USER MOD reduce.3.24.130724 H: found=0, std=0, add=1270, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1261 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 CYS SG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -1.96! USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HD1:sc= -7.14! C(o=-7.1!,f=-12!) USER MOD Single : A 36 HIS : no HD1:sc= -2.14 K(o=-2.1,f=-5.2!) USER MOD Single : A 41 ASN : amide:sc= -0.922 K(o=-0.92,f=-1.6) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0.0128 USER MOD Single : A 49 GLN : amide:sc= -16.8! C(o=-17!,f=-19!) USER MOD Single : A 51 MET CE :methyl 149:sc= -0.159 (180deg=-0.616) USER MOD Single : A 52 MET CE :methyl -122:sc= -3.13! (180deg=-8.9!) USER MOD Single : A 55 SER OG : rot 100:sc= -1.45! USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -0.828 K(o=-0.83,f=-1.5!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -11.1! C(o=-11!,f=-13!) USER MOD Single : A 72 GLN : amide:sc= -0.328 K(o=-0.33,f=-2.6!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 49:sc= 0.00641 USER MOD Single : A 78 SER OG : rot 180:sc= -3! USER MOD Single : A 81 HIS : no HD1:sc= -4.85 K(o=-4.8,f=-9.9!) USER MOD Single : A 86 THR OG1 : rot -125:sc= 0.504 USER MOD Single : A 91 THR OG1 : rot 122:sc= 0.766 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 HIS : no HD1:sc= -2.98! C(o=-3!,f=-3.8!) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.0793 USER MOD Single : A 110 SER OG : rot 180:sc= -1.38 USER MOD Single : A 114 HIS : no HD1:sc= -10.6! C(o=-11!,f=-15!) USER MOD Single : A 121 HIS : no HD1:sc= -3.14! C(o=-3.1!,f=-4.7!) USER MOD Single : A 122 SER OG : rot 180:sc= -0.578 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -88:sc= 0.989 USER MOD Single : A 132 SER OG : rot 22:sc= -3.3! USER MOD Single : A 135 HIS : no HE2:sc= -0.158 K(o=-0.16,f=-1.2) USER MOD Single : A 136 HIS : no HD1:sc= -3.57 K(o=-3.6,f=-2.3) USER MOD Single : A 140 SER OG : rot 180:sc= 0.0362 USER MOD Single : A 143 THR OG1 : rot 91:sc= -20.8! USER MOD Single : A 150 GLN : amide:sc= -1.93 K(o=-1.9,f=-5.6!) USER MOD Single : A 154 GLN : amide:sc= -16.1! C(o=-16!,f=-9.9!) USER MOD Single : A 155 ASN : amide:sc= -33.9! C(o=-34!,f=-32!) USER MOD Single : A 157 MET CE :methyl 147:sc= -2.03! (180deg=-2.59!) USER MOD Single : A 161 GLN : amide:sc= -1.31 K(o=-1.3,f=-0.05) USER MOD Single : A 163 HIS : no HE2:sc= -2.38! X(o=-2.4!,f=-2.7) USER MOD Single : A 164 MET CE :methyl 150:sc= -1.55 (180deg=-4.72!) USER MOD Single : A 165 MET CE :methyl -170:sc= -0.0134 (180deg=-0.229) USER MOD Single : A 168 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -35.140 -8.394 -14.004 1.00 0.00 N ATOM 2 CA GLY A 1 -34.712 -9.678 -13.385 1.00 0.00 C ATOM 3 C GLY A 1 -33.491 -9.518 -12.501 1.00 0.00 C ATOM 4 O GLY A 1 -32.373 -9.820 -12.915 1.00 0.00 O ATOM 0 H1 GLY A 1 -35.978 -8.557 -14.598 1.00 0.00 H new ATOM 0 H2 GLY A 1 -35.374 -7.709 -13.257 1.00 0.00 H new ATOM 0 H3 GLY A 1 -34.368 -8.017 -14.590 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -35.533 -10.084 -12.795 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -34.495 -10.402 -14.171 1.00 0.00 H new ATOM 10 N SER A 2 -33.707 -9.038 -11.279 1.00 0.00 N ATOM 11 CA SER A 2 -32.615 -8.837 -10.333 1.00 0.00 C ATOM 12 C SER A 2 -32.853 -9.630 -9.052 1.00 0.00 C ATOM 13 O SER A 2 -33.009 -9.055 -7.975 1.00 0.00 O ATOM 14 CB SER A 2 -32.465 -7.350 -10.007 1.00 0.00 C ATOM 15 OG SER A 2 -31.964 -6.631 -11.121 1.00 0.00 O ATOM 0 H SER A 2 -34.627 -8.782 -10.922 1.00 0.00 H new ATOM 0 HA SER A 2 -31.695 -9.196 -10.794 1.00 0.00 H new ATOM 0 HB2 SER A 2 -33.431 -6.940 -9.710 1.00 0.00 H new ATOM 0 HB3 SER A 2 -31.792 -7.227 -9.158 1.00 0.00 H new ATOM 0 HG SER A 2 -31.879 -5.683 -10.887 1.00 0.00 H new ATOM 21 N MET A 3 -32.877 -10.953 -9.176 1.00 0.00 N ATOM 22 CA MET A 3 -33.093 -11.823 -8.027 1.00 0.00 C ATOM 23 C MET A 3 -31.856 -11.867 -7.137 1.00 0.00 C ATOM 24 O MET A 3 -31.024 -10.959 -7.168 1.00 0.00 O ATOM 25 CB MET A 3 -33.452 -13.236 -8.489 1.00 0.00 C ATOM 26 CG MET A 3 -34.066 -13.284 -9.879 1.00 0.00 C ATOM 27 SD MET A 3 -34.995 -14.801 -10.176 1.00 0.00 S ATOM 28 CE MET A 3 -34.832 -14.955 -11.953 1.00 0.00 C ATOM 0 H MET A 3 -32.750 -11.445 -10.060 1.00 0.00 H new ATOM 0 HA MET A 3 -33.922 -11.416 -7.448 1.00 0.00 H new ATOM 0 HB2 MET A 3 -32.553 -13.853 -8.476 1.00 0.00 H new ATOM 0 HB3 MET A 3 -34.150 -13.676 -7.777 1.00 0.00 H new ATOM 0 HG2 MET A 3 -34.726 -12.427 -10.010 1.00 0.00 H new ATOM 0 HG3 MET A 3 -33.276 -13.195 -10.624 1.00 0.00 H new ATOM 0 HE1 MET A 3 -35.356 -15.849 -12.290 1.00 0.00 H new ATOM 0 HE2 MET A 3 -35.264 -14.078 -12.435 1.00 0.00 H new ATOM 0 HE3 MET A 3 -33.777 -15.031 -12.216 1.00 0.00 H new ATOM 38 N LEU A 4 -31.741 -12.927 -6.343 1.00 0.00 N ATOM 39 CA LEU A 4 -30.605 -13.088 -5.443 1.00 0.00 C ATOM 40 C LEU A 4 -29.300 -13.193 -6.226 1.00 0.00 C ATOM 41 O LEU A 4 -29.042 -14.196 -6.890 1.00 0.00 O ATOM 42 CB LEU A 4 -30.791 -14.330 -4.569 1.00 0.00 C ATOM 43 CG LEU A 4 -31.957 -14.257 -3.580 1.00 0.00 C ATOM 44 CD1 LEU A 4 -32.965 -15.359 -3.863 1.00 0.00 C ATOM 45 CD2 LEU A 4 -31.448 -14.349 -2.149 1.00 0.00 C ATOM 0 H LEU A 4 -32.420 -13.687 -6.305 1.00 0.00 H new ATOM 0 HA LEU A 4 -30.553 -12.207 -4.803 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -30.938 -15.193 -5.218 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -29.871 -14.504 -4.011 1.00 0.00 H new ATOM 0 HG LEU A 4 -32.456 -13.296 -3.705 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -33.787 -15.292 -3.150 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -33.352 -15.246 -4.876 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -32.479 -16.330 -3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -32.290 -14.295 -1.459 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -30.924 -15.295 -2.009 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -30.765 -13.523 -1.952 1.00 0.00 H new ATOM 57 N LEU A 5 -28.479 -12.151 -6.141 1.00 0.00 N ATOM 58 CA LEU A 5 -27.199 -12.125 -6.840 1.00 0.00 C ATOM 59 C LEU A 5 -26.436 -10.842 -6.529 1.00 0.00 C ATOM 60 O LEU A 5 -26.024 -10.118 -7.435 1.00 0.00 O ATOM 61 CB LEU A 5 -27.411 -12.251 -8.350 1.00 0.00 C ATOM 62 CG LEU A 5 -26.139 -12.496 -9.163 1.00 0.00 C ATOM 63 CD1 LEU A 5 -25.627 -13.911 -8.937 1.00 0.00 C ATOM 64 CD2 LEU A 5 -26.395 -12.249 -10.643 1.00 0.00 C ATOM 0 H LEU A 5 -28.678 -11.313 -5.595 1.00 0.00 H new ATOM 0 HA LEU A 5 -26.609 -12.973 -6.492 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -28.107 -13.069 -8.537 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -27.886 -11.339 -8.712 1.00 0.00 H new ATOM 0 HG LEU A 5 -25.374 -11.796 -8.826 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -24.721 -14.068 -9.523 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -25.404 -14.053 -7.879 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -26.388 -14.627 -9.246 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -25.479 -12.428 -11.206 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -27.175 -12.924 -10.995 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -26.715 -11.217 -10.790 1.00 0.00 H new ATOM 76 N GLU A 6 -26.251 -10.567 -5.242 1.00 0.00 N ATOM 77 CA GLU A 6 -25.537 -9.371 -4.809 1.00 0.00 C ATOM 78 C GLU A 6 -24.195 -9.735 -4.184 1.00 0.00 C ATOM 79 O GLU A 6 -23.181 -9.086 -4.444 1.00 0.00 O ATOM 80 CB GLU A 6 -26.383 -8.581 -3.810 1.00 0.00 C ATOM 81 CG GLU A 6 -26.286 -7.075 -3.986 1.00 0.00 C ATOM 82 CD GLU A 6 -26.642 -6.316 -2.722 1.00 0.00 C ATOM 83 OE1 GLU A 6 -26.514 -6.898 -1.625 1.00 0.00 O ATOM 84 OE2 GLU A 6 -27.051 -5.141 -2.831 1.00 0.00 O ATOM 0 H GLU A 6 -26.586 -11.157 -4.480 1.00 0.00 H new ATOM 0 HA GLU A 6 -25.351 -8.751 -5.686 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -27.425 -8.884 -3.911 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -26.072 -8.841 -2.798 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -25.272 -6.813 -4.289 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -26.951 -6.764 -4.792 1.00 0.00 H new ATOM 91 N GLU A 7 -24.195 -10.776 -3.358 1.00 0.00 N ATOM 92 CA GLU A 7 -22.976 -11.225 -2.695 1.00 0.00 C ATOM 93 C GLU A 7 -22.128 -10.036 -2.254 1.00 0.00 C ATOM 94 O GLU A 7 -20.898 -10.087 -2.299 1.00 0.00 O ATOM 95 CB GLU A 7 -22.166 -12.125 -3.630 1.00 0.00 C ATOM 96 CG GLU A 7 -22.333 -13.609 -3.340 1.00 0.00 C ATOM 97 CD GLU A 7 -23.786 -14.018 -3.208 1.00 0.00 C ATOM 98 OE1 GLU A 7 -24.414 -14.327 -4.243 1.00 0.00 O ATOM 99 OE2 GLU A 7 -24.297 -14.032 -2.068 1.00 0.00 O ATOM 0 H GLU A 7 -25.025 -11.324 -3.132 1.00 0.00 H new ATOM 0 HA GLU A 7 -23.260 -11.794 -1.810 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -22.465 -11.928 -4.660 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -21.111 -11.864 -3.549 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -21.868 -14.186 -4.140 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -21.805 -13.857 -2.419 1.00 0.00 H new ATOM 106 N VAL A 8 -22.793 -8.967 -1.829 1.00 0.00 N ATOM 107 CA VAL A 8 -22.100 -7.765 -1.380 1.00 0.00 C ATOM 108 C VAL A 8 -23.091 -6.702 -0.919 1.00 0.00 C ATOM 109 O VAL A 8 -24.139 -6.506 -1.534 1.00 0.00 O ATOM 110 CB VAL A 8 -21.216 -7.176 -2.496 1.00 0.00 C ATOM 111 CG1 VAL A 8 -22.064 -6.749 -3.682 1.00 0.00 C ATOM 112 CG2 VAL A 8 -20.398 -6.009 -1.967 1.00 0.00 C ATOM 0 H VAL A 8 -23.810 -8.908 -1.786 1.00 0.00 H new ATOM 0 HA VAL A 8 -21.467 -8.058 -0.542 1.00 0.00 H new ATOM 0 HB VAL A 8 -20.527 -7.950 -2.835 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -21.421 -6.336 -4.459 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -22.600 -7.613 -4.076 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -22.780 -5.992 -3.363 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -19.780 -5.605 -2.769 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -21.068 -5.232 -1.599 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -19.759 -6.352 -1.153 1.00 0.00 H new ATOM 122 N CYS A 9 -22.753 -6.017 0.169 1.00 0.00 N ATOM 123 CA CYS A 9 -23.614 -4.974 0.713 1.00 0.00 C ATOM 124 C CYS A 9 -23.427 -3.664 -0.045 1.00 0.00 C ATOM 125 O CYS A 9 -24.329 -3.208 -0.748 1.00 0.00 O ATOM 126 CB CYS A 9 -23.319 -4.764 2.199 1.00 0.00 C ATOM 127 SG CYS A 9 -24.206 -5.896 3.295 1.00 0.00 S ATOM 0 H CYS A 9 -21.889 -6.166 0.691 1.00 0.00 H new ATOM 0 HA CYS A 9 -24.649 -5.295 0.597 1.00 0.00 H new ATOM 0 HB2 CYS A 9 -22.248 -4.879 2.366 1.00 0.00 H new ATOM 0 HB3 CYS A 9 -23.575 -3.739 2.468 1.00 0.00 H new ATOM 0 HG CYS A 9 -23.889 -5.642 4.530 1.00 0.00 H new ATOM 133 N VAL A 10 -22.253 -3.061 0.104 1.00 0.00 N ATOM 134 CA VAL A 10 -21.949 -1.804 -0.566 1.00 0.00 C ATOM 135 C VAL A 10 -20.688 -1.921 -1.418 1.00 0.00 C ATOM 136 O VAL A 10 -20.336 -0.998 -2.152 1.00 0.00 O ATOM 137 CB VAL A 10 -21.770 -0.658 0.450 1.00 0.00 C ATOM 138 CG1 VAL A 10 -20.393 -0.722 1.095 1.00 0.00 C ATOM 139 CG2 VAL A 10 -21.994 0.690 -0.219 1.00 0.00 C ATOM 0 H VAL A 10 -21.496 -3.423 0.684 1.00 0.00 H new ATOM 0 HA VAL A 10 -22.796 -1.577 -1.213 1.00 0.00 H new ATOM 0 HB VAL A 10 -22.517 -0.775 1.235 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -20.287 0.095 1.808 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -20.278 -1.674 1.614 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -19.626 -0.633 0.325 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -21.863 1.486 0.514 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -21.274 0.819 -1.027 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -23.005 0.732 -0.624 1.00 0.00 H new ATOM 149 N GLY A 11 -20.012 -3.061 -1.314 1.00 0.00 N ATOM 150 CA GLY A 11 -18.798 -3.276 -2.080 1.00 0.00 C ATOM 151 C GLY A 11 -18.905 -2.740 -3.494 1.00 0.00 C ATOM 152 O GLY A 11 -18.138 -1.863 -3.892 1.00 0.00 O ATOM 0 H GLY A 11 -20.283 -3.839 -0.713 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -17.962 -2.794 -1.574 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -18.577 -4.343 -2.114 1.00 0.00 H new ATOM 156 N ASP A 12 -19.858 -3.268 -4.254 1.00 0.00 N ATOM 157 CA ASP A 12 -20.063 -2.836 -5.631 1.00 0.00 C ATOM 158 C ASP A 12 -20.305 -1.333 -5.695 1.00 0.00 C ATOM 159 O ASP A 12 -20.183 -0.717 -6.754 1.00 0.00 O ATOM 160 CB ASP A 12 -21.243 -3.584 -6.254 1.00 0.00 C ATOM 161 CG ASP A 12 -22.579 -3.098 -5.726 1.00 0.00 C ATOM 162 OD1 ASP A 12 -22.607 -2.033 -5.074 1.00 0.00 O ATOM 163 OD2 ASP A 12 -23.597 -3.782 -5.964 1.00 0.00 O ATOM 0 H ASP A 12 -20.500 -3.995 -3.940 1.00 0.00 H new ATOM 0 HA ASP A 12 -19.160 -3.066 -6.197 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -21.217 -3.461 -7.337 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -21.141 -4.650 -6.052 1.00 0.00 H new ATOM 168 N ARG A 13 -20.646 -0.747 -4.551 1.00 0.00 N ATOM 169 CA ARG A 13 -20.903 0.686 -4.473 1.00 0.00 C ATOM 170 C ARG A 13 -19.678 1.427 -3.947 1.00 0.00 C ATOM 171 O ARG A 13 -19.078 2.236 -4.655 1.00 0.00 O ATOM 172 CB ARG A 13 -22.105 0.962 -3.569 1.00 0.00 C ATOM 173 CG ARG A 13 -22.720 2.336 -3.779 1.00 0.00 C ATOM 174 CD ARG A 13 -23.896 2.278 -4.739 1.00 0.00 C ATOM 175 NE ARG A 13 -23.481 2.474 -6.124 1.00 0.00 N ATOM 176 CZ ARG A 13 -24.330 2.549 -7.144 1.00 0.00 C ATOM 177 NH1 ARG A 13 -25.634 2.443 -6.934 1.00 0.00 N ATOM 178 NH2 ARG A 13 -23.873 2.728 -8.376 1.00 0.00 N ATOM 0 H ARG A 13 -20.751 -1.243 -3.666 1.00 0.00 H new ATOM 0 HA ARG A 13 -21.123 1.046 -5.478 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -22.865 0.202 -3.747 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -21.796 0.866 -2.528 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -23.050 2.738 -2.821 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -21.964 3.019 -4.168 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -24.395 1.314 -4.643 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -24.624 3.042 -4.467 1.00 0.00 H new ATOM 0 HE ARG A 13 -22.484 2.558 -6.320 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -25.989 2.304 -5.988 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -26.283 2.501 -7.719 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -22.870 2.808 -8.541 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -24.525 2.785 -9.158 1.00 0.00 H new ATOM 192 N LEU A 14 -19.311 1.144 -2.702 1.00 0.00 N ATOM 193 CA LEU A 14 -18.157 1.781 -2.080 1.00 0.00 C ATOM 194 C LEU A 14 -16.860 1.304 -2.725 1.00 0.00 C ATOM 195 O LEU A 14 -16.113 2.097 -3.299 1.00 0.00 O ATOM 196 CB LEU A 14 -18.132 1.487 -0.579 1.00 0.00 C ATOM 197 CG LEU A 14 -17.031 2.206 0.203 1.00 0.00 C ATOM 198 CD1 LEU A 14 -15.730 1.422 0.133 1.00 0.00 C ATOM 199 CD2 LEU A 14 -16.836 3.618 -0.329 1.00 0.00 C ATOM 0 H LEU A 14 -19.797 0.477 -2.103 1.00 0.00 H new ATOM 0 HA LEU A 14 -18.243 2.857 -2.230 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -19.097 1.762 -0.154 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -18.016 0.413 -0.436 1.00 0.00 H new ATOM 0 HG LEU A 14 -17.335 2.272 1.248 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -14.958 1.948 0.695 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.879 0.431 0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -15.419 1.325 -0.907 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -16.049 4.115 0.238 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -16.553 3.575 -1.381 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -17.766 4.177 -0.226 1.00 0.00 H new ATOM 211 N SER A 15 -16.598 0.005 -2.627 1.00 0.00 N ATOM 212 CA SER A 15 -15.390 -0.576 -3.202 1.00 0.00 C ATOM 213 C SER A 15 -15.296 -0.263 -4.691 1.00 0.00 C ATOM 214 O SER A 15 -14.203 -0.178 -5.250 1.00 0.00 O ATOM 215 CB SER A 15 -15.372 -2.089 -2.984 1.00 0.00 C ATOM 216 OG SER A 15 -14.806 -2.758 -4.098 1.00 0.00 O ATOM 0 H SER A 15 -17.205 -0.665 -2.155 1.00 0.00 H new ATOM 0 HA SER A 15 -14.529 -0.135 -2.700 1.00 0.00 H new ATOM 0 HB2 SER A 15 -14.800 -2.323 -2.086 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.388 -2.448 -2.818 1.00 0.00 H new ATOM 0 HG SER A 15 -14.804 -3.724 -3.933 1.00 0.00 H new ATOM 222 N GLY A 16 -16.449 -0.088 -5.327 1.00 0.00 N ATOM 223 CA GLY A 16 -16.473 0.218 -6.745 1.00 0.00 C ATOM 224 C GLY A 16 -15.952 1.611 -7.039 1.00 0.00 C ATOM 225 O GLY A 16 -15.106 1.793 -7.913 1.00 0.00 O ATOM 0 H GLY A 16 -17.367 -0.153 -4.886 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -15.871 -0.514 -7.283 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -17.493 0.127 -7.117 1.00 0.00 H new ATOM 229 N ALA A 17 -16.461 2.595 -6.304 1.00 0.00 N ATOM 230 CA ALA A 17 -16.042 3.978 -6.486 1.00 0.00 C ATOM 231 C ALA A 17 -14.638 4.206 -5.936 1.00 0.00 C ATOM 232 O ALA A 17 -13.833 4.917 -6.537 1.00 0.00 O ATOM 233 CB ALA A 17 -17.032 4.920 -5.816 1.00 0.00 C ATOM 0 H ALA A 17 -17.164 2.459 -5.577 1.00 0.00 H new ATOM 0 HA ALA A 17 -16.022 4.187 -7.556 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -16.708 5.951 -5.959 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -18.019 4.785 -6.259 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -17.080 4.699 -4.750 1.00 0.00 H new ATOM 239 N ALA A 18 -14.352 3.601 -4.787 1.00 0.00 N ATOM 240 CA ALA A 18 -13.047 3.742 -4.154 1.00 0.00 C ATOM 241 C ALA A 18 -11.920 3.410 -5.128 1.00 0.00 C ATOM 242 O ALA A 18 -10.925 4.130 -5.209 1.00 0.00 O ATOM 243 CB ALA A 18 -12.961 2.852 -2.923 1.00 0.00 C ATOM 0 H ALA A 18 -15.007 3.009 -4.276 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.931 4.782 -3.849 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.981 2.966 -2.459 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.735 3.139 -2.212 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.105 1.812 -3.215 1.00 0.00 H new ATOM 249 N ALA A 19 -12.082 2.316 -5.862 1.00 0.00 N ATOM 250 CA ALA A 19 -11.076 1.891 -6.829 1.00 0.00 C ATOM 251 C ALA A 19 -11.077 2.794 -8.058 1.00 0.00 C ATOM 252 O ALA A 19 -10.024 3.097 -8.618 1.00 0.00 O ATOM 253 CB ALA A 19 -11.311 0.444 -7.230 1.00 0.00 C ATOM 0 H ALA A 19 -12.899 1.707 -5.807 1.00 0.00 H new ATOM 0 HA ALA A 19 -10.097 1.971 -6.357 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -10.554 0.139 -7.952 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -11.249 -0.193 -6.348 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -12.300 0.347 -7.678 1.00 0.00 H new ATOM 259 N ARG A 20 -12.264 3.220 -8.473 1.00 0.00 N ATOM 260 CA ARG A 20 -12.398 4.090 -9.636 1.00 0.00 C ATOM 261 C ARG A 20 -11.934 5.508 -9.315 1.00 0.00 C ATOM 262 O ARG A 20 -11.834 6.354 -10.203 1.00 0.00 O ATOM 263 CB ARG A 20 -13.850 4.111 -10.117 1.00 0.00 C ATOM 264 CG ARG A 20 -14.321 2.781 -10.679 1.00 0.00 C ATOM 265 CD ARG A 20 -15.839 2.703 -10.729 1.00 0.00 C ATOM 266 NE ARG A 20 -16.309 1.329 -10.871 1.00 0.00 N ATOM 267 CZ ARG A 20 -16.199 0.626 -11.993 1.00 0.00 C ATOM 268 NH1 ARG A 20 -15.645 1.172 -13.067 1.00 0.00 N ATOM 269 NH2 ARG A 20 -16.641 -0.624 -12.044 1.00 0.00 N ATOM 