USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 990 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 ASN : amide:sc= 1.29 K(o=1.6,f=-0.37) USER MOD Set 1.2: A 60 GLN : amide:sc= 0.285 K(o=1.6,f=-1.2) USER MOD Set 2.1: A 33 THR OG1 : rot 166:sc= 1.2 USER MOD Set 2.2: A 73 TYR OH : rot 48:sc= 1.05 USER MOD Single : A 1 MET CE :methyl 159:sc= 0 (180deg=-0.412) USER MOD Single : A 1 MET N :NH3+ 140:sc= 0.0704 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 177:sc= 1.23 (180deg=1.14) USER MOD Single : A 5 MET CE :methyl 179:sc= -0.375 (180deg=-0.376) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0328 USER MOD Single : A 13 SER OG : rot 150:sc= 0.465 USER MOD Single : A 15 SER OG : rot 118:sc= 0.432 USER MOD Single : A 16 GLN : amide:sc= 2.14 K(o=2.1,f=-8!) USER MOD Single : A 17 MET CE :methyl -166:sc= -1.01 (180deg=-1.31) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -110:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -77:sc= 0.729 USER MOD Single : A 35 SER OG : rot -115:sc= 0.398 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.548 K(o=-0.55,f=-1.1) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -146:sc= -0.104 (180deg=-2.29!) USER MOD Single : A 58 SER OG : rot 180:sc= 0.282 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.014 USER MOD Single : A 62 SER OG : rot 29:sc= 1.24 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.628 K(o=0.63,f=-6.9!) USER MOD Single : A 78 SER OG : rot 106:sc= 0.764 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.386 X(o=0.39,f=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.633 K(o=0.63,f=-0.47) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.271 K(o=0.27,f=-0.52) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 86:sc= 0.601 USER MOD Single : A 118 GLN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.413 K(o=-0.41,f=-3.1!) USER MOD Single : A 129 LYS NZ :NH3+ -154:sc= 1.28 (180deg=1.2) USER MOD Single : A 131 SER OG : rot 180:sc= -0.0307 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.523 0.331 0.765 1.00 0.00 N ATOM 2 CA MET A 1 1.861 0.520 -0.681 1.00 0.00 C ATOM 3 C MET A 1 2.408 -0.791 -1.283 1.00 0.00 C ATOM 4 O MET A 1 2.977 -1.607 -0.557 1.00 0.00 O ATOM 5 CB MET A 1 2.786 1.752 -0.900 1.00 0.00 C ATOM 6 CG MET A 1 4.296 1.504 -0.720 1.00 0.00 C ATOM 7 SD MET A 1 5.281 2.984 -0.333 1.00 0.00 S ATOM 8 CE MET A 1 5.456 3.730 -1.976 1.00 0.00 C ATOM 0 H1 MET A 1 1.809 1.175 1.302 1.00 0.00 H new ATOM 0 H2 MET A 1 0.498 0.187 0.866 1.00 0.00 H new ATOM 0 H3 MET A 1 2.027 -0.501 1.133 1.00 0.00 H new ATOM 0 HA MET A 1 0.948 0.753 -1.230 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.618 2.133 -1.907 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.482 2.537 -0.208 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.436 0.775 0.078 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.686 1.056 -1.634 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.693 4.789 -1.871 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.259 3.231 -2.519 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.522 3.620 -2.527 1.00 0.00 H new ATOM 18 N LYS A 2 2.243 -1.024 -2.595 1.00 0.00 N ATOM 19 CA LYS A 2 2.639 -2.301 -3.226 1.00 0.00 C ATOM 20 C LYS A 2 4.157 -2.315 -3.337 1.00 0.00 C ATOM 21 O LYS A 2 4.703 -1.352 -3.868 1.00 0.00 O ATOM 22 CB LYS A 2 1.949 -2.539 -4.595 1.00 0.00 C ATOM 23 CG LYS A 2 0.541 -1.922 -4.717 1.00 0.00 C ATOM 24 CD LYS A 2 -0.028 -2.090 -6.134 1.00 0.00 C ATOM 25 CE LYS A 2 -1.160 -1.091 -6.429 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.450 -1.439 -5.768 1.00 0.00 N ATOM 0 H LYS A 2 1.839 -0.347 -3.242 1.00 0.00 H new ATOM 0 HA LYS A 2 2.303 -3.129 -2.602 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.581 -2.129 -5.382 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.878 -3.612 -4.770 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.128 -2.394 -3.997 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.584 -0.862 -4.465 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.771 -1.956 -6.863 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.402 -3.107 -6.255 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.851 -0.098 -6.103 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.316 -1.039 -7.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.167 -0.725 -6.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.767 -2.373 -6.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.317 -1.461 -4.737 1.00 0.00 H new ATOM 40 N LYS A 3 4.854 -3.355 -2.876 1.00 0.00 N ATOM 41 CA LYS A 3 6.295 -3.471 -3.115 1.00 0.00 C ATOM 42 C LYS A 3 6.506 -4.376 -4.307 1.00 0.00 C ATOM 43 O LYS A 3 5.835 -5.402 -4.422 1.00 0.00 O ATOM 44 CB LYS A 3 7.086 -3.962 -1.896 1.00 0.00 C ATOM 45 CG LYS A 3 6.673 -3.321 -0.567 1.00 0.00 C ATOM 46 CD LYS A 3 7.589 -3.825 0.552 1.00 0.00 C ATOM 47 CE LYS A 3 7.145 -3.185 1.870 1.00 0.00 C ATOM 48 NZ LYS A 3 7.957 -3.673 3.016 1.00 0.00 N ATOM 0 H LYS A 3 4.450 -4.123 -2.340 1.00 0.00 H new ATOM 0 HA LYS A 3 6.685 -2.473 -3.316 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.969 -5.043 -1.815 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.145 -3.768 -2.064 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.735 -2.235 -0.640 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.636 -3.566 -0.340 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.538 -4.912 0.623 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.626 -3.568 0.337 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.233 -2.101 1.797 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.093 -3.408 2.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.663 -3.181 3.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.814 -4.696 3.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.963 -3.483 2.834 1.00 0.00 H new ATOM 62 N VAL A 4 7.435 -3.981 -5.160 1.00 0.00 N ATOM 63 CA VAL A 4 7.691 -4.545 -6.466 1.00 0.00 C ATOM 64 C VAL A 4 9.124 -5.069 -6.443 1.00 0.00 C ATOM 65 O VAL A 4 9.987 -4.524 -5.753 1.00 0.00 O ATOM 66 CB VAL A 4 7.514 -3.451 -7.546 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.489 -4.023 -8.966 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.263 -2.566 -7.416 1.00 0.00 C ATOM 0 H VAL A 4 8.067 -3.211 -4.942 1.00 0.00 H new ATOM 0 HA VAL A 4 6.998 -5.352 -6.702 1.00 0.00 H new ATOM 0 HB VAL A 4 8.392 -2.831 -7.368 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.363 -3.212 -9.683 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.427 -4.541 -9.166 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.660 -4.724 -9.061 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.247 -1.838 -8.227 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.370 -3.188 -7.469 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.285 -2.044 -6.460 1.00 0.00 H new ATOM 78 N MET A 5 9.392 -6.080 -7.251 1.00 0.00 N ATOM 79 CA MET A 5 10.729 -6.573 -7.554 1.00 0.00 C ATOM 80 C MET A 5 10.820 -6.805 -9.053 1.00 0.00 C ATOM 81 O MET A 5 9.844 -7.236 -9.662 1.00 0.00 O ATOM 82 CB