRO A 82 -10.647 14.448 0.926 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.245 16.178 -0.596 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.918 15.151 0.655 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -12.168 18.063 0.795 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -13.577 17.255 1.454 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -11.488 17.902 3.042 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -12.402 16.434 3.324 1.00 0.00 H new ATOM 1317 N GLU A 83 -9.339 17.279 0.027 1.00 0.00 N ATOM 1318 CA GLU A 83 -8.358 17.871 -0.876 1.00 0.00 C ATOM 1319 C GLU A 83 -7.052 17.084 -0.845 1.00 0.00 C ATOM 1320 O GLU A 83 -6.419 16.869 -1.879 1.00 0.00 O ATOM 1321 CB GLU A 83 -8.103 19.332 -0.497 1.00 0.00 C ATOM 1322 CG GLU A 83 -8.209 20.291 -1.672 1.00 0.00 C ATOM 1323 CD GLU A 83 -7.080 21.303 -1.704 1.00 0.00 C ATOM 1324 OE1 GLU A 83 -5.929 20.918 -1.407 1.00 0.00 O ATOM 1325 OE2 GLU A 83 -7.346 22.480 -2.025 1.00 0.00 O ATOM 0 H GLU A 83 -9.661 17.902 0.768 1.00 0.00 H new ATOM 0 HA GLU A 83 -8.758 17.834 -1.889 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.817 19.630 0.270 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.109 19.417 -0.058 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -8.208 19.722 -2.602 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -9.162 20.817 -1.622 1.00 0.00 H new ATOM 1332 N MET A 84 -6.657 16.656 0.349 1.00 0.00 N ATOM 1333 CA MET A 84 -5.430 15.888 0.521 1.00 0.00 C ATOM 1334 C MET A 84 -5.696 14.398 0.330 1.00 0.00 C ATOM 1335 O MET A 84 -4.848 13.665 -0.179 1.00 0.00 O ATOM 1336 CB MET A 84 -4.839 16.142 1.910 1.00 0.00 C ATOM 1337 CG MET A 84 -3.563 15.362 2.185 1.00 0.00 C ATOM 1338 SD MET A 84 -3.513 14.675 3.852 1.00 0.00 S ATOM 1339 CE MET A 84 -5.050 13.757 3.888 1.00 0.00 C ATOM 0 H MET A 84 -7.170 16.828 1.214 1.00 0.00 H new ATOM 0 HA MET A 84 -4.714 16.211 -0.234 1.00 0.00 H new ATOM 0 HB2 MET A 84 -4.633 17.207 2.018 1.00 0.00 H new ATOM 0 HB3 MET A 84 -5.582 15.883 2.664 1.00 0.00 H new ATOM 0 HG2 MET A 84 -3.473 14.553 1.460 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.704 16.017 2.040 1.00 0.00 H new ATOM 0 HE1 MET A 84 -4.900 12.817 4.419 1.00 0.00 H new ATOM 0 HE2 MET A 84 -5.813 14.345 4.399 1.00 0.00 H new ATOM 0 HE3 MET A 84 -5.374 13.550 2.868 1.00 0.00 H new ATOM 1349 N ILE A 85 -6.881 13.961 0.741 1.00 0.00 N ATOM 1350 CA ILE A 85 -7.268 12.561 0.616 1.00 0.00 C ATOM 1351 C ILE A 85 -7.384 12.155 -0.852 1.00 0.00 C ATOM 1352 O ILE A 85 -7.082 11.019 -1.219 1.00 0.00 O ATOM 1353 CB ILE A 85 -8.609 12.293 1.339 1.00 0.00 C ATOM 1354 CG1 ILE A 85 -8.407 12.339 2.855 1.00 0.00 C ATOM 1355 CG2 ILE A 85 -9.202 10.953 0.923 1.00 0.00 C ATOM 1356 CD1 ILE A 85 -9.622 12.826 3.613 1.00 0.00 C ATOM 0 H ILE A 85 -7.592 14.558 1.165 1.00 0.00 H new ATOM 0 HA ILE A 85 -6.488 11.961 1.085 1.00 0.00 H new ATOM 0 HB ILE A 85 -9.313 13.074 1.050 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -8.144 11.342 3.209 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -7.563 12.990 3.081 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -10.144 10.793 1.448 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -9.381 10.952 -0.152 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -8.506 10.153 1.175 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -9.406 12.832 4.681 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -9.873 13.835 3.288 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -10.464 12.162 3.417 1.00 0.00 H new ATOM 1368 N ASP A 86 -7.824 13.091 -1.687 1.00 0.00 N ATOM 1369 CA ASP A 86 -7.982 12.832 -3.114 1.00 0.00 C ATOM 1370 C ASP A 86 -6.672 12.351 -3.734 1.00 0.00 C ATOM 1371 O ASP A 86 -6.617 11.279 -4.338 1.00 0.00 O ATOM 1372 CB ASP A 86 -8.465 14.094 -3.831 1.00 0.00 C ATOM 1373 CG ASP A 86 -9.263 13.779 -5.082 1.00 0.00 C ATOM 1374 OD1 ASP A 86 -8.642 13.462 -6.118 1.00 0.00 O ATOM 1375 OD2 ASP A 86 -10.509 13.848 -5.023 1.00 0.00 O ATOM 0 H ASP A 86 -8.078 14.036 -1.400 1.00 0.00 H new ATOM 0 HA ASP A 86 -8.727 12.045 -3.232 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -9.080 14.683 -3.150 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.605 14.709 -4.097 1.00 0.00 H new ATOM 1380 N GLU A 87 -5.621 13.150 -3.584 1.00 0.00 N ATOM 1381 CA GLU A 87 -4.314 12.806 -4.133 1.00 0.00 C ATOM 1382 C GLU A 87 -3.709 11.615 -3.398 1.00 0.00 C ATOM 1383 O GLU A 87 -3.092 10.745 -4.012 1.00 0.00 O ATOM 1384 CB GLU A 87 -3.369 14.006 -4.048 1.00 0.00 C ATOM 1385 CG GLU A 87 -3.867 15.226 -4.805 1.00 0.00 C ATOM 1386 CD GLU A 87 -2.748 16.182 -5.170 1.00 0.00 C ATOM 1387 OE1 GLU A 87 -2.114 16.735 -4.247 1.00 0.00 O ATOM 1388 OE2 GLU A 87 -2.505 16.376 -6.380 1.00 0.00 O ATOM 0 H GLU A 87 -5.648 14.040 -3.087 1.00 0.00 H new ATOM 0 HA GLU A 87 -4.450 12.532 -5.179 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.226 14.272 -3.001 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.393 13.718 -4.440 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -4.375 14.903 -5.714 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.604 15.750 -4.197 1.00 0.00 H new ATOM 1395 N ARG A 88 -3.890 11.578 -2.083 1.00 0.00 N ATOM 1396 CA ARG A 88 -3.363 10.486 -1.273 1.00 0.00 C ATOM 1397 C ARG A 88 -3.859 9.139 -1.792 1.00 0.00 C ATOM 1398 O ARG A 88 -3.224 8.106 -1.576 1.00 0.00 O ATOM 1399 CB ARG A 88 -3.766 10.666 0.192 1.00 0.00 C ATOM 1400 CG ARG A 88 -2.595 10.980 1.111 1.00 0.00 C ATOM 1401 CD ARG A 88 -2.935 12.090 