0 H ARG A 20 -13.147 2.978 -8.023 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.765 3.693 -10.430 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -14.496 4.394 -9.286 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -13.960 4.879 -10.882 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -13.915 2.644 -11.681 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -13.934 1.968 -10.065 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -16.255 3.137 -9.820 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -16.206 3.300 -11.564 1.00 0.00 H new ATOM 0 HE ARG A 20 -16.746 0.884 -10.064 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -15.303 2.132 -13.032 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -15.561 0.632 -13.928 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -17.067 -1.048 -11.220 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -16.555 -1.161 -12.907 1.00 0.00 H new ATOM 283 N GLY A 21 -11.658 5.761 -8.040 1.00 0.00 N ATOM 284 CA GLY A 21 -11.214 7.080 -7.624 1.00 0.00 C ATOM 285 C GLY A 21 -12.085 7.657 -6.526 1.00 0.00 C ATOM 286 O GLY A 21 -11.634 7.829 -5.394 1.00 0.00 O ATOM 0 H GLY A 21 -11.734 5.077 -7.287 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -10.183 7.021 -7.275 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -11.222 7.752 -8.482 1.00 0.00 H new ATOM 290 N ASP A 22 -13.339 7.945 -6.862 1.00 0.00 N ATOM 291 CA ASP A 22 -14.285 8.492 -5.913 1.00 0.00 C ATOM 292 C ASP A 22 -13.598 9.405 -4.908 1.00 0.00 C ATOM 293 O ASP A 22 -13.950 9.432 -3.730 1.00 0.00 O ATOM 294 CB ASP A 22 -15.024 7.350 -5.214 1.00 0.00 C ATOM 295 CG ASP A 22 -14.380 6.930 -3.906 1.00 0.00 C ATOM 296 OD1 ASP A 22 -13.136 6.992 -3.810 1.00 0.00 O ATOM 297 OD2 ASP A 22 -15.120 6.540 -2.978 1.00 0.00 O ATOM 0 H ASP A 22 -13.720 7.804 -7.797 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.010 9.103 -6.451 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -16.053 7.655 -5.023 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -15.066 6.490 -5.883 1.00 0.00 H new ATOM 302 N VAL A 23 -12.627 10.170 -5.385 1.00 0.00 N ATOM 303 CA VAL A 23 -11.909 11.095 -4.525 1.00 0.00 C ATOM 304 C VAL A 23 -12.897 11.985 -3.785 1.00 0.00 C ATOM 305 O VAL A 23 -12.835 12.127 -2.565 1.00 0.00 O ATOM 306 CB VAL A 23 -10.937 11.978 -5.331 1.00 0.00 C ATOM 307 CG1 VAL A 23 -11.629 12.553 -6.557 1.00 0.00 C ATOM 308 CG2 VAL A 23 -10.372 13.087 -4.458 1.00 0.00 C ATOM 0 H VAL A 23 -12.320 10.168 -6.358 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.330 10.506 -3.814 1.00 0.00 H new ATOM 0 HB VAL A 23 -10.107 11.357 -5.669 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.927 13.174 -7.114 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.977 11.739 -7.193 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -12.480 13.159 -6.244 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -9.688 13.700 -5.045 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.187 13.708 -4.086 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -9.836 12.650 -3.616 1.00 0.00 H new ATOM 318 N GLN A 24 -13.821 12.570 -4.540 1.00 0.00 N ATOM 319 CA GLN A 24 -14.845 13.436 -3.968 1.00 0.00 C ATOM 320 C GLN A 24 -15.914 12.613 -3.253 1.00 0.00 C ATOM 321 O GLN A 24 -16.499 13.056 -2.265 1.00 0.00 O ATOM 322 CB GLN A 24 -15.492 14.290 -5.061 1.00 0.00 C ATOM 323 CG GLN A 24 -14.495 14.880 -6.045 1.00 0.00 C ATOM 324 CD GLN A 24 -15.171 15.554 -7.224 1.00 0.00 C ATOM 325 OE1 GLN A 24 -14.945 15.186 -8.377 1.00 0.00 O ATOM 326 NE2 GLN A 24 -16.006 16.546 -6.939 1.00 0.00 N ATOM 0 H GLN A 24 -13.881 12.459 -5.552 1.00 0.00 H new ATOM 0 HA GLN A 24 -14.366 14.091 -3.241 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -16.212 13.681 -5.608 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -16.051 15.101 -4.593 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -13.865 15.605 -5.529 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -13.839 14.090 -6.410 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -16.163 16.817 -5.968 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -16.490 17.037 -7.691 1.00 0.00 H new ATOM 335 N GLU A 25 -16.168 11.415 -3.775 1.00 0.00 N ATOM 336 CA GLU A 25 -17.173 10.521 -3.209 1.00 0.00 C ATOM 337 C GLU A 25 -16.699 9.903 -1.896 1.00 0.00 C ATOM 338 O GLU A 25 -17.488 9.717 -0.971 1.00 0.00 O ATOM 339 CB GLU A 25 -17.509 9.417 -4.213 1.00 0.00 C ATOM 340 CG GLU A 25 -18.832 9.629 -4.931 1.00 0.00 C ATOM 341 CD GLU A 25 -19.999 8.987 -4.206 1.00 0.00 C ATOM 342 OE1 GLU A 25 -20.146 9.227 -2.989 1.00 0.00 O ATOM 343 OE2 GLU A 25 -20.766 8.244 -4.856 1.00 0.00 O ATOM 0 H GLU A 25 -15.688 11.040 -4.593 1.00 0.00 H new ATOM 0 HA GLU A 25 -18.066 11.110 -2.998 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -16.710 9.354 -4.952 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -17.537 8.460 -3.692 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -19.017 10.698 -5.035 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -18.764 9.218 -5.938 1.00 0.00 H new ATOM 350 N VAL A 26 -15.413 9.581 -1.823 1.00 0.00 N ATOM 351 CA VAL A 26 -14.848 8.978 -0.623 1.00 0.00 C ATOM 352 C VAL A 26 -15.183 9.806 0.613 1.00 0.00 C ATOM 353 O VAL A 26 -15.402 9.265 1.697 1.00 0.00 O ATOM 354 CB VAL A 26 -13.317 8.823 -0.734 1.00 0.00 C ATOM 355 CG1 VAL A 26 -12.612 10.130 -0.391 1.00 0.00 C ATOM 356 CG2 VAL A 26 -12.828 7.695 0.162 1.00 0.00 C ATOM 0 H VAL A 26 -14.744 9.727 -2.579 1.00 0.00 H new ATOM 0 HA VAL A 26 -15.293 7.988 -0.525 1.00 0.00 H new ATOM 0 HB VAL A 26 -13.074 8.571 -1.766 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -11.534 9.995 -0.477 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -12.936 10.910 -1.080 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -12.861 10.421 0.629 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -11.746 7.601 0.070 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -13.087 7.915 1.198 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -13.301 6.760 -0.139 1.00 0.00 H new ATOM 366 N ARG A 27 -15.224 11.122 0.440 1.00 0.00 N ATOM 367 CA ARG A 27 -15.534 12.027 1.538 1.00 0.00 C ATOM 368 C ARG A 27 -17.005 11.927 1.926 1.00 0.00 C ATOM 369 O ARG A 27 -17.337 11.742 3.097 1.00 0.00 O ATOM 370 CB ARG A 27 -15.193 13.467 1.153 1.00 0.00 C ATOM 371 CG ARG A 27 -13.872 13.602 0.412 1.00 0.00 C ATOM 372 CD ARG A 27 -12.855 14.388 1.223 1.00 0.00 C ATOM 373 NE ARG A 27 -13.390 15.665 1.688 1.00 0.00 N ATOM 374 CZ ARG A 27 -12.646 16.618 2.240 1.00 0.00 C ATOM 375 NH1 ARG A 27 -11.342 16.439 2.395 1.00 0.00 N ATOM 376 NH2 ARG A 27 -13.206 17.752 2.637 1.00 0.00 N ATOM 0 H ARG A 27 -15.046 11.585 -0.451 1.00 0.00 H new ATOM 0 HA ARG A 27 -14.929 11.736 2.397 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -15.993 13.867 0.529 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -15.158 14.077 2.056 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -13.475 12.611 0.191 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -14.039 14.099 -0.544 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -12.539 13.794 2.081 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -11.968 14.567 0.615 1.00 0.00 H new ATOM 0 HE ARG A 27 -14.390 15.835 1.583 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -10.907 15.568 2.090 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -10.773 17.172 2.819 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -14.209 17.894 2.519 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -12.634 18.482 3.060 1.00 0.00 H new ATOM 390 N ARG A 28 -17.885 12.051 0.938 1.00 0.00 N ATOM 391 CA ARG A 28 -19.320 11.977 1.184 1.00 0.00 C ATOM 392 C ARG A 28 -19.753 10.544 1.483 1.00 0.00 C ATOM 393 O ARG A 28 -20.633 10.311 2.308 1.00 0.00 O ATOM 394 CB ARG A 28 -20.097 12.515 -0.019 1.00 0.00 C ATOM 395 CG ARG A 28 -19.371 13.624 -0.764 1.00 0.00 C ATOM 396 CD ARG A 28 -20.337 14.684 -1.267 1.00 0.00 C ATOM 397 NE ARG A 28 -20.236 14.874 -2.711 1.00 0.00 N ATOM 398 CZ ARG A 28 -19.179 15.414 -3.309 1.00 0.00 C ATOM 399 NH1 ARG A 28 -18.140 15.814 -2.590 1.00 0.00 N ATOM 400 NH2 ARG A 28 -19.161 15.554 -4.628 1.00 0.00 N ATOM 0 H ARG A 28 -17.630 12.203 -0.038 1.00 0.00 H new ATOM 0 HA ARG A 28 -19.541 12.593 2.056 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -20.296 11.695 -0.709 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -21.063 12.888 0.320 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -18.635 14.085 -0.105 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -18.824 13.200 -1.606 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -21.357 14.397 -1.009 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -20.134 15.628 -0.762 1.00 0.00 H new ATOM 0 HE ARG A 28 -21.019 14.576 -3.293 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -18.150 15.708 -1.576 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -17.330 16.228 -3.051 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -19.959 15.247 -5.184 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -18.349 15.969 -5.086 1.00 0.00 H new ATOM 414 N LEU A 29 -19.132 9.587 0.805 1.00 0.00 N ATOM 415 CA LEU A 29 -19.461 8.180 0.999 1.00 0.00 C ATOM 416 C LEU A 29 -19.389 7.797 2.476 1.00 0.00 C ATOM 417 O LEU A 29 -20.385 7.386 3.069 1.00 0.00 O ATOM 418 CB LEU A 29 -18.516 7.295 0.186 1.00 0.00 C ATOM 419 CG LEU A 29 -18.890 7.134 -1.289 1.00 0.00 C ATOM 420 CD1 LEU A 29 -17.859 6.282 -2.013 1.00 0.00 C ATOM 421 CD2 LEU A 29 -20.278 6.523 -1.422 1.00 0.00 C ATOM 0 H LEU A 29 -18.399 9.759 0.117 1.00 0.00 H new ATOM 0 HA LEU A 29 -20.483 8.025 0.653 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -17.510 7.711 0.247 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -18.481 6.308 0.646 1.00 0.00 H new ATOM 0 HG LEU A 29 -18.902 8.121 -1.751 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -18.143 6.179 -3.060 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -16.881 6.760 -1.947 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -17.813 5.296 -1.551 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -20.529 6.415 -2.477 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -20.292 5.543 -0.944 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -21.009 7.172 -0.940 1.00 0.00 H new ATOM 433 N LEU A 30 -18.201 7.924 3.059 1.00 0.00 N ATOM 434 CA LEU A 30 -17.995 7.580 4.462 1.00 0.00 C ATOM 435 C LEU A 30 -18.616 8.616 5.398 1.00 0.00 C ATOM 436 O LEU A 30 -19.328 8.266 6.340 1.00 0.00 O ATOM 437 CB LEU A 30 -16.501 7.450 4.758 1.00 0.00 C ATOM 438 CG LEU A 30 -15.686 6.730 3.682 1.00 0.00 C ATOM 439 CD1 LEU A 30 -14.265 6.488 4.163 1.00 0.00 C ATOM 440 CD2 LEU A 30 -16.353 5.419 3.296 1.00 0.00 C ATOM 0 H LEU A 30 -17.366 8.263 2.581 1.00 0.00 H new ATOM 0 HA LEU A 30 -18.490 6.626 4.641 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -16.086 8.448 4.899 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.378 6.918 5.701 1.00 0.00 H new ATOM 0 HG LEU A 30 -15.644 7.366 2.798 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -13.700 5.975 3.385 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -13.789 7.443 4.387 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -14.285 5.872 5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -15.759 4.921 2.530 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -16.427 4.776 4.173 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -17.352 5.619 2.908 1.00 0.00 H new ATOM 452 N HIS A 31 -18.329 9.888 5.146 1.00 0.00 N ATOM 453 CA HIS A 31 -18.844 10.972 5.979 1.00 0.00 C ATOM 454 C HIS A 31 -20.349 11.161 5.800 1.00 0.00 C ATOM 455 O HIS A 31 -21.008 11.763 6.648 1.00 0.00 O ATOM 456 CB HIS A 31 -18.116 12.278 5.658 1.00 0.00 C ATOM 457 CG HIS A 31 -16.624 12.150 5.673 1.00 0.00 C ATOM 458 ND1 HIS A 31 -15.978 11.402 6.628 1.00 0.00 N ATOM 459 CD2 HIS A 31 -15.704 12.686 4.836 1.00 0.00 C ATOM 460 CE1 HIS A 31 -14.690 11.499 6.353 1.00 0.00 C ATOM 461 NE2 HIS A 31 -14.474 12.267 5.275 1.00 0.00 N ATOM 0 H HIS A 31 -17.742 10.196 4.371 1.00 0.00 H new ATOM 0 HA HIS A 31 -18.662 10.699 7.018 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -18.433 12.629 4.676 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -18.415 13.038 6.380 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -15.901 13.322 3.986 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -13.909 11.020 6.924 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -13.570 12.495 4.862 1.00 0.00 H new ATOM 469 N ARG A 32 -20.891 10.652 4.700 1.00 0.00 N ATOM 470 CA ARG A 32 -22.320 10.780 4.432 1.00 0.00 C ATOM 471 C ARG A 32 -22.955 9.420 4.166 1.00 0.00 C ATOM 472 O ARG A 32 -23.601 8.844 5.042 1.00 0.00 O ATOM 473 CB ARG A 32 -22.559 11.709 3.239 1.00 0.00 C ATOM 474 CG ARG A 32 -23.465 12.887 3.556 1.00 0.00 C ATOM 475 CD ARG A 32 -22.687 14.192 3.592 1.00 0.00 C ATOM 476 NE ARG A 32 -23.544 15.332 3.909 1.00 0.00 N ATOM 477 CZ ARG A 32 -23.107 16.585 3.973 1.00 0.00 C ATOM 478 NH1 ARG A 32 -21.829 16.857 3.742 1.00 0.00 N ATOM 479 NH2 ARG A 32 -23.945 17.568 4.269 1.00 0.00 N ATOM 0 H ARG A 32 -20.368 10.150 3.983 1.00 0.00 H new ATOM 0 HA ARG A 32 -22.788 11.209 5.318 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -21.599 12.085 2.884 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -22.997 11.134 2.423 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -24.254 12.953 2.807 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -23.951 12.725 4.518 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -21.891 14.119 4.334 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -22.209 14.356 2.626 1.00 0.00 H new ATOM 0 HE ARG A 32 -24.532 15.156 4.091 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -21.180 16.103 3.515 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -21.495 17.820 3.792 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -24.928 17.363 4.448 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -23.607 18.529 4.318 1.00 0.00 H new ATOM 493 N GLU A 33 -22.770 8.916 2.952 1.00 0.00 N ATOM 494 CA GLU A 33 -23.326 7.624 2.567 1.00 0.00 C ATOM 495 C GLU A 33 -23.211 6.613 3.704 1.00 0.00 C ATOM 496 O GLU A 33 -24.015 5.686 3.807 1.00 0.00 O ATOM 497 CB GLU A 33 -22.615 7.092 1.321 1.00 0.00 C ATOM 498 CG GLU A 33 -23.439 6.090 0.529 1.00 0.00 C ATOM 499 CD GLU A 33 -22.625 4.896 0.070 1.00 0.00 C ATOM 500 OE1 GLU A 33 -21.851 5.043 -0.899 1.00 0.00 O ATOM 501 OE2 GLU A 33 -22.759 3.814 0.680 1.00 0.00 O ATOM 0 H GLU A 33 -22.239 9.382 2.217 1.00 0.00 H new ATOM 0 HA GLU A 33 -24.383 7.767 2.343 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -22.359 7.931 0.674 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -21.678 6.623 1.621 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -24.270 5.743 1.143 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -23.870 6.587 -0.340 1.00 0.00 H new ATOM 508 N LEU A 34 -22.204 6.792 4.554 1.00 0.00 N ATOM 509 CA LEU A 34 -21.987 5.890 5.678 1.00 0.00 C ATOM 510 C LEU A 34 -21.694 4.479 5.182 1.00 0.00 C ATOM 511 O LEU A 34 -22.029 3.494 5.840 1.00 0.00 O ATOM 512 CB LEU A 34 -23.208 5.880 6.600 1.00 0.00 C ATOM 513 CG LEU A 34 -23.224 6.979 7.665 1.00 0.00 C ATOM 514 CD1 LEU A 34 -24.651 7.281 8.097 1.00 0.00 C ATOM 515 CD2 LEU A 34 -22.375 6.575 8.860 1.00 0.00 C ATOM 0 H LEU A 34 -21.527 7.552 4.485 1.00 0.00 H new ATOM 0 HA LEU A 34 -21.126 6.248 6.242 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -24.106 5.974 5.990 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -23.260 4.912 7.098 1.00 0.00 H new ATOM 0 HG LEU A 34 -22.798 7.885 7.234 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -24.644 8.065 8.855 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -25.229 7.615 7.235 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -25.104 6.380 8.511 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -22.398 7.368 9.607 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -22.771 5.656 9.293 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -21.347 6.410 8.537 1.00 0.00 H new ATOM 527 N VAL A 35 -21.069 4.393 4.012 1.00 0.00 N ATOM 528 CA VAL A 35 -20.729 3.113 3.412 1.00 0.00 C ATOM 529 C VAL A 35 -19.916 2.248 4.372 1.00 0.00 C ATOM 530 O VAL A 35 -19.200 2.761 5.231 1.00 0.00 O ATOM 531 CB VAL A 35 -19.929 3.313 2.113 1.00 0.00 C ATOM 532 CG1 VAL A 35 -20.865 3.428 0.920 1.00 0.00 C ATOM 533 CG2 VAL A 35 -19.033 4.538 2.217 1.00 0.00 C ATOM 0 H VAL A 35 -20.787 5.203 3.459 1.00 0.00 H new ATOM 0 HA VAL A 35 -21.666 2.605 3.186 1.00 0.00 H new ATOM 0 HB VAL A 35 -19.294 2.440 1.964 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -20.280 3.569 0.011 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -21.457 2.517 0.833 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -21.530 4.281 1.060 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -18.476 4.661 1.288 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -19.645 5.423 2.393 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.335 4.409 3.044 1.00 0.00 H new ATOM 543 N HIS A 36 -20.032 0.933 4.215 1.00 0.00 N ATOM 544 CA HIS A 36 -19.306 -0.006 5.065 1.00 0.00 C ATOM 545 C HIS A 36 -17.913 -0.278 4.505 1.00 0.00 C ATOM 546 O HIS A 36 -17.765 -0.684 3.352 1.00 0.00 O ATOM 547 CB HIS A 36 -20.081 -1.319 5.190 1.00 0.00 C ATOM 548 CG HIS A 36 -20.455 -1.663 6.599 1.00 0.00 C ATOM 549 ND1 HIS A 36 -19.500 -1.845 7.569 1.00 0.00 N ATOM 550 CD2 HIS A 36 -21.682 -1.848 7.144 1.00 0.00 C ATOM 551 CE1 HIS A 36 -20.160 -2.134 8.677 1.00 0.00 C ATOM 552 NE2 HIS A 36 -21.485 -2.147 8.468 1.00 0.00 N ATOM 0 H HIS A 36 -20.621 0.493 3.508 1.00 0.00 H new ATOM 0 HA HIS A 36 -19.202 0.442 6.053 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -20.987 -1.255 4.588 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -19.479 -2.127 4.775 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -22.631 -1.774 6.634 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -19.692 -2.334 9.630 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -22.208 -2.342 9.161 1.00 0.00 H new ATOM 560 N PRO A 37 -16.872 -0.057 5.321 1.00 0.00 N ATOM 561 CA PRO A 37 -15.482 -0.277 4.909 1.00 0.00 C ATOM 562 C PRO A 37 -15.148 -1.758 4.759 1.00 0.00 C ATOM 563 O PRO A 37 -14.098 -2.117 4.225 1.00 0.00 O ATOM 564 CB PRO A 37 -14.672 0.340 6.050 1.00 0.00 C ATOM 565 CG PRO A 37 -15.572 0.261 7.236 1.00 0.00 C ATOM 566 CD PRO A 37 -16.970 0.427 6.709 1.00 0.00 C ATOM 0 HA PRO A 37 -15.273 0.161 3.933 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.745 -0.207 6.219 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -14.398 1.371 5.829 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -15.459 -0.695 7.748 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.333 1.040 7.959 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -17.689 -0.154 7.287 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.294 