USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 768 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 52 SER OG : rot 80:sc= 1.28 USER MOD Set 1.2: A 83 SER OG : rot -42:sc= 1.05 USER MOD Set 2.1: A 82 SER OG : rot -175:sc= 2.36 USER MOD Set 2.2: A 104 THR OG1 : rot 69:sc= 1.21 USER MOD Set 3.1: A 55 SER OG : rot -73:sc= 0.803 USER MOD Set 3.2: A 85 LYS NZ :NH3+ 170:sc= 0.913 (180deg=0) USER MOD Set 4.1: A 1 MET N :NH3+ 169:sc= 1.12 (180deg=0) USER MOD Set 4.2: A 3 ASN : amide:sc= 0.948 K(o=2.1,f=-5.2) USER MOD Set 5.1: A 2 ASN : amide:sc= 0.405 K(o=0.8,f=-1.2) USER MOD Set 5.2: A 20 GLN : amide:sc= 0.391 K(o=0.8,f=-1.2) USER MOD Single : A 1 MET CE :methyl 171:sc= -0.0113 (180deg=-0.0916) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= 0.763 K(o=0.76,f=-4.9!) USER MOD Single : A 14 LYS NZ :NH3+ -129:sc= 1.23 (180deg=-0.209) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0.309 K(o=0.31,f=-5.4!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN :FLIP amide:sc= -0.163 F(o=-0.99,f=-0.16) USER MOD Single : A 37 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 73:sc= 1.2 USER MOD Single : A 42 THR OG1 : rot 21:sc= 1.13 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -144:sc= 1.02 (180deg=0.521) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl -149:sc= -1.35 (180deg=-1.7) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 49:sc= 0.845 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0.136 K(o=0.14,f=-2.7!) USER MOD Single : A 77 LYS NZ :NH3+ -111:sc= 0.613 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 75:sc= 0.92 USER MOD Single : A 96 HIS : no HE2:sc= 0.672 K(o=0.67,f=-3!) USER MOD Single : A 99 LYS NZ :NH3+ -129:sc= 0.64 (180deg=-1.74!) USER MOD Single : A 102 LYS NZ :NH3+ 163:sc= 1.2 (180deg=1.15) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.043 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.342 -17.112 6.242 1.00 0.00 N ATOM 2 CA MET A 1 7.420 -17.114 7.395 1.00 0.00 C ATOM 3 C MET A 1 6.607 -15.833 7.354 1.00 0.00 C ATOM 4 O MET A 1 7.183 -14.785 7.096 1.00 0.00 O ATOM 5 CB MET A 1 8.181 -17.215 8.722 1.00 0.00 C ATOM 6 CG MET A 1 8.322 -18.672 9.169 1.00 0.00 C ATOM 7 SD MET A 1 9.463 -18.980 10.553 1.00 0.00 S ATOM 8 CE MET A 1 9.220 -17.530 11.622 1.00 0.00 C ATOM 0 H1 MET A 1 9.034 -17.881 6.349 1.00 0.00 H new ATOM 0 H2 MET A 1 7.801 -17.252 5.365 1.00 0.00 H new ATOM 0 H3 MET A 1 8.842 -16.201 6.199 1.00 0.00 H new ATOM 0 HA MET A 1 6.767 -17.984 7.331 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.169 -16.768 8.613 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.657 -16.645 9.489 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.336 -19.042 9.449 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.653 -19.262 8.314 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.740 -17.684 12.567 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.618 -16.643 11.129 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.156 -17.392 11.812 1.00 0.00 H new ATOM 16 N ASN A 2 5.292 -15.892 7.599 1.00 0.00 N ATOM 17 CA ASN A 2 4.297 -14.811 7.427 1.00 0.00 C ATOM 18 C ASN A 2 4.090 -14.435 5.955 1.00 0.00 C ATOM 19 O ASN A 2 2.954 -14.225 5.527 1.00 0.00 O ATOM 20 CB ASN A 2 4.634 -13.582 8.291 1.00 0.00 C ATOM 21 CG ASN A 2 3.422 -12.724 8.659 1.00 0.00 C ATOM 22 OD1 ASN A 2 2.270 -13.072 8.421 1.00 0.00 O ATOM 23 ND2 ASN A 2 3.650 -11.548 9.220 1.00 0.00 N ATOM 0 H ASN A 2 4.861 -16.749 7.945 1.00 0.00 H new ATOM 0 HA ASN A 2 3.345 -15.205 7.783 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.119 -13.918 9.207 1.00 0.00 H new ATOM 0 HB3 ASN A 2 5.355 -12.963 7.757 1.00 0.00 H new ATOM 0 HD21 ASN A 2 2.869 -10.934 9.453 1.00 0.00 H new ATOM 0 HD22 ASN A 2 4.606 -11.255 9.420 1.00 0.00 H new ATOM 29 N ASN A 3 5.160 -14.486 5.157 1.00 0.00 N ATOM 30 CA ASN A 3 5.198 -14.629 3.704 1.00 0.00 C ATOM 31 C ASN A 3 4.425 -13.536 2.981 1.00 0.00 C ATOM 32 O ASN A 3 3.829 -13.797 1.934 1.00 0.00 O ATOM 33 CB ASN A 3 4.808 -16.063 3.299 1.00 0.00 C ATOM 34 CG ASN A 3 5.989 -16.982 3.515 1.00 0.00 C ATOM 35 OD1 ASN A 3 6.173 -17.515 4.607 1.00 0.00 O ATOM 36 ND2 ASN A 3 6.848 -17.120 2.522 1.00 0.00 N ATOM 0 H ASN A 3 6.100 -14.423 5.547 1.00 0.00 H new ATOM 0 HA ASN A 3 6.224 -14.479 3.369 1.00 0.00 H new ATOM 0 HB2 ASN A 3 3.957 -16.401 3.890 1.00 0.00 H new ATOM 0 HB3 ASN A 3 4.500 -16.087 2.254 1.00 0.00 H new ATOM 0 HD21 ASN A 3 7.690 -17.681 2.651 1.00 0.00 H new ATOM 0 HD22 ASN A 3 6.669 -16.666 1.626 1.00 0.00 H new ATOM 42 N LEU A 4 4.461 -12.330 3.541 1.00 0.00 N ATOM 43 CA LEU A 4 3.868 -11.097 3.072 1.00 0.00 C ATOM 44 C LEU A 4 2.367 -11.232 2.799 1.00 0.00 C ATOM 45 O LEU A 4 1.932 -11.725 1.752 1.00 0.00 O ATOM 46 CB LEU A 4 4.727 -10.453 1.984 1.00 0.00 C ATOM 47 CG LEU A 4 3.941 -9.448 1.118 1.00 0.00 C ATOM 48 CD1 LEU A 4 4.509 -8.037 1.162 1.00 0.00 C ATOM 49 CD2 LEU A 4 3.900 -10.036 -0.278 1.00 0.00 C ATOM 0 H LEU A 4 4.957 -12.186 4.421 1.00 0.00 H new ATOM 0 HA LEU A 4 3.879 -10.360 3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.571 -9.943 2.448 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.139 -11.233 1.344 1.00 0.00 H new ATOM 0 HG LEU A 4 2.932 -9.315 1.508 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.908 -7.383 0.531 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.490 -7.669 2.188 1.00 0.00 H new ATOM 0 HD13 LEU A 4 5.537 -8.047 0.799 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.353 -9.364 -0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 4 4.917 -10.163 -0.649 1.00 0.00 H new ATOM 0 HD23 LEU A 4 3.401 -11.004 -0.250 1.00 0.00 H new ATOM 60 N LYS A 5 1.563 -10.697 3.709 1.00 0.00 N ATOM 61 CA LYS A 5 0.120 -10.573 3.558 1.00 0.00 C ATOM 62 C LYS A 5 -0.348 -9.289 4.181 1.00 0.00 C ATOM 63 O LYS A 5 0.262 -8.767 5.104 1.00 0.00 O ATOM 64 CB LYS A 5 -0.629 -11.789 4.133 1.00 0.00 C ATOM 65 CG LYS A 5 -0.513 -12.982 3.175 1.00 0.00 C ATOM 66 CD LYS A 5 -1.631 -14.018 3.337 1.00 0.00 C ATOM 67 CE LYS A 5 -1.700 -14.836 2.041 1.00 0.00 C ATOM 68 NZ LYS A 5 -2.717 -15.898 2.105 1.00 0.00 N ATOM 0 H LYS A 5 1.906 -10.328 4.596 1.00 0.00 H new ATOM 0 HA LYS A 5 -0.110 -10.549 2.493 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -0.216 -12.053 5.107 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -1.678 -11.539 4.289 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -0.518 -12.614 2.149 1.00 0.00 H new ATOM 0 HG3 LYS A 5 0.448 -13.471 3.334 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -1.430 -14.667 4.189 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -2.584 -13.525 3.530 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -1.923 -14.172 1.206 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -0.725 -15.281 1.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.727 -16.424 1.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -2.491 -16.548 2.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.652 -15.474 2.268 1.00 0.00 H new ATOM 78 N LEU A 6 -1.432 -8.759 3.638 1.00 0.00 N ATOM 79 CA LEU A 6 -2.191 -7.738 4.295 1.00 0.00 C ATOM 80 C LEU A 6 -3.149 -8.377 5.277 1.00 0.00 C ATOM 81 O LEU A 6 -3.377 -9.587 5.224 1.00 0.00 O ATOM 82 CB LEU A 6 -2.906 -6.838 3.302 1.00 0.00 C ATOM 83 CG LEU A 6 -3.382 -7.440 1.975 1.00 0.00 C ATOM 84 CD1 LEU A 6 -4.526 -8.438 2.212 1.00 0.00 C ATOM 85 CD2 LEU A 6 -3.724 -6.339 0.982 1.00 0.00 C ATOM 0 H LEU A 6 -1.801 -9.033 2.727 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.508 -7.092 4.847 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -3.776 -6.416 3.805 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.239 -6.008 3.068 1.00 0.00 H new ATOM 0 HG LEU A 6 -2.572 -8.014 1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -4.849 -8.854 1.258 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -4.178 -9.243 2.860 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -5.363 -7.926 2.687 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.060 -6.785 0.046 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -4.517 -5.713 1.391 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -2.840 -5.729 0.797 1.00 0.00 H new ATOM 96 N ASP A 7 -3.733 -7.544 6.133 1.00 0.00 N ATOM 97 CA ASP A 7 -4.490 -7.975 7.292 1.00 0.00 C ATOM 98 C ASP A 7 -5.957 -7.590 7.178 1.00 0.00 C ATOM 99 O ASP A 7 -6.845 -8.412 7.396 1.00 0.00 O ATOM 100 CB ASP A 7 -3.902 -7.350 8.567 1.00 0.00 C ATOM 101 CG ASP A 7 -3.739 -8.351 9.710 1.00 0.00 C ATOM 102 OD1 ASP A 7 -4.288 -9.476 9.662 1.00 0.00 O ATOM 103 OD2 ASP A 7 -3.057 -7.980 10.691 1.00 0.00 O ATOM 0 H ASP A 7 -3.689 -6.530 6.034 1.00 0.00 H new ATOM 0 HA ASP A 7 -4.422 -9.062 7.343 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -2.931 -6.913 8.335 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -4.548 -6.536 8.896 1.00 0.00 H new ATOM 107 N ILE A 8 -6.150 -6.331 6.773 1.00 0.00 N ATOM 108 CA ILE A 8 -7.364 -5.608 6.434 1.00 0.00 C ATOM 109 C ILE A 8 -8.333 -5.423 7.602 1.00 0.00 C ATOM 110 O ILE A 8 -8.728 -6.352 8.305 1.00 0.00 O ATOM 111 CB ILE A 8 -8.010 -6.161 5.154 1.00 0.00 C ATOM 112 CG1 ILE A 8 -7.029 -5.968 3.988 1.00 0.00 C ATOM 113 CG2 ILE A 8 -9.313 -5.401 4.847 1.00 0.00 C ATOM 114 CD1 ILE A 8 -7.451 -6.642 2.678 1.00 0.00 C ATOM 0 H ILE A 8 -5.342 -5.719 6.663 1.00 0.00 H new ATOM 0 HA ILE A 8 -7.061 -4.586 6.206 1.00 0.00 H new ATOM 0 HB ILE A 8 -8.239 -7.218 5.290 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -6.905 -4.900 3.808 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.054 -6.356 4.283 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -9.762 -5.801 3.938 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.008 -5.520 5.678 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.093 -4.343 4.707 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.699 -6.452 1.912 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.545 -7.716 2.836 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -8.410 -6.238 2.353 1.00 0.00 H new ATOM 125 N VAL A 9 -8.726 -4.163 7.761 1.00 0.00 N ATOM 126 CA VAL A 9 -9.666 -3.639 8.724 1.00 0.00 C ATOM 127 C VAL A 9 -10.542 -2.656 7.953 1.00 0.00 C ATOM 128 O VAL A 9 -10.176 -1.505 7.745 1.00 0.00 O ATOM 129 CB VAL A 9 -8.890 -3.082 9.935 1.00 0.00 C ATOM 130 CG1 VAL A 9 -9.805 -2.396 10.956 1.00 0.00 C ATOM 131 CG2 VAL A 9 -8.113 -4.228 10.595 1.00 0.00 C ATOM 0 H VAL A 9 -8.357 -3.424 7.162 1.00 0.00 H new ATOM 0 HA VAL A 9 -10.333 -4.378 9.169 1.00 0.00 H new ATOM 0 HB VAL A 9 -8.203 -2.317 9.575 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -9.207 -2.023 11.787 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -10.323 -1.564 10.479 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -10.537 -3.113 11.329 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -7.560 -3.846 11.453 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -8.811 -4.997 10.926 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -7.415 -4.656 9.875 1.00 0.00 H new ATOM 141 N GLU A 10 -11.663 -3.132 7.420 1.00 0.00 N ATOM 142 CA GLU A 10 -12.639 -2.278 6.769 1.00 0.00 C ATOM 143 C GLU A 10 -13.285 -1.426 7.855 1.00 0.00 C ATOM 144 O GLU A 10 -14.146 -1.897 8.601 1.00 0.00 O ATOM 145 CB GLU A 10 -13.664 -3.082 5.952 1.00 0.00 C ATOM 146 CG GLU A 10 -13.192 -3.293 4.496 1.00 0.00 C ATOM 147 CD GLU A 10 -14.323 -3.348 3.456 1.00 0.00 C ATOM 148 OE1 GLU A 10 -15.472 -2.958 3.759 1.00 0.00 O ATOM 149 OE2 GLU A 10 -14.013 -3.647 2.277 1.00 0.00 O ATOM 0 H GLU A 10 -11.916 -4.120 7.429 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.152 -1.635 6.036 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.829 -4.050 6.425 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.621 -2.560 5.953 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.510 -2.486 4.229 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.623 -4.221 4.444 1.00 0.00 H new ATOM 154 N GLN A 11 -12.858 -0.166 7.939 1.00 0.00 N ATOM 155 CA GLN A 11 -13.280 0.772 8.957 1.00 0.00 C ATOM 156 C GLN A 11 -14.668 1.302 8.560 1.00 0.00 C ATOM 157 O GLN A 11 -15.381 0.660 7.779 1.00 0.00 O ATOM 158 CB GLN A 11 -12.240 1.895 9.117 1.00 0.00 C ATOM 159 CG GLN A 11 -12.190 2.450 10.550 1.00 0.00 C ATOM 160 CD GLN A 11 -12.397 3.959 10.588 1.00 0.00 C ATOM 161 OE1 GLN A 11 -13.521 4.427 10.443 1.00 0.00 O ATOM 162 NE2 GLN A 11 -11.360 4.759 10.733 1.00 0.00 N ATOM 0 H GLN A 11 -12.191 0.233 7.279 1.00 0.00 H new ATOM 0 HA GLN A 11 -13.354 0.288 9.931 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -11.255 1.516 8.843 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -12.474 2.704 8.425 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -12.957 1.964 11.153 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -11.228 2.205 11.000 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -10.426 4.367 10.853 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -11.491 5.771 10.725 1.00 0.00 H new ATOM 169 N ASP A 12 -15.098 2.447 9.097 1.00 0.00 N ATOM 170 CA ASP A 12 -16.463 2.896 8.857 1.00 0.00 C ATOM 171 C ASP A 12 -16.633 3.248 7.388 1.00 0.00 C ATOM 172 O ASP A 12 -17.570 2.766 6.755 1.00 0.00 O ATOM 173 CB ASP A 12 -16.839 4.104 9.705 1.00 0.00 C ATOM 174 CG ASP A 12 -18.358 4.303 9.739 1.00 0.00 C ATOM 175 OD1 ASP A 12 -19.123 3.322 9.910 1.00 0.00 O ATOM 176 OD2 ASP A 12 -18.821 5.458 9.641 1.00 0.00 O ATOM 0 H ASP A 12 -14.535 3.062 9.685 1.00 0.00 H new ATOM 0 HA ASP A 12 -17.125 2.076 9.137 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -16.464 3.971 10.720 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -16.361 4.997 9.303 1.00 0.00 H new ATOM 180 N ASP A 13 -15.710 4.045 6.832 1.00 0.00 N ATOM 181 CA ASP A 13 -15.705 4.395 5.411 1.00 0.00 C ATOM 182 C ASP A 13 -14.291 4.504 4.801 1.00 0.00 C ATOM 183 O ASP A 13 -14.122 4.935 3.656 1.00 0.00 O ATOM 184 CB ASP A 13 -16.561 5.639 5.134 1.00 0.00 C ATOM 185 CG ASP A 13 -17.223 5.621 3.748 1.00 0.00 C ATOM 186 OD1 ASP A 13 -16.950 4.730 2.909 1.00 0.00 O ATOM 187 OD2 ASP A 13 -18.111 6.473 3.521 1.00 0.00 O ATOM 0 H ASP A 13 -14.945 4.465 7.360 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.169 3.555 4.894 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -17.334 5.717 5.898 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -15.937 6.528 5.220 1.00 0.00 H new ATOM 191 N LYS A 14 -13.240 4.108 5.532 1.00 0.00 N ATOM 192 CA LYS A 14 -11.912 3.869 4.973 1.00 0.00 C ATOM 193 C LYS A 14 -11.596 2.382 5.113 1.00 0.00 C ATOM 194 O LYS A 14 -12.093 1.746 6.038 1.00 0.00 O ATOM 195 CB LYS A 14 -10.889 4.794 5.653 1.00 0.00 C ATOM 196 CG LYS A 14 -10.628 4.480 7.135 1.00 0.00 C ATOM 197 CD LYS A 14 -9.420 5.233 7.701 1.00 0.00 C ATOM 198 CE LYS A 14 -9.670 6.733 7.894 1.00 0.00 C ATOM 199 NZ LYS A 14 -8.431 7.460 8.270 1.00 0.00 N ATOM 0 H LYS A 14 -13.293 3.944 6.537 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.869 4.111 3.911 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.946 4.732 5.110 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -11.238 5.823 5.569 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.514 4.735 7.717 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -10.468 3.408 7.251 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.144 4.793 8.659 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.571 5.097 7.031 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.072 7.155 6.973 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -10.424 6.878 8.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -8.611 8.039 9.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -7.675 6.775 8.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.138 8.076 7.485 1.00 0.00 H new ATOM 209 N ALA A 15 -10.807 1.805 4.212 1.00 0.00 N ATOM 210 CA ALA A 15 -10.344 0.420 4.331 1.00 0.00 C ATOM 211 C ALA A 15 -8.893 0.428 4.807 1.00 0.00 C ATOM 212 O ALA A 15 -8.004 0.792 4.038 1.00 0.00 O ATOM 213 CB ALA A 15 -10.512 -0.346 3.013 1.00 0.00 C ATOM 0 H ALA A 15 -10.468 2.282 3.377 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.956 -0.106 5.064 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.158 -1.369 3.139 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -11.565 -0.358 2.731 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -9.933 0.144 2.231 1.00 0.00 H new ATOM 219 N ILE A 16 -8.646 0.052 6.066 1.00 0.00 N ATOM 220 CA ILE A 16 -7.310 0.030 6.660 1.00 0.00 C ATOM 221 C ILE A 16 -6.644 -1.288 6.235 1.00 0.00 C ATOM 222 O ILE A 16 -6.825 -2.333 6.859 1.00 0.00 O ATOM 223 CB ILE A 16 -7.431 0.211 8.194 1.00 0.00 C ATOM 224 CG1 ILE A 16 -8.088 1.561 8.556 1.00 0.00 C ATOM 225 CG2 ILE A 16 -6.088 0.065 8.922 1.00 0.00 C ATOM 226 CD1 ILE A 16 -8.613 1.574 9.993 1.00 0.00 C ATOM 0 H ILE A 16 -9.380 -0.249 6.708 1.00 0.00 H new ATOM 0 HA ILE A 16 -6.680 0.849 6.313 1.00 0.00 H new ATOM 0 HB ILE A 16 -8.076 -0.598 8.538 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -7.362 2.364 8.428 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -8.909 1.761 7.868 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -6.238 0.202 9.993 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -5.680 -0.929 8.737 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.391 0.818 8.554 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -9.067 2.542 10.206 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -9.359 0.789 10.115 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -7.788 1.401 10.684 1.00 0.00 H new ATOM 237 N VAL A 17 -5.907 -1.290 5.130 1.00 0.00 N ATOM 238 CA VAL A 17 -5.109 -2.413 4.670 1.00 0.00 C ATOM 239 C VAL A 17 -3.764 -2.345 5.384 1.00 0.00 C ATOM 240 O VAL A 17 -2.773 -1.805 4.891 1.00 0.00 O ATOM 241 CB VAL A 17 -4.961 -2.394 3.137 1.00 0.00 C ATOM 242 CG1 VAL A 17 -4.232 -3.676 2.707 1.00 0.00 C ATOM 243 CG2 VAL A 17 -6.307 -2.276 2.403 1.00 0.00 C ATOM 0 H VAL A 17 -5.849 -0.481 4.511 1.00 0.00 H new ATOM 0 HA VAL A 17 -5.597 -3.358 4.909 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.389 -1.508 2.863 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.117 -3.683 1.623 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -3.249 -3.711 3.177 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.812 -4.546 3.016 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.135 -2.268 1.327 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.939 -3.125 2.663 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.803 -1.351 2.698 1.00 0.00 H new ATOM 253 N ARG A 18 -3.706 -2.924 6.575 1.00 0.00 N ATOM 254 CA ARG A 18 -2.404 -3.139 7.198 1.00 0.00 C ATOM 255 C ARG A 18 -1.663 -4.144 6.342 1.00 0.00 C ATOM 256 O ARG A 18 -2.238 -5.179 6.012 1.00 0.00 O ATOM 257 CB ARG A 18 -2.455 -3.566 8.670 1.00 0.00 C ATOM 258 CG ARG A 18 -3.436 -2.711 9.475 1.00 0.00 C ATOM 259 CD ARG A 18 -3.183 -2.794 10.981 1.00 0.00 C ATOM 260 NE ARG A 18 -2.254 -1.753 11.458 1.00 0.00 N ATOM 261 CZ ARG A 18 -2.276 -1.205 12.678 1.00 0.00 C ATOM 262 NH1 ARG A 18 -2.915 -1.804 13.671 1.00 0.00 N ATOM 263 NH2 ARG A 18 -1.636 -0.064 12.903 1.00 0.00 N ATOM 0 H ARG A 18 -4.511 -3.243 7.114 1.00 0.00 H new ATOM 0 HA ARG A 18 -1.880 -2.184 7.237 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -2.748 -4.614 8.735 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -1.460 -3.486 9.107 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -3.358 -1.673 9.153 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -4.455 -3.035 9.262 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -4.131 -2.700 11.511 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -2.778 -3.776 11.224 1.00 0.00 H new ATOM 0 HE ARG A 18 -1.540 -1.426 10.808 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -3.395 -2.689 13.508 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -2.927 -1.380 14.599 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.128 0.394 12.146 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -1.652 0.355 13.833 1.00 0.00 H new ATOM 274 N VAL A 19 -0.445 -3.828 5.929 1.00 0.00 N ATOM 275 CA VAL A 19 0.417 -4.699 5.149 1.00 0.00 C ATOM 276 C VAL A 19 1.394 -5.333 6.122 1.00 0.00 C ATOM 277 O VAL A 19 1.838 -4.677 7.068 1.00 0.00 O ATOM 278 CB VAL A 19 1.126 -3.831 4.096 1.00 0.00 C ATOM 279 CG1 VAL A 19 2.398 -4.449 3.487 1.00 0.00 C ATOM 280 CG2 VAL A 19 0.156 -3.541 2.951 1.00 0.00 C ATOM 0 H VAL A 19 -0.016 -2.926 6.136 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.124 -5.488 4.627 1.00 0.00 H new ATOM 0 HB VAL A 19 1.438 -2.933 4.628 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.823 -3.761 2.757 1.00 0.00 H new ATOM 0 HG12 VAL A 19 3.126 -4.635 4.277 1.00 0.00 H new ATOM 0 HG13 VAL A 19 2.147 -5.389 2.996 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.652 -2.926 2.201 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.163 -4.480 2.498 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.714 -3.011 3.337 1.00 0.00 H new ATOM 290 N GLN A 20 1.775 -6.577 5.878 1.00 0.00 N ATOM 291 CA GLN A 20 2.839 -7.239 6.606 1.00 0.00 C ATOM 292 C GLN A 20 3.824 -7.846 5.623 1.00 0.00 C ATOM 293 O GLN A 20 3.431 -8.233 4.520 1.00 0.00 O ATOM 294 CB GLN A 20 2.288 -8.288 7.579 1.00 0.00 C ATOM 295 CG GLN A 20 1.260 -7.696 8.554 1.00 0.00 C ATOM 296 CD GLN A 20 1.320 -8.369 9.918 1.00 0.00 C ATOM 297 OE1 GLN A 20 1.438 -9.590 10.034 1.00 0.00 O ATOM 298 NE2 GLN A 20 1.252 -7.570 10.974 1.00 0.00 N ATOM 0 H GLN A 20 1.347 -7.160 5.159 1.00 0.00 H new ATOM 0 HA GLN A 20 3.363 -6.500 7.213 1.00 0.00 H new ATOM 0 HB2 GLN A 20 1.825 -9.097 7.014 1.00 0.00 H new ATOM 0 HB3 GLN A 20 3.112 -8.724 8.144 1.00 0.00 H new ATOM 0 HG2 GLN A 20 1.441 -6.627 8.668 1.00 0.00 H new ATOM 0 HG3 GLN A 20 0.259 -7.807 8.138 1.00 0.00 H new ATOM 0 HE21 GLN A 20 1.154 -6.563 10.846 1.00 0.00 H new ATOM 0 HE22 GLN A 20 1.297 -7.963 11.914 1.00 0.00 H new ATOM 305 N GLY A 21 5.084 -7.928 6.051 1.00 0.00 N ATOM 306 CA GLY A 21 6.186 -8.444 5.271 1.00 0.00 C ATOM 307 C GLY A 21 6.911 -7.276 4.623 1.00 0.00 C ATOM 308 O GLY A 21 6.410 -6.154 4.587 1.00 0.00 O ATOM 0 H GLY A 21 5.365 -7.624 6.983 1.00 0.00 H new ATOM 0 HA2 GLY A 21 6.869 -9.007 5.907 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.820 -9.132 4.509 1.00 0.00 H new ATOM 312 N ASP A 22 8.111 -7.547 4.140 1.00 0.00 N ATOM 313 CA ASP A 22 8.903 -6.632 3.340 1.00 0.00 C ATOM 314 C ASP A 22 8.337 -6.633 1.932 1.00 0.00 C ATOM 315 O ASP A 22 7.874 -7.664 1.441 1.00 0.00 O ATOM 316 CB ASP A 22 10.364 -7.080 3.336 1.00 0.00 C ATOM 317 CG ASP A 22 10.954 -6.962 4.735 1.00 0.00 C ATOM 318 OD1 ASP A 22 10.858 -5.869 5.327 1.00 0.00 O ATOM 319 OD2 ASP A 22 11.459 -7.981 5.257 1.00 0.00 O ATOM 0 H ASP A 22 8.576 -8.441 4.300 1.00 0.00 H new ATOM 0 HA ASP A 22 8.863 -5.624 3.753 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.435 -8.111 2.989 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.937 -6.469 2.639 1.00 0.00 H new ATOM 323 N ILE A 23 8.378 -5.482 1.273 1.00 0.00 N ATOM 324 CA ILE A 23 7.741 -5.254 -0.014 1.00 0.00 C ATOM 325 C ILE A 23 8.756 -5.567 -1.124 1.00 0.00 C ATOM 326 O ILE A 23 9.367 -4.688 -1.740 1.00 0.00 O ATOM 327 CB ILE A 23 7.081 -3.854 -0.021 1.00 0.00 C ATOM 328 CG1 ILE A 23 6.413 -3.530 -1.366 1.00 0.00 C ATOM 329 CG2 ILE A 23 8.045 -2.710 0.252 1.00 0.00 C ATOM 330 CD1 ILE A 23 4.929 -3.868 -1.341 1.00 0.00 C ATOM 0 H ILE A 23 8.868 -4.662 1.629 1.00 0.00 H new ATOM 0 HA ILE A 23 6.907 -5.928 -0.210 1.00 0.00 H new ATOM 0 HB ILE A 23 6.351 -3.922 0.786 1.00 0.00 H new ATOM 0 HG12 ILE A 23 6.544 -2.472 -1.594 1.00 0.00 H new ATOM 0 HG13 ILE A 23 6.903 -4.091 -2.162 1.00 0.00 H new ATOM 0 HG21 ILE A 23 7.503 -1.764 0.229 1.00 0.00 H new ATOM 0 HG22 ILE A 23 8.500 -2.844 1.233 1.00 0.00 H new ATOM 0 HG23 ILE A 23 8.824 -2.700 -0.511 1.00 0.00 H new ATOM 0 HD11 ILE A 23 4.485 -3.627 -2.307 1.00 0.00 H new ATOM 0 HD12 ILE A 23 4.801 -4.931 -1.138 1.00 0.00 H new ATOM 0 HD13 ILE A 23 4.437 -3.288 -0.561 1.00 0.00 H new ATOM 341 N ASP A 24 8.958 -6.853 -1.387 1.00 0.00 N ATOM 342 CA ASP A 24 9.950 -7.368 -2.323 1.00 0.00 C ATOM 343 C ASP A 24 9.327 -7.957 -3.589 1.00 0.00 C ATOM 344 O ASP A 24 8.114 -7.955 -3.763 1.00 0.00 O ATOM 345 CB ASP A 24 10.883 -8.382 -1.670 1.00 0.00 C ATOM 346 CG ASP A 24 10.285 -9.404 -0.729 1.00 0.00 C ATOM 347 OD1 ASP A 24 9.073 -9.674 -0.834 1.00 0.00 O ATOM 348 OD2 ASP A 24 11.084 -9.999 0.031 1.00 0.00 O ATOM 0 H ASP A 24 8.416 -7.592 -0.938 1.00 0.00 H new ATOM 0 HA ASP A 24 10.541 -6.503 -2.624 1.00 0.00 H new ATOM 0 HB2 ASP A 24 11.396 -8.923 -2.466 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.643 -7.828 -1.120 1.00 0.00 H new ATOM 352 N ALA A 25 10.161 -8.503 -4.477 1.00 0.00 N ATOM 353 CA ALA A 25 9.809 -9.341 -5.610 1.00 0.00 C ATOM 354 C ALA A 25 8.817 -10.476 -5.291 1.00 0.00 C ATOM 355 O ALA A 25 8.363 -11.134 -6.219 1.00 0.00 O ATOM 356 CB ALA A 25 11.106 -9.937 -6.158 1.00 0.00 C ATOM 0 H ALA A 25 11.168 -8.357 -4.413 1.00 0.00 H new ATOM 0 HA ALA A 25 9.295 -8.709 -6.334 1.00 0.00 H new ATOM 0 HB1 ALA A 25 10.881 -10.575 -7.013 1.00 0.00 H new ATOM 0 HB2 ALA A 25 11.772 -9.133 -6.471 1.00 0.00 H new ATOM 0 HB3 ALA A 25 11.591 -10.529 -5.382 1.00 0.00 H new ATOM 362 N TYR A 26 8.493 -10.763 -4.028 1.00 0.00 N ATOM 363 CA TYR A 26 7.476 -11.732 -3.650 1.00 0.00 C ATOM 364 C TYR A 26 6.111 -11.044 -3.637 1.00 0.00 C ATOM 365 O TYR A 26 5.116 -11.655 -4.025 1.00 0.00 O ATOM 366 CB TYR A 26 7.800 -12.341 -2.274 1.00 0.00 C ATOM 367 CG TYR A 26 9.141 -13.061 -2.178 1.00 0.00 C ATOM 368 CD1 TYR A 26 10.351 -12.357 -2.337 1.00 0.00 C ATOM 369 CD2 TYR A 26 9.191 -14.445 -1.924 1.00 0.00 C ATOM 370 CE1 TYR A 26 11.585 -13.015 -2.312 1.00 0.00 C ATOM 371 CE2 TYR A 26 10.426 -15.118 -1.895 1.00 0.00 C ATOM 372 CZ TYR A 26 11.627 -14.408 -2.113 1.00 0.00 C ATOM 373 OH TYR A 26 12.818 -15.059 -2.112 1.00 0.00 O ATOM 0 H TYR A 26 8.942 -10.317 -3.228 1.00 0.00 H new ATOM 0 HA TYR A 26 7.457 -12.545 -4.375 1.00 0.00 H new ATOM 0 HB2 TYR A 26 7.780 -11.545 -1.529 1.00 0.00 H new ATOM 0 HB3 TYR A 26 7.009 -13.044 -2.011 1.00 0.00 H new ATOM 0 HD1 TYR A 26 10.325 -11.287 -2.481 1.00 0.00 H new ATOM 0 HD2 TYR A 26 8.277 -14.993 -1.751 1.00 0.00 H new ATOM 0 HE1 TYR A 26 12.500 -12.458 -2.445 1.00 0.00 H new ATOM 0 HE2 TYR A 26 10.456 -16.181 -1.705 1.00 0.00 H new ATOM 0 HH TYR A 26 12.668 -16.015 -1.960 1.00 0.00 H new ATOM 382 N ASN A 27 6.047 -9.750 -3.283 1.00 0.00 N ATOM 383 CA ASN A 27 4.781 -9.025 -3.296 1.00 0.00 C ATOM 384 C ASN A 27 4.434 -8.717 -4.735 1.00 0.00 C ATOM 385 O ASN A 27 3.266 -8.440 -5.007 1.00 0.00 O ATOM 386 CB ASN A 27 4.802 -7.687 -2.537 1.00 0.00 C ATOM 387 CG ASN A 27 4.990 -6.422 -3.387 1.00 0.00 C ATOM 388 OD1 ASN A 27 4.022 -5.714 -3.622 1.00 0.00 O ATOM 389 ND2 ASN A 27 6.164 -6.089 -3.879 