2.094 1.00 0.00 C ATOM 1402 NE ARG A 88 -2.620 11.717 3.471 1.00 0.00 N ATOM 1403 CZ ARG A 88 -1.394 11.758 3.987 1.00 0.00 C ATOM 1404 NH1 ARG A 88 -0.366 12.149 3.244 1.00 0.00 N ATOM 1405 NH2 ARG A 88 -1.196 11.405 5.250 1.00 0.00 N ATOM 0 H ARG A 88 -4.396 12.290 -1.556 1.00 0.00 H new ATOM 0 HA ARG A 88 -2.275 10.504 -1.344 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.498 11.470 0.263 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.256 9.757 0.540 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.312 10.082 1.660 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -1.732 11.274 0.514 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.384 12.992 1.827 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -3.995 12.330 2.017 1.00 0.00 H new ATOM 0 HE ARG A 88 -3.384 11.407 4.072 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.513 12.420 2.272 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.571 12.178 3.645 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -1.983 11.103 5.824 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.257 11.436 5.647 1.00 0.00 H new ATOM 1419 N ARG A 89 -4.997 9.157 -2.481 1.00 0.00 N ATOM 1420 CA ARG A 89 -5.577 7.940 -3.035 1.00 0.00 C ATOM 1421 C ARG A 89 -4.644 7.317 -4.068 1.00 0.00 C ATOM 1422 O ARG A 89 -4.264 6.152 -3.950 1.00 0.00 O ATOM 1423 CB ARG A 89 -6.935 8.241 -3.672 1.00 0.00 C ATOM 1424 CG ARG A 89 -7.956 7.131 -3.478 1.00 0.00 C ATOM 1425 CD ARG A 89 -9.222 7.639 -2.803 1.00 0.00 C ATOM 1426 NE ARG A 89 -10.365 7.641 -3.713 1.00 0.00 N ATOM 1427 CZ ARG A 89 -11.533 8.216 -3.434 1.00 0.00 C ATOM 1428 NH1 ARG A 89 -11.715 8.838 -2.275 1.00 0.00 N ATOM 1429 NH2 ARG A 89 -12.521 8.169 -4.317 1.00 0.00 N ATOM 0 H ARG A 89 -5.535 10.003 -2.668 1.00 0.00 H new ATOM 0 HA ARG A 89 -5.716 7.229 -2.221 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.329 9.165 -3.248 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -6.796 8.414 -4.739 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -8.209 6.697 -4.445 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -7.518 6.335 -2.876 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.448 7.014 -1.939 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -9.054 8.649 -2.430 1.00 0.00 H new ATOM 0 HE ARG A 89 -10.262 7.175 -4.614 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -10.958 8.877 -1.593 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -12.612 9.277 -2.067 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -12.386 7.693 -5.209 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -13.416 8.609 -4.104 1.00 0.00 H new ATOM 1443 N ILE A 90 -4.282 8.096 -5.083 1.00 0.00 N ATOM 1444 CA ILE A 90 -3.395 7.611 -6.135 1.00 0.00 C ATOM 1445 C ILE A 90 -1.995 7.342 -5.601 1.00 0.00 C ATOM 1446 O ILE A 90 -1.612 7.844 -4.545 1.00 0.00 O ATOM 1447 CB ILE A 90 -3.300 8.605 -7.308 1.00 0.00 C ATOM 1448 CG1 ILE A 90 -3.112 10.036 -6.791 1.00 0.00 C ATOM 1449 CG2 ILE A 90 -4.537 8.498 -8.185 1.00 0.00 C ATOM 1450 CD1 ILE A 90 -3.244 11.094 -7.862 1.00 0.00 C ATOM 0 H ILE A 90 -4.588 9.062 -5.199 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.829 6.679 -6.496 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.428 8.353 -7.912 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -3.847 10.230 -6.010 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.128 10.120 -6.330 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.460 9.205 -9.011 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -4.616 7.485 -8.580 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.423 8.727 -7.593 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.098 12.080 -7.420 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.491 10.927 -8.633 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -4.237 11.039 -8.307 1.00 0.00 H new ATOM 1462 N GLY A 91 -1.234 6.547 -6.347 1.00 0.00 N ATOM 1463 CA GLY A 91 0.121 6.221 -5.943 1.00 0.00 C ATOM 1464 C GLY A 91 0.205 4.942 -5.131 1.00 0.00 C ATOM 1465 O GLY A 91 1.255 4.302 -5.078 1.00 0.00 O ATOM 0 H GLY A 91 -1.532 6.122 -7.225 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.746 6.123 -6.831 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.528 7.045 -5.357 1.00 0.00 H new ATOM 1469 N LEU A 92 -0.901 4.568 -4.493 1.00 0.00 N ATOM 1470 CA LEU A 92 -0.939 3.358 -3.678 1.00 0.00 C ATOM 1471 C LEU A 92 -1.016 2.109 -4.549 1.00 0.00 C ATOM 1472 O LEU A 92 -0.267 1.153 -4.347 1.00 0.00 O ATOM 1473 CB LEU A 92 -2.134 3.402 -2.723 1.00 0.00 C ATOM 1474 CG LEU A 92 -2.154 4.594 -1.764 1.00 0.00 C ATOM 1475 CD1 LEU A 92 -3.522 4.734 -1.115 1.00 0.00 C ATOM 1476 CD2 LEU A 92 -1.071 4.443 -0.707 1.00 0.00 C ATOM 0 H LEU A 92 -1.780 5.084 -4.525 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.017 3.314 -3.099 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.051 3.414 -3.313 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -2.145 2.483 -2.137 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.953 5.501 -2.335 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.517 5.587 -0.436 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.277 4.888 -1.886 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.754 3.827 -0.556 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.099 5.299 -0.033 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.242 3.528 -0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.095 4.393 -1.190 1.00 0.00 H new ATOM 1488 N GLU A 93 -1.930 2.119 -5.515 1.00 