1.467 6.750 1.00 0.00 H new ATOM 574 N ASP A 38 -16.047 -2.614 5.234 1.00 0.00 N ATOM 575 CA ASP A 38 -15.847 -4.056 5.151 1.00 0.00 C ATOM 576 C ASP A 38 -16.445 -4.620 3.865 1.00 0.00 C ATOM 577 O ASP A 38 -16.242 -5.789 3.537 1.00 0.00 O ATOM 578 CB ASP A 38 -16.473 -4.747 6.365 1.00 0.00 C ATOM 579 CG ASP A 38 -17.866 -4.233 6.670 1.00 0.00 C ATOM 580 OD1 ASP A 38 -18.609 -3.929 5.712 1.00 0.00 O ATOM 581 OD2 ASP A 38 -18.214 -4.134 7.865 1.00 0.00 O ATOM 0 H ASP A 38 -16.921 -2.334 5.680 1.00 0.00 H new ATOM 0 HA ASP A 38 -14.774 -4.248 5.143 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -16.517 -5.821 6.185 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -15.834 -4.595 7.235 1.00 0.00 H new ATOM 586 N ALA A 39 -17.182 -3.783 3.142 1.00 0.00 N ATOM 587 CA ALA A 39 -17.806 -4.201 1.893 1.00 0.00 C ATOM 588 C ALA A 39 -16.843 -5.020 1.043 1.00 0.00 C ATOM 589 O ALA A 39 -15.668 -4.678 0.915 1.00 0.00 O ATOM 590 CB ALA A 39 -18.295 -2.986 1.118 1.00 0.00 C ATOM 0 H ALA A 39 -17.361 -2.812 3.400 1.00 0.00 H new ATOM 0 HA ALA A 39 -18.660 -4.834 2.136 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -18.759 -3.311 0.187 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -19.025 -2.442 1.717 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -17.451 -2.333 0.894 1.00 0.00 H new ATOM 596 N LEU A 40 -17.350 -6.103 0.463 1.00 0.00 N ATOM 597 CA LEU A 40 -16.534 -6.973 -0.377 1.00 0.00 C ATOM 598 C LEU A 40 -17.222 -7.239 -1.713 1.00 0.00 C ATOM 599 O LEU A 40 -18.221 -7.955 -1.776 1.00 0.00 O ATOM 600 CB LEU A 40 -16.256 -8.294 0.340 1.00 0.00 C ATOM 601 CG LEU A 40 -15.456 -8.169 1.638 1.00 0.00 C ATOM 602 CD1 LEU A 40 -15.883 -9.237 2.632 1.00 0.00 C ATOM 603 CD2 LEU A 40 -13.965 -8.265 1.356 1.00 0.00 C ATOM 0 H LEU A 40 -18.321 -6.399 0.559 1.00 0.00 H new ATOM 0 HA LEU A 40 -15.588 -6.468 -0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -17.208 -8.777 0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -15.716 -8.953 -0.340 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.660 -7.192 2.076 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -15.303 -9.133 3.549 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -16.943 -9.121 2.857 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -15.709 -10.224 2.203 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -13.411 -8.174 2.291 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -13.743 -9.227 0.895 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.670 -7.462 0.680 1.00 0.00 H new ATOM 615 N ASN A 41 -16.680 -6.658 -2.779 1.00 0.00 N ATOM 616 CA ASN A 41 -17.242 -6.832 -4.113 1.00 0.00 C ATOM 617 C ASN A 41 -17.691 -8.273 -4.333 1.00 0.00 C ATOM 618 O ASN A 41 -18.774 -8.522 -4.865 1.00 0.00 O ATOM 619 CB ASN A 41 -16.215 -6.438 -5.177 1.00 0.00 C ATOM 620 CG ASN A 41 -15.093 -7.449 -5.302 1.00 0.00 C ATOM 621 OD1 ASN A 41 -15.164 -8.375 -6.111 1.00 0.00 O ATOM 622 ND2 ASN A 41 -14.049 -7.278 -4.499 1.00 0.00 N ATOM 0 H ASN A 41 -15.852 -6.063 -2.744 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.113 -6.183 -4.199 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -16.715 -6.334 -6.140 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -15.795 -5.463 -4.929 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -13.264 -7.928 -4.538 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -14.032 -6.497 -3.844 1.00 0.00 H new ATOM 629 N ARG A 42 -16.853 -9.218 -3.922 1.00 0.00 N ATOM 630 CA ARG A 42 -17.165 -10.635 -4.073 1.00 0.00 C ATOM 631 C ARG A 42 -16.828 -11.405 -2.802 1.00 0.00 C ATOM 632 O ARG A 42 -16.396 -12.557 -2.857 1.00 0.00 O ATOM 633 CB ARG A 42 -16.396 -11.222 -5.258 1.00 0.00 C ATOM 634 CG ARG A 42 -16.927 -12.569 -5.721 1.00 0.00 C ATOM 635 CD ARG A 42 -18.419 -12.514 -6.004 1.00 0.00 C ATOM 636 NE ARG A 42 -18.911 -13.760 -6.586 1.00 0.00 N ATOM 637 CZ ARG A 42 -20.191 -13.990 -6.862 1.00 0.00 C ATOM 638 NH1 ARG A 42 -21.102 -13.060 -6.612 1.00 0.00 N ATOM 639 NH2 ARG A 42 -20.561 -15.152 -7.385 1.00 0.00 N ATOM 0 H ARG A 42 -15.953 -9.029 -3.482 1.00 0.00 H new ATOM 0 HA ARG A 42 -18.235 -10.729 -4.259 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -16.436 -10.519 -6.090 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -15.347 -11.330 -4.982 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -16.396 -12.880 -6.621 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -16.728 -13.321 -4.958 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -18.956 -12.309 -5.078 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -18.629 -11.688 -6.684 1.00 0.00 H new ATOM 0 HE ARG A 42 -18.235 -14.495 -6.792 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -20.821 -12.167 -6.207 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -22.084 -13.238 -6.824 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -19.863 -15.871 -7.576 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -21.544 -15.327 -7.596 1.00 0.00 H new ATOM 653 N PHE A 43 -17.027 -10.762 -1.656 1.00 0.00 N ATOM 654 CA PHE A 43 -16.744 -11.387 -0.370 1.00 0.00 C ATOM 655 C PHE A 43 -15.354 -12.013 -0.368 1.00 0.00 C ATOM 656 O PHE A 43 -15.180 -13.164 0.037 1.00 0.00 O ATOM 657 CB PHE A 43 -17.796 -12.451 -0.053 1.00 0.00 C ATOM 658 CG PHE A 43 -18.763 -12.036 1.018 1.00 0.00 C ATOM 659 CD1 PHE A 43 -18.383 -12.040 2.355 1.00 0.00 C ATOM 660 CD2 PHE A 43 -20.056 -11.642 0.689 1.00 0.00 C ATOM 661 CE1 PHE A 43 -19.275 -11.657 3.346 1.00 0.00 C ATOM 662 CE2 PHE A 43 -20.952 -11.259 1.675 1.00 0.00 C ATOM 663 CZ PHE A 43 -20.560 -11.266 3.005 1.00 0.00 C ATOM 0 H PHE A 43 -17.383 -9.808 -1.592 1.00 0.00 H new ATOM 0 HA PHE A 43 -16.778 -10.614 0.398 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -18.351 -12.684 -0.962 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -17.293 -13.367 0.258 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -17.383 -12.345 2.625 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -20.365 -11.634 -0.346 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -18.968 -11.664 4.382 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -21.953 -10.956 1.408 1.00 0.00 H new ATOM 0 HZ PHE A 43 -21.256 -10.967 3.775 1.00 0.00 H new ATOM 673 N GLY A 44 -14.366 -11.250 -0.823 1.00 0.00 N ATOM 674 CA GLY A 44 -13.004 -11.748 -0.866 1.00 0.00 C ATOM 675 C GLY A 44 -11.983 -10.669 -0.560 1.00 0.00 C ATOM 676 O GLY A 44 -11.048 -10.891 0.210 1.00 0.00 O ATOM 0 H GLY A 44 -14.484 -10.296 -1.163 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -12.895 -12.561 -0.149 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.803 -12.164 -1.853 1.00 0.00 H new ATOM 680 N LYS A 45 -12.159 -9.501 -1.167 1.00 0.00 N ATOM 681 CA LYS A 45 -11.245 -8.384 -0.957 1.00 0.00 C ATOM 682 C LYS A 45 -11.989 -7.164 -0.426 1.00 0.00 C ATOM 683 O LYS A 45 -13.154 -6.940 -0.759 1.00 0.00 O ATOM 684 CB LYS A 45 -10.527 -8.031 -2.261 1.00 0.00 C ATOM 685 CG LYS A 45 -10.685 -9.082 -3.348 1.00 0.00 C ATOM 686 CD LYS A 45 -9.905 -8.713 -4.598 1.00 0.00 C ATOM 687 CE LYS A 45 -10.645 -7.677 -5.430 1.00 0.00 C ATOM 688 NZ LYS A 45 -11.367 -8.297 -6.575 1.00 0.00 N ATOM 0 H LYS A 45 -12.927 -9.303 -1.809 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.506 -8.688 -0.215 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -10.909 -7.079 -2.630 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -9.466 -7.890 -2.055 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.341 -10.047 -2.975 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.740 -9.194 -3.596 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -8.927 -8.324 -4.316 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.732 -9.607 -5.197 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.356 -7.144 -4.798 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -9.936 -6.939 -5.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -11.858 -7.558 -7.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -10.686 -8.784 -7.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -12.062 -8.983 -6.217 1.00 0.00 H new ATOM 702 N THR A 46 -11.310 -6.376 0.402 1.00 0.00 N ATOM 703 CA THR A 46 -11.907 -5.177 0.979 1.00 0.00 C ATOM 704 C THR A 46 -11.749 -3.986 0.041 1.00 0.00 C ATOM 705 O THR A 46 -10.979 -4.036 -0.919 1.00 0.00 O ATOM 706 CB THR A 46 -11.268 -4.865 2.333 1.00 0.00 C ATOM 707 OG1 THR A 46 -9.855 -4.890 2.239 1.00 0.00 O ATOM 708 CG2 THR A 46 -11.672 -5.836 3.422 1.00 0.00 C ATOM 0 H THR A 46 -10.346 -6.546 0.688 1.00 0.00 H new ATOM 0 HA THR A 46 -12.971 -5.364 1.123 1.00 0.00 H new ATOM 0 HB THR A 46 -11.628 -3.872 2.600 1.00 0.00 H new ATOM 0 HG1 THR A 46 -9.465 -4.686 3.115 1.00 0.00 H new ATOM 0 HG21 THR A 46 -11.184 -5.558 4.356 1.00 0.00 H new ATOM 0 HG22 THR A 46 -12.754 -5.805 3.554 1.00 0.00 H new ATOM 0 HG23 THR A 46 -11.370 -6.845 3.141 1.00 0.00 H new ATOM 716 N ALA A 47 -12.482 -2.914 0.322 1.00 0.00 N ATOM 717 CA ALA A 47 -12.422 -1.710 -0.498 1.00 0.00 C ATOM 718 C ALA A 47 -10.992 -1.194 -0.614 1.00 0.00 C ATOM 719 O ALA A 47 -10.654 -0.481 -1.560 1.00 0.00 O ATOM 720 CB ALA A 47 -13.330 -0.634 0.079 1.00 0.00 C ATOM 0 H ALA A 47 -13.125 -2.855 1.112 1.00 0.00 H new ATOM 0 HA ALA A 47 -12.769 -1.964 -1.499 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -13.276 0.260 -0.543 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -14.357 -0.998 0.102 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -13.009 -0.391 1.092 1.00 0.00 H new ATOM 726 N LEU A 48 -10.155 -1.556 0.353 1.00 0.00 N ATOM 727 CA LEU A 48 -8.761 -1.127 0.355 1.00 0.00 C ATOM 728 C LEU A 48 -7.960 -1.871 -0.710 1.00 0.00 C ATOM 729 O LEU A 48 -7.163 -1.272 -1.432 1.00 0.00 O ATOM 730 CB LEU A 48 -8.135 -1.352 1.733 1.00 0.00 C ATOM 731 CG LEU A 48 -7.564 -0.096 2.393 1.00 0.00 C ATOM 732 CD1 LEU A 48 -6.582 -0.471 3.493 1.00 0.00 C ATOM 733 CD2 LEU A 48 -6.894 0.790 1.355 1.00 0.00 C ATOM 0 H LEU A 48 -10.417 -2.144 1.144 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.736 -0.062 0.124 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -8.889 -1.781 2.393 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -7.338 -2.089 1.638 1.00 0.00 H new ATOM 0 HG LEU A 48 -8.385 0.462 2.844 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.186 0.435 3.951 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -7.093 -1.067 4.249 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.763 -1.050 3.067 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -6.493 1.680 1.840 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -6.083 0.241 0.877 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -7.625 1.086 0.603 1.00 0.00 H new ATOM 745 N GLN A 49 -8.178 -3.179 -0.802 1.00 0.00 N ATOM 746 CA GLN A 49 -7.477 -4.003 -1.780 1.00 0.00 C ATOM 747 C GLN A 49 -7.822 -3.568 -3.200 1.00 0.00 C ATOM 748 O GLN A 49 -7.085 -3.855 -4.145 1.00 0.00 O ATOM 749 CB GLN A 49 -7.830 -5.478 -1.583 1.00 0.00 C ATOM 750 CG GLN A 49 -6.647 -6.416 -1.755 1.00 0.00 C ATOM 751 CD GLN A 49 -5.849 -6.127 -3.011 1.00 0.00 C ATOM 752 OE1 GLN A 49 -6.388 -6.138 -4.118 1.00 0.00 O ATOM 753 NE2 GLN A 49 -4.558 -5.868 -2.845 1.00 0.00 N ATOM 0 H GLN A 49 -8.834 -3.691 -0.212 1.00 0.00 H new ATOM 0 HA GLN A 49 -6.405 -3.873 -1.629 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -8.247 -5.613 -0.585 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.608 -5.755 -2.294 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.993 -6.333 -0.887 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.006 -7.445 -1.786 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.154 -5.870 -1.909 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.970 -5.667 -3.654 1.00 0.00 H new ATOM 762 N VAL A 50 -8.946 -2.875 -3.345 1.00 0.00 N ATOM 763 CA VAL A 50 -9.389 -2.399 -4.649 1.00 0.00 C ATOM 764 C VAL A 50 -9.150 -0.900 -4.795 1.00 0.00 C ATOM 765 O VAL A 50 -8.839 -0.414 -5.883 1.00 0.00 O ATOM 766 CB VAL A 50 -10.883 -2.693 -4.878 1.00 0.00 C ATOM 767 CG1 VAL A 50 -11.121 -4.189 -5.007 1.00 0.00 C ATOM 768 CG2 VAL A 50 -11.722 -2.105 -3.754 1.00 0.00 C ATOM 0 H VAL A 50 -9.567 -2.630 -2.574 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.803 -2.934 -5.397 1.00 0.00 H new ATOM 0 HB VAL A 50 -11.188 -2.220 -5.812 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -12.183 -4.376 -5.168 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.552 -4.576 -5.852 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -10.799 -4.689 -4.093 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -12.775 -2.323 -3.933 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -11.417 -2.544 -2.804 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -11.576 -1.025 -3.718 1.00 0.00 H new ATOM 778 N MET A 51 -9.295 -0.173 -3.692 1.00 0.00 N ATOM 779 CA MET A 51 -9.095 1.271 -3.696 1.00 0.00 C ATOM 780 C MET A 51 -7.871 1.649 -4.524 1.00 0.00 C ATOM 781 O MET A 51 -6.815 1.027 -4.406 1.00 0.00 O ATOM 782 CB MET A 51 -8.935 1.789 -2.264 1.00 0.00 C ATOM 783 CG MET A 51 -8.473 3.236 -2.187 1.00 0.00 C ATOM 784 SD MET A 51 -7.171 3.485 -0.968 1.00 0.00 S ATOM 785 CE MET A 51 -5.776 2.750 -1.815 1.00 0.00 C ATOM 0 H MET A 51 -9.550 -0.561 -2.784 1.00 0.00 H new ATOM 0 HA MET A 51 -9.973 1.733 -4.147 1.00 0.00 H new ATOM 0 HB2 MET A 51 -9.888 1.693 -1.743 1.00 0.00 H new ATOM 0 HB3 MET A 51 -8.218 1.159 -1.737 1.00 0.00 H new ATOM 0 HG2 MET A 51 -8.113 3.551 -3.167 1.00 0.00 H new ATOM 0 HG3 MET A 51 -9.323 3.872 -1.940 1.00 0.00 H new ATOM 0 HE1 MET A 51 -4.860 3.262 -1.519 1.00 0.00 H new ATOM 0 HE2 MET A 51 -5.704 1.695 -1.550 1.00 0.00 H new ATOM 0 HE3 MET A 51 -5.913 2.845 -2.892 1.00 0.00 H new ATOM 795 N MET A 52 -8.019 2.671 -5.360 1.00 0.00 N ATOM 796 CA MET A 52 -6.923 3.128 -6.205 1.00 0.00 C ATOM 797 C MET A 52 -6.052 4.138 -5.465 1.00 0.00 C ATOM 798 O MET A 52 -6.562 5.057 -4.824 1.00 0.00 O ATOM 799 CB MET A 52 -7.468 3.754 -7.490 1.00 0.00 C ATOM 800 CG MET A 52 -8.400 4.931 -7.247 1.00 0.00 C ATOM 801 SD MET A 52 -7.554 6.519 -7.338 1.00 0.00 S ATOM 802 CE MET A 52 -8.359 7.252 -8.760 1.00 0.00 C ATOM 0 H MET A 52 -8.886 3.197 -5.470 1.00 0.00 H new ATOM 0 HA MET A 52 -6.310 2.264 -6.462 1.00 0.00 H new ATOM 0 HB2 MET A 52 -6.632 4.085 -8.106 1.00 0.00 H new ATOM 0 HB3 MET A 52 -8.000 2.991 -8.058 1.00 0.00 H new ATOM 0 HG2 MET A 52 -9.204 4.910 -7.982 1.00 0.00 H new ATOM 0 HG3 MET A 52 -8.863 4.826 -6.266 1.00 0.00 H new ATOM 0 HE1 MET A 52 -7.612 7.496 -9.516 1.00 0.00 H new ATOM 0 HE2 MET A 52 -9.078 6.546 -9.175 1.00 0.00 H new ATOM 0 HE3 MET A 52 -8.877 8.161 -8.456 1.00 0.00 H new ATOM 812 N PHE A 53 -4.737 3.965 -5.560 1.00 0.00 N ATOM 813 CA PHE A 53 -3.801 4.869 -4.900 1.00 0.00 C ATOM 814 C PHE A 53 -3.653 6.163 -5.694 1.00 0.00 C ATOM 815 O PHE A 53 -2.542 6.581 -6.018 1.00 0.00 O ATOM 816 CB PHE A 53 -2.433 4.201 -4.733 1.00 0.00 C ATOM 817 CG PHE A 53 -2.445 3.023 -3.802 1.00 0.00 C ATOM 818 CD1 PHE A 53 -3.151 1.866 -4.126 1.00 0.00 C ATOM 819 CD2 PHE A 53 -1.752 3.068 -2.597 1.00 0.00 C ATOM 820 CE1 PHE A 53 -3.161 0.779 -3.264 1.00 0.00 C ATOM 821 CE2 PHE A 53 -1.760 1.985 -1.734 1.00 0.00 C ATOM 822 CZ PHE A 53 -2.471 0.833 -2.077 1.00 0.00 C ATOM 0 H PHE A 53 -4.297 3.210 -6.086 1.00 0.00 H new ATOM 0 HA PHE A 53 -4.199 5.106 -3.913 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -2.075 3.877 -5.710 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -1.721 4.939 -4.362 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -3.696 1.815 -5.057 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -1.201 3.958 -2.331 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -3.712 -0.112 -3.527 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -1.219 2.031 -0.800 1.00 0.00 H new ATOM 0 HZ PHE A 53 -2.479 -0.016 -1.409 1.00 0.00 H new ATOM 832 N GLY A 54 -4.782 6.792 -6.003 1.00 0.00 N ATOM 833 CA GLY A 54 -4.760 8.034 -6.754 1.00 0.00 C ATOM 834 C GLY A 54 -5.072 9.232 -5.883 1.00 0.00 C ATOM 835 O GLY A 54 -4.256 10.145 -5.754 1.00 0.00 O ATOM 0 H GLY A 54 -5.713 6.464 -5.746 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.779 8.164 -7.210 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.484 7.979 -7.567 1.00 0.00 H new ATOM 839 N SER A 55 -6.254 9.225 -5.275 1.00 0.00 N ATOM 840 CA SER A 55 -6.668 10.314 -4.401 1.00 0.00 C ATOM 841 C SER A 55 -6.170 10.071 -2.981 1.00 0.00 C ATOM 842 O SER A 55 -6.590 9.118 -2.322 1.00 0.00 O ATOM 843 CB SER A 55 -8.191 10.454 -4.407 1.00 0.00 C ATOM 844 OG SER A 55 -8.766 9.733 -5.483 1.00 0.00 O ATOM 0 H SER A 55 -6.941 8.477 -5.372 1.00 0.00 H new ATOM 0 HA SER A 55 -6.231 11.241 -4.773 1.00 0.00 H new ATOM 0 HB2 SER A 55 -8.596 10.089 -3.463 1.00 0.00 H new ATOM 0 HB3 SER A 55 -8.462 11.507 -4.485 1.00 0.00 H new ATOM 0 HG SER A 55 -9.113 8.877 -5.155 1.00 0.00 H new ATOM 850 N PRO A 56 -5.260 10.925 -2.492 1.00 0.00 N ATOM 851 CA PRO A 56 -4.700 10.794 -1.146 1.00 0.00 C ATOM 852 C PRO A 56 -5.784 10.716 -0.078 1.00 0.00 C ATOM 853 O PRO A 56 -5.696 9.914 0.851 1.00 0.00 O ATOM 854 CB PRO A 56 -3.851 12.063 -0.968 1.00 0.00 C ATOM 855 CG PRO A 56 -4.233 12.967 -2.094 1.00 0.00 C ATOM 856 CD PRO A 56 -4.705 12.080 -3.208 1.00 0.00 C ATOM 0 HA PRO A 56 -4.124 9.875 -1.037 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.047 12.533 -0.005 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -2.787 11.829 -0.998 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -5.019 13.658 -1.788 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.384 13.571 -2.412 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -5.456 12.572 -3.826 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.888 11.791 -3.869 1.00 0.00 H new ATOM 864 N ALA A 57 -6.807 11.550 -0.217 1.00 0.00 N ATOM 865 CA ALA A 57 -7.908 11.567 0.736 1.00 0.00 C ATOM 866 C ALA A 57 -8.652 10.239 0.735 1.00 0.00 C ATOM 867 O ALA A 57 -9.150 9.794 1.768 1.00 0.00 O ATOM 868 CB ALA A 57 -8.862 12.711 0.425 1.00 0.00 C ATOM 0 H ALA A 57 -6.897 12.222 -0.979 1.00 0.00 H new ATOM 0 HA ALA A 57 -7.491 11.720 1.732 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -9.679 12.710 1.146 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -8.326 13.658 0.485 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -9.265 12.586 -0.580 1.00 0.00 H new ATOM 874 N VAL A 58 -8.720 9.606 -0.432 1.00 0.00 N ATOM 875 CA VAL A 58 -9.395 8.330 -0.569 1.00 0.00 C ATOM 876 C VAL A 58 -8.701 7.265 0.276 1.00 0.00 C ATOM 877 O VAL A 58 -9.355 6.431 0.902 1.00 0.00 O ATOM 878 CB VAL A 58 -9.437 7.896 -2.055 1.00 0.00 C ATOM 879 CG1 VAL A 58 -9.428 6.384 -2.195 1.00 0.00 C ATOM 880 CG2 VAL A 58 -10.652 8.491 -2.747 1.00 0.00 C ATOM 0 H VAL A 58 -8.313 9.962 -1.297 1.00 0.00 H new ATOM 0 HA VAL A 58 -10.419 8.442 -0.212 1.00 0.00 H new ATOM 0 HB VAL A 58 -8.537 8.276 -2.539 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -9.458 6.116 -3.251 