1.00 0.00 N ATOM 0 H ASN A 27 6.851 -9.196 -2.989 1.00 0.00 H new ATOM 0 HA ASN A 27 4.056 -9.667 -2.796 1.00 0.00 H new ATOM 0 HB2 ASN A 27 3.866 -7.592 -1.986 1.00 0.00 H new ATOM 0 HB3 ASN A 27 5.604 -7.725 -1.800 1.00 0.00 H new ATOM 0 HD21 ASN A 27 6.258 -5.248 -4.449 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.980 -6.671 -3.690 1.00 0.00 H new ATOM 395 N SER A 28 5.450 -8.769 -5.613 1.00 0.00 N ATOM 396 CA SER A 28 5.357 -8.440 -7.021 1.00 0.00 C ATOM 397 C SER A 28 4.116 -9.040 -7.697 1.00 0.00 C ATOM 398 O SER A 28 3.627 -8.459 -8.666 1.00 0.00 O ATOM 399 CB SER A 28 6.646 -8.879 -7.725 1.00 0.00 C ATOM 400 OG SER A 28 6.846 -8.239 -8.979 1.00 0.00 O ATOM 0 H SER A 28 6.390 -9.054 -5.337 1.00 0.00 H new ATOM 0 HA SER A 28 5.241 -7.360 -7.107 1.00 0.00 H new ATOM 0 HB2 SER A 28 7.496 -8.667 -7.077 1.00 0.00 H new ATOM 0 HB3 SER A 28 6.621 -9.958 -7.875 1.00 0.00 H new ATOM 0 HG SER A 28 7.682 -8.557 -9.379 1.00 0.00 H new ATOM 405 N SER A 29 3.586 -10.167 -7.206 1.00 0.00 N ATOM 406 CA SER A 29 2.231 -10.587 -7.528 1.00 0.00 C ATOM 407 C SER A 29 1.352 -10.732 -6.298 1.00 0.00 C ATOM 408 O SER A 29 0.156 -10.491 -6.421 1.00 0.00 O ATOM 409 CB SER A 29 2.211 -11.849 -8.386 1.00 0.00 C ATOM 410 OG SER A 29 2.882 -12.928 -7.769 1.00 0.00 O ATOM 0 H SER A 29 4.084 -10.802 -6.582 1.00 0.00 H new ATOM 0 HA SER A 29 1.800 -9.782 -8.124 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.178 -12.133 -8.586 1.00 0.00 H new ATOM 0 HB3 SER A 29 2.676 -11.638 -9.349 1.00 0.00 H new ATOM 0 HG SER A 29 2.843 -13.714 -8.352 1.00 0.00 H new ATOM 415 N GLU A 30 1.903 -11.111 -5.138 1.00 0.00 N ATOM 416 CA GLU A 30 1.115 -11.490 -3.980 1.00 0.00 C ATOM 417 C GLU A 30 0.199 -10.348 -3.556 1.00 0.00 C ATOM 418 O GLU A 30 -1.014 -10.465 -3.701 1.00 0.00 O ATOM 419 CB GLU A 30 2.036 -11.933 -2.835 1.00 0.00 C ATOM 420 CG GLU A 30 1.286 -12.757 -1.793 1.00 0.00 C ATOM 421 CD GLU A 30 0.815 -14.089 -2.370 1.00 0.00 C ATOM 422 OE1 GLU A 30 1.689 -14.942 -2.645 1.00 0.00 O ATOM 423 OE2 GLU A 30 -0.412 -14.261 -2.575 1.00 0.00 O ATOM 0 H GLU A 30 2.910 -11.160 -4.985 1.00 0.00 H new ATOM 0 HA GLU A 30 0.480 -12.335 -4.245 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.861 -12.520 -3.238 1.00 0.00 H new ATOM 0 HB3 GLU A 30 2.473 -11.055 -2.359 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.934 -12.939 -0.936 1.00 0.00 H new ATOM 0 HG3 GLU A 30 0.427 -12.192 -1.430 1.00 0.00 H new ATOM 428 N LEU A 31 0.787 -9.249 -3.071 1.00 0.00 N ATOM 429 CA LEU A 31 0.108 -8.036 -2.658 1.00 0.00 C ATOM 430 C LEU A 31 -0.749 -7.533 -3.793 1.00 0.00 C ATOM 431 O LEU A 31 -1.899 -7.168 -3.573 1.00 0.00 O ATOM 432 CB LEU A 31 1.150 -7.007 -2.208 1.00 0.00 C ATOM 433 CG LEU A 31 0.479 -5.682 -1.812 1.00 0.00 C ATOM 434 CD1 LEU A 31 1.348 -4.934 -0.800 1.00 0.00 C ATOM 435 CD2 LEU A 31 0.209 -4.810 -3.035 1.00 0.00 C ATOM 0 H LEU A 31 1.798 -9.188 -2.954 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.552 -8.228 -1.812 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.714 -7.401 -1.362 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.864 -6.831 -3.013 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.482 -5.912 -1.351 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.863 -3.997 -0.526 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.479 -5.548 0.091 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.322 -4.723 -1.242 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.266 -3.880 -2.721 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.150 -4.585 -3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.450 -5.341 -3.722 1.00 0.00 H new ATOM 446 N LYS A 32 -0.175 -7.501 -4.993 1.00 0.00 N ATOM 447 CA LYS A 32 -0.855 -7.015 -6.174 1.00 0.00 C ATOM 448 C LYS A 32 -2.216 -7.709 -6.298 1.00 0.00 C ATOM 449 O LYS A 32 -3.216 -7.018 -6.465 1.00 0.00 O ATOM 450 CB LYS A 32 0.028 -7.269 -7.414 1.00 0.00 C ATOM 451 CG LYS A 32 -0.378 -6.249 -8.492 1.00 0.00 C ATOM 452 CD LYS A 32 -0.024 -6.641 -9.927 1.00 0.00 C ATOM 453 CE LYS A 32 -0.851 -7.846 -10.402 1.00 0.00 C ATOM 454 NZ LYS A 32 -0.910 -7.931 -11.876 1.00 0.00 N ATOM 0 H LYS A 32 0.780 -7.815 -5.166 1.00 0.00 H new ATOM 0 HA LYS A 32 -1.029 -5.942 -6.097 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.083 -7.160 -7.162 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -0.109 -8.287 -7.779 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.455 -6.090 -8.431 1.00 0.00 H new ATOM 0 HG3 LYS A 32 0.099 -5.295 -8.265 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -0.199 -5.794 -10.590 1.00 0.00 H new ATOM 0 HD3 LYS A 32 1.038 -6.880 -9.989 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -0.417 -8.763 -10.003 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -1.862 -7.772 -10.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.477 -8.757 -12.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -1.347 -7.067 -12.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 0.053 -8.028 -12.257 1.00 0.00 H new ATOM 464 N GLU A 33 -2.264 -9.041 -6.176 1.00 0.00 N ATOM 465 CA GLU A 33 -3.485 -9.839 -6.128 1.00 0.00 C ATOM 466 C GLU A 33 -4.360 -9.436 -4.951 1.00 0.00 C ATOM 467 O GLU A 33 -5.541 -9.138 -5.144 1.00 0.00 O ATOM 468 CB GLU A 33 -3.173 -11.340 -6.101 1.00 0.00 C ATOM 469 CG GLU A 33 -3.161 -11.839 -7.547 1.00 0.00 C ATOM 470 CD GLU A 33 -2.708 -13.290 -7.724 1.00 0.00 C ATOM 471 OE1 GLU A 33 -2.417 -13.998 -6.730 1.00 0.00 O ATOM 472 OE2 GLU A 33 -2.683 -13.740 -8.895 1.00 0.00 O ATOM 0 H GLU A 33 -1.420 -9.609 -6.106 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.045 -9.638 -7.041 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.209 -11.522 -5.626 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -3.922 -11.876 -5.518 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.164 -11.734 -7.961 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.505 -11.195 -8.133 1.00 0.00 H new ATOM 477 N GLN A 34 -3.778 -9.377 -3.751 1.00 0.00 N ATOM 478 CA GLN A 34 -4.489 -9.049 -2.516 1.00 0.00 C ATOM 479 C GLN A 34 -5.114 -7.660 -2.540 1.00 0.00 C ATOM 480 O GLN A 34 -5.904 -7.348 -1.659 1.00 0.00 O ATOM 481 CB GLN A 34 -3.590 -9.191 -1.279 1.00 0.00 C ATOM 482 CG GLN A 34 -2.848 -10.519 -1.250 1.00 0.00 C ATOM 483 CD GLN A 34 -2.872 -11.211 0.103 1.00 0.00 C ATOM 484 OE1 GLN A 34 -2.050 -10.776 1.033 1.00 0.00 O flip ATOM 485 NE2 GLN A 34 -3.626 -12.148 0.337 1.00 0.00 N flip ATOM 0 H GLN A 34 -2.784 -9.559 -3.609 1.00 0.00 H new ATOM 0 HA GLN A 34 -5.298 -9.777 -2.449 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -2.868 -8.374 -1.262 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -4.198 -9.098 -0.379 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -3.285 -11.184 -1.995 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -1.811 -10.351 -1.542 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -4.262 -12.483 -0.386 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -3.617 -12.593 1.255 1.00 0.00 H new ATOM 492 N LEU A 35 -4.775 -6.829 -3.528 1.00 0.00 N ATOM 493 CA LEU A 35 -5.347 -5.511 -3.701 1.00 0.00 C ATOM 494 C LEU A 35 -6.172 -5.382 -4.959 1.00 0.00 C ATOM 495 O LEU A 35 -7.206 -4.761 -4.837 1.00 0.00 O ATOM 496 CB LEU A 35 -4.281 -4.436 -3.691 1.00 0.00 C ATOM 497 CG LEU A 35 -3.649 -4.155 -2.318 1.00 0.00 C ATOM 498 CD1 LEU A 35 -2.651 -2.995 -2.365 1.00 0.00 C ATOM 499 CD2 LEU A 35 -4.714 -3.775 -1.280 1.00 0.00 C ATOM 0 H LEU A 35 -4.082 -7.066 -4.238 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.013 -5.372 -2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.491 -4.723 -4.385 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.717 -3.511 -4.069 1.00 0.00 H new ATOM 0 HG LEU A 35 -3.140 -5.078 -2.040 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.232 -2.835 -1.372 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.849 -3.233 -3.063 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -3.161 -2.089 -2.693 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -4.234 -3.583 -0.320 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -5.239 -2.878 -1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.426 -4.594 -1.172 1.00 0.00 H new ATOM 510 N ARG A 36 -5.831 -5.912 -6.138 1.00 0.00 N ATOM 511 CA ARG A 36 -6.789 -5.920 -7.253 1.00 0.00 C ATOM 512 C ARG A 36 -8.077 -6.612 -6.811 1.00 0.00 C ATOM 513 O ARG A 36 -9.167 -6.090 -7.037 1.00 0.00 O ATOM 514 CB ARG A 36 -6.202 -6.550 -8.535 1.00 0.00 C ATOM 515 CG ARG A 36 -5.789 -8.022 -8.375 1.00 0.00 C ATOM 516 CD ARG A 36 -5.094 -8.654 -9.587 1.00 0.00 C ATOM 517 NE ARG A 36 -5.941 -8.644 -10.790 1.00 0.00 N ATOM 518 CZ ARG A 36 -5.657 -9.238 -11.953 1.00 0.00 C ATOM 519 NH1 ARG A 36 -4.651 -10.098 -12.085 1.00 0.00 N ATOM 520 NH2 ARG A 36 -6.387 -8.931 -13.015 1.00 0.00 N ATOM 0 H ARG A 36 -4.924 -6.331 -6.345 1.00 0.00 H new ATOM 0 HA ARG A 36 -7.017 -4.887 -7.516 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -6.939 -6.475 -9.335 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -5.333 -5.971 -8.847 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -5.124 -8.102 -7.515 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -6.679 -8.607 -8.144 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -4.169 -8.115 -9.793 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -4.818 -9.681 -9.349 1.00 0.00 H new ATOM 0 HE ARG A 36 -6.825 -8.138 -10.731 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -4.065 -10.324 -11.282 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -4.466 -10.531 -12.990 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -7.146 -8.255 -12.934 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -6.190 -9.371 -13.914 1.00 0.00 H new ATOM 531 N ASN A 37 -7.961 -7.752 -6.125 1.00 0.00 N ATOM 532 CA ASN A 37 -9.104 -8.562 -5.758 1.00 0.00 C ATOM 533 C ASN A 37 -9.851 -7.870 -4.619 1.00 0.00 C ATOM 534 O ASN A 37 -11.083 -7.849 -4.581 1.00 0.00 O ATOM 535 CB ASN A 37 -8.617 -9.969 -5.367 1.00 0.00 C ATOM 536 CG ASN A 37 -9.754 -10.964 -5.148 1.00 0.00 C ATOM 537 OD1 ASN A 37 -10.921 -10.704 -5.427 1.00 0.00 O ATOM 538 ND2 ASN A 37 -9.425 -12.162 -4.698 1.00 0.00 N ATOM 0 H ASN A 37 -7.067 -8.132 -5.813 1.00 0.00 H new ATOM 0 HA ASN A 37 -9.795 -8.672 -6.594 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -7.958 -10.348 -6.148 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -8.024 -9.900 -4.455 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -10.142 -12.877 -4.581 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.454 -12.371 -4.468 1.00 0.00 H new ATOM 544 N PHE A 38 -9.106 -7.225 -3.712 1.00 0.00 N ATOM 545 CA PHE A 38 -9.708 -6.520 -2.602 1.00 0.00 C ATOM 546 C PHE A 38 -10.359 -5.242 -3.084 1.00 0.00 C ATOM 547 O PHE A 38 -11.507 -5.024 -2.753 1.00 0.00 O ATOM 548 CB PHE A 38 -8.719 -6.228 -1.485 1.00 0.00 C ATOM 549 CG PHE A 38 -9.280 -5.339 -0.398 1.00 0.00 C ATOM 550 CD1 PHE A 38 -10.338 -5.799 0.408 1.00 0.00 C ATOM 551 CD2 PHE A 38 -8.783 -4.033 -0.234 1.00 0.00 C ATOM 552 CE1 PHE A 38 -10.876 -4.967 1.401 1.00 0.00 C ATOM 553 CE2 PHE A 38 -9.334 -3.195 0.745 1.00 0.00 C ATOM 554 CZ PHE A 38 -10.366 -3.672 1.577 1.00 0.00 C ATOM 0 H PHE A 38 -8.087 -7.184 -3.736 1.00 0.00 H new ATOM 0 HA PHE A 38 -10.469 -7.177 -2.182 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -8.396 -7.170 -1.042 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -7.834 -5.755 -1.909 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -10.736 -6.792 0.262 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -7.979 -3.677 -0.861 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -11.680 -5.322 2.028 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -8.968 -2.186 0.861 1.00 0.00 H new ATOM 0 HZ PHE A 38 -10.766 -3.038 2.354 1.00 0.00 H new ATOM 563 N ILE A 39 -9.703 -4.407 -3.886 1.00 0.00 N ATOM 564 CA ILE A 39 -10.344 -3.226 -4.472 1.00 0.00 C ATOM 565 C ILE A 39 -11.599 -3.587 -5.278 1.00 0.00 C ATOM 566 O ILE A 39 -12.547 -2.798 -5.301 1.00 0.00 O ATOM 567 CB ILE A 39 -9.286 -2.477 -5.292 1.00 0.00 C ATOM 568 CG1 ILE A 39 -8.396 -1.700 -4.296 1.00 0.00 C ATOM 569 CG2 ILE A 39 -9.841 -1.521 -6.357 1.00 0.00 C ATOM 570 CD1 ILE A 39 -7.004 -1.359 -4.811 1.00 0.00 C ATOM 0 H ILE A 39 -8.724 -4.525 -4.147 1.00 0.00 H new ATOM 0 HA ILE A 39 -10.712 -2.568 -3.685 1.00 0.00 H new ATOM 0 HB ILE A 39 -8.730 -3.223 -5.860 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.903 -0.775 -4.023 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.296 -2.289 -3.384 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -9.015 -1.041 -6.881 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.446 -2.082 -7.070 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.457 -0.760 -5.878 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -6.455 -0.815 -4.043 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -6.471 -2.278 -5.055 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -7.088 -0.740 -5.704 1.00 0.00 H new ATOM 581 N SER A 40 -11.629 -4.754 -5.916 1.00 0.00 N ATOM 582 CA SER A 40 -12.781 -5.276 -6.640 1.00 0.00 C ATOM 583 C SER A 40 -13.884 -5.785 -5.681 1.00 0.00 C ATOM 584 O SER A 40 -15.023 -5.991 -6.103 1.00 0.00 O ATOM 585 CB SER A 40 -12.225 -6.365 -7.572 1.00 0.00 C ATOM 586 OG SER A 40 -13.166 -6.936 -8.449 1.00 0.00 O ATOM 0 H SER A 40 -10.825 -5.381 -5.943 