USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 737 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 46 HIS : no HD1:sc= -2.71! C(o=-6.9!,f=-7!) USER MOD Set 1.2: A 73 GLN : amide:sc= -4.17 K(o=-6.9,f=-12!) USER MOD Set 2.1: A 59 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 61 ASN : amide:sc= -7.4! C(o=-7.4!,f=-5.2!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 159:sc= -0.0473 (180deg=-0.436) USER MOD Single : A 21 THR OG1 : rot 180:sc=-0.00224 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 HIS : no HD1:sc= -0.171 X(o=-0.17,f=-0.0095) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 77:sc= 1.1 USER MOD Single : A 38 THR OG1 : rot -36:sc= 0.782 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.368 X(o=-0.37,f=-0.22) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.0134 X(o=-0.013,f=-0.0042) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= -1.17 USER MOD Single : A 63 THR OG1 : rot 48:sc= 0.777 USER MOD Single : A 66 GLN : amide:sc= -1.02 K(o=-1,f=-8!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 120:sc= 2.05 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -1.41 K(o=-1.4,f=0.085!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -3.04! K(o=-3!,f=-0.37) USER MOD Single : A 95 THR OG1 : rot 109:sc= 1.6 USER MOD Single : A 96 THR OG1 : rot 180:sc=-0.00307 USER MOD Single : A 98 ASN : amide:sc= -3.83! C(o=-3.8!,f=-6.3!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc=-0.00533 X(o=-0.0053,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -1.02 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -0.041 X(o=-0.041,f=0) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HE2:sc= -0.102 K(o=-0.1,f=-0.83) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 8.551 -42.265 12.281 1.00 0.00 N ATOM 2 CA GLY A 15 8.834 -40.964 11.698 1.00 0.00 C ATOM 3 C GLY A 15 8.059 -39.859 12.420 1.00 0.00 C ATOM 4 O GLY A 15 7.517 -40.082 13.502 1.00 0.00 O ATOM 0 HA2 GLY A 15 9.903 -40.760 11.756 1.00 0.00 H new ATOM 0 HA3 GLY A 15 8.567 -40.969 10.641 1.00 0.00 H new ATOM 8 N SER A 16 8.032 -38.693 11.792 1.00 0.00 N ATOM 9 CA SER A 16 7.333 -37.554 12.362 1.00 0.00 C ATOM 10 C SER A 16 6.933 -36.578 11.253 1.00 0.00 C ATOM 11 O SER A 16 7.357 -36.726 10.108 1.00 0.00 O ATOM 12 CB SER A 16 8.196 -36.844 13.406 1.00 0.00 C ATOM 13 OG SER A 16 7.448 -36.492 14.567 1.00 0.00 O ATOM 0 H SER A 16 8.482 -38.512 10.895 1.00 0.00 H new ATOM 0 HA SER A 16 6.434 -37.918 12.860 1.00 0.00 H new ATOM 0 HB2 SER A 16 9.025 -37.491 13.691 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.629 -35.945 12.968 1.00 0.00 H new ATOM 0 HG SER A 16 8.035 -36.042 15.210 1.00 0.00 H new ATOM 18 N GLY A 17 6.120 -35.602 11.632 1.00 0.00 N ATOM 19 CA GLY A 17 5.657 -34.603 10.684 1.00 0.00 C ATOM 20 C GLY A 17 5.802 -33.193 11.260 1.00 0.00 C ATOM 21 O GLY A 17 4.806 -32.527 11.537 1.00 0.00 O ATOM 0 H GLY A 17 5.770 -35.482 12.583 1.00 0.00 H new ATOM 0 HA2 GLY A 17 6.228 -34.682 9.759 1.00 0.00 H new ATOM 0 HA3 GLY A 17 4.613 -34.791 10.432 1.00 0.00 H new ATOM 25 N MET A 18 7.051 -32.780 11.422 1.00 0.00 N ATOM 26 CA MET A 18 7.338 -31.461 11.959 1.00 0.00 C ATOM 27 C MET A 18 8.820 -31.115 11.800 1.00 0.00 C ATOM 28 O MET A 18 9.681 -31.765 12.391 1.00 0.00 O ATOM 29 CB MET A 18 6.963 -31.421 13.443 1.00 0.00 C ATOM 30 CG MET A 18 6.524 -30.015 13.859 1.00 0.00 C ATOM 31 SD MET A 18 5.434 -30.108 15.268 1.00 0.00 S ATOM 32 CE MET A 18 5.104 -28.373 15.520 1.00 0.00 C ATOM 0 H MET A 18 7.875 -33.335 11.191 1.00 0.00 H new ATOM 0 HA MET A 18 6.750 -30.729 11.405 1.00 0.00 H new ATOM 0 HB2 MET A 18 6.158 -32.130 13.638 1.00 0.00 H new ATOM 0 HB3 MET A 18 7.816 -31.733 14.046 1.00 0.00 H new ATOM 0 HG2 MET A 18 7.397 -29.410 14.104 1.00 0.00 H new ATOM 0 HG3 MET A 18 6.017 -29.523 13.029 1.00 0.00 H new ATOM 0 HE1 MET A 18 4.433 -28.250 16.370 1.00 0.00 H new ATOM 0 HE2 MET A 18 6.039 -27.850 15.718 1.00 0.00 H new ATOM 0 HE3 MET A 18 4.638 -27.958 14.626 1.00 0.00 H new ATOM 40 N LYS A 19 9.072 -30.093 10.996 1.00 0.00 N ATOM 41 CA LYS A 19 10.435 -29.652 10.749 1.00 0.00 C ATOM 42 C LYS A 19 10.416 -28.460 9.789 1.00 0.00 C ATOM 43 O LYS A 19 9.350 -28.015 9.368 1.00 0.00 O ATOM 44 CB LYS A 19 11.296 -30.819 10.264 1.00 0.00 C ATOM 45 CG LYS A 19 12.505 -31.027 11.178 1.00 0.00 C ATOM 46 CD LYS A 19 13.464 -32.065 10.592 1.00 0.00 C ATOM 47 CE LYS A 19 14.226 -31.493 9.394 1.00 0.00 C ATOM 48 NZ LYS A 19 15.141 -30.413 9.830 1.00 0.00 N ATOM 0 H LYS A 19 8.355 -29.557 10.507 1.00 0.00 H new ATOM 0 HA LYS A 19 10.897 -29.308 11.674 1.00 0.00 H new ATOM 0 HB2 LYS A 19 10.697 -31.729 10.235 1.00 0.00 H new ATOM 0 HB3 LYS A 19 11.634 -30.627 9.246 1.00 0.00 H new ATOM 0 HG2 LYS A 19 13.028 -30.081 11.316 1.00 0.00 H new ATOM 0 HG3 LYS A 19 12.169 -31.352 12.163 1.00 0.00 H new ATOM 0 HD2 LYS A 19 14.171 -32.386 11.358 1.00 0.00 H new ATOM 0 HD3 LYS A 19 12.905 -32.949 10.284 1.00 0.00 H new ATOM 0 HE2 LYS A 19 14.794 -32.284 8.905 1.00 0.00 H new ATOM 0 HE3 LYS A 19 13.521 -31.106 8.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 15.886 -30.280 9.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 14.606 -29.528 9.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 15.575 -30.671 10.739 1.00 0.00 H new ATOM 58 N GLU A 20 11.609 -27.978 9.472 1.00 0.00 N ATOM 59 CA GLU A 20 11.743 -26.848 8.569 1.00 0.00 C ATOM 60 C GLU A 20 11.132 -25.593 9.197 1.00 0.00 C ATOM 61 O GLU A 20 9.918 -25.517 9.386 1.00 0.00 O ATOM 62 CB GLU A 20 11.103 -27.150 7.213 1.00 0.00 C ATOM 63 CG GLU A 20 12.148 -27.646 6.212 1.00 0.00 C ATOM 64 CD GLU A 20 11.851 -29.084 5.778 1.00 0.00 C ATOM 65 OE1 GLU A 20 11.671 -29.925 6.685 1.00 0.00 O ATOM 66 OE2 GLU A 20 11.811 -29.309 4.549 1.00 0.00 O ATOM 0 H GLU A 20 12.491 -28.349 9.824 1.00 0.00 H new ATOM 0 HA GLU A 20 12.804 -26.667 8.399 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.324 -27.903 7.334 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.621 -26.252 6.826 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.159 -26.994 5.339 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.140 -27.595 6.661 1.00 0.00 H new ATOM 71 N THR A 21 12.000 -24.640 9.501 1.00 0.00 N ATOM 72 CA THR A 21 11.561 -23.392 10.102 1.00 0.00 C ATOM 73 C THR A 21 12.744 -22.436 10.270 1.00 0.00 C ATOM 74 O THR A 21 13.864 -22.869 10.535 1.00 0.00 O ATOM 75 CB THR A 21 10.857 -23.725 11.420 1.00 0.00 C ATOM 76 OG1 THR A 21 10.777 -22.473 12.097 1.00 0.00 O ATOM 77 CG2 THR A 21 11.716 -24.592 12.341 1.00 0.00 C ATOM 0 H THR A 21 13.005 -24.707 9.342 1.00 0.00 H new ATOM 0 HA THR A 21 10.851 -22.871 9.459 1.00 0.00 H new ATOM 0 HB THR A 21 9.919 -24.239 11.210 1.00 0.00 H new ATOM 0 HG1 THR A 21 10.332 -22.596 12.961 1.00 0.00 H new ATOM 0 HG21 THR A 21 11.169 -24.798 13.261 1.00 0.00 H new ATOM 0 HG22 THR A 21 11.952 -25.531 11.841 1.00 0.00 H new ATOM 0 HG23 THR A 21 12.640 -24.065 12.579 1.00 0.00 H new ATOM 85 N ALA A 22 12.454 -21.153 10.109 1.00 0.00 N ATOM 86 CA ALA A 22 13.479 -20.132 10.239 1.00 0.00 C ATOM 87 C ALA A 22 12.816 -18.781 10.515 1.00 0.00 C ATOM 88 O ALA A 22 11.611 -18.627 10.323 1.00 0.00 O ATOM 89 CB ALA A 22 14.343 -20.112 8.977 1.00 0.00 C ATOM 0 H ALA A 22 11.523 -20.798 9.890 1.00 0.00 H new ATOM 0 HA ALA A 22 14.136 -20.353 11.080 1.00 0.00 H new ATOM 0 HB1 ALA A 22 15.112 -19.346 9.075 1.00 0.00 H new ATOM 0 HB2 ALA A 22 14.815 -21.085 8.844 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.718 -19.891 8.112 1.00 0.00 H new ATOM 95 N ALA A 23 13.632 -17.837 10.958 1.00 0.00 N ATOM 96 CA ALA A 23 13.139 -16.503 11.261 1.00 0.00 C ATOM 97 C ALA A 23 14.310 -15.616 11.687 1.00 0.00 C ATOM 98 O ALA A 23 15.221 -16.072 12.377 1.00 0.00 O ATOM 99 CB ALA A 23 12.053 -16.592 12.335 1.00 0.00 C ATOM 0 H ALA A 23 14.631 -17.968 11.115 1.00 0.00 H new ATOM 0 HA ALA A 23 12.688 -16.051 10.378 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.683 -15.592 12.562 1.00 0.00 H new ATOM 0 HB2 ALA A 23 11.231 -17.209 11.971 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.470 -17.039 13.238 1.00 0.00 H new ATOM 105 N ALA A 24 14.250 -14.364 11.257 1.00 0.00 N ATOM 106 CA ALA A 24 15.294 -13.408 11.584 1.00 0.00 C ATOM 107 C ALA A 24 14.857 -12.010 11.144 1.00 0.00 C ATOM 108 O ALA A 24 14.647 -11.767 9.956 1.00 0.00 O ATOM 109 CB ALA A 24 16.607 -13.843 10.930 1.00 0.00 C ATOM 0 H ALA A 24 13.494 -13.989 10.684 1.00 0.00 H new ATOM 0 HA ALA A 24 15.461 -13.376 12.661 1.00 0.00 H new ATOM 0 HB1 ALA A 24 17.391 -13.126 11.175 1.00 0.00 H new ATOM 0 HB2 ALA A 24 16.889 -14.829 11.300 1.00 0.00 H new ATOM 0 HB3 ALA A 24 16.479 -13.884 9.848 1.00 0.00 H new ATOM 115 N LYS A 25 14.733 -11.127 12.124 1.00 0.00 N ATOM 116 CA LYS A 25 14.325 -9.759 11.851 1.00 0.00 C ATOM 117 C LYS A 25 15.365 -8.797 12.427 1.00 0.00 C ATOM 118 O LYS A 25 16.392 -9.228 12.951 1.00 0.00 O ATOM 119 CB LYS A 25 12.906 -9.512 12.367 1.00 0.00 C ATOM 120 CG LYS A 25 11.890 -9.566 11.224 1.00 0.00 C ATOM 121 CD LYS A 25 10.713 -10.475 11.581 1.00 0.00 C ATOM 122 CE LYS A 25 9.585 -10.339 10.556 1.00 0.00 C ATOM 123 NZ LYS A 25 8.430 -11.181 10.940 1.00 0.00 N ATOM 0 H LYS A 25 14.908 -11.332 13.108 1.00 0.00 H new ATOM 0 HA LYS A 25 14.285 -9.579 10.777 1.00 0.00 H new ATOM 0 HB2 LYS A 25 12.653 -10.260 13.119 1.00 0.00 H new ATOM 0 HB3 LYS A 25 12.857 -8.539 12.856 1.00 0.00 H new ATOM 0 HG2 LYS A 25 11.526 -8.561 11.008 1.00 0.00 H new ATOM 0 HG3 LYS A 25 12.375 -9.931 10.318 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.049 -11.511 11.622 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.340 -10.221 12.573 1.00 0.00 H new ATOM 0 HE2 LYS A 25 9.275 -9.297 10.485 1.00 0.00 H new ATOM 0 HE3 LYS A 25 9.945 -10.633 9.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 7.674 -11.076 10.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 8.726 -12.177 10.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.077 -10.882 11.871 1.00 0.00 H new ATOM 133 N PHE A 26 15.065 -7.512 12.310 1.00 0.00 N ATOM 134 CA PHE A 26 15.962 -6.485 12.813 1.00 0.00 C ATOM 135 C PHE A 26 15.191 -5.419 13.595 1.00 0.00 C ATOM 136 O PHE A 26 13.969 -5.329 13.489 1.00 0.00 O ATOM 137 CB PHE A 26 16.620 -5.832 11.596 1.00 0.00 C ATOM 138 CG PHE A 26 17.341 -6.817 10.675 1.00 0.00 C ATOM 139 CD1 PHE A 26 18.630 -7.168 10.930 1.00 0.00 C ATOM 140 CD2 PHE A 26 16.693 -7.343 9.601 1.00 0.00 C ATOM 141 CE1 PHE A 26 19.300 -8.083 10.074 1.00 0.00 C ATOM 142 CE2 PHE A 26 17.362 -8.258 8.746 1.00 0.00 C ATOM 143 CZ PHE A 26 18.652 -8.608 9.000 1.00 0.00 C ATOM 0 H PHE A 26 14.213 -7.158 11.874 1.00 0.00 H new ATOM 0 HA PHE A 26 16.697 -6.929 13.484 1.00 0.00 H new ATOM 0 HB2 PHE A 26 15.857 -5.306 11.022 1.00 0.00 H new ATOM 0 HB3 PHE A 26 17.333 -5.083 11.940 1.00 0.00 H new ATOM 0 HD1 PHE A 26 19.144 -6.751 11.783 1.00 0.00 H new ATOM 0 HD2 PHE A 26 15.669 -7.065 9.399 1.00 0.00 H new ATOM 0 HE1 PHE A 26 20.324 -8.361 10.276 1.00 0.00 H new ATOM 0 HE2 PHE A 26 16.847 -8.676 7.894 1.00 0.00 H new ATOM 0 HZ PHE A 26 19.161 -9.303 8.349 1.00 0.00 H new ATOM 152 N GLU A 27 15.938 -4.639 14.362 1.00 0.00 N ATOM 153 CA GLU A 27 15.340 -3.582 15.161 1.00 0.00 C ATOM 154 C GLU A 27 14.447 -2.697 14.288 1.00 0.00 C ATOM 155 O GLU A 27 14.856 -2.268 13.211 1.00 0.00 O ATOM 156 CB GLU A 27 16.415 -2.752 15.865 1.00 0.00 C ATOM 157 CG GLU A 27 16.599 -3.208 17.313 1.00 0.00 C ATOM 158 CD GLU A 27 17.302 -2.131 18.143 1.00 0.00 C ATOM 159 OE1 GLU A 27 16.852 -0.969 18.063 1.00 0.00 O ATOM 160 OE2 GLU A 27 18.275 -2.496 18.838 1.00 0.00 O ATOM 0 H GLU A 27 16.951 -4.717 14.447 1.00 0.00 H new ATOM 0 HA GLU A 27 14.721 -4.042 15.931 1.00 0.00 H new ATOM 0 HB2 GLU A 27 17.359 -2.843 15.328 1.00 0.00 H new ATOM 0 HB3 GLU A 27 16.137 -1.698 15.844 1.00 0.00 H new ATOM 0 HG2 GLU A 27 15.628 -3.435 17.753 1.00 0.00 H new ATOM 0 HG3 GLU A 27 17.182 -4.129 17.337 1.00 0.00 H new ATOM 165 N ARG A 28 13.246 -2.449 14.788 1.00 0.00 N ATOM 166 CA ARG A 28 12.292 -1.622 14.067 1.00 0.00 C ATOM 167 C ARG A 28 11.089 -1.302 14.957 1.00 0.00 C ATOM 168 O ARG A 28 10.303 -2.190 15.286 1.00 0.00 O ATOM 169 CB ARG A 28 11.807 -2.322 12.798 1.00 0.00 C ATOM 170 CG ARG A 28 12.279 -1.578 11.547 1.00 0.00 C ATOM 171 CD ARG A 28 13.298 -2.411 10.766 1.00 0.00 C ATOM 172 NE ARG A 28 12.615 -3.176 9.700 1.00 0.00 N ATOM 173 CZ ARG A 28 13.248 -3.940 8.799 1.00 0.00 C ATOM 174 NH1 ARG A 28 14.584 -4.045 8.831 1.00 0.00 N ATOM 175 NH2 ARG A 28 12.547 -4.600 7.867 1.00 0.00 N ATOM 0 H ARG A 28 12.911 -2.806 15.683 1.00 0.00 H new ATOM 0 HA ARG A 28 12.798 -0.698 13.788 1.00 0.00 H new ATOM 0 HB2 ARG A 28 12.179 -3.346 12.778 1.00 0.00 H new ATOM 0 HB3 ARG A 28 10.718 -2.379 12.803 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.424 -1.352 10.910 1.00 0.00 H new ATOM 0 HG3 ARG A 28 12.725 -0.625 11.833 1.00 0.00 H new ATOM 0 HD2 ARG A 28 14.055 -1.759 10.329 1.00 0.00 H new ATOM 0 HD3 ARG A 28 13.816 -3.093 11.440 1.00 0.00 H new ATOM 0 HE ARG A 28 11.598 -3.118 9.647 1.00 0.00 H new ATOM 0 HH11 ARG A 28 15.118 -3.544 9.541 1.00 0.00 H new ATOM 0 HH12 ARG A 28 15.066 -4.626 8.146 1.00 0.00 H new ATOM 0 HH21 ARG A 28 11.530 -4.521 7.843 1.00 0.00 H new ATOM 0 HH22 ARG A 28 13.030 -5.181 7.182 1.00 0.00 H new ATOM 186 N GLN A 29 10.983 -0.033 15.320 1.00 0.00 N ATOM 187 CA GLN A 29 9.889 0.415 16.166 1.00 0.00 C ATOM 188 C GLN A 29 9.025 1.434 15.420 1.00 0.00 C ATOM 189 O GLN A 29 7.835 1.205 15.203 1.00 0.00 O ATOM 190 CB GLN A 29 10.413 0.998 17.479 1.00 0.00 C ATOM 191 CG GLN A 29 9.639 0.439 18.674 1.00 0.00 C ATOM 192 CD GLN A 29 10.260 0.901 19.994 1.00 0.00 C ATOM 193 OE1 GLN A 29 10.950 0.163 20.678 1.00 0.00 O ATOM 194 NE2 GLN A 29 9.979 2.161 20.313 1.00 0.00 N ATOM 0 H GLN