MET A 5 11.076 -7.875 -6.812 1.00 0.00 C ATOM 83 CG MET A 5 11.126 -7.768 -5.288 1.00 0.00 C ATOM 84 SD MET A 5 12.319 -8.935 -4.584 1.00 0.00 S ATOM 85 CE MET A 5 12.120 -8.539 -2.833 1.00 0.00 C ATOM 0 H MET A 5 8.659 -6.601 -7.733 1.00 0.00 H new ATOM 0 HA MET A 5 11.446 -5.824 -7.218 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.342 -8.634 -7.082 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.044 -8.228 -7.166 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.396 -6.752 -5.002 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.136 -7.963 -4.875 1.00 0.00 H new ATOM 0 HE1 MET A 5 12.772 -9.180 -2.239 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.385 -7.495 -2.664 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.083 -8.703 -2.538 1.00 0.00 H new ATOM 95 N PHE A 6 12.006 -6.580 -9.615 1.00 0.00 N ATOM 96 CA PHE A 6 12.359 -6.907 -10.986 1.00 0.00 C ATOM 97 C PHE A 6 13.713 -7.577 -10.864 1.00 0.00 C ATOM 98 O PHE A 6 14.601 -7.000 -10.240 1.00 0.00 O ATOM 99 CB PHE A 6 12.432 -5.644 -11.863 1.00 0.00 C ATOM 100 CG PHE A 6 11.156 -4.836 -11.969 1.00 0.00 C ATOM 101 CD1 PHE A 6 10.867 -3.850 -11.010 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.281 -5.031 -13.057 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.705 -3.076 -11.134 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.115 -4.255 -13.178 1.00 0.00 C ATOM 105 CZ PHE A 6 8.826 -3.277 -12.213 1.00 0.00 C ATOM 0 H PHE A 6 12.775 -6.147 -9.103 1.00 0.00 H new ATOM 0 HA PHE A 6 11.619 -7.547 -11.468 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.217 -4.997 -11.470 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.736 -5.940 -12.867 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.539 -3.689 -10.180 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.508 -5.780 -13.801 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.483 -2.320 -10.396 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.444 -4.411 -14.010 1.00 0.00 H new ATOM 0 HZ PHE A 6 7.930 -2.680 -12.299 1.00 0.00 H new ATOM 115 N VAL A 7 13.883 -8.785 -11.390 1.00 0.00 N ATOM 116 CA VAL A 7 15.080 -9.561 -11.094 1.00 0.00 C ATOM 117 C VAL A 7 15.428 -10.473 -12.271 1.00 0.00 C ATOM 118 O VAL A 7 14.540 -11.006 -12.933 1.00 0.00 O ATOM 119 CB VAL A 7 14.871 -10.270 -9.725 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.463 -10.864 -9.526 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.921 -11.346 -9.417 1.00 0.00 C ATOM 0 H VAL A 7 13.218 -9.242 -12.014 1.00 0.00 H new ATOM 0 HA VAL A 7 15.963 -8.931 -10.981 1.00 0.00 H new ATOM 0 HB VAL A 7 14.994 -9.454 -9.013 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.404 -11.339 -8.547 1.00 0.00 H new ATOM 0 HG12 VAL A 7 12.720 -10.069 -9.589 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.268 -11.605 -10.301 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.708 -11.795 -8.447 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.890 -12.116 -10.188 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.912 -10.892 -9.398 1.00 0.00 H new ATOM 131 N CYS A 8 16.727 -10.622 -12.525 1.00 0.00 N ATOM 132 CA CYS A 8 17.348 -11.580 -13.435 1.00 0.00 C ATOM 133 C CYS A 8 18.388 -12.365 -12.605 1.00 0.00 C ATOM 134 O CYS A 8 18.488 -12.166 -11.391 1.00 0.00 O ATOM 135 CB CYS A 8 17.955 -10.781 -14.609 1.00 0.00 C ATOM 136 SG CYS A 8 18.529 -11.696 -16.075 1.00 0.00 S ATOM 0 H CYS A 8 17.422 -10.033 -12.066 1.00 0.00 H new ATOM 0 HA CYS A 8 16.654 -12.300 -13.868 1.00 0.00 H new ATOM 0 HB2 CYS A 8 17.209 -10.059 -14.940 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.800 -10.212 -14.221 1.00 0.00 H new ATOM 141 N LYS A 9 19.182 -13.248 -13.223 1.00 0.00 N ATOM 142 CA LYS A 9 20.156 -14.074 -12.491 1.00 0.00 C ATOM 143 C LYS A 9 21.188 -13.210 -11.760 1.00 0.00 C ATOM 144 O LYS A 9 21.505 -13.484 -10.606 1.00 0.00 O ATOM 145 CB LYS A 9 20.795 -15.095 -13.456 1.00 0.00 C ATOM 146 CG LYS A 9 21.658 -16.127 -12.707 1.00 0.00 C ATOM 147 CD LYS A 9 22.138 -17.285 -13.596 1.00 0.00 C ATOM 148 CE LYS A 9 23.102 -16.829 -14.708 1.00 0.00 C ATOM 149 NZ LYS A 9 23.614 -17.974 -15.508 1.00 0.00 N ATOM 0 H LYS A 9 19.171 -13.411 -14.230 1.00 0.00 H new ATOM 0 HA LYS A 9 19.641 -14.635 -11.711 1.00 0.00 H new ATOM 0 HB2 LYS A 9 20.011 -15.611 -14.011 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.409 -14.569 -14.187 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.525 -15.623 -12.281 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.084 -16.533 -11.874 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.635 -18.031 -12.975 1.00 0.00 H new ATOM 0 HD3 LYS A 9 21.274 -17.771 -14.048 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.590 -16.127 -15.366 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.941 -16.294 -14.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 24.259 -17.622 -16.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.126 -18.631 -14.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.816 -18.470 -15.954 1.00 0.00 H new ATOM 163 N ARG A 10 21.688 -12.151 -12.402 1.00 0.00 N ATOM 164 CA ARG A 10 22.624 -11.197 -11.796 1.00 0.00 C ATOM 165 C ARG A 10 22.048 -9.789 -11.892 1.00 0.00 C ATOM 166 O ARG A 10 21.123 -9.541 -12.662 1.00 0.00 O ATOM 167 CB ARG A 10 24.018 -11.343 -12.453 1.00 0.00 C ATOM 168 CG ARG A 10 24.761 -12.547 -11.853 1.00 0.00 C ATOM 169 CD ARG A 10 26.155 -12.760 -12.450 1.00 0.00 C ATOM 170 NE ARG A 10 26.876 -13.780 -11.673 1.00 0.00 N ATOM 171 CZ ARG A 10 28.063 -14.330 -11.944 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.743 -14.006 -13.042 1.00 0.00 N ATOM 173 NH2 ARG A 10 28.543 -15.208 -11.073 1.00 0.00 N ATOM 0 H ARG A 10 21.452 -11.928 -13.369 1.00 0.00 H new ATOM 0 HA ARG A 10 22.760 -11.408 -10.735 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.909 -11.473 -13.530 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.599 -10.434 -12.298 1.00 0.00 H new ATOM 0 HG2 ARG A 10 24.852 -12.408 -10.776 1.00 0.00 H new ATOM 0 HG3 ARG A 10 24.166 -13.447 -12.009 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.072 -13.073 -13.491 1.00 0.00 H new ATOM 0 HD3 ARG A 10 26.711 -11.823 -12.443 1.00 0.00 H new ATOM 0 HE ARG A 10 26.414 -14.107 -10.825 1.00 0.00 H new ATOM 0 HH11 ARG A 10 28.359 -13.325 -13.697 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.648 -14.439 -13.228 1.00 0.00 H new ATOM 0 HH21 ARG A 10 28.009 -15.439 -10.235 1.00 0.00 H new ATOM 0 HH22 ARG A 10 29.446 -15.652 -11.241 1.00 0.00 H new ATOM 187 N ASN A 11 22.600 -8.858 -11.111 1.00 0.00 N ATOM 188 CA ASN A 11 22.134 -7.464 -11.097 1.00 0.00 C ATOM 189 C ASN A 11 22.639 -6.697 -12.322 1.00 0.00 C ATOM 190 O ASN A 11 22.005 -5.737 -12.747 1.00 0.00 O ATOM 191 CB ASN A 11 22.609 -6.752 -9.822 1.00 0.00 C ATOM 192 CG ASN A 11 21.683 -5.619 -9.365 1.00 0.00 C ATOM 193 OD1 ASN A 11 21.283 -5.591 -8.206 1.00 0.00 O ATOM 194 ND2 ASN A 11 21.288 -4.695 -10.223 1.00 0.00 N ATOM 0 H ASN A 11 23.376 -9.043 -10.475 1.00 0.00 H new ATOM 0 HA ASN A 11 21.044 -7.483 -11.120 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.696 -7.484 -9.019 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.606 -6.347 -9.993 1.00 0.00 H new ATOM 0 HD21 ASN A 11 20.650 -3.958 -9.921 1.00 0.00 H new ATOM 0 HD22 ASN A 11 21.621 -4.718 -11.187 1.00 0.00 H new ATOM 201 N SER A 12 23.786 -7.101 -12.875 1.00 0.00 N ATOM 202 CA SER A 12 24.509 -6.354 -13.901 1.00 0.00 C ATOM 203 C SER A 12 23.785 -6.319 -15.252 1.00 0.00 C ATOM 204 O SER A 12 24.037 -5.412 -16.046 1.00 0.00 O ATOM 205 CB SER A 12 25.902 -6.987 -14.060 1.00 0.00 C ATOM 206 OG SER A 12 26.402 -7.441 -12.806 1.00 0.00 O ATOM 0 H SER A 12 24.245 -7.974 -12.615 1.00 0.00 H new ATOM 0 HA SER A 12 24.580 -5.316 -13.576 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.848 -7.822 -14.758 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.590 -6.258 -14.488 1.00 0.00 H new ATOM 0 HG SER A 12 27.288 -7.841 -12.932 1.00 0.00 H new ATOM 212 N SER A 13 22.906 -7.293 -15.521 1.00 0.00 N ATOM 213 CA SER A 13 22.229 -7.455 -16.800 1.00 0.00 C ATOM 214 C SER A 13 20.732 -7.572 -16.537 1.00 0.00 C ATOM 215 O SER A 13 20.329 -8.295 -15.627 1.00 0.00 O ATOM 216 CB SER A 13 22.802 -8.692 -17.508 1.00 0.00 C ATOM 217 OG SER A 13 22.484 -8.688 -18.890 1.00 0.00 O ATOM 0 H SER A 13 22.645 -8.002 -14.836 1.00 0.00 H new ATOM 0 HA SER A 13 22.389 -6.599 -17.455 1.00 0.00 H new ATOM 0 HB2 SER A 13 23.884 -8.717 -17.382 1.00 0.00 H new ATOM 0 HB3 SER A 13 22.406 -9.595 -17.044 1.00 0.00 H new ATOM 0 HG SER A 13 23.191 -9.146 -19.390 1.00 0.00 H new ATOM 223 N ARG A 14 19.913 -6.884 -17.337 1.00 0.00 N ATOM 224 CA ARG A 14 18.449 -6.763 -17.264 1.00 0.00 C ATOM 225 C ARG A 14 17.932 -6.122 -15.981 1.00 0.00 C ATOM 226 O ARG A 14 17.060 -5.265 -16.079 1.00 0.00 O ATOM 227 CB ARG A 14 17.720 -8.085 -17.565 1.00 0.00 C ATOM 228 CG ARG A 14 17.884 -8.594 -18.989 1.00 0.00 C ATOM 229 CD ARG A 14 19.181 -9.371 -19.212 1.00 0.00 C ATOM 230 NE ARG A 14 19.062 -10.078 -20.485 1.00 0.00 N ATOM 231 CZ ARG A 14 20.044 -10.650 -21.196 1.00 0.00 C ATOM 232 NH1 ARG A 14 21.312 -10.562 -20.800 1.00 0.00 N ATOM 233 NH2 ARG A 14 19.745 -11.303 -22.313 1.00 0.00 N ATOM 0 H ARG A 14 20.287 -6.350 -18.121 1.00 0.00 H new ATOM 0 HA ARG A 14 18.204 -6.065 -18.064 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.083 -8.849 -16.877 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.657 -7.952 -17.362 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.038 -9.235 -19.237 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.854 -7.747 -19.675 1.00 0.00 H new ATOM 0 HD2 ARG A 14 20.035 -8.693 -19.229 1.00 0.00 H new ATOM 0 HD3 ARG A 14 19.350 -10.076 -18.398 1.00 0.00 H new ATOM 0 HE ARG A 14 18.123 -10.144 -20.878 1.00 0.00 H new ATOM 0 HH11 ARG A 14 21.546 -10.055 -19.946 1.00 0.00 H new ATOM 0 HH12 ARG A 14 22.050 -11.002 -21.350 1.00 0.00 H new ATOM 0 HH21 ARG A 14 18.775 -11.366 -22.623 1.00 0.00 H new ATOM 0 HH22 ARG A 14 20.485 -11.742 -22.861 1.00 0.00 H new ATOM 247 N SER A 15 18.453 -6.461 -14.805 1.00 0.00 N ATOM 248 CA SER A 15 18.073 -5.870 -13.525 1.00 0.00 C ATOM 249 C SER A 15 18.664 -4.456 -13.359 1.00 0.00 C ATOM 250 O SER A 15 19.198 -4.120 -12.306 1.00 0.00 O ATOM 251 CB SER A 15 18.462 -6.814 -12.379 1.00 0.00 C ATOM 252 OG SER A 15 18.347 -8.181 -12.755 1.00 0.00 O ATOM 0 H SER A 15 19.174 -7.177 -14.714 1.00 0.00 H new ATOM 0 HA SER A 15 16.990 -5.746 -13.498 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.487 -6.607 -12.071 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.824 -6.620 -11.517 1.00 0.00 H new ATOM 0 HG SER A 15 19.228 -8.608 -12.709 1.00 0.00 H new ATOM 258 N GLN A 16 18.655 -3.643 -14.412 1.00 0.00 N ATOM 259 CA GLN A 16 18.957 -2.234 -14.434 1.00 0.00 C ATOM 260 C GLN A 16 17.856 -1.611 -15.296 1.00 0.00 C ATOM 261 O GLN A 16 17.330 -2.286 -16.182 1.00 0.00 O ATOM 262 CB GLN A 16 20.363 -1.991 -14.960 1.00 0.00 C ATOM 263 CG GLN A 16 20.542 -2.168 -16.473 1.00 0.00 C ATOM 264 CD GLN A 16 22.038 -2.253 -16.775 1.00 0.00 C ATOM 265 OE1 GLN A 16 22.830 -1.560 -16.148 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.488 -3.111 -17.665 1.00 0.00 N ATOM 0 H GLN A 16 18.416 -3.991 -15.341 1.00 0.00 H new ATOM 0 HA GLN A 16 18.962 -1.779 -13.444 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.662 -0.978 -14.693 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.046 -2.670 -14.449 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.035 -3.071 -16.812 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.094 -1.331 -17.008 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.834 -3.691 -18.190 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.491 -3.196 -17.830 1.00 0.00 H new ATOM 275 N MET A 17 17.537 -0.335 -15.102 1.00 0.00 N ATOM 276 CA MET A 17 16.497 0.414 -15.810 1.00 0.00 C ATOM 277 C MET A 17 15.064 -0.061 -15.533 1.00 0.00 C ATOM 278 O MET A 17 14.189 0.797 -15.465 1.00 0.00 O ATOM 279 CB MET A 17 16.852 0.523 -17.308 1.00 0.00 C ATOM 280 CG MET A 17 15.879 1.315 -18.190 1.00 0.00 C ATOM 281 SD MET A 17 16.122 3.106 -18.382 1.00 0.00 S ATOM 282 CE MET A 17 15.897 3.780 -16.716 1.00 0.00 C ATOM 0 H MET A 17 18.021 0.237 -14.410 1.00 0.00 H new ATOM 0 HA MET A 17 16.488 1.423 -15.398 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.837 0.981 -17.392 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.934 -0.486 -17.713 1.00 0.00 H new ATOM 0 HG2 MET A 17 15.902 0.871 -19.185 1.00 0.00 H new ATOM 0 HG3 MET A 17 14.875 1.160 -17.794 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.779 4.862 -16.774 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.008 3.342 -16.263 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.769 3.542 -16.107 1.00 0.00 H new ATOM 292 N ALA A 18 14.785 -1.351 -15.313 1.00 0.00 N ATOM 293 CA ALA A 18 13.428 -1.833 -15.039 1.00 0.00 C ATOM 294 C ALA A 18 12.928 -1.253 -13.716 1.00 0.00 C ATOM 295 O ALA A 18 11.889 -0.597 -13.664 1.00 0.00 O ATOM 296 CB ALA A 18 13.403 -3.372 -15.065 1.00 0.00 C ATOM 0 H ALA A 18 15.491 -2.087 -15.320 1.00 0.00 H new ATOM 0 HA ALA A 18 12.744 -1.491 -15.816 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.392 -3.723 -14.861 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.718 -3.724 -16.047 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.082 -3.760 -14.306 1.00 0.00 H new ATOM 302 N GLU A 19 13.747 -1.376 -12.674 1.00 0.00 N ATOM 303 CA GLU A 19 13.526 -0.757 -11.378 1.00 0.00 C ATOM 304 C GLU A 19 13.498 0.762 -11.503 1.00 0.00 C ATOM 305 O GLU A 19 12.692 1.421 -10.849 1.00 0.00 O ATOM 306 CB GLU A 19 14.624 -1.214 -10.398 1.00 0.00 C ATOM 307 CG GLU A 19 16.046 -0.630 -10.574 1.00 0.00 C ATOM 308 CD GLU A 19 16.721 -0.938 -11.915 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.404 -1.946 -12.581 1.00 0.00 O ATOM 310 OE2 GLU A 19 17.591 -0.133 -12.312 1.00 0.00 O ATOM 0 H GLU A 19 14.606 -1.925 -12.714 1.00 0.00 H new ATOM 0 HA GLU A 19 12.557 -1.071 -10.991 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.289 -0.978 -9.388 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.699 -2.299 -10.463 