0.00 N ATOM 1489 CA GLU A 93 -2.109 0.982 -6.414 1.00 0.00 C ATOM 1490 C GLU A 93 -0.802 0.622 -7.117 1.00 0.00 C ATOM 1491 O GLU A 93 -0.482 -0.555 -7.285 1.00 0.00 O ATOM 1492 CB GLU A 93 -3.190 1.289 -7.452 1.00 0.00 C ATOM 1493 CG GLU A 93 -4.479 1.823 -6.850 1.00 0.00 C ATOM 1494 CD GLU A 93 -5.003 3.044 -7.580 1.00 0.00 C ATOM 1495 OE1 GLU A 93 -4.690 3.197 -8.780 1.00 0.00 O ATOM 1496 OE2 GLU A 93 -5.726 3.846 -6.953 1.00 0.00 O ATOM 0 H GLU A 93 -2.559 2.902 -5.696 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.421 0.128 -5.813 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.802 2.018 -8.163 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.410 0.381 -8.014 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -5.237 1.040 -6.870 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -4.309 2.075 -5.803 1.00 0.00 H new ATOM 1503 N ARG A 94 -0.052 1.639 -7.525 1.00 0.00 N ATOM 1504 CA ARG A 94 1.221 1.417 -8.211 1.00 0.00 C ATOM 1505 C ARG A 94 2.266 0.870 -7.243 1.00 0.00 C ATOM 1506 O ARG A 94 3.138 0.092 -7.631 1.00 0.00 O ATOM 1507 CB ARG A 94 1.746 2.700 -8.880 1.00 0.00 C ATOM 1508 CG ARG A 94 1.172 3.994 -8.321 1.00 0.00 C ATOM 1509 CD ARG A 94 -0.155 4.342 -8.979 1.00 0.00 C ATOM 1510 NE ARG A 94 0.002 5.323 -10.049 1.00 0.00 N ATOM 1511 CZ ARG A 94 -0.896 5.520 -11.013 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -2.015 4.807 -11.042 1.00 0.00 N ATOM 1513 NH2 ARG A 94 -0.674 6.433 -11.949 1.00 0.00 N ATOM 0 H ARG A 94 -0.299 2.620 -7.395 1.00 0.00 H new ATOM 0 HA ARG A 94 1.038 0.682 -8.995 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.831 2.727 -8.779 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.526 2.653 -9.947 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.032 3.896 -7.244 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.882 4.806 -8.478 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.608 3.436 -9.382 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.840 4.733 -8.227 1.00 0.00 H new ATOM 0 HE ARG A 94 0.849 5.891 -10.059 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -2.191 4.104 -10.324 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -2.699 4.962 -11.782 1.00 0.00 H new ATOM 0 HH21 ARG A 94 0.184 6.984 -11.931 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -1.361 6.584 -12.687 1.00 0.00 H new ATOM 1527 N PHE A 95 2.170 1.274 -5.981 1.00 0.00 N ATOM 1528 CA PHE A 95 3.104 0.814 -4.961 1.00 0.00 C ATOM 1529 C PHE A 95 3.018 -0.701 -4.800 1.00 0.00 C ATOM 1530 O PHE A 95 4.020 -1.368 -4.545 1.00 0.00 O ATOM 1531 CB PHE A 95 2.813 1.500 -3.624 1.00 0.00 C ATOM 1532 CG PHE A 95 3.836 1.214 -2.561 1.00 0.00 C ATOM 1533 CD1 PHE A 95 3.759 0.058 -1.800 1.00 0.00 C ATOM 1534 CD2 PHE A 95 4.875 2.100 -2.322 1.00 0.00 C ATOM 1535 CE1 PHE A 95 4.697 -0.209 -0.821 1.00 0.00 C ATOM 1536 CE2 PHE A 95 5.816 1.839 -1.343 1.00 0.00 C ATOM 1537 CZ PHE A 95 5.726 0.683 -0.593 1.00 0.00 C ATOM 0 H PHE A 95 1.456 1.918 -5.641 1.00 0.00 H new ATOM 0 HA PHE A 95 4.114 1.075 -5.279 1.00 0.00 H new ATOM 0 HB2 PHE A 95 2.759 2.577 -3.783 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.833 1.181 -3.268 1.00 0.00 H new ATOM 0 HD1 PHE A 95 2.956 -0.643 -1.974 1.00 0.00 H new ATOM 0 HD2 PHE A 95 4.950 3.005 -2.907 1.00 0.00 H new ATOM 0 HE1 PHE A 95 4.625 -1.114 -0.235 1.00 0.00 H new ATOM 0 HE2 PHE A 95 6.620 2.538 -1.165 1.00 0.00 H new ATOM 0 HZ PHE A 95 6.460 0.477 0.172 1.00 0.00 H new ATOM 1547 N LEU A 96 1.810 -1.234 -4.954 1.00 0.00 N ATOM 1548 CA LEU A 96 1.582 -2.670 -4.830 1.00 0.00 C ATOM 1549 C LEU A 96 1.798 -3.379 -6.163 1.00 0.00 C ATOM 1550 O LEU A 96 2.350 -4.478 -6.211 1.00 0.00 O ATOM 1551 CB LEU A 96 0.162 -2.940 -4.327 1.00 0.00 C ATOM 1552 CG LEU A 96 -0.280 -2.084 -3.139 1.00 0.00 C ATOM 1553 CD1 LEU A 96 -1.745 -2.335 -2.816 1.00 0.00 C ATOM 1554 CD2 LEU A 96 0.591 -2.369 -1.925 1.00 0.00 C ATOM 0 H LEU A 96 0.972 -0.692 -5.165 1.00 0.00 H new ATOM 0 HA LEU A 96 2.301 -3.061 -4.110 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.535 -2.779 -5.150 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.087 -3.990 -4.046 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.163 -1.034 -3.408 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -2.042 -1.717 -1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.357 -2.081 -3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.888 -3.386 -2.566 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.263 -1.752 -1.089 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.505 -3.421 -1.655 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.630 -2.138 -2.160 1.00 0.00 H new ATOM 1566 N ASN A 97 1.352 -2.747 -7.243 1.00 0.00 N ATOM 1567 CA ASN A 97 1.483 -3.317 -8.582 1.00 0.00 C ATOM 1568 C ASN A 97 2.923 -3.734 -8.876 1.00 0.00 C ATOM 1569 O ASN A 97 3.199 -4.905 -9.135 1.00 0.00 O ATOM 1570 CB ASN A 97 1.010 -2.311 -9.633 1.00 0.00 C ATOM 1571 CG ASN A 97 -0.448 -2.502 -10.002 1.00 0.00 C ATOM 1572 OD1 ASN A 97 -0.772 -2.851 -11.137 1.00 0.00 O ATOM 1573 ND2 ASN A 97 -1.337 -2.271 -9.042 1.00 0.00 N ATOM 0 H ASN A 97 0.894 -1.836 -7.218 1.00 0.00 H new ATOM 0 HA ASN A 97 0.857 -4.209 -8.625 1.00 0.00 H new ATOM 0 HB2 ASN A 97 1.157 -1.299 -9.255 1.00 0.00 H new ATOM 0 HB3 ASN A 97 1.624 -2.409 -10.528 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.333 -2.381 -9.232 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -1.023 -1.983 -8.115 1.00 0.00 H new ATOM 1580 N GLU A 98 3.836 -2.769 -8.843 1.00 0.00 N