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -8.520 5.982 -1.745 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -10.299 5.967 -1.690 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -10.667 8.176 -3.791 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.559 8.145 -2.251 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -10.603 9.579 -2.697 1.00 0.00 H new ATOM 890 N ALA A 59 -7.375 7.303 0.288 1.00 0.00 N ATOM 891 CA ALA A 59 -6.587 6.346 1.053 1.00 0.00 C ATOM 892 C ALA A 59 -6.861 6.474 2.547 1.00 0.00 C ATOM 893 O ALA A 59 -7.298 5.523 3.194 1.00 0.00 O ATOM 894 CB ALA A 59 -5.106 6.538 0.768 1.00 0.00 C ATOM 0 H ALA A 59 -6.821 7.989 -0.225 1.00 0.00 H new ATOM 0 HA ALA A 59 -6.880 5.343 0.744 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.528 5.817 1.346 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.917 6.386 -0.295 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.810 7.549 1.048 1.00 0.00 H new ATOM 900 N LEU A 60 -6.594 7.657 3.089 1.00 0.00 N ATOM 901 CA LEU A 60 -6.801 7.919 4.508 1.00 0.00 C ATOM 902 C LEU A 60 -8.274 7.799 4.891 1.00 0.00 C ATOM 903 O LEU A 60 -8.604 7.258 5.946 1.00 0.00 O ATOM 904 CB LEU A 60 -6.283 9.313 4.862 1.00 0.00 C ATOM 905 CG LEU A 60 -6.775 9.866 6.200 1.00 0.00 C ATOM 906 CD1 LEU A 60 -6.228 9.036 7.353 1.00 0.00 C ATOM 907 CD2 LEU A 60 -6.378 11.326 6.354 1.00 0.00 C ATOM 0 H LEU A 60 -6.232 8.453 2.564 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.246 7.169 5.071 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -5.193 9.286 4.876 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.575 10.004 4.071 1.00 0.00 H new ATOM 0 HG LEU A 60 -7.863 9.805 6.219 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.588 9.444 8.298 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.565 8.005 7.251 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.138 9.065 7.337 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -6.737 11.702 7.312 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.292 11.414 6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.820 11.910 5.547 1.00 0.00 H new ATOM 919 N GLU A 61 -9.152 8.313 4.036 1.00 0.00 N ATOM 920 CA GLU A 61 -10.590 8.273 4.296 1.00 0.00 C ATOM 921 C GLU A 61 -11.107 6.837 4.364 1.00 0.00 C ATOM 922 O GLU A 61 -11.869 6.488 5.264 1.00 0.00 O ATOM 923 CB GLU A 61 -11.348 9.045 3.216 1.00 0.00 C ATOM 924 CG GLU A 61 -11.298 10.554 3.396 1.00 0.00 C ATOM 925 CD GLU A 61 -12.537 11.248 2.863 1.00 0.00 C ATOM 926 OE1 GLU A 61 -12.809 11.126 1.649 1.00 0.00 O ATOM 927 OE2 GLU A 61 -13.234 11.911 3.656 1.00 0.00 O ATOM 0 H GLU A 61 -8.895 8.762 3.157 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.762 8.743 5.264 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.933 8.790 2.241 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.389 8.722 3.214 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -11.184 10.786 4.455 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -10.418 10.948 2.887 1.00 0.00 H new ATOM 934 N LEU A 62 -10.695 6.012 3.408 1.00 0.00 N ATOM 935 CA LEU A 62 -11.128 4.621 3.367 1.00 0.00 C ATOM 936 C LEU A 62 -10.653 3.860 4.600 1.00 0.00 C ATOM 937 O LEU A 62 -11.457 3.286 5.335 1.00 0.00 O ATOM 938 CB LEU A 62 -10.606 3.940 2.100 1.00 0.00 C ATOM 939 CG LEU A 62 -11.658 3.702 1.014 1.00 0.00 C ATOM 940 CD1 LEU A 62 -10.996 3.263 -0.284 1.00 0.00 C ATOM 941 CD2 LEU A 62 -12.675 2.668 1.472 1.00 0.00 C ATOM 0 H LEU A 62 -10.064 6.281 2.653 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.218 4.609 3.357 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.805 4.549 1.682 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.166 2.981 2.375 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.182 4.640 0.832 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.760 3.099 -1.044 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -10.308 4.038 -0.622 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.445 2.337 -0.117 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -13.415 2.512 0.687 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -12.167 1.727 1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -13.173 3.022 2.374 1.00 0.00 H new ATOM 953 N LEU A 63 -9.342 3.854 4.822 1.00 0.00 N ATOM 954 CA LEU A 63 -8.766 3.157 5.968 1.00 0.00 C ATOM 955 C LEU A 63 -9.241 3.767 7.286 1.00 0.00 C ATOM 956 O LEU A 63 -9.274 3.091 8.314 1.00 0.00 O ATOM 957 CB LEU A 63 -7.238 3.187 5.897 1.00 0.00 C ATOM 958 CG LEU A 63 -6.614 4.583 5.891 1.00 0.00 C ATOM 959 CD1 LEU A 63 -6.592 5.162 7.296 1.00 0.00 C ATOM 960 CD2 LEU A 63 -5.210 4.532 5.307 1.00 0.00 C ATOM 0 H LEU A 63 -8.660 4.322 4.226 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.105 2.122 5.932 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.840 2.632 6.746 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -6.922 2.661 4.996 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.223 5.234 5.264 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.145 6.156 7.273 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.611 5.231 7.677 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.005 4.515 7.947 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.778 5.533 5.309 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.590 3.868 5.909 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.255 4.158 4.284 1.00 0.00 H new ATOM 972 N LYS A 64 -9.606 5.046 7.251 1.00 0.00 N ATOM 973 CA LYS A 64 -10.076 5.738 8.445 1.00 0.00 C ATOM 974 C LYS A 64 -11.364 5.112 8.968 1.00 0.00 C ATOM 975 O LYS A 64 -11.501 4.856 10.164 1.00 0.00 O ATOM 976 CB LYS A 64 -10.307 7.220 8.146 1.00 0.00 C ATOM 977 CG LYS A 64 -9.224 8.132 8.704 1.00 0.00 C ATOM 978 CD LYS A 64 -9.752 8.992 9.842 1.00 0.00 C ATOM 979 CE LYS A 64 -9.314 8.456 11.196 1.00 0.00 C ATOM 980 NZ LYS A 64 -10.249 8.859 12.283 1.00 0.00 N ATOM 0 H LYS A 64 -9.585 5.622 6.410 1.00 0.00 H new ATOM 0 HA LYS A 64 -9.307 5.642 9.212 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.366 7.359 7.067 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -11.270 7.519 8.559 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -8.387 7.530 9.059 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -8.841 8.773 7.910 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -9.395 10.015 9.722 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -10.841 9.027 9.798 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -9.254 7.368 11.154 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -8.313 8.822 11.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -9.915 8.474 13.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -10.287 9.897 12.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.199 8.489 12.079 1.00 0.00 H new ATOM 994 N GLN A 65 -12.307 4.871 8.064 1.00 0.00 N ATOM 995 CA GLN A 65 -13.586 4.280 8.429 1.00 0.00 C ATOM 996 C GLN A 65 -13.388 3.008 9.248 1.00 0.00 C ATOM 997 O GLN A 65 -14.069 2.791 10.249 1.00 0.00 O ATOM 998 CB GLN A 65 -14.398 3.972 7.172 1.00 0.00 C ATOM 999 CG GLN A 65 -15.554 4.932 6.946 1.00 0.00 C ATOM 1000 CD GLN A 65 -16.391 5.141 8.192 1.00 0.00 C ATOM 1001 OE1 GLN A 65 -16.129 6.045 8.985 1.00 0.00 O ATOM 1002 NE2 GLN A 65 -17.405 4.302 8.372 1.00 0.00 N ATOM 0 H GLN A 65 -12.208 5.077 7.070 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.131 4.998 9.042 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -13.737 4.002 6.306 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -14.788 2.956 7.241 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -15.163 5.893 6.610 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.188 4.549 6.147 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -17.586 3.567 7.689 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -18.003 4.393 9.194 1.00 0.00 H new ATOM 1011 N GLY A 66 -12.452 2.172 8.814 1.00 0.00 N ATOM 1012 CA GLY A 66 -12.183 0.933 9.520 1.00 0.00 C ATOM 1013 C GLY A 66 -11.746 -0.182 8.593 1.00 0.00 C ATOM 1014 O GLY A 66 -12.127 -1.338 8.777 1.00 0.00 O ATOM 0 H GLY A 66 -11.875 2.329 7.987 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.407 1.105 10.266 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -13.079 0.623 10.058 1.00 0.00 H new ATOM 1018 N ALA A 67 -10.942 0.163 7.592 1.00 0.00 N ATOM 1019 CA ALA A 67 -10.450 -0.818 6.634 1.00 0.00 C ATOM 1020 C ALA A 67 -9.139 -1.435 7.109 1.00 0.00 C ATOM 1021 O ALA A 67 -8.445 -0.867 7.951 1.00 0.00 O ATOM 1022 CB ALA A 67 -10.271 -0.179 5.266 1.00 0.00 C ATOM 0 H ALA A 67 -10.618 1.115 7.424 1.00 0.00 H new ATOM 0 HA ALA A 67 -11.190 -1.615 6.554 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.903 -0.925 4.561 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.228 0.208 4.917 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -9.553 0.638 5.337 1.00 0.00 H new ATOM 1028 N SER A 68 -8.807 -2.600 6.564 1.00 0.00 N ATOM 1029 CA SER A 68 -7.580 -3.292 6.937 1.00 0.00 C ATOM 1030 C SER A 68 -6.671 -3.483 5.727 1.00 0.00 C ATOM 1031 O SER A 68 -6.982 -4.257 4.820 1.00 0.00 O ATOM 1032 CB SER A 68 -7.906 -4.648 7.564 1.00 0.00 C ATOM 1033 OG SER A 68 -7.741 -4.612 8.972 1.00 0.00 O ATOM 0 H SER A 68 -9.369 -3.084 5.864 1.00 0.00 H new ATOM 0 HA SER A 68 -7.055 -2.678 7.668 1.00 0.00 H new ATOM 0 HB2 SER A 68 -8.931 -4.927 7.322 1.00 0.00 H new ATOM 0 HB3 SER A 68 -7.258 -5.414 7.138 1.00 0.00 H new ATOM 0 HG SER A 68 -7.957 -5.490 9.349 1.00 0.00 H new ATOM 1039 N PRO A 69 -5.532 -2.774 5.699 1.00 0.00 N ATOM 1040 CA PRO A 69 -4.570 -2.861 4.597 1.00 0.00 C ATOM 1041 C PRO A 69 -3.712 -4.122 4.671 1.00 0.00 C ATOM 1042 O PRO A 69 -2.760 -4.280 3.907 1.00 0.00 O ATOM 1043 CB PRO A 69 -3.709 -1.616 4.798 1.00 0.00 C ATOM 1044 CG PRO A 69 -3.737 -1.377 6.269 1.00 0.00 C ATOM 1045 CD PRO A 69 -5.094 -1.829 6.742 1.00 0.00 C ATOM 0 HA PRO A 69 -5.060 -2.912 3.624 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -2.692 -1.775 4.441 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -4.110 -0.763 4.250 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -2.945 -1.934 6.769 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -3.577 -0.323 6.495 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -5.038 -2.309 7.719 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -5.784 -0.991 6.838 1.00 0.00 H new ATOM 1053 N ASN A 70 -4.054 -5.014 5.596 1.00 0.00 N ATOM 1054 CA ASN A 70 -3.313 -6.259 5.770 1.00 0.00 C ATOM 1055 C ASN A 70 -3.885 -7.367 4.889 1.00 0.00 C ATOM 1056 O ASN A 70 -3.755 -8.550 5.202 1.00 0.00 O ATOM 1057 CB ASN A 70 -3.345 -6.694 7.237 1.00 0.00 C ATOM 1058 CG ASN A 70 -2.330 -5.951 8.085 1.00 0.00 C ATOM 1059 OD1 ASN A 70 -1.143 -6.279 8.083 1.00 0.00 O ATOM 1060 ND2 ASN A 70 -2.795 -4.945 8.817 1.00 0.00 N ATOM 0 H ASN A 70 -4.839 -4.898 6.236 1.00 0.00 H new ATOM 0 HA ASN A 70 -2.280 -6.080 5.470 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -4.343 -6.526 7.641 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -3.152 -7.765 7.299 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -2.160 -4.409 9.409 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -3.787 -4.709 8.787 1.00 0.00 H new ATOM 1067 N VAL A 71 -4.516 -6.976 3.786 1.00 0.00 N ATOM 1068 CA VAL A 71 -5.104 -7.938 2.862 1.00 0.00 C ATOM 1069 C VAL A 71 -4.289 -8.032 1.578 1.00 0.00 C ATOM 1070 O VAL A 71 -3.823 -7.022 1.052 1.00 0.00 O ATOM 1071 CB VAL A 71 -6.557 -7.564 2.509 1.00 0.00 C ATOM 1072 CG1 VAL A 71 -7.365 -7.315 3.774 1.00 0.00 C ATOM 1073 CG2 VAL A 71 -6.593 -6.348 1.597 1.00 0.00 C ATOM 0 H VAL A 71 -4.633 -6.001 3.511 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.099 -8.905 3.365 1.00 0.00 H new ATOM 0 HB VAL A 71 -7.007 -8.400 1.974 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -8.388 -7.052 3.506 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -7.370 -8.217 4.386 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -6.916 -6.497 4.337 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -7.628 -6.101 1.360 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.124 -5.502 2.100 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.053 -6.568 0.676 1.00 0.00 H new ATOM 1083 N GLN A 72 -4.116 -9.252 1.078 1.00 0.00 N ATOM 1084 CA GLN A 72 -3.353 -9.475 -0.146 1.00 0.00 C ATOM 1085 C GLN A 72 -4.211 -10.143 -1.215 1.00 0.00 C ATOM 1086 O GLN A 72 -5.166 -10.854 -0.903 1.00 0.00 O ATOM 1087 CB GLN A 72 -2.123 -10.339 0.145 1.00 0.00 C ATOM 1088 CG GLN A 72 -1.350 -9.902 1.377 1.00 0.00 C ATOM 1089 CD GLN A 72 -0.886 -11.073 2.219 1.00 0.00 C ATOM 1090 OE1 GLN A 72 -1.398 -12.186 2.093 1.00 0.00 O ATOM 1091 NE2 GLN A 72 0.090 -10.829 3.087 1.00 0.00 N ATOM 0 H GLN A 72 -4.493 -10.100 1.501 1.00 0.00 H new ATOM 0 HA GLN A 72 -3.030 -8.504 -0.521 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -2.439 -11.374 0.273 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -1.459 -10.313 -0.719 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -0.485 -9.315 1.069 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -1.978 -9.250 1.983 1.00 0.00 H new ATOM 0 HE21 GLN A 72 0.486 -9.892 3.159 1.00 0.00 H new ATOM 0 HE22 GLN A 72 0.443 -11.579 3.681 1.00 0.00 H new ATOM 1100 N ASP A 73 -3.862 -9.908 -2.475 1.00 0.00 N ATOM 1101 CA ASP A 73 -4.597 -10.486 -3.593 1.00 0.00 C ATOM 1102 C ASP A 73 -3.707 -10.598 -4.828 1.00 0.00 C ATOM 1103 O ASP A 73 -2.512 -10.306 -4.771 1.00 0.00 O ATOM 1104 CB ASP A 73 -5.830 -9.640 -3.913 1.00 0.00 C ATOM 1105 CG ASP A 73 -5.485 -8.392 -4.701 1.00 0.00 C ATOM 1106 OD1 ASP A 73 -4.966 -7.432 -4.094 1.00 0.00 O ATOM 1107 OD2 ASP A 73 -5.734 -8.374 -5.924 1.00 0.00 O ATOM 0 H ASP A 73 -3.074 -9.321 -2.748 1.00 0.00 H new ATOM 0 HA ASP A 73 -4.918 -11.487 -3.306 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -6.542 -10.240 -4.480 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -6.323 -9.355 -2.984 1.00 0.00 H new ATOM 1112 N ALA A 74 -4.297 -11.020 -5.941 1.00 0.00 N ATOM 1113 CA ALA A 74 -3.557 -11.169 -7.188 1.00 0.00 C ATOM 1114 C ALA A 74 -2.547 -12.307 -7.097 1.00 0.00 C ATOM 1115 O ALA A 74 -2.640 -13.294 -7.827 1.00 0.00 O ATOM 1116 CB ALA A 74 -2.856 -9.866 -7.543 1.00 0.00 C ATOM 0 H ALA A 74 -5.285 -11.265 -6.005 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.269 -11.414 -7.976 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -2.307 -9.991 -8.476 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.596 -9.075 -7.661 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.162 -9.598 -6.747 1.00 0.00 H new ATOM 1122 N SER A 75 -1.582 -12.163 -6.196 1.00 0.00 N ATOM 1123 CA SER A 75 -0.552 -13.179 -6.009 1.00 0.00 C ATOM 1124 C SER A 75 0.281 -12.889 -4.765 1.00 0.00 C ATOM 1125 O SER A 75 1.478 -13.173 -4.728 1.00 0.00 O ATOM 1126 CB SER A 75 0.355 -13.249 -7.238 1.00 0.00 C ATOM 1127 OG SER A 75 0.479 -14.580 -7.706 1.00 0.00 O ATOM 0 H SER A 75 -1.491 -11.353 -5.583 1.00 0.00 H new ATOM 0 HA SER A 75 -1.048 -14.141 -5.876 1.00 0.00 H new ATOM 0 HB2 SER A 75 -0.051 -12.618 -8.029 1.00 0.00 H new ATOM 0 HB3 SER A 75 1.340 -12.854 -6.989 1.00 0.00 H new ATOM 0 HG SER A 75 1.062 -14.597 -8.493 1.00 0.00 H new ATOM 1133 N GLY A 76 -0.359 -12.321 -3.749 1.00 0.00 N ATOM 1134 CA GLY A 76 0.340 -12.003 -2.518 1.00 0.00 C ATOM 1135 C GLY A 76 0.929 -10.607 -2.528 1.00 0.00 C ATOM 1136 O GLY A 76 2.149 -10.439 -2.507 1.00 0.00 O ATOM 0 H GLY A 76 -1.349 -12.075 -3.756 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -0.349 -12.097 -1.678 1.00 0.00 H new ATOM 0 HA3 GLY A 76 1.137 -12.729 -2.359 1.00 0.00 H new ATOM 1140 N THR A 77 0.061 -9.601 -2.558 1.00 0.00 N ATOM 1141 CA THR A 77 0.501 -8.211 -2.571 1.00 0.00 C ATOM 1142 C THR A 77 -0.595 -7.292 -2.043 1.00 0.00 C ATOM 1143 O THR A 77 -1.567 -7.002 -2.741 1.00 0.00 O ATOM 1144 CB THR A 77 0.896 -7.794 -3.987 1.00 0.00 C ATOM 1145 OG1 THR A 77 0.015 -8.361 -4.940 1.00 0.00 O ATOM 1146 CG2 THR A 77 2.303 -8.205 -4.360 1.00 0.00 C ATOM 0 H THR A 77 -0.952 -9.723 -2.574 1.00 0.00 H new ATOM 0 HA THR A 77 1.370 -8.122 -1.919 1.00 0.00 H new ATOM 0 HB THR A 77 0.839 -6.706 -3.995 1.00 0.00 H new ATOM 0 HG1 THR A 77 -0.912 -8.201 -4.664 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.520 -7.879 -5.377 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.011 -7.743 -3.672 1.00 0.00 H new ATOM 0 HG23 THR A 77 2.393 -9.290 -4.300 1.00 0.00 H new ATOM 1154 N SER A 78 -0.433 -6.837 -0.805 1.00 0.00 N ATOM 1155 CA SER A 78 -1.411 -5.952 -0.183 1.00 0.00 C ATOM 1156 C SER A 78 -1.381 -4.567 -0.823 1.00 0.00 C ATOM 1157 O SER A 78 -0.680 -4.341 -1.809 1.00 0.00 O ATOM 1158 CB SER A 78 -1.148 -5.844 1.320 1.00 0.00 C ATOM 1159 OG SER A 78 -0.375 -4.695 1.622 1.00 0.00 O ATOM 0 H SER A 78 0.365 -7.066 -0.213 1.00 0.00 H new ATOM 0 HA SER A 78 -2.402 -6.379 -0.340 1.00 0.00 H new ATOM 0 HB2 SER A 78 -2.096 -5.799 1.856 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.628 -6.737 1.666 1.00 0.00 H new ATOM 0 HG SER A 78 -0.222 -4.648 2.589 1.00 0.00 H new ATOM 1165 N PRO A 79 -2.151 -3.621 -0.264 1.00 0.00 N ATOM 1166 CA PRO A 79 -2.220 -2.249 -0.776 1.00 0.00 C ATOM 1167 C PRO A 79 -0.841 -1.628 -0.971 1.00 0.00 C ATOM 1168 O PRO A 79 -0.535 -1.092 -2.037 1.00 0.00 O ATOM 1169 CB PRO A 79 -2.992 -1.505 0.316 1.00 0.00 C ATOM 1170 CG PRO A 79 -3.816 -2.553 0.981 1.00 0.00 C ATOM 1171 CD PRO A 79 -3.013 -3.820 0.913 1.00 0.00 C ATOM 0 HA PRO A 79 -2.690 -2.204 -1.759 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -2.315 -1.027 1.023 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -3.618 -0.719 -0.107 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -4.030 -2.282 2.015 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -4.775 -2.672 0.477 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -2.426 -3.972 1.819 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -3.653 -4.695 0.798 1.00 0.00 H new ATOM 1179 N VAL A 80 -0.012 -1.701 0.065 1.00 0.00 N ATOM 1180 CA VAL A 80 1.330 -1.149 0.014 1.00 0.00 C ATOM 1181 C VAL A 80 2.152 -1.788 -1.101 1.00 0.00 C ATOM 1182 O VAL A 80 2.859 -1.100 -1.837 1.00 0.00 O ATOM 1183 CB VAL A 80 2.055 -1.355 1.353 1.00 0.00 C ATOM 1184 CG1 VAL A 80 1.454 -0.465 2.429 1.00 0.00 C ATOM 1185 CG2 VAL A 80 2.004 -2.818 1.768 1.00 0.00 C ATOM 0 H VAL A 80 -0.251 -2.141 0.954 1.00 0.00 H new ATOM 0 HA VAL A 80 1.231 -0.082 -0.187 1.00 0.00 H new ATOM 0 HB VAL A 80 3.101 -1.074 1.226 1.00 0.00 H new ATOM 0 HG11 VAL A 80 1.981 -0.625 3.370 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.550 0.580 2.133 1.00 0.00 H new ATOM 0 HG13 VAL A 80 0.400 -0.710 2.557 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.522 -2.945 2.718 1.00 0.00 H new ATOM 0 HG22 VAL A 80 0.965 -3.129 1.877 1.00 0.00 H new ATOM 0 HG23 VAL A 80 2.488 -3.429 1.006 1.00 0.00 H new ATOM 1195 N HIS A 81 2.055 -3.109 -1.219 1.00 0.00 N ATOM 1196 CA HIS A 81 2.791 -3.842 -2.242 1.00 0.00 C ATOM 1197 C HIS A 81 2.379 -3.393 -3.641 1.00 