1.00 0.00 H new ATOM 0 HA SER A 40 -13.282 -4.502 -7.222 1.00 0.00 H new ATOM 0 HB2 SER A 40 -11.414 -5.938 -8.162 1.00 0.00 H new ATOM 0 HB3 SER A 40 -11.792 -7.158 -6.962 1.00 0.00 H new ATOM 0 HG SER A 40 -12.727 -7.615 -9.003 1.00 0.00 H new ATOM 591 N THR A 41 -13.595 -5.974 -4.392 1.00 0.00 N ATOM 592 CA THR A 41 -14.533 -6.312 -3.341 1.00 0.00 C ATOM 593 C THR A 41 -14.974 -5.056 -2.573 1.00 0.00 C ATOM 594 O THR A 41 -16.153 -4.917 -2.250 1.00 0.00 O ATOM 595 CB THR A 41 -13.819 -7.295 -2.412 1.00 0.00 C ATOM 596 OG1 THR A 41 -13.358 -8.440 -3.118 1.00 0.00 O ATOM 597 CG2 THR A 41 -14.694 -7.709 -1.239 1.00 0.00 C ATOM 0 H THR A 41 -12.641 -5.888 -4.042 1.00 0.00 H new ATOM 0 HA THR A 41 -15.436 -6.757 -3.758 1.00 0.00 H new ATOM 0 HB THR A 41 -12.952 -6.770 -2.010 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.583 -8.196 -3.666 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.147 -8.407 -0.606 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.964 -6.827 -0.658 1.00 0.00 H new ATOM 0 HG23 THR A 41 -15.599 -8.189 -1.612 1.00 0.00 H new ATOM 605 N THR A 42 -14.010 -4.214 -2.188 1.00 0.00 N ATOM 606 CA THR A 42 -14.086 -3.435 -0.969 1.00 0.00 C ATOM 607 C THR A 42 -15.237 -2.449 -0.985 1.00 0.00 C ATOM 608 O THR A 42 -15.529 -1.782 -1.985 1.00 0.00 O ATOM 609 CB THR A 42 -12.740 -2.747 -0.683 1.00 0.00 C ATOM 610 OG1 THR A 42 -12.770 -2.086 0.568 1.00 0.00 O ATOM 611 CG2 THR A 42 -12.343 -1.725 -1.749 1.00 0.00 C ATOM 0 H THR A 42 -13.155 -4.060 -2.722 1.00 0.00 H new ATOM 0 HA THR A 42 -14.293 -4.124 -0.150 1.00 0.00 H new ATOM 0 HB THR A 42 -12.000 -3.547 -0.684 1.00 0.00 H new ATOM 0 HG1 THR A 42 -13.479 -2.471 1.124 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.385 -1.278 -1.485 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.258 -2.222 -2.716 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.103 -0.946 -1.807 1.00 0.00 H new ATOM 619 N SER A 43 -15.836 -2.326 0.188 1.00 0.00 N ATOM 620 CA SER A 43 -16.948 -1.469 0.508 1.00 0.00 C ATOM 621 C SER A 43 -16.505 -0.068 0.943 1.00 0.00 C ATOM 622 O SER A 43 -17.363 0.790 1.144 1.00 0.00 O ATOM 623 CB SER A 43 -17.708 -2.209 1.606 1.00 0.00 C ATOM 624 OG SER A 43 -18.821 -2.858 1.025 1.00 0.00 O ATOM 0 H SER A 43 -15.529 -2.866 0.997 1.00 0.00 H new ATOM 0 HA SER A 43 -17.577 -1.284 -0.363 1.00 0.00 H new ATOM 0 HB2 SER A 43 -17.058 -2.936 2.092 1.00 0.00 H new ATOM 0 HB3 SER A 43 -18.037 -1.510 2.375 1.00 0.00 H new ATOM 0 HG SER A 43 -19.318 -3.339 1.719 1.00 0.00 H new ATOM 629 N LYS A 44 -15.201 0.215 1.057 1.00 0.00 N ATOM 630 CA LYS A 44 -14.702 1.513 1.517 1.00 0.00 C ATOM 631 C LYS A 44 -13.890 2.162 0.416 1.00 0.00 C ATOM 632 O LYS A 44 -13.148 1.478 -0.286 1.00 0.00 O ATOM 633 CB LYS A 44 -13.807 1.339 2.752 1.00 0.00 C ATOM 634 CG LYS A 44 -14.318 0.337 3.793 1.00 0.00 C ATOM 635 CD LYS A 44 -15.629 0.800 4.427 1.00 0.00 C ATOM 636 CE LYS A 44 -16.312 -0.380 5.103 1.00 0.00 C ATOM 637 NZ LYS A 44 -17.475 0.057 5.880 1.00 0.00 N ATOM 0 H LYS A 44 -14.463 -0.452 0.832 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.556 2.139 1.777 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -12.817 1.023 2.422 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -13.687 2.309 3.234 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.465 -0.635 3.321 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.565 0.204 4.570 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -15.435 1.587 5.155 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -16.283 1.225 3.666 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.625 -1.103 4.350 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.604 -0.888 5.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.553 -0.519 6.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.362 1.057 6.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -18.337 -0.056 5.309 1.00 0.00 H new ATOM 647 N LYS A 45 -13.952 3.489 0.311 1.00 0.00 N ATOM 648 CA LYS A 45 -13.188 4.192 -0.711 1.00 0.00 C ATOM 649 C LYS A 45 -11.767 4.519 -0.271 1.00 0.00 C ATOM 650 O LYS A 45 -10.885 4.440 -1.117 1.00 0.00 O ATOM 651 CB LYS A 45 -13.960 5.420 -1.184 1.00 0.00 C ATOM 652 CG LYS A 45 -15.163 5.001 -2.046 1.00 0.00 C ATOM 653 CD LYS A 45 -16.299 6.033 -2.029 1.00 0.00 C ATOM 654 CE LYS A 45 -15.858 7.478 -2.280 1.00 0.00 C ATOM 655 NZ LYS A 45 -16.879 8.447 -1.819 1.00 0.00 N ATOM 0 H LYS A 45 -14.516 4.089 0.913 1.00 0.00 H new ATOM 0 HA LYS A 45 -13.066 3.521 -1.561 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -14.304 5.994 -0.324 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -13.302 6.071 -1.759 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.832 4.850 -3.073 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -15.543 4.044 -1.689 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -17.034 5.756 -2.785 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -16.801 5.984 -1.063 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -14.917 7.667 -1.764 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -15.672 7.623 -3.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -16.547 9.415 -2.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -17.770 8.282 -2.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -17.038 8.325 -0.798 1.00 0.00 H new ATOM 665 N LYS A 46 -11.487 4.868 0.992 1.00 0.00 N ATOM 666 CA LYS A 46 -10.102 5.156 1.392 1.00 0.00 C ATOM 667 C LYS A 46 -9.281 3.885 1.502 1.00 0.00 C ATOM 668 O LYS A 46 -9.321 3.298 2.570 1.00 0.00 O ATOM 669 CB LYS A 46 -10.007 6.045 2.655 1.00 0.00 C ATOM 670 CG LYS A 46 -9.532 7.486 2.392 1.00 0.00 C ATOM 671 CD LYS A 46 -10.289 8.553 3.186 1.00 0.00 C ATOM 672 CE LYS A 46 -11.559 8.959 2.437 1.00 0.00 C ATOM 673 NZ LYS A 46 -12.311 9.984 3.181 1.00 0.00 N ATOM 0 H LYS A 46 -12.179 4.956 1.736 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.662 5.752 0.592 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.986 6.081 3.132 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.324 5.575 3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -8.471 7.556 2.632 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -9.633 7.701 1.328 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.546 8.169 4.173 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -9.652 9.425 3.339 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.296 9.341 1.451 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.189 8.083 2.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -13.167 10.240 2.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -12.581 9.609 4.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.716 10.828 3.307 1.00 0.00 H new ATOM 683 N ILE A 47 -8.548 3.423 0.483 1.00 0.00 N ATOM 684 CA ILE A 47 -7.682 2.270 0.696 1.00 0.00 C ATOM 685 C ILE A 47 -6.417 2.826 1.344 1.00 0.00 C ATOM 686 O ILE A 47 -5.627 3.531 0.711 1.00 0.00 O ATOM 687 CB ILE A 47 -7.431 1.486 -0.600 1.00 0.00 C ATOM 688 CG1 ILE A 47 -8.689 1.309 -1.478 1.00 0.00 C ATOM 689 CG2 ILE A 47 -6.844 0.110 -0.258 1.00 0.00 C ATOM 690 CD1 ILE A 47 -9.928 0.733 -0.784 1.00 0.00 C ATOM 0 H ILE A 47 -8.538 3.814 -0.459 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.141 1.527 1.348 1.00 0.00 H new ATOM 0 HB ILE A 47 -6.728 2.077 -1.188 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -8.953 2.280 -1.897 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -8.433 0.659 -2.315 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.665 -0.448 -1.177 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -5.903 0.239 0.277 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -7.546 -0.439 0.369 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -10.745 0.656 -1.502 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -9.697 -0.257 -0.390 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -10.225 1.389 0.034 1.00 0.00 H new ATOM 701 N VAL A 48 -6.278 2.636 2.645 1.00 0.00 N ATOM 702 CA VAL A 48 -5.147 3.112 3.421 1.00 0.00 C ATOM 703 C VAL A 48 -4.258 1.923 3.616 1.00 0.00 C ATOM 704 O VAL A 48 -4.723 0.849 3.969 1.00 0.00 O ATOM 705 CB VAL A 48 -5.632 3.668 4.771 1.00 0.00 C ATOM 706 CG1 VAL A 48 -4.483 4.307 5.548 1.00 0.00 C ATOM 707 CG2 VAL A 48 -6.762 4.684 4.585 1.00 0.00 C ATOM 0 H VAL A 48 -6.967 2.133 3.205 1.00 0.00 H new ATOM 0 HA VAL A 48 -4.615 3.920 2.918 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.017 2.825 5.344 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.855 4.691 6.498 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.711 3.560 5.736 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.061 5.126 4.966 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.080 5.056 5.559 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.407 5.516 3.977 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.604 4.204 4.087 1.00 0.00 H new ATOM 717 N LEU A 49 -2.972 2.100 3.396 1.00 0.00 N ATOM 718 CA LEU A 49 -1.994 1.068 3.602 1.00 0.00 C ATOM 719 C LEU A 49 -1.234 1.410 4.874 1.00 0.00 C ATOM 720 O LEU A 49 -1.077 2.579 5.196 1.00 0.00 O ATOM 721 CB LEU A 49 -1.131 0.944 2.347 1.00 0.00 C ATOM 722 CG LEU A 49 -1.730 0.163 1.153 1.00 0.00 C ATOM 723 CD1 LEU A 49 -1.962 -1.326 1.459 1.00 0.00 C ATOM 724 CD2 LEU A 49 -3.014 0.780 0.584 1.00 0.00 C ATOM 0 H LEU A 49 -2.577 2.980 3.064 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.433 0.081 3.749 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.886 1.949 2.005 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.193 0.465 2.628 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.961 0.242 0.385 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.383 -1.816 0.581 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.013 -1.796 1.717 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.654 -1.422 2.296 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -3.371 0.174 -0.249 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -3.777 0.813 1.361 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.808 1.792 0.235 1.00 0.00 H new ATOM 735 N ASP A 50 -0.806 0.401 5.621 1.00 0.00 N ATOM 736 CA ASP A 50 -0.015 0.536 6.861 1.00 0.00 C ATOM 737 C ASP A 50 1.257 -0.289 6.763 1.00 0.00 C ATOM 738 O ASP A 50 1.173 -1.514 6.668 1.00 0.00 O ATOM 739 CB ASP A 50 -0.790 0.045 8.084 1.00 0.00 C ATOM 740 CG ASP A 50 -0.317 0.662 9.397 1.00 0.00 C ATOM 741 OD1 ASP A 50 -0.013 1.866 9.447 1.00 0.00 O ATOM 742 OD2 ASP A 50 -0.302 -0.092 10.398 1.00 0.00 O ATOM 0 H ASP A 50 -1.001 -0.571 5.382 1.00 0.00 H new ATOM 0 HA ASP A 50 0.213 1.596 6.976 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.848 0.270 7.947 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.700 -1.039 8.149 1.00 0.00 H new ATOM 746 N LEU A 51 2.431 0.336 6.765 1.00 0.00 N ATOM 747 CA LEU A 51 3.682 -0.266 6.337 1.00 0.00 C ATOM 748 C LEU A 51 4.659 -0.432 7.503 1.00 0.00 C ATOM 749 O LEU A 51 5.854 -0.611 7.293 1.00 0.00 O ATOM 750 CB LEU A 51 4.267 0.556 5.176 1.00 0.00 C ATOM 751 CG LEU A 51 3.425 0.683 3.888 1.00 0.00 C ATOM 752 CD1 LEU A 51 2.715 -0.599 3.446 1.00 0.00 C ATOM 753 CD2 LEU A 51 2.367 1.784 3.928 1.00 0.00 C ATOM 0 H LEU A 51 2.537 1.302 7.074 1.00 0.00 H new ATOM 0 HA LEU A 51 3.492 -1.276 5.974 1.00 0.00 H new ATOM 0 HB2 LEU A 51 4.468 1.562 5.545 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.228 0.118 4.906 1.00 0.00 H new ATOM 0 HG LEU A 51 4.199 0.935 3.164 1.00 0.00 H new ATOM 0 HD11 LEU A 51 2.151 -0.406 2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.454 -1.378 3.258 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.034 -0.927 4.231 1.00 0.00 H new ATOM 0 HD21 LEU A 51 1.824 1.801 2.983 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.670 1.590 4.744 1.00 0.00 H new ATOM 0 HD23 LEU A 51 2.851 2.748 4.086 1.00 0.00 H new ATOM 764 N SER A 52 4.153 -0.437 8.734 1.00 0.00 N ATOM 765 CA SER A 52 4.940 -0.619 9.945 1.00 0.00 C ATOM 766 C SER A 52 5.745 -1.933 9.950 1.00 0.00 C ATOM 767 O SER A 52 6.798 -2.012 10.584 1.00 0.00 O ATOM 768 CB SER A 52 4.004 -0.556 11.157 1.00 0.00 C ATOM 769 OG SER A 52 4.474 0.345 12.132 1.00 0.00 O ATOM 0 H SER A 52 3.158 -0.311 8.919 1.00 0.00 H new ATOM 0 HA SER A 52 5.676 0.184 9.989 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.008 -0.254 10.832 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.909 -1.549 11.595 1.00 0.00 H new ATOM 0 HG SER A 52 4.247 1.261 11.867 1.00 0.00 H new ATOM 774 N SER A 53 5.272 -2.973 9.259 1.00 0.00 N ATOM 775 CA SER A 53 5.962 -4.248 9.129 1.00 0.00 C ATOM 776 C SER A 53 7.004 -4.246 8.006 1.00 0.00 C ATOM 777 O SER A 53 7.784 -5.198 7.921 1.00 0.00 O ATOM 778 CB SER A 53 4.905 -5.310 8.835 1.00 0.00 C ATOM 779 OG SER A 53 4.402 -5.884 10.027 1.00 0.00 O ATOM 0 H SER A 53 4.380 -2.946 8.766 1.00 0.00 H new ATOM 0 HA SER A 53 6.500 -4.449 10.055 1.00 0.00 H new ATOM 0 HB2 SER A 53 4.086 -4.864 8.271 1.00 0.00 H new ATOM 0 HB3 SER A 53 5.336 -6.090 8.208 1.00 0.00 H new ATOM 0 HG SER A 53 3.726 -6.559 9.806 1.00 0.00 H new ATOM 784 N VAL A 54 7.014 -3.241 7.135 1.00 0.00 N ATOM 785 CA VAL A 54 7.859 -3.223 5.960 1.00 0.00 C ATOM 786 C VAL A 54 9.210 -2.646 6.401 1.00 0.00 C ATOM 787 O VAL A 54 9.318 -1.442 6.637 1.00 0.00 O ATOM 788 CB VAL A 54 7.199 -2.356 4.865 1.00 0.00 C ATOM 789 CG1 VAL A 54 8.078 -2.310 3.618 1.00 0.00 C ATOM 790 CG2 VAL A 54 5.818 -2.861 4.419 1.00 0.00 