ATOM 1581 CA GLU A 98 5.244 -3.037 -9.117 1.00 0.00 C ATOM 1582 C GLU A 98 5.844 -4.002 -8.094 1.00 0.00 C ATOM 1583 O GLU A 98 6.903 -4.583 -8.330 1.00 0.00 O ATOM 1584 CB GLU A 98 6.039 -1.730 -9.129 1.00 0.00 C ATOM 1585 CG GLU A 98 7.458 -1.886 -9.649 1.00 0.00 C ATOM 1586 CD GLU A 98 7.512 -2.033 -11.156 1.00 0.00 C ATOM 1587 OE1 GLU A 98 6.965 -3.028 -11.676 1.00 0.00 O ATOM 1588 OE2 GLU A 98 8.104 -1.154 -11.818 1.00 0.00 O ATOM 0 H GLU A 98 3.626 -1.794 -8.629 1.00 0.00 H new ATOM 0 HA GLU A 98 5.305 -3.507 -10.098 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.513 -1.000 -9.745 1.00 0.00 H new ATOM 0 HB3 GLU A 98 6.074 -1.326 -8.117 1.00 0.00 H new ATOM 0 HG2 GLU A 98 8.048 -1.019 -9.351 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.917 -2.759 -9.186 1.00 0.00 H new ATOM 1595 N LEU A 99 5.170 -4.168 -6.960 1.00 0.00 N ATOM 1596 CA LEU A 99 5.655 -5.062 -5.912 1.00 0.00 C ATOM 1597 C LEU A 99 5.119 -6.479 -6.098 1.00 0.00 C ATOM 1598 O LEU A 99 5.887 -7.426 -6.261 1.00 0.00 O ATOM 1599 CB LEU A 99 5.255 -4.535 -4.536 1.00 0.00 C ATOM 1600 CG LEU A 99 6.042 -5.136 -3.371 1.00 0.00 C ATOM 1601 CD1 LEU A 99 6.405 -4.063 -2.359 1.00 0.00 C ATOM 1602 CD2 LEU A 99 5.246 -6.251 -2.713 1.00 0.00 C ATOM 0 H LEU A 99 4.291 -3.698 -6.743 1.00 0.00 H new ATOM 0 HA LEU A 99 6.742 -5.095 -5.983 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.384 -3.453 -4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.194 -4.731 -4.380 1.00 0.00 H new ATOM 0 HG LEU A 99 6.967 -5.559 -3.761 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.965 -4.511 -1.538 1.00 0.00 H new ATOM 0 HD12 LEU A 99 7.017 -3.300 -2.841 1.00 0.00 H new ATOM 0 HD13 LEU A 99 5.495 -3.606 -1.971 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.820 -6.668 -1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.304 -5.852 -2.336 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.042 -7.033 -3.444 1.00 0.00 H new ATOM 1614 N TYR A 100 3.798 -6.617 -6.063 1.00 0.00 N ATOM 1615 CA TYR A 100 3.160 -7.919 -6.218 1.00 0.00 C ATOM 1616 C TYR A 100 3.321 -8.448 -7.640 1.00 0.00 C ATOM 1617 O TYR A 100 3.470 -9.652 -7.850 1.00 0.00 O ATOM 1618 CB TYR A 100 1.675 -7.829 -5.860 1.00 0.00 C ATOM 1619 CG TYR A 100 1.413 -7.325 -4.457 1.00 0.00 C ATOM 1620 CD1 TYR A 100 2.334 -7.532 -3.436 1.00 0.00 C ATOM 1621 CD2 TYR A 100 0.241 -6.644 -4.153 1.00 0.00 C ATOM 1622 CE1 TYR A 100 2.094 -7.073 -2.154 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -0.005 -6.182 -2.873 1.00 0.00 C ATOM 1624 CZ TYR A 100 0.925 -6.399 -1.879 1.00 0.00 C ATOM 1625 OH TYR A 100 0.682 -5.941 -0.603 1.00 0.00 O ATOM 0 H TYR A 100 3.148 -5.843 -5.929 1.00 0.00 H new ATOM 0 HA TYR A 100 3.651 -8.615 -5.538 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.179 -7.169 -6.571 1.00 0.00 H new ATOM 0 HB3 TYR A 100 1.224 -8.815 -5.972 1.00 0.00 H new ATOM 0 HD1 TYR A 100 3.252 -8.060 -3.648 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -0.490 -6.473 -4.929 1.00 0.00 H new ATOM 0 HE1 TYR A 100 2.820 -7.242 -1.372 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -0.921 -5.654 -2.653 1.00 0.00 H new ATOM 0 HH TYR A 100 -0.186 -5.486 -0.578 1.00 0.00 H new ATOM 1635 N ASN A 101 3.289 -7.545 -8.613 1.00 0.00 N ATOM 1636 CA ASN A 101 3.429 -7.929 -10.013 1.00 0.00 C ATOM 1637 C ASN A 101 4.900 -8.033 -10.406 1.00 0.00 C ATOM 1638 O ASN A 101 5.355 -7.368 -11.337 1.00 0.00 O ATOM 1639 CB ASN A 101 2.712 -6.922 -10.914 1.00 0.00 C ATOM 1640 CG ASN A 101 1.980 -7.592 -12.060 1.00 0.00 C ATOM 1641 OD1 ASN A 101 2.387 -7.490 -13.217 1.00 0.00 O ATOM 1642 ND2 ASN A 101 0.890 -8.282 -11.742 1.00 0.00 N ATOM 0 H ASN A 101 3.168 -6.544 -8.459 1.00 0.00 H new ATOM 0 HA ASN A 101 2.971 -8.909 -10.143 1.00 0.00 H new ATOM 0 HB2 ASN A 101 2.002 -6.347 -10.319 1.00 0.00 H new ATOM 0 HB3 ASN A 101 3.438 -6.215 -11.314 1.00 0.00 H new ATOM 0 HD21 ASN A 101 0.354 -8.754 -12.471 1.00 0.00 H new ATOM 0 HD22 ASN A 101 0.589 -8.340 -10.769 1.00 0.00 H new ATOM 1649 N ASP A 102 5.640 -8.874 -9.691 1.00 0.00 N ATOM 1650 CA ASP A 102 7.059 -9.070 -9.965 1.00 0.00 C ATOM 1651 C ASP A 102 7.334 -10.508 -10.396 1.00 0.00 C ATOM 1652 O ASP A 102 6.824 -11.453 -9.798 1.00 0.00 O ATOM 1653 CB ASP A 102 7.892 -8.723 -8.727 1.00 0.00 C ATOM 1654 CG ASP A 102 8.920 -7.644 -9.007 1.00 0.00 C ATOM 1655 OD1 ASP A 102 9.603 -7.732 -10.049 1.00 0.00 O ATOM 1656 OD2 ASP A 102 9.042 -6.713 -8.184 1.00 0.00 O ATOM 0 H ASP A 102 5.280 -9.431 -8.916 1.00 0.00 H new ATOM 0 HA ASP A 102 7.344 -8.405 -10.781 1.00 0.00 H new ATOM 0 HB2 ASP A 102 7.229 -8.391 -7.928 1.00 0.00 H new ATOM 0 HB3 ASP A 102 8.398 -9.620 -8.370 1.00 0.00 H new ATOM 1661 N ARG A 103 8.141 -10.663 -11.441 1.00 0.00 N ATOM 1662 CA ARG A 103 8.483 -11.985 -11.955 1.00 0.00 C ATOM 1663 C ARG A 103 9.973 -12.268 -11.793 1.00 0.00 C ATOM 1664 O ARG A 103 10.373 -13.394 -11.501 1.00 0.00 O ATOM 1665 CB ARG A 103 8.087 -12.099 -13.428 1.00 0.00 C ATOM 1666 CG ARG A 103 6.590 -11.984 -13.668 1.00 0.00 C ATOM 1667 CD ARG A 103 5.986 -13.312 -14.094 1.00 0.00 C ATOM 1668 NE ARG A 103 6.475 -13.742 -15.402 1.00 0.00 N ATOM 1669 CZ ARG A 103 6.022 -13.260 -16.557 1.00 0.00 C ATOM 1670 NH1 ARG A 103 5.072 -12.332 -16.571 1.00 0.00 N ATOM 1671 NH2 ARG A 103 6.518 -13.708 -17.702 1.00 0.00 N ATOM 0 H ARG A 103 8.570 -9.889 -11.949 1.00 0.00 H new ATOM 0 HA ARG A 103 7.929 -12.725 -11.377 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.598 -11.320 -13.994 1.00 0.00 H new ATOM 0 HB3 ARG