A 29 11.636 0.700 15.044 1.00 0.00 H new ATOM 0 HA GLN A 29 9.270 -0.448 16.412 1.00 0.00 H new ATOM 0 HB2 GLN A 29 11.473 0.766 17.587 1.00 0.00 H new ATOM 0 HB3 GLN A 29 10.325 2.084 17.460 1.00 0.00 H new ATOM 0 HG2 GLN A 29 8.600 0.764 18.623 1.00 0.00 H new ATOM 0 HG3 GLN A 29 9.634 -0.650 18.632 1.00 0.00 H new ATOM 0 HE21 GLN A 29 9.395 2.725 19.696 1.00 0.00 H new ATOM 0 HE22 GLN A 29 10.348 2.563 21.175 1.00 0.00 H new ATOM 201 N HIS A 30 9.657 2.538 15.046 1.00 0.00 N ATOM 202 CA HIS A 30 8.961 3.592 14.329 1.00 0.00 C ATOM 203 C HIS A 30 9.951 4.695 13.950 1.00 0.00 C ATOM 204 O HIS A 30 10.992 4.845 14.588 1.00 0.00 O ATOM 205 CB HIS A 30 7.777 4.114 15.144 1.00 0.00 C ATOM 206 CG HIS A 30 6.641 4.647 14.306 1.00 0.00 C ATOM 207 ND1 HIS A 30 5.461 3.949 14.109 1.00 0.00 N ATOM 208 CD2 HIS A 30 6.515 5.817 13.615 1.00 0.00 C ATOM 209 CE1 HIS A 30 4.670 4.675 13.333 1.00 0.00 C ATOM 210 NE2 HIS A 30 5.325 5.831 13.028 1.00 0.00 N ATOM 0 H HIS A 30 10.643 2.724 15.227 1.00 0.00 H new ATOM 0 HA HIS A 30 8.543 3.193 13.405 1.00 0.00 H new ATOM 0 HB2 HIS A 30 7.402 3.309 15.776 1.00 0.00 H new ATOM 0 HB3 HIS A 30 8.127 4.904 15.808 1.00 0.00 H new ATOM 0 HD2 HIS A 30 7.258 6.599 13.556 1.00 0.00 H new ATOM 0 HE1 HIS A 30 3.680 4.399 13.000 1.00 0.00 H new ATOM 0 HE2 HIS A 30 4.960 6.584 12.444 1.00 0.00 H new ATOM 217 N MET A 31 9.593 5.438 12.914 1.00 0.00 N ATOM 218 CA MET A 31 10.437 6.523 12.442 1.00 0.00 C ATOM 219 C MET A 31 10.041 7.849 13.095 1.00 0.00 C ATOM 220 O MET A 31 10.107 8.901 12.462 1.00 0.00 O ATOM 221 CB MET A 31 10.312 6.645 10.923 1.00 0.00 C ATOM 222 CG MET A 31 8.979 7.287 10.532 1.00 0.00 C ATOM 223 SD MET A 31 8.180 6.314 9.268 1.00 0.00 S ATOM 224 CE MET A 31 6.655 7.226 9.093 1.00 0.00 C ATOM 0 H MET A 31 8.729 5.310 12.387 1.00 0.00 H new ATOM 0 HA MET A 31 11.469 6.299 12.713 1.00 0.00 H new ATOM 0 HB2 MET A 31 11.136 7.243 10.534 1.00 0.00 H new ATOM 0 HB3 MET A 31 10.392 5.658 10.468 1.00 0.00 H new ATOM 0 HG2 MET A 31 8.333 7.364 11.406 1.00 0.00 H new ATOM 0 HG3 MET A 31 9.147 8.301 10.170 1.00 0.00 H new ATOM 0 HE1 MET A 31 6.031 6.750 8.336 1.00 0.00 H new ATOM 0 HE2 MET A 31 6.125 7.236 10.046 1.00 0.00 H new ATOM 0 HE3 MET A 31 6.876 8.250 8.790 1.00 0.00 H new ATOM 232 N ASP A 32 9.638 7.756 14.354 1.00 0.00 N ATOM 233 CA ASP A 32 9.233 8.935 15.100 1.00 0.00 C ATOM 234 C ASP A 32 8.026 9.577 14.411 1.00 0.00 C ATOM 235 O ASP A 32 7.908 9.533 13.188 1.00 0.00 O ATOM 236 CB ASP A 32 10.356 9.970 15.147 1.00 0.00 C ATOM 237 CG ASP A 32 10.027 11.247 15.923 1.00 0.00 C ATOM 238 OD1 ASP A 32 9.600 11.108 17.089 1.00 0.00 O ATOM 239 OD2 ASP A 32 10.210 12.334 15.333 1.00 0.00 O ATOM 0 H ASP A 32 9.583 6.882 14.876 1.00 0.00 H new ATOM 0 HA ASP A 32 8.988 8.624 16.116 1.00 0.00 H new ATOM 0 HB2 ASP A 32 11.237 9.508 15.594 1.00 0.00 H new ATOM 0 HB3 ASP A 32 10.622 10.242 14.126 1.00 0.00 H new ATOM 243 N SER A 33 7.159 10.158 15.228 1.00 0.00 N ATOM 244 CA SER A 33 5.966 10.808 14.714 1.00 0.00 C ATOM 245 C SER A 33 5.002 11.116 15.861 1.00 0.00 C ATOM 246 O SER A 33 5.007 10.431 16.881 1.00 0.00 O ATOM 247 CB SER A 33 5.277 9.940 13.660 1.00 0.00 C ATOM 248 OG SER A 33 5.713 10.254 12.341 1.00 0.00 O ATOM 0 H SER A 33 7.260 10.192 16.242 1.00 0.00 H new ATOM 0 HA SER A 33 6.264 11.742 14.238 1.00 0.00 H new ATOM 0 HB2 SER A 33 5.479 8.889 13.868 1.00 0.00 H new ATOM 0 HB3 SER A 33 4.198 10.077 13.727 1.00 0.00 H new ATOM 0 HG SER A 33 6.598 9.862 12.187 1.00 0.00 H new ATOM 253 N PRO A 34 4.177 12.177 15.650 1.00 0.00 N ATOM 254 CA PRO A 34 3.209 12.584 16.654 1.00 0.00 C ATOM 255 C PRO A 34 2.020 11.622 16.692 1.00 0.00 C ATOM 256 O PRO A 34 2.107 10.502 16.190 1.00 0.00 O ATOM 257 CB PRO A 34 2.816 14.001 16.269 1.00 0.00 C ATOM 258 CG PRO A 34 3.220 14.165 14.812 1.00 0.00 C ATOM 259 CD PRO A 34 4.143 13.012 14.453 1.00 0.00 C ATOM 0 HA PRO A 34 3.615 12.558 17.665 1.00 0.00 H new ATOM 0 HB2 PRO A 34 1.745 14.158 16.397 1.00 0.00 H new ATOM 0 HB3 PRO A 34 3.323 14.732 16.899 1.00 0.00 H new ATOM 0 HG2 PRO A 34 2.340 14.164 14.169 1.00 0.00 H new ATOM 0 HG3 PRO A 34 3.724 15.119 14.661 1.00 0.00 H new ATOM 0 HD2 PRO A 34 3.767 12.457 13.594 1.00 0.00 H new ATOM 0 HD3 PRO A 34 5.139 13.369 14.191 1.00 0.00 H new ATOM 264 N ASP A 35 0.937 12.095 17.291 1.00 0.00 N ATOM 265 CA ASP A 35 -0.268 11.290 17.400 1.00 0.00 C ATOM 266 C ASP A 35 -1.330 11.837 16.444 1.00 0.00 C ATOM 267 O ASP A 35 -1.391 13.041 16.202 1.00 0.00 O ATOM 268 CB ASP A 35 -0.838 11.343 18.819 1.00 0.00 C ATOM 269 CG ASP A 35 -2.185 10.640 19.002 1.00 0.00 C ATOM 270 OD1 ASP A 35 -3.165 11.127 18.398 1.00 0.00 O ATOM 271 OD2 ASP A 35 -2.203 9.632 19.741 1.00 0.00 O ATOM 0 H ASP A 35 0.869 13.024 17.706 1.00 0.00 H new ATOM 0 HA ASP A 35 -0.010 10.260 17.152 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -0.116 10.895 19.501 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.948 12.387 19.112 1.00 0.00 H new ATOM 275 N LEU A 36 -2.140 10.926 15.927 1.00 0.00 N ATOM 276 CA LEU A 36 -3.196 11.301 15.002 1.00 0.00 C ATOM 277 C LEU A 36 -2.615 11.414 13.590 1.00 0.00 C ATOM 278 O LEU A 36 -3.138 10.817 12.650 1.00 0.00 O ATOM 279 CB LEU A 36 -3.901 12.572 15.481 1.00 0.00 C ATOM 280 CG LEU A 36 -5.429 12.548 15.435 1.00 0.00 C ATOM 281 CD1 LEU A 36 -6.022 13.622 16.351 1.00 0.00 C ATOM 282 CD2 LEU A 36 -5.937 12.678 13.998 1.00 0.00 C ATOM 0 H LEU A 36 -2.087 9.928 16.131 1.00 0.00 H new ATOM 0 HA LEU A 36 -3.966 10.530 14.969 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.591 12.771 16.507 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.552 13.408 14.875 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.766 11.582 15.810 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -7.110 13.584 16.300 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.700 13.443 17.377 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.678 14.605 16.029 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.027 12.658 13.994 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.590 13.620 13.573 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.557 11.849 13.401 1.00 0.00 H new ATOM 293 N GLY A 37 -1.543 12.186 13.486 1.00 0.00 N ATOM 294 CA GLY A 37 -0.886 12.384 12.206 1.00 0.00 C ATOM 295 C GLY A 37 -0.860 13.867 11.828 1.00 0.00 C ATOM 296 O GLY A 37 -1.889 14.540 11.866 1.00 0.00 O ATOM 0 H GLY A 37 -1.114 12.681 14.267 1.00 0.00 H new ATOM 0 HA2 GLY A 37 0.133 11.999 12.252 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -1.407 11.817 11.434 1.00 0.00 H new ATOM 300 N THR A 38 0.328 14.333 11.472 1.00 0.00 N ATOM 301 CA THR A 38 0.503 15.724 11.088 1.00 0.00 C ATOM 302 C THR A 38 0.080 15.932 9.633 1.00 0.00 C ATOM 303 O THR A 38 0.192 17.035 9.101 1.00 0.00 O ATOM 304 CB THR A 38 1.958 16.110 11.359 1.00 0.00 C ATOM 305 OG1 THR A 38 2.003 17.507 11.083 1.00 0.00 O ATOM 306 CG2 THR A 38 2.925 15.498 10.344 1.00 0.00 C ATOM 0 H THR A 38 1.179 13.772 11.441 1.00 0.00 H new ATOM 0 HA THR A 38 -0.137 16.381 11.677 1.00 0.00 H new ATOM 0 HB THR A 38 2.237 15.791 12.363 1.00 0.00 H new ATOM 0 HG1 THR A 38 1.414 17.710 10.327 1.00 0.00 H new ATOM 0 HG21 THR A 38 3.944 15.803 10.582 1.00 0.00 H new ATOM 0 HG22 THR A 38 2.854 14.411 10.383 1.00 0.00 H new ATOM 0 HG23 THR A 38 2.668 15.843 9.343 1.00 0.00 H new ATOM 314 N THR A 39 -0.399 14.853 9.029 1.00 0.00 N ATOM 315 CA THR A 39 -0.839 14.905 7.645 1.00 0.00 C ATOM 316 C THR A 39 -1.474 13.573 7.239 1.00 0.00 C ATOM 317 O THR A 39 -0.852 12.520 7.364 1.00 0.00 O ATOM 318 CB THR A 39 0.362 15.293 6.780 1.00 0.00 C ATOM 319 OG1 THR A 39 -0.175 15.391 5.464 1.00 0.00 O ATOM 320 CG2 THR A 39 1.397 14.171 6.679 1.00 0.00 C ATOM 0 H THR A 39 -0.492 13.939 9.473 1.00 0.00 H new ATOM 0 HA THR A 39 -1.615 15.658 7.505 1.00 0.00 H new ATOM 0 HB THR A 39 0.833 16.185 7.192 1.00 0.00 H new ATOM 0 HG1 THR A 39 0.537 15.641 4.838 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.228 14.498 6.054 1.00 0.00 H new ATOM 0 HG22 THR A 39 1.766 13.926 7.675 1.00 0.00 H new ATOM 0 HG23 THR A 39 0.935 13.289 6.236 1.00 0.00 H new ATOM 328 N LEU A 40 -2.707 13.665 6.762 1.00 0.00 N ATOM 329 CA LEU A 40 -3.434 12.480 6.336 1.00 0.00 C ATOM 330 C LEU A 40 -2.798 11.927 5.059 1.00 0.00 C ATOM 331 O LEU A 40 -2.238 12.681 4.265 1.00 0.00 O ATOM 332 CB LEU A 40 -4.926 12.789 6.196 1.00 0.00 C ATOM 333 CG LEU A 40 -5.318 13.680 5.015 1.00 0.00 C ATOM 334 CD1 LEU A 40 -6.657 13.242 4.419 1.00 0.00 C ATOM 335 CD2 LEU A 40 -5.326 15.155 5.420 1.00 0.00 C ATOM 0 H LEU A 40 -3.221 14.540 6.661 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.363 11.698 7.092 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -5.466 11.846 6.109 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.266 13.267 7.115 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.565 13.565 4.235 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.912 13.891 3.582 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.580 12.212 4.070 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -7.434 13.310 5.181 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.608 15.766 4.563 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -6.044 15.307 6.226 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.332 15.444 5.761 1.00 0.00 H new ATOM 346 N LEU A 41 -2.905 10.616 4.903 1.00 0.00 N ATOM 347 CA LEU A 41 -2.347 9.954 3.737 1.00 0.00 C ATOM 348 C LEU A 41 -3.380 9.960 2.608 1.00 0.00 C ATOM 349 O LEU A 41 -3.144 9.395 1.542 1.00 0.00 O ATOM 350 CB LEU A 41 -1.845 8.555 4.103 1.00 0.00 C ATOM 351 CG LEU A 41 -1.060 8.446 5.412 1.00 0.00 C ATOM 352 CD1 LEU A 41 -1.145 7.030 5.985 1.00 0.00 C ATOM 353 CD2 LEU A 41 0.388 8.901 5.222 1.00 0.00 C ATOM 0 H LEU A 41 -3.370 9.995 5.565 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.474 10.496 3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -2.704 7.886 4.160 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.213 8.194 3.292 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.515 9.117 6.141 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.579 6.979 6.915 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.187 6.779 6.181 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -0.729 6.322 5.268 1.00 0.00 H new ATOM 0 HD21 LEU A 41 0.924 8.814 6.167 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.871 8.275 4.472 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.403 9.940 4.891 1.00 0.00 H new ATOM 364 N GLU A 42 -4.504 10.606 2.882 1.00 0.00 N ATOM 365 CA GLU A 42 -5.575 10.693 1.905 1.00 0.00 C ATOM 366 C GLU A 42 -5.884 12.158 1.585 1.00 0.00 C ATOM 367 O GLU A 42 -7.034 12.512 1.331 1.00 0.00 O ATOM 368 CB GLU A 42 -6.826 9.964 2.394 1.00 0.00 C ATOM 369 CG GLU A 42 -7.849 9.810 1.266 1.00 0.00 C ATOM 370 CD GLU A 42 -7.176 9.335 -0.024 1.00 0.00 C ATOM 371 OE1 GLU A 42 -7.092 8.100 -0.197 1.00 0.00 O ATOM 372 OE2 GLU A 42 -6.762 10.217 -0.806 1.00 0.00 O ATOM 0 H GLU A 42 -4.696 11.074 3.768 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.244 10.202 0.989 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.552 8.981 2.777 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.272 10.516 3.221 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.618 9.097 1.563 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -8.348 10.763 1.090 1.00 0.00 H new ATOM 377 N GLN A 43 -4.837 12.969 1.607 1.00 0.00 N ATOM 378 CA GLN A 43 -4.981 14.386 1.324 1.00 0.00 C ATOM 379 C GLN A 43 -5.997 14.601 0.200 1.00 0.00 C ATOM 380 O GLN A 43 -6.846 15.486 0.287 1.00 0.00 O ATOM 381 CB GLN A 43 -3.632 15.016 0.971 1.00 0.00 C ATOM 382 CG GLN A 43 -2.746 14.026 0.213 1.00 0.00 C ATOM 383 CD GLN A 43 -1.607 13.518 1.099 1.00 0.00 C ATOM 384 OE1 GLN A 43 -0.810 14.276 1.625 1.00 0.00 O ATOM 385 NE2 GLN A 43 -1.575 12.195 1.233 1.00 0.00 N ATOM 0 H GLN A 43 -3.884 12.671 1.817 1.00 0.00 H new ATOM 0 HA GLN A 43 -5.351 14.880 2.223 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -3.791 15.907 0.363 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -3.127 15.338 1.882 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -3.347 13.184 -0.131 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.334 14.507 -0.674 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -2.274 11.618 0.765 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -0.852 11.758 1.804 1.00 0.00 H new ATOM 392 N TYR A 44 -5.874 13.776 -0.831 1.00 0.00 N ATOM 393 CA TYR A 44 -6.771 13.865 -1.971 1.00 0.00 C ATOM 394 C TYR A 44 -6.482 12.756 -2.983 1.00 0.00 C ATOM 395 O TYR A 44 -7.401 12.207 -3.587 1.00 0.00 O ATOM 396 CB TYR A 44 -6.491 15.220 -2.623 1.00 0.00 C ATOM 397 CG TYR A 44 -5.214 15.253 -3.465 1.00 0.00 C ATOM 398 CD1 TYR A 44 -3.981 15.149 -2.855 1.00 0.00 C ATOM 399 CD2 TYR A 44 -5.296 15.388 -4.838 1.00 0.00 C ATOM 400 CE1 TYR A 44 -2.779 15.179 -3.648 1.00 0.00 C ATOM 401 CE2 TYR A 44 -4.095 15.418 -5.630 1.00 0.00 C ATOM 402 CZ TYR A 44 -2.896 15.313 -4.997 1.00 0.00 C ATOM 403 OH TYR A 44 -1.761 15.342 -5.746 1.00 0.00 O ATOM 0 H TYR A 44 -5.167 13.044 -0.900 1.00 0.00 H new ATOM 0 HA TYR A 44 -7.808 13.761 -1.653 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -7.337 15.490 -3.255 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -6.420 15.979 -1.844 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -3.917 15.045 -1.782 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -6.261 15.471 -5.316 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -1.808 15.097 -3.183 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -4.145 15.522 -6.704 1.00 0.00 H new ATOM 0 HH TYR A 44 -1.996 15.441 -6.692 1.00 0.00 H new ATOM 412 N CYS A 45 -5.200 12.459 -3.137 1.00 0.00 N ATOM 413 CA CYS A 45 -4.777 