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.994 0.452 -10.453 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.679 -1.010 -9.772 1.00 0.00 H new ATOM 317 N GLY A 20 14.358 1.307 -12.370 1.00 0.00 N ATOM 318 CA GLY A 20 14.511 2.736 -12.568 1.00 0.00 C ATOM 319 C GLY A 20 13.194 3.325 -13.038 1.00 0.00 C ATOM 320 O GLY A 20 12.624 4.185 -12.374 1.00 0.00 O ATOM 0 H GLY A 20 14.975 0.749 -12.961 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.823 3.211 -11.638 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.292 2.931 -13.303 1.00 0.00 H new ATOM 324 N PHE A 21 12.645 2.792 -14.129 1.00 0.00 N ATOM 325 CA PHE A 21 11.359 3.242 -14.634 1.00 0.00 C ATOM 326 C PHE A 21 10.244 2.970 -13.655 1.00 0.00 C ATOM 327 O PHE A 21 9.309 3.761 -13.587 1.00 0.00 O ATOM 328 CB PHE A 21 11.031 2.574 -15.964 1.00 0.00 C ATOM 329 CG PHE A 21 11.528 3.361 -17.141 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.137 4.705 -17.311 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.375 2.735 -18.065 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.585 5.406 -18.446 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.836 3.445 -19.182 1.00 0.00 C ATOM 334 CZ PHE A 21 12.424 4.773 -19.381 1.00 0.00 C ATOM 0 H PHE A 21 13.076 2.047 -14.677 1.00 0.00 H new ATOM 0 HA PHE A 21 11.439 4.319 -14.778 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.472 1.578 -15.985 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.952 2.446 -16.046 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.504 5.189 -16.582 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.672 1.707 -17.917 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.284 6.432 -18.599 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.505 2.973 -19.886 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.753 5.311 -20.257 1.00 0.00 H new ATOM 344 N ALA A 22 10.316 1.887 -12.888 1.00 0.00 N ATOM 345 CA ALA A 22 9.241 1.582 -11.972 1.00 0.00 C ATOM 346 C ALA A 22 9.168 2.615 -10.856 1.00 0.00 C ATOM 347 O ALA A 22 8.067 3.033 -10.510 1.00 0.00 O ATOM 348 CB ALA A 22 9.416 0.165 -11.440 1.00 0.00 C ATOM 0 H ALA A 22 11.091 1.224 -12.886 1.00 0.00 H new ATOM 0 HA ALA A 22 8.288 1.629 -12.499 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.606 -0.067 -10.749 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.397 -0.540 -12.271 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.370 0.087 -10.919 1.00 0.00 H new ATOM 354 N LYS A 23 10.308 3.098 -10.353 1.00 0.00 N ATOM 355 CA LYS A 23 10.293 4.192 -9.383 1.00 0.00 C ATOM 356 C LYS A 23 9.722 5.459 -10.028 1.00 0.00 C ATOM 357 O LYS A 23 8.965 6.168 -9.373 1.00 0.00 O ATOM 358 CB LYS A 23 11.679 4.345 -8.703 1.00 0.00 C ATOM 359 CG LYS A 23 12.304 5.760 -8.627 1.00 0.00 C ATOM 360 CD LYS A 23 13.229 6.149 -9.801 1.00 0.00 C ATOM 361 CE LYS A 23 14.550 5.346 -9.836 1.00 0.00 C ATOM 362 NZ LYS A 23 15.523 5.753 -8.773 1.00 0.00 N ATOM 0 H LYS A 23 11.237 2.755 -10.597 1.00 0.00 H new ATOM 0 HA LYS A 23 9.616 3.966 -8.559 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.595 3.963 -7.686 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.381 3.698 -9.229 1.00 0.00 H new ATOM 0 HG2 LYS A 23 11.497 6.490 -8.567 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.873 5.836 -7.700 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.696 5.997 -10.739 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.461 7.212 -9.734 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.325 4.285 -9.725 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.017 5.472 -10.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.385 5.177 -8.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 15.766 6.757 -8.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 15.095 5.608 -7.836 1.00 0.00 H new ATOM 376 N THR A 24 10.021 5.724 -11.299 1.00 0.00 N ATOM 377 CA THR A 24 9.536 6.892 -12.014 1.00 0.00 C ATOM 378 C THR A 24 8.019 6.850 -12.233 1.00 0.00 C ATOM 379 O THR A 24 7.295 7.766 -11.848 1.00 0.00 O ATOM 380 CB THR A 24 10.378 6.974 -13.288 1.00 0.00 C ATOM 381 OG1 THR A 24 11.671 7.405 -12.922 1.00 0.00 O ATOM 382 CG2 THR A 24 9.788 7.846 -14.379 1.00 0.00 C ATOM 0 H THR A 24 10.617 5.120 -11.865 1.00 0.00 H new ATOM 0 HA THR A 24 9.660 7.812 -11.442 1.00 0.00 H new ATOM 0 HB THR A 24 10.406 5.981 -13.736 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.817 8.317 -13.250 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.451 7.846 -15.244 1.00 0.00 H new ATOM 0 HG22 THR A 24 8.813 7.455 -14.670 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.675 8.865 -14.009 1.00 0.00 H new ATOM 390 N LEU A 25 7.537 5.777 -12.848 1.00 0.00 N ATOM 391 CA LEU A 25 6.159 5.634 -13.310 1.00 0.00 C ATOM 392 C LEU A 25 5.236 5.348 -12.127 1.00 0.00 C ATOM 393 O LEU A 25 4.098 5.809 -12.095 1.00 0.00 O ATOM 394 CB LEU A 25 6.099 4.466 -14.313 1.00 0.00 C ATOM 395 CG LEU A 25 6.882 4.702 -15.616 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.117 3.352 -16.292 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.165 5.670 -16.560 1.00 0.00 C ATOM 0 H LEU A 25 8.110 4.957 -13.046 1.00 0.00 H new ATOM 0 HA LEU A 25 5.832 6.557 -13.789 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.485 3.569 -13.830 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.056 4.270 -14.561 1.00 0.00 H new ATOM 0 HG LEU A 25 7.835 5.170 -15.370 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.672 3.501 -17.219 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.690 2.706 -15.626 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.158 2.885 -16.514 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.759 5.803 -17.465 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.188 5.265 -16.823 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.037 6.633 -16.065 1.00 0.00 H new ATOM 409 N GLY A 26 5.740 4.587 -11.153 1.00 0.00 N ATOM 410 CA GLY A 26 5.027 4.176 -9.958 1.00 0.00 C ATOM 411 C GLY A 26 5.274 5.103 -8.773 1.00 0.00 C ATOM 412 O GLY A 26 4.939 4.716 -7.654 1.00 0.00 O ATOM 0 H GLY A 26 6.695 4.230 -11.184 1.00 0.00 H new ATOM 0 HA2 GLY A 26 3.959 4.144 -10.171 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.329 3.164 -9.690 1.00 0.00 H new ATOM 416 N ALA A 27 5.874 6.280 -8.984 1.00 0.00 N ATOM 417 CA ALA A 27 6.286 7.203 -7.927 1.00 0.00 C ATOM 418 C ALA A 27 5.126 7.471 -6.962 1.00 0.00 C ATOM 419 O ALA A 27 4.053 7.913 -7.376 1.00 0.00 O ATOM 420 CB ALA A 27 6.789 8.515 -8.552 1.00 0.00 C ATOM 0 H ALA A 27 6.091 6.623 -9.920 1.00 0.00 H new ATOM 0 HA ALA A 27 7.098 6.750 -7.357 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.095 9.201 -7.762 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.639 8.306 -9.201 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.989 8.969 -9.137 1.00 0.00 H new ATOM 426 N GLY A 28 5.343 7.179 -5.676 1.00 0.00 N ATOM 427 CA GLY A 28 4.364 7.352 -4.605 1.00 0.00 C ATOM 428 C GLY A 28 3.305 6.243 -4.535 1.00 0.00 C ATOM 429 O GLY A 28 2.660 6.100 -3.495 1.00 0.00 O ATOM 0 H GLY A 28 6.232 6.805 -5.344 