A 103 8.436 -13.056 -13.816 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.101 -11.637 -12.758 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.401 -11.235 -14.437 1.00 0.00 H new ATOM 0 HD2 ARG A 103 6.223 -14.073 -13.350 1.00 0.00 H new ATOM 0 HD3 ARG A 103 4.900 -13.223 -14.124 1.00 0.00 H new ATOM 0 HE ARG A 103 7.206 -14.453 -15.432 1.00 0.00 H new ATOM 0 HH11 ARG A 103 4.685 -11.985 -15.693 1.00 0.00 H new ATOM 0 HH12 ARG A 103 4.729 -11.967 -17.459 1.00 0.00 H new ATOM 0 HH21 ARG A 103 7.247 -14.422 -17.698 1.00 0.00 H new ATOM 0 HH22 ARG A 103 6.171 -13.339 -18.587 1.00 0.00 H new ATOM 1685 N PHE A 104 10.791 -11.238 -11.987 1.00 0.00 N ATOM 1686 CA PHE A 104 12.237 -11.377 -11.864 1.00 0.00 C ATOM 1687 C PHE A 104 12.652 -11.492 -10.401 1.00 0.00 C ATOM 1688 O PHE A 104 13.331 -12.442 -10.011 1.00 0.00 O ATOM 1689 CB PHE A 104 12.942 -10.185 -12.513 1.00 0.00 C ATOM 1690 CG PHE A 104 12.989 -10.258 -14.012 1.00 0.00 C ATOM 1691 CD1 PHE A 104 11.831 -10.456 -14.746 1.00 0.00 C ATOM 1692 CD2 PHE A 104 14.192 -10.131 -14.688 1.00 0.00 C ATOM 1693 CE1 PHE A 104 11.871 -10.524 -16.126 1.00 0.00 C ATOM 1694 CE2 PHE A 104 14.239 -10.198 -16.067 1.00 0.00 C ATOM 1695 CZ PHE A 104 13.076 -10.395 -16.788 1.00 0.00 C ATOM 0 H PHE A 104 10.477 -10.299 -12.230 1.00 0.00 H new ATOM 0 HA PHE A 104 12.533 -12.291 -12.379 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.433 -9.268 -12.218 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.960 -10.122 -12.128 1.00 0.00 H new ATOM 0 HD1 PHE A 104 10.886 -10.558 -14.234 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.104 -9.978 -14.130 1.00 0.00 H new ATOM 0 HE1 PHE A 104 10.960 -10.678 -16.686 1.00 0.00 H new ATOM 0 HE2 PHE A 104 15.183 -10.097 -16.581 1.00 0.00 H new ATOM 0 HZ PHE A 104 13.110 -10.448 -17.866 1.00 0.00 H new ATOM 1705 N ASP A 105 12.239 -10.519 -9.598 1.00 0.00 N ATOM 1706 CA ASP A 105 12.567 -10.508 -8.177 1.00 0.00 C ATOM 1707 C ASP A 105 11.336 -10.189 -7.338 1.00 0.00 C ATOM 1708 O ASP A 105 10.845 -9.060 -7.342 1.00 0.00 O ATOM 1709 CB ASP A 105 13.669 -9.487 -7.896 1.00 0.00 C ATOM 1710 CG ASP A 105 15.058 -10.075 -8.056 1.00 0.00 C ATOM 1711 OD1 ASP A 105 15.584 -10.632 -7.070 1.00 0.00 O ATOM 1712 OD2 ASP A 105 15.618 -9.979 -9.168 1.00 0.00 O ATOM 0 H ASP A 105 11.676 -9.727 -9.907 1.00 0.00 H new ATOM 0 HA ASP A 105 12.923 -11.501 -7.903 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.556 -8.640 -8.572 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.555 -9.103 -6.882 1.00 0.00 H new ATOM 1717 N SER A 106 10.841 -11.190 -6.619 1.00 0.00 N ATOM 1718 CA SER A 106 9.667 -11.013 -5.774 1.00 0.00 C ATOM 1719 C SER A 106 10.057 -10.918 -4.303 1.00 0.00 C ATOM 1720 O SER A 106 9.254 -11.218 -3.421 1.00 0.00 O ATOM 1721 CB SER A 106 8.684 -12.165 -5.974 1.00 0.00 C ATOM 1722 OG SER A 106 9.367 -13.391 -6.174 1.00 0.00 O ATOM 0 H SER A 106 11.234 -12.131 -6.605 1.00 0.00 H new ATOM 0 HA SER A 106 9.187 -10.079 -6.066 1.00 0.00 H new ATOM 0 HB2 SER A 106 8.032 -12.246 -5.104 1.00 0.00 H new ATOM 0 HB3 SER A 106 8.045 -11.957 -6.832 1.00 0.00 H new ATOM 0 HG SER A 106 8.715 -14.112 -6.298 1.00 0.00 H new ATOM 1728 N ARG A 107 11.289 -10.493 -4.042 1.00 0.00 N ATOM 1729 CA ARG A 107 11.765 -10.354 -2.670 1.00 0.00 C ATOM 1730 C ARG A 107 10.903 -9.353 -1.913 1.00 0.00 C ATOM 1731 O ARG A 107 10.668 -9.497 -0.713 1.00 0.00 O ATOM 1732 CB ARG A 107 13.225 -9.899 -2.652 1.00 0.00 C ATOM 1733 CG ARG A 107 14.140 -10.732 -3.532 1.00 0.00 C ATOM 1734 CD ARG A 107 15.310 -9.909 -4.042 1.00 0.00 C ATOM 1735 NE ARG A 107 14.885 -8.869 -4.975 1.00 0.00 N ATOM 1736 CZ ARG A 107 15.715 -8.212 -5.781 1.00 0.00 C ATOM 1737 NH1 ARG A 107 17.014 -8.480 -5.769 1.00 0.00 N ATOM 1738 NH2 ARG A 107 15.244 -7.281 -6.601 1.00 0.00 N ATOM 0 H ARG A 107 11.972 -10.240 -4.757 1.00 0.00 H new ATOM 0 HA ARG A 107 11.695 -11.326 -2.182 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.275 -8.859 -2.974 1.00 0.00 H new ATOM 0 HB3 ARG A 107 13.593 -9.933 -1.627 1.00 0.00 H new ATOM 0 HG2 ARG A 107 14.512 -11.587 -2.968 1.00 0.00 H new ATOM 0 HG3 ARG A 107 13.575 -11.128 -4.376 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.825 -9.450 -3.198 1.00 0.00 H new ATOM 0 HD3 ARG A 107 16.027 -10.566 -4.534 1.00 0.00 H new ATOM 0 HE ARG A 107 13.893 -8.632 -5.011 1.00 0.00 H new ATOM 0 HH11 ARG A 107 17.382 -9.193 -5.139 1.00 0.00 H new ATOM 0 HH12 ARG A 107 17.645 -7.973 -6.389 1.00 0.00 H new ATOM 0 HH21 ARG A 107 14.246 -7.069 -6.613 1.00 0.00 H new ATOM 0 HH22 ARG A 107 15.880 -6.777 -7.219 1.00 0.00 H new ATOM 1752 N TRP A 108 10.438 -8.336 -2.628 1.00 0.00 N ATOM 1753 CA TRP A 108 9.600 -7.299 -2.040 1.00 0.00 C ATOM 1754 C TRP A 108 8.262 -7.866 -1.575 1.00 0.00 C ATOM 1755 O TRP A 108 7.748 -7.482 -0.524 1.00 0.00 O ATOM 1756 CB TRP A 108 9.371 -6.172 -3.049 1.00 0.00 C ATOM 1757 CG TRP A 108 10.643 -5.544 -3.531 1.00 0.00 C ATOM 1758 CD1 TRP A 108 11.215 -5.689 -4.762 1.00 0.00 C ATOM 1759 CD2 TRP A 108 11.503 -4.674 -2.788 1.00 0.00 C ATOM 1760 NE1 TRP A 108 12.379 -4.962 -4.829 1.00 0.00 N ATOM 1761 CE2 TRP A 108 12.578 -4.329 -3.630 1.00 0.00 C ATOM 1762 CE3 TRP A 108 11.469 -4.153 -1.493 1.00 0.00 C ATOM 1763 CZ2 TRP A 108 13.607 -3.486 -3.216 1.00 0.00 C ATOM 1764 CZ3 TRP A 108 12.490 -3.317 -1.083 1.00 0.00 C ATOM 1765 CH2 TRP A 108 13.546 -2.991 -1.943 1.00 0.00 C ATOM 0 H TRP A 108 10.629 -8.207 -3.622 1.00 0.00 H new ATOM 0 HA TRP A 108 10.119 -6.901 -1.168 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.821 -6.565 -3.904 1.00 0.00 H new ATOM 0 HB3 TRP A 108 8.745 -5.405 -2.592 1.00 0.00 H new ATOM 0 HD1 TRP A 108 10.812 -6.287 -5.565 1.00 0.00 H new ATOM 0 HE1 TRP A 108 12.995 -4.903 -5.640 1.00 0.00 H new ATOM 0 HE3 TRP A 108 10.658 -4.399 -0.823 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 14.423 -3.233 -3.