C ATOM 0 H VAL A 54 6.428 -2.412 7.232 1.00 0.00 H new ATOM 0 HA VAL A 54 7.999 -4.219 5.540 1.00 0.00 H new ATOM 0 HB VAL A 54 7.080 -1.373 5.321 1.00 0.00 H new ATOM 0 HG11 VAL A 54 7.598 -1.695 2.857 1.00 0.00 H new ATOM 0 HG12 VAL A 54 9.048 -1.882 3.872 1.00 0.00 H new ATOM 0 HG13 VAL A 54 8.217 -3.320 3.233 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.420 -2.200 3.649 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.912 -3.870 4.018 1.00 0.00 H new ATOM 0 HG23 VAL A 54 5.141 -2.871 5.273 1.00 0.00 H new ATOM 800 N SER A 55 10.239 -3.473 6.548 1.00 0.00 N ATOM 801 CA SER A 55 11.588 -3.048 6.858 1.00 0.00 C ATOM 802 C SER A 55 12.454 -2.895 5.601 1.00 0.00 C ATOM 803 O SER A 55 13.457 -2.177 5.662 1.00 0.00 O ATOM 804 CB SER A 55 12.181 -4.086 7.798 1.00 0.00 C ATOM 805 OG SER A 55 12.036 -3.735 9.162 1.00 0.00 O ATOM 0 H SER A 55 10.149 -4.484 6.451 1.00 0.00 H new ATOM 0 HA SER A 55 11.562 -2.063 7.325 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.699 -5.047 7.621 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.239 -4.214 7.571 1.00 0.00 H new ATOM 0 HG SER A 55 12.655 -3.007 9.380 1.00 0.00 H new ATOM 810 N TYR A 56 12.085 -3.506 4.474 1.00 0.00 N ATOM 811 CA TYR A 56 12.815 -3.481 3.211 1.00 0.00 C ATOM 812 C TYR A 56 11.831 -3.294 2.058 1.00 0.00 C ATOM 813 O TYR A 56 10.685 -3.743 2.136 1.00 0.00 O ATOM 814 CB TYR A 56 13.616 -4.794 3.096 1.00 0.00 C ATOM 815 CG TYR A 56 14.203 -5.141 1.736 1.00 0.00 C ATOM 816 CD1 TYR A 56 13.366 -5.606 0.700 1.00 0.00 C ATOM 817 CD2 TYR A 56 15.593 -5.065 1.524 1.00 0.00 C ATOM 818 CE1 TYR A 56 13.907 -5.966 -0.544 1.00 0.00 C ATOM 819 CE2 TYR A 56 16.147 -5.476 0.299 1.00 0.00 C ATOM 820 CZ TYR A 56 15.305 -5.946 -0.733 1.00 0.00 C ATOM 821 OH TYR A 56 15.837 -6.411 -1.896 1.00 0.00 O ATOM 0 H TYR A 56 11.228 -4.057 4.417 1.00 0.00 H new ATOM 0 HA TYR A 56 13.515 -2.646 3.171 1.00 0.00 H new ATOM 0 HB2 TYR A 56 14.434 -4.753 3.815 1.00 0.00 H new ATOM 0 HB3 TYR A 56 12.965 -5.613 3.400 1.00 0.00 H new ATOM 0 HD1 TYR A 56 12.302 -5.686 0.865 1.00 0.00 H new ATOM 0 HD2 TYR A 56 16.236 -4.689 2.306 1.00 0.00 H new ATOM 0 HE1 TYR A 56 13.255 -6.257 -1.354 1.00 0.00 H new ATOM 0 HE2 TYR A 56 17.215 -5.432 0.147 1.00 0.00 H new ATOM 0 HH TYR A 56 16.813 -6.326 -1.866 1.00 0.00 H new ATOM 830 N MET A 57 12.297 -2.659 0.981 1.00 0.00 N ATOM 831 CA MET A 57 11.606 -2.493 -0.289 1.00 0.00 C ATOM 832 C MET A 57 12.616 -2.676 -1.413 1.00 0.00 C ATOM 833 O MET A 57 13.738 -2.162 -1.338 1.00 0.00 O ATOM 834 CB MET A 57 10.963 -1.099 -0.354 1.00 0.00 C ATOM 835 CG MET A 57 10.187 -0.760 -1.645 1.00 0.00 C ATOM 836 SD MET A 57 9.168 0.732 -1.470 1.00 0.00 S ATOM 837 CE MET A 57 7.902 0.366 -2.704 1.00 0.00 C ATOM 0 H MET A 57 13.220 -2.224 0.977 1.00 0.00 H new ATOM 0 HA MET A 57 10.813 -3.234 -0.390 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.282 -0.997 0.491 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.748 -0.354 -0.222 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.893 -0.620 -2.464 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.550 -1.602 -1.914 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.538 1.297 -3.139 1.00 0.00 H new ATOM 0 HE2 MET A 57 8.329 -0.258 -3.489 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.074 -0.162 -2.230 1.00 0.00 H new ATOM 845 N ASP A 58 12.178 -3.342 -2.477 1.00 0.00 N ATOM 846 CA ASP A 58 12.883 -3.419 -3.752 1.00 0.00 C ATOM 847 C ASP A 58 12.017 -2.772 -4.847 1.00 0.00 C ATOM 848 O ASP A 58 10.932 -2.253 -4.570 1.00 0.00 O ATOM 849 CB ASP A 58 13.328 -4.866 -4.027 1.00 0.00 C ATOM 850 CG ASP A 58 14.150 -5.001 -5.303 1.00 0.00 C ATOM 851 OD1 ASP A 58 15.341 -4.613 -5.305 1.00 0.00 O ATOM 852 OD2 ASP A 58 13.572 -5.410 -6.332 1.00 0.00 O ATOM 0 H ASP A 58 11.298 -3.858 -2.476 1.00 0.00 H new ATOM 0 HA ASP A 58 13.810 -2.847 -3.732 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.915 -5.227 -3.183 1.00 0.00 H new ATOM 0 HB3 ASP A 58 12.447 -5.504 -4.099 1.00 0.00 H new ATOM 856 N SER A 59 12.504 -2.756 -6.080 1.00 0.00 N ATOM 857 CA SER A 59 11.937 -2.056 -7.222 1.00 0.00 C ATOM 858 C SER A 59 10.641 -2.686 -7.749 1.00 0.00 C ATOM 859 O SER A 59 9.928 -2.029 -8.520 1.00 0.00 O ATOM 860 CB SER A 59 13.016 -1.992 -8.304 1.00 0.00 C ATOM 861 OG SER A 59 14.155 -1.322 -7.786 1.00 0.00 O ATOM 0 H SER A 59 13.356 -3.262 -6.323 1.00 0.00 H new ATOM 0 HA SER A 59 11.642 -1.055 -6.909 1.00 0.00 H new ATOM 0 HB2 SER A 59 13.286 -2.998 -8.626 1.00 0.00 H new ATOM 0 HB3 SER A 59 12.638 -1.467 -9.181 1.00 0.00 H new ATOM 0 HG SER A 59 14.851 -1.279 -8.475 1.00 0.00 H new ATOM 866 N ALA A 60 10.281 -3.903 -7.319 1.00 0.00 N ATOM 867 CA ALA A 60 8.978 -4.462 -7.635 1.00 0.00 C ATOM 868 C ALA A 60 7.945 -3.611 -6.916 1.00 0.00 C ATOM 869 O ALA A 60 7.070 -3.058 -7.569 1.00 0.00 O ATOM 870 CB ALA A 60 8.874 -5.946 -7.282 1.00 0.00 C ATOM 0 H ALA A 60 10.877 -4.509 -6.755 1.00 0.00 H new ATOM 0 HA ALA A 60 8.804 -4.432 -8.711 1.00 0.00 H new ATOM 0 HB1 ALA A 60 7.880 -6.312 -7.539 1.00 0.00 H new ATOM 0 HB2 ALA A 60 9.623 -6.506 -7.841 1.00 0.00 H new ATOM 0 HB3 ALA A 60 9.045 -6.079 -6.214 1.00 0.00 H new ATOM 876 N GLY A 61 8.123 -3.429 -5.607 1.00 0.00 N ATOM 877 CA GLY A 61 7.354 -2.649 -4.655 1.00 0.00 C ATOM 878 C GLY A 61 6.579 -1.517 -5.310 1.00 0.00 C ATOM 879 O GLY A 61 5.356 -1.514 -5.377 1.00 0.00 O ATOM 0 H GLY A 61 8.907 -3.884 -5.139 1.00 0.00 H new ATOM 0 HA2 GLY A 61 6.658 -3.305 -4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 61 8.027 -2.235 -3.904 1.00 0.00 H new ATOM 883 N LEU A 62 7.308 -0.549 -5.838 1.00 0.00 N ATOM 884 CA LEU A 62 6.762 0.694 -6.358 1.00 0.00 C ATOM 885 C LEU A 62 5.986 0.470 -7.651 1.00 0.00 C ATOM 886 O LEU A 62 4.918 1.053 -7.794 1.00 0.00 O ATOM 887 CB LEU A 62 7.831 1.785 -6.518 1.00 0.00 C ATOM 888 CG LEU A 62 9.236 1.332 -6.967 1.00 0.00 C ATOM 889 CD1 LEU A 62 9.978 2.478 -7.644 1.00 0.00 C ATOM 890 CD2 LEU A 62 10.072 0.885 -5.760 1.00 0.00 C ATOM 0 H LEU A 62 8.323 -0.607 -5.919 1.00 0.00 H new ATOM 0 HA LEU A 62 6.056 1.060 -5.612 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.464 2.515 -7.240 1.00 0.00 H new ATOM 0 HB3 LEU A 62 7.931 2.303 -5.564 1.00 0.00 H new ATOM 0 HG LEU A 62 9.103 0.503 -7.663 1.00 0.00 H new ATOM 0 HD11 LEU A 62 10.967 2.139 -7.953 1.00 0.00 H new ATOM 0 HD12 LEU A 62 9.417 2.808 -8.519 1.00 0.00 H new ATOM 0 HD13 LEU A 62 10.081 3.308 -6.945 1.00 0.00 H new ATOM 0 HD21 LEU A 62 11.059 0.569 -6.098 1.00 0.00 H new ATOM 0 HD22 LEU A 62 10.176 1.715 -5.062 1.00 0.00 H new ATOM 0 HD23 LEU A 62 9.576 0.052 -5.262 1.00 0.00 H new ATOM 901 N GLY A 63 6.454 -0.389 -8.556 1.00 0.00 N ATOM 902 CA GLY A 63 5.706 -0.865 -9.722 1.00 0.00 C ATOM 903 C GLY A 63 4.509 -1.748 -9.349 1.00 0.00 C ATOM 904 O GLY A 63 3.617 -1.982 -10.165 1.00 0.00 O ATOM 0 H GLY A 63 7.392 -0.785 -8.497 1.00 0.00 H new ATOM 0 HA2 GLY A 63 5.353 -0.007 -10.295 1.00 0.00 H new ATOM 0 HA3 GLY A 63 6.377 -1.428 -10.372 1.00 0.00 H new ATOM 908 N THR A 64 4.450 -2.206 -8.102 1.00 0.00 N ATOM 909 CA THR A 64 3.414 -3.072 -7.575 1.00 0.00 C ATOM 910 C THR A 64 2.438 -2.229 -6.748 1.00 0.00 C ATOM 911 O THR A 64 1.367 -2.717 -6.400 1.00 0.00 O ATOM 912 CB THR A 64 4.073 -4.233 -6.794 1.00 0.00 C ATOM 913 OG1 THR A 64 5.099 -4.822 -7.571 1.00 0.00 O ATOM 914 CG2 THR A 64 3.094 -5.362 -6.510 1.00 0.00 C ATOM 0 H THR A 64 5.157 -1.970 -7.405 1.00 0.00 H new ATOM 0 HA THR A 64 2.827 -3.535 -8.369 1.00 0.00 H new ATOM 0 HB THR A 64 4.442 -3.797 -5.866 1.00 0.00 H new ATOM 0 HG1 THR A 64 5.687 -4.121 -7.921 1.00 0.00 H new ATOM 0 HG21 THR A 64 3.602 -6.154 -5.960 1.00 0.00 H new ATOM 0 HG22 THR A 64 2.263 -4.982 -5.915 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.714 -5.760 -7.451 1.00 0.00 H new ATOM 922 N LEU A 65 2.748 -0.946 -6.507 1.00 0.00 N ATOM 923 CA LEU A 65 1.862 0.005 -5.857 1.00 0.00 C ATOM 924 C LEU A 65 1.321 1.021 -6.855 1.00 0.00 C ATOM 925 O LEU A 65 0.136 1.329 -6.806 1.00 0.00 O ATOM 926 CB LEU A 65 2.617 0.753 -4.753 1.00 0.00 C ATOM 927 CG LEU A 65 2.996 -0.056 -3.502 1.00 0.00 C ATOM 928 CD1 LEU A 65 3.985 0.751 -2.655 1.00 0.00 C ATOM 929 CD2 LEU A 65 1.769 -0.421 -2.657 1.00 0.00 C ATOM 0 H LEU A 65 3.647 -0.541 -6.769 1.00 0.00 H new ATOM 0 HA LEU A 65 1.028 -0.553 -5.431 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.531 1.161 -5.183 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.007 1.600 -4.438 1.00 0.00 H new ATOM 0 HG LEU A 65 3.454 -0.988 -3.834 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.255 0.179 -1.767 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.881 0.958 -3.240 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.523 1.691 -2.354 1.00 0.00 H new ATOM 0 HD21 LEU A 65 2.085 -0.992 -1.784 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.267 0.490 -2.332 1.00 0.00 H new ATOM 0 HD23 LEU A 65 1.082 -1.021 -3.254 1.00 0.00 H new ATOM 940 N VAL A 66 2.131 1.564 -7.769 1.00 0.00 N ATOM 941 CA VAL A 66 1.653 2.508 -8.782 1.00 0.00 C ATOM 942 C VAL A 66 0.542 1.872 -9.641 1.00 0.00 C ATOM 943 O VAL A 66 -0.419 2.543 -10.017 1.00 0.00 O ATOM 944 CB VAL A 66 2.872 2.995 -9.591 1.00 0.00 C ATOM 945 CG1 VAL A 66 3.434 1.890 -10.467 1.00 0.00 C ATOM 946 CG2 VAL A 66 2.581 4.221 -10.461 1.00 0.00 C ATOM 0 H VAL A 66 3.129 1.363 -7.827 1.00 0.00 H new ATOM 0 HA VAL A 66 1.187 3.380 -8.323 1.00 0.00 H new ATOM 0 HB VAL A 66 3.608 3.288 -8.843 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.292 2.268 -11.023 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.746 1.053 -9.842 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.668 1.554 -11.166 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.484 4.507 -11.001 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.792 3.982 -11.174 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.260 5.048 -9.828 1.00 0.00 H new ATOM 956 N VAL A 67 0.620 0.561 -9.897 1.00 0.00 N ATOM 957 CA VAL A 67 -0.422 -0.195 -10.587 1.00 0.00 C ATOM 958 C VAL A 67 -1.745 -0.135 -9.803 1.00 0.00 C ATOM 959 O VAL A 67 -2.826 -0.042 -10.383 1.00 0.00 O ATOM 960 CB VAL A 67 0.107 -1.616 -10.877 1.00 0.00 C ATOM 961 CG1 VAL A 67 0.106 -2.492 -9.628 1.00 0.00 C ATOM 962 CG2 VAL A 67 -0.668 -2.297 -12.005 1.00 0.00 C ATOM 0 H VAL A 67 1.421 -0.009 -9.625 1.00 0.00 H new ATOM 0 HA VAL A 67 -0.661 0.248 -11.554 1.00 0.00 H new ATOM 0 HB VAL A 67 1.140 -1.495 -11.203 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.486 -3.483 -9.878 1.00 0.00 H new ATOM 0 HG12 VAL A 67 0.742 -2.041 -8.867 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.911 -2.579 -9.246 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.262 -3.294 -12.175 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.719 -2.376 -11.728 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.576 -1.707 -12.917 1.00 0.00 H new ATOM 972 N ILE A 68 -1.663 -0.123 -8.471 1.00 0.00 N ATOM 973 CA ILE A 68 -2.805 -0.079 -7.577 1.00 0.00 C ATOM 974 C ILE A 68 -3.434 1.323 -7.568 1.00 0.00 C ATOM 975 O ILE A 68 -4.632 1.419 -7.302 1.00 0.00 O ATOM 976 CB ILE A 68 -2.393 -0.574 -6.169 1.00 0.00 C ATOM 977 CG1 ILE A 68 -1.756 -1.986 -6.161 1.00 0.00 C ATOM 978 CG2 ILE A 68 -3.579 -0.539 -5.203 1.00 0.00 C ATOM 979 CD1 ILE A 68 -2.653 -3.130 -6.617 1.00 0.00 C ATOM 0 H ILE A 68 -0.771 -0.144 -7.977 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.580 -0.756 -7.937 1.00 0.00 H new ATOM 0 HB ILE A 68 -1.623 0.121 -5.835 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.873 -1.967 -6.800 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -1.413 -2.202 -5.149 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.260 -0.892 -4.222 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -3.949 0.483 -5.118 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.374 -1.183 -5.579 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -2.099 -4.068 -6.569 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -3.525 -3.190 -5.966 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -2.977 -2.952 -7.642 1.00 0.00 H new ATOM 990 N LEU A 69 -2.706 2.405 -7.906 1.00 0.00 N ATOM 991 CA LEU A 69 -3.352 3.710 -8.109 1.00 0.00 C ATOM 992 C LEU A 69 -4.399 3.558 -9.198 1.00 0.00 C ATOM 993 O LEU A 69 -5.536 3.977 -9.001 1.00 0.00 O ATOM 994 CB LEU A 69 -2.374 4.852 -8.460 1.00 0.00 C ATOM 995 CG LEU A 69 -3.112 6.181 -8.787 1.00 0.00 C ATOM 996 CD1 LEU A 69 -2.351 7.395 -8.256 1.00 0.00 C ATOM 997 CD2 LEU A 69 -3.315 6.410 -10.296 1.00 0.00 C ATOM 0 H LEU A 69 -1.695 2.401 -8.041 1.00 0.00 H new ATOM 0 HA LEU A 69 -3.803 4.002 -7.160 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.693 5.013 -7.625 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.766 4.557 -9.315 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.082 6.079 -8.300 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.898 8.304 -8.504 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.250 7.316 -7.174 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -1.361 7.432 -8.711 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -3.836 7.355 -10.454 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.345 6.443 -10.793 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -3.908 5.595 -10.711 1.00 0.00 H new ATOM 1008 N LYS A 70 -4.013 2.955 -10.328 1.00 0.00 N ATOM 1009 CA LYS A 70 -4.929 2.688 -11.422 1.00 0.00 C ATOM 1010 C LYS A 70 -6.060 1.829 -10.902 1.00 0.00 C ATOM 1011 O LYS A 70 -7.171 2.333 -10.857 1.00 0.00 O ATOM 1012 CB LYS A 70 -4.174 2.142 -12.635 1.00 0.00 C ATOM 1013 CG LYS A 70 -5.055 2.084 -13.885 1.00 0.00 C ATOM 1014 CD LYS A 70 -4.159 1.960 -15.124 1.00 0.00 C ATOM 1015 CE LYS A 70 -4.987 1.923 -16.411 1.00 0.00 C ATOM 1016 NZ LYS A 70 -4.111 1.746 -17.588 1.00 0.00 N ATOM 0 H LYS A 70 -3.058 2.642 -10.501 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.393 3.600 -11.797 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.305 2.770 -12.833 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -3.800 1.143 -12.409 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.736 1.235 -13.826 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.670 2.981 -13.954 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.466 2.801 -15.159 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.557 1.054 -15.051 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.709 1.108 -16.362 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.556 2.847 -16.