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.890 7.397 -3.651 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.862 8.310 -4.738 1.00 0.00 H new ATOM 433 N LYS A 29 3.135 5.428 -5.586 1.00 0.00 N ATOM 434 CA LYS A 29 2.162 4.329 -5.607 1.00 0.00 C ATOM 435 C LYS A 29 2.786 3.045 -5.083 1.00 0.00 C ATOM 436 O LYS A 29 2.130 2.306 -4.353 1.00 0.00 O ATOM 437 CB LYS A 29 1.599 4.081 -7.032 1.00 0.00 C ATOM 438 CG LYS A 29 1.240 5.336 -7.843 1.00 0.00 C ATOM 439 CD LYS A 29 0.508 4.955 -9.143 1.00 0.00 C ATOM 440 CE LYS A 29 0.426 6.155 -10.101 1.00 0.00 C ATOM 441 NZ LYS A 29 -0.528 5.922 -11.222 1.00 0.00 N ATOM 0 H LYS A 29 3.672 5.514 -6.449 1.00 0.00 H new ATOM 0 HA LYS A 29 1.338 4.625 -4.958 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.333 3.506 -7.596 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.707 3.461 -6.946 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.609 5.993 -7.244 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.146 5.893 -8.080 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.030 4.131 -9.630 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.497 4.603 -8.909 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.119 7.041 -9.544 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.416 6.361 -10.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.548 6.758 -11.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.223 5.093 -11.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.480 5.752 -10.838 1.00 0.00 H new ATOM 455 N ILE A 30 4.025 2.757 -5.487 1.00 0.00 N ATOM 456 CA ILE A 30 4.668 1.463 -5.262 1.00 0.00 C ATOM 457 C ILE A 30 6.149 1.633 -4.902 1.00 0.00 C ATOM 458 O ILE A 30 6.791 2.599 -5.319 1.00 0.00 O ATOM 459 CB ILE A 30 4.434 0.544 -6.490 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.983 1.137 -7.805 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.936 0.228 -6.634 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.643 0.369 -9.092 1.00 0.00 C ATOM 0 H ILE A 30 4.615 3.423 -5.985 1.00 0.00 H new ATOM 0 HA ILE A 30 4.213 0.974 -4.401 1.00 0.00 H new ATOM 0 HB ILE A 30 4.991 -0.375 -6.306 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.607 2.155 -7.905 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.068 1.205 -7.723 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.782 -0.418 -7.499 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.583 -0.278 -5.736 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.380 1.156 -6.770 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.082 0.881 -9.948 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.044 -0.642 -9.029 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.561 0.323 -9.213 1.00 0.00 H new ATOM 474 N ALA A 31 6.666 0.693 -4.105 1.00 0.00 N ATOM 475 CA ALA A 31 8.080 0.558 -3.753 1.00 0.00 C ATOM 476 C ALA A 31 8.708 -0.453 -4.703 1.00 0.00 C ATOM 477 O ALA A 31 8.001 -1.279 -5.266 1.00 0.00 O ATOM 478 CB ALA A 31 8.235 0.104 -2.291 1.00 0.00 C ATOM 0 H ALA A 31 6.085 -0.024 -3.670 1.00 0.00 H new ATOM 0 HA ALA A 31 8.583 1.520 -3.848 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.294 0.010 -2.050 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.776 0.840 -1.631 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.745 -0.860 -2.155 1.00 0.00 H new ATOM 484 N VAL A 32 10.021 -0.420 -4.883 1.00 0.00 N ATOM 485 CA VAL A 32 10.739 -1.263 -5.833 1.00 0.00 C ATOM 486 C VAL A 32 12.031 -1.713 -5.151 1.00 0.00 C ATOM 487 O VAL A 32 12.733 -0.896 -4.552 1.00 0.00 O ATOM 488 CB VAL A 32 11.014 -0.449 -7.117 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.567 -1.364 -8.209 1.00 0.00 C ATOM 490 CG2 VAL A 32 9.770 0.261 -7.687 1.00 0.00 C ATOM 0 H VAL A 32 10.632 0.208 -4.361 1.00 0.00 H new ATOM 0 HA VAL A 32 10.163 -2.142 -6.122 1.00 0.00 H new ATOM 0 HB VAL A 32 11.732 0.317 -6.825 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.758 -0.781 -9.110 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.497 -1.818 -7.867 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.841 -2.147 -8.430 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.045 0.811 -8.587 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.009 -0.480 -7.933 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.375 0.955 -6.945 1.00 0.00 H new ATOM 500 N THR A 33 12.355 -2.998 -5.275 1.00 0.00 N ATOM 501 CA THR A 33 13.554 -3.605 -4.742 1.00 0.00 C ATOM 502 C THR A 33 14.029 -4.641 -5.754 1.00 0.00 C ATOM 503 O THR A 33 13.410 -5.691 -5.898 1.00 0.00 O ATOM 504 CB THR A 33 13.218 -4.279 -3.404 1.00 0.00 C ATOM 505 OG1 THR A 33 12.471 -3.420 -2.550 1.00 0.00 O ATOM 506 CG2 THR A 33 14.458 -4.769 -2.653 1.00 0.00 C ATOM 0 H THR A 33 11.761 -3.663 -5.770 1.00 0.00 H new ATOM 0 HA THR A 33 14.335 -2.864 -4.571 1.00 0.00 H new ATOM 0 HB THR A 33 12.613 -5.146 -3.667 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.090 -3.942 -1.813 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.155 -5.236 -1.716 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.990 -5.497 -3.265 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.113 -3.924 -2.442 1.00 0.00 H new ATOM 514 N SER A 34 15.107 -4.365 -6.477 1.00 0.00 N ATOM 515 CA SER A 34 15.740 -5.393 -7.289 1.00 0.00 C ATOM 516 C SER A 34 16.794 -6.089 -6.431 1.00 0.00 C ATOM 517 O SER A 34 17.890 -5.566 -6.230 1.00 0.00 O ATOM 518 CB SER A 34 16.298 -4.782 -8.571 1.00 0.00 C ATOM 519 OG SER A 34 15.204 -4.403 -9.377 1.00 0.00 O ATOM 0 H SER A 34 15.556 -3.450 -6.517 1.00 0.00 H new ATOM 0 HA SER A 34 15.022 -6.146 -7.613 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.922 -3.918 -8.343 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.928 -5.501 -9.095 1.00 0.00 H new ATOM 0 HG SER A 34 14.819 -5.198 -9.801 1.00 0.00 H new ATOM 525 N SER A 35 16.431 -7.257 -5.899 1.00 0.00 N ATOM 526 CA SER A 35 17.278 -8.061 -5.029 1.00 0.00 C ATOM 527 C SER A 35 18.460 -8.636 -5.815 1.00 0.00 C ATOM 528 O SER A 35 19.614 -8.281 -5.565 1.00 0.00 O ATOM 529 CB SER A 35 16.406 -9.132 -4.383 1.00 0.00 C ATOM 530 OG SER A 35 15.601 -9.733 -5.393 1.00 0.00 O ATOM 0 H SER A 35 15.517 -7.677 -6.068 1.00 0.00 H new ATOM 0 HA SER A 35 17.718 -7.455 -4.237 1.00 0.00 H new ATOM 0 HB2 SER A 35 17.028 -9.884 -3.898 1.00 0.00 H new ATOM 0 HB3 SER A 35 15.776 -8.692 -3.610 1.00 0.00 H new ATOM 0 HG SER A 35 14.656 -9.542 -5.215 1.00 0.00 H new ATOM 536 N GLY A 36 18.153 -9.480 -6.806 1.00 0.00 N ATOM 537 CA GLY A 36 19.143 -10.235 -7.542 1.00 0.00 C ATOM 538 C GLY A 36 19.272 -11.597 -6.880 1.00 0.00 C ATOM 539 O GLY A 36 19.294 -11.708 -5.651 1.00 0.00 O ATOM 0 H GLY A 36 17.196 -9.652 -7.114 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.844 -10.343 -8.585 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.101 -9.715 -7.538 1.00 0.00 H new ATOM 543 N LEU A 37 19.323 -12.649 -7.695 1.00 0.00 N ATOM 544 CA LEU A 37 19.654 -13.985 -7.219 1.00 0.00 C ATOM 545 C LEU A 37 21.129 -14.002 -6.801 1.00 0.00 C ATOM 546 O LEU A 37 21.511 -14.684 -5.851 1.00 0.00 O ATOM 547 CB LEU A 37 19.308 -14.993 -8.317 1.00 0.00 C ATOM 