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 12.473 -2.909 -0.083 1.00 0.00 H new ATOM 0 HH2 TRP A 108 14.329 -2.335 -1.593 1.00 0.00 H new ATOM 1776 N ARG A 109 7.697 -8.779 -2.361 1.00 0.00 N ATOM 1777 CA ARG A 109 6.416 -9.388 -2.018 1.00 0.00 C ATOM 1778 C ARG A 109 6.613 -10.644 -1.172 1.00 0.00 C ATOM 1779 O ARG A 109 5.729 -11.035 -0.410 1.00 0.00 O ATOM 1780 CB ARG A 109 5.630 -9.728 -3.286 1.00 0.00 C ATOM 1781 CG ARG A 109 6.312 -10.759 -4.170 1.00 0.00 C ATOM 1782 CD ARG A 109 5.678 -10.815 -5.549 1.00 0.00 C ATOM 1783 NE ARG A 109 4.743 -11.930 -5.677 1.00 0.00 N ATOM 1784 CZ ARG A 109 4.330 -12.422 -6.843 1.00 0.00 C ATOM 1785 NH1 ARG A 109 4.768 -11.902 -7.983 1.00 0.00 N ATOM 1786 NH2 ARG A 109 3.478 -13.438 -6.869 1.00 0.00 N ATOM 0 H ARG A 109 8.104 -9.112 -3.235 1.00 0.00 H new ATOM 0 HA ARG A 109 5.848 -8.666 -1.431 1.00 0.00 H new ATOM 0 HB2 ARG A 109 4.645 -10.099 -3.003 1.00 0.00 H new ATOM 0 HB3 ARG A 109 5.474 -8.816 -3.861 1.00 0.00 H new ATOM 0 HG2 ARG A 109 7.370 -10.516 -4.264 1.00 0.00 H new ATOM 0 HG3 ARG A 109 6.251 -11.741 -3.700 1.00 0.00 H new ATOM 0 HD2 ARG A 109 5.155 -9.879 -5.746 1.00 0.00 H new ATOM 0 HD3 ARG A 109 6.459 -10.908 -6.304 1.00 0.00 H new ATOM 0 HE ARG A 109 4.385 -12.357 -4.822 1.00 0.00 H new ATOM 0 HH11 ARG A 109 5.424 -11.121 -7.969 1.00 0.00 H new ATOM 0 HH12 ARG A 109 4.448 -12.283 -8.873 1.00 0.00 H new ATOM 0 HH21 ARG A 109 3.139 -13.842 -5.996 1.00 0.00 H new ATOM 0 HH22 ARG A 109 3.161 -13.815 -7.762 1.00 0.00 H new ATOM 1800 N ASP A 110 7.778 -11.271 -1.308 1.00 0.00 N ATOM 1801 CA ASP A 110 8.087 -12.479 -0.552 1.00 0.00 C ATOM 1802 C ASP A 110 8.203 -12.173 0.938 1.00 0.00 C ATOM 1803 O ASP A 110 7.898 -13.016 1.782 1.00 0.00 O ATOM 1804 CB ASP A 110 9.388 -13.104 -1.060 1.00 0.00 C ATOM 1805 CG ASP A 110 9.536 -14.553 -0.637 1.00 0.00 C ATOM 1806 OD1 ASP A 110 9.401 -14.835 0.573 1.00 0.00 O ATOM 1807 OD2 ASP A 110 9.788 -15.405 -1.515 1.00 0.00 O ATOM 0 H ASP A 110 8.522 -10.963 -1.934 1.00 0.00 H new ATOM 0 HA ASP A 110 7.271 -13.188 -0.696 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.418 -13.041 -2.148 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.235 -12.530 -0.684 1.00 0.00 H new ATOM 1812 N THR A 111 8.649 -10.960 1.255 1.00 0.00 N ATOM 1813 CA THR A 111 8.808 -10.536 2.641 1.00 0.00 C ATOM 1814 C THR A 111 7.524 -10.757 3.436 1.00 0.00 C ATOM 1815 O THR A 111 6.422 -10.552 2.925 1.00 0.00 O ATOM 1816 CB THR A 111 9.208 -9.059 2.695 1.00 0.00 C ATOM 1817 OG1 THR A 111 9.450 -8.554 1.394 1.00 0.00 O ATOM 1818 CG2 THR A 111 10.451 -8.810 3.520 1.00 0.00 C ATOM 0 H THR A 111 8.907 -10.252 0.567 1.00 0.00 H new ATOM 0 HA THR A 111 9.595 -11.140 3.092 1.00 0.00 H new ATOM 0 HB THR A 111 8.367 -8.549 3.165 1.00 0.00 H new ATOM 0 HG1 THR A 111 10.165 -9.072 0.970 1.00 0.00 H new ATOM 0 HG21 THR A 111 10.681 -7.745 3.519 1.00 0.00 H new ATOM 0 HG22 THR A 111 10.281 -9.143 4.544 1.00 0.00 H new ATOM 0 HG23 THR A 111 11.288 -9.363 3.093 1.00 0.00 H new ATOM 1826 N LYS A 112 7.675 -11.172 4.690 1.00 0.00 N ATOM 1827 CA LYS A 112 6.528 -11.416 5.556 1.00 0.00 C ATOM 1828 C LYS A 112 5.728 -10.134 5.768 1.00 0.00 C ATOM 1829 O LYS A 112 4.505 -10.167 5.900 1.00 0.00 O ATOM 1830 CB LYS A 112 6.987 -11.974 6.904 1.00 0.00 C ATOM 1831 CG LYS A 112 7.074 -13.491 6.937 1.00 0.00 C ATOM 1832 CD LYS A 112 6.491 -14.058 8.222 1.00 0.00 C ATOM 1833 CE LYS A 112 5.778 -15.377 7.975 1.00 0.00 C ATOM 1834 NZ LYS A 112 6.593 -16.301 7.139 1.00 0.00 N ATOM 0 H LYS A 112 8.580 -11.346 5.128 1.00 0.00 H new ATOM 0 HA LYS A 112 5.886 -12.150 5.069 1.00 0.00 H new ATOM 0 HB2 LYS A 112 7.964 -11.557 7.146 1.00 0.00 H new ATOM 0 HB3 LYS A 112 6.297 -11.641 7.679 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.541 -13.905 6.081 1.00 0.00 H new ATOM 0 HG3 LYS A 112 8.116 -13.798 6.843 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.288 -14.205 8.951 1.00 0.00 H new ATOM 0 HD3 LYS A 112 5.793 -13.341 8.654 1.00 0.00 H new ATOM 0 HE2 LYS A 112 5.554 -15.853 8.930 1.00 0.00 H new ATOM 0 HE3 LYS A 112 4.824 -15.187 7.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.299 -17.282 7.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 6.451 -16.076 6.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 7.599 -16.191 7.380 1.00 0.00 H new ATOM 1848 N ILE A 113 6.430 -9.006 5.798 1.00 0.00 N ATOM 1849 CA ILE A 113 5.789 -7.712 5.991 1.00 0.00 C ATOM 1850 C ILE A 113 4.849 -7.390 4.835 1.00 0.00 C ATOM 1851 O ILE A 113 3.763 -6.844 5.038 1.00 0.00 O ATOM 1852 CB ILE A 113 6.828 -6.582 6.121 1.00 0.00 C ATOM 1853 CG1 ILE A 113 7.723 -6.535 4.882 1.00 0.00 C ATOM 1854 CG2 ILE A 113 7.669 -6.770 7.373 1.00 0.00 C ATOM 1855 CD1 ILE A 113 8.765 -5.441 4.929 1.00 0.00 C ATOM 0 H ILE A 113 7.443 -8.963 5.691 1.00 0.00 H new ATOM 0 HA ILE A 113 5.218 -7.777 6.917 1.00 0.00 H new ATOM 0 HB ILE A 113 6.296 -5.634 6.202 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.223 -7.497 4.769 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.100 -6.394 3.999 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.397 -5.962 7.447 