0.00 C ATOM 1198 O HIS A 81 3.197 -3.360 -4.560 1.00 0.00 O ATOM 1199 CB HIS A 81 2.557 -5.346 -2.090 1.00 0.00 C ATOM 1200 CG HIS A 81 3.289 -5.956 -0.935 1.00 0.00 C ATOM 1201 ND1 HIS A 81 2.844 -7.108 -0.334 1.00 0.00 N ATOM 1202 CD2 HIS A 81 4.420 -5.540 -0.314 1.00 0.00 C ATOM 1203 CE1 HIS A 81 3.706 -7.367 0.633 1.00 0.00 C ATOM 1204 NE2 HIS A 81 4.679 -6.444 0.684 1.00 0.00 N ATOM 0 H HIS A 81 1.473 -3.693 -0.618 1.00 0.00 H new ATOM 0 HA HIS A 81 3.852 -3.629 -2.110 1.00 0.00 H new ATOM 0 HB2 HIS A 81 1.489 -5.528 -1.969 1.00 0.00 H new ATOM 0 HB3 HIS A 81 2.864 -5.847 -3.008 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.004 -4.665 -0.558 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.636 -8.215 1.299 1.00 0.00 H new ATOM 0 HE2 HIS A 81 5.461 -6.420 1.339 1.00 0.00 H new ATOM 1212 N ASP A 82 1.104 -3.051 -3.796 1.00 0.00 N ATOM 1213 CA ASP A 82 0.582 -2.608 -5.084 1.00 0.00 C ATOM 1214 C ASP A 82 1.075 -1.204 -5.422 1.00 0.00 C ATOM 1215 O ASP A 82 1.593 -0.964 -6.513 1.00 0.00 O ATOM 1216 CB ASP A 82 -0.947 -2.635 -5.073 1.00 0.00 C ATOM 1217 CG ASP A 82 -1.510 -2.879 -3.687 1.00 0.00 C ATOM 1218 OD1 ASP A 82 -1.288 -3.980 -3.141 1.00 0.00 O ATOM 1219 OD2 ASP A 82 -2.174 -1.969 -3.148 1.00 0.00 O ATOM 0 H ASP A 82 0.413 -3.072 -3.046 1.00 0.00 H new ATOM 0 HA ASP A 82 0.947 -3.293 -5.849 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -1.327 -1.688 -5.455 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -1.299 -3.415 -5.748 1.00 0.00 H new ATOM 1224 N ALA A 83 0.904 -0.280 -4.482 1.00 0.00 N ATOM 1225 CA ALA A 83 1.327 1.102 -4.685 1.00 0.00 C ATOM 1226 C ALA A 83 2.848 1.219 -4.699 1.00 0.00 C ATOM 1227 O ALA A 83 3.397 2.257 -5.071 1.00 0.00 O ATOM 1228 CB ALA A 83 0.736 1.998 -3.605 1.00 0.00 C ATOM 0 H ALA A 83 0.476 -0.462 -3.574 1.00 0.00 H new ATOM 0 HA ALA A 83 0.957 1.428 -5.657 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.059 3.026 -3.768 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.352 1.949 -3.647 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.077 1.661 -2.626 1.00 0.00 H new ATOM 1234 N ALA A 84 3.524 0.151 -4.290 1.00 0.00 N ATOM 1235 CA ALA A 84 4.981 0.136 -4.254 1.00 0.00 C ATOM 1236 C ALA A 84 5.572 0.039 -5.658 1.00 0.00 C ATOM 1237 O ALA A 84 6.531 0.737 -5.988 1.00 0.00 O ATOM 1238 CB ALA A 84 5.473 -1.018 -3.392 1.00 0.00 C ATOM 0 H ALA A 84 3.086 -0.716 -3.979 1.00 0.00 H new ATOM 0 HA ALA A 84 5.316 1.076 -3.816 1.00 0.00 H new ATOM 0 HB1 ALA A 84 6.563 -1.019 -3.373 1.00 0.00 H new ATOM 0 HB2 ALA A 84 5.092 -0.902 -2.377 1.00 0.00 H new ATOM 0 HB3 ALA A 84 5.117 -1.960 -3.808 1.00 0.00 H new ATOM 1244 N ARG A 85 4.998 -0.834 -6.481 1.00 0.00 N ATOM 1245 CA ARG A 85 5.472 -1.025 -7.849 1.00 0.00 C ATOM 1246 C ARG A 85 5.347 0.261 -8.662 1.00 0.00 C ATOM 1247 O ARG A 85 6.338 0.775 -9.182 1.00 0.00 O ATOM 1248 CB ARG A 85 4.690 -2.150 -8.531 1.00 0.00 C ATOM 1249 CG ARG A 85 5.245 -3.538 -8.247 1.00 0.00 C ATOM 1250 CD ARG A 85 6.763 -3.563 -8.325 1.00 0.00 C ATOM 1251 NE ARG A 85 7.260 -4.798 -8.925 1.00 0.00 N ATOM 1252 CZ ARG A 85 8.513 -5.226 -8.799 1.00 0.00 C ATOM 1253 NH1 ARG A 85 9.389 -4.520 -8.098 1.00 0.00 N ATOM 1254 NH2 ARG A 85 8.889 -6.359 -9.374 1.00 0.00 N ATOM 0 H ARG A 85 4.204 -1.421 -6.225 1.00 0.00 H new ATOM 0 HA ARG A 85 6.526 -1.299 -7.801 1.00 0.00 H new ATOM 0 HB2 ARG A 85 3.651 -2.109 -8.203 1.00 0.00 H new ATOM 0 HB3 ARG A 85 4.691 -1.981 -9.608 1.00 0.00 H new ATOM 0 HG2 ARG A 85 4.926 -3.862 -7.256 1.00 0.00 H new ATOM 0 HG3 ARG A 85 4.832 -4.249 -8.963 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.110 -2.711 -8.909 1.00 0.00 H new ATOM 0 HD3 ARG A 85 7.179 -3.453 -7.324 1.00 0.00 H new ATOM 0 HE ARG A 85 6.610 -5.364 -9.471 1.00 0.00 H new ATOM 0 HH11 ARG A 85 9.102 -3.647 -7.654 1.00 0.00 H new ATOM 0 HH12 ARG A 85 10.350 -4.849 -8.002 1.00 0.00 H new ATOM 0 HH21 ARG A 85 8.217 -6.904 -9.914 1.00 0.00 H new ATOM 0 HH22 ARG A 85 9.850 -6.686 -9.276 1.00 0.00 H new ATOM 1268 N THR A 86 4.127 0.779 -8.765 1.00 0.00 N ATOM 1269 CA THR A 86 3.883 2.007 -9.513 1.00 0.00 C ATOM 1270 C THR A 86 4.426 3.208 -8.754 1.00 0.00 C ATOM 1271 O THR A 86 4.702 4.257 -9.336 1.00 0.00 O ATOM 1272 CB THR A 86 2.384 2.186 -9.766 1.00 0.00 C ATOM 1273 OG1 THR A 86 1.805 3.020 -8.779 1.00 0.00 O ATOM 1274 CG2 THR A 86 1.616 0.881 -9.771 1.00 0.00 C ATOM 0 H THR A 86 3.295 0.369 -8.341 1.00 0.00 H new ATOM 0 HA THR A 86 4.398 1.934 -10.471 1.00 0.00 H new ATOM 0 HB THR A 86 2.311 2.635 -10.756 1.00 0.00 H new ATOM 0 HG1 THR A 86 1.055 2.553 -8.355 1.00 0.00 H new ATOM 0 HG21 THR A 86 0.560 1.081 -9.956 1.00 0.00 H new ATOM 0 HG22 THR A 86 2.005 0.233 -10.556 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.728 0.389 -8.805 1.00 0.00 H new ATOM 1282 N GLY A 87 4.571 3.042 -7.446 1.00 0.00 N ATOM 1283 CA GLY A 87 5.074 4.110 -6.609 1.00 0.00 C ATOM 1284 C GLY A 87 3.972 4.748 -5.795 1.00 0.00 C ATOM 1285 O GLY A 87 3.989 4.693 -4.566 1.00 0.00 O ATOM 0 H GLY A 87 4.347 2.180 -6.948 1.00 0.00 H new ATOM 0 HA2 GLY A 87 5.840 3.718 -5.940 1.00 0.00 H new ATOM 0 HA3 GLY A 87 5.551 4.867 -7.232 1.00 0.00 H new ATOM 1289 N PHE A 88 3.011 5.348 -6.493 1.00 0.00 N ATOM 1290 CA PHE A 88 1.877 6.008 -5.849 1.00 0.00 C ATOM 1291 C PHE A 88 2.292 6.570 -4.501 1.00 0.00 C ATOM 1292 O PHE A 88 1.534 6.537 -3.534 1.00 0.00 O ATOM 1293 CB PHE A 88 0.714 5.028 -5.685 1.00 0.00 C ATOM 1294 CG PHE A 88 0.077 4.637 -6.988 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -0.074 5.566 -8.011 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -0.375 3.338 -7.190 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -0.665 5.206 -9.213 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -0.964 2.972 -8.390 1.00 0.00 C ATOM 1299 CZ PHE A 88 -1.096 3.915 -9.412 1.00 0.00 C ATOM 0 H PHE A 88 2.995 5.391 -7.512 1.00 0.00 H new ATOM 0 HA PHE A 88 1.547 6.832 -6.482 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.073 4.131 -5.180 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.041 5.476 -5.040 1.00 0.00 H new ATOM 0 HD1 PHE A 88 0.273 6.579 -7.868 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -0.266 2.606 -6.403 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.787 5.941 -9.995 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.319 1.962 -8.534 1.00 0.00 H new ATOM 0 HZ PHE A 88 -1.536 3.631 -10.357 1.00 0.00 H new ATOM 1309 N LEU A 89 3.517 7.073 -4.453 1.00 0.00 N ATOM 1310 CA LEU A 89 4.075 7.636 -3.229 1.00 0.00 C ATOM 1311 C LEU A 89 3.140 8.673 -2.613 1.00 0.00 C ATOM 1312 O LEU A 89 2.955 8.705 -1.396 1.00 0.00 O ATOM 1313 CB LEU A 89 5.437 8.268 -3.516 1.00 0.00 C ATOM 1314 CG LEU A 89 6.123 8.899 -2.305 1.00 0.00 C ATOM 1315 CD1 LEU A 89 5.668 10.339 -2.125 1.00 0.00 C ATOM 1316 CD2 LEU A 89 5.841 8.084 -1.053 1.00 0.00 C ATOM 0 H LEU A 89 4.149 7.103 -5.253 1.00 0.00 H new ATOM 0 HA LEU A 89 4.195 6.824 -2.512 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.095 7.504 -3.931 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.312 9.032 -4.283 1.00 0.00 H new ATOM 0 HG LEU A 89 7.199 8.902 -2.477 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.167 10.772 -1.258 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.922 10.915 -3.015 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.589 10.363 -1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.336 8.546 -0.199 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.766 8.051 -0.875 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.218 7.070 -1.186 1.00 0.00 H new ATOM 1328 N ASP A 90 2.551 9.517 -3.451 1.00 0.00 N ATOM 1329 CA ASP A 90 1.638 10.549 -2.970 1.00 0.00 C ATOM 1330 C ASP A 90 0.488 9.932 -2.179 1.00 0.00 C ATOM 1331 O ASP A 90 0.332 10.192 -0.986 1.00 0.00 O ATOM 1332 CB ASP A 90 1.087 11.363 -4.142 1.00 0.00 C ATOM 1333 CG ASP A 90 -0.411 11.572 -4.050 1.00 0.00 C ATOM 1334 OD1 ASP A 90 -0.932 11.640 -2.917 1.00 0.00 O ATOM 1335 OD2 ASP A 90 -1.063 11.669 -5.111 1.00 0.00 O ATOM 0 H ASP A 90 2.687 9.509 -4.462 1.00 0.00 H new ATOM 0 HA ASP A 90 2.197 11.212 -2.309 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.585 12.332 -4.173 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.323 10.854 -5.076 1.00 0.00 H new ATOM 1340 N THR A 91 -0.316 9.114 -2.852 1.00 0.00 N ATOM 1341 CA THR A 91 -1.453 8.461 -2.211 1.00 0.00 C ATOM 1342 C THR A 91 -0.986 7.365 -1.260 1.00 0.00 C ATOM 1343 O THR A 91 -1.452 7.278 -0.125 1.00 0.00 O ATOM 1344 CB THR A 91 -2.390 7.875 -3.268 1.00 0.00 C ATOM 1345 OG1 THR A 91 -2.031 8.326 -4.561 1.00 0.00 O ATOM 1346 CG2 THR A 91 -3.843 8.234 -3.043 1.00 0.00 C ATOM 0 H THR A 91 -0.201 8.888 -3.840 1.00 0.00 H new ATOM 0 HA THR A 91 -1.993 9.210 -1.632 1.00 0.00 H new ATOM 0 HB THR A 91 -2.282 6.794 -3.183 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.840 7.555 -5.135 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.454 7.787 -3.827 1.00 0.00 H new ATOM 0 HG22 THR A 91 -4.165 7.856 -2.073 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.958 9.318 -3.067 1.00 0.00 H new ATOM 1354 N LEU A 92 -0.057 6.535 -1.723 1.00 0.00 N ATOM 1355 CA LEU A 92 0.470 5.457 -0.899 1.00 0.00 C ATOM 1356 C LEU A 92 0.946 6.010 0.435 1.00 0.00 C ATOM 1357 O LEU A 92 0.690 5.431 1.490 1.00 0.00 O ATOM 1358 CB LEU A 92 1.623 4.747 -1.614 1.00 0.00 C ATOM 1359 CG LEU A 92 2.342 3.680 -0.785 1.00 0.00 C ATOM 1360 CD1 LEU A 92 1.538 2.388 -0.768 1.00 0.00 C ATOM 1361 CD2 LEU A 92 3.739 3.434 -1.330 1.00 0.00 C ATOM 0 H LEU A 92 0.344 6.589 -2.659 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.326 4.733 -0.723 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.236 4.281 -2.520 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.352 5.495 -1.926 1.00 0.00 H new ATOM 0 HG LEU A 92 2.433 4.041 0.239 1.00 0.00 H new ATOM 0 HD11 LEU A 92 2.064 1.640 -0.174 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.558 2.575 -0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.416 2.022 -1.787 1.00 0.00 H new ATOM 0 HD21 LEU A 92 4.235 2.673 -0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 92 3.672 3.093 -2.363 1.00 0.00 H new ATOM 0 HD23 LEU A 92 4.313 4.360 -1.290 1.00 0.00 H new ATOM 1373 N LYS A 93 1.632 7.146 0.376 1.00 0.00 N ATOM 1374 CA LYS A 93 2.138 7.798 1.573 1.00 0.00 C ATOM 1375 C LYS A 93 1.014 8.014 2.578 1.00 0.00 C ATOM 1376 O LYS A 93 1.210 7.875 3.783 1.00 0.00 O ATOM 1377 CB LYS A 93 2.781 9.139 1.211 1.00 0.00 C ATOM 1378 CG LYS A 93 3.246 9.941 2.414 1.00 0.00 C ATOM 1379 CD LYS A 93 4.544 10.678 2.123 1.00 0.00 C ATOM 1380 CE LYS A 93 4.464 11.458 0.820 1.00 0.00 C ATOM 1381 NZ LYS A 93 4.357 12.925 1.055 1.00 0.00 N ATOM 0 H LYS A 93 1.850 7.634 -0.493 1.00 0.00 H new ATOM 0 HA LYS A 93 2.892 7.154 2.026 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.633 8.958 0.556 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.064 9.734 0.645 1.00 0.00 H new ATOM 0 HG2 LYS A 93 2.474 10.658 2.695 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.387 9.274 3.265 1.00 0.00 H new ATOM 0 HD2 LYS A 93 4.768 11.360 2.943 1.00 0.00 H new ATOM 0 HD3 LYS A 93 5.365 9.963 2.070 1.00 0.00 H new ATOM 0 HE2 LYS A 93 5.349 11.251 0.218 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.602 11.119 0.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 4.305 13.420 0.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.499 13.126 1.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 5.192 13.254 1.580 1.00 0.00 H new ATOM 1395 N VAL A 94 -0.168 8.352 2.069 1.00 0.00 N ATOM 1396 CA VAL A 94 -1.325 8.585 2.923 1.00 0.00 C ATOM 1397 C VAL A 94 -1.626 7.363 3.786 1.00 0.00 C ATOM 1398 O VAL A 94 -1.604 7.439 5.014 1.00 0.00 O ATOM 1399 CB VAL A 94 -2.577 8.941 2.094 1.00 0.00 C ATOM 1400 CG1 VAL A 94 -3.828 8.877 2.958 1.00 0.00 C ATOM 1401 CG2 VAL A 94 -2.427 10.318 1.466 1.00 0.00 C ATOM 0 H VAL A 94 -0.348 8.470 1.072 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.077 9.428 3.568 1.00 0.00 H new ATOM 0 HB VAL A 94 -2.679 8.209 1.293 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.700 9.131 2.355 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.944 7.869 3.357 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.738 9.585 3.782 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -3.319 10.552 0.885 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.299 11.064 2.251 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.555 10.326 0.811 1.00 0.00 H new ATOM 1411 N LEU A 95 -1.907 6.238 3.137 1.00 0.00 N ATOM 1412 CA LEU A 95 -2.215 5.001 3.846 1.00 0.00 C ATOM 1413 C LEU A 95 -0.960 4.400 4.472 1.00 0.00 C ATOM 1414 O LEU A 95 -1.021 3.784 5.536 1.00 0.00 O ATOM 1415 CB LEU A 95 -2.855 3.988 2.893 1.00 0.00 C ATOM 1416 CG LEU A 95 -1.988 3.588 1.698 1.00 0.00 C ATOM 1417 CD1 LEU A 95 -1.703 2.094 1.724 1.00 0.00 C ATOM 1418 CD2 LEU A 95 -2.662 3.983 0.393 1.00 0.00 C ATOM 0 H LEU A 95 -1.928 6.157 2.120 1.00 0.00 H new ATOM 0 HA LEU A 95 -2.919 5.238 4.644 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.107 3.090 3.457 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.791 4.403 2.521 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.039 4.120 1.767 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.085 1.827 0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.177 1.840 2.644 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -2.643 1.544 1.680 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.030 3.690 -0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.626 3.480 0.314 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -2.814 5.062 0.374 1.00 0.00 H new ATOM 1430 N VAL A 96 0.174 4.579 3.804 1.00 0.00 N ATOM 1431 CA VAL A 96 1.441 4.050 4.295 1.00 0.00 C ATOM 1432 C VAL A 96 1.947 4.851 5.494 1.00 0.00 C ATOM 1433 O VAL A 96 2.380 4.278 6.494 1.00 0.00 O ATOM 1434 CB VAL A 96 2.511 4.035 3.178 1.00 0.00 C ATOM 1435 CG1 VAL A 96 3.920 4.014 3.759 1.00 0.00 C ATOM 1436 CG2 VAL A 96 2.294 2.841 2.262 1.00 0.00 C ATOM 0 H VAL A 96 0.242 5.086 2.922 1.00 0.00 H new ATOM 0 HA VAL A 96 1.261 3.024 4.616 1.00 0.00 H new ATOM 0 HB VAL A 96 2.407 4.951 2.597 1.00 0.00 H new ATOM 0 HG11 VAL A 96 4.648 4.004 2.948 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.074 4.901 4.373 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.047 3.122 4.372 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.053 2.840 1.479 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.369 1.920 2.841 1.00 0.00 H new ATOM 0 HG23 VAL A 96 1.305 2.905 1.808 1.00 0.00 H new ATOM 1446 N GLU A 97 1.890 6.175 5.390 1.00 0.00 N ATOM 1447 CA GLU A 97 2.345 7.040 6.473 1.00 0.00 C ATOM 1448 C GLU A 97 1.579 6.746 7.758 1.00 0.00 C ATOM 1449 O GLU A 97 2.121 6.870 8.856 1.00 0.00 O ATOM 1450 CB GLU A 97 2.172 8.512 6.092 1.00 0.00 C ATOM 1451 CG GLU A 97 0.721 8.963 6.052 1.00 0.00 C ATOM 1452 CD GLU A 97 -0.032 8.407 4.858 1.00 0.00 C ATOM 1453 OE1 GLU A 97 0.429 8.613 3.717 1.00 0.00 O ATOM 1454 OE2 GLU A 97 -1.085 7.768 5.068 1.00 0.00 O ATOM 0 H GLU A 97 1.535 6.670 4.572 1.00 0.00 H new ATOM 0 HA GLU A 97 3.403 6.839 6.642 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.716 9.130 6.806 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.624 8.681 5.115 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.222 8.650 6.969 1.00 0.00 H new ATOM 0 HG3 GLU A 97 0.684 10.052 6.025 1.00 0.00 H new ATOM 1461 N HIS A 98 0.317 6.356 7.613 1.00 0.00 N ATOM 1462 CA HIS A 98 -0.522 6.043 8.762 1.00 0.00 C ATOM 1463 C HIS A 98 -0.109 4.715 9.384 1.00 0.00 C ATOM 1464 O HIS A 98 0.102 4.621 10.594 1.00 0.00 O ATOM 1465 CB HIS A 98 -1.993 5.991 8.346 1.00 0.00 C ATOM 1466 CG HIS A 98 -2.872 5.295 9.337 1.00 0.00 C ATOM 1467 ND1 HIS A 98 -3.973 4.577 8.939 1.00 0.00 N ATOM 1468 CD2 HIS A 98 -2.772 5.240 10.688 1.00 0.00 C ATOM 1469 CE1 HIS A 98 -4.515 4.101 10.045 1.00 0.00 C ATOM 1470 NE2 HIS A 98 -3.822 4.477 11.131 1.00 0.00 N ATOM 0 H HIS A 98 -0.146 6.249 6.711 1.00 0.00 H new ATOM 0 HA HIS A 98 -0.391 6.830 9.505 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -2.357 7.008 8.202 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -2.072 5.484 7.384 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -2.012 5.707 11.297 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -5.403 3.487 10.072 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -4.035 4.241 12.100 1.00 0.00 H new ATOM 1478 N GLY A 99 0.006 3.690 8.547 1.00 0.00 N ATOM 1479 CA GLY A 99 0.395 2.378 9.026 1.00 0.00 C ATOM 1480 C GLY A 99 0.784 1.446 7.897 1.00 0.00 C ATOM 1481 O GLY A 99 1.957 1.104 7.743 1.00 0.00 O ATOM 0 H GLY A 99 -0.164 3.745 7.543 1.00 0.00 H new ATOM 0 HA2 GLY A 99 1.233 2.479 9.716 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -0.430 1.940 9.588 1.00 0.00 H new ATOM 1485 N ALA A 100 -0.207 1.037 7.108 1.00 0.00 N ATOM 1486 CA ALA A 100 0.020 0.139 5.979 1.00 0.00 C ATOM 1487 C ALA A 100 1.198 -0.795 6.234 1.00 0.00 C ATOM 1488 O ALA A 100 2.317 -0.532 5.794 1.00 0.00 O ATOM 1489 CB ALA A 100 0.246 0.939 4.707 1.00 0.00 C ATOM 0 H ALA A 100 -1.180 1.315 7.231 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.871 -0.477 5.859 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.414 0.257 3.873 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.631 1.553 4.503 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.118 1.582 4.831 1.00 0.00 H new ATOM 1495 N ASP A 101 0.941 -1.885 6.949 1.00 0.00 N ATOM 1496 CA ASP A 101 1.984 -2.855 7.259 1.00 0.00 C ATOM 1497 C ASP A 101 2.904 -3.067 6.062 1.00 0.00 C ATOM 1498 O ASP A 101 2.595 -3.845 5.160 1.00 0.00 O ATOM 1499 CB ASP A 101 1.361 -4.187 7.681 1.00 0.00 C ATOM 1500 CG ASP A 101 0.133 -4.537 6.862 1.00 0.00 C ATOM 1501 OD1 ASP A 101 -0.493 -3.611 6.306 1.00 0.00 O ATOM 1502 OD2 ASP A 101 -0.203 -5.738 6.778 1.00 0.00 O ATOM 0 H ASP A 101 0.022 -2.118 7.324 1.00 0.00 H new ATOM 0 HA ASP A 101 2.578 -2.461 8.084 1.00 0.00 H new ATOM 0 HB2 ASP A 101 2.101 -4.980 7.577 1.00 0.00 H new ATOM 0 HB3 ASP A 101 1.090 -4.140 8.736 1.00 0.00 H new ATOM 1507 N VAL A 102 4.033 -2.368 6.059 1.00 0.00 N ATOM 1508 CA VAL A 102 4.998 -2.479 4.971 1.00 0.00 C ATOM 1509 C VAL A 102 5.930 -3.667 5.182 1.00 0.00 C ATOM 1510 O VAL A 102 6.942 -3.803 4.496 1.00 0.00 O ATOM 1511 CB VAL A 102 5.842 -1.197 4.836 1.00 0.00 C ATOM 1512 CG1 VAL A 102 5.002 -0.058 4.279 1.00 0.00 C ATOM 1513 CG2 VAL A 102 6.450 -0.815 6.178 1.00 0.00 C ATOM 0 H VAL A 102 4.303 -1.718 6.798 1.00 0.00 H new ATOM 0 HA VAL A 102 4.426 -2.627 4.055 1.00 0.00 H new ATOM 0 HB VAL A 102 6.655 -1.392 4.136 1.00 0.00 H new ATOM 0 HG11 VAL A 102 5.616 0.838 4.191 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.621 -0.334 3.296 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.166 0.139 4.950 1.00 0.00 H new ATOM 0 HG21 VAL A 102 7.043 0.093 6.064 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.654 -0.640 6.901 1.00 0.00 H new ATOM 0 HG23 VAL A 102 7.090 -1.624 6.531 1.00 0.00 H new ATOM 1523 N ASN A 103 5.583 -4.524 6.137 1.00 0.00 N ATOM 1524 CA ASN A 103 6.391 -5.700 6.437 1.00 0.00 C ATOM 1525 C ASN A 103 5.942 -6.899 5.608 1.00 0.00 C ATOM 1526 O ASN A 103 6.727 -7.810 5.343 1.00 0.00 O ATOM 1527 CB ASN A 103 6.306 -6.035 7.928 1.00 0.00 C ATOM 1528 CG ASN A 103 7.544 -5.604 8.689 1.00 0.00 C ATOM 1529 OD1 ASN A 103 8.453 -6.400 8.919 1.00 0.00 O ATOM 1530 ND2 ASN A 103 7.585 -4.337 9.082 1.00 0.00 N ATOM 0 H ASN A 103 4.749 -4.426 6.716 1.00 0.00 H new ATOM 0 HA ASN A 103 7.426 -5.473 6.180 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.431 -5.548 8.358 1.00 0.00 H new ATOM 0 HB3 ASN A 103 6.164 -7.109 8.049 1.00 0.00 H new ATOM 0 HD21 ASN A 103 8.394 -3.989 9.597 1.00 0.00 H new ATOM 0 HD22 ASN A 103 6.808 -3.712 8.869 1.00 0.00 H new ATOM 1537 N ALA A 104 4.677 -6.894 5.204 1.00 0.00 N ATOM 1538 CA ALA A 104 4.126 -7.983 4.405 1.00 0.00 C ATOM 1539 C ALA A 104 5.011 -8.281 3.199 1.00 0.00 C ATOM 1540 O ALA A 104 5.780 -7.429 2.755 1.00 0.00 O ATOM 1541 CB ALA A 104 2.714 -7.644 3.955 1.00 0.00 C ATOM 0 H ALA A 104 4.014 -6.149 5.416 1.00 0.00 H new ATOM 0 HA ALA A 104 4.092 -8.877 5.027 1.00 0.00 H new ATOM 0 HB1 ALA A 104 2.315 -8.465 3.360 1.00 0.00 H new ATOM 0 HB2 ALA A 104 2.081 -7.488 4.829 1.00 0.00 H new ATOM 0 HB3 ALA A 104 2.732 -6.735 3.353 1.00 0.00 H new ATOM 1547 N LEU A 105 4.896 -9.496 2.673 1.00 0.00 N ATOM 1548 CA LEU A 105 5.684 -9.906 1.517 1.00 0.00 C ATOM 1549 C LEU A 105 4.869 -10.805 0.593 1.00 0.00 C ATOM 1550 O LEU A 105 3.854 -11.373 0.999 1.00 0.00 O ATOM 1551 CB LEU A 105 6.953 -10.633 1.970 1.00 0.00 C ATOM 1552 CG LEU A 105 7.381 -10.353 3.412 1.00 0.00 C ATOM 1553 CD1 LEU A 105 8.121 -11.549 3.990 1.00 0.00 C ATOM 1554 CD2 LEU A 105 8.250 -9.106 3.479 1.00 0.00 C ATOM 0 H LEU A 105 4.265 -10.214 3.029 1.00 0.00 H new ATOM 0 HA LEU A 105 5.966 -9.010 0.964 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.799 -11.706 1.855 1.00 0.00 H new ATOM 0 HB3 LEU A 105 7.770 -10.355 1.304 1.00 0.00 H new ATOM 0 HG LEU A 105 6.485 -10.180 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.418 -11.332 5.016 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.468 -12.422 3.978 1.00 0.00 H new ATOM 0 HD13 LEU A 105 9.009 -11.752 3.391 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.545 -8.923 4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 105 9.141 -9.250 2.868 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.688 -8.250 3.105 1.00 0.00 H new ATOM 1566 N ASP A 106 5.319 -10.931 -0.652 1.00 0.00 N ATOM 1567 CA ASP A 106 4.633 -11.757 -1.633 1.00 0.00 C ATOM 1568 C ASP A 106 5.066 -13.214 -1.519 1.00 0.00 C ATOM 1569 O ASP A 106 4.473 -13.993 -0.772 1.00 0.00 O ATOM 1570 CB ASP A 106 4.908 -11.239 -3.046 1.00 0.00 C ATOM 1571 CG ASP A 106 5.680 -9.934 -3.043 1.00 0.00 C ATOM 1572 OD1 ASP A 106 6.008 -9.440 -1.945 1.00 0.00 O ATOM 1573 OD2 ASP A 106 5.959 -9.407 -4.143 1.00 0.00 O ATOM 0 H ASP A 106 6.158 -10.469 -1.003 1.00 0.00 H new ATOM 0 HA ASP A 106 3.563 -11.701 -1.434 1.00 0.00 H new ATOM 0 HB2 ASP A 106 5.470 -11.989 -3.602 1.00 0.00 H new ATOM 0 HB3 ASP A 106 3.962 -11.097 -3.569 1.00 0.00 H new ATOM 1578 N SER A 107 6.104 -13.578 -2.266 1.00 0.00 N ATOM 1579 CA SER A 107 6.617 -14.944 -2.250 1.00 0.00 C ATOM 1580 C SER A 107 8.093 -14.966 -1.867 1.00 0.00 C ATOM 1581 O SER A 107 8.544 -15.853 -1.143 1.00 0.00 O ATOM 1582 CB SER A 107 6.423 -15.598 -3.619 1.00 0.00 C ATOM 1583 OG SER A 107 5.325 -15.024 -4.308 1.00 0.00 O ATOM 0 H SER A 107 6.606 -12.946 -2.890 1.00 0.00 H new ATOM 0 HA SER A 107 6.059 -15.508 -1.503 1.00 0.00 H new ATOM 0 HB2 SER A 107 7.330 -15.482 -4.213 1.00 0.00 H new ATOM 0 HB3 SER A 107 6.259 -16.668 -3.494 1.00 0.00 H new ATOM 0 HG SER A 107 5.223 -15.458 -5.181 1.00 0.00 H new ATOM 1589 N THR A 108 8.840 -13.983 -2.359 1.00 0.00 N ATOM 1590 CA THR A 108 10.265 -13.886 -2.070 1.00 0.00 C ATOM 1591 C THR A 108 10.504 -13.385 -0.648 1.00 0.00 C ATOM 1592 O THR A 108 11.646 -13.268 -0.204 1.00 0.00 O ATOM 1593 CB THR A 108 10.945 -12.952 -3.072 1.00 0.00 C ATOM 1594 OG1 THR A 108 10.078 -12.665 -4.155 1.00 0.00 O ATOM 1595 CG2 THR A 108 12.225 -13.518 -3.646 1.00 0.00 C ATOM 0 H THR A 108 8.481 -13.242 -2.961 1.00 0.00 H new ATOM 0 HA THR A 108 10.696 -14.883 -2.159 1.00 0.00 H new ATOM 0 HB THR A 108 11.187 -12.051 -2.509 1.00 0.00 H new ATOM 0 HG1 THR A 108 10.529 -12.065 -4.785 1.00 0.00 H new ATOM 0 HG21 THR A 108 12.655 -12.805 -4.349 1.00 0.00 H new ATOM 0 HG22 THR A 108 12.934 -13.705 -2.839 1.00 0.00 H new ATOM 0 HG23 THR A 108 12.010 -14.453 -4.164 1.00 0.00 H new ATOM 1603 N GLY A 109 9.419 -13.089 0.062 1.00 0.00 N ATOM 1604 CA GLY A 109 9.534 -12.604 1.425 1.00 0.00 C ATOM 1605 C GLY A 109 10.267 -11.280 1.509 1.00 0.00 C ATOM 1606 O GLY A 109 10.823 -10.936 2.553 1.00 0.00 O ATOM 0 H GLY A 109 8.463 -13.176 -0.283 1.00 0.00 H new ATOM 0 HA2 GLY A 109 8.538 -12.492 1.853 1.00 0.00 H new ATOM 0 HA3 GLY A 109 10.058 -13.345 2.028 1.00 0.00 H new ATOM 1610 N SER A 110 10.269 -10.536 0.409 1.00 0.00 N ATOM 1611 CA SER A 110 10.941 -9.242 0.364 1.00 0.00 C ATOM 1612 C SER A 110 9.965 -8.111 0.675 1.00 0.00 C ATOM 1613 O SER A 110 8.819 -8.127 0.227 1.00 0.00 O ATOM 1614 CB SER A 110 11.574 -9.019 -1.010 1.00 0.00 C ATOM 1615 OG SER A 110 11.973 -10.249 -1.594 1.00 0.00 O ATOM 0 H SER A 110 9.814 -10.806 -0.463 1.00 0.00 H new ATOM 0 HA SER A 110 11.724 -9.242 1.122 1.00 0.00 H new ATOM 0 HB2 SER A 110 10.862 -8.516 -1.665 1.00 0.00 H new ATOM 0 HB3 SER A 110 12.438 -8.361 -0.913 1.00 0.00 H new ATOM 0 HG SER A 110 12.373 -10.079 -2.472 1.00 0.00 H new ATOM 1621 N LEU A 111 10.429 -7.131 1.442 1.00 0.00 N ATOM 1622 CA LEU A 111 9.598 -5.990 1.810 1.00 0.00 C ATOM 1623 C LEU A 111 9.302 -5.120 0.593 1.00 0.00 C ATOM 1624 O LEU A 111 9.979 -5.216 -0.431 1.00 0.00 O ATOM 1625 CB LEU A 111 10.287 -5.157 2.894 1.00 0.00 C ATOM 1626 CG LEU A 111 10.996 -5.969 3.981 1.00 0.00 C ATOM 1627 CD1 LEU A 111 11.647 -5.043 4.998 1.00 0.00 C ATOM 1628 CD2 LEU A 111 10.019 -6.913 4.664 1.00 0.00 C ATOM 0 H LEU A 111 11.376 -7.103 1.821 1.00 0.00 H new ATOM 0 HA LEU A 111 8.654 -6.370 2.201 1.00 0.00 H new ATOM 0 HB2 LEU A 111 11.016 -4.501 2.418 1.00 0.00 H new ATOM 0 HB3 LEU A 111 9.542 -4.517 3.367 1.00 0.00 H new ATOM 0 HG LEU A 111 11.777 -6.566 3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 111 12.146 -5.637 5.763 1.00 0.00 H new ATOM 0 HD12 LEU A 111 12.378 -4.408 4.497 1.00 0.00 H new ATOM 0 HD13 LEU A 111 10.884 -4.419 5.463 1.00 0.00 H new ATOM 0 HD21 LEU A 111 10.541 -7.482 5.434 1.00 0.00 H new ATOM 0 HD22 LEU A 111 9.215 -6.336 5.121 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.600 -7.598 3.927 1.00 0.00 H new ATOM 1640 N PRO A 112 8.282 -4.255 0.693 1.00 0.00 N ATOM 1641 CA PRO A 112 7.892 -3.362 -0.401 1.00 0.00 C ATOM 1642 C PRO A 112 9.079 -2.591 -0.969 1.00 0.00 C ATOM 1643 O PRO A 112 9.138 -2.316 -2.167 1.00 0.00 O ATOM 1644 CB PRO A 112 6.896 -2.407 0.260 1.00 0.00 C ATOM 1645 CG PRO A 112 6.324 -3.186 1.394 1.00 0.00 C ATOM 1646 CD PRO A 112 7.430 -4.082 1.883 1.00 0.00 C ATOM 0 HA PRO A 112 7.478 -3.909 -1.248 1.00 0.00 H new ATOM 0 HB2 PRO A 112 7.389 -1.500 0.611 1.00 0.00 H new ATOM 0 HB3 PRO A 112 6.120 -2.097 -0.440 1.00 0.00 H new ATOM 0 HG2 PRO A 112 5.979 -2.523 2.188 1.00 0.00 H new ATOM 0 HG3 PRO A 112 5.463 -3.771 1.070 1.00 0.00 H new ATOM 0 HD2 PRO A 112 7.979 -3.628 2.708 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.045 -5.036 2.243 1.00 0.00 H new ATOM 1654 N ILE A 113 10.026 -2.245 -0.101 1.00 0.00 N ATOM 1655 CA ILE A 113 11.211 -1.507 -0.519 1.00 0.00 C ATOM 1656 C ILE A 113 12.021 -2.305 -1.535 1.00 0.00 C ATOM 1657 O ILE A 113 12.478 -1.763 -2.543 1.00 0.00 O ATOM 1658 CB ILE A 113 12.114 -1.159 0.681 1.00 0.00 C ATOM 1659 CG1 ILE A 113 13.461 -0.621 0.194 1.00 0.00 C ATOM 1660 CG2 ILE A 113 12.314 -2.380 1.567 1.00 0.00 C ATOM 1661 CD1 ILE A 113 13.938 0.593 0.960 1.00 0.00 C ATOM 0 H ILE A 113 9.995 -2.464 0.895 1.00 0.00 H new ATOM 0 HA ILE A 113 10.862 -0.582 -0.978 1.00 0.00 H new ATOM 0 HB ILE A 113 11.626 -0.383 1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 113 14.209 -1.409 0.276 1.00 0.00 H new ATOM 0 HG13 ILE A 113 13.381 -0.366 -0.863 1.00 0.00 H new ATOM 0 HG21 ILE A 113 12.954 -2.117 2.409 1.00 0.00 H new ATOM 0 HG22 ILE A 113 11.348 -2.723 1.938 1.00 0.00 H new ATOM 0 HG23 ILE A 113 12.784 -3.176 0.989 1.00 0.00 H new ATOM 0 HD11 ILE A 113 14.898 0.920 0.562 1.00 0.00 H new ATOM 0 HD12 ILE A 113 13.209 1.397 0.858 1.00 0.00 H new ATOM 0 HD13 ILE A 113 14.051 0.337 2.014 1.00 0.00 H new ATOM 1673 N HIS A 114 12.194 -3.594 -1.265 1.00 0.00 N ATOM 1674 CA HIS A 114 12.948 -4.465 -2.158 1.00 0.00 C ATOM 1675 C HIS A 114 12.410 -4.373 -3.582 1.00 0.00 C ATOM 1676 O HIS A 114 13.177 -4.276 -4.540 1.00 0.00 O ATOM 1677 CB HIS A 114 12.884 -5.913 -1.665 1.00 0.00 C ATOM 1678 CG HIS A 114 13.265 -6.071 -0.226 1.00 0.00 C ATOM 1679 ND1 HIS A 114 12.671 -5.320 0.759 1.00 0.00 N ATOM 1680 CD2 HIS A 114 14.178 -6.899 0.338 1.00 0.00 C ATOM 1681 CE1 HIS A 114 13.230 -5.703 1.893 1.00 0.00 C ATOM 1682 NE2 HIS A 114 14.151 -6.659 1.688 1.00 0.00 N ATOM 0 H HIS A 114 11.823 -4.058 -0.436 1.00 0.00 H new ATOM 0 HA HIS A 114 13.987 -4.137 -2.159 1.00 0.00 H new ATOM 0 HB2 HIS A 114 11.873 -6.293 -1.809 1.00 0.00 H new ATOM 0 HB3 HIS A 114 13.545 -6.526 -2.277 1.00 0.00 H new ATOM 0 HD2 HIS A 114 14.806 -7.611 -0.177 1.00 0.00 H new ATOM 0 HE1 HIS A 114 12.978 -5.299 2.862 1.00 0.00 H new ATOM 0 HE2 HIS A 114 14.720 -7.118 2.399 1.00 0.00 H new ATOM 1690 N LEU A 115 11.088 -4.397 -3.714 1.00 0.00 N ATOM 1691 CA LEU A 115 10.450 -4.308 -5.022 1.00 0.00 C ATOM 1692 C LEU A 115 10.669 -2.931 -5.630 1.00 0.00 C ATOM 1693 O LEU A 115 11.076 -2.809 -6.785 1.00 0.00 O ATOM 1694 CB LEU A 115 8.951 -4.593 -4.907 1.00 0.00 C ATOM 1695 CG LEU A 115 8.544 -5.443 -3.704 1.00 0.00 C ATOM 1696 CD1 LEU A 115 7.067 -5.798 -3.780 1.00 0.00 C ATOM 1697 CD2 LEU A 115 9.395 -6.701 -3.627 1.00 0.00 C ATOM 0 H LEU A 115 10.438 -4.477 -2.932 1.00 0.00 H new ATOM 0 HA LEU A 115 10.903 -5.056 -5.673 1.00 0.00 H new ATOM 0 HB2 LEU A 115 8.419 -3.643 -4.858 1.00 0.00 H new ATOM 0 HB3 LEU A 115 8.622 -5.096 -5.816 1.00 0.00 H new ATOM 0 HG LEU A 115 8.711 -4.862 -2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.793 -6.403 -2.916 1.00 0.00 H new ATOM 0 HD12 LEU A 115 6.473 -4.884 -3.785 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.875 -6.361 -4.693 1.00 0.00 H new ATOM 0 HD21 LEU A 115 9.091 -7.294 -2.764 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.260 -7.287 -4.536 1.00 0.00 H new ATOM 0 HD23 LEU A 115 10.445 -6.425 -3.526 1.00 0.00 H new ATOM 1709 N ALA A 116 10.405 -1.895 -4.842 1.00 0.00 N ATOM 1710 CA ALA A 116 10.585 -0.528 -5.306 1.00 0.00 C ATOM 1711 C ALA A 116 11.992 -0.340 -5.854 1.00 0.00 C ATOM 1712 O ALA A 116 12.187 0.270 -6.905 1.00 0.00 O ATOM 1713 CB ALA A 116 10.311 0.455 -4.177 1.00 0.00 C ATOM 0 H ALA A 116 10.067 -1.977 -3.883 1.00 0.00 H new ATOM 0 HA ALA A 116 9.874 -0.333 -6.109 1.00 0.00 H new ATOM 0 HB1 ALA A 116 10.450 1.473 -4.540 1.00 0.00 H new ATOM 0 HB2 ALA A 116 9.286 0.331 -3.827 1.00 0.00 H new ATOM 0 HB3 ALA A 116 11.001 0.266 -3.354 1.00 0.00 H new ATOM 1719 N ILE A 117 12.971 -0.882 -5.135 1.00 0.00 N ATOM 1720 CA ILE A 117 14.365 -0.792 -5.546 1.00 0.00 C ATOM 1721 C ILE A 117 14.544 -1.329 -6.961 1.00 0.00 C ATOM 1722 O ILE A 117 15.293 -0.766 -7.759 1.00 0.00 O ATOM 1723 CB ILE A 117 15.283 -1.578 -4.590 1.00 0.00 C ATOM 1724 CG1 ILE A 117 15.324 -0.905 -3.217 1.00 0.00 C ATOM 1725 CG2 ILE A 117 16.683 -1.692 -5.173 1.00 0.00 C ATOM 1726 CD1 ILE A 117 15.699 -1.846 -2.093 1.00 0.00 C ATOM 0 H ILE A 117 12.822 -1.389 -4.263 1.00 0.00 H new ATOM 0 HA ILE A 117 14.643 0.261 -5.517 1.00 0.00 H new ATOM 0 HB ILE A 117 14.879 -2.583 -4.468 1.00 0.00 H new ATOM 0 HG12 ILE A 117 16.039 -0.083 -3.246 1.00 0.00 H new ATOM 0 HG13 ILE A 117 14.347 -0.470 -3.005 1.00 0.00 H new ATOM 0 HG21 ILE A 117 17.319 -2.250 -4.486 1.00 0.00 H new ATOM 0 HG22 ILE A 117 16.638 -2.213 -6.129 1.00 0.00 H new ATOM 0 HG23 ILE A 117 17.097 -0.695 -5.322 1.00 0.00 H new ATOM 0 HD11 ILE A 117 15.708 -1.300 -1.149 1.00 0.00 H new ATOM 0 HD12 ILE A 117 14.971 -2.655 -2.037 1.00 0.00 H new ATOM 0 HD13 ILE A 117 16.689 -2.262 -2.281 1.00 0.00 H new ATOM 1738 N ARG A 118 13.847 -2.420 -7.267 1.00 0.00 N ATOM 1739 CA ARG A 118 13.927 -3.030 -8.589 1.00 0.00 C ATOM 1740 C ARG A 118 13.418 -2.065 -9.653 1.00 0.00 C ATOM 1741 O ARG A 118 14.002 -1.948 -10.731 1.00 0.00 O ATOM 1742 CB ARG A 118 13.117 -4.328 -8.631 1.00 0.00 C ATOM 1743 CG ARG A 118 13.275 -5.187 -7.387 1.00 0.00 C ATOM 1744 CD ARG A 118 14.102 -6.431 -7.671 1.00 0.00 C ATOM 1745 NE ARG A 118 13.291 -7.646 -7.652 1.00 0.00 N ATOM 1746 CZ ARG A 118 12.898 -8.250 -6.535 1.00 0.00 C ATOM 1747 NH1 ARG A 118 13.233 -7.750 -5.353 1.00 0.00 N ATOM 1748 NH2 ARG A 118 12.166 -9.355 -6.599 1.00 0.00 N ATOM 0 H ARG A 118 13.222 -2.898 -6.618 1.00 0.00 H new ATOM 0 HA ARG A 118 14.972 -3.262 -8.795 1.00 0.00 H new ATOM 0 HB2 ARG A 118 12.063 -4.084 -8.762 1.00 0.00 H new ATOM 0 HB3 ARG A 118 13.421 -4.907 -9.503 1.00 0.00 H new ATOM 0 HG2 ARG A 118 13.752 -4.604 -6.599 1.00 0.00 H new ATOM 0 HG3 ARG A 118 12.292 -5.479 -7.018 1.00 0.00 H new ATOM 0 HD2 ARG A 118 14.583 -6.332 -8.644 1.00 0.00 H new ATOM 0 HD3 ARG A 118 14.897 -6.514 -6.930 1.00 0.00 H new ATOM 0 HE ARG A 118 13.011 -8.053 -8.544 1.00 0.00 H new ATOM 0 HH11 ARG A 118 13.794 -6.900 -5.299 1.00 0.00 H new ATOM 0 HH12 ARG A 118 12.930 -8.216 -4.498 1.00 0.00 H new ATOM 0 HH21 ARG A 118 11.904 -9.742 -7.506 1.00 0.00 H new ATOM 0 HH22 ARG A 118 11.865 -9.818 -5.741 1.00 0.00 H new ATOM 1762 N GLU A 119 12.326 -1.376 -9.342 1.00 0.00 N ATOM 1763 CA GLU A 119 11.734 -0.421 -10.261 1.00 0.00 C ATOM 1764 C GLU A 119 12.592 0.836 -10.363 1.00 0.00 C ATOM 1765 O GLU A 119 13.006 1.230 -11.454 1.00 0.00 O ATOM 1766 CB GLU A 119 10.325 -0.060 -9.796 1.00 0.00 C ATOM 1767 CG GLU A 119 9.509 -1.258 -9.331 1.00 0.00 C ATOM 1768 CD GLU A 119 9.236 -1.232 -7.841 1.00 0.00 C ATOM 1769 OE1 GLU A 119 10.206 -1.139 -7.060 1.00 0.00 O ATOM 1770 OE2 GLU A 119 8.050 -1.307 -7.453 1.00 0.00 O ATOM 0 H GLU A 119 11.833 -1.465 -8.454 1.00 0.00 H new ATOM 0 HA GLU A 119 11.680 -0.878 -11.249 1.00 0.00 H new ATOM 0 HB2 GLU A 119 10.394 0.660 -8.981 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.797 0.433 -10.613 1.00 0.00 H new ATOM 0 HG2 GLU A 119 8.562 -1.280 -9.870 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.041 -2.175 -9.584 1.00 0.00 H new ATOM 1777 N GLY A 120 12.859 1.462 -9.219 1.00 0.00 N ATOM 1778 CA GLY A 120 13.670 2.666 -9.204 1.00 0.00 C ATOM 1779 C GLY A 120 12.842 3.930 -9.326 1.00 0.00 C ATOM 1780 O GLY A 120 13.111 4.776 -10.178 1.00 0.00 O ATOM 0 H GLY A 120 12.528 1.157 -8.304 1.00 0.00 H new ATOM 0 HA2 GLY A 120 14.245 2.701 -8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 120 14.388 2.626 -10.023 1.00 0.00 H new ATOM 1784 N HIS A 121 11.831 4.060 -8.472 1.00 0.00 N ATOM 1785 CA HIS A 121 10.963 5.232 -8.490 1.00 0.00 C ATOM 1786 C HIS A 121 11.605 6.400 -7.744 1.00 0.00 C ATOM 1787 O HIS A 121 11.088 7.516 -7.759 1.00 0.00 O ATOM 1788 CB HIS A 121 9.606 4.898 -7.868 1.00 0.00 C ATOM 1789 CG HIS A 121 8.486 4.862 -8.861 1.00 0.00 C ATOM 1790 ND1 HIS A 121 7.856 6.011 -9.272 1.00 0.00 N ATOM 1791 CD2 HIS A 121 7.925 3.800 -9.490 1.00 0.00 C ATOM 1792 CE1 HIS A 121 6.932 5.628 -10.137 1.00 0.00 C ATOM 1793 NE2 HIS A 121 6.937 4.296 -10.301 1.00 0.00 N ATOM 0 H HIS A 121 11.593 3.369 -7.760 1.00 0.00 H new ATOM 0 HA HIS A 121 10.816 5.527 -9.529 1.00 0.00 H new ATOM 0 HB2 HIS A 121 9.671 3.930 -7.371 1.00 0.00 H new ATOM 0 HB3 HIS A 121 9.376 5.636 -7.100 1.00 0.00 H new ATOM 0 HD2 HIS A 121 8.203 2.763 -9.374 1.00 0.00 H new ATOM 0 HE1 HIS A 121 6.259 6.301 -10.647 1.00 0.00 H new ATOM 0 HE2 HIS A 121 6.324 3.756 -10.912 1.00 0.00 H new ATOM 1801 N SER A 122 12.734 6.134 -7.093 1.00 0.00 N ATOM 1802 CA SER A 122 13.445 7.165 -6.343 1.00 0.00 C ATOM 1803 C SER A 122 12.672 7.563 -5.090 1.00 0.00 C ATOM 1804 O SER A 122 13.072 7.238 -3.972 1.00 0.00 O ATOM 1805 CB SER A 122 13.682 8.394 -7.223 1.00 0.00 C ATOM 1806 OG SER A 122 13.315 9.585 -6.546 1.00 0.00 O ATOM 0 H SER A 122 13.176 5.215 -7.070 1.00 0.00 H new ATOM 0 HA SER A 122 14.407 6.755 -6.036 1.00 0.00 H new ATOM 0 HB2 SER A 122 14.733 8.443 -7.509 1.00 0.00 H new ATOM 0 HB3 SER A 122 13.105 8.303 -8.143 1.00 0.00 H new ATOM 0 HG SER A 122 13.477 10.356 -7.129 1.00 0.00 H new ATOM 1812 N SER A 123 11.563 8.269 -5.284 1.00 0.00 N ATOM 1813 CA SER A 123 10.735 8.714 -4.169 1.00 0.00 C ATOM 1814 C SER A 123 10.089 7.526 -3.461 1.00 0.00 C ATOM 1815 O SER A 123 9.927 7.533 -2.240 1.00 0.00 O ATOM 1816 CB SER A 123 9.654 9.677 -4.662 1.00 0.00 C ATOM 1817 OG SER A 123 9.621 10.854 -3.873 1.00 0.00 O ATOM 0 H SER A 123 11.217 8.545 -6.203 1.00 0.00 H new ATOM 0 HA SER A 123 11.377 9.232 -3.457 1.00 0.00 H new ATOM 0 HB2 SER A 123 9.843 9.939 -5.703 1.00 0.00 H new ATOM 0 HB3 SER A 123 8.682 9.185 -4.628 1.00 0.00 H new ATOM 0 HG SER A 123 8.923 11.454 -4.210 1.00 0.00 H new ATOM 1823 N VAL A 124 9.726 6.507 -4.232 1.00 0.00 N ATOM 1824 CA VAL A 124 9.104 5.313 -3.676 1.00 0.00 C ATOM 1825 C VAL A 124 10.133 4.464 -2.946 1.00 0.00 C ATOM 1826 O VAL A 124 10.024 4.228 -1.743 1.00 0.00 O ATOM 1827 CB VAL A 124 8.435 4.464 -4.773 1.00 0.00 C ATOM 1828 CG1 VAL A 124 7.705 3.279 -4.160 1.00 0.00 C ATOM 1829 CG2 VAL A 124 7.485 5.316 -5.602 1.00 0.00 C ATOM 0 H VAL A 124 9.852 6.485 -5.244 1.00 0.00 H new ATOM 0 HA VAL A 124 8.339 5.644 -2.974 1.00 0.00 H new ATOM 0 HB VAL A 124 9.211 4.079 -5.434 1.00 0.00 H new ATOM 0 HG11 VAL A 124 7.239 2.691 -4.950 1.00 0.00 H new ATOM 0 HG12 VAL A 124 8.415 2.657 -3.615 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.938 3.639 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.021 4.700 -6.372 1.00 0.00 H new ATOM 0 HG22 VAL A 124 6.712 5.732 -4.956 1.00 0.00 H new ATOM 0 HG23 VAL A 124 8.040 6.127 -6.072 1.00 0.00 H new ATOM 1839 N VAL A 125 11.136 4.010 -3.688 1.00 0.00 N ATOM 1840 CA VAL A 125 12.195 3.188 -3.125 1.00 0.00 C ATOM 1841 C VAL A 125 12.829 3.856 -1.909 1.00 0.00 C ATOM 1842 O VAL A 125 13.057 3.212 -0.885 1.00 0.00 O ATOM 1843 CB VAL A 125 13.287 2.907 -4.172 1.00 0.00 C ATOM 1844 CG1 VAL A 125 12.664 2.454 -5.484 1.00 0.00 C ATOM 1845 CG2 VAL A 125 14.156 4.136 -4.385 1.00 0.00 C ATOM 0 H VAL A 125 11.236 4.199 -4.685 1.00 0.00 H new ATOM 0 HA VAL A 125 11.740 2.247 -2.815 1.00 0.00 H new ATOM 0 HB VAL A 125 13.922 2.103 -3.799 1.00 0.00 H new ATOM 0 HG11 VAL A 125 13.451 2.260 -6.213 1.00 0.00 H new ATOM 0 HG12 VAL A 125 12.090 1.542 -5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 