548 CG LEU A 37 17.784 -15.206 -8.408 1.00 0.00 C ATOM 549 CD1 LEU A 37 17.383 -15.562 -9.843 1.00 0.00 C ATOM 550 CD2 LEU A 37 17.337 -16.317 -7.445 1.00 0.00 C ATOM 0 H LEU A 37 19.137 -12.597 -8.697 1.00 0.00 H new ATOM 0 HA LEU A 37 19.075 -14.267 -6.340 1.00 0.00 H new ATOM 0 HB2 LEU A 37 19.687 -14.638 -9.275 1.00 0.00 H new ATOM 0 HB3 LEU A 37 19.800 -15.944 -8.112 1.00 0.00 H new ATOM 0 HG LEU A 37 17.289 -14.278 -8.123 1.00 0.00 H new ATOM 0 HD11 LEU A 37 16.304 -15.710 -9.893 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.670 -14.751 -10.513 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.889 -16.479 -10.145 1.00 0.00 H new ATOM 0 HD21 LEU A 37 16.258 -16.454 -7.523 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.840 -17.248 -7.705 1.00 0.00 H new ATOM 0 HD23 LEU A 37 17.595 -16.038 -6.423 1.00 0.00 H new ATOM 562 N GLU A 38 21.923 -13.180 -7.483 1.00 0.00 N ATOM 563 CA GLU A 38 23.287 -12.793 -7.207 1.00 0.00 C ATOM 564 C GLU A 38 23.328 -11.294 -7.469 1.00 0.00 C ATOM 565 O GLU A 38 22.505 -10.789 -8.246 1.00 0.00 O ATOM 566 CB GLU A 38 24.266 -13.493 -8.148 1.00 0.00 C ATOM 567 CG GLU A 38 24.671 -14.854 -7.590 1.00 0.00 C ATOM 568 CD GLU A 38 25.558 -15.666 -8.556 1.00 0.00 C ATOM 569 OE1 GLU A 38 26.474 -15.091 -9.197 1.00 0.00 O ATOM 570 OE2 GLU A 38 25.359 -16.900 -8.670 1.00 0.00 O ATOM 0 H GLU A 38 21.582 -12.726 -8.330 1.00 0.00 H new ATOM 0 HA GLU A 38 23.574 -13.061 -6.190 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.808 -13.618 -9.129 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.152 -12.873 -8.286 1.00 0.00 H new ATOM 0 HG2 GLU A 38 25.205 -14.710 -6.651 1.00 0.00 H new ATOM 0 HG3 GLU A 38 23.773 -15.428 -7.362 1.00 0.00 H new ATOM 577 N SER A 39 24.272 -10.574 -6.861 1.00 0.00 N ATOM 578 CA SER A 39 24.278 -9.133 -6.982 1.00 0.00 C ATOM 579 C SER A 39 25.654 -8.491 -7.090 1.00 0.00 C ATOM 580 O SER A 39 26.684 -9.037 -6.679 1.00 0.00 O ATOM 581 CB SER A 39 23.385 -8.532 -5.894 1.00 0.00 C ATOM 582 OG SER A 39 23.822 -8.887 -4.590 1.00 0.00 O ATOM 0 H SER A 39 25.024 -10.964 -6.293 1.00 0.00 H new ATOM 0 HA SER A 39 23.853 -8.888 -7.955 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.377 -7.446 -5.990 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.360 -8.872 -6.038 1.00 0.00 H new ATOM 0 HG SER A 39 23.227 -8.483 -3.924 1.00 0.00 H new ATOM 588 N SER A 40 25.590 -7.317 -7.711 1.00 0.00 N ATOM 589 CA SER A 40 26.630 -6.449 -8.221 1.00 0.00 C ATOM 590 C SER A 40 25.941 -5.087 -8.424 1.00 0.00 C ATOM 591 O SER A 40 24.728 -4.964 -8.211 1.00 0.00 O ATOM 592 CB SER A 40 27.081 -7.023 -9.577 1.00 0.00 C ATOM 593 OG SER A 40 27.799 -8.241 -9.426 1.00 0.00 O ATOM 0 H SER A 40 24.675 -6.902 -7.889 1.00 0.00 H new ATOM 0 HA SER A 40 27.497 -6.362 -7.566 1.00 0.00 H new ATOM 0 HB2 SER A 40 26.208 -7.192 -10.208 1.00 0.00 H new ATOM 0 HB3 SER A 40 27.708 -6.293 -10.089 1.00 0.00 H new ATOM 0 HG SER A 40 28.066 -8.575 -10.308 1.00 0.00 H new ATOM 599 N ARG A 41 26.669 -4.070 -8.879 1.00 0.00 N ATOM 600 CA ARG A 41 26.055 -2.809 -9.315 1.00 0.00 C ATOM 601 C ARG A 41 25.546 -2.989 -10.751 1.00 0.00 C ATOM 602 O ARG A 41 25.683 -4.052 -11.361 1.00 0.00 O ATOM 603 CB ARG A 41 27.098 -1.674 -9.178 1.00 0.00 C ATOM 604 CG ARG A 41 26.541 -0.326 -8.690 1.00 0.00 C ATOM 605 CD ARG A 41 27.722 0.590 -8.334 1.00 0.00 C ATOM 606 NE ARG A 41 27.300 1.975 -8.057 1.00 0.00 N ATOM 607 CZ ARG A 41 28.092 2.949 -7.590 1.00 0.00 C ATOM 608 NH1 ARG A 41 29.334 2.687 -7.180 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.637 4.195 -7.539 1.00 0.00 N ATOM 0 H ARG A 41 27.686 -4.090 -8.957 1.00 0.00 H new ATOM 0 HA ARG A 41 25.200 -2.536 -8.696 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.876 -1.999 -8.487 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.575 -1.522 -10.146 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.926 0.132 -9.465 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.901 -0.473 -7.820 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.238 0.190 -7.461 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.438 0.589 -9.156 1.00 0.00 H new ATOM 0 HE ARG A 41 26.324 2.211 -8.236 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.694 1.733 -7.219 1.00 0.00 H new ATOM 0 HH12 ARG A 41 29.924 3.440 -6.827 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.690 4.405 -7.854 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.234 4.942 -7.185 1.00 0.00 H new ATOM 623 N VAL A 42 24.945 -1.935 -11.286 1.00 0.00 N ATOM 624 CA VAL A 42 24.447 -1.865 -12.655 1.00 0.00 C ATOM 625 C VAL A 42 25.613 -1.546 -13.609 1.00 0.00 C ATOM 626 O VAL A 42 26.743 -1.320 -13.166 1.00 0.00 O ATOM 627 CB VAL A 42 23.292 -0.849 -12.679 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.288 -1.075 -11.545 1.00 0.00 C ATOM 629 CG2 VAL A 42 23.787 0.604 -12.606 1.00 0.00 C ATOM 0 H VAL A 42 24.785 -1.075 -10.762 1.00 0.00 H new ATOM 0 HA VAL A 42 24.044 -2.815 -13.007 1.00 0.00 H new ATOM 0 HB VAL A 42 22.795 -1.013 -13.635 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.494 -0.331 -11.609 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.858 -2.073 -11.633 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.796 -0.982 -10.585 1.00 0.00 H new ATOM 0 HG21 VAL A 42 22.933 1.281 -12.626 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.346 0.752 -11.682 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.434 0.811 -13.458 1.00 0.00 H new ATOM 639 N HIS A 43 25.350 -1.517 -14.917 1.00 0.00 N ATOM 640 CA HIS A 43 26.381 -1.259 -15.930 1.00 0.00 C ATOM 641 C HIS A 43 26.685 0.254 -16.005 1.00 0.00 C ATOM 642 O HIS A 43 25.746 1.047 -15.942 1.00 0.00 O ATOM 643 CB HIS A 43 25.915 -1.863 -17.268 1.00 0.00 C ATOM 644 CG HIS A 43 26.910 -1.758 -18.395 1.00 0.00 C ATOM 645 ND1 HIS A 43 28.001 -2.567 -18.617 1.00 0.00 N ATOM 646 CD2 HIS A 43 26.880 -0.845 -19.413 1.00 0.00 C ATOM 647 CE1 HIS A 43 28.628 -2.124 -19.721 1.00 0.00 C ATOM 648 NE2 HIS A 43 27.978 -1.070 -20.246 1.00 0.00 N ATOM 0 H HIS A 43 24.419 -1.671 -15.305 1.00 0.00 H new ATOM 0 HA HIS A 43 27.323 -1.739 -15.665 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.676 -2.915 -17.111 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.992 -1.368 -17.571 1.00 0.00 H new ATOM 0 HD2 HIS A 43 26.132 -0.078 -19.550 1.00 0.00 H new ATOM 0 HE1 HIS A 43 29.530 -2.555 -20.130 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.234 -0.543 -21.081 1.00 0.00 H new ATOM 656 N PRO A 44 27.943 0.707 -16.176 1.00 0.00 N ATOM 657 CA PRO A 44 28.296 2.129 -16.121 1.00 0.00 C ATOM 658 C PRO A 44 27.587 2.977 -17.178 1.00 0.00 C ATOM 659 O PRO A 44 26.956 3.976 -16.831 1.00 0.00 O ATOM 660 CB PRO A 44 29.821 2.195 -16.278 1.00 0.00 C ATOM 661 CG PRO A 44 30.190 0.847 -16.898 1.00 0.00 C ATOM 662 CD PRO A 44 29.160 -0.089 -16.279 1.00 0.00 C ATOM 0 HA PRO A 44 27.966 2.554 -15.173 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.120 3.024 -16.919 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.315 2.341 -15.317 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.119 