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -4.690 1.723 -18.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.439 2.538 -17.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.587 0.852 -17.499 1.00 0.00 H new ATOM 1026 N ASP A 71 -5.807 0.597 -10.456 1.00 0.00 N ATOM 1027 CA ASP A 71 -6.854 -0.332 -10.023 1.00 0.00 C ATOM 1028 C ASP A 71 -7.849 0.288 -9.038 1.00 0.00 C ATOM 1029 O ASP A 71 -9.045 0.014 -9.147 1.00 0.00 O ATOM 1030 CB ASP A 71 -6.277 -1.644 -9.460 1.00 0.00 C ATOM 1031 CG ASP A 71 -6.205 -2.735 -10.531 1.00 0.00 C ATOM 1032 OD1 ASP A 71 -5.665 -2.498 -11.633 1.00 0.00 O ATOM 1033 OD2 ASP A 71 -6.751 -3.832 -10.291 1.00 0.00 O ATOM 0 H ASP A 71 -4.865 0.213 -10.384 1.00 0.00 H new ATOM 0 HA ASP A 71 -7.412 -0.569 -10.929 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.280 -1.461 -9.059 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -6.896 -1.988 -8.631 1.00 0.00 H new ATOM 1037 N ALA A 72 -7.393 1.127 -8.104 1.00 0.00 N ATOM 1038 CA ALA A 72 -8.234 1.902 -7.206 1.00 0.00 C ATOM 1039 C ALA A 72 -9.063 2.911 -7.992 1.00 0.00 C ATOM 1040 O ALA A 72 -10.285 2.887 -7.884 1.00 0.00 O ATOM 1041 CB ALA A 72 -7.350 2.609 -6.171 1.00 0.00 C ATOM 0 H ALA A 72 -6.397 1.286 -7.952 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.924 1.236 -6.688 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.976 3.192 -5.495 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -6.793 1.866 -5.600 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -6.652 3.272 -6.681 1.00 0.00 H new ATOM 1047 N LYS A 73 -8.423 3.768 -8.790 1.00 0.00 N ATOM 1048 CA LYS A 73 -9.071 4.759 -9.644 1.00 0.00 C ATOM 1049 C LYS A 73 -10.137 4.122 -10.537 1.00 0.00 C ATOM 1050 O LYS A 73 -11.170 4.764 -10.734 1.00 0.00 O ATOM 1051 CB LYS A 73 -7.980 5.552 -10.402 1.00 0.00 C ATOM 1052 CG LYS A 73 -8.419 6.234 -11.704 1.00 0.00 C ATOM 1053 CD LYS A 73 -8.297 5.289 -12.917 1.00 0.00 C ATOM 1054 CE LYS A 73 -9.487 5.408 -13.875 1.00 0.00 C ATOM 1055 NZ LYS A 73 -9.472 6.663 -14.645 1.00 0.00 N ATOM 0 H LYS A 73 -7.406 3.790 -8.860 1.00 0.00 H new ATOM 0 HA LYS A 73 -9.628 5.477 -9.042 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -7.584 6.315 -9.732 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -7.159 4.872 -10.631 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -9.451 6.570 -11.608 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -7.809 7.122 -11.872 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -7.377 5.512 -13.456 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -8.219 4.260 -12.566 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -9.480 4.563 -14.564 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -10.414 5.347 -13.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -10.298 6.693 -15.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -9.507 7.472 -13.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -8.601 6.713 -15.211 1.00 0.00 H new ATOM 1065 N ILE A 74 -9.943 2.890 -11.031 1.00 0.00 N ATOM 1066 CA ILE A 74 -10.937 2.172 -11.828 1.00 0.00 C ATOM 1067 C ILE A 74 -12.230 2.089 -11.009 1.00 0.00 C ATOM 1068 O ILE A 74 -13.262 2.590 -11.459 1.00 0.00 O ATOM 1069 CB ILE A 74 -10.442 0.770 -12.279 1.00 0.00 C ATOM 1070 CG1 ILE A 74 -9.102 0.813 -13.044 1.00 0.00 C ATOM 1071 CG2 ILE A 74 -11.478 0.126 -13.207 1.00 0.00 C ATOM 1072 CD1 ILE A 74 -8.516 -0.541 -13.441 1.00 0.00 C ATOM 0 H ILE A 74 -9.082 2.363 -10.885 1.00 0.00 H new ATOM 0 HA ILE A 74 -11.119 2.718 -12.754 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.299 0.195 -11.364 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.241 1.406 -13.948 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.371 1.337 -12.428 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -11.125 -0.857 -13.520 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -12.425 0.020 -12.677 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -11.622 0.756 -14.085 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.576 -0.389 -13.972 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -8.335 -1.136 -12.546 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -9.218 -1.065 -14.089 1.00 0.00 H new ATOM 1083 N ASN A 75 -12.161 1.529 -9.793 1.00 0.00 N ATOM 1084 CA ASN A 75 -13.331 1.306 -8.943 1.00 0.00 C ATOM 1085 C ASN A 75 -13.668 2.544 -8.112 1.00 0.00 C ATOM 1086 O ASN A 75 -14.538 2.521 -7.240 1.00 0.00 O ATOM 1087 CB ASN A 75 -13.164 0.041 -8.075 1.00 0.00 C ATOM 1088 CG ASN A 75 -14.521 -0.597 -7.742 1.00 0.00 C ATOM 1089 OD1 ASN A 75 -15.573 -0.164 -8.205 1.00 0.00 O ATOM 1090 ND2 ASN A 75 -14.563 -1.602 -6.886 1.00 0.00 N ATOM 0 H ASN A 75 -11.285 1.218 -9.373 1.00 0.00 H new ATOM 0 HA ASN A 75 -14.186 1.129 -9.596 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -12.540 -0.682 -8.600 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -12.645 0.298 -7.151 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -15.460 -2.007 -6.619 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -13.698 -1.973 -6.492 1.00 0.00 H new ATOM 1096 N GLY A 76 -12.959 3.642 -8.361 1.00 0.00 N ATOM 1097 CA GLY A 76 -13.151 4.929 -7.743 1.00 0.00 C ATOM 1098 C GLY A 76 -12.860 4.883 -6.255 1.00 0.00 C ATOM 1099 O GLY A 76 -13.673 5.356 -5.457 1.00 0.00 O ATOM 0 H GLY A 76 -12.196 3.646 -9.038 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.500 5.663 -8.219 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.177 5.261 -7.904 1.00 0.00 H new ATOM 1103 N LYS A 77 -11.745 4.250 -5.879 1.00 0.00 N ATOM 1104 CA LYS A 77 -11.217 4.272 -4.517 1.00 0.00 C ATOM 1105 C LYS A 77 -10.051 5.274 -4.438 1.00 0.00 C ATOM 1106 O LYS A 77 -9.422 5.575 -5.460 1.00 0.00 O ATOM 1107 CB LYS A 77 -10.793 2.854 -4.105 1.00 0.00 C ATOM 1108 CG LYS A 77 -11.731 1.718 -4.545 1.00 0.00 C ATOM 1109 CD LYS A 77 -13.130 1.785 -3.922 1.00 0.00 C ATOM 1110 CE LYS A 77 -13.945 0.590 -4.418 1.00 0.00 C ATOM 1111 NZ LYS A 77 -15.305 0.560 -3.858 1.00 0.00 N ATOM 0 H LYS A 77 -11.177 3.700 -6.524 1.00 0.00 H new ATOM 0 HA LYS A 77 -11.985 4.600 -3.817 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -9.801 2.659 -4.514 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -10.702 2.824 -3.019 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -11.827 1.740 -5.631 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.274 0.763 -4.285 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.060 1.770 -2.834 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -13.622 2.718 -4.197 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -14.005 0.622 -5.506 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -13.427 -0.332 -4.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -15.392 -0.240 -3.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -15.491 1.448 -3.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -15.995 0.451 -4.628 1.00 0.00 H new ATOM 1121 N GLU A 78 -9.745 5.799 -3.248 1.00 0.00 N ATOM 1122 CA GLU A 78 -8.475 6.471 -2.965 1.00 0.00 C ATOM 1123 C GLU A 78 -7.412 5.410 -2.616 1.00 0.00 C ATOM 1124 O GLU A 78 -7.691 4.212 -2.540 1.00 0.00 O ATOM 1125 CB GLU A 78 -8.618 7.552 -1.860 1.00 0.00 C ATOM 1126 CG GLU A 78 -7.459 8.574 -1.909 1.00 0.00 C ATOM 1127 CD GLU A 78 -7.773 9.965 -1.336 1.00 0.00 C ATOM 1128 OE1 GLU A 78 -8.769 10.602 -1.757 1.00 0.00 O ATOM 1129 OE2 GLU A 78 -6.984 10.454 -0.494 1.00 0.00 O ATOM 0 H GLU A 78 -10.377 5.769 -2.448 1.00 0.00 H new ATOM 0 HA GLU A 78 -8.152 7.010 -3.856 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -9.568 8.073 -1.981 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -8.639 7.072 -0.882 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.611 8.160 -1.364 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.146 8.691 -2.946 1.00 0.00 H new ATOM 1134 N PHE A 79 -6.176 5.842 -2.404 1.00 0.00 N ATOM 1135 CA PHE A 79 -5.005 5.050 -2.072 1.00 0.00 C ATOM 1136 C PHE A 79 -4.102 5.966 -1.242 1.00 0.00 C ATOM 1137 O PHE A 79 -3.889 7.110 -1.650 1.00 0.00 O ATOM 1138 CB PHE A 79 -4.334 4.640 -3.384 1.00 0.00 C ATOM 1139 CG PHE A 79 -2.856 4.359 -3.245 1.00 0.00 C ATOM 1140 CD1 PHE A 79 -2.409 3.083 -2.854 1.00 0.00 C ATOM 1141 CD2 PHE A 79 -1.938 5.417 -3.380 1.00 0.00 C ATOM 1142 CE1 PHE A 79 -1.043 2.872 -2.601 1.00 0.00 C ATOM 1143 CE2 PHE A 79 -0.584 5.214 -3.081 1.00 0.00 C ATOM 1144 CZ PHE A 79 -0.133 3.938 -2.717 1.00 0.00 C ATOM 0 H PHE A 79 -5.951 6.835 -2.465 1.00 0.00 H new ATOM 0 HA PHE A 79 -5.235 4.145 -1.510 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.829 3.751 -3.773 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -4.477 5.432 -4.119 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.112 2.270 -2.749 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.277 6.386 -3.714 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.692 1.891 -2.317 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.111 6.039 -3.131 1.00 0.00 H new ATOM 0 HZ PHE A 79 0.917 3.773 -2.525 1.00 0.00 H new ATOM 1153 N ILE A 80 -3.619 5.528 -0.076 1.00 0.00 N ATOM 1154 CA ILE A 80 -2.751 6.305 0.816 1.00 0.00 C ATOM 1155 C ILE A 80 -1.804 5.307 1.501 1.00 0.00 C ATOM 1156 O ILE A 80 -2.213 4.166 1.712 1.00 0.00 O ATOM 1157 CB ILE A 80 -3.602 7.104 1.850 1.00 0.00 C ATOM 1158 CG1 ILE A 80 -4.684 8.000 1.194 1.00 0.00 C ATOM 1159 CG2 ILE A 80 -2.689 7.986 2.716 1.00 0.00 C ATOM 1160 CD1 ILE A 80 -5.812 8.493 2.103 1.00 0.00 C ATOM 0 H ILE A 80 -3.826 4.597 0.285 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.173 7.044 0.261 1.00 0.00 H new ATOM 0 HB ILE A 80 -4.116 6.360 2.458 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.189 8.870 0.763 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -5.130 7.446 0.368 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -3.293 8.540 3.435 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.976 7.358 3.249 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.150 8.687 2.079 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -6.502 9.108 1.526 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -6.347 7.638 2.516 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -5.392 9.085 2.916 1.00 0.00 H new ATOM 1171 N LEU A 81 -0.581 5.703 1.873 1.00 0.00 N ATOM 1172 CA LEU A 81 0.405 4.852 2.548 1.00 0.00 C ATOM 1173 C LEU A 81 0.765 5.466 3.896 1.00 0.00 C ATOM 1174 O LEU A 81 1.264 6.592 3.954 1.00 0.00 O ATOM 1175 CB LEU A 81 1.705 4.801 1.729 1.00 0.00 C ATOM 1176 CG LEU A 81 1.612 4.329 0.274 1.00 0.00 C ATOM 1177 CD1 LEU A 81 3.022 4.446 -0.316 1.00 0.00 C ATOM 1178 CD2 LEU A 81 1.059 2.907 0.147 1.00 0.00 C ATOM 0 H LEU A 81 -0.241 6.650 1.708 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.024 3.857 2.662 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.142 5.800 1.730 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.404 4.147 2.250 1.00 0.00 H new ATOM 0 HG LEU A 81 0.905 4.950 -0.276 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.009 4.120 -1.356 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.353 5.483 -0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.708 3.818 0.253 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.016 2.626 -0.905 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.710 2.214 0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.057 2.867 0.575 1.00 0.00 H new ATOM 1189 N SER A 82 0.607 4.714 4.974 1.00 0.00 N ATOM 1190 CA SER A 82 0.849 5.172 6.332 1.00 0.00 C ATOM 1191 C SER A 82 1.831 4.250 7.060 1.00 0.00 C ATOM 1192 O SER A 82 2.073 3.119 6.641 1.00 0.00 O ATOM 1193 CB SER A 82 -0.515 5.373 7.008 1.00 0.00 C ATOM 1194 OG SER A 82 -0.838 6.745 6.984 1.00 0.00 O ATOM 0 H SER A 82 0.299 3.743 4.927 1.00 0.00 H new ATOM 0 HA SER A 82 1.356 6.137 6.355 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.281 4.796 6.490 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.484 5.011 8.036 1.00 0.00 H new ATOM 0 HG SER A 82 -1.667 6.895 7.484 1.00 0.00 H new ATOM 1199 N SER A 83 2.431 4.747 8.140 1.00 0.00 N ATOM 1200 CA SER A 83 3.483 4.090 8.910 1.00 0.00 C ATOM 1201 C SER A 83 4.700 3.640 8.064 1.00 0.00 C ATOM 1202 O SER A 83 5.364 2.656 8.402 1.00 0.00 O ATOM 1203 CB SER A 83 2.832 2.962 9.731 1.00 0.00 C ATOM 1204 OG SER A 83 3.647 2.548 10.813 1.00 0.00 O ATOM 0 H SER A 83 2.185 5.661 8.519 1.00 0.00 H