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.023 -6.758 8.251 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.191 -7.725 7.320 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.363 -5.468 4.018 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.272 -4.472 5.011 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.413 -5.592 5.792 1.00 0.00 H new ATOM 1867 N ALA A 114 5.271 -7.731 3.623 1.00 0.00 N ATOM 1868 CA ALA A 114 4.468 -7.478 2.435 1.00 0.00 C ATOM 1869 C ALA A 114 3.193 -8.313 2.452 1.00 0.00 C ATOM 1870 O ALA A 114 2.119 -7.834 2.089 1.00 0.00 O ATOM 1871 CB ALA A 114 5.275 -7.770 1.180 1.00 0.00 C ATOM 0 H ALA A 114 6.166 -8.184 3.438 1.00 0.00 H new ATOM 0 HA ALA A 114 4.185 -6.425 2.433 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.662 -7.576 0.300 1.00 0.00 H new ATOM 0 HB2 ALA A 114 6.156 -7.129 1.157 1.00 0.00 H new ATOM 0 HB3 ALA A 114 5.586 -8.815 1.183 1.00 0.00 H new ATOM 1877 N GLN A 115 3.318 -9.565 2.883 1.00 0.00 N ATOM 1878 CA GLN A 115 2.177 -10.467 2.952 1.00 0.00 C ATOM 1879 C GLN A 115 1.213 -10.038 4.054 1.00 0.00 C ATOM 1880 O GLN A 115 -0.004 -10.059 3.870 1.00 0.00 O ATOM 1881 CB GLN A 115 2.647 -11.902 3.200 1.00 0.00 C ATOM 1882 CG GLN A 115 3.655 -12.396 2.176 1.00 0.00 C ATOM 1883 CD GLN A 115 2.996 -12.953 0.929 1.00 0.00 C ATOM 1884 OE1 GLN A 115 2.083 -13.775 1.009 1.00 0.00 O ATOM 1885 NE2 GLN A 115 3.456 -12.506 -0.234 1.00 0.00 N ATOM 0 H GLN A 115 4.200 -9.976 3.190 1.00 0.00 H new ATOM 0 HA GLN A 115 1.653 -10.425 1.997 1.00 0.00 H new ATOM 0 HB2 GLN A 115 3.091 -11.964 4.194 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.782 -12.565 3.195 1.00 0.00 H new ATOM 0 HG2 GLN A 115 4.316 -11.575 1.897 1.00 0.00 H new ATOM 0 HG3 GLN A 115 4.278 -13.167 2.628 1.00 0.00 H new ATOM 0 HE21 GLN A 115 4.215 -11.824 -0.254 1.00 0.00 H new ATOM 0 HE22 GLN A 115 3.051 -12.844 -1.107 1.00 0.00 H new ATOM 1894 N ASP A 116 1.765 -9.649 5.199 1.00 0.00 N ATOM 1895 CA ASP A 116 0.952 -9.215 6.330 1.00 0.00 C ATOM 1896 C ASP A 116 0.198 -7.927 6.007 1.00 0.00 C ATOM 1897 O ASP A 116 -0.772 -7.581 6.681 1.00 0.00 O ATOM 1898 CB ASP A 116 1.832 -9.007 7.565 1.00 0.00 C ATOM 1899 CG ASP A 116 1.156 -9.473 8.840 1.00 0.00 C ATOM 1900 OD1 ASP A 116 -0.028 -9.130 9.044 1.00 0.00 O ATOM 1901 OD2 ASP A 116 1.810 -10.180 9.634 1.00 0.00 O ATOM 0 H ASP A 116 2.771 -9.625 5.368 1.00 0.00 H new ATOM 0 HA ASP A 116 0.220 -9.996 6.536 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.770 -9.548 7.435 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.083 -7.950 7.655 1.00 0.00 H new ATOM 1906 N PHE A 117 0.650 -7.217 4.976 1.00 0.00 N ATOM 1907 CA PHE A 117 0.016 -5.968 4.571 1.00 0.00 C ATOM 1908 C PHE A 117 -1.459 -6.178 4.240 1.00 0.00 C ATOM 1909 O PHE A 117 -2.320 -5.423 4.693 1.00 0.00 O ATOM 1910 CB PHE A 117 0.741 -5.375 3.362 1.00 0.00 C ATOM 1911 CG PHE A 117 0.517 -3.900 3.192 1.00 0.00 C ATOM 1912 CD1 PHE A 117 0.937 -3.006 4.164 1.00 0.00 C ATOM 1913 CD2 PHE A 117 -0.114 -3.408 2.061 1.00 0.00 C ATOM 1914 CE1 PHE A 117 0.732 -1.648 4.009 1.00 0.00 C ATOM 1915 CE2 PHE A 117 -0.322 -2.051 1.901 1.00 0.00 C ATOM 1916 CZ PHE A 117 0.102 -1.170 2.876 1.00 0.00 C ATOM 0 H PHE A 117 1.453 -7.486 4.407 1.00 0.00 H new ATOM 0 HA PHE A 117 0.082 -5.273 5.408 1.00 0.00 H new ATOM 0 HB2 PHE A 117 1.810 -5.563 3.462 1.00 0.00 H new ATOM 0 HB3 PHE A 117 0.409 -5.891 2.461 1.00 0.00 H new ATOM 0 HD1 PHE A 117 1.430 -3.374 5.052 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -0.447 -4.093 1.295 1.00 0.00 H new ATOM 0 HE1 PHE A 117 1.064 -0.961 4.773 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -0.815 -1.680 1.015 1.00 0.00 H new ATOM 0 HZ PHE A 117 -0.059 -0.109 2.753 1.00 0.00 H new ATOM 1926 N LEU A 118 -1.745 -7.205 3.446 1.00 0.00 N ATOM 1927 CA LEU A 118 -3.118 -7.509 3.054 1.00 0.00 C ATOM 1928 C LEU A 118 -3.614 -8.785 3.729 1.00 0.00 C ATOM 1929 O LEU A 118 -4.486 -9.477 3.203 1.00 0.00 O ATOM 1930 CB LEU A 118 -3.217 -7.651 1.533 1.00 0.00 C ATOM 1931 CG LEU A 118 -2.763 -6.430 0.728 1.00 0.00 C ATOM 1932 CD1 LEU A 118 -3.184 -6.565 -0.727 1.00 0.00 C ATOM 1933 CD2 LEU A 118 -3.326 -5.150 1.328 1.00 0.00 C ATOM 0 H LEU A 118 -1.046 -7.840 3.062 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.750 -6.682 3.379 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.620 -8.510 1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.252 -7.872 1.272 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.675 -6.378 0.770 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -2.853 -5.689 -1.284 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.731 -7.459 -1.155 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.270 -6.644 -0.786 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.991 -4.295 0.741 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.415 -5.192 1.319 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.976 -5.045 2.355 1.00 0.00 H new ATOM 1945 N GLN A 119 -3.055 -9.091 4.896 1.00 0.00 N ATOM 1946 CA GLN A 119 -3.445 -10.285 5.639 1.00 0.00 C ATOM 1947 C GLN A 119 -3.201 -11.543 4.813 1.00 0.00 C ATOM 1948 O GLN A 119 -4.013 -12.469 4.816 1.00 0.00 O ATOM 1949 CB GLN A 119 -4.918 -10.202 6.042 1.00 0.00 C ATOM 1950 CG GLN A 119 -5.304 -8.872 6.669 1.00 0.00 C ATOM 1951 CD GLN A 119 -6.631 -8.935 7.399 1.00 0.00 C ATOM 1952 OE1 GLN A 119 -6.675 -8.954 8.629 1.00 0.00 O ATOM 1953 NE2 GLN A 119 -7.722 -8.970 6.642 1.00 0.00 N ATOM 0 H GLN A 119 -2.332 -8.530 5.347 1.00 0.00 H new ATOM 0 HA GLN A 