11.425 -4.067 1.00 0.00 C ATOM 414 C CYS A 45 -5.206 11.841 -5.476 1.00 0.00 C ATOM 415 O CYS A 45 -5.213 13.026 -5.801 1.00 0.00 O ATOM 416 CB CYS A 45 -5.338 10.054 -3.681 1.00 0.00 C ATOM 417 SG CYS A 45 -4.293 8.634 -4.166 1.00 0.00 S ATOM 0 H CYS A 45 -4.440 12.916 -2.633 1.00 0.00 H new ATOM 0 HA CYS A 45 -3.692 11.324 -4.034 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -5.484 10.028 -2.601 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -6.320 9.937 -4.138 1.00 0.00 H new ATOM 421 N HIS A 46 -5.554 10.842 -6.273 1.00 0.00 N ATOM 422 CA HIS A 46 -5.983 11.088 -7.639 1.00 0.00 C ATOM 423 C HIS A 46 -7.400 11.667 -7.635 1.00 0.00 C ATOM 424 O HIS A 46 -7.897 12.093 -6.594 1.00 0.00 O ATOM 425 CB HIS A 46 -5.863 9.818 -8.484 1.00 0.00 C ATOM 426 CG HIS A 46 -4.996 9.976 -9.710 1.00 0.00 C ATOM 427 ND1 HIS A 46 -3.770 10.617 -9.683 1.00 0.00 N ATOM 428 CD2 HIS A 46 -5.189 9.568 -10.997 1.00 0.00 C ATOM 429 CE1 HIS A 46 -3.257 10.591 -10.905 1.00 0.00 C ATOM 430 NE2 HIS A 46 -4.139 9.941 -11.718 1.00 0.00 N ATOM 0 H HIS A 46 -5.548 9.860 -5.999 1.00 0.00 H new ATOM 0 HA HIS A 46 -5.328 11.825 -8.103 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.456 9.019 -7.864 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -6.860 9.505 -8.794 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -6.051 9.032 -11.367 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -2.308 11.011 -11.204 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -4.012 9.770 -12.716 1.00 0.00 H new ATOM 437 N ARG A 47 -8.008 11.664 -8.813 1.00 0.00 N ATOM 438 CA ARG A 47 -9.357 12.184 -8.958 1.00 0.00 C ATOM 439 C ARG A 47 -10.315 11.444 -8.022 1.00 0.00 C ATOM 440 O ARG A 47 -11.240 12.042 -7.475 1.00 0.00 O ATOM 441 CB ARG A 47 -9.850 12.040 -10.399 1.00 0.00 C ATOM 442 CG ARG A 47 -9.404 10.706 -11.001 1.00 0.00 C ATOM 443 CD ARG A 47 -8.233 10.904 -11.966 1.00 0.00 C ATOM 444 NE ARG A 47 -8.735 11.349 -13.285 1.00 0.00 N ATOM 445 CZ ARG A 47 -7.946 11.652 -14.325 1.00 0.00 C ATOM 446 NH1 ARG A 47 -6.615 11.561 -14.206 1.00 0.00 N ATOM 447 NH2 ARG A 47 -8.489 12.047 -15.485 1.00 0.00 N ATOM 0 H ARG A 47 -7.592 11.310 -9.674 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.334 13.242 -8.697 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -10.938 12.108 -10.423 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -9.465 12.862 -11.003 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.111 10.023 -10.204 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.239 10.243 -11.527 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -7.540 11.643 -11.563 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.678 9.972 -12.074 1.00 0.00 H new ATOM 0 HE ARG A 47 -9.744 11.430 -13.410 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -6.201 11.261 -13.323 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.015 11.792 -14.998 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -9.503 12.117 -15.576 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.889 12.278 -16.277 1.00 0.00 H new ATOM 458 N THR A 48 -10.060 10.153 -7.868 1.00 0.00 N ATOM 459 CA THR A 48 -10.889 9.325 -7.008 1.00 0.00 C ATOM 460 C THR A 48 -12.337 9.819 -7.025 1.00 0.00 C ATOM 461 O THR A 48 -12.720 10.655 -6.209 1.00 0.00 O ATOM 462 CB THR A 48 -10.264 9.320 -5.612 1.00 0.00 C ATOM 463 OG1 THR A 48 -11.116 8.467 -4.853 1.00 0.00 O ATOM 464 CG2 THR A 48 -10.379 10.678 -4.914 1.00 0.00 C ATOM 0 H THR A 48 -9.292 9.660 -8.324 1.00 0.00 H new ATOM 0 HA THR A 48 -10.927 8.296 -7.366 1.00 0.00 H new ATOM 0 HB THR A 48 -9.214 9.037 -5.686 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.783 8.406 -3.933 1.00 0.00 H new ATOM 0 HG21 THR A 48 -9.920 10.620 -3.927 1.00 0.00 H new ATOM 0 HG22 THR A 48 -9.869 11.437 -5.507 1.00 0.00 H new ATOM 0 HG23 THR A 48 -11.430 10.946 -4.810 1.00 0.00 H new ATOM 472 N THR A 49 -13.102 9.281 -7.962 1.00 0.00 N ATOM 473 CA THR A 49 -14.498 9.657 -8.097 1.00 0.00 C ATOM 474 C THR A 49 -15.356 8.427 -8.399 1.00 0.00 C ATOM 475 O THR A 49 -15.596 8.103 -9.562 1.00 0.00 O ATOM 476 CB THR A 49 -14.596 10.744 -9.169 1.00 0.00 C ATOM 477 OG1 THR A 49 -15.954 11.169 -9.110 1.00 0.00 O ATOM 478 CG2 THR A 49 -14.440 10.185 -10.585 1.00 0.00 C ATOM 0 H THR A 49 -12.781 8.586 -8.636 1.00 0.00 H new ATOM 0 HA THR A 49 -14.888 10.065 -7.164 1.00 0.00 H new ATOM 0 HB THR A 49 -13.831 11.499 -8.991 1.00 0.00 H new ATOM 0 HG1 THR A 49 -16.105 11.875 -9.773 1.00 0.00 H new ATOM 0 HG21 THR A 49 -14.518 10.997 -11.307 1.00 0.00 H new ATOM 0 HG22 THR A 49 -13.466 9.705 -10.682 1.00 0.00 H new ATOM 0 HG23 THR A 49 -15.225 9.454 -10.776 1.00 0.00 H new ATOM 486 N ILE A 50 -15.795 7.773 -7.334 1.00 0.00 N ATOM 487 CA ILE A 50 -16.620 6.585 -7.472 1.00 0.00 C ATOM 488 C ILE A 50 -17.143 6.171 -6.095 1.00 0.00 C ATOM 489 O ILE A 50 -16.620 6.606 -5.070 1.00 0.00 O ATOM 490 CB ILE A 50 -15.849 5.479 -8.195 1.00 0.00 C ATOM 491 CG1 ILE A 50 -16.798 4.388 -8.696 1.00 0.00 C ATOM 492 CG2 ILE A 50 -14.741 4.910 -7.306 1.00 0.00 C ATOM 493 CD1 ILE A 50 -16.086 3.447 -9.670 1.00 0.00 C ATOM 0 H ILE A 50 -15.595 8.043 -6.371 1.00 0.00 H new ATOM 0 HA ILE A 50 -17.490 6.795 -8.094 1.00 0.00 H new ATOM 0 HB ILE A 50 -15.367 5.915 -9.070 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -17.182 3.818 -7.850 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -17.656 4.845 -9.188 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -14.209 4.126 -7.845 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -14.044 5.705 -7.040 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -15.180 4.494 -6.399 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -16.783 2.681 -10.011 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -15.724 4.016 -10.527 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -15.243 2.973 -9.167 1.00 0.00 H new ATOM 504 N GLY A 51 -18.170 5.334 -6.115 1.00 0.00 N ATOM 505 CA GLY A 51 -18.770 4.857 -4.881 1.00 0.00 C ATOM 506 C GLY A 51 -20.217 5.340 -4.751 1.00 0.00 C ATOM 507 O GLY A 51 -20.565 6.013 -3.783 1.00 0.00 O ATOM 0 H GLY A 51 -18.602 4.974 -6.966 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.743 3.768 -4.857 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -18.188 5.209 -4.030 1.00 0.00 H new ATOM 511 N ASN A 52 -21.019 4.978 -5.742 1.00 0.00 N ATOM 512 CA ASN A 52 -22.419 5.367 -5.751 1.00 0.00 C ATOM 513 C ASN A 52 -22.523 6.878 -5.962 1.00 0.00 C ATOM 514 O ASN A 52 -23.173 7.574 -5.183 1.00 0.00 O ATOM 515 CB ASN A 52 -23.093 5.027 -4.420 1.00 0.00 C ATOM 516 CG ASN A 52 -24.600 4.838 -4.601 1.00 0.00 C ATOM 517 OD1 ASN A 52 -25.061 3.922 -5.265 1.00 0.00 O ATOM 518 ND2 ASN A 52 -25.340 5.750 -3.977 1.00 0.00 N ATOM 0 H ASN A 52 -20.726 4.420 -6.544 1.00 0.00 H new ATOM 0 HA ASN A 52 -22.915 4.824 -6.555 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -22.656 4.117 -4.009 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -22.907 5.824 -3.700 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -26.357 5.709 -4.037 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -24.890 6.490 -3.438 1.00 0.00 H new ATOM 524 N PHE A 53 -21.872 7.343 -7.018 1.00 0.00 N ATOM 525 CA PHE A 53 -21.882 8.760 -7.341 1.00 0.00 C ATOM 526 C PHE A 53 -21.315 9.007 -8.740 1.00 0.00 C ATOM 527 O PHE A 53 -21.839 9.832 -9.489 1.00 0.00 O ATOM 528 CB PHE A 53 -20.992 9.459 -6.312 1.00 0.00 C ATOM 529 CG PHE A 53 -21.229 10.967 -6.209 1.00 0.00 C ATOM 530 CD1 PHE A 53 -20.764 11.797 -7.181 1.00 0.00 C ATOM 531 CD2 PHE A 53 -21.903 11.479 -5.144 1.00 0.00 C ATOM 532 CE1 PHE A 53 -20.983 13.196 -7.085 1.00 0.00 C ATOM 533 CE2 PHE A 53 -22.122 12.879 -5.048 1.00 0.00 C ATOM 534 CZ PHE A 53 -21.658 13.708 -6.021 1.00 0.00 C ATOM 0 H PHE A 53 -21.334 6.763 -7.662 1.00 0.00 H new ATOM 0 HA PHE A 53 -22.904 9.140 -7.320 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -21.160 9.007 -5.334 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -19.948 9.282 -6.570 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -20.228 11.391 -8.026 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -22.272 10.821 -4.371 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -20.613 13.854 -7.857 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -22.657 13.285 -4.202 1.00 0.00 H new ATOM 0 HZ PHE A 53 -21.825 14.773 -5.949 1.00 0.00 H new ATOM 543 N SER A 54 -20.255 8.277 -9.052 1.00 0.00 N ATOM 544 CA SER A 54 -19.611 8.408 -10.348 1.00 0.00 C ATOM 545 C SER A 54 -18.854 7.123 -10.688 1.00 0.00 C ATOM 546 O SER A 54 -17.629 7.074 -10.585 1.00 0.00 O ATOM 547 CB SER A 54 -18.661 9.607 -10.373 1.00 0.00 C ATOM 548 OG SER A 54 -19.173 10.677 -11.164 1.00 0.00 O ATOM 0 H SER A 54 -19.826 7.592 -8.430 1.00 0.00 H new ATOM 0 HA SER A 54 -20.384 8.576 -11.098 1.00 0.00 H new ATOM 0 HB2 SER A 54 -18.492 9.957 -9.355 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.694 9.295 -10.767 1.00 0.00 H new ATOM 0 HG SER A 54 -18.539 11.424 -11.154 1.00 0.00 H new ATOM 553 N GLY A 55 -19.614 6.113 -11.085 1.00 0.00 N ATOM 554 CA GLY A 55 -19.029 4.830 -11.440 1.00 0.00 C ATOM 555 C GLY A 55 -19.156 4.568 -12.942 1.00 0.00 C ATOM 556 O GLY A 55 -20.208 4.138 -13.413 1.00 0.00 O ATOM 0 H GLY A 55 -20.630 6.157 -11.169 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -17.978 4.813 -11.152 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -19.525 4.034 -10.885 1.00 0.00 H new ATOM 560 N PRO A 56 -18.041 4.843 -13.671 1.00 0.00 N ATOM 561 CA PRO A 56 -18.019 4.641 -15.109 1.00 0.00 C ATOM 562 C PRO A 56 -17.917 3.154 -15.452 1.00 0.00 C ATOM 563 O PRO A 56 -18.851 2.574 -16.002 1.00 0.00 O ATOM 564 CB PRO A 56 -16.828 5.447 -15.601 1.00 0.00 C ATOM 565 CG PRO A 56 -15.957 5.691 -14.379 1.00 0.00 C ATOM 566 CD PRO A 56 -16.778 5.354 -13.146 1.00 0.00 C ATOM 0 HA PRO A 56 -18.936 4.974 -15.595 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.279 4.903 -16.370 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -17.150 6.389 -16.045 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -15.060 5.073 -14.420 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -15.628 6.730 -14.346 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -16.276 4.610 -12.527 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -16.935 6.234 -12.522 1.00 0.00 H new ATOM 571 N TYR A 57 -16.772 2.578 -15.112 1.00 0.00 N ATOM 572 CA TYR A 57 -16.536 1.169 -15.377 1.00 0.00 C ATOM 573 C TYR A 57 -16.228 0.413 -14.084 1.00 0.00 C ATOM 574 O TYR A 57 -16.388 0.952 -12.991 1.00 0.00 O ATOM 575 CB TYR A 57 -15.311 1.111 -16.292 1.00 0.00 C ATOM 576 CG TYR A 57 -14.486 2.400 -16.308 1.00 0.00 C ATOM 577 CD1 TYR A 57 -13.798 2.794 -15.178 1.00 0.00 C ATOM 578 CD2 TYR A 57 -14.429 3.168 -17.453 1.00 0.00 C ATOM 579 CE1 TYR A 57 -13.022 4.006 -15.193 1.00 0.00 C ATOM 580 CE2 TYR A 57 -13.652 4.381 -17.469 1.00 0.00 C ATOM 581 CZ TYR A 57 -12.987 4.739 -16.337 1.00 0.00 C ATOM 582 OH TYR A 57 -12.253 5.886 -16.353 1.00 0.00 O ATOM 0 H TYR A 57 -15.999 3.062 -14.656 1.00 0.00 H new ATOM 0 HA TYR A 57 -17.416 0.710 -15.828 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -14.672 0.287 -15.975 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -15.639 0.889 -17.308 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -13.842 2.192 -14.282 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -14.967 2.860 -18.337 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -12.480 4.326 -14.315 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -13.599 4.992 -18.358 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.320 6.305 -17.237 1.00 0.00 H new ATOM 591 N THR A 58 -15.791 -0.828 -14.251 1.00 0.00 N ATOM 592 CA THR A 58 -15.459 -1.664 -13.110 1.00 0.00 C ATOM 593 C THR A 58 -13.945 -1.689 -12.890 1.00 0.00 C ATOM 594 O THR A 58 -13.392 -2.704 -12.472 1.00 0.00 O ATOM 595 CB THR A 58 -16.061 -3.050 -13.350 1.00 0.00 C ATOM 596 OG1 THR A 58 -17.446 -2.795 -13.563 1.00 0.00 O ATOM 597 CG2 THR A 58 -16.031 -3.926 -12.095 1.00 0.00 C ATOM 0 H THR A 58 -15.660 -1.274 -15.159 1.00 0.00 H new ATOM 0 HA THR A 58 -15.883 -1.264 -12.189 1.00 0.00 H new ATOM 0 HB THR A 58 -15.518 -3.548 -14.153 1.00 0.00 H new ATOM 0 HG1 THR A 58 -17.913 -3.641 -13.728 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.470 -4.898 -12.319 1.00 0.00 H new ATOM 0 HG22 THR A 58 -14.999 -4.060 -11.769 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.603 -3.445 -11.301 1.00 0.00 H new ATOM 605 N TYR A 59 -13.318 -0.558 -13.179 1.00 0.00 N ATOM 606 CA TYR A 59 -11.880 -0.437 -13.018 1.00 0.00 C ATOM 607 C TYR A 59 -11.511 -0.207 -11.551 1.00 0.00 C ATOM 608 O TYR A 59 -12.378 0.075 -10.726 1.00 0.00 O ATOM 609 CB TYR A 59 -11.466 0.789 -13.833 1.00 0.00 C ATOM 610 CG TYR A 59 -11.632 2.116 -13.091 1.00 0.00 C ATOM 611 CD1 TYR A 59 -12.688 2.292 -12.219 1.00 0.00 C ATOM 612 CD2 TYR A 59 -10.726 3.138 -13.291 1.00 0.00 C ATOM 613 CE1 TYR A 59 -12.844 3.541 -11.520 1.00 0.00 C ATOM 614 CE2 TYR A 59 -10.882 4.387 -12.591 1.00 0.00 C ATOM 615 CZ TYR A 59 -11.934 4.526 -11.740 1.00 0.00 C ATOM 616 OH TYR A 59 -12.082 5.706 -11.080 1.00 0.00 O ATOM 0 H TYR A 59 -13.781 0.283 -13.524 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.379 -1.347 -13.348 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -10.423 0.679 -14.131 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -12.057 0.820 -14.748 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -13.397 1.493 -12.061 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -9.900 3.001 -13.973 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -13.666 3.692 -10.836 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -10.180 5.194 -12.738 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.358 6.316 -11.334 