new ATOM 0 HA SER A 83 3.934 4.812 9.591 1.00 0.00 H new ATOM 0 HB2 SER A 83 1.869 3.302 10.113 1.00 0.00 H new ATOM 0 HB3 SER A 83 2.634 2.110 9.081 1.00 0.00 H new ATOM 0 HG SER A 83 4.580 2.495 10.518 1.00 0.00 H new ATOM 1209 N LEU A 84 5.028 4.326 6.965 1.00 0.00 N ATOM 1210 CA LEU A 84 6.221 4.045 6.167 1.00 0.00 C ATOM 1211 C LEU A 84 7.455 4.295 7.012 1.00 0.00 C ATOM 1212 O LEU A 84 7.670 5.410 7.500 1.00 0.00 O ATOM 1213 CB LEU A 84 6.294 4.928 4.908 1.00 0.00 C ATOM 1214 CG LEU A 84 5.352 4.454 3.790 1.00 0.00 C ATOM 1215 CD1 LEU A 84 5.023 5.595 2.824 1.00 0.00 C ATOM 1216 CD2 LEU A 84 5.976 3.281 3.019 1.00 0.00 C ATOM 0 H LEU A 84 4.467 5.097 6.603 1.00 0.00 H new ATOM 0 HA LEU A 84 6.170 3.004 5.848 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.045 5.955 5.175 1.00 0.00 H new ATOM 0 HB3 LEU A 84 7.318 4.936 4.535 1.00 0.00 H new ATOM 0 HG LEU A 84 4.426 4.120 4.257 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.355 5.230 2.044 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.537 6.404 3.369 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.943 5.964 2.371 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.294 2.959 2.232 1.00 0.00 H new ATOM 0 HD22 LEU A 84 6.919 3.598 2.575 1.00 0.00 H new ATOM 0 HD23 LEU A 84 6.158 2.452 3.703 1.00 0.00 H new ATOM 1227 N LYS A 85 8.287 3.259 7.151 1.00 0.00 N ATOM 1228 CA LYS A 85 9.554 3.349 7.843 1.00 0.00 C ATOM 1229 C LYS A 85 10.429 4.338 7.150 1.00 0.00 C ATOM 1230 O LYS A 85 10.344 4.540 5.937 1.00 0.00 O ATOM 1231 CB LYS A 85 10.270 2.005 7.927 1.00 0.00 C ATOM 1232 CG LYS A 85 9.456 1.015 8.742 1.00 0.00 C ATOM 1233 CD LYS A 85 10.395 -0.040 9.333 1.00 0.00 C ATOM 1234 CE LYS A 85 9.536 -1.125 9.955 1.00 0.00 C ATOM 1235 NZ LYS A 85 10.293 -2.073 10.796 1.00 0.00 N ATOM 0 H LYS A 85 8.088 2.330 6.779 1.00 0.00 H new ATOM 0 HA LYS A 85 9.347 3.671 8.864 1.00 0.00 H new ATOM 0 HB2 LYS A 85 10.434 1.611 6.924 1.00 0.00 H new ATOM 0 HB3 LYS A 85 11.252 2.138 8.381 1.00 0.00 H new ATOM 0 HG2 LYS A 85 8.923 1.533 9.539 1.00 0.00 H new ATOM 0 HG3 LYS A 85 8.704 0.539 8.113 1.00 0.00 H new ATOM 0 HD2 LYS A 85 11.037 -0.458 8.558 1.00 0.00 H new ATOM 0 HD3 LYS A 85 11.049 0.407 10.082 1.00 0.00 H new ATOM 0 HE2 LYS A 85 8.758 -0.658 10.559 1.00 0.00 H new ATOM 0 HE3 LYS A 85 9.034 -1.678 9.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 9.629 -2.678 11.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 10.899 -2.665 10.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 10.885 -1.545 11.469 1.00 0.00 H new ATOM 1245 N GLU A 86 11.373 4.844 7.920 1.00 0.00 N ATOM 1246 CA GLU A 86 12.296 5.838 7.420 1.00 0.00 C ATOM 1247 C GLU A 86 13.087 5.253 6.249 1.00 0.00 C ATOM 1248 O GLU A 86 13.376 5.929 5.266 1.00 0.00 O ATOM 1249 CB GLU A 86 13.239 6.243 8.561 1.00 0.00 C ATOM 1250 CG GLU A 86 14.089 7.481 8.270 1.00 0.00 C ATOM 1251 CD GLU A 86 13.309 8.767 8.515 1.00 0.00 C ATOM 1252 OE1 GLU A 86 12.614 9.220 7.582 1.00 0.00 O ATOM 1253 OE2 GLU A 86 13.465 9.343 9.621 1.00 0.00 O ATOM 0 H GLU A 86 11.519 4.581 8.895 1.00 0.00 H new ATOM 0 HA GLU A 86 11.758 6.718 7.067 1.00 0.00 H new ATOM 0 HB2 GLU A 86 12.647 6.427 9.457 1.00 0.00 H new ATOM 0 HB3 GLU A 86 13.902 5.406 8.783 1.00 0.00 H new ATOM 0 HG2 GLU A 86 14.978 7.469 8.900 1.00 0.00 H new ATOM 0 HG3 GLU A 86 14.431 7.453 7.235 1.00 0.00 H new ATOM 1258 N SER A 87 13.392 3.957 6.322 1.00 0.00 N ATOM 1259 CA SER A 87 14.149 3.273 5.281 1.00 0.00 C ATOM 1260 C SER A 87 13.367 3.066 3.990 1.00 0.00 C ATOM 1261 O SER A 87 13.979 2.726 2.987 1.00 0.00 O ATOM 1262 CB SER A 87 14.705 1.951 5.810 1.00 0.00 C ATOM 1263 OG SER A 87 15.576 2.208 6.901 1.00 0.00 O ATOM 0 H SER A 87 13.122 3.357 7.101 1.00 0.00 H new ATOM 0 HA SER A 87 14.977 3.931 5.017 1.00 0.00 H new ATOM 0 HB2 SER A 87 13.889 1.302 6.127 1.00 0.00 H new ATOM 0 HB3 SER A 87 15.241 1.427 5.019 1.00 0.00 H new ATOM 0 HG SER A 87 15.932 1.361 7.242 1.00 0.00 H new ATOM 1268 N ILE A 88 12.057 3.308 3.981 1.00 0.00 N ATOM 1269 CA ILE A 88 11.185 2.992 2.870 1.00 0.00 C ATOM 1270 C ILE A 88 10.640 4.299 2.321 1.00 0.00 C ATOM 1271 O ILE A 88 10.606 4.513 1.112 1.00 0.00 O ATOM 1272 CB ILE A 88 10.069 2.046 3.334 1.00 0.00 C ATOM 1273 CG1 ILE A 88 10.595 0.801 4.083 1.00 0.00 C ATOM 1274 CG2 ILE A 88 9.244 1.657 2.101 1.00 0.00 C ATOM 1275 CD1 ILE A 88 11.522 -0.103 3.273 1.00 0.00 C ATOM 0 H ILE A 88 11.570 3.739 4.767 1.00 0.00 H new ATOM 0 HA ILE A 88 11.726 2.475 2.078 1.00 0.00 H new ATOM 0 HB ILE A 88 9.448 2.566 4.063 1.00 0.00 H new ATOM 0 HG12 ILE A 88 11.126 1.131 4.976 1.00 0.00 H new ATOM 0 HG13 ILE A 88 9.742 0.212 4.419 1.00 0.00 H new ATOM 0 HG21 ILE A 88 8.441 0.983 2.399 1.00 0.00 H new ATOM 0 HG22 ILE A 88 8.818 2.553 1.651 1.00 0.00 H new ATOM 0 HG23 ILE A 88 9.887 1.158 1.376 1.00 0.00 H new ATOM 0 HD11 ILE A 88 11.836 -0.947 3.888 1.00 0.00 H new ATOM 0 HD12 ILE A 88 10.994 -0.471 2.393 1.00 0.00 H new ATOM 0 HD13 ILE A 88 12.399 0.463 2.959 1.00 0.00 H new ATOM 1286 N SER A 89 10.275 5.219 3.208 1.00 0.00 N ATOM 1287 CA SER A 89 9.826 6.527 2.785 1.00 0.00 C ATOM 1288 C SER A 89 10.963 7.254 2.054 1.00 0.00 C ATOM 1289 O SER A 89 10.764 7.798 0.966 1.00 0.00 O ATOM 1290 CB SER A 89 9.265 7.337 3.961 1.00 0.00 C ATOM 1291 OG SER A 89 7.937 7.715 3.671 1.00 0.00 O ATOM 0 H SER A 89 10.283 5.078 4.218 1.00 0.00 H new ATOM 0 HA SER A 89 9.000 6.410 2.083 1.00 0.00 H new ATOM 0 HB2 SER A 89 9.296 6.743 4.875 1.00 0.00 H new ATOM 0 HB3 SER A 89 9.878 8.221 4.135 1.00 0.00 H new ATOM 0 HG SER A 89 7.573 8.232 4.420 1.00 0.00 H new ATOM 1296 N ARG A 90 12.198 7.174 2.575 1.00 0.00 N ATOM 1297 CA ARG A 90 13.374 7.660 1.855 1.00 0.00 C ATOM 1298 C ARG A 90 13.532 6.983 0.500 1.00 0.00 C ATOM 1299 O ARG A 90 13.969 7.628 -0.438 1.00 0.00 O ATOM 1300 CB ARG A 90 14.634 7.483 2.702 1.00 0.00 C ATOM 1301 CG ARG A 90 15.273 6.103 2.546 1.00 0.00 C ATOM 1302 CD ARG A 90 16.324 5.890 3.600 1.00 0.00 C ATOM 1303 NE ARG A 90 17.573 6.626 3.347 1.00 0.00 N ATOM 1304 CZ ARG A 90 18.751 6.296 3.883 1.00 0.00 C ATOM 1305 NH1 ARG A 90 18.832 5.341 4.805 1.00 0.00 N ATOM 1306 NH2 ARG A 90 19.852 6.920 3.497 1.00 0.00 N ATOM 0 H ARG A 90 12.402 6.777 3.492 1.00 0.00 H new ATOM 0 HA ARG A 90 13.227 8.724 1.668 1.00 0.00 H new ATOM 0 HB2 ARG A 90 15.361 8.247 2.425 1.00 0.00 H new ATOM 0 HB3 ARG A 90 14.385 7.645 3.751 1.00 0.00 H new ATOM 0 HG2 ARG A 90 14.508 5.330 2.624 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.718 6.011 1.555 1.00 0.00 H new ATOM 0 HD2 ARG A 90 15.923 6.194 4.567 1.00 0.00 H new ATOM 0 HD3 ARG A 90 16.547 4.825 3.668 1.00 0.00 H new ATOM 0 HE ARG A 90 17.537 7.435 2.727 1.00 0.00 H new ATOM 0 HH11 ARG A 90 17.990 4.853 5.109 1.00 0.00 H new ATOM 0 HH12 ARG A 90 19.737 5.097 5.208 1.00 0.00 H new ATOM 0 HH21 ARG A 90 19.801 7.653 2.790 1.00 0.00 H new ATOM 0 HH22 ARG A 90 20.751 6.668 3.907 1.00 0.00 H new ATOM 1317 N ILE A 91 13.230 5.688 0.391 1.00 0.00 N ATOM 1318 CA ILE A 91 13.426 4.906 -0.817 1.00 0.00 C ATOM 1319 C ILE A 91 12.475 5.457 -1.882 1.00 0.00 C ATOM 1320 O ILE A 91 12.877 5.715 -3.020 1.00 0.00 O ATOM 1321 CB ILE A 91 13.179 3.412 -0.483 1.00 0.00 C ATOM 1322 CG1 ILE A 91 14.520 2.708 -0.225 1.00 0.00 C ATOM 1323 CG2 ILE A 91 12.351 2.677 -1.548 1.00 0.00 C ATOM 1324 CD1 ILE A 91 14.360 1.255 0.242 1.00 0.00 C ATOM 0 H ILE A 91 12.834 5.148 1.160 1.00 0.00 H new ATOM 0 HA ILE A 91 14.441 4.978 -1.207 1.00 0.00 H new ATOM 0 HB ILE A 91 12.575 3.379 0.424 1.00 0.00 H new ATOM 0 HG12 ILE A 91 15.114 2.726 -1.139 1.00 0.00 H new ATOM 0 HG13 ILE A 91 15.077 3.266 0.528 1.00 0.00 H new ATOM 0 HG21 ILE A 91 12.216 1.637 -1.251 1.00 0.00 H new ATOM 0 HG22 ILE A 91 11.377 3.156 -1.645 1.00 0.00 H new ATOM 0 HG23 ILE A 91 12.872 2.716 -2.505 1.00 0.00 H new ATOM 0 HD11 ILE A 91 15.344 0.815 0.406 1.00 0.00 H new ATOM 0 HD12 ILE A 91 13.792 1.232 1.172 1.00 0.00 H new ATOM 0 HD13 ILE A 91 13.830 0.684 -0.520 1.00 0.00 H new ATOM 1335 N LEU A 92 11.209 5.664 -1.501 1.00 0.00 N ATOM 1336 CA LEU A 92 10.202 6.248 -2.365 1.00 0.00 C ATOM 1337 C LEU A 92 10.701 7.631 -2.770 1.00 0.00 C ATOM 1338 O LEU A 92 10.778 7.941 -3.951 1.00 0.00 O ATOM 1339 CB LEU A 92 8.835 6.300 -1.655 1.00 0.00 C ATOM 1340 CG LEU A 92 8.226 4.908 -1.345 1.00 0.00 C ATOM 1341 CD1 LEU A 92 7.183 4.988 -0.226 1.00 0.00 C ATOM 1342 CD2 LEU A 92 7.595 4.236 -2.574 1.00 0.00 C ATOM 0 H LEU A 92 10.861 5.425 -0.572 1.00 0.00 H new ATOM 0 HA LEU A 92 10.050 5.641 -3.258 1.00 0.00 H new ATOM 0 HB2 LEU A 92 8.944 6.852 -0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.136 6.859 -2.277 1.00 0.00 H new ATOM 0 HG LEU A 92 9.065 4.293 -1.021 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.777 3.995 -0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 92 7.651 5.369 0.681 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.377 5.657 -0.527 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.187 3.266 -2.289 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.795 4.866 -2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.355 4.099 -3.344 1.00 0.00 H new ATOM 1353 N LYS A 93 11.132 8.468 -1.829 1.00 0.00 N ATOM 1354 CA LYS A 93 11.593 9.813 -2.111 1.00 0.00 C ATOM 1355 C LYS A 93 12.779 9.824 -3.074 1.00 0.00 C ATOM 1356 O LYS A 93 12.818 10.645 -3.994 1.00 0.00 O ATOM 1357 CB LYS A 93 11.907 10.420 -0.746 1.00 0.00 C ATOM 1358 CG LYS A 93 12.603 11.767 -0.830 1.00 0.00 C ATOM 1359 CD LYS A 93 11.850 12.911 -0.157 1.00 0.00 C ATOM 1360 CE LYS A 93 11.755 12.703 1.353 1.00 0.00 C ATOM 1361 NZ LYS A 93 11.038 13.820 2.009 1.00 0.00 N ATOM 0 H LYS A 93 11.169 8.222 -0.840 1.00 0.00 H new ATOM 0 HA LYS A 93 10.840 10.406 -2.631 1.00 0.00 H new ATOM 0 HB2 LYS A 93 10.979 10.533 -0.185 1.00 0.00 H new ATOM 0 HB3 LYS A 93 12.536 9.729 -0.185 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.590 11.681 -0.375 1.00 0.00 H new ATOM 0 HG3 LYS A 93 12.757 12.018 -1.880 1.00 0.00 H new ATOM 0 HD2 LYS A 93 12.356 13.854 -0.365 1.00 0.00 H new ATOM 0 HD3 LYS A 93 10.848 12.987 -0.579 1.00 0.00 H new ATOM 0 HE2 LYS A 93 11.239 11.766 1.561 1.00 0.00 H new ATOM 0 HE3 LYS A 93 12.757 12.615 1.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 10.991 13.648 3.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 11.545 14.710 1.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 10.074 13.887 1.624 1.00 0.00 H new ATOM 1371 N LEU A 94 13.742 8.930 -2.866 1.00 0.00 N ATOM 1372 CA LEU A 94 14.894 8.705 -3.723 1.00 0.00 C ATOM 1373 C LEU A 94 14.396 8.458 -5.137 1.00 0.00 C ATOM 1374 O LEU A 94 14.633 9.283 -6.019 1.00 0.00 O ATOM 1375 CB LEU A 94 15.740 7.544 -3.160 1.00 0.00 C ATOM 1376 CG LEU A 94 16.704 7.993 -2.046 1.00 0.00 C ATOM 1377 CD1 LEU A 94 17.347 6.764 -1.392 1.00 0.00 C ATOM 1378 CD2 LEU A 94 17.797 8.899 -2.612 1.00 0.00 C ATOM 0 H LEU A 94 13.736 8.314 -2.053 1.00 0.00 H new ATOM 0 HA LEU A 94 15.549 9.576 -3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 94 15.076 6.772 -2.770 1.00 0.00 H new ATOM 0 HB3 LEU A 94 16.313 7.092 -3.970 1.00 0.00 H new ATOM 0 HG LEU A 94 16.136 8.551 -1.301 1.00 0.00 H new ATOM 0 HD11 LEU A 94 18.028 7.086 -0.604 1.00 0.00 H new ATOM 0 HD12 LEU A 94 16.570 6.131 -0.963 1.00 0.00 H new ATOM 0 HD13 LEU A 94 17.901 6.200 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU A 94 18.468 9.205 -1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 94 18.362 8.357 -3.370 1.00 0.00 H new ATOM 0 HD23 LEU A 94 17.342 9.782 -3.061 1.00 0.00 H new ATOM 1389 N THR A 95 13.598 7.413 -5.330 1.00 0.00 N ATOM 1390 CA THR A 95 13.045 6.991 -6.618 1.00 0.00 C ATOM 1391 C THR A 95 11.944 7.917 -7.164 1.00 0.00 C ATOM 1392 O THR A 95 11.164 7.533 -8.029 1.00 0.00 O ATOM 1393 CB THR A 95 12.584 5.519 -6.521 1.00 0.00 C ATOM 1394 OG1 THR A 95 13.308 4.771 -5.554 1.00 0.00 O ATOM 1395 CG2 THR A 95 12.803 4.795 -7.851 1.00 0.00 C ATOM 0 H THR A 95 13.305 6.809 -4.562 1.00 0.00 H new ATOM 0 HA THR A 95 13.843 7.069 -7.356 1.00 0.00 H new ATOM 0 HB THR A 95 11.531 5.571 -6.243 1.00 0.00 H new ATOM 0 HG1 THR A 95 13.014 5.027 -4.655 1.00 0.00 H new ATOM 0 HG21 THR A 95 12.472 3.760 -7.761 1.00 0.00 H new ATOM 0 HG22 THR A 95 12.231 5.292 -8.634 1.00 0.00 H new ATOM 0 HG23 THR A 95 13.862 4.816 -8.107 1.00 0.00 H new ATOM 1403 N HIS A 96 11.871 9.151 -6.663 1.00 0.00 N ATOM 1404 CA HIS A 96 10.868 10.162 -6.957 1.00 0.00 C ATOM 1405 C HIS A 96 9.446 9.621 -6.921 1.00 0.00 C ATOM 1406 O HIS A 96 8.616 10.017 -7.725 1.00 0.00 O ATOM 1407 CB HIS A 96 11.105 10.897 -8.286 1.00 0.00 C ATOM 1408 CG HIS A 96 12.443 11.567 -8.472 1.00 0.00 C ATOM 1409 ND1 HIS A 96 13.681 11.194 -7.966 1.00 0.00 N ATOM 1410 CD2 HIS A 96 12.640 12.630 -9.301 1.00 0.00 C ATOM 1411 CE1 HIS A 96 14.598 12.033 -8.477 1.00 0.00 C ATOM 1412 NE2 HIS A 96 13.987 12.915 -9.287 1.00 0.00 N ATOM 0 H HIS A 96 12.563 9.489 -5.994 1.00 0.00 H new ATOM 0 HA HIS A 96 10.982 10.886 -6.150 1.00 0.00 H new ATOM 0 HB2 HIS A 96 10.970 10.181 -9.097 1.00 0.00 H new ATOM 0 HB3 HIS A 96 10.329 11.655 -8.396 1.00 0.00 H new ATOM 0 HD1 HIS A 96 13.862 10.423 -7.323 1.00 0.00 H new ATOM 0 HD2 HIS A 96 11.881 13.152 -9.864 1.00 0.00 H new ATOM 0 HE1 HIS A 96 15.658 12.003 -8.270 1.00 0.00 H new ATOM 1420 N LEU A 97 9.173 8.741 -5.975 1.00 0.00 N ATOM 1421 CA LEU A 97 7.943 8.003 -5.800 1.00 0.00 C ATOM 1422 C LEU A 97 7.100 8.652 -4.714 