119 -2.833 -10.339 6.539 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -5.537 -10.372 5.161 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -5.139 -11.004 6.746 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -4.525 -8.563 7.366 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -5.357 -8.110 5.892 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -7.638 -8.952 5.626 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -8.643 -9.015 7.077 1.00 0.00 H new ATOM 1962 N LEU A 120 -2.078 -11.568 4.104 1.00 0.00 N ATOM 1963 CA LEU A 120 -1.723 -12.711 3.270 1.00 0.00 C ATOM 1964 C LEU A 120 -0.817 -13.679 4.027 1.00 0.00 C ATOM 1965 O LEU A 120 0.149 -14.203 3.473 1.00 0.00 O ATOM 1966 CB LEU A 120 -1.026 -12.239 1.990 1.00 0.00 C ATOM 1967 CG LEU A 120 -1.525 -10.905 1.430 1.00 0.00 C ATOM 1968 CD1 LEU A 120 -0.455 -10.257 0.565 1.00 0.00 C ATOM 1969 CD2 LEU A 120 -2.807 -11.108 0.636 1.00 0.00 C ATOM 0 H LEU A 120 -1.397 -10.809 4.090 1.00 0.00 H new ATOM 0 HA LEU A 120 -2.642 -13.233 3.005 1.00 0.00 H new ATOM 0 HB2 LEU A 120 0.043 -12.155 2.187 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.150 -13.005 1.225 1.00 0.00 H new ATOM 0 HG LEU A 120 -1.740 -10.238 2.265 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.827 -9.309 0.175 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.438 -10.078 1.164 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.208 -10.919 -0.265 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.148 -10.150 0.245 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.618 -11.791 -0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.575 -11.529 1.286 1.00 0.00 H new ATOM 1981 N SER A 121 -1.138 -13.912 5.295 1.00 0.00 N ATOM 1982 CA SER A 121 -0.353 -14.818 6.126 1.00 0.00 C ATOM 1983 C SER A 121 -1.002 -15.002 7.495 1.00 0.00 C ATOM 1984 O SER A 121 -2.159 -14.636 7.698 1.00 0.00 O ATOM 1985 CB SER A 121 1.073 -14.287 6.289 1.00 0.00 C ATOM 1986 OG SER A 121 1.925 -15.274 6.844 1.00 0.00 O ATOM 0 H SER A 121 -1.935 -13.487 5.769 1.00 0.00 H new ATOM 0 HA SER A 121 -0.317 -15.788 5.630 1.00 0.00 H new ATOM 0 HB2 SER A 121 1.460 -13.972 5.320 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.065 -13.406 6.931 1.00 0.00 H new ATOM 0 HG SER A 121 2.717 -14.844 7.229 1.00 0.00 H new ATOM 1992 N LYS A 122 -0.249 -15.573 8.431 1.00 0.00 N ATOM 1993 CA LYS A 122 -0.751 -15.806 9.780 1.00 0.00 C ATOM 1994 C LYS A 122 -0.189 -14.774 10.757 1.00 0.00 C ATOM 1995 O LYS A 122 0.973 -14.860 11.157 1.00 0.00 O ATOM 1996 CB LYS A 122 -0.383 -17.216 10.244 1.00 0.00 C ATOM 1997 CG LYS A 122 -1.326 -18.292 9.729 1.00 0.00 C ATOM 1998 CD LYS A 122 -2.264 -18.783 10.820 1.00 0.00 C ATOM 1999 CE LYS A 122 -3.080 -19.980 10.356 1.00 0.00 C ATOM 2000 NZ LYS A 122 -4.455 -19.970 10.929 1.00 0.00 N ATOM 0 H LYS A 122 0.711 -15.883 8.279 1.00 0.00 H new ATOM 0 HA LYS A 122 -1.836 -15.707 9.760 1.00 0.00 H new ATOM 0 HB2 LYS A 122 0.630 -17.445 9.915 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -0.377 -17.241 11.334 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -1.909 -17.897 8.897 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -0.746 -19.130 9.342 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -1.686 -19.056 11.703 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -2.935 -17.976 11.115 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -3.140 -19.979 9.268 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -2.572 -20.900 10.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -4.979 -20.802 10.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -4.399 -19.997 11.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -4.949 -19.104 10.632 1.00 0.00 H new ATOM 2014 N PRO A 123 -1.005 -13.782 11.158 1.00 0.00 N ATOM 2015 CA PRO A 123 -0.574 -12.737 12.092 1.00 0.00 C ATOM 2016 C PRO A 123 0.080 -13.313 13.344 1.00 0.00 C ATOM 2017 O PRO A 123 -0.559 -14.024 14.120 1.00 0.00 O ATOM 2018 CB PRO A 123 -1.878 -12.023 12.451 1.00 0.00 C ATOM 2019 CG PRO A 123 -2.764 -12.242 11.275 1.00 0.00 C ATOM 2020 CD PRO A 123 -2.408 -13.599 10.734 1.00 0.00 C ATOM 0 HA PRO A 123 0.179 -12.083 11.653 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -2.317 -12.434 13.360 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -1.712 -10.961 12.629 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -3.814 -12.201 11.565 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -2.611 -11.469 10.522 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -3.055 -14.376 11.141 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -2.508 -13.637 9.649 1.00 0.00 H new ATOM 2028 N ASN A 124 1.358 -13.000 13.535 1.00 0.00 N ATOM 2029 CA ASN A 124 2.099 -13.486 14.692 1.00 0.00 C ATOM 2030 C ASN A 124 2.753 -12.331 15.443 1.00 0.00 C ATOM 2031 O ASN A 124 3.028 -12.490 16.651 1.00 0.00 O ATOM 2032 CB ASN A 124 3.163 -14.495 14.255 1.00 0.00 C ATOM 2033 CG ASN A 124 3.290 -15.656 15.222 1.00 0.00 C ATOM 2034 OD1 ASN A 124 2.336 -16.011 15.913 1.00 0.00 O ATOM 2035 ND2 ASN A 124 4.474 -16.255 15.275 1.00 0.00 N ATOM 2036 OXT ASN A 124 2.988 -11.277 14.816 1.00 0.00 O ATOM 0 H ASN A 124 1.901 -12.412 12.903 1.00 0.00 H new ATOM 0 HA ASN A 124 1.395 -13.979 15.363 1.00 0.00 H new ATOM 0 HB2 ASN A 124 2.914 -14.876 13.265 1.00 0.00 H new ATOM 0 HB3 ASN A 124 4.125 -13.990 14.169 1.00 0.00 H new ATOM 0 HD21 ASN A 124 4.619 -17.042 15.907 1.00 0.00 H new ATOM 0 HD22 ASN A 124 5.238 -15.928 14.684 1.00 0.00 H new TER 2043 ASN A 124