1.00 0.00 H new ATOM 625 N CYS A 60 -10.222 -0.338 -11.272 1.00 0.00 N ATOM 626 CA CYS A 60 -9.727 -0.148 -9.918 1.00 0.00 C ATOM 627 C CYS A 60 -9.928 1.320 -9.535 1.00 0.00 C ATOM 628 O CYS A 60 -9.875 2.202 -10.390 1.00 0.00 O ATOM 629 CB CYS A 60 -8.264 -0.577 -9.786 1.00 0.00 C ATOM 630 SG CYS A 60 -7.976 -2.377 -9.947 1.00 0.00 S ATOM 0 H CYS A 60 -9.506 -0.573 -11.959 1.00 0.00 H new ATOM 0 HA CYS A 60 -10.287 -0.782 -9.230 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.678 -0.060 -10.546 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.889 -0.248 -8.817 1.00 0.00 H new ATOM 634 N ASN A 61 -10.154 1.535 -8.247 1.00 0.00 N ATOM 635 CA ASN A 61 -10.362 2.881 -7.740 1.00 0.00 C ATOM 636 C ASN A 61 -9.214 3.252 -6.800 1.00 0.00 C ATOM 637 O ASN A 61 -8.479 2.379 -6.338 1.00 0.00 O ATOM 638 CB ASN A 61 -11.669 2.975 -6.949 1.00 0.00 C ATOM 639 CG ASN A 61 -11.940 4.415 -6.507 1.00 0.00 C ATOM 640 OD1 ASN A 61 -12.149 4.705 -5.341 1.00 0.00 O ATOM 641 ND2 ASN A 61 -11.927 5.297 -7.502 1.00 0.00 N ATOM 0 H ASN A 61 -10.198 0.801 -7.540 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.405 3.559 -8.593 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.496 2.617 -7.562 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.617 2.326 -6.075 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -12.099 6.284 -7.311 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -11.745 4.986 -8.456 1.00 0.00 H new ATOM 647 N THR A 62 -9.093 4.546 -6.545 1.00 0.00 N ATOM 648 CA THR A 62 -8.045 5.043 -5.669 1.00 0.00 C ATOM 649 C THR A 62 -8.224 4.485 -4.256 1.00 0.00 C ATOM 650 O THR A 62 -9.295 4.617 -3.663 1.00 0.00 O ATOM 651 CB THR A 62 -8.065 6.571 -5.727 1.00 0.00 C ATOM 652 OG1 THR A 62 -7.394 6.881 -6.945 1.00 0.00 O ATOM 653 CG2 THR A 62 -7.191 7.210 -4.646 1.00 0.00 C ATOM 0 H THR A 62 -9.704 5.267 -6.930 1.00 0.00 H new ATOM 0 HA THR A 62 -7.062 4.705 -5.996 1.00 0.00 H new ATOM 0 HB THR A 62 -9.090 6.925 -5.620 1.00 0.00 H new ATOM 0 HG1 THR A 62 -7.363 7.853 -7.063 1.00 0.00 H new ATOM 0 HG21 THR A 62 -7.241 8.295 -4.732 1.00 0.00 H new ATOM 0 HG22 THR A 62 -7.549 6.907 -3.662 1.00 0.00 H new ATOM 0 HG23 THR A 62 -6.159 6.883 -4.772 1.00 0.00 H new ATOM 661 N THR A 63 -7.161 3.874 -3.756 1.00 0.00 N ATOM 662 CA THR A 63 -7.186 3.297 -2.422 1.00 0.00 C ATOM 663 C THR A 63 -5.765 3.143 -1.880 1.00 0.00 C ATOM 664 O THR A 63 -4.802 3.122 -2.647 1.00 0.00 O ATOM 665 CB THR A 63 -7.955 1.976 -2.494 1.00 0.00 C ATOM 666 OG1 THR A 63 -9.264 2.312 -2.043 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.459 0.953 -1.470 1.00 0.00 C ATOM 0 H THR A 63 -6.276 3.765 -4.251 1.00 0.00 H new ATOM 0 HA THR A 63 -7.699 3.952 -1.718 1.00 0.00 H new ATOM 0 HB THR A 63 -7.866 1.558 -3.497 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.569 3.124 -2.499 1.00 0.00 H new ATOM 0 HG21 THR A 63 -8.038 0.034 -1.564 1.00 0.00 H new ATOM 0 HG22 THR A 63 -6.406 0.738 -1.651 1.00 0.00 H new ATOM 0 HG23 THR A 63 -7.579 1.357 -0.465 1.00 0.00 H new ATOM 675 N LEU A 64 -5.676 3.040 -0.562 1.00 0.00 N ATOM 676 CA LEU A 64 -4.388 2.888 0.092 1.00 0.00 C ATOM 677 C LEU A 64 -4.468 1.750 1.112 1.00 0.00 C ATOM 678 O LEU A 64 -5.344 1.747 1.976 1.00 0.00 O ATOM 679 CB LEU A 64 -3.932 4.220 0.693 1.00 0.00 C ATOM 680 CG LEU A 64 -4.934 4.919 1.612 1.00 0.00 C ATOM 681 CD1 LEU A 64 -4.868 4.349 3.030 1.00 0.00 C ATOM 682 CD2 LEU A 64 -4.731 6.436 1.595 1.00 0.00 C ATOM 0 H LEU A 64 -6.476 3.059 0.071 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.623 2.612 -0.634 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.014 4.047 1.254 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.684 4.898 -0.123 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.937 4.724 1.232 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -5.591 4.864 3.663 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -5.101 3.284 3.005 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.866 4.492 3.433 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.457 6.908 2.257 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.723 6.672 1.935 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.869 6.810 0.581 1.00 0.00 H new ATOM 693 N ASP A 65 -3.543 0.811 0.976 1.00 0.00 N ATOM 694 CA ASP A 65 -3.498 -0.330 1.874 1.00 0.00 C ATOM 695 C ASP A 65 -2.503 -0.048 3.002 1.00 0.00 C ATOM 696 O ASP A 65 -2.156 1.105 3.254 1.00 0.00 O ATOM 697 CB ASP A 65 -3.037 -1.590 1.141 1.00 0.00 C ATOM 698 CG ASP A 65 -3.898 -2.832 1.384 1.00 0.00 C ATOM 699 OD1 ASP A 65 -4.182 -3.103 2.570 1.00 0.00 O ATOM 700 OD2 ASP A 65 -4.254 -3.481 0.376 1.00 0.00 O ATOM 0 H ASP A 65 -2.819 0.817 0.257 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.502 -0.489 2.267 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.018 -1.383 0.071 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -2.013 -1.812 1.441 1.00 0.00 H new ATOM 704 N GLN A 66 -2.072 -1.121 3.649 1.00 0.00 N ATOM 705 CA GLN A 66 -1.123 -1.002 4.743 1.00 0.00 C ATOM 706 C GLN A 66 -0.081 0.073 4.430 1.00 0.00 C ATOM 707 O GLN A 66 0.442 0.719 5.336 1.00 0.00 O ATOM 708 CB GLN A 66 -0.454 -2.346 5.036 1.00 0.00 C ATOM 709 CG GLN A 66 -1.386 -3.263 5.830 1.00 0.00 C ATOM 710 CD GLN A 66 -2.275 -4.085 4.894 1.00 0.00 C ATOM 711 OE1 GLN A 66 -1.828 -4.652 3.911 1.00 0.00 O ATOM 712 NE2 GLN A 66 -3.555 -4.117 5.253 1.00 0.00 N ATOM 0 H GLN A 66 -2.362 -2.076 3.437 1.00 0.00 H new ATOM 0 HA GLN A 66 -1.667 -0.701 5.638 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.175 -2.829 4.099 1.00 0.00 H new ATOM 0 HB3 GLN A 66 0.466 -2.183 5.597 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -0.796 -3.931 6.457 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -2.008 -2.666 6.497 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -3.863 -3.620 6.089 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -4.229 -4.639 4.693 1.00 0.00 H new ATOM 719 N ILE A 67 0.188 0.233 3.142 1.00 0.00 N ATOM 720 CA ILE A 67 1.158 1.218 2.697 1.00 0.00 C ATOM 721 C ILE A 67 0.450 2.553 2.459 1.00 0.00 C ATOM 722 O ILE A 67 -0.219 2.732 1.442 1.00 0.00 O ATOM 723 CB ILE A 67 1.925 0.703 1.478 1.00 0.00 C ATOM 724 CG1 ILE A 67 2.697 -0.574 1.815 1.00 0.00 C ATOM 725 CG2 ILE A 67 2.837 1.789 0.904 1.00 0.00 C ATOM 726 CD1 ILE A 67 1.854 -1.818 1.527 1.00 0.00 C ATOM 0 H ILE A 67 -0.249 -0.303 2.393 1.00 0.00 H new ATOM 0 HA ILE A 67 1.909 1.388 3.468 1.00 0.00 H new ATOM 0 HB ILE A 67 1.202 0.447 0.703 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.617 -0.611 1.232 1.00 0.00 H new ATOM 0 HG13 ILE A 67 2.986 -0.562 2.866 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.370 1.396 0.038 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.236 2.646 0.601 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.555 2.099 1.663 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.427 -2.711 1.775 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.946 -1.790 2.130 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.587 -1.840 0.470 1.00 0.00 H new ATOM 737 N GLY A 68 0.621 3.456 3.413 1.00 0.00 N ATOM 738 CA GLY A 68 0.005 4.769 3.320 1.00 0.00 C ATOM 739 C GLY A 68 -0.026 5.258 1.871 1.00 0.00 C ATOM 740 O GLY A 68 -1.028 5.812 1.420 1.00 0.00 O ATOM 0 H GLY A 68 1.177 3.305 4.254 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.010 4.727 3.715 1.00 0.00 H new ATOM 0 HA3 GLY A 68 0.558 5.479 3.935 1.00 0.00 H new ATOM 744 N THR A 69 1.084 5.037 1.181 1.00 0.00 N ATOM 745 CA THR A 69 1.197 5.448 -0.208 1.00 0.00 C ATOM 746 C THR A 69 -0.054 5.041 -0.988 1.00 0.00 C ATOM 747 O THR A 69 -0.280 3.856 -1.232 1.00 0.00 O ATOM 748 CB THR A 69 2.487 4.853 -0.774 1.00 0.00 C ATOM 749 OG1 THR A 69 3.506 5.742 -0.327 1.00 0.00 O ATOM 750 CG2 THR A 69 2.554 4.946 -2.300 1.00 0.00 C ATOM 0 H THR A 69 1.913 4.578 1.559 1.00 0.00 H new ATOM 0 HA THR A 69 1.257 6.533 -0.296 1.00 0.00 H new ATOM 0 HB THR A 69 2.569 3.810 -0.470 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.377 5.429 -0.649 1.00 0.00 H new ATOM 0 HG21 THR A 69 3.489 4.510 -2.650 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.715 4.403 -2.735 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.506 5.992 -2.603 1.00 0.00 H new ATOM 758 N CYS A 70 -0.835 6.045 -1.357 1.00 0.00 N ATOM 759 CA CYS A 70 -2.058 5.806 -2.106 1.00 0.00 C ATOM 760 C CYS A 70 -1.696 5.660 -3.585 1.00 0.00 C ATOM 761 O CYS A 70 -0.804 6.347 -4.079 1.00 0.00 O ATOM 762 CB CYS A 70 -3.088 6.914 -1.876 1.00 0.00 C ATOM 763 SG CYS A 70 -2.809 8.435 -2.854 1.00 0.00 S ATOM 0 H CYS A 70 -0.645 7.026 -1.152 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.527 4.886 -1.756 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -4.079 6.524 -2.111 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -3.090 7.175 -0.818 1.00 0.00 H new ATOM 767 N TRP A 71 -2.408 4.762 -4.250 1.00 0.00 N ATOM 768 CA TRP A 71 -2.173 4.518 -5.662 1.00 0.00 C ATOM 769 C TRP A 71 -3.381 5.043 -6.441 1.00 0.00 C ATOM 770 O TRP A 71 -4.519 4.911 -5.991 1.00 0.00 O ATOM 771 CB TRP A 71 -1.891 3.037 -5.923 1.00 0.00 C ATOM 772 CG TRP A 71 -0.797 2.445 -5.033 1.00 0.00 C ATOM 773 CD1 TRP A 71 -0.855 2.177 -3.722 1.00 0.00 C ATOM 774 CD2 TRP A 71 0.531 2.057 -5.446 1.00 0.00 C ATOM 775 NE1 TRP A 71 0.333 1.645 -3.261 1.00 0.00 N ATOM 776 CE2 TRP A 71 1.202 1.571 -4.343 1.00 0.00 C ATOM 777 CE3 TRP A 71 1.144 2.114 -6.710 1.00 0.00 C ATOM 778 CZ2 TRP A 71 2.521 1.105 -4.392 1.00 0.00 C ATOM 779 CZ3 TRP A 71 2.463 1.646 -6.742 1.00 0.00 C ATOM 780 CH2 TRP A 71 3.152 1.153 -5.641 1.00 0.00 C ATOM 0 H TRP A 71 -3.148 4.195 -3.836 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.283 5.048 -6.002 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -2.811 2.471 -5.775 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -1.603 2.911 -6.967 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -1.722 2.355 -3.103 1.00 0.00 H new ATOM 0 HE1 TRP A 71 0.535 1.359 -2.303 1.00 0.00 H new ATOM 0 HE3 TRP A 71 0.637 2.489 -7.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 3.025 0.729 -3.514 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 2.981 1.670 -7.689 1.00 0.00 H new ATOM 0 HH2 TRP A 71 4.170 0.808 -5.748 1.00 0.00 H new ATOM 790 N PRO A 72 -3.085 5.642 -7.624 1.00 0.00 N ATOM 791 CA PRO A 72 -4.134 6.189 -8.470 1.00 0.00 C ATOM 792 C PRO A 72 -4.897 5.072 -9.185 1.00 0.00 C ATOM 793 O PRO A 72 -4.309 4.069 -9.585 1.00 0.00 O ATOM 794 CB PRO A 72 -3.420 7.128 -9.426 1.00 0.00 C ATOM 795 CG PRO A 72 -1.954 6.724 -9.391 1.00 0.00 C ATOM 796 CD PRO A 72 -1.751 5.817 -8.189 1.00 0.00 C ATOM 0 HA PRO A 72 -4.896 6.725 -7.904 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.825 7.041 -10.434 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.546 8.167 -9.120 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.678 6.207 -10.310 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.317 7.605 -9.317 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.318 4.861 -8.484 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.071 6.266 -7.465 1.00 0.00 H new ATOM 801 N GLN A 73 -6.198 5.284 -9.327 1.00 0.00 N ATOM 802 CA GLN A 73 -7.048 4.309 -9.988 1.00 0.00 C ATOM 803 C GLN A 73 -6.296 3.648 -11.146 1.00 0.00 C ATOM 804 O GLN A 73 -5.414 4.258 -11.746 1.00 0.00 O ATOM 805 CB GLN A 73 -8.347 4.954 -10.475 1.00 0.00 C ATOM 806 CG GLN A 73 -8.991 5.792 -9.369 1.00 0.00 C ATOM 807 CD GLN A 73 -9.009 7.275 -9.743 1.00 0.00 C ATOM 808 OE1 GLN A 73 -9.958 7.996 -9.484 1.00 0.00 O ATOM 809 NE2 GLN A 73 -7.908 7.688 -10.367 1.00 0.00 N ATOM 0 H GLN A 73 -6.684 6.117 -8.995 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.313 3.538 -9.265 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.142 5.584 -11.341 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.042 4.180 -10.801 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.009 5.446 -9.192 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.441 5.655 -8.438 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.150 7.031 -10.553 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.822 8.661 -10.659 1.00 0.00 H new ATOM 816 N SER A 74 -6.674 2.409 -11.423 1.00 0.00 N ATOM 817 CA SER A 74 -6.047 1.658 -12.499 1.00 0.00 C ATOM 818 C SER A 74 -7.090 0.795 -13.212 1.00 0.00 C ATOM 819 O SER A 74 -8.286 0.921 -12.954 1.00 0.00 O ATOM 820 CB SER A 74 -4.908 0.786 -11.969 1.00 0.00 C ATOM 821 OG SER A 74 -4.122 1.466 -10.994 1.00 0.00 O ATOM 0 H SER A 74 -7.406 1.906 -10.922 1.00 0.00 H new ATOM 0 HA SER A 74 -5.625 2.367 -13.211 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.321 -0.123 -11.531 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.271 0.479 -12.798 1.00 0.00 H new ATOM 0 HG SER A 74 -4.159 0.977 -10.145 1.00 0.00 H new ATOM 826 N ALA A 75 -6.599 -0.062 -14.094 1.00 0.00 N ATOM 827 CA ALA A 75 -7.472 -0.946 -14.846 1.00 0.00 C ATOM 828 C ALA A 75 -7.455 -2.337 -14.210 1.00 0.00 C ATOM 829 O ALA A 75 -6.477 -2.717 -13.568 1.00 0.00 O ATOM 830 CB ALA A 75 -7.036 -0.970 -16.312 1.00 0.00 C ATOM 0 H ALA A 75 -5.606 -0.163 -14.305 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.500 -0.584 -14.818 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.692 -1.634 -16.876 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.096 0.037 -16.726 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.009 -1.330 -16.380 1.00 0.00 H new ATOM 836 N PRO A 76 -8.577 -3.077 -14.415 1.00 0.00 N ATOM 837 CA PRO A 76 -8.699 -4.418 -13.868 1.00 0.00 C ATOM 838 C PRO A 76 -7.855 -5.414 -14.666 1.00 0.00 C ATOM 839 O PRO A 76 -7.684 -5.262 -15.874 1.00 0.00 O ATOM 840 CB PRO A 76 -10.186 -4.728 -13.916 1.00 0.00 C ATOM 841 CG PRO A 76 -10.785 -3.745 -14.910 1.00 0.00 C ATOM 842 CD PRO A 76 -9.754 -2.659 -15.170 1.00 0.00 C ATOM 0 HA PRO A 76 -8.323 -4.492 -12.848 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.360 -5.757 -14.231 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.641 -4.614 -12.932 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -11.047 -4.253 -15.838 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.703 -3.312 -14.513 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.532 -2.571 -16.233 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.112 -1.685 -14.837 1.00 0.00 H new ATOM 847 N GLY A 77 -7.348 -6.411 -13.955 1.00 0.00 N ATOM 848 CA GLY A 77 -6.525 -7.432 -14.581 1.00 0.00 C ATOM 849 C GLY A 77 -5.136 -6.886 -14.919 1.00 0.00 C ATOM 850 O GLY A 77 -4.334 -7.571 -15.551 1.00 0.00 O ATOM 0 H GLY A 77 -7.491 -6.533 -12.953 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -6.430 -8.288 -13.913 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -7.010 -7.789 -15.489 1.00 0.00 H new ATOM 854 N ALA A 78 -4.896 -5.658 -14.484 1.00 0.00 N ATOM 855 CA ALA A 78 -3.619 -5.012 -14.733 1.00 0.00 C ATOM 856 C ALA A 78 -2.701 -5.226 -13.528 1.00 0.00 C ATOM 857 O ALA A 78 -2.894 -6.162 -12.754 1.00 0.00 O ATOM 858 CB ALA A 78 -3.846 -3.530 -15.037 1.00 0.00 C ATOM 0 H ALA A 78 -5.565 -5.093 -13.960 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.130 -5.451 -15.603 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.887 -3.046 -15.224 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.480 -3.432 -15.918 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.333 -3.054 -14.186 1.00 0.00 H new ATOM 864 N LEU A 79 -1.721 -4.342 -13.406 1.00 0.00 N ATOM 865 CA LEU A 79 -0.773 -4.422 -12.308 1.00 0.00 C ATOM 866 C LEU A 79 0.157 -3.208 -12.354 1.00 0.00 C ATOM 867 O LEU A 79 0.683 -2.864 -13.411 1.00 0.00 O ATOM 868 CB LEU A 79 -0.036 -5.763 -12.334 1.00 0.00 C ATOM 869 CG LEU A 79 0.413 -6.254 -13.711 1.00 0.00 C ATOM 870 CD1 LEU A 79 1.884 -5.914 -13.962 1.00 0.00 C ATOM 871 CD2 LEU A 79 0.134 -7.750 -13.877 1.00 0.00 C ATOM 0 H LEU A 79 -1.563 -3.567 -14.050 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.294 -4.389 -11.351 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.843 -5.685 -11.694 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.685 -6.520 -11.894 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.172 -5.731 -14.468 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.178 -6.274 -14.948 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.021 -4.834 -13.915 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.503 -6.392 -13.202 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.462 -8.074 -14.865 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.676 -8.308 -13.113 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.935 -7.935 -13.772 1.00 0.00 H new ATOM 882 N VAL A 80 0.331 -2.592 -11.193 1.00 0.00 N ATOM 883 CA VAL A 80 1.189 -1.424 -11.088 1.00 0.00 C ATOM 884 C VAL A 80 2.517 -1.828 -10.445 1.00 0.00 C ATOM 885 O VAL A 80 2.883 -1.311 -9.390 1.00 0.00 O ATOM 886 CB VAL A 80 0.467 -0.313 -10.321 1.00 0.00 C ATOM 887 CG1 VAL A 80 1.443 0.789 -9.905 1.00 0.00 C ATOM 888 CG2 VAL A 80 -0.688 0.259 -11.145 1.00 0.00 C ATOM 0 H VAL A 80 -0.107 -2.880 -10.318 1.00 0.00 H new ATOM 0 HA VAL A 80 1.415 -1.025 -12.077 1.00 0.00 H new ATOM 0 HB VAL A 80 0.048 -0.749 -9.414 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.905 1.566 -9.362 1.00 0.00 H new ATOM 0 HG12 VAL A 80 2.216 0.367 -9.263 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.904 1.221 -10.793 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.185 1.046 -10.578 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.301 0.672 -12.077 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.403 -0.533 -11.368 1.00 0.00 H new ATOM 898 N GLU A 81 3.203 -2.749 -11.108 1.00 0.00 N ATOM 899 CA GLU A 81 4.482 -3.228 -10.614 1.00 0.00 C ATOM 900 C GLU A 81 5.620 -2.366 -11.164 1.00 0.00 C ATOM 901 O GLU A 81 5.569 -1.922 -12.310 1.00 0.00 O ATOM 902 CB GLU A 81 4.689 -4.702 -10.969 1.00 0.00 C ATOM 903 CG GLU A 81 4.966 -4.872 -12.464 1.00 0.00 C ATOM 904 CD GLU A 81 6.412 -5.310 -12.708 1.00 0.00 C ATOM 905 OE1 GLU A 81 6.844 -6.254 -12.012 1.00 0.00 O ATOM 906 OE2 GLU A 81 7.052 -4.691 -13.586 1.00 0.00 O ATOM 0 H GLU A 81 2.897 -3.175 -11.982 1.00 0.00 H new ATOM 0 HA GLU A 81 4.484 -3.146 -9.527 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.522 -5.105 -10.393 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.804 -5.274 -10.692 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.283 -5.611 -12.882 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.775 -3.932 -12.982 1.00 0.00 H new ATOM 911 N ARG A 82 6.620 -2.154 -10.321 1.00 0.00 N ATOM 912 CA ARG A 82 7.769 -1.354 -10.709 1.00 0.00 C ATOM 913 C ARG A 82 9.013 -1.800 -9.937 1.00 0.00 C ATOM 914 O ARG A 82 9.572 -1.032 -9.156 1.00 0.00 O ATOM 915 CB ARG A 82 7.518 0.132 -10.443 1.00 0.00 C ATOM 916 CG ARG A 82 6.221 0.597 -11.107 1.00 0.00 C ATOM 917 CD ARG A 82 6.147 2.124 -11.157 1.00 0.00 C ATOM 918 NE ARG A 82 5.340 2.631 -10.024 1.00 0.00 N ATOM 919 CZ ARG A 82 5.374 3.895 -9.584 1.00 0.00 C ATOM 920 NH1 ARG A 82 6.174 4.791 -10.178 1.00 0.00 N ATOM 921 NH2 ARG A 82 4.608 4.264 -8.548 1.00 0.00 N ATOM 0 H ARG A 82 6.658 -2.522 -9.371 1.00 0.00 H new ATOM 0 HA ARG A 82 7.930 -1.500 -11.777 1.00 0.00 H new ATOM 0 HB2 ARG A 82 7.464 0.309 -9.369 1.00 0.00 H new ATOM 0 HB3 ARG A 82 8.355 0.719 -10.821 1.00 0.00 H new ATOM 0 HG2 ARG A 82 6.161 0.193 -12.118 1.00 0.00 H new ATOM 0 HG3 ARG A 82 5.366 0.206 -10.556 1.00 0.00 H new ATOM 0 HD2 ARG A 82 7.151 2.546 -11.116 1.00 0.00 H new ATOM 0 HD3 ARG A 82 5.705 2.444 -12.101 1.00 0.00 H new ATOM 0 HE ARG A 82 4.719 1.976 -9.549 1.00 0.00 H new ATOM 0 HH11 ARG A 82 6.758 4.510 -10.966 1.00 0.00 H new ATOM 0 HH12 ARG A 82 6.199 5.754 -9.842 1.00 0.00 H new ATOM 0 HH21 ARG A 82 4.000 3.582 -8.095 1.00 0.00 H new ATOM 0 HH22 ARG A 82 4.634 5.227 -8.212 1.00 0.00 H new ATOM 932 N PRO A 83 9.419 -3.072 -10.190 1.00 0.00 N ATOM 933 CA PRO A 83 10.587 -3.630 -9.528 1.00 0.00 C ATOM 934 C PRO A 83 11.877 -3.062 -10.122 1.00 0.00 C ATOM 935 O PRO A 83 12.306 -3.478 -11.198 1.00 0.00 O ATOM 936 CB PRO A 83 10.460 -5.134 -9.710 1.00 0.00 C ATOM 937 CG PRO A 83 9.483 -5.335 -10.858 1.00 0.00 C ATOM 938 CD PRO A 83 8.782 -4.011 -11.109 1.00 0.00 C ATOM 0 HA PRO A 83 10.635 -3.373 -8.470 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.427 -5.583 -9.937 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.095 -5.608 -8.799 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.009 -5.664 -11.754 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.758 -6.110 -10.611 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.899 -3.692 -12.145 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.712 -4.087 -10.918 1.00 0.00 H new ATOM 943 N CYS A 84 12.461 -2.121 -9.396 1.00 0.00 N ATOM 944 CA CYS A 84 13.695 -1.492 -9.837 1.00 0.00 C ATOM 945 C CYS A 84 13.401 -0.706 -11.116 1.00 0.00 C ATOM 946 O CYS A 84 12.423 -0.982 -11.809 1.00 0.00 O ATOM 947 CB CYS A 84 14.811 -2.518 -10.042 1.00 0.00 C ATOM 948 SG CYS A 84 14.854 -3.864 -8.802 1.00 0.00 S ATOM 0 H CYS A 84 12.103 -1.778 -8.505 1.00 0.00 H new ATOM 0 HA CYS A 84 14.055 -0.810 -9.066 1.00 0.00 H new ATOM 0 HB2 CYS A 84 14.702 -2.959 -11.033 1.00 0.00 H new ATOM 0 HB3 CYS A 84 15.769 -1.999 -10.028 1.00 0.00 H new ATOM 952 N PRO A 85 14.289 0.286 -11.398 1.00 0.00 N ATOM 953 CA PRO A 85 14.136 1.114 -12.581 1.00 0.00 C ATOM 954 C PRO A 85 14.537 0.348 -13.843 1.00 0.00 C ATOM 955 O PRO A 85 13.725 0.167 -14.749 1.00 0.00 O ATOM 956 CB PRO A 85 15.006 2.333 -12.324 1.00 0.00 C ATOM 957 CG PRO A 85 15.972 1.930 -11.222 1.00 0.00 C ATOM 958 CD PRO A 85 15.459 0.641 -10.599 1.00 0.00 C ATOM 0 HA PRO A 85 13.102 1.410 -12.756 1.00 0.00 H new ATOM 0 HB2 PRO A 85 15.543 2.627 -13.226 1.00 0.00 H new ATOM 0 HB3 PRO A 85 14.401 3.188 -12.020 1.00 0.00 H new ATOM 0 HG2 PRO A 85 16.974 1.786 -11.627 1.00 0.00 H new ATOM 0 HG3 PRO A 85 16.042 2.716 -10.470 1.00 0.00 H new ATOM 0 HD2 PRO A 85 16.215 -0.144 -10.632 1.00 0.00 H new ATOM 0 HD3 PRO A 85 15.195 0.785 -9.551 1.00 0.00 H new ATOM 963 N GLU A 86 15.791 -0.081 -13.861 1.00 0.00 N ATOM 964 CA GLU A 86 16.310 -0.824 -14.997 1.00 0.00 C ATOM 965 C GLU A 86 17.100 -2.043 -14.517 1.00 0.00 C ATOM 966 O GLU A 86 17.792 -1.980 -13.503 1.00 0.00 O ATOM 967 CB GLU A 86 17.172 0.071 -15.889 1.00 0.00 C ATOM 968 CG GLU A 86 16.830 -0.134 -17.367 1.00 0.00 C ATOM 969 CD GLU A 86 18.099 -0.270 -18.210 1.00 0.00 C ATOM 970 OE1 GLU A 86 19.016 0.549 -17.990 1.00 0.00 O ATOM 971 OE2 GLU A 86 18.122 -1.190 -19.056 1.00 0.00 O ATOM 0 H GLU A 86 16.462 0.072 -13.108 1.00 0.00 H new ATOM 0 HA GLU A 86 15.468 -1.173 -15.594 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.019 1.116 -15.618 1.00 0.00 H new ATOM 0 HB3 GLU A 86 18.226 -0.150 -15.722 1.00 0.00 H new ATOM 0 HG2 GLU A 86 16.216 -1.027 -17.481 1.00 0.00 H new ATOM 0 HG3 GLU A 86 16.238 0.708 -17.727 1.00 0.00 H new ATOM 976 N TYR A 87 16.971 -3.126 -15.271 1.00 0.00 N ATOM 977 CA TYR A 87 17.664 -4.358 -14.936 1.00 0.00 C ATOM 978 C TYR A 87 19.134 -4.292 -15.356 1.00 0.00 C ATOM 979 O TYR A 87 19.591 -5.105 -16.158 1.00 0.00 O ATOM 980 CB TYR A 87 16.968 -5.464 -15.732 1.00 0.00 C ATOM 981 CG TYR A 87 16.981 -6.830 -15.042 1.00 0.00 C ATOM 982 CD1 TYR A 87 18.141 -7.577 -15.014 1.00 0.00 C ATOM 983 CD2 TYR A 87 15.834 -7.314 -14.448 1.00 0.00 C ATOM 984 CE1 TYR A 87 18.153 -8.863 -14.365 1.00 0.00 C ATOM 985 CE2 TYR A 87 15.845 -8.599 -13.800 1.00 0.00 C ATOM 986 CZ TYR A 87 17.005 -9.310 -13.790 1.00 0.00 C ATOM 987 OH TYR A 87 17.016 -10.524 -13.177 1.00 0.00 O ATOM 0 H TYR A 87 16.397 -3.175 -16.113 1.00 0.00 H new ATOM 0 HA TYR A 87 17.634 -4.535 -13.861 1.00 0.00 H new ATOM 0 HB2 TYR A 87 15.934 -5.171 -15.915 1.00 0.00 H new ATOM 0 HB3 TYR A 87 17.450 -5.555 -16.705 1.00 0.00 H new ATOM 0 HD1 TYR A 87 19.039 -7.198 -15.478 1.00 0.00 H new ATOM 0 HD2 TYR A 87 14.927 -6.728 -14.469 1.00 0.00 H new ATOM 0 HE1 TYR A 87 19.054 -9.459 -14.336 1.00 0.00 H new ATOM 0 HE2 TYR A 87 14.953 -8.990 -13.333 1.00 0.00 H new ATOM 0 HH TYR A 87 16.127 -10.713 -12.810 1.00 0.00 H new ATOM 996 N PHE A 88 19.833 -3.316 -14.795 1.00 0.00 N ATOM 997 CA PHE A 88 21.242 -3.133 -15.101 1.00 0.00 C ATOM 998 C PHE A 88 22.101 -4.166 -14.367 1.00 0.00 C ATOM 999 O PHE A 88 23.000 -4.762 -14.958 1.00 0.00 O ATOM 1000 CB PHE A 88 21.627 -1.733 -14.620 1.00 0.00 C ATOM 1001 CG PHE A 88 21.183 -1.423 -13.188 1.00 0.00 C ATOM 1002 CD1 PHE A 88 21.961 -1.801 -12.139 1.00 0.00 C ATOM 1003 CD2 PHE A 88 20.011 -0.771 -12.965 1.00 0.00 C ATOM 1004 CE1 PHE A 88 21.550 -1.514 -10.810 1.00 0.00 C ATOM 1005 CE2 PHE A 88 19.599 -0.484 -11.637 1.00 0.00 C ATOM 1006 CZ PHE A 88 20.378 -0.862 -10.588 1.00 0.00 C ATOM 0 H PHE A 88 19.450 -2.644 -14.130 1.00 0.00 H new ATOM 0 HA PHE A 88 21.409 -3.255 -16.171 1.00 0.00 H new ATOM 0 HB2 PHE A 88 22.709 -1.622 -14.686 1.00 0.00 H new ATOM 0 HB3 PHE A 88 21.189 -0.996 -15.293 1.00 0.00 H new ATOM 0 HD1 PHE A 88 22.892 -2.320 -12.316 1.00 0.00 H new ATOM 0 HD2 PHE A 88 19.393 -0.471 -13.798 1.00 0.00 H new ATOM 0 HE1 PHE A 88 22.168 -1.814 -9.977 1.00 0.00 H new ATOM 0 HE2 PHE A 88 18.668 0.034 -11.460 1.00 0.00 H new ATOM 0 HZ PHE A 88 20.065 -0.644 -9.578 1.00 0.00 H new ATOM 1015 N ASN A 89 21.793 -4.344 -13.092 1.00 0.00 N ATOM 1016 CA ASN A 89 22.526 -5.294 -12.270 1.00 0.00 C ATOM 1017 C ASN A 89 23.968 -4.812 -12.104 1.00 0.00 C ATOM 1018 O ASN A 89 24.867 -5.278 -12.801 1.00 0.00 O ATOM 1019 CB ASN A 89 22.563 -6.676 -12.928 1.00 0.00 C ATOM 1020 CG ASN A 89 21.166 -7.104 -13.383 1.00 0.00 C ATOM 1021 OD1 ASN A 89 20.968 -7.593 -14.483 1.00 0.00 O ATOM 1022 ND2 ASN A 89 20.214 -6.891 -12.479 1.00 0.00 N ATOM 0 H ASN A 89 21.046 -3.847 -12.607 1.00 0.00 H new ATOM 0 HA ASN A 89 22.022 -5.365 -11.306 1.00 0.00 H new ATOM 0 HB2 ASN A 89 23.238 -6.658 -13.783 1.00 0.00 H new ATOM 0 HB3 ASN A 89 22.960 -7.407 -12.224 1.00 0.00 H new ATOM 0 HD21 ASN A 89 19.247 -7.141 -12.688 1.00 0.00 H new ATOM 0 HD22 ASN A 89 20.450 -6.478 -11.577 1.00 0.00 H new ATOM 1028 N GLY A 90 24.144 -3.882 -11.176 1.00 0.00 N ATOM 1029 CA GLY A 90 25.461 -3.330 -10.909 1.00 0.00 C ATOM 1030 C GLY A 90 25.599 -1.927 -11.502 1.00 0.00 C ATOM 1031 O GLY A 90 26.486 -1.679 -12.318 1.00 0.00 O ATOM 0 H GLY A 90 23.396 -3.497 -10.600 1.00 0.00 H new ATOM 0 HA2 GLY A 90 25.632 -3.292 -9.833 1.00 0.00 H new ATOM 0 HA3 GLY A 90 26.225 -3.983 -11.330 1.00 0.00 H new ATOM 1035 N ILE A 91 24.709 -1.047 -11.071 1.00 0.00 N ATOM 1036 CA ILE A 91 24.719 0.326 -11.549 1.00 0.00 C ATOM 1037 C ILE A 91 23.989 1.217 -10.544 1.00 0.00 C ATOM 1038 O ILE A 91 23.343 0.721 -9.622 1.00 0.00 O ATOM 1039 CB ILE A 91 24.151 0.403 -12.967 1.00 0.00 C ATOM 1040 CG1 ILE A 91 25.253 0.701 -13.985 1.00 0.00 C ATOM 1041 CG2 ILE A 91 23.008 1.418 -13.045 1.00 0.00 C ATOM 1042 CD1 ILE A 91 25.812 2.111 -13.790 1.00 0.00 C ATOM 0 H ILE A 91 23.975 -1.257 -10.395 1.00 0.00 H new ATOM 0 HA ILE A 91 25.741 0.698 -11.620 1.00 0.00 H new ATOM 0 HB ILE A 91 23.735 -0.572 -13.221 1.00 0.00 H new ATOM 0 HG12 ILE A 91 26.055 -0.030 -13.882 1.00 0.00 H new ATOM 0 HG13 ILE A 91 24.857 0.599 -14.995 1.00 0.00 H new ATOM 0 HG21 ILE A 91 22.622 1.453 -14.064 1.00 0.00 H new ATOM 0 HG22 ILE A 91 22.210 1.120 -12.365 1.00 0.00 H new ATOM 0 HG23 ILE A 91 23.377 2.404 -12.762 1.00 0.00 H new ATOM 0 HD11 ILE A 91 26.594 2.297 -14.526 1.00 0.00 H new ATOM 0 HD12 ILE A 91 25.012 2.840 -13.917 1.00 0.00 H new ATOM 0 HD13 ILE A 91 26.229 2.202 -12.787 1.00 0.00 H new ATOM 1053 N LYS A 92 24.115 2.519 -10.754 1.00 0.00 N ATOM 1054 CA LYS A 92 23.476 3.485 -9.878 1.00 0.00 C ATOM 1055 C LYS A 92 22.023 3.681 -10.317 1.00 0.00 C ATOM 1056 O LYS A 92 21.761 4.276 -11.361 1.00 0.00 O ATOM 1057 CB LYS A 92 24.284 4.783 -9.830 1.00 0.00 C ATOM 1058 CG LYS A 92 24.464 5.264 -8.389 1.00 0.00 C ATOM 1059 CD LYS A 92 25.098 6.656 -8.350 1.00 0.00 C ATOM 1060 CE LYS A 92 25.921 6.848 -7.074 1.00 0.00 C ATOM 1061 NZ LYS A 92 25.140 7.594 -6.062 1.00 0.00 N ATOM 0 H LYS A 92 24.651 2.928 -11.519 1.00 0.00 H new ATOM 0 HA LYS A 92 23.454 3.113 -8.854 1.00 0.00 H new ATOM 0 HB2 LYS A 92 25.260 4.625 -10.289 1.00 0.00 H new ATOM 0 HB3 LYS A 92 23.778 5.552 -10.413 1.00 0.00 H new ATOM 0 HG2 LYS A 92 23.497 5.287 -7.886 1.00 0.00 H new ATOM 0 HG3 LYS A 92 25.091 4.560 -7.842 1.00 0.00 H new ATOM 0 HD2 LYS A 92 25.736 6.793 -9.223 1.00 0.00 H new ATOM 0 HD3 LYS A 92 24.319 7.416 -8.402 1.00 0.00 H new ATOM 0 HE2 LYS A 92 26.214 5.878 -6.673 1.00 0.00 H new ATOM 0 HE3 LYS A 92 26.839 7.388 -7.