1.00 0.00 C ATOM 1423 O LEU A 97 5.889 8.479 -4.717 1.00 0.00 O ATOM 1424 CB LEU A 97 8.307 6.551 -5.421 1.00 0.00 C ATOM 1425 CG LEU A 97 7.813 5.459 -6.368 1.00 0.00 C ATOM 1426 CD1 LEU A 97 6.295 5.414 -6.426 1.00 0.00 C ATOM 1427 CD2 LEU A 97 8.404 5.578 -7.769 1.00 0.00 C ATOM 0 H LEU A 97 9.859 8.509 -5.257 1.00 0.00 H new ATOM 0 HA LEU A 97 7.359 8.006 -6.720 1.00 0.00 H new ATOM 0 HB2 LEU A 97 9.392 6.478 -5.351 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.909 6.347 -4.427 1.00 0.00 H new ATOM 0 HG LEU A 97 8.169 4.516 -5.952 1.00 0.00 H new ATOM 0 HD11 LEU A 97 5.980 4.625 -7.109 1.00 0.00 H new ATOM 0 HD12 LEU A 97 5.899 5.211 -5.431 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.916 6.373 -6.779 1.00 0.00 H new ATOM 0 HD21 LEU A 97 8.017 4.775 -8.397 1.00 0.00 H new ATOM 0 HD22 LEU A 97 8.128 6.541 -8.200 1.00 0.00 H new ATOM 0 HD23 LEU A 97 9.490 5.503 -7.713 1.00 0.00 H new ATOM 1438 N ASP A 98 7.700 9.399 -3.779 1.00 0.00 N ATOM 1439 CA ASP A 98 6.936 10.098 -2.743 1.00 0.00 C ATOM 1440 C ASP A 98 6.073 11.189 -3.388 1.00 0.00 C ATOM 1441 O ASP A 98 4.860 11.217 -3.201 1.00 0.00 O ATOM 1442 CB ASP A 98 7.847 10.633 -1.622 1.00 0.00 C ATOM 1443 CG ASP A 98 8.451 12.008 -1.914 1.00 0.00 C ATOM 1444 OD1 ASP A 98 9.250 12.121 -2.869 1.00 0.00 O ATOM 1445 OD2 ASP A 98 8.089 12.979 -1.212 1.00 0.00 O ATOM 0 H ASP A 98 8.709 9.534 -3.720 1.00 0.00 H new ATOM 0 HA ASP A 98 6.266 9.390 -2.256 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.273 10.689 -0.697 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.655 9.921 -1.454 1.00 0.00 H new ATOM 1449 N LYS A 99 6.694 12.012 -4.238 1.00 0.00 N ATOM 1450 CA LYS A 99 6.141 13.154 -4.969 1.00 0.00 C ATOM 1451 C LYS A 99 5.029 12.851 -5.967 1.00 0.00 C ATOM 1452 O LYS A 99 4.610 13.750 -6.695 1.00 0.00 O ATOM 1453 CB LYS A 99 7.270 13.962 -5.611 1.00 0.00 C ATOM 1454 CG LYS A 99 8.159 13.145 -6.537 1.00 0.00 C ATOM 1455 CD LYS A 99 9.560 13.792 -6.565 1.00 0.00 C ATOM 1456 CE LYS A 99 10.415 13.343 -5.375 1.00 0.00 C ATOM 1457 NZ LYS A 99 10.344 14.261 -4.215 1.00 0.00 N ATOM 0 H LYS A 99 7.683 11.884 -4.450 1.00 0.00 H new ATOM 0 HA LYS A 99 5.631 13.748 -4.210 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.838 14.789 -6.174 1.00 0.00 H new ATOM 0 HB3 LYS A 99 7.885 14.399 -4.824 1.00 0.00 H new ATOM 0 HG2 LYS A 99 8.224 12.114 -6.188 1.00 0.00 H new ATOM 0 HG3 LYS A 99 7.735 13.115 -7.541 1.00 0.00 H new ATOM 0 HD2 LYS A 99 10.064 13.529 -7.495 1.00 0.00 H new ATOM 0 HD3 LYS A 99 9.460 14.877 -6.553 1.00 0.00 H new ATOM 0 HE2 LYS A 99 10.094 12.350 -5.062 1.00 0.00 H new ATOM 0 HE3 LYS A 99 11.453 13.256 -5.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 11.307 14.506 -3.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 9.837 15.127 -4.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 9.839 13.795 -3.434 1.00 0.00 H new ATOM 1467 N ILE A 100 4.596 11.604 -6.057 1.00 0.00 N ATOM 1468 CA ILE A 100 3.648 11.121 -7.030 1.00 0.00 C ATOM 1469 C ILE A 100 2.668 10.119 -6.381 1.00 0.00 C ATOM 1470 O ILE A 100 1.904 9.477 -7.103 1.00 0.00 O ATOM 1471 CB ILE A 100 4.457 10.552 -8.216 1.00 0.00 C ATOM 1472 CG1 ILE A 100 5.526 9.544 -7.805 1.00 0.00 C ATOM 1473 CG2 ILE A 100 5.176 11.649 -9.034 1.00 0.00 C ATOM 1474 CD1 ILE A 100 5.989 8.690 -8.996 1.00 0.00 C ATOM 0 H ILE A 100 4.915 10.873 -5.421 1.00 0.00 H new ATOM 0 HA ILE A 100 3.009 11.918 -7.412 1.00 0.00 H new ATOM 0 HB ILE A 100 3.696 10.057 -8.819 1.00 0.00 H new ATOM 0 HG12 ILE A 100 6.380 10.072 -7.382 1.00 0.00 H new ATOM 0 HG13 ILE A 100 5.133 8.895 -7.023 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.728 11.189 -9.854 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.439 12.344 -9.437 1.00 0.00 H new ATOM 0 HG23 ILE A 100 5.869 12.189 -8.388 1.00 0.00 H new ATOM 0 HD11 ILE A 100 6.750 7.984 -8.664 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.139 8.142 -9.403 1.00 0.00 H new ATOM 0 HD13 ILE A 100 6.406 9.337 -9.767 1.00 0.00 H new ATOM 1485 N PHE A 101 2.698 9.963 -5.049 1.00 0.00 N ATOM 1486 CA PHE A 101 1.906 9.093 -4.165 1.00 0.00 C ATOM 1487 C PHE A 101 1.378 9.919 -2.967 1.00 0.00 C ATOM 1488 O PHE A 101 1.491 11.148 -2.972 1.00 0.00 O ATOM 1489 CB PHE A 101 2.832 7.982 -3.653 1.00 0.00 C ATOM 1490 CG PHE A 101 2.964 6.722 -4.489 1.00 0.00 C ATOM 1491 CD1 PHE A 101 3.202 6.739 -5.875 1.00 0.00 C ATOM 1492 CD2 PHE A 101 2.885 5.482 -3.844 1.00 0.00 C ATOM 1493 CE1 PHE A 101 3.267 5.554 -6.617 1.00 0.00 C ATOM 1494 CE2 PHE A 101 3.017 4.293 -4.555 1.00 0.00 C ATOM 1495 CZ PHE A 101 3.180 4.340 -5.939 1.00 0.00 C ATOM 0 H PHE A 101 3.359 10.511 -4.499 1.00 0.00 H new ATOM 0 HA PHE A 101 1.058 8.669 -4.702 1.00 0.00 H new ATOM 0 HB2 PHE A 101 3.828 8.407 -3.531 1.00 0.00 H new ATOM 0 HB3 PHE A 101 2.486 7.690 -2.661 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.337 7.686 -6.377 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.719 5.448 -2.777 1.00 0.00 H new ATOM 0 HE1 PHE A 101 3.382 5.580 -7.691 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.993 3.344 -4.040 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.240 3.417 -6.496 1.00 0.00 H new ATOM 1504 N LYS A 102 0.804 9.279 -1.932 1.00 0.00 N ATOM 1505 CA LYS A 102 0.388 9.921 -0.682 1.00 0.00 C ATOM 1506 C LYS A 102 0.969 9.183 0.501 1.00 0.00 C ATOM 1507 O LYS A 102 0.910 7.952 0.517 1.00 0.00 O ATOM 1508 CB LYS A 102 -1.142 9.974 -0.608 1.00 0.00 C ATOM 1509 CG LYS A 102 -1.674 10.909 0.491 1.00 0.00 C ATOM 1510 CD LYS A 102 -3.119 11.344 0.206 1.00 0.00 C ATOM 1511 CE LYS A 102 -3.927 11.475 1.500 1.00 0.00 C ATOM 1512 NZ LYS A 102 -5.335 11.835 1.234 1.00 0.00 N ATOM 0 H LYS A 102 0.614 8.277 -1.947 1.00 0.00 H new ATOM 0 HA LYS A 102 0.766 10.943 -0.657 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.533 10.301 -1.572 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.524 8.968 -0.434 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.628 10.403 1.455 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.035 11.789 0.563 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.116 12.298 -0.322 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.597 10.617 -0.451 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -3.890 10.534 2.048 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.472 12.233 2.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.909 11.637 2.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -5.397 12.847 1.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -5.691 11.275 0.433 1.00 0.00 H new ATOM 1522 N ILE A 103 1.505 9.944 1.452 1.00 0.00 N ATOM 1523 CA ILE A 103 2.183 9.463 2.636 1.00 0.00 C ATOM 1524 C ILE A 103 1.605 10.165 3.862 1.00 0.00 C ATOM 1525 O ILE A 103 1.562 11.397 3.884 1.00 0.00 O ATOM 1526 CB ILE A 103 3.717 9.677 2.510 1.00 0.00 C ATOM 1527 CG1 ILE A 103 4.333 8.833 1.365 1.00 0.00 C ATOM 1528 CG2 ILE A 103 4.440 9.330 3.827 1.00 0.00 C ATOM 1529 CD1 ILE A 103 4.425 9.579 0.029 1.00 0.00 C ATOM 0 H ILE A 103 1.472 10.963 1.408 1.00 0.00 H new ATOM 0 HA ILE A 103 2.022 8.391 2.747 1.00 0.00 H new ATOM 0 HB ILE A 103 3.858 10.733 2.281 1.00 0.00 H new ATOM 0 HG12 ILE A 103 5.331 8.511 1.660 1.00 0.00 H new ATOM 0 HG13 ILE A 103 3.735 7.932 1.227 1.00 0.00 H new ATOM 0 HG21 ILE A 103 5.511 9.490 3.707 1.00 0.00 H new ATOM 0 HG22 ILE A 103 4.065 9.969 4.627 1.00 0.00 H new ATOM 0 HG23 ILE A 103 4.255 8.286 4.079 1.00 0.00 H new ATOM 0 HD11 ILE A 103 4.866 8.925 -0.723 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.427 9.878 -0.290 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.048 10.465 0.149 1.00 0.00 H new ATOM 1540 N THR A 104 1.243 9.391 4.881 1.00 0.00 N ATOM 1541 CA THR A 104 0.828 9.849 6.199 1.00 0.00 C ATOM 1542 C THR A 104 1.468 8.989 7.293 1.00 0.00 C ATOM 1543 O THR A 104 2.282 8.109 7.024 1.00 0.00 O ATOM 1544 CB THR A 104 -0.702 9.957 6.262 1.00 0.00 C ATOM 1545 OG1 THR A 104 -1.369 8.923 5.561 1.00 0.00 O ATOM 1546 CG2 THR A 104 -1.172 11.267 5.633 1.00 0.00 C ATOM 0 H THR A 104 1.231 8.374 4.803 1.00 0.00 H new ATOM 0 HA THR A 104 1.196 10.858 6.387 1.00 0.00 H new ATOM 0 HB THR A 104 -0.946 9.893 7.322 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.237 8.072 6.030 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.259 11.327 5.686 1.00 0.00 H new ATOM 0 HG22 THR A 104 -0.735 12.107 6.173 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.857 11.303 4.590 1.00 0.00 H new ATOM 1554 N ASP A 105 1.175 9.283 8.549 1.00 0.00 N ATOM 1555 CA ASP A 105 1.854 8.721 9.705 1.00 0.00 C ATOM 1556 C ASP A 105 1.098 7.505 10.188 1.00 0.00 C ATOM 1557 O ASP A 105 1.672 6.439 10.394 1.00 0.00 O ATOM 1558 CB ASP A 105 1.861 9.764 10.825 1.00 0.00 C ATOM 1559 CG ASP A 105 3.092 10.647 10.768 1.00 0.00 C ATOM 1560 OD1 ASP A 105 3.241 11.382 9.760 1.00 0.00 O ATOM 1561 OD2 ASP A 105 3.873 10.621 11.741 1.00 0.00 O ATOM 0 H ASP A 105 0.436 9.939 8.800 1.00 0.00 H new ATOM 0 HA ASP A 105 2.872 8.442 9.434 1.00 0.00 H new ATOM 0 HB2 ASP A 105 0.967 10.383 10.750 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.820 9.260 11.791 1.00 0.00 H new ATOM 1565 N THR A 106 -0.207 7.661 10.349 1.00 0.00 N ATOM 1566 CA THR A 106 -1.080 6.639 10.906 1.00 0.00 C ATOM 1567 C THR A 106 -2.171 6.374 9.888 1.00 0.00 C ATOM 1568 O THR A 106 -2.455 7.202 9.013 1.00 0.00 O ATOM 1569 CB THR A 106 -1.644 7.079 12.271 1.00 0.00 C ATOM 1570 OG1 THR A 106 -2.412 8.247 12.097 1.00 0.00 O ATOM 1571 CG2 THR A 106 -0.564 7.323 13.328 1.00 0.00 C ATOM 0 H THR A 106 -0.698 8.517 10.092 1.00 0.00 H new ATOM 0 HA THR A 106 -0.530 5.718 11.097 1.00 0.00 H new ATOM 0 HB THR A 106 -2.258 6.259 12.643 1.00 0.00 H new ATOM 0 HG1 THR A 106 -2.775 8.531 12.962 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.033 7.630 14.263 1.00 0.00 H new ATOM 0 HG22 THR A 106 0.001 6.405 13.489 1.00 0.00 H new ATOM 0 HG23 THR A 106 0.110 8.108 12.985 1.00 0.00 H new ATOM 1579 N VAL A 107 -2.812 5.221 9.984 1.00 0.00 N ATOM 1580 CA VAL A 107 -3.986 4.915 9.187 1.00 0.00 C ATOM 1581 C VAL A 107 -5.162 5.824 9.558 1.00 0.00 C ATOM 1582 O VAL A 107 -6.081 6.021 8.762 1.00 0.00 O ATOM 1583 CB VAL A 107 -4.315 3.427 9.350 1.00 0.00 C ATOM 1584 CG1 VAL A 107 -3.158 2.599 8.788 1.00 0.00 C ATOM 1585 CG2 VAL A 107 -4.515 3.020 10.813 1.00 0.00 C ATOM 0 H VAL A 107 -2.532 4.472 10.617 1.00 0.00 H new ATOM 0 HA VAL A 107 -3.782 5.111 8.134 1.00 0.00 H new ATOM 0 HB VAL A 107 -5.248 3.245 8.816 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -3.382 1.538 8.899 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -3.023 2.833 7.732 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.243 2.836 9.332 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.745 1.956 10.866 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.603 3.223 11.375 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -5.339 3.592 11.240 1.00 0.00 H new ATOM 1595 N GLU A 108 -5.098 6.429 10.744 1.00 0.00 N ATOM 1596 CA GLU A 108 -6.009 7.469 11.173 1.00 0.00 C ATOM 1597 C GLU A 108 -5.823 8.728 10.330 1.00 0.00 C ATOM 1598 O GLU A 108 -6.803 9.273 9.824 1.00 0.00 O ATOM 1599 CB GLU A 108 -5.811 7.766 12.664 1.00 0.00 C ATOM 1600 CG GLU A 108 -6.807 6.968 13.506 1.00 0.00 C ATOM 1601 CD GLU A 108 -8.243 7.483 13.385 1.00 0.00 C ATOM 1602 OE1 GLU A 108 -8.924 7.137 12.389 1.00 0.00 O ATOM 1603 OE2 GLU A 108 -8.737 8.181 14.299 1.00 0.00 O ATOM 0 H GLU A 108 -4.392 6.198 11.443 1.00 0.00 H new ATOM 0 HA GLU A 108 -7.032 7.120 11.029 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -4.792 7.514 12.959 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -5.942 8.832 12.849 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.776 5.922 13.201 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -6.501 7.004 14.552 1.00 0.00 H new ATOM 1608 N GLU A 109 -4.574 9.164 10.147 1.00 0.00 N ATOM 1609 CA GLU A 109 -4.234 10.433 9.520 1.00 0.00 C ATOM 1610 C GLU A 109 -4.564 10.438 8.021 1.00 0.00 C ATOM 1611 O GLU A 109 -4.654 11.505 7.403 1.00 0.00 O ATOM 1612 CB GLU A 109 -2.736 10.722 9.751 1.00 0.00 C ATOM 1613 CG GLU A 109 -2.414 12.199 9.970 1.00 0.00 C ATOM 1614 CD GLU A 109 -3.156 12.765 11.181 1.00 0.00 C ATOM 1615 OE1 GLU A 109 -2.797 12.438 12.332 1.00 0.00 O ATOM 1616 OE2 GLU A 109 -4.123 13.540 10.969 1.00 0.00 O ATOM 0 H GLU A 109 -3.756 8.629 10.439 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.836 11.218 9.977 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -2.397 10.155 10.618 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -2.170 10.361 8.892 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -1.340 12.320 10.112 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -2.684 12.767 9.079 1.00 0.00 H new ATOM 1621 N ALA A 110 -4.735 9.245 7.450 1.00 0.00 N ATOM 1622 CA ALA A 110 -5.012 9.000 6.052 1.00 0.00 C ATOM 1623 C ALA A 110 -6.416 9.477 5.699 1.00 0.00 C ATOM 1624 O ALA A 110 -6.516 10.506 4.996 1.00 0.00 O ATOM 1625 CB ALA A 110 -4.837 7.514 5.770 1.00 0.00 C ATOM 0 H ALA A 110 -4.679 8.381 7.990 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.315 9.560 5.428 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -5.043 7.317 4.718 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -3.814 7.218 6.001 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -5.529 6.942 6.389 1.00 0.00 H new TER 1631 ALA A 110