125 12.004 3.235 -5.862 1.00 0.00 H new ATOM 0 HG21 VAL A 125 14.922 3.916 -5.129 1.00 0.00 H new ATOM 0 HG22 VAL A 125 13.538 4.963 -4.734 1.00 0.00 H new ATOM 0 HG23 VAL A 125 14.633 4.412 -3.444 1.00 0.00 H new ATOM 1855 N SER A 126 13.114 5.149 -2.028 1.00 0.00 N ATOM 1856 CA SER A 126 13.722 5.898 -0.937 1.00 0.00 C ATOM 1857 C SER A 126 12.727 6.130 0.191 1.00 0.00 C ATOM 1858 O SER A 126 13.106 6.246 1.356 1.00 0.00 O ATOM 1859 CB SER A 126 14.260 7.236 -1.443 1.00 0.00 C ATOM 1860 OG SER A 126 13.226 8.201 -1.532 1.00 0.00 O ATOM 0 H SER A 126 12.933 5.698 -2.868 1.00 0.00 H new ATOM 0 HA SER A 126 14.550 5.307 -0.547 1.00 0.00 H new ATOM 0 HB2 SER A 126 15.040 7.595 -0.772 1.00 0.00 H new ATOM 0 HB3 SER A 126 14.720 7.100 -2.422 1.00 0.00 H new ATOM 0 HG SER A 126 12.800 8.144 -2.413 1.00 0.00 H new ATOM 1866 N PHE A 127 11.452 6.197 -0.165 1.00 0.00 N ATOM 1867 CA PHE A 127 10.395 6.413 0.815 1.00 0.00 C ATOM 1868 C PHE A 127 10.160 5.156 1.645 1.00 0.00 C ATOM 1869 O PHE A 127 10.018 5.221 2.866 1.00 0.00 O ATOM 1870 CB PHE A 127 9.098 6.826 0.118 1.00 0.00 C ATOM 1871 CG PHE A 127 7.896 6.801 1.019 1.00 0.00 C ATOM 1872 CD1 PHE A 127 7.895 7.514 2.214 1.00 0.00 C ATOM 1873 CD2 PHE A 127 6.767 6.066 0.676 1.00 0.00 C ATOM 1874 CE1 PHE A 127 6.788 7.495 3.048 1.00 0.00 C ATOM 1875 CE2 PHE A 127 5.658 6.042 1.507 1.00 0.00 C ATOM 1876 CZ PHE A 127 5.666 6.755 2.690 1.00 0.00 C ATOM 0 H PHE A 127 11.123 6.105 -1.126 1.00 0.00 H new ATOM 0 HA PHE A 127 10.711 7.215 1.482 1.00 0.00 H new ATOM 0 HB2 PHE A 127 9.217 7.831 -0.287 1.00 0.00 H new ATOM 0 HB3 PHE A 127 8.922 6.161 -0.727 1.00 0.00 H new ATOM 0 HD1 PHE A 127 8.766 8.088 2.495 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.754 5.507 -0.248 1.00 0.00 H new ATOM 0 HE1 PHE A 127 6.797 8.053 3.973 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.788 5.466 1.230 1.00 0.00 H new ATOM 0 HZ PHE A 127 4.801 6.738 3.337 1.00 0.00 H new ATOM 1886 N LEU A 128 10.116 4.013 0.970 1.00 0.00 N ATOM 1887 CA LEU A 128 9.894 2.736 1.636 1.00 0.00 C ATOM 1888 C LEU A 128 11.076 2.367 2.527 1.00 0.00 C ATOM 1889 O LEU A 128 10.993 1.437 3.329 1.00 0.00 O ATOM 1890 CB LEU A 128 9.654 1.637 0.602 1.00 0.00 C ATOM 1891 CG LEU A 128 8.447 0.741 0.880 1.00 0.00 C ATOM 1892 CD1 LEU A 128 8.623 0.014 2.204 1.00 0.00 C ATOM 1893 CD2 LEU A 128 7.167 1.561 0.884 1.00 0.00 C ATOM 0 H LEU A 128 10.232 3.945 -0.041 1.00 0.00 H new ATOM 0 HA LEU A 128 9.010 2.833 2.267 1.00 0.00 H new ATOM 0 HB2 LEU A 128 9.526 2.101 -0.376 1.00 0.00 H new ATOM 0 HB3 LEU A 128 10.545 1.012 0.544 1.00 0.00 H new ATOM 0 HG LEU A 128 8.374 -0.002 0.086 1.00 0.00 H new ATOM 0 HD11 LEU A 128 7.756 -0.620 2.389 1.00 0.00 H new ATOM 0 HD12 LEU A 128 9.521 -0.602 2.164 1.00 0.00 H new ATOM 0 HD13 LEU A 128 8.718 0.742 3.009 1.00 0.00 H new ATOM 0 HD21 LEU A 128 6.317 0.908 1.083 1.00 0.00 H new ATOM 0 HD22 LEU A 128 7.227 2.325 1.659 1.00 0.00 H new ATOM 0 HD23 LEU A 128 7.038 2.038 -0.087 1.00 0.00 H new ATOM 1905 N ALA A 129 12.174 3.099 2.380 1.00 0.00 N ATOM 1906 CA ALA A 129 13.372 2.845 3.172 1.00 0.00 C ATOM 1907 C ALA A 129 13.071 2.906 4.667 1.00 0.00 C ATOM 1908 O ALA A 129 13.135 1.894 5.364 1.00 0.00 O ATOM 1909 CB ALA A 129 14.465 3.838 2.810 1.00 0.00 C ATOM 0 H ALA A 129 12.260 3.872 1.721 1.00 0.00 H new ATOM 0 HA ALA A 129 13.720 1.838 2.942 1.00 0.00 H new ATOM 0 HB1 ALA A 129 15.353 3.636 3.409 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.711 3.739 1.753 1.00 0.00 H new ATOM 0 HB3 ALA A 129 14.116 4.851 3.008 1.00 0.00 H new ATOM 1915 N PRO A 130 12.739 4.103 5.177 1.00 0.00 N ATOM 1916 CA PRO A 130 12.429 4.299 6.598 1.00 0.00 C ATOM 1917 C PRO A 130 11.179 3.539 7.032 1.00 0.00 C ATOM 1918 O PRO A 130 11.244 2.658 7.888 1.00 0.00 O ATOM 1919 CB PRO A 130 12.203 5.811 6.715 1.00 0.00 C ATOM 1920 CG PRO A 130 11.885 6.265 5.331 1.00 0.00 C ATOM 1921 CD PRO A 130 12.644 5.354 4.409 1.00 0.00 C ATOM 0 HA PRO A 130 13.227 3.925 7.240 1.00 0.00 H new ATOM 0 HB2 PRO A 130 11.386 6.035 7.401 1.00 0.00 H new ATOM 0 HB3 PRO A 130 13.090 6.313 7.101 1.00 0.00 H new ATOM 0 HG2 PRO A 130 10.813 6.209 5.139 1.00 0.00 H new ATOM 0 HG3 PRO A 130 12.181 7.304 5.184 1.00 0.00 H new ATOM 0 HD2 PRO A 130 12.119 5.208 3.465 1.00 0.00 H new ATOM 0 HD3 PRO A 130 13.629 5.754 4.168 1.00 0.00 H new ATOM 1929 N GLU A 131 10.042 3.885 6.436 1.00 0.00 N ATOM 1930 CA GLU A 131 8.778 3.234 6.765 1.00 0.00 C ATOM 1931 C GLU A 131 8.982 1.745 7.019 1.00 0.00 C ATOM 1932 O GLU A 131 8.259 1.135 7.806 1.00 0.00 O ATOM 1933 CB GLU A 131 7.767 3.437 5.635 1.00 0.00 C ATOM 1934 CG GLU A 131 7.751 4.851 5.080 1.00 0.00 C ATOM 1935 CD GLU A 131 7.724 4.882 3.566 1.00 0.00 C ATOM 1936 OE1 GLU A 131 6.747 4.371 2.979 1.00 0.00 O ATOM 1937 OE2 GLU A 131 8.679 5.419 2.965 1.00 0.00 O ATOM 0 H GLU A 131 9.970 4.611 5.724 1.00 0.00 H new ATOM 0 HA GLU A 131 8.390 3.689 7.676 1.00 0.00 H new ATOM 0 HB2 GLU A 131 7.993 2.741 4.827 1.00 0.00 H new ATOM 0 HB3 GLU A 131 6.771 3.188 6.001 1.00 0.00 H new ATOM 0 HG2 GLU A 131 6.879 5.379 5.466 1.00 0.00 H new ATOM 0 HG3 GLU A 131 8.631 5.387 5.435 1.00 0.00 H new ATOM 1944 N SER A 132 9.970 1.165 6.346 1.00 0.00 N ATOM 1945 CA SER A 132 10.269 -0.254 6.501 1.00 0.00 C ATOM 1946 C SER A 132 11.427 -0.463 7.469 1.00 0.00 C ATOM 1947 O SER A 132 12.481 0.160 7.335 1.00 0.00 O ATOM 1948 CB SER A 132 10.603 -0.880 5.145 1.00 0.00 C ATOM 1949 OG SER A 132 9.431 -1.092 4.379 1.00 0.00 O ATOM 0 H SER A 132 10.577 1.655 5.689 1.00 0.00 H new ATOM 0 HA SER A 132 9.384 -0.742 6.910 1.00 0.00 H new ATOM 0 HB2 SER A 132 11.285 -0.229 4.599 1.00 0.00 H new ATOM 0 HB3 SER A 132 11.119 -1.828 5.296 1.00 0.00 H new ATOM 0 HG SER A 132 8.719 -0.500 4.700 1.00 0.00 H new ATOM 1955 N ASP A 133 11.224 -1.341 8.446 1.00 0.00 N ATOM 1956 CA ASP A 133 12.251 -1.632 9.439 1.00 0.00 C ATOM 1957 C ASP A 133 13.638 -1.599 8.808 1.00 0.00 C ATOM 1958 O ASP A 133 14.099 -2.590 8.242 1.00 0.00 O ATOM 1959 CB ASP A 133 12.001 -2.998 10.079 1.00 0.00 C ATOM 1960 CG ASP A 133 12.727 -4.115 9.355 1.00 0.00 C ATOM 1961 OD1 ASP A 133 13.937 -4.297 9.605 1.00 0.00 O ATOM 1962 OD2 ASP A 133 12.085 -4.808 8.538 1.00 0.00 O ATOM 0 H ASP A 133 10.357 -1.863 8.571 1.00 0.00 H new ATOM 0 HA ASP A 133 12.203 -0.865 10.212 1.00 0.00 H new ATOM 0 HB2 ASP A 133 12.323 -2.973 11.120 1.00 0.00 H new ATOM 0 HB3 ASP A 133 10.931 -3.205 10.081 1.00 0.00 H new ATOM 1967 N LEU A 134 14.300 -0.451 8.908 1.00 0.00 N ATOM 1968 CA LEU A 134 15.633 -0.283 8.349 1.00 0.00 C ATOM 1969 C LEU A 134 16.614 -1.269 8.977 1.00 0.00 C ATOM 1970 O LEU A 134 16.448 -1.677 10.127 1.00 0.00 O ATOM 1971 CB LEU A 134 16.117 1.150 8.568 1.00 0.00 C ATOM 1972 CG LEU A 134 16.032 2.064 7.343 1.00 0.00 C ATOM 1973 CD1 LEU A 134 16.906 3.294 7.537 1.00 0.00 C ATOM 1974 CD2 LEU A 134 16.436 1.314 6.083 1.00 0.00 C ATOM 0 H LEU A 134 13.932 0.379 9.373 1.00 0.00 H new ATOM 0 HA LEU A 134 15.583 -0.484 7.279 1.00 0.00 H new ATOM 0 HB2 LEU A 134 15.532 1.594 9.373 1.00 0.00 H new ATOM 0 HB3 LEU A 134 17.153 1.118 8.906 1.00 0.00 H new ATOM 0 HG LEU A 134 14.998 2.389 7.228 1.00 0.00 H new ATOM 0 HD11 LEU A 134 16.834 3.934 6.657 1.00 0.00 H new ATOM 0 HD12 LEU A 134 16.569 3.845 8.415 1.00 0.00 H new ATOM 0 HD13 LEU A 134 17.942 2.986 7.678 1.00 0.00 H new ATOM 0 HD21 LEU A 134 16.368 1.982 5.224 1.00 0.00 H new ATOM 0 HD22 LEU A 134 17.461 0.957 6.185 1.00 0.00 H new ATOM 0 HD23 LEU A 134 15.769 0.465 5.935 1.00 0.00 H new ATOM 1986 N HIS A 135 17.634 -1.648 8.215 1.00 0.00 N ATOM 1987 CA HIS A 135 18.642 -2.585 8.696 1.00 0.00 C ATOM 1988 C HIS A 135 18.090 -4.006 8.731 1.00 0.00 C ATOM 1989 O HIS A 135 18.683 -4.899 9.337 1.00 0.00 O ATOM 1990 CB HIS A 135 19.126 -2.180 10.088 1.00 0.00 C ATOM 1991 CG HIS A 135 20.523 -2.626 10.389 1.00 0.00 C ATOM 1992 ND1 HIS A 135 20.787 -3.890 10.857 1.00 0.00 N ATOM 1993 CD2 HIS A 135 21.689 -1.945 10.273 1.00 0.00 C ATOM 1994 CE1 HIS A 135 22.097 -3.952 11.015 1.00 0.00 C ATOM 1995 NE2 HIS A 135 22.688 -2.796 10.673 1.00 0.00 N ATOM 0 H HIS A 135 17.785 -1.320 7.261 1.00 0.00 H new ATOM 0 HA HIS A 135 19.485 -2.557 8.005 1.00 0.00 H new ATOM 0 HB2 HIS A 135 19.072 -1.095 10.181 1.00 0.00 H new ATOM 0 HB3 HIS A 135 18.451 -2.598 10.834 1.00 0.00 H new ATOM 0 HD1 HIS A 135 20.110 -4.630 11.044 1.00 0.00 H new ATOM 0 HD2 HIS A 135 21.809 -0.928 9.931 1.00 0.00 H new ATOM 0 HE1 HIS A 135 22.626 -4.823 11.374 1.00 0.00 H new ATOM 2003 N HIS A 136 16.950 -4.209 8.079 1.00 0.00 N ATOM 2004 CA HIS A 136 16.319 -5.523 8.037 1.00 0.00 C ATOM 2005 C HIS A 136 16.541 -6.191 6.685 1.00 0.00 C ATOM 2006 O HIS A 136 16.999 -5.557 5.734 1.00 0.00 O ATOM 2007 CB HIS A 136 14.820 -5.402 8.315 1.00 0.00 C ATOM 2008 CG HIS A 136 14.159 -6.711 8.617 1.00 0.00 C ATOM 2009 ND1 HIS A 136 14.491 -7.440 9.733 1.00 0.00 N ATOM 2010 CD2 HIS A 136 13.202 -7.374 7.923 1.00 0.00 C ATOM 2011 CE1 HIS A 136 13.735 -8.523 9.695 1.00 0.00 C ATOM 2012 NE2 HIS A 136 12.937 -8.527 8.616 1.00 0.00 N ATOM 0 H HIS A 136 16.445 -3.481 7.573 1.00 0.00 H new ATOM 0 HA HIS A 136 16.777 -6.141 8.809 1.00 0.00 H new ATOM 0 HB2 HIS A 136 14.668 -4.725 9.156 1.00 0.00 H new ATOM 0 HB3 HIS A 136 14.334 -4.950 7.450 1.00 0.00 H new ATOM 0 HD2 HIS A 136 12.738 -7.055 7.001 1.00 0.00 H new ATOM 0 HE1 HIS A 136 13.757 -9.306 10.438 1.00 0.00 H new ATOM 0 HE2 HIS A 136 12.263 -9.249 8.361 1.00 0.00 H new ATOM 2020 N ARG A 137 16.211 -7.476 6.606 1.00 0.00 N ATOM 2021 CA ARG A 137 16.371 -8.233 5.370 1.00 0.00 C ATOM 2022 C ARG A 137 15.067 -8.927 4.990 1.00 0.00 C ATOM 2023 O ARG A 137 13.993 -8.546 5.453 1.00 0.00 O ATOM 2024 CB ARG A 137 17.489 -9.269 5.522 1.00 0.00 C ATOM 2025 CG ARG A 137 18.490 -8.929 6.613 1.00 0.00 C ATOM 2026 CD ARG A 137 19.668 -9.889 6.606 1.00 0.00 C ATOM 2027 NE ARG A 137 19.259 -11.261 6.897 1.00 0.00 N ATOM 2028 CZ ARG A 137 19.038 -11.719 8.125 1.00 0.00 C ATOM 2029 NH1 ARG A 137 19.188 -10.919 9.172 1.00 0.00 N ATOM 2030 NH2 ARG A 137 18.667 -12.980 8.306 1.00 0.00 N ATOM 0 H ARG A 137 15.831 -8.015 7.384 1.00 0.00 H new ATOM 0 HA ARG A 137 16.638 -7.536 4.576 1.00 0.00 H new ATOM 0 HB2 ARG A 137 17.045 -10.241 5.738 1.00 0.00 H new ATOM 0 HB3 ARG A 137 18.017 -9.363 4.573 1.00 0.00 H new ATOM 0 HG2 ARG A 137 18.849 -7.909 6.474 1.00 0.00 H new ATOM 0 HG3 ARG A 137 17.997 -8.963 7.584 1.00 0.00 H new ATOM 0 HD2 ARG A 137 20.157 -9.855 5.632 1.00 0.00 H new ATOM 0 HD3 ARG A 137 20.403 -9.566 7.343 1.00 0.00 H new ATOM 0 HE ARG A 137 19.136 -11.903 6.114 1.00 0.00 H new ATOM 0 HH11 ARG A 137 19.474 -9.949 9.036 1.00 0.00 H new ATOM 0 HH12 ARG A 137 19.018 -11.273 10.113 1.00 0.00 H new ATOM 0 HH21 ARG A 137 18.551 -13.598 7.503 1.00 0.00 H new ATOM 0 HH22 ARG A 137 18.497 -13.331 9.248 1.00 0.00 H new ATOM 2044 N ASP A 138 15.170 -9.945 4.145 1.00 0.00 N ATOM 2045 CA ASP A 138 13.997 -10.692 3.704 1.00 0.00 C ATOM 2046 C ASP A 138 14.280 -12.191 3.701 1.00 0.00 C ATOM 2047 O ASP A 138 15.320 -12.637 4.185 1.00 0.00 O ATOM 2048 CB ASP A 138 13.570 -10.235 2.307 1.00 0.00 C ATOM 2049 CG ASP A 138 12.077 -9.990 2.210 1.00 0.00 C ATOM 2050 OD1 ASP A 138 11.361 -10.289 3.190 1.00 0.00 O ATOM 2051 OD2 ASP A 138 11.623 -9.500 1.154 1.00 0.00 O ATOM 0 H ASP A 138 16.052 -10.273 3.751 1.00 0.00 H new ATOM 0 HA ASP A 138 13.185 -10.495 4.404 1.00 0.00 H new ATOM 0 HB2 ASP A 138 14.103 -9.320 2.048 1.00 0.00 H new ATOM 0 HB3 ASP A 138 13.860 -10.990 1.576 1.00 0.00 H new ATOM 2056 N ALA A 139 13.347 -12.966 3.155 1.00 0.00 N ATOM 2057 CA ALA A 139 13.501 -14.414 3.093 1.00 0.00 C ATOM 2058 C ALA A 139 14.665 -14.805 2.189 1.00 0.00 C ATOM 2059 O ALA A 139 15.068 -15.967 2.147 1.00 0.00 O ATOM 2060 CB ALA A 139 12.213 -15.061 2.608 1.00 0.00 C ATOM 0 H ALA A 139 12.479 -12.615 2.750 1.00 0.00 H new ATOM 0 HA ALA A 139 13.720 -14.774 4.098 1.00 0.00 H new ATOM 0 HB1 ALA A 139 12.342 -16.143 2.566 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.403 -14.819 3.296 1.00 0.00 H new ATOM 0 HB3 ALA A 139 11.970 -14.686 1.614 1.00 0.00 H new ATOM 2066 N SER A 140 15.203 -13.826 1.470 1.00 0.00 N ATOM 2067 CA SER A 140 16.322 -14.066 0.568 1.00 0.00 C ATOM 2068 C SER A 140 17.643 -13.692 1.232 1.00 0.00 C ATOM 2069 O SER A 140 18.649 -14.385 1.073 1.00 0.00 O ATOM 2070 CB SER A 140 16.144 -13.270 -0.727 1.00 0.00 C ATOM 2071 OG SER A 140 15.434 -12.066 -0.492 1.00 0.00 O ATOM 0 H SER A 140 14.882 -12.858 1.495 1.00 0.00 H new ATOM 0 HA SER A 140 16.343 -15.129 0.330 1.00 0.00 H new ATOM 0 HB2 SER A 140 17.120 -13.043 -1.155 1.00 0.00 H new ATOM 0 HB3 SER A 140 15.608 -13.875 -1.459 1.00 0.00 H new ATOM 0 HG SER A 140 15.335 -11.575 -1.334 1.00 0.00 H new ATOM 2077 N GLY A 141 17.633 -12.592 1.979 1.00 0.00 N ATOM 2078 CA GLY A 141 18.835 -12.145 2.657 1.00 0.00 C ATOM 2079 C GLY A 141 19.479 -10.957 1.971 1.00 0.00 C ATOM 2080 O GLY A 141 20.566 -11.074 1.404 1.00 0.00 O ATOM 0 H GLY A 141 16.814 -12.003 2.126 1.00 0.00 H new ATOM 0 HA2 GLY A 141 18.591 -11.878 3.685 1.00 0.00 H new ATOM 0 HA3 GLY A 141 19.550 -12.966 2.702 1.00 0.00 H new ATOM 2084 N LEU A 142 18.810 -9.809 2.022 1.00 0.00 N ATOM 2085 CA LEU A 142 19.328 -8.597 1.398 1.00 0.00 C ATOM 2086 C LEU A 142 18.728 -7.350 2.040 1.00 0.00 C ATOM 2087 O LEU A 142 17.517 -7.265 2.245 1.00 0.00 O ATOM 2088 CB LEU A 142 19.030 -8.606 -0.103 1.00 0.00 C ATOM 2089 CG LEU A 142 19.766 -9.684 -0.902 1.00 0.00 C ATOM 2090 CD1 LEU A 142 19.326 -9.661 -2.357 1.00 0.00 C ATOM 2091 CD2 LEU A 142 21.271 -9.493 -0.793 1.00 0.00 C ATOM 0 H LEU A 142 17.910 -9.693 2.488 1.00 0.00 H new ATOM 0 HA LEU A 142 20.407 -8.575 1.549 1.00 0.00 H new ATOM 0 HB2 LEU A 142 17.957 -8.739 -0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 142 19.287 -7.630 -0.515 1.00 0.00 H new ATOM 0 HG LEU A 142 19.513 -10.658 -0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 142 19.859 -10.434 -2.911 1.00 0.00 H new ATOM 0 HD12 LEU A 142 18.254 -9.847 -2.416 1.00 0.00 H new ATOM 0 HD13 LEU A 142 19.549 -8.686 -2.789 1.00 0.00 H new ATOM 0 HD21 LEU A 142 21.779 -10.268 -1.367 1.00 0.00 H new ATOM 0 HD22 LEU A 142 21.543 -8.513 -1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 142 21.572 -9.560 0.253 1.00 0.00 H new ATOM 2103 N THR A 143 19.586 -6.384 2.352 1.00 0.00 N ATOM 2104 CA THR A 143 19.148 -5.136 2.970 1.00 0.00 C ATOM 2105 C THR A 143 18.960 -4.047 1.918 1.00 0.00 C ATOM 2106 O THR A 143 19.517 -4.125 0.823 1.00 0.00 O ATOM 2107 CB THR A 143 20.168 -4.679 4.015 1.00 0.00 C ATOM 2108 OG1 THR A 143 21.428 -4.437 3.413 1.00 0.00 O ATOM 2109 CG2 THR A 143 20.376 -5.682 5.128 1.00 0.00 C ATOM 0 H THR A 143 20.591 -6.441 2.187 1.00 0.00 H new ATOM 0 HA THR A 143 18.190 -5.315 3.458 1.00 0.00 H new ATOM 0 HB THR A 143 19.753 -3.767 4.444 1.00 0.00 H new ATOM 0 HG1 THR A 143 21.484 -3.498 3.138 1.00 0.00 H new ATOM 0 HG21 THR A 143 21.111 -5.295 5.834 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.432 -5.853 5.645 1.00 0.00 H new ATOM 0 HG23 THR A 143 20.735 -6.622 4.709 1.00 0.00 H new ATOM 2117 N PRO A 144 18.173 -3.009 2.242 1.00 0.00 N ATOM 2118 CA PRO A 144 17.909 -1.896 1.338 1.00 0.00 C ATOM 2119 C PRO A 144 19.145 -1.497 0.540 1.00 0.00 C ATOM 2120 O PRO A 144 19.086 -1.350 -0.680 1.00 0.00 O ATOM 2121 CB PRO A 144 17.479 -0.756 2.278 1.00 0.00 C ATOM 2122 CG PRO A 144 17.457 -1.334 3.663 1.00 0.00 C ATOM 2123 CD PRO A 144 17.481 -2.830 3.515 1.00 0.00 C ATOM 0 HA PRO A 144 17.157 -2.149 0.591 1.00 0.00 H new ATOM 0 HB2 PRO A 144 18.175 0.081 2.217 1.00 0.00 H new ATOM 0 HB3 PRO A 144 16.496 -0.374 2.001 1.00 0.00 H new ATOM 0 HG2 PRO A 144 18.316 -0.990 4.238 1.00 0.00 H new ATOM 0 HG3 PRO A 144 16.564 -1.014 4.200 1.00 0.00 H new ATOM 0 HD2 PRO A 144 18.012 -3.311 4.337 1.00 0.00 H new ATOM 0 HD3 PRO A 144 16.476 -3.252 3.494 1.00 0.00 H new ATOM 2131 N LEU A 145 20.264 -1.328 1.235 1.00 0.00 N ATOM 2132 CA LEU A 145 21.514 -0.950 0.587 1.00 0.00 C ATOM 2133 C LEU A 145 22.016 -2.071 -0.316 1.00 0.00 C ATOM 2134 O LEU A 145 22.505 -1.821 -1.419 1.00 0.00 O ATOM 2135 CB LEU A 145 22.575 -0.607 1.634 1.00 0.00 C ATOM 2136 CG LEU A 145 22.937 0.876 1.722 1.00 0.00 C ATOM 2137 CD1 LEU A 145 24.104 1.084 2.676 1.00 0.00 C ATOM 2138 CD2 LEU A 145 23.267 1.427 0.344 1.00 0.00 C ATOM 0 H LEU A 145 20.331 -1.447 2.246 1.00 0.00 H new ATOM 0 HA LEU A 145 21.325 -0.069 -0.027 1.00 0.00 H new ATOM 0 HB2 LEU A 145 22.221 -0.938 2.610 1.00 0.00 H new ATOM 0 HB3 LEU A 145 23.479 -1.174 1.413 1.00 0.00 H new ATOM 0 HG LEU A 145 22.075 1.419 2.111 1.00 0.00 H new ATOM 0 HD11 LEU A 145 24.348 2.145 2.726 1.00 0.00 H new ATOM 0 HD12 LEU A 145 23.830 0.727 3.669 1.00 0.00 H new ATOM 0 HD13 LEU A 145 24.971 0.529 2.317 1.00 0.00 H new ATOM 0 HD21 LEU A 145 23.522 2.484 0.426 1.00 0.00 H new ATOM 0 HD22 LEU A 145 24.113 0.881 -0.073 1.00 0.00 H new ATOM 0 HD23 LEU A 145 22.403 1.312 -0.310 1.00 0.00 H new ATOM 2150 N GLU A 146 21.891 -3.306 0.156 1.00 0.00 N ATOM 2151 CA GLU A 146 22.331 -4.466 -0.611 1.00 0.00 C ATOM 2152 C GLU A 146 21.715 -4.454 -2.007 1.00 0.00 C ATOM 2153 O GLU A 146 22.414 -4.256 -3.001 1.00 0.00 O ATOM 2154 CB GLU A 146 21.957 -5.758 0.116 1.00 0.00 C ATOM 2155 CG GLU A 146 22.948 -6.156 1.198 1.00 0.00 C ATOM 2156 CD GLU A 146 22.686 -5.454 2.516 1.00 0.00 C ATOM 2157 OE1 GLU A 146 22.728 -4.206 2.543 1.00 0.00 O ATOM 2158 OE2 GLU A 146 22.440 -6.153 3.522 1.00 0.00 O ATOM 0 H GLU A 146 21.489 -3.530 1.066 1.00 0.00 H new ATOM 0 HA GLU A 146 23.415 -4.418 -0.710 1.00 0.00 H new ATOM 0 HB2 GLU A 146 20.970 -5.640 0.564 1.00 0.00 H new ATOM 0 HB3 GLU A 146 21.882 -6.566 -0.612 1.00 0.00 H new ATOM 0 HG2 GLU A 146 22.901 -7.234 1.349 1.00 0.00 H new ATOM 0 HG3 GLU A 146 23.959 -5.925 0.862 1.00 0.00 H new ATOM 2165 N LEU A 147 20.403 -4.661 -2.075 1.00 0.00 N ATOM 2166 CA LEU A 147 19.701 -4.665 -3.353 1.00 0.00 C ATOM 2167 C LEU A 147 20.012 -3.393 -4.131 1.00 0.00 C ATOM 2168 O LEU A 147 20.005 -3.386 -5.362 1.00 0.00 O ATOM 2169 CB LEU A 147 18.192 -4.789 -3.131 1.00 0.00 C ATOM 2170 CG LEU A 147 17.432 -5.518 -4.240 1.00 0.00 C ATOM 2171 CD1 LEU A 147 17.833 -6.984 -4.287 1.00 0.00 C ATOM 2172 CD2 LEU A 147 15.930 -5.380 -4.036 1.00 0.00 C ATOM 0 H LEU A 147 19.807 -4.827 -1.264 1.00 0.00 H new ATOM 0 HA LEU A 147 20.042 -5.523 -3.932 1.00 0.00 H new ATOM 0 HB2 LEU A 147 18.020 -5.312 -2.190 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.773 -3.789 -3.021 1.00 0.00 H new ATOM 0 HG LEU A 147 17.693 -5.061 -5.195 1.00 0.00 H new ATOM 0 HD11 LEU A 147 17.282 -7.487 -5.082 1.00 0.00 H new ATOM 0 HD12 LEU A 147 18.903 -7.063 -4.481 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.602 -7.455 -3.332 1.00 0.00 H new ATOM 0 HD21 LEU A 147 15.405 -5.905 -4.834 1.00 0.00 H new ATOM 0 HD22 LEU A 147 15.652 -5.811 -3.074 1.00 0.00 H new ATOM 0 HD23 LEU A 147 15.656 -4.325 -4.053 1.00 0.00 H new ATOM 2184 N ALA A 148 20.293 -2.319 -3.402 1.00 0.00 