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 25.712 7.716 -5.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 24.882 8.527 -6.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 24.276 7.064 -5.830 1.00 0.00 H new ATOM 1071 N TYR A 93 21.116 3.169 -9.497 1.00 0.00 N ATOM 1072 CA TYR A 93 19.697 3.281 -9.788 1.00 0.00 C ATOM 1073 C TYR A 93 19.162 4.657 -9.387 1.00 0.00 C ATOM 1074 O TYR A 93 19.872 5.447 -8.768 1.00 0.00 O ATOM 1075 CB TYR A 93 19.007 2.212 -8.938 1.00 0.00 C ATOM 1076 CG TYR A 93 19.359 2.277 -7.450 1.00 0.00 C ATOM 1077 CD1 TYR A 93 18.953 3.357 -6.691 1.00 0.00 C ATOM 1078 CD2 TYR A 93 20.082 1.258 -6.866 1.00 0.00 C ATOM 1079 CE1 TYR A 93 19.283 3.419 -5.292 1.00 0.00 C ATOM 1080 CE2 TYR A 93 20.414 1.320 -5.466 1.00 0.00 C ATOM 1081 CZ TYR A 93 19.998 2.397 -4.748 1.00 0.00 C ATOM 1082 OH TYR A 93 20.311 2.456 -3.426 1.00 0.00 O ATOM 0 H TYR A 93 21.337 2.676 -8.632 1.00 0.00 H new ATOM 0 HA TYR A 93 19.513 3.151 -10.854 1.00 0.00 H new ATOM 0 HB2 TYR A 93 17.928 2.314 -9.050 1.00 0.00 H new ATOM 0 HB3 TYR A 93 19.276 1.228 -9.322 1.00 0.00 H new ATOM 0 HD1 TYR A 93 18.387 4.156 -7.148 1.00 0.00 H new ATOM 0 HD2 TYR A 93 20.399 0.413 -7.459 1.00 0.00 H new ATOM 0 HE1 TYR A 93 18.970 4.258 -4.687 1.00 0.00 H new ATOM 0 HE2 TYR A 93 20.981 0.529 -4.997 1.00 0.00 H new ATOM 0 HH TYR A 93 20.822 1.658 -3.175 1.00 0.00 H new ATOM 1091 N ASN A 94 17.914 4.902 -9.759 1.00 0.00 N ATOM 1092 CA ASN A 94 17.275 6.170 -9.447 1.00 0.00 C ATOM 1093 C ASN A 94 16.209 5.947 -8.373 1.00 0.00 C ATOM 1094 O ASN A 94 15.914 6.849 -7.589 1.00 0.00 O ATOM 1095 CB ASN A 94 16.588 6.758 -10.681 1.00 0.00 C ATOM 1096 CG ASN A 94 17.616 7.184 -11.731 1.00 0.00 C ATOM 1097 OD1 ASN A 94 17.619 8.303 -12.215 1.00 0.00 O ATOM 1098 ND2 ASN A 94 18.485 6.231 -12.054 1.00 0.00 N ATOM 0 H ASN A 94 17.328 4.244 -10.273 1.00 0.00 H new ATOM 0 HA ASN A 94 18.044 6.860 -9.100 1.00 0.00 H new ATOM 0 HB2 ASN A 94 15.909 6.021 -11.110 1.00 0.00 H new ATOM 0 HB3 ASN A 94 15.983 7.617 -10.390 1.00 0.00 H new ATOM 0 HD21 ASN A 94 19.211 6.416 -12.746 1.00 0.00 H new ATOM 0 HD22 ASN A 94 18.426 5.315 -11.610 1.00 0.00 H new ATOM 1104 N THR A 95 15.660 4.741 -8.369 1.00 0.00 N ATOM 1105 CA THR A 95 14.633 4.390 -7.403 1.00 0.00 C ATOM 1106 C THR A 95 13.391 5.260 -7.604 1.00 0.00 C ATOM 1107 O THR A 95 13.411 6.454 -7.309 1.00 0.00 O ATOM 1108 CB THR A 95 15.239 4.510 -6.003 1.00 0.00 C ATOM 1109 OG1 THR A 95 16.040 3.339 -5.871 1.00 0.00 O ATOM 1110 CG2 THR A 95 14.191 4.371 -4.898 1.00 0.00 C ATOM 0 H THR A 95 15.907 3.995 -9.019 1.00 0.00 H new ATOM 0 HA THR A 95 14.297 3.362 -7.540 1.00 0.00 H new ATOM 0 HB THR A 95 15.743 5.472 -5.906 1.00 0.00 H new ATOM 0 HG1 THR A 95 16.988 3.586 -5.904 1.00 0.00 H new ATOM 0 HG21 THR A 95 14.674 4.464 -3.925 1.00 0.00 H new ATOM 0 HG22 THR A 95 13.441 5.154 -5.007 1.00 0.00 H new ATOM 0 HG23 THR A 95 13.710 3.396 -4.973 1.00 0.00 H new ATOM 1118 N THR A 96 12.339 4.628 -8.106 1.00 0.00 N ATOM 1119 CA THR A 96 11.090 5.331 -8.350 1.00 0.00 C ATOM 1120 C THR A 96 9.948 4.671 -7.577 1.00 0.00 C ATOM 1121 O THR A 96 8.925 4.312 -8.159 1.00 0.00 O ATOM 1122 CB THR A 96 10.858 5.371 -9.862 1.00 0.00 C ATOM 1123 OG1 THR A 96 10.756 3.998 -10.234 1.00 0.00 O ATOM 1124 CG2 THR A 96 12.082 5.873 -10.630 1.00 0.00 C ATOM 0 H THR A 96 12.326 3.638 -8.350 1.00 0.00 H new ATOM 0 HA THR A 96 11.136 6.358 -7.987 1.00 0.00 H new ATOM 0 HB THR A 96 10.004 6.012 -10.080 1.00 0.00 H new ATOM 0 HG1 THR A 96 10.603 3.931 -11.200 1.00 0.00 H new ATOM 0 HG21 THR A 96 11.863 5.882 -11.698 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.328 6.883 -10.302 1.00 0.00 H new ATOM 0 HG23 THR A 96 12.928 5.213 -10.438 1.00 0.00 H new ATOM 1132 N ARG A 97 10.160 4.530 -6.277 1.00 0.00 N ATOM 1133 CA ARG A 97 9.159 3.919 -5.417 1.00 0.00 C ATOM 1134 C ARG A 97 8.787 2.530 -5.940 1.00 0.00 C ATOM 1135 O ARG A 97 7.657 2.307 -6.370 1.00 0.00 O ATOM 1136 CB ARG A 97 7.899 4.782 -5.340 1.00 0.00 C ATOM 1137 CG ARG A 97 7.976 5.763 -4.169 1.00 0.00 C ATOM 1138 CD ARG A 97 8.032 5.020 -2.833 1.00 0.00 C ATOM 1139 NE ARG A 97 9.302 5.324 -2.138 1.00 0.00 N ATOM 1140 CZ ARG A 97 9.631 6.535 -1.668 1.00 0.00 C ATOM 1141 NH1 ARG A 97 8.785 7.563 -1.817 1.00 0.00 N ATOM 1142 NH2 ARG A 97 10.806 6.718 -1.050 1.00 0.00 N ATOM 0 H ARG A 97 11.010 4.828 -5.798 1.00 0.00 H new ATOM 0 HA ARG A 97 9.587 3.832 -4.418 1.00 0.00 H new ATOM 0 HB2 ARG A 97 7.774 5.333 -6.272 1.00 0.00 H new ATOM 0 HB3 ARG A 97 7.023 4.143 -5.227 1.00 0.00 H new ATOM 0 HG2 ARG A 97 8.859 6.393 -4.276 1.00 0.00 H new ATOM 0 HG3 ARG A 97 7.109 6.423 -4.186 1.00 0.00 H new ATOM 0 HD2 ARG A 97 7.187 5.312 -2.209 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.948 3.946 -3.001 1.00 0.00 H new ATOM 0 HE ARG A 97 9.969 4.564 -2.008 1.00 0.00 H new ATOM 0 HH11 ARG A 97 7.891 7.424 -2.288 1.00 0.00 H new ATOM 0 HH12 ARG A 97 9.035 8.485 -1.459 1.00 0.00 H new ATOM 0 HH21 ARG A 97 11.450 5.935 -0.937 1.00 0.00 H new ATOM 0 HH22 ARG A 97 11.056 7.640 -0.692 1.00 0.00 H new ATOM 1153 N ASN A 98 9.760 1.632 -5.885 1.00 0.00 N ATOM 1154 CA ASN A 98 9.550 0.271 -6.348 1.00 0.00 C ATOM 1155 C ASN A 98 8.379 -0.347 -5.582 1.00 0.00 C ATOM 1156 O ASN A 98 8.063 0.080 -4.472 1.00 0.00 O ATOM 1157 CB ASN A 98 10.787 -0.593 -6.097 1.00 0.00 C ATOM 1158 CG ASN A 98 11.303 -0.412 -4.668 1.00 0.00 C ATOM 1159 OD1 ASN A 98 10.655 0.174 -3.817 1.00 0.00 O ATOM 1160 ND2 ASN A 98 12.502 -0.946 -4.454 1.00 0.00 N ATOM 0 H ASN A 98 10.696 1.821 -5.527 1.00 0.00 H new ATOM 0 HA ASN A 98 9.346 0.306 -7.418 1.00 0.00 H new ATOM 0 HB2 ASN A 98 10.543 -1.641 -6.269 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.571 -0.327 -6.807 1.00 0.00 H new ATOM 0 HD21 ASN A 98 12.933 -0.878 -3.532 1.00 0.00 H new ATOM 0 HD22 ASN A 98 12.990 -1.423 -5.212 1.00 0.00 H new ATOM 1166 N ALA A 99 7.765 -1.342 -6.205 1.00 0.00 N ATOM 1167 CA ALA A 99 6.635 -2.024 -5.595 1.00 0.00 C ATOM 1168 C ALA A 99 6.027 -2.997 -6.607 1.00 0.00 C ATOM 1169 O ALA A 99 6.405 -2.999 -7.777 1.00 0.00 O ATOM 1170 CB ALA A 99 5.622 -0.990 -5.100 1.00 0.00 C ATOM 0 H ALA A 99 8.028 -1.693 -7.126 1.00 0.00 H new ATOM 0 HA ALA A 99 6.957 -2.605 -4.731 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.775 -1.501 -4.643 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.095 -0.341 -4.363 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.273 -0.391 -5.941 1.00 0.00 H new ATOM 1176 N TYR A 100 5.095 -3.803 -6.118 1.00 0.00 N ATOM 1177 CA TYR A 100 4.431 -4.779 -6.965 1.00 0.00 C ATOM 1178 C TYR A 100 2.993 -5.018 -6.502 1.00 0.00 C ATOM 1179 O TYR A 100 2.761 -5.727 -5.523 1.00 0.00 O ATOM 1180 CB TYR A 100 5.226 -6.078 -6.814 1.00 0.00 C ATOM 1181 CG TYR A 100 4.636 -7.260 -7.586 1.00 0.00 C ATOM 1182 CD1 TYR A 100 3.710 -8.086 -6.982 1.00 0.00 C ATOM 1183 CD2 TYR A 100 5.032 -7.502 -8.885 1.00 0.00 C ATOM 1184 CE1 TYR A 100 3.156 -9.199 -7.707 1.00 0.00 C ATOM 1185 CE2 TYR A 100 4.479 -8.615 -9.612 1.00 0.00 C ATOM 1186 CZ TYR A 100 3.567 -9.409 -8.987 1.00 0.00 C ATOM 1187 OH TYR A 100 3.044 -10.460 -9.673 1.00 0.00 O ATOM 0 H TYR A 100 4.784 -3.800 -5.146 1.00 0.00 H new ATOM 0 HA TYR A 100 4.393 -4.430 -7.997 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.248 -5.909 -7.154 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.281 -6.338 -5.757 1.00 0.00 H new ATOM 0 HD1 TYR A 100 3.401 -7.897 -5.965 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.757 -6.856 -9.357 1.00 0.00 H new ATOM 0 HE1 TYR A 100 2.431 -9.853 -7.246 1.00 0.00 H new ATOM 0 HE2 TYR A 100 4.781 -8.815 -10.629 1.00 0.00 H new ATOM 0 HH TYR A 100 3.428 -10.486 -10.574 1.00 0.00 H new ATOM 1196 N ARG A 101 2.063 -4.413 -7.227 1.00 0.00 N ATOM 1197 CA ARG A 101 0.654 -4.552 -6.902 1.00 0.00 C ATOM 1198 C ARG A 101 -0.152 -4.882 -8.161 1.00 0.00 C ATOM 1199 O ARG A 101 -0.078 -4.162 -9.156 1.00 0.00 O ATOM 1200 CB ARG A 101 0.104 -3.268 -6.276 1.00 0.00 C ATOM 1201 CG ARG A 101 0.026 -3.392 -4.753 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.428 -3.497 -4.285 1.00 0.00 C ATOM 1203 NE ARG A 101 -1.699 -2.482 -3.242 1.00 0.00 N ATOM 1204 CZ ARG A 101 -2.009 -1.205 -3.500 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -2.090 -0.777 -4.767 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -2.239 -0.354 -2.491 1.00 0.00 N ATOM 0 H ARG A 101 2.258 -3.826 -8.038 1.00 0.00 H new ATOM 0 HA ARG A 101 0.559 -5.365 -6.182 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.742 -2.426 -6.544 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.887 -3.058 -6.679 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.581 -4.272 -4.427 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.499 -2.527 -4.289 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -2.102 -3.352 -5.129 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -1.621 -4.495 -3.892 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.646 -2.773 -2.266 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -1.916 -1.424 -5.536 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -2.326 0.196 -4.963 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -2.178 -0.679 -1.526 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -2.475 0.619 -2.688 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.901 -5.970 -8.077 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.718 -6.404 -9.197 1.00 0.00 C ATOM 1219 C GLU A 102 -3.177 -5.998 -8.979 1.00 0.00 C ATOM 1220 O GLU A 102 -3.617 -5.835 -7.842 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.597 -7.915 -9.412 1.00 0.00 C ATOM 1222 CG GLU A 102 -2.018 -8.682 -8.157 1.00 0.00 C ATOM 1223 CD GLU A 102 -2.814 -9.937 -8.522 1.00 0.00 C ATOM 1224 OE1 GLU A 102 -2.267 -10.750 -9.298 1.00 0.00 O ATOM 1225 OE2 GLU A 102 -3.952 -10.053 -8.019 1.00 0.00 O ATOM 0 H GLU A 102 -0.960 -6.565 -7.250 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.354 -5.911 -10.098 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -2.220 -8.217 -10.254 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.569 -8.168 -9.670 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -1.134 -8.962 -7.584 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.621 -8.037 -7.518 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.888 -5.844 -10.087 1.00 0.00 N ATOM 1231 CA CYS A 103 -5.287 -5.458 -10.031 1.00 0.00 C ATOM 1232 C CYS A 103 -6.121 -6.589 -10.637 1.00 0.00 C ATOM 1233 O CYS A 103 -5.982 -6.903 -11.818 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.535 -4.124 -10.738 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.047 -2.756 -9.636 1.00 0.00 S ATOM 0 H CYS A 103 -3.521 -5.980 -11.029 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.583 -5.304 -8.993 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.624 -3.830 -11.260 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.304 -4.268 -11.497 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.969 -7.170 -9.801 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.825 -8.259 -10.239 1.00 0.00 C ATOM 1241 C LEU A 104 -8.706 -7.775 -11.393 1.00 0.00 C ATOM 1242 O LEU A 104 -8.822 -6.574 -11.629 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.614 -8.828 -9.059 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.955 -9.984 -8.305 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -8.606 -10.189 -6.936 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -7.968 -11.264 -9.144 1.00 0.00 C ATOM 0 H LEU A 104 -7.081 -6.907 -8.822 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.226 -9.086 -10.619 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.804 -8.021 -8.352 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.584 -9.165 -9.425 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.911 -9.725 -8.128 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.118 -11.017 -6.421 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -8.500 -9.280 -6.343 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -9.664 -10.416 -7.067 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.494 -12.070 -8.585 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.998 -11.538 -9.373 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.422 -11.096 -10.072 1.00 0.00 H new ATOM 1257 N GLU A 105 -9.304 -8.737 -12.081 1.00 0.00 N ATOM 1258 CA GLU A 105 -10.171 -8.425 -13.205 1.00 0.00 C ATOM 1259 C GLU A 105 -11.537 -7.951 -12.705 1.00 0.00 C ATOM 1260 O GLU A 105 -12.426 -7.659 -13.504 1.00 0.00 O ATOM 1261 CB GLU A 105 -10.316 -9.630 -14.137 1.00 0.00 C ATOM 1262 CG GLU A 105 -10.676 -9.186 -15.556 1.00 0.00 C ATOM 1263 CD GLU A 105 -11.024 -10.388 -16.435 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -11.982 -11.102 -16.068 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -10.323 -10.567 -17.455 1.00 0.00 O ATOM 0 H GLU A 105 -9.205 -9.732 -11.882 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.715 -7.618 -13.778 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.384 -10.195 -14.154 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.087 -10.299 -13.755 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.521 -8.499 -15.522 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.840 -8.641 -15.994 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.660 -7.887 -11.388 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.903 -7.452 -10.773 1.00 0.00 C ATOM 1272 C ASN A 106 -12.795 -5.970 -10.407 1.00 0.00 C ATOM 1273 O ASN A 106 -13.755 -5.377 -9.918 1.00 0.00 O ATOM 1274 CB ASN A 106 -13.186 -8.236 -9.490 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.634 -8.728 -9.455 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -15.571 -7.968 -9.267 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -14.766 -10.038 -9.647 1.00 0.00 N ATOM 0 H ASN A 106 -10.920 -8.129 -10.729 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.710 -7.623 -11.486 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.508 -9.087 -9.422 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.992 -7.604 -8.623 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.693 -10.463 -9.643 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -13.940 -10.617 -9.799 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.618 -5.415 -10.659 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.373 -4.015 -10.362 1.00 0.00 C ATOM 1285 C GLY A 107 -10.995 -3.823 -8.892 1.00 0.00 C ATOM 1286 O GLY A 107 -11.566 -2.976 -8.207 1.00 0.00 O ATOM 0 H GLY A 107 -10.824 -5.910 -11.065 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.572 -3.639 -10.999 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.264 -3.430 -10.591 1.00 0.00 H new ATOM 1290 N THR A 108 -10.036 -4.624 -8.452 1.00 0.00 N ATOM 1291 CA THR A 108 -9.575 -4.553 -7.075 1.00 0.00 C ATOM 1292 C THR A 108 -8.055 -4.721 -7.013 1.00 0.00 C ATOM 1293 O THR A 108 -7.454 -5.302 -7.914 1.00 0.00 O ATOM 1294 CB THR A 108 -10.337 -5.606 -6.268 1.00 0.00 C ATOM 1295 OG1 THR A 108 -10.053 -6.831 -6.939 1.00 0.00 O ATOM 1296 CG2 THR A 108 -11.854 -5.455 -6.392 1.00 0.00 C ATOM 0 H THR A 108 -9.565 -5.325 -9.024 1.00 0.00 H new ATOM 0 HA THR A 108 -9.780 -3.576 -6.638 1.00 0.00 H new ATOM 0 HB THR A 108 -10.051 -5.536 -5.219 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.507 -7.568 -6.480 1.00 0.00 H new ATOM 0 HG21 THR A 108 -12.346 -6.227 -5.800 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.153 -4.472 -6.027 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.146 -5.558 -7.437 1.00 0.00 H new ATOM 1304 N TRP A 109 -7.480 -4.200 -5.939 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.041 -4.285 -5.747 1.00 0.00 C ATOM 1306 C TRP A 109 -5.725 -5.656 -5.144 1.00 0.00 C ATOM 1307 O TRP A 109 -6.600 -6.515 -5.053 1.00 0.00 O ATOM 1308 CB TRP A 109 -5.533 -3.123 -4.890 1.00 0.00 C ATOM 1309 CG TRP A 109 -5.450 -1.791 -5.636 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -6.184 -0.687 -5.437 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -4.548 -1.464 -6.713 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -5.822 0.323 -6.306 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -4.795 -0.165 -7.106 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -3.554 -2.241 -7.336 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.092 0.473 -8.135 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -2.861 -1.590 -8.362 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -3.098 -0.282 -8.770 1.00 0.00 C ATOM 0 H TRP A 109 -7.983 -3.718 -5.194 1.00 0.00 H new ATOM 0 HA TRP A 109 -5.518 -4.195 -6.699 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -6.191 -3.005 -4.029 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -4.545 -3.374 -4.504 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -6.960 -0.599 -4.691 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.233 1.256 -6.352 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -3.343 -3.259 -7.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -4.305 1.492 -8.423 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -2.087 -2.143 -8.874 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -2.518 0.150 -9.573 1.00 0.00 H new ATOM 1327 N ALA A 110 -4.471 -5.816 -4.747 1.00 0.00 N ATOM 1328 CA ALA A 110 -4.029 -7.068 -4.155 1.00 0.00 C ATOM 1329 C ALA A 110 -4.006 -6.927 -2.631 1.00 0.00 C ATOM 1330 O ALA A 110 -4.530 -5.957 -2.087 1.00 0.00 O ATOM 1331 CB ALA A 110 -2.661 -7.447 -4.726 1.00 0.00 C ATOM 0 H ALA A 110 -3.748 -5.101 -4.823 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.720 -7.874 -4.401 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -2.329 -8.386 -4.282 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -2.738 -7.563 -5.807 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -1.941 -6.662 -4.496 1.00 0.00 H new ATOM 1337 N SER A 111 -3.393 -7.909 -1.988 1.00 0.00 N ATOM 1338 CA SER A 111 -3.295 -7.907 -0.538 1.00 0.00 C ATOM 1339 C SER A 111 -2.581 -6.639 -0.064 1.00 0.00 C ATOM 1340 O SER A 111 -3.139 -5.860 0.706 1.00 0.00 O ATOM 1341 CB SER A 111 -2.560 -9.150 -0.033 1.00 0.00 C ATOM 1342 OG SER A 111 -3.462 -10.166 0.395 1.00 0.00 O ATOM 0 H SER A 111 -2.959 -8.712 -2.444 1.00 0.00 H new ATOM 0 HA SER A 111 -4.304 -7.924 -0.127 1.00 0.00 H new ATOM 0 HB2 SER A 111 -1.923 -9.541 -0.826 1.00 0.00 H new ATOM 0 HB3 SER A 111 -1.906 -8.874 0.794 1.00 0.00 H new ATOM 0 HG SER A 111 -2.954 -10.943 0.708 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.357 -6.473 -0.544 1.00 0.00 N ATOM 1348 CA ARG A 112 -0.561 -5.313 -0.179 1.00 0.00 C ATOM 1349 C ARG A 112 0.742 -5.290 -0.981 1.00 0.00 C ATOM 1350 O ARG A 112 1.389 -6.323 -1.150 1.00 0.00 O ATOM 1351 CB ARG A 112 -0.233 -5.319 1.315 1.00 0.00 C ATOM 1352 CG ARG A 112 0.536 -6.583 1.703 1.00 0.00 C ATOM 1353 CD ARG A 112 0.936 -6.551 3.180 1.00 0.00 C ATOM 1354 NE ARG A 112 0.623 -7.850 3.817 1.00 0.00 N ATOM 1355 CZ ARG A 112 -0.608 -8.230 4.185 1.00 0.00 C ATOM 1356 NH1 ARG A 112 -1.650 -7.412 3.980 1.00 0.00 N ATOM 1357 NH2 ARG A 112 -0.798 -9.427 4.756 1.00 0.00 N ATOM 0 H ARG A 112 -0.897 -7.122 -1.182 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.147 -4.423 -0.407 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.359 -4.438 1.564 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -1.155 -5.258 1.893 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.079 -7.461 1.508 1.00 0.00 H new ATOM 0 HG3 ARG A 112 1.428 -6.675 1.083 1.00 0.00 H new ATOM 0 HD2 ARG A 112 2.001 -6.338 3.272 1.00 0.00 H new ATOM 0 HD3 ARG A 112 0.405 -5.748 3.692 1.00 0.00 H new ATOM 0 HE ARG A 112 1.393 -8.497 3.987 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.505 -6.501 3.544 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -2.588 -7.700 4.260 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -0.005 -10.050 4.911 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -1.735 -9.716 5.036 1.00 0.00 H new ATOM 1368 N VAL A 113 1.087 -4.102 -1.453 1.00 0.00 N ATOM 1369 CA VAL A 113 2.302 -3.931 -2.232 1.00 0.00 C ATOM 1370 C VAL A 113 3.466 -4.613 -1.511 1.00 0.00 C ATOM 1371 O VAL A 113 3.441 -4.767 -0.291 1.00 0.00 O ATOM 1372 CB VAL A 113 2.550 -2.444 -2.495 1.00 0.00 C ATOM 1373 CG1 VAL A 113 3.235 -1.783 -1.297 1.00 0.00 C ATOM 1374 CG2 VAL A 113 3.365 -2.242 -3.773 1.00 0.00 C ATOM 0 H VAL A 113 0.547 -3.248 -1.311 1.00 0.00 H new ATOM 0 HA VAL A 113 2.200 -4.407 -3.207 1.00 0.00 H new ATOM 0 HB VAL A 113 1.582 -1.962 -2.636 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.400 -0.727 -1.509 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.601 -1.881 -0.416 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.193 -2.270 -1.111 1.00 0.00 H new ATOM 0 HG21 VAL A 113 3.527 -1.177 -3.937 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.327 -2.744 -3.674 1.00 0.00 H new ATOM 0 HG23 VAL A 113 2.822 -2.661 -4.621 1.00 0.00 H new ATOM 1384 N ASN A 114 4.459 -5.003 -2.296 1.00 0.00 N ATOM 1385 CA ASN A 114 5.631 -5.666 -1.748 1.00 0.00 C ATOM 1386 C ASN A 114 6.726 -5.721 -2.814 1.00 0.00 C ATOM 1387 O ASN A 114 6.437 -5.680 -4.009 1.00 0.00 O ATOM 1388 CB ASN A 114 5.306 -7.101 -1.329 1.00 0.00 C ATOM 1389 CG ASN A 114 5.114 -7.999 -2.552 1.00 0.00 C ATOM 1390 OD1 ASN A 114 5.983 -8.763 -2.937 1.00 0.00 O ATOM 1391 ND2 ASN A 114 3.929 -7.865 -3.140 1.00 0.00 N ATOM 0 H ASN A 114 4.477 -4.873 -3.308 1.00 0.00 H new ATOM 0 HA ASN A 114 5.961 -5.101 -0.876 1.00 0.00 H new ATOM 0 HB2 ASN A 114 6.111 -7.494 -0.708 1.00 0.00 H new ATOM 0 HB3 ASN A 114 4.401 -7.110 -0.721 1.00 0.00 H new ATOM 0 HD21 ASN A 114 3.703 -8.421 -3.965 1.00 0.00 H new ATOM 0 HD22 ASN A 114 3.246 -7.206 -2.766 1.00 0.00 H new ATOM 1397 N TYR A 115 7.962 -5.812 -2.344 1.00 0.00 N ATOM 1398 CA TYR A 115 9.102 -5.873 -3.243 1.00 0.00 C ATOM 1399 C TYR A 115 10.406 -6.049 -2.462 1.00 0.00 C ATOM 1400 O TYR A 115 10.963 -5.079 -1.950 1.00 0.00 O ATOM 1401 CB TYR A 115 9.135 -4.529 -3.973 1.00 0.00 C ATOM 1402 CG TYR A 115 9.095 -3.315 -3.043 1.00 0.00 C ATOM 1403 CD1 TYR A 115 7.885 -2.841 -2.579 1.00 0.00 C ATOM 1404 CD2 TYR A 115 10.269 -2.692 -2.669 1.00 0.00 C ATOM 1405 CE1 TYR A 115 7.847 -1.699 -1.703 1.00 0.00 C ATOM 1406 CE2 TYR A 115 10.231 -1.550 -1.794 1.00 0.00 C ATOM 1407 CZ TYR A 115 9.021 -1.109 -1.355 1.00 0.00 C ATOM 1408 OH TYR A 115 8.985 -0.029 -0.529 1.00 0.00 O ATOM 0 H TYR A 115 8.199 -5.845 -1.352 1.00 0.00 H new ATOM 0 HA TYR A 115 9.008 -6.717 -3.926 1.00 0.00 H new ATOM 0 HB2 TYR A 115 10.039 -4.479 -4.580 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.288 -4.478 -4.657 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.966 -3.327 -2.873 1.00 0.00 H new ATOM 0 HD2 TYR A 115 11.216 -3.062 -3.033 1.00 0.00 H new ATOM 0 HE1 TYR A 115 6.907 -1.320 -1.331 1.00 0.00 H new ATOM 0 HE2 TYR A 115 11.142 -1.054 -1.493 1.00 0.00 H new ATOM 0 HH TYR A 115 9.898 0.288 -0.365 1.00 0.00 H new ATOM 1417 N SER A 116 10.855 -7.294 -2.396 1.00 0.00 N ATOM 1418 CA SER A 116 12.084 -7.608 -1.687 1.00 0.00 C ATOM 1419 C SER A 116 13.100 -8.227 -2.649 1.00 0.00 C ATOM 1420 O SER A 116 14.205 -8.585 -2.245 1.00 0.00 O ATOM 1421 CB SER A 116 11.817 -8.557 -0.516 1.00 0.00 C ATOM 1422 OG SER A 116 11.152 -9.746 -0.934 1.00 0.00 O ATOM 0 H SER A 116 10.390 -8.096 -2.821 1.00 0.00 H new ATOM 0 HA SER A 116 12.492 -6.681 -1.284 1.00 0.00 H new ATOM 0 HB2 SER A 116 12.761 -8.818 -0.039 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.211 -8.047 0.233 1.00 0.00 H new ATOM 0 HG SER A 116 11.001 -10.326 -0.159 1.00 0.00 H new ATOM 1427 N HIS A 117 12.690 -8.333 -3.905 1.00 0.00 N ATOM 1428 CA HIS A 117 13.550 -8.902 -4.928 1.00 0.00 C ATOM 1429 C HIS A 117 14.315 -7.782 -5.635 1.00 0.00 C ATOM 1430 O HIS A 117 14.884 -7.994 -6.706 1.00 0.00 O ATOM 1431 CB HIS A 117 12.744 -9.773 -5.894 1.00 0.00 C ATOM 1432 CG HIS A 117 12.023 -10.922 -5.231 1.00 0.00 C ATOM 1433 ND1 HIS A 117 12.687 -11.946 -4.578 1.00 0.00 N ATOM 1434 CD2 HIS A 117 10.691 -11.198 -5.125 1.00 0.00 C ATOM 1435 CE1 HIS A 117 11.786 -12.795 -4.106 1.00 0.00 C ATOM 1436 NE2 HIS A 117 10.550 -12.329 -4.446 1.00 0.00 N ATOM 0 H HIS A 117 11.773 -8.034 -4.237 1.00 0.00 H new ATOM 0 HA HIS A 117 14.285 -9.561 -4.466 1.00 0.00 H new ATOM 0 HB2 HIS A 117 12.014 -9.148 -6.408 1.00 0.00 H new ATOM 0 HB3 HIS A 117 13.415 -10.170 -6.655 1.00 0.00 H new ATOM 0 HD2 HIS A 117 9.888 -10.598 -5.526 1.00 0.00 H new ATOM 0 HE1 HIS A 117 11.994 -13.697 -3.550 1.00 0.00 H new ATOM 0 HE2 HIS A 117 9.663 -12.777 -4.216 1.00 0.00 H new ATOM 1443 N CYS A 118 14.304 -6.615 -5.010 1.00 0.00 N ATOM 1444 CA CYS A 118 14.991 -5.461 -5.566 1.00 0.00 C ATOM 1445 C CYS A 118 16.097 -5.046 -4.596 1.00 0.00 C ATOM 1446 O CYS A 118 17.236 -4.824 -5.005 1.00 0.00 O ATOM 1447 CB CYS A 118 14.022 -4.312 -5.854 1.00 0.00 C ATOM 1448 SG CYS A 118 14.668 -3.030 -6.989 1.00 0.00 S ATOM 0 H CYS A 118 13.830 -6.443 -4.123 1.00 0.00 H new ATOM 0 HA CYS A 118 15.434 -5.726 -6.526 1.00 0.00 H new ATOM 0 HB2 CYS A 118 13.107 -4.725 -6.278 1.00 0.00 H new ATOM 0 HB3 CYS A 118 13.751 -3.839 -4.910 1.00 0.00 H new ATOM 1452 N GLU A 119 15.724 -4.953 -3.328 1.00 0.00 N ATOM 1453 CA GLU A 119 16.671 -4.567 -2.295 1.00 0.00 C ATOM 1454 C GLU A 119 17.965 -5.371 -2.434 1.00 0.00 C ATOM 1455 O GLU A 119 19.053 -4.801 -2.477 1.00 0.00 O ATOM 1456 CB GLU A 119 16.064 -4.742 -0.901 1.00 0.00 C ATOM 1457 CG GLU A 119 16.248 -3.477 -0.060 1.00 0.00 C ATOM 1458 CD GLU A 119 16.663 -3.826 1.370 1.00 0.00 C ATOM 1459 OE1 GLU A 119 15.795 -4.351 2.102 1.00 0.00 O ATOM 1460 OE2 GLU A 119 17.839 -3.559 1.701 1.00 0.00 O ATOM 0 H GLU A 119 14.779 -5.138 -2.992 1.00 0.00 H new ATOM 0 HA GLU A 119 16.907 -3.511 -2.423 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.002 -4.973 -0.989 1.00 0.00 H new ATOM 0 HB3 GLU A 119 16.534 -5.588 -0.399 1.00 0.00 H new ATOM 0 HG2 GLU A 119 17.005 -2.839 -0.517 1.00 0.00 H new ATOM 0 HG3 GLU A 119 15.318 -2.908 -0.044 1.00 0.00 H new ATOM 1465 N PRO A 120 17.799 -6.719 -2.503 1.00 0.00 N ATOM 1466 CA PRO A 120 18.941 -7.609 -2.637 1.00 0.00 C ATOM 1467 C PRO A 120 19.501 -7.571 -4.060 1.00 0.00 C ATOM 1468 O PRO A 120 18.801 -7.899 -5.016 1.00 0.00 O ATOM 1469 CB PRO A 120 18.420 -8.980 -2.240 1.00 0.00 C ATOM 1470 CG PRO A 120 16.906 -8.898 -2.347 1.00 0.00 C ATOM 1471 CD PRO A 120 16.525 -7.431 -2.455 1.00 0.00 C ATOM 0 HA PRO A 120 19.778 -7.317 -2.003 1.00 0.00 H new ATOM 0 HB2 PRO A 120 18.817 -9.754 -2.897 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.727 -9.236 -1.226 1.00 0.00 H new ATOM 0 HG2 PRO A 120 16.555 -9.449 -3.220 1.00 0.00 H new ATOM 0 HG3 PRO A 120 16.437 -9.351 -1.474 1.00 0.00 H new ATOM 0 HD2 PRO A 120 15.931 -7.241 -3.349 1.00 0.00 H new ATOM 0 HD3 PRO A 120 15.926 -7.114 -1.601 1.00 0.00 H new ATOM 1476 N ILE A 121 20.759 -7.166 -4.155 1.00 0.00 N ATOM 1477 CA ILE A 121 21.422 -7.081 -5.445 1.00 0.00 C ATOM 1478 C ILE A 121 22.865 -7.571 -5.307 1.00 0.00 C ATOM 1479 O ILE A 121 23.438 -7.525 -4.219 1.00 0.00 O ATOM 1480 CB ILE A 121 21.305 -5.667 -6.016 1.00 0.00 C ATOM 1481 CG1 ILE A 121 19.869 -5.368 -6.451 1.00 0.00 C ATOM 1482 CG2 ILE A 121 22.306 -5.449 -7.153 1.00 0.00 C ATOM 1483 CD1 ILE A 121 19.536 -6.073 -7.766 1.00 0.00 C ATOM 0 H ILE A 121 21.336 -6.893 -3.360 1.00 0.00 H new ATOM 0 HA ILE A 121 20.932 -7.733 -6.168 1.00 0.00 H new ATOM 0 HB ILE A 121 21.556 -4.959 -5.227 1.00 0.00 H new ATOM 0 HG12 ILE A 121 19.175 -5.692 -5.675 1.00 0.00 H new ATOM 0 HG13 ILE A 121 19.737 -4.292 -6.568 1.00 0.00 H new ATOM 0 HG21 ILE A 121 22.201 -4.436 -7.541 1.00 0.00 H new ATOM 0 HG22 ILE A 121 23.319 -5.591 -6.778 1.00 0.00 H new ATOM 0 HG23 ILE A 121 22.111 -6.165 -7.952 1.00 0.00 H new ATOM 0 HD11 ILE A 121 18.510 -5.843 -8.052 1.00 0.00 H new ATOM 0 HD12 ILE A 121 20.216 -5.729 -8.546 1.00 0.00 H new ATOM 0 HD13 ILE A 121 19.645 -7.150 -7.639 1.00 0.00 H new ATOM 1494 N LEU A 122 23.412 -8.028 -6.423 1.00 0.00 N ATOM 1495 CA LEU A 122 24.777 -8.526 -6.439 1.00 0.00 C ATOM 1496 C LEU A 122 25.740 -7.354 -6.640 1.00 0.00 C ATOM 1497 O LEU A 122 26.573 -7.378 -7.544 1.00 0.00 O ATOM 1498 CB LEU A 122 24.931 -9.634 -7.483 1.00 0.00 C ATOM 1499 CG LEU A 122 24.599 -9.247 -8.925 1.00 0.00 C ATOM 1500 CD1 LEU A 122 25.832 -9.367 -9.823 1.00 0.00 C ATOM 1501 CD2 LEU A 122 23.422 -10.069 -9.456 1.00 0.00 C ATOM 0 H LEU A 122 22.935 -8.064 -7.324 1.00 0.00 H new ATOM 0 HA LEU A 122 25.027 -8.984 -5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.959 -9.995 -7.452 1.00 0.00 H new ATOM 0 HB3 LEU A 122 24.292 -10.469 -7.195 1.00 0.00 H new ATOM 0 HG LEU A 122 24.293 -8.201 -8.936 1.00 0.00 H new ATOM 0 HD11 LEU A 122 25.568 -9.086 -10.843 1.00 0.00 H new ATOM 0 HD12 LEU A 122 26.616 -8.705 -9.455 1.00 0.00 H new ATOM 0 HD13 LEU A 122 26.192 -10.396 -9.812 1.00 0.00 H new ATOM 0 HD21 LEU A 122 23.206 -9.774 -10.483 1.00 0.00 H new ATOM 0 HD22 LEU A 122 23.676 -11.129 -9.428 1.00 0.00 H new ATOM 0 HD23 LEU A 122 22.544 -9.890 -8.835 1.00 0.00 H new ATOM 1512 N ASP A 123 25.592 -6.355 -5.782 1.00 0.00 N ATOM 1513 CA ASP A 123 26.438 -5.176 -5.853 1.00 0.00 C ATOM 1514 C ASP A 123 26.041 -4.200 -4.744 1.00 0.00 C ATOM 1515 O ASP A 123 25.302 -3.246 -4.987 1.00 0.00 O ATOM 1516 CB ASP A 123 26.272 -4.460 -7.196 1.00 0.00 C ATOM 1517 CG ASP A 123 27.490 -3.654 -7.653 1.00 0.00 C ATOM 1518 OD1 ASP A 123 27.711 -2.575 -7.061 1.00 0.00 O ATOM 1519 OD2 ASP A 123 28.172 -4.134 -8.584 1.00 0.00 O ATOM 0 H ASP A 123 24.899 -6.338 -5.034 1.00 0.00 H new ATOM 0 HA ASP A 123 27.474 -5.497 -5.740 1.00 0.00 H new ATOM 0 HB2 ASP A 123 26.038 -5.202 -7.960 1.00 0.00 H new ATOM 0 HB3 ASP A 123 25.415 -3.790 -7.130 1.00 0.00 H new ATOM 1523 N ASP A 124 26.549 -4.472 -3.551 1.00 0.00 N ATOM 1524 CA ASP A 124 26.256 -3.630 -2.404 1.00 0.00 C ATOM 1525 C ASP A 124 26.920 -4.222 -1.159 1.00 0.00 C ATOM 1526 O ASP A 124 26.823 -5.424 -0.912 1.00 0.00 O ATOM 1527 CB ASP A 124 24.749 -3.554 -2.147 1.00 0.00 C ATOM 1528 CG ASP A 124 24.204 -2.143 -1.908 1.00 0.00 C ATOM 1529 OD1 ASP A 124 24.573 -1.562 -0.865 1.00 0.00 O ATOM 1530 OD2 ASP A 124 23.431 -1.680 -2.773 1.00 0.00 O ATOM 0 H ASP A 124 27.162 -5.263 -3.354 1.00 0.00 H new ATOM 0 HA ASP A 124 26.636 -2.630 -2.613 1.00 0.00 H new ATOM 0 HB2 ASP A 124 24.228 -3.989 -3.000 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.512 -4.171 -1.280 1.00 0.00 H new ATOM 1534 N LYS A 125 27.578 -3.352 -0.407 1.00 0.00 N ATOM 1535 CA LYS A 125 28.257 -3.775 0.806 1.00 0.00 C ATOM 1536 C LYS A 125 29.054 -2.599 1.375 1.00 0.00 C ATOM 1537 O LYS A 125 30.234 -2.439 1.068 1.00 0.00 O ATOM 1538 CB LYS A 125 29.104 -5.021 0.540 1.00 0.00 C ATOM 1539 CG LYS A 125 28.631 -6.198 1.396 1.00 0.00 C ATOM 1540 CD LYS A 125 28.934 -5.956 2.876 1.00 0.00 C ATOM 1541 CE LYS A 125 28.536 -7.167 3.722 1.00 0.00 C ATOM 1542 NZ LYS A 125 27.065 -7.224 3.884 1.00 0.00 N ATOM 0 H LYS A 125 27.655 -2.356 -0.614 1.00 0.00 H new ATOM 0 HA LYS A 125 27.532 -4.068 1.566 1.00 0.00 H new ATOM 0 HB2 LYS A 125 29.045 -5.287 -0.515 1.00 0.00 H new ATOM 0 HB3 LYS A 125 30.151 -4.807 0.756 1.00 0.00 H new ATOM 0 HG2 LYS A 125 27.559 -6.344 1.260 1.00 0.00 H new ATOM 0 HG3 LYS A 125 29.122 -7.113 1.065 1.00 0.00 H new ATOM 0 HD2 LYS A 125 29.997 -5.752 3.005 1.00 0.00 H new ATOM 0 HD3 LYS A 125 28.396 -5.074 3.222 1.00 0.00 H new ATOM 0 HE2 LYS A 125 28.892 -8.082 3.248 1.00 0.00 H new ATOM 0 HE3 LYS A 125 29.014 -7.108 4.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 26.811 -8.051 4.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 26.734 -6.358 4.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 26.616 -7.302 2.949 1.00 0.00 H new ATOM 1552 N GLN A 126 28.377 -1.807 2.193 1.00 0.00 N ATOM 1553 CA GLN A 126 29.008 -0.651 2.807 1.00 0.00 C ATOM 1554 C GLN A 126 28.476 -0.448 4.227 1.00 0.00 C ATOM 1555 O GLN A 126 27.580 -1.167 4.667 1.00 0.00 O ATOM 1556 CB GLN A 126 28.797 0.604 1.958 1.00 0.00 C ATOM 1557 CG GLN A 126 29.901 0.748 0.909 1.00 0.00 C ATOM 1558 CD GLN A 126 29.988 2.187 0.398 1.00 0.00 C ATOM 1559 OE1 GLN A 126 30.957 2.895 0.621 1.00 0.00 O ATOM 1560 NE2 GLN A 126 28.925 2.580 -0.298 1.00 0.00 N ATOM 0 H GLN A 126 27.398 -1.943 2.445 1.00 0.00 H new ATOM 0 HA GLN A 126 30.081 -0.835 2.865 1.00 0.00 H new ATOM 0 HB2 GLN A 126 27.826 0.555 1.465 1.00 0.00 H new ATOM 0 HB3 GLN A 126 28.784 1.484 2.601 1.00 0.00 H new ATOM 0 HG2 GLN A 126 30.858 0.453 1.340 1.00 0.00 H new ATOM 0 HG3 GLN A 126 29.706 0.074 0.075 1.00 0.00 H new ATOM 0 HE21 GLN A 126 28.147 1.937 -0.448 1.00 0.00 H new ATOM 0 HE22 GLN A 126 28.887 3.524 -0.682 1.00 0.00 H new ATOM 1567 N ARG A 127 29.052 0.534 4.906 1.00 0.00 N ATOM 1568 CA ARG A 127 28.646 0.841 6.267 1.00 0.00 C ATOM 1569 C ARG A 127 28.990 -0.324 7.198 1.00 0.00 C ATOM 1570 O ARG A 127 28.762 -1.483 6.858 1.00 0.00 O ATOM 1571 CB ARG A 127 27.144 1.120 6.345 1.00 0.00 C ATOM 1572 CG ARG A 127 26.874 2.608 6.579 1.00 0.00 C ATOM 1573 CD ARG A 127 25.454 2.982 6.151 1.00 0.00 C ATOM 1574 NE ARG A 127 25.308 2.822 4.687 1.00 0.00 N ATOM 1575 CZ ARG A 127 25.868 3.637 3.783 1.00 0.00 C ATOM 1576 NH1 ARG A 127 26.613 4.675 4.186 1.00 0.00 N ATOM 1577 NH2 ARG A 127 25.681 3.415 2.474 1.00 0.00 N ATOM 0 H ARG A 127 29.796 1.127 4.539 1.00 0.00 H new ATOM 0 HA ARG A 127 29.186 1.734 6.581 1.00 0.00 H new ATOM 0 HB2 ARG A 127 26.663 0.800 5.421 1.00 0.00 H new ATOM 0 HB3 ARG A 127 26.703 0.535 7.153 1.00 0.00 H new ATOM 0 HG2 ARG A 127 27.014 2.845 7.634 1.00 0.00 H new ATOM 0 HG3 ARG A 127 27.595 3.204 6.020 1.00 0.00 H new ATOM 0 HD2 ARG A 127 24.731 2.351 6.668 1.00 0.00 H new ATOM 0 HD3 ARG A 127 25.239 4.012 6.436 1.00 0.00 H new ATOM 0 HE ARG A 127 24.746 2.043 4.345 1.00 0.00 H new ATOM 0 HH11 ARG A 127 26.754 4.845 5.182 1.00 0.00 H new ATOM 0 HH12 ARG A 127 27.039 5.295 3.497 1.00 0.00 H new ATOM 0 HH21 ARG A 127 25.113 2.626 2.167 1.00 0.00 H new ATOM 0 HH22 ARG A 127 26.107 4.035 1.786 1.00 0.00 H new ATOM 1588 N LYS A 128 29.534 0.026 8.355 1.00 0.00 N ATOM 1589 CA LYS A 128 29.913 -0.975 9.337 1.00 0.00 C ATOM 1590 C LYS A 128 30.364 -0.278 10.621 1.00 0.00 C ATOM 1591 O LYS A 128 29.742 -0.438 11.671 1.00 0.00 O ATOM 1592 CB LYS A 128 30.956 -1.930 8.755 1.00 0.00 C ATOM 1593 CG LYS A 128 30.876 -3.304 9.422 1.00 0.00 C ATOM 1594 CD LYS A 128 31.862 -3.406 10.588 1.00 0.00 C ATOM 1595 CE LYS A 128 32.473 -4.806 10.669 1.00 0.00 C ATOM 1596 NZ LYS A 128 31.466 -5.784 11.140 1.00 0.00 N ATOM 0 H LYS A 128 29.721 0.989 8.634 1.00 0.00 H new ATOM 0 HA LYS A 128 29.057 -1.597 9.596 1.00 0.00 H new ATOM 0 HB2 LYS A 128 30.800 -2.034 7.681 1.00 0.00 H new ATOM 0 HB3 LYS A 128 31.953 -1.513 8.893 1.00 0.00 H new ATOM 0 HG2 LYS A 128 29.862 -3.479 9.782 1.00 0.00 H new ATOM 0 HG3 LYS A 128 31.092 -4.081 8.689 1.00 0.00 H new ATOM 0 HD2 LYS A 128 32.653 -2.667 10.465 1.00 0.00 H new ATOM 0 HD3 LYS A 128 31.351 -3.174 11.522 1.00 0.00 H new ATOM 0 HE2 LYS A 128 32.847 -5.103 9.689 1.00 0.00 H new ATOM 0 HE3 LYS A 128 33.326 -4.798 11.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 31.897 -6.729 11.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 31.129 -5.507 12.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 30.664 -5.803 10.478 1.00 0.00 H new ATOM 1606 N TYR A 129 31.443 0.480 10.497 1.00 0.00 N ATOM 1607 CA TYR A 129 31.986 1.203 11.635 1.00 0.00 C ATOM 1608 C TYR A 129 32.234 0.260 12.815 1.00 0.00 C ATOM 1609 O TYR A 129 31.843 -0.906 12.776 1.00 0.00 O ATOM 1610 CB TYR A 129 30.922 2.226 12.031 1.00 0.00 C ATOM 1611 CG TYR A 129 31.314 3.104 13.221 1.00 0.00 C ATOM 1612 CD1 TYR A 129 32.457 3.876 13.163 1.00 0.00 C ATOM 1613 CD2 TYR A 129 30.526 3.123 14.354 1.00 0.00 C ATOM 1614 CE1 TYR A 129 32.826 4.702 14.283 1.00 0.00 C ATOM 1615 CE2 TYR A 129 30.895 3.949 15.474 1.00 0.00 C ATOM 1616 CZ TYR A 129 32.027 4.698 15.384 1.00 0.00 C ATOM 1617 OH TYR A 129 32.376 5.478 16.441 1.00 0.00 O ATOM 0 H TYR A 129 31.957 0.610 9.625 1.00 0.00 H new ATOM 0 HA TYR A 129 32.937 1.668 11.376 1.00 0.00 H new ATOM 0 HB2 TYR A 129 30.712 2.866 11.174 1.00 0.00 H new ATOM 0 HB3 TYR A 129 29.998 1.700 12.270 1.00 0.00 H new ATOM 0 HD1 TYR A 129 33.075 3.860 12.277 1.00 0.00 H new ATOM 0 HD2 TYR A 129 29.632 2.518 14.400 1.00 0.00 H new ATOM 0 HE1 TYR A 129 33.717 5.311 14.250 1.00 0.00 H new ATOM 0 HE2 TYR A 129 30.287 3.973 16.366 1.00 0.00 H new ATOM 0 HH TYR A 129 31.713 5.376 17.156 1.00 0.00 H new ATOM 1626 N ASP A 130 32.882 0.800 13.836 1.00 0.00 N ATOM 1627 CA ASP A 130 33.187 0.022 15.025 1.00 0.00 C ATOM 1628 C ASP A 130 34.069 0.852 15.960 1.00 0.00 C ATOM 1629 O ASP A 130 34.611 1.880 15.558 1.00 0.00 O ATOM 1630 CB ASP A 130 33.947 -1.256 14.668 1.00 0.00 C ATOM 1631 CG ASP A 130 33.168 -2.554 14.883 1.00 0.00 C ATOM 1632 OD1 ASP A 130 32.961 -2.902 16.065 1.00 0.00 O ATOM 1633 OD2 ASP A 130 32.795 -3.169 13.860 1.00 0.00 O ATOM 0 H ASP A 130 33.205 1.767 13.865 1.00 0.00 H new ATOM 0 HA ASP A 130 32.245 -0.242 15.506 1.00 0.00 H new ATOM 0 HB2 ASP A 130 34.249 -1.201 13.622 1.00 0.00 H new ATOM 0 HB3 ASP A 130 34.860 -1.296 15.262 1.00 0.00 H new ATOM 1637 N LEU A 131 34.187 0.373 17.190 1.00 0.00 N ATOM 1638 CA LEU A 131 34.995 1.058 18.185 1.00 0.00 C ATOM 1639 C LEU A 131 35.959 0.059 18.828 1.00 0.00 C ATOM 1640 O LEU A 131 35.558 -1.043 19.201 1.00 0.00 O ATOM 1641 CB LEU A 131 34.102 1.786 19.192 1.00 0.00 C ATOM 1642 CG LEU A 131 34.827 2.580 20.280 1.00 0.00 C ATOM 1643 CD1 LEU A 131 35.608 3.750 19.677 1.00 0.00 C ATOM 1644 CD2 LEU A 131 33.851 3.040 21.365 1.00 0.00 C ATOM 0 H LEU A 131 33.737 -0.481 17.520 1.00 0.00 H new ATOM 0 HA LEU A 131 35.603 1.832 17.715 1.00 0.00 H new ATOM 0 HB2 LEU A 131 33.452 2.468 18.644 1.00 0.00 H new ATOM 0 HB3 LEU A 131 33.458 1.051 19.675 1.00 0.00 H new ATOM 0 HG LEU A 131 35.552 1.922 20.758 1.00 0.00 H new ATOM 0 HD11 LEU A 131 36.114 4.298 20.472 1.00 0.00 H new ATOM 0 HD12 LEU A 131 36.347 3.369 18.972 1.00 0.00 H new ATOM 0 HD13 LEU A 131 34.920 4.417 19.157 1.00 0.00 H new ATOM 0 HD21 LEU A 131 34.392 3.602 22.126 1.00 0.00 H new ATOM 0 HD22 LEU A 131 33.085 3.676 20.920 1.00 0.00 H new ATOM 0 HD23 LEU A 131 33.379 2.170 21.823 1.00 0.00 H new ATOM 1655 N HIS A 132 37.210 0.479 18.939 1.00 0.00 N ATOM 1656 CA HIS A 132 38.235 -0.365 19.531 1.00 0.00 C ATOM 1657 C HIS A 132 39.082 0.460 20.501 1.00 0.00 C ATOM 1658 O HIS A 132 39.332 1.641 20.263 1.00 0.00 O ATOM 1659 CB HIS A 132 39.070 -1.046 18.445 1.00 0.00 C ATOM 1660 CG HIS A 132 38.974 -2.554 18.452 1.00 0.00 C ATOM 1661 ND1 HIS A 132 37.803 -3.229 18.748 1.00 0.00 N ATOM 1662 CD2 HIS A 132 39.914 -3.508 18.196 1.00 0.00 C ATOM 1663 CE1 HIS A 132 38.040 -4.530 18.671 1.00 0.00 C ATOM 1664 NE2 HIS A 132 39.349 -4.701 18.329 1.00 0.00 N ATOM 0 H HIS A 132 37.538 1.394 18.629 1.00 0.00 H new ATOM 0 HA HIS A 132 37.767 -1.166 20.104 1.00 0.00 H new ATOM 0 HB2 HIS A 132 38.751 -0.676 17.470 1.00 0.00 H new ATOM 0 HB3 HIS A 132 40.114 -0.758 18.569 1.00 0.00 H new ATOM 0 HD1 HIS A 132 36.909 -2.798 18.985 1.00 0.00 H new ATOM 0 HD2 HIS A 132 40.944 -3.324 17.930 1.00 0.00 H new ATOM 0 HE1 HIS A 132 37.322 -5.317 18.848 1.00 0.00 H new ATOM 1672 N TYR A 133 39.501 -0.194 21.573 1.00 0.00 N ATOM 1673 CA TYR A 133 40.315 0.464 22.581 1.00 0.00 C ATOM 1674 C TYR A 133 41.779 0.539 22.140 1.00 0.00 C ATOM 1675 O TYR A 133 42.370 1.618 22.119 1.00 0.00 O ATOM 1676 CB TYR A 133 40.218 -0.406 23.836 1.00 0.00 C ATOM 1677 CG TYR A 133 40.619 0.315 25.125 1.00 0.00 C ATOM 1678 CD1 TYR A 133 41.938 0.668 25.336 1.00 0.00 C ATOM 1679 CD2 TYR A 133 39.664 0.611 26.076 1.00 0.00 C ATOM 1680 CE1 TYR A 133 42.315 1.346 26.549 1.00 0.00 C ATOM 1681 CE2 TYR A 133 40.043 1.290 27.289 1.00 0.00 C ATOM 1682 CZ TYR A 133 41.349 1.624 27.465 1.00 0.00 C ATOM 1683 OH TYR A 133 41.707 2.264 28.611 1.00 0.00 O ATOM 0 H TYR A 133 39.292 -1.174 21.766 1.00 0.00 H new ATOM 0 HA TYR A 133 39.966 1.483 22.750 1.00 0.00 H new ATOM 0 HB2 TYR A 133 39.195 -0.767 23.937 1.00 0.00 H new ATOM 0 HB3 TYR A 133 40.854 -1.282 23.709 1.00 0.00 H new ATOM 0 HD1 TYR A 133 42.685 0.436 24.592 1.00 0.00 H new ATOM 0 HD2 TYR A 133 38.633 0.334 25.911 1.00 0.00 H new ATOM 0 HE1 TYR A 133 43.342 1.628 26.727 1.00 0.00 H new ATOM 0 HE2 TYR A 133 39.306 1.528 28.042 1.00 0.00 H new ATOM 0 HH TYR A 133 40.915 2.398 29.172 1.00 0.00 H new TER 1692 TYR A 133