N ATOM 2185 CA ALA A 148 20.620 -1.043 -4.021 1.00 0.00 C ATOM 2186 C ALA A 148 22.018 -1.088 -4.628 1.00 0.00 C ATOM 2187 O ALA A 148 22.385 -0.235 -5.437 1.00 0.00 O ATOM 2188 CB ALA A 148 20.514 0.083 -3.005 1.00 0.00 C ATOM 0 H ALA A 148 20.301 -2.308 -2.382 1.00 0.00 H new ATOM 0 HA ALA A 148 19.904 -0.853 -4.821 1.00 0.00 H new ATOM 0 HB1 ALA A 148 20.762 1.030 -3.484 1.00 0.00 H new ATOM 0 HB2 ALA A 148 19.497 0.128 -2.617 1.00 0.00 H new ATOM 0 HB3 ALA A 148 21.208 -0.101 -2.185 1.00 0.00 H new ATOM 2194 N ARG A 149 22.791 -2.098 -4.235 1.00 0.00 N ATOM 2195 CA ARG A 149 24.147 -2.268 -4.742 1.00 0.00 C ATOM 2196 C ARG A 149 24.110 -2.758 -6.181 1.00 0.00 C ATOM 2197 O ARG A 149 24.783 -2.211 -7.054 1.00 0.00 O ATOM 2198 CB ARG A 149 24.924 -3.254 -3.869 1.00 0.00 C ATOM 2199 CG ARG A 149 26.407 -3.317 -4.195 1.00 0.00 C ATOM 2200 CD ARG A 149 27.211 -3.873 -3.030 1.00 0.00 C ATOM 2201 NE ARG A 149 28.310 -2.990 -2.652 1.00 0.00 N ATOM 2202 CZ ARG A 149 28.900 -3.019 -1.460 1.00 0.00 C ATOM 2203 NH1 ARG A 149 28.493 -3.881 -0.540 1.00 0.00 N ATOM 2204 NH2 ARG A 149 29.895 -2.187 -1.190 1.00 0.00 N ATOM 0 H ARG A 149 22.499 -2.811 -3.566 1.00 0.00 H new ATOM 0 HA ARG A 149 24.653 -1.303 -4.711 1.00 0.00 H new ATOM 0 HB2 ARG A 149 24.802 -2.974 -2.823 1.00 0.00 H new ATOM 0 HB3 ARG A 149 24.492 -4.248 -3.986 1.00 0.00 H new ATOM 0 HG2 ARG A 149 26.561 -3.941 -5.075 1.00 0.00 H new ATOM 0 HG3 ARG A 149 26.768 -2.319 -4.445 1.00 0.00 H new ATOM 0 HD2 ARG A 149 26.553 -4.020 -2.173 1.00 0.00 H new ATOM 0 HD3 ARG A 149 27.609 -4.852 -3.298 1.00 0.00 H new ATOM 0 HE ARG A 149 28.644 -2.314 -3.339 1.00 0.00 H new ATOM 0 HH11 ARG A 149 27.727 -4.523 -0.746 1.00 0.00 H new ATOM 0 HH12 ARG A 149 28.946 -3.903 0.374 1.00 0.00 H new ATOM 0 HH21 ARG A 149 30.210 -1.522 -1.897 1.00 0.00 H new ATOM 0 HH22 ARG A 149 30.346 -2.211 -0.275 1.00 0.00 H new ATOM 2218 N GLN A 150 23.306 -3.785 -6.420 1.00 0.00 N ATOM 2219 CA GLN A 150 23.162 -4.343 -7.753 1.00 0.00 C ATOM 2220 C GLN A 150 22.385 -3.378 -8.637 1.00 0.00 C ATOM 2221 O GLN A 150 22.965 -2.499 -9.274 1.00 0.00 O ATOM 2222 CB GLN A 150 22.455 -5.700 -7.705 1.00 0.00 C ATOM 2223 CG GLN A 150 21.511 -5.857 -6.532 1.00 0.00 C ATOM 2224 CD GLN A 150 20.288 -6.687 -6.871 1.00 0.00 C ATOM 2225 OE1 GLN A 150 19.154 -6.237 -6.709 1.00 0.00 O ATOM 2226 NE2 GLN A 150 20.514 -7.907 -7.344 1.00 0.00 N ATOM 0 H GLN A 150 22.744 -4.248 -5.706 1.00 0.00 H new ATOM 0 HA GLN A 150 24.157 -4.493 -8.173 1.00 0.00 H new ATOM 0 HB2 GLN A 150 21.896 -5.841 -8.630 1.00 0.00 H new ATOM 0 HB3 GLN A 150 23.206 -6.489 -7.663 1.00 0.00 H new ATOM 0 HG2 GLN A 150 22.043 -6.324 -5.703 1.00 0.00 H new ATOM 0 HG3 GLN A 150 21.193 -4.871 -6.192 1.00 0.00 H new ATOM 0 HE21 GLN A 150 21.471 -8.239 -7.462 1.00 0.00 H new ATOM 0 HE22 GLN A 150 19.730 -8.512 -7.589 1.00 0.00 H new ATOM 2235 N ARG A 151 21.067 -3.535 -8.655 1.00 0.00 N ATOM 2236 CA ARG A 151 20.204 -2.668 -9.440 1.00 0.00 C ATOM 2237 C ARG A 151 20.045 -1.311 -8.765 1.00 0.00 C ATOM 2238 O ARG A 151 18.926 -0.833 -8.580 1.00 0.00 O ATOM 2239 CB ARG A 151 18.833 -3.318 -9.638 1.00 0.00 C ATOM 2240 CG ARG A 151 18.879 -4.591 -10.467 1.00 0.00 C ATOM 2241 CD ARG A 151 18.053 -5.699 -9.832 1.00 0.00 C ATOM 2242 NE ARG A 151 18.106 -6.933 -10.610 1.00 0.00 N ATOM 2243 CZ ARG A 151 17.552 -8.075 -10.217 1.00 0.00 C ATOM 2244 NH1 ARG A 151 16.911 -8.139 -9.057 1.00 0.00 N ATOM 2245 NH2 ARG A 151 17.638 -9.154 -10.981 1.00 0.00 N ATOM 0 H ARG A 151 20.573 -4.258 -8.132 1.00 0.00 H new ATOM 0 HA ARG A 151 20.668 -2.519 -10.415 1.00 0.00 H new ATOM 0 HB2 ARG A 151 18.403 -3.545 -8.662 1.00 0.00 H new ATOM 0 HB3 ARG A 151 18.167 -2.603 -10.121 1.00 0.00 H new ATOM 0 HG2 ARG A 151 18.506 -4.387 -11.471 1.00 0.00 H new ATOM 0 HG3 ARG A 151 19.913 -4.921 -10.572 1.00 0.00 H new ATOM 0 HD2 ARG A 151 18.418 -5.890 -8.823 1.00 0.00 H new ATOM 0 HD3 ARG A 151 17.017 -5.372 -9.740 1.00 0.00 H new ATOM 0 HE ARG A 151 18.595 -6.918 -11.505 1.00 0.00 H new ATOM 0 HH11 ARG A 151 16.843 -7.311 -8.466 1.00 0.00 H new ATOM 0 HH12 ARG A 151 16.486 -9.016 -8.757 1.00 0.00 H new ATOM 0 HH21 ARG A 151 18.130 -9.109 -11.873 1.00 0.00 H new ATOM 0 HH22 ARG A 151 17.212 -10.029 -10.677 1.00 0.00 H new ATOM 2259 N GLY A 152 21.161 -0.687 -8.395 1.00 0.00 N ATOM 2260 CA GLY A 152 21.102 0.613 -7.746 1.00 0.00 C ATOM 2261 C GLY A 152 20.761 1.732 -8.704 1.00 0.00 C ATOM 2262 O GLY A 152 21.378 2.797 -8.662 1.00 0.00 O ATOM 0 H GLY A 152 22.102 -1.056 -8.532 1.00 0.00 H new ATOM 0 HA2 GLY A 152 20.358 0.583 -6.950 1.00 0.00 H new ATOM 0 HA3 GLY A 152 22.063 0.823 -7.276 1.00 0.00 H new ATOM 2266 N ALA A 153 19.776 1.496 -9.565 1.00 0.00 N ATOM 2267 CA ALA A 153 19.347 2.500 -10.535 1.00 0.00 C ATOM 2268 C ALA A 153 19.471 3.891 -9.934 1.00 0.00 C ATOM 2269 O ALA A 153 19.371 4.045 -8.721 1.00 0.00 O ATOM 2270 CB ALA A 153 17.912 2.240 -10.967 1.00 0.00 C ATOM 0 H ALA A 153 19.259 0.618 -9.611 1.00 0.00 H new ATOM 0 HA ALA A 153 19.990 2.436 -11.413 1.00 0.00 H new ATOM 0 HB1 ALA A 153 17.607 2.997 -11.690 1.00 0.00 H new ATOM 0 HB2 ALA A 153 17.843 1.253 -11.424 1.00 0.00 H new ATOM 0 HB3 ALA A 153 17.257 2.284 -10.097 1.00 0.00 H new ATOM 2276 N GLN A 154 19.704 4.897 -10.769 1.00 0.00 N ATOM 2277 CA GLN A 154 19.852 6.259 -10.269 1.00 0.00 C ATOM 2278 C GLN A 154 20.666 6.235 -8.977 1.00 0.00 C ATOM 2279 O GLN A 154 21.352 5.252 -8.695 1.00 0.00 O ATOM 2280 CB GLN A 154 18.471 6.894 -10.034 1.00 0.00 C ATOM 2281 CG GLN A 154 17.328 5.887 -9.965 1.00 0.00 C ATOM 2282 CD GLN A 154 17.119 5.270 -8.585 1.00 0.00 C ATOM 2283 OE1 GLN A 154 16.199 4.474 -8.394 1.00 0.00 O ATOM 2284 NE2 GLN A 154 17.957 5.625 -7.612 1.00 0.00 N ATOM 0 H GLN A 154 19.794 4.799 -11.780 1.00 0.00 H new ATOM 0 HA GLN A 154 20.377 6.864 -11.008 1.00 0.00 H new ATOM 0 HB2 GLN A 154 18.497 7.462 -9.104 1.00 0.00 H new ATOM 0 HB3 GLN A 154 18.268 7.604 -10.836 1.00 0.00 H new ATOM 0 HG2 GLN A 154 16.406 6.380 -10.274 1.00 0.00 H new ATOM 0 HG3 GLN A 154 17.518 5.089 -10.682 1.00 0.00 H new ATOM 0 HE21 GLN A 154 18.709 6.287 -7.803 1.00 0.00 H new ATOM 0 HE22 GLN A 154 17.846 5.235 -6.676 1.00 0.00 H new ATOM 2293 N ASN A 155 20.590 7.296 -8.183 1.00 0.00 N ATOM 2294 CA ASN A 155 21.323 7.349 -6.920 1.00 0.00 C ATOM 2295 C ASN A 155 20.670 6.462 -5.852 1.00 0.00 C ATOM 2296 O ASN A 155 20.537 6.874 -4.701 1.00 0.00 O ATOM 2297 CB ASN A 155 21.403 8.791 -6.416 1.00 0.00 C ATOM 2298 CG ASN A 155 22.830 9.236 -6.161 1.00 0.00 C ATOM 2299 OD1 ASN A 155 23.662 8.457 -5.695 1.00 0.00 O ATOM 2300 ND2 ASN A 155 23.119 10.496 -6.464 1.00 0.00 N ATOM 0 H ASN A 155 20.034 8.126 -8.387 1.00 0.00 H new ATOM 0 HA ASN A 155 22.329 6.972 -7.105 1.00 0.00 H new ATOM 0 HB2 ASN A 155 20.944 9.455 -7.148 1.00 0.00 H new ATOM 0 HB3 ASN A 155 20.826 8.884 -5.496 1.00 0.00 H new ATOM 0 HD21 ASN A 155 24.062 10.853 -6.313 1.00 0.00 H new ATOM 0 HD22 ASN A 155 22.398 11.106 -6.848 1.00 0.00 H new ATOM 2307 N LEU A 156 20.263 5.247 -6.229 1.00 0.00 N ATOM 2308 CA LEU A 156 19.627 4.328 -5.289 1.00 0.00 C ATOM 2309 C LEU A 156 20.549 4.020 -4.122 1.00 0.00 C ATOM 2310 O LEU A 156 20.190 4.218 -2.962 1.00 0.00 O ATOM 2311 CB LEU A 156 19.238 3.026 -5.989 1.00 0.00 C ATOM 2312 CG LEU A 156 17.737 2.823 -6.184 1.00 0.00 C ATOM 2313 CD1 LEU A 156 17.433 1.369 -6.509 1.00 0.00 C ATOM 2314 CD2 LEU A 156 16.979 3.267 -4.942 1.00 0.00 C ATOM 0 H LEU A 156 20.363 4.880 -7.176 1.00 0.00 H new ATOM 0 HA LEU A 156 18.728 4.813 -4.909 1.00 0.00 H new ATOM 0 HB2 LEU A 156 19.723 2.996 -6.964 1.00 0.00 H new ATOM 0 HB3 LEU A 156 19.631 2.189 -5.412 1.00 0.00 H new ATOM 0 HG LEU A 156 17.409 3.435 -7.025 1.00 0.00 H new ATOM 0 HD11 LEU A 156 16.359 1.243 -6.645 1.00 0.00 H new ATOM 0 HD12 LEU A 156 17.950 1.085 -7.426 1.00 0.00 H new ATOM 0 HD13 LEU A 156 17.772 0.735 -5.690 1.00 0.00 H new ATOM 0 HD21 LEU A 156 15.910 3.117 -5.095 1.00 0.00 H new ATOM 0 HD22 LEU A 156 17.309 2.680 -4.085 1.00 0.00 H new ATOM 0 HD23 LEU A 156 17.174 4.323 -4.755 1.00 0.00 H new ATOM 2326 N MET A 157 21.741 3.533 -4.438 1.00 0.00 N ATOM 2327 CA MET A 157 22.715 3.196 -3.424 1.00 0.00 C ATOM 2328 C MET A 157 22.918 4.367 -2.470 1.00 0.00 C ATOM 2329 O MET A 157 22.966 4.188 -1.254 1.00 0.00 O ATOM 2330 CB MET A 157 24.033 2.824 -4.096 1.00 0.00 C ATOM 2331 CG MET A 157 24.189 1.335 -4.345 1.00 0.00 C ATOM 2332 SD MET A 157 25.778 0.704 -3.775 1.00 0.00 S ATOM 2333 CE MET A 157 25.402 0.340 -2.062 1.00 0.00 C ATOM 0 H MET A 157 22.052 3.364 -5.395 1.00 0.00 H new ATOM 0 HA MET A 157 22.352 2.346 -2.846 1.00 0.00 H new ATOM 0 HB2 MET A 157 24.109 3.353 -5.046 1.00 0.00 H new ATOM 0 HB3 MET A 157 24.859 3.168 -3.473 1.00 0.00 H new ATOM 0 HG2 MET A 157 23.386 0.799 -3.839 1.00 0.00 H new ATOM 0 HG3 MET A 157 24.083 1.135 -5.411 1.00 0.00 H new ATOM 0 HE1 MET A 157 25.980 -0.526 -1.739 1.00 0.00 H new ATOM 0 HE2 MET A 157 25.659 1.199 -1.443 1.00 0.00 H new ATOM 0 HE3 MET A 157 24.338 0.125 -1.961 1.00 0.00 H new ATOM 2343 N ASP A 158 23.028 5.566 -3.031 1.00 0.00 N ATOM 2344 CA ASP A 158 23.217 6.765 -2.228 1.00 0.00 C ATOM 2345 C ASP A 158 21.926 7.171 -1.529 1.00 0.00 C ATOM 2346 O ASP A 158 21.948 7.664 -0.401 1.00 0.00 O ATOM 2347 CB ASP A 158 23.732 7.916 -3.096 1.00 0.00 C ATOM 2348 CG ASP A 158 23.565 7.642 -4.577 1.00 0.00 C ATOM 2349 OD1 ASP A 158 22.418 7.407 -5.011 1.00 0.00 O ATOM 2350 OD2 ASP A 158 24.581 7.663 -5.302 1.00 0.00 O ATOM 0 H ASP A 158 22.989 5.732 -4.037 1.00 0.00 H new ATOM 0 HA ASP A 158 23.960 6.539 -1.463 1.00 0.00 H new ATOM 0 HB2 ASP A 158 23.199 8.830 -2.836 1.00 0.00 H new ATOM 0 HB3 ASP A 158 24.786 8.089 -2.878 1.00 0.00 H new ATOM 2355 N ILE A 159 20.803 6.955 -2.199 1.00 0.00 N ATOM 2356 CA ILE A 159 19.508 7.291 -1.643 1.00 0.00 C ATOM 2357 C ILE A 159 19.338 6.656 -0.264 1.00 0.00 C ATOM 2358 O ILE A 159 18.998 7.329 0.710 1.00 0.00 O ATOM 2359 CB ILE A 159 18.378 6.809 -2.581 1.00 0.00 C ATOM 2360 CG1 ILE A 159 18.172 7.796 -3.730 1.00 0.00 C ATOM 2361 CG2 ILE A 159 17.082 6.612 -1.819 1.00 0.00 C ATOM 2362 CD1 ILE A 159 17.587 7.158 -4.973 1.00 0.00 C ATOM 0 H ILE A 159 20.767 6.546 -3.133 1.00 0.00 H new ATOM 0 HA ILE A 159 19.450 8.375 -1.544 1.00 0.00 H new ATOM 0 HB ILE A 159 18.678 5.847 -2.997 1.00 0.00 H new ATOM 0 HG12 ILE A 159 17.512 8.597 -3.397 1.00 0.00 H new ATOM 0 HG13 ILE A 159 19.128 8.254 -3.982 1.00 0.00 H new ATOM 0 HG21 ILE A 159 16.305 6.273 -2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 159 17.229 5.865 -1.038 1.00 0.00 H new ATOM 0 HG23 ILE A 159 16.779 7.556 -1.366 1.00 0.00 H new ATOM 0 HD11 ILE A 159 17.467 7.915 -5.748 1.00 0.00 H new ATOM 0 HD12 ILE A 159 18.257 6.376 -5.330 1.00 0.00 H new ATOM 0 HD13 ILE A 159 16.616 6.724 -4.736 1.00 0.00 H new ATOM 2374 N LEU A 160 19.569 5.352 -0.201 1.00 0.00 N ATOM 2375 CA LEU A 160 19.437 4.600 1.042 1.00 0.00 C ATOM 2376 C LEU A 160 20.603 4.880 1.984 1.00 0.00 C ATOM 2377 O LEU A 160 20.484 4.724 3.199 1.00 0.00 O ATOM 2378 CB LEU A 160 19.335 3.105 0.749 1.00 0.00 C ATOM 2379 CG LEU A 160 18.972 2.768 -0.694 1.00 0.00 C ATOM 2380 CD1 LEU A 160 18.624 1.296 -0.834 1.00 0.00 C ATOM 2381 CD2 LEU A 160 17.827 3.644 -1.181 1.00 0.00 C ATOM 0 H LEU A 160 19.851 4.788 -1.003 1.00 0.00 H new ATOM 0 HA LEU A 160 18.522 4.925 1.537 1.00 0.00 H new ATOM 0 HB2 LEU A 160 20.288 2.634 0.990 1.00 0.00 H new ATOM 0 HB3 LEU A 160 18.587 2.668 1.410 1.00 0.00 H new ATOM 0 HG LEU A 160 19.842 2.970 -1.319 1.00 0.00 H new ATOM 0 HD11 LEU A 160 18.369 1.080 -1.871 1.00 0.00 H new ATOM 0 HD12 LEU A 160 19.480 0.690 -0.537 1.00 0.00 H new ATOM 0 HD13 LEU A 160 17.773 1.061 -0.194 1.00 0.00 H new ATOM 0 HD21 LEU A 160 17.585 3.386 -2.212 1.00 0.00 H new ATOM 0 HD22 LEU A 160 16.952 3.482 -0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 160 18.123 4.692 -1.129 1.00 0.00 H new ATOM 2393 N GLN A 161 21.730 5.289 1.412 1.00 0.00 N ATOM 2394 CA GLN A 161 22.922 5.587 2.196 1.00 0.00 C ATOM 2395 C GLN A 161 22.688 6.774 3.124 1.00 0.00 C ATOM 2396 O GLN A 161 23.107 6.762 4.282 1.00 0.00 O ATOM 2397 CB GLN A 161 24.101 5.875 1.268 1.00 0.00 C ATOM 2398 CG GLN A 161 25.236 4.872 1.396 1.00 0.00 C ATOM 2399 CD GLN A 161 25.977 4.993 2.712 1.00 0.00 C ATOM 2400 OE1 GLN A 161 27.022 5.639 2.792 1.00 0.00 O ATOM 2401 NE2 GLN A 161 25.437 4.372 3.754 1.00 0.00 N ATOM 0 H GLN A 161 21.843 5.422 0.407 1.00 0.00 H new ATOM 0 HA GLN A 161 23.150 4.715 2.809 1.00 0.00 H new ATOM 0 HB2 GLN A 161 23.748 5.881 0.237 1.00 0.00 H new ATOM 0 HB3 GLN A 161 24.484 6.873 1.480 1.00 0.00 H new ATOM 0 HG2 GLN A 161 24.836 3.863 1.300 1.00 0.00 H new ATOM 0 HG3 GLN A 161 25.937 5.016 0.574 1.00 0.00 H new ATOM 0 HE21 GLN A 161 24.569 3.848 3.642 1.00 0.00 H new ATOM 0 HE22 GLN A 161 25.890 4.419 4.667 1.00 0.00 H new ATOM 2410 N GLY A 162 22.015 7.799 2.611 1.00 0.00 N ATOM 2411 CA GLY A 162 21.737 8.979 3.408 1.00 0.00 C ATOM 2412 C GLY A 162 20.679 8.729 4.465 1.00 0.00 C ATOM 2413 O GLY A 162 20.899 8.994 5.647 1.00 0.00 O ATOM 0 H GLY A 162 21.657 7.833 1.657 1.00 0.00 H new ATOM 0 HA2 GLY A 162 22.656 9.313 3.890 1.00 0.00 H new ATOM 0 HA3 GLY A 162 21.409 9.787 2.754 1.00 0.00 H new ATOM 2417 N HIS A 163 19.529 8.219 4.039 1.00 0.00 N ATOM 2418 CA HIS A 163 18.433 7.933 4.957 1.00 0.00 C ATOM 2419 C HIS A 163 18.854 6.906 6.003 1.00 0.00 C ATOM 2420 O HIS A 163 18.505 7.021 7.177 1.00 0.00 O ATOM 2421 CB HIS A 163 17.214 7.423 4.186 1.00 0.00 C ATOM 2422 CG HIS A 163 16.905 8.222 2.958 1.00 0.00 C ATOM 2423 ND1 HIS A 163 16.932 9.595 2.971 1.00 0.00 N ATOM 2424 CD2 HIS A 163 16.571 7.797 1.716 1.00 0.00 C ATOM 2425 CE1 HIS A 163 16.616 9.974 1.745 1.00 0.00 C ATOM 2426 NE2 HIS A 163 16.389 8.919 0.949 1.00 0.00 N ATOM 0 H HIS A 163 19.332 7.995 3.064 1.00 0.00 H new ATOM 0 HA HIS A 163 18.169 8.859 5.468 1.00 0.00 H new ATOM 0 HB2 HIS A 163 17.383 6.385 3.901 1.00 0.00 H new ATOM 0 HB3 HIS A 163 16.346 7.435 4.845 1.00 0.00 H new ATOM 0 HD1 HIS A 163 17.151 10.198 3.764 1.00 0.00 H new ATOM 0 HD2 HIS A 163 16.468 6.772 1.392 1.00 0.00 H new ATOM 0 HE1 HIS A 163 16.549 11.003 1.425 1.00 0.00 H new ATOM 2434 N MET A 164 19.606 5.900 5.566 1.00 0.00 N ATOM 2435 CA MET A 164 20.077 4.853 6.464 1.00 0.00 C ATOM 2436 C MET A 164 21.093 5.403 7.459 1.00 0.00 C ATOM 2437 O MET A 164 22.294 5.168 7.329 1.00 0.00 O ATOM 2438 CB MET A 164 20.698 3.707 5.663 1.00 0.00 C ATOM 2439 CG MET A 164 21.205 2.564 6.527 1.00 0.00 C ATOM 2440 SD MET A 164 20.486 0.975 6.070 1.00 0.00 S ATOM 2441 CE MET A 164 20.479 1.108 4.284 1.00 0.00 C ATOM 0 H MET A 164 19.902 5.789 4.596 1.00 0.00 H new ATOM 0 HA MET A 164 19.220 4.475 7.021 1.00 0.00 H new ATOM 0 HB2 MET A 164 19.957 3.321 4.963 1.00 0.00 H new ATOM 0 HB3 MET A 164 21.525 4.097 5.069 1.00 0.00 H new ATOM 0 HG2 MET A 164 22.290 2.505 6.444 1.00 0.00 H new ATOM 0 HG3 MET A 164 20.977 2.775 7.572 1.00 0.00 H new ATOM 0 HE1 MET A 164 20.587 0.116 3.845 1.00 0.00 H new ATOM 0 HE2 MET A 164 19.538 1.550 3.956 1.00 0.00 H new ATOM 0 HE3 MET A 164 21.308 1.739 3.963 1.00 0.00 H new ATOM 2451 N MET A 165 20.603 6.136 8.454 1.00 0.00 N ATOM 2452 CA MET A 165 21.467 6.718 9.473 1.00 0.00 C ATOM 2453 C MET A 165 21.554 5.811 10.696 1.00 0.00 C ATOM 2454 O MET A 165 20.579 5.647 11.430 1.00 0.00 O ATOM 2455 CB MET A 165 20.947 8.098 9.885 1.00 0.00 C ATOM 2456 CG MET A 165 20.660 9.016 8.708 1.00 0.00 C ATOM 2457 SD MET A 165 20.536 10.749 9.193 1.00 0.00 S ATOM 2458 CE MET A 165 19.230 10.666 10.415 1.00 0.00 C ATOM 0 H MET A 165 19.611 6.341 8.576 1.00 0.00 H new ATOM 0 HA MET A 165 22.466 6.824 9.049 1.00 0.00 H new ATOM 0 HB2 MET A 165 20.035 7.974 10.469 1.00 0.00 H new ATOM 0 HB3 MET A 165 21.680 8.574 10.536 1.00 0.00 H new ATOM 0 HG2 MET A 165 21.450 8.906 7.965 1.00 0.00 H new ATOM 0 HG3 MET A 165 19.729 8.709 8.231 1.00 0.00 H new ATOM 0 HE1 MET A 165 18.914 11.675 10.679 1.00 0.00 H new ATOM 0 HE2 MET A 165 18.383 10.117 10.005 1.00 0.00 H new ATOM 0 HE3 MET A 165 19.597 10.156 11.306 1.00 0.00 H new ATOM 2468 N ILE A 166 22.727 5.223 10.909 1.00 0.00 N ATOM 2469 CA ILE A 166 22.938 4.331 12.044 1.00 0.00 C ATOM 2470 C ILE A 166 24.039 4.856 12.960 1.00 0.00 C ATOM 2471 O ILE A 166 25.192 4.437 12.865 1.00 0.00 O ATOM 2472 CB ILE A 166 23.306 2.909 11.579 1.00 0.00 C ATOM 2473 CG1 ILE A 166 24.017 2.959 10.225 1.00 0.00 C ATOM 2474 CG2 ILE A 166 22.062 2.039 11.499 1.00 0.00 C ATOM 2475 CD1 ILE A 166 24.292 1.593 9.636 1.00 0.00 C ATOM 0 H ILE A 166 23.545 5.348 10.312 1.00 0.00 H new ATOM 0 HA ILE A 166 21.999 4.293 12.596 1.00 0.00 H new ATOM 0 HB ILE A 166 23.986 2.469 12.309 1.00 0.00 H new ATOM 0 HG12 ILE A 166 23.408 3.532 9.525 1.00 0.00 H new ATOM 0 HG13 ILE A 166 24.960 3.493 10.339 1.00 0.00 H new ATOM 0 HG21 ILE A 166 22.339 1.038 11.169 1.00 0.00 H new ATOM 0 HG22 ILE A 166 21.595 1.981 12.482 1.00 0.00 H new ATOM 0 HG23 ILE A 166 21.359 2.474 10.788 1.00 0.00 H new ATOM 0 HD11 ILE A 166 24.798 1.705 8.677 1.00 0.00 H new ATOM 0 HD12 ILE A 166 24.926 1.025 10.316 1.00 0.00 H new ATOM 0 HD13 ILE A 166 23.351 1.063 9.490 1.00 0.00 H new ATOM 2487 N PRO A 167 23.691 5.785 13.862 1.00 0.00 N ATOM 2488 CA PRO A 167 24.649 6.373 14.802 1.00 0.00 C ATOM 2489 C PRO A 167 25.452 5.315 15.546 1.00 0.00 C ATOM 2490 O PRO A 167 26.664 5.196 15.366 1.00 0.00 O ATOM 2491 CB PRO A 167 23.760 7.153 15.773 1.00 0.00 C ATOM 2492 CG PRO A 167 22.539 7.481 14.987 1.00 0.00 C ATOM 2493 CD PRO A 167 22.334 6.333 14.036 1.00 0.00 C ATOM 0 HA PRO A 167 25.392 6.989 14.296 1.00 0.00 H new ATOM 0 HB2 PRO A 167 23.516 6.557 16.653 1.00 0.00 H new ATOM 0 HB3 PRO A 167 24.257 8.056 16.127 1.00 0.00 H new ATOM 0 HG2 PRO A 167 21.676 7.604 15.641 1.00 0.00 H new ATOM 0 HG3 PRO A 167 22.664 8.418 14.445 1.00 0.00 H new ATOM 0 HD2 PRO A 167 21.650 5.590 14.446 1.00 0.00 H new ATOM 0 HD3 PRO A 167 21.911 6.667 13.088 1.00 0.00 H new ATOM 2501 N MET A 168 24.764 4.552 16.381 1.00 0.00 N ATOM 2502 CA MET A 168 25.403 3.496 17.160 1.00 0.00 C ATOM 2503 C MET A 168 24.630 2.188 17.037 1.00 0.00 C ATOM 2504 O MET A 168 23.794 1.910 17.923 1.00 0.00 O ATOM 2505 CB MET A 168 25.505 3.905 18.632 1.00 0.00 C ATOM 2506 CG MET A 168 25.094 5.344 18.899 1.00 0.00 C ATOM 2507 SD MET A 168 25.666 5.945 20.499 1.00 0.00 S ATOM 2508 CE MET A 168 24.477 5.175 21.595 1.00 0.00 C ATOM 2509 OXT MET A 168 24.867 1.451 16.056 1.00 0.00 O ATOM 0 H MET A 168 23.760 4.643 16.539 1.00 0.00 H new ATOM 0 HA MET A 168 26.407 3.345 16.763 1.00 0.00 H new ATOM 0 HB2 MET A 168 24.878 3.241 19.228 1.00 0.00 H new ATOM 0 HB3 MET A 168 26.532 3.762 18.969 1.00 0.00 H new ATOM 0 HG2 MET A 168 25.493 5.984 18.112 1.00 0.00 H new ATOM 0 HG3 MET A 168 24.008 5.422 18.853 1.00 0.00 H new ATOM 0 HE1 MET A 168 24.699 5.453 22.625 1.00 0.00 H new ATOM 0 HE2 MET A 168 23.473 5.512 21.337 1.00 0.00 H new ATOM 0 HE3 MET A 168 24.534 4.092 21.491 1.00 0.00 H new TER 2519 MET A 168