0.867 -17.986 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.209 0.551 -16.650 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.004 -0.971 -16.900 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.485 -0.442 -15.300 1.00 0.00 H new ATOM 670 N THR A 45 27.620 2.577 -18.453 1.00 0.00 N ATOM 671 CA THR A 45 26.997 3.353 -19.528 1.00 0.00 C ATOM 672 C THR A 45 25.473 3.388 -19.362 1.00 0.00 C ATOM 673 O THR A 45 24.831 4.333 -19.820 1.00 0.00 O ATOM 674 CB THR A 45 27.464 2.800 -20.884 1.00 0.00 C ATOM 675 OG1 THR A 45 28.882 2.701 -20.885 1.00 0.00 O ATOM 676 CG2 THR A 45 27.003 3.634 -22.087 1.00 0.00 C ATOM 0 H THR A 45 28.073 1.718 -18.766 1.00 0.00 H new ATOM 0 HA THR A 45 27.315 4.394 -19.480 1.00 0.00 H new ATOM 0 HB THR A 45 27.001 1.820 -20.999 1.00 0.00 H new ATOM 0 HG1 THR A 45 29.185 2.347 -21.747 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.372 3.180 -23.007 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.914 3.668 -22.110 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.396 4.647 -21.999 1.00 0.00 H new ATOM 684 N ALA A 46 24.882 2.432 -18.625 1.00 0.00 N ATOM 685 CA ALA A 46 23.457 2.459 -18.323 1.00 0.00 C ATOM 686 C ALA A 46 23.123 3.734 -17.590 1.00 0.00 C ATOM 687 O ALA A 46 22.168 4.395 -17.947 1.00 0.00 O ATOM 688 CB ALA A 46 23.048 1.270 -17.443 1.00 0.00 C ATOM 0 H ALA A 46 25.378 1.633 -18.231 1.00 0.00 H new ATOM 0 HA ALA A 46 22.914 2.401 -19.267 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.979 1.321 -17.237 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.273 0.339 -17.962 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.601 1.305 -16.504 1.00 0.00 H new ATOM 694 N ILE A 47 23.926 4.113 -16.604 1.00 0.00 N ATOM 695 CA ILE A 47 23.624 5.249 -15.744 1.00 0.00 C ATOM 696 C ILE A 47 23.533 6.503 -16.618 1.00 0.00 C ATOM 697 O ILE A 47 22.590 7.272 -16.474 1.00 0.00 O ATOM 698 CB ILE A 47 24.728 5.360 -14.667 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.806 4.084 -13.796 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.520 6.607 -13.787 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.124 3.952 -13.020 1.00 0.00 C ATOM 0 H ILE A 47 24.803 3.643 -16.379 1.00 0.00 H new ATOM 0 HA ILE A 47 22.671 5.126 -15.230 1.00 0.00 H new ATOM 0 HB ILE A 47 25.679 5.464 -15.189 1.00 0.00 H new ATOM 0 HG12 ILE A 47 23.976 4.085 -13.089 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.680 3.210 -14.434 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.310 6.660 -13.038 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.550 7.501 -14.410 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.552 6.544 -13.289 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.109 3.035 -12.431 1.00 0.00 H new ATOM 0 HD12 ILE A 47 26.958 3.919 -13.722 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.242 4.808 -12.356 1.00 0.00 H new ATOM 713 N ALA A 48 24.463 6.677 -17.560 1.00 0.00 N ATOM 714 CA ALA A 48 24.486 7.832 -18.446 1.00 0.00 C ATOM 715 C ALA A 48 23.251 7.845 -19.360 1.00 0.00 C ATOM 716 O ALA A 48 22.590 8.869 -19.526 1.00 0.00 O ATOM 717 CB ALA A 48 25.786 7.823 -19.261 1.00 0.00 C ATOM 0 H ALA A 48 25.222 6.016 -17.726 1.00 0.00 H new ATOM 0 HA ALA A 48 24.454 8.744 -17.849 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.805 8.687 -19.925 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.640 7.866 -18.585 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.838 6.909 -19.853 1.00 0.00 H new ATOM 723 N MET A 49 22.910 6.687 -19.926 1.00 0.00 N ATOM 724 CA MET A 49 21.767 6.520 -20.821 1.00 0.00 C ATOM 725 C MET A 49 20.447 6.739 -20.066 1.00 0.00 C ATOM 726 O MET A 49 19.492 7.366 -20.533 1.00 0.00 O ATOM 727 CB MET A 49 21.876 5.115 -21.433 1.00 0.00 C ATOM 728 CG MET A 49 23.066 5.047 -22.404 1.00 0.00 C ATOM 729 SD MET A 49 22.873 6.043 -23.907 1.00 0.00 S ATOM 730 CE MET A 49 24.221 7.216 -23.607 1.00 0.00 C ATOM 0 H MET A 49 23.431 5.824 -19.772 1.00 0.00 H new ATOM 0 HA MET A 49 21.774 7.263 -21.618 1.00 0.00 H new ATOM 0 HB2 MET A 49 22.000 4.375 -20.642 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.954 4.867 -21.959 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.964 5.374 -21.880 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.225 4.007 -22.691 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.274 7.928 -24.431 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.037 7.752 -22.676 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.164 6.675 -23.534 1.00 0.00 H new ATOM 740 N MET A 50 20.394 6.252 -18.842 1.00 0.00 N ATOM 741 CA MET A 50 19.197 6.278 -18.042 1.00 0.00 C ATOM 742 C MET A 50 19.046 7.714 -17.543 1.00 0.00 C ATOM 743 O MET A 50 17.931 8.221 -17.473 1.00 0.00 O ATOM 744 CB MET A 50 19.263 5.183 -16.970 1.00 0.00 C ATOM 745 CG MET A 50 19.334 3.730 -17.529 1.00 0.00 C ATOM 746 SD MET A 50 19.367 3.448 -19.341 1.00 0.00 S ATOM 747 CE MET A 50 19.478 1.643 -19.512 1.00 0.00 C ATOM 0 H MET A 50 21.193 5.823 -18.374 1.00 0.00 H new ATOM 0 HA MET A 50 18.288 6.034 -18.593 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.137 5.360 -16.342 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.386 5.269 -16.328 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.227 3.265 -17.112 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.477 3.187 -17.131 1.00 0.00 H new ATOM 0 HE1 MET A 50 20.076 1.397 -20.389 1.00 0.00 H new ATOM 0 HE2 MET A 50 19.947 1.221 -18.623 1.00 0.00 H new ATOM 0 HE3 MET A 50 18.477 1.226 -19.627 1.00 0.00 H new ATOM 757 N GLU A 51 20.153 8.432 -17.357 1.00 0.00 N ATOM 758 CA GLU A 51 20.158 9.853 -17.102 1.00 0.00 C ATOM 759 C GLU A 51 19.744 10.625 -18.362 1.00 0.00 C ATOM 760 O GLU A 51 19.249 11.744 -18.224 1.00 0.00 O ATOM 761 CB GLU A 51 21.520 10.274 -16.531 1.00 0.00 C ATOM 762 CG GLU A 51 21.578 11.749 -16.111 1.00 0.00 C ATOM 763 CD GLU A 51 22.897 12.059 -15.383 1.00 0.00 C ATOM 764 OE1 GLU A 51 23.926 12.306 -16.058 1.00 0.00 O ATOM 765 OE2 GLU A 51 22.912 12.074 -14.126 1.00 0.00 O ATOM 0 H GLU A 51 21.087 8.023 -17.382 1.00 0.00 H new ATOM 0 HA GLU A 51 19.415 10.104 -16.345 1.00 0.00 H new ATOM 0 HB2 GLU A 51 21.752 9.649 -15.668 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.292 10.086 -17.277 1.00 0.00 H new ATOM 0 HG2 GLU A 51 21.485 12.386 -16.991 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.735 11.980 -15.460 1.00 0.00 H new ATOM 772 N GLU A 52 19.837 10.046 -19.572 1.00 0.00 N ATOM 773 CA GLU A 52 19.231 10.687 -20.742 1.00 0.00 C ATOM 774 C GLU A 52 17.716 10.724 -20.553 1.00 0.00 C ATOM 775 O GLU A 52 17.085 11.727 -20.897 1.00 0.00 O ATOM 776 CB GLU A 52 19.512 10.038 -22.113 1.00 0.00 C ATOM 777 CG GLU A 52 20.973 9.927 -22.535 1.00 0.00 C ATOM 778 CD GLU A 52 21.136 9.468 -24.001 1.00 0.00 C ATOM 779 OE1 GLU A 52 20.470 8.495 -24.445 1.00 0.00 O ATOM 780 OE2 GLU A 52 21.952 10.082 -24.726 1.00 0.00 O ATOM 0 H GLU A 52 20.311 9.163 -19.759 1.00 0.00 H new ATOM 0 HA GLU A 52 19.699 11.671 -20.782 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.083 9.036 -22.109 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.981 10.609 -22.874 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.459 10.894 -22.405 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.484 9.222 -21.879 1.00 0.00 H new ATOM 787 N VAL A 53 17.136 9.660 -19.974 1.00 0.00 N ATOM 788 CA VAL A 53 15.713 9.686 -19.583 1.00 0.00 C ATOM 789 C VAL A 53 15.500 10.317 -18.186 1.00 0.00 C ATOM 790 O VAL A 53 14.383 10.336 -17.666 1.00 0.00 O ATOM 791 CB VAL A 53 15.017 8.334 -19.876 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.352 7.215 -18.885 1.00 0.00 C ATOM 793 CG2 VAL A 53 13.492 8.465 -20.001 1.00 0.00 C ATOM 0 H VAL A 53 17.618 8.785 -19.768 1.00 0.00 H new ATOM 0 HA VAL A 53 15.172 10.379 -20.227 1.00 0.00 H new ATOM 0 HB VAL A 53 15.432 8.043 -20.841 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.820 6.307 -19.169 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.425 7.026 -18.898 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.049 7.515 -17.882 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.058 7.486 -20.206 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.083 8.855 -19.069 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.251 9.147 -20.816 1.00 0.00 H new ATOM 803 N GLY A 54 16.549 10.899 -17.591 1.00 0.00 N ATOM 804 CA GLY A 54 16.486 11.616 -16.323 1.00 0.00 C ATOM 805 C GLY A 54 16.367 10.694 -15.104 1.00 0.00 C ATOM 806 O GLY A 54 15.986 11.164 -14.029 1.00 0.00 O ATOM 0 H GLY A 54 17.486 10.880 -17.993 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.380 12.231 -16.218 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.633 12.294 -16.340 1.00 0.00 H new ATOM 810 N ILE A 55 16.669 9.401 -15.253 1.00 0.00 N ATOM 811 CA ILE A 55 16.543 8.394 -14.199 1.00 0.00 C ATOM 812 C ILE A 55 17.943 7.979 -13.739 1.00 0.00 C ATOM 813 O ILE A 55 18.814 7.730 -14.569 1.00 0.00 O ATOM 814 CB ILE A 55 15.697 7.209 -14.696 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.269 7.672 -15.063 1.00 0.00 C ATOM 816 CG2 ILE A 55 15.630 6.058 -13.670 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.325 6.537 -15.474 1.00 0.00 C ATOM 0 H ILE A 55 17.016 9.018 -16.132 1.00 0.00 H new ATOM 0 HA ILE A 55 16.019 8.804 -13.336 1.00 0.00 H new ATOM 0 HB ILE A 55 16.193 6.824 -15.587 1.00 0.00 H new ATOM 0 HG12 ILE A 55 13.839 8.196 -14.209 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.331 8.391 -15.880 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.021 5.248 -14.071 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.636 5.690 -13.469 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.185 6.422 -12.744 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.345 6.948 -15.715 1.00 0.00 H new ATOM 0 HD12 ILE A 55 13.729 6.026 -16.348 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.229 5.828 -14.652 1.00 0.00 H new ATOM 829 N ASP A 56 18.140 7.835 -12.424 1.00 0.00 N ATOM 830 CA ASP A 56 19.355 7.235 -11.875 1.00 0.00 C ATOM 831 C ASP A 56 19.084 5.795 -11.444 1.00 0.00 C ATOM 832 O ASP A 56 17.996 5.467 -10.970 1.00 0.00 O ATOM 833 CB ASP A 56 19.948 8.057 -10.726 1.00 0.00 C ATOM 834 CG ASP A 56 21.219 7.366 -10.192 1.00 0.00 C ATOM 835 OD1 ASP A 56 22.040 6.915 -11.027 1.00 0.00 O ATOM 836 OD2 ASP A 56 21.358 7.215 -8.956 1.00 0.00 O ATOM 0 H ASP A 56 17.466 8.129 -11.717 1.00 0.00 H new ATOM 0 HA ASP A 56 20.104 7.230 -12.667 1.00 0.00 H new ATOM 0 HB2 ASP A 56 20.188 9.063 -11.072 1.00 0.00 H new ATOM 0 HB3 ASP A 56 19.216 8.161 -9.925 1.00 0.00 H new ATOM 841 N ILE A 57 20.097 4.948 -11.614 1.00 0.00 N ATOM 842 CA ILE A 57 20.141 3.527 -11.262 1.00 0.00 C ATOM 843 C ILE A 57 21.496 3.147 -10.633 1.00 0.00 C ATOM 844 O ILE A 57 21.589 2.087 -10.027 1.00 0.00 O ATOM 845 CB ILE A 57 19.845 2.660 -12.508 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.721 3.080 -13.707 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.355 2.722 -12.887 1.00 0.00 C ATOM 848 CD1 ILE A 57 20.838 1.992 -14.769 1.00 0.00 C ATOM 0 H ILE A 57 20.974 5.258 -12.032 1.00 0.00 H new ATOM 0 HA ILE A 57 19.371 3.336 -10.515 1.00 0.00 H new ATOM 0 HB ILE A 57 20.092 1.630 -12.251 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.301 3.978 -14.160 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.717 3.339 -13.349 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.177 2.103 -13.766 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.753 2.354 -12.056 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.078 3.753 -13.107 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.466 2.347 -15.586 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.285 1.101 -14.329 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.847 1.750 -15.152 1.00 0.00 H new ATOM 860 N SER A 58 22.537 3.981 -10.749 1.00 0.00 N ATOM 861 CA SER A 58 23.829 3.845 -10.065 1.00 0.00 C ATOM 862 C SER A 58 23.706 3.363 -8.615 1.00 0.00 C ATOM 863 O SER A 58 24.470 2.495 -8.196 1.00 0.00 O ATOM 864 CB SER A 58 24.531 5.214 -10.084 1.00 0.00 C ATOM 865 OG SER A 58 25.880 5.104 -9.661 1.00 0.00 O ATOM 0 H SER A 58 22.500 4.805 -11.349 1.00 0.00 H new ATOM 0 HA SER A 58 24.402 3.085 -10.597 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.496 5.630 -11.091 1.00 0.00 H new ATOM 0 HB3 SER A 58 23.998 5.908 -9.434 1.00 0.00 H new ATOM 0 HG SER A 58 26.303 5.988 -9.684 1.00 0.00 H new ATOM 871 N GLY A 59 22.747 3.903 -7.862 1.00 0.00 N ATOM 872 CA GLY A 59 22.573 3.624 -6.439 1.00 0.00 C ATOM 873 C GLY A 59 21.935 2.265 -6.135 1.00 0.00 C ATOM 874 O GLY A 59 21.616 2.009 -4.972 1.00 0.00 O ATOM 0 H GLY A 59 22.058 4.558 -8.232 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.546 3.673 -5.950 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.956 4.408 -6.000 1.00 0.00 H new ATOM 878 N GLN A 60 21.704 1.401 -7.133 1.00 0.00 N ATOM 879 CA GLN A 60 21.075 0.113 -6.929 1.00 0.00 C ATOM 880 C GLN A 60 22.001 -0.806 -6.143 1.00 0.00 C ATOM 881 O GLN A 60 23.156 -1.014 -6.522 1.00 0.00 O ATOM 882 CB GLN A 60 20.790 -0.612 -8.255 1.00 0.00 C ATOM 883 CG GLN A 60 19.307 -0.813 -8.567 1.00 0.00 C ATOM 884 CD GLN A 60 19.206 -2.013 -9.501 1.00 0.00 C ATOM 885 OE1 GLN A 60 19.179 -3.157 -9.067 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.256 -1.805 -10.797 1.00 0.00 N ATOM 0 H GLN A 60 21.954 1.588 -8.104 1.00 0.00 H new ATOM 0 HA GLN A 60 20.144 0.314 -6.400 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.245 -0.046 -9.068 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.278 -1.586 -8.233 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.741 -0.988 -7.652 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.888 0.077 -9.036 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.279 -0.852 -11.160 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.272 -2.596 -11.440 1.00 0.00 H new ATOM 895 N THR A 61 21.447 -1.402 -5.103 1.00 0.00 N ATOM 896 CA THR A 61 22.015 -2.501 -4.366 1.00 0.00 C ATOM 897 C THR A 61 20.897 -3.031 -3.468 1.00 0.00 C ATOM 898 O THR A 61 19.878 -2.362 -3.253 1.00 0.00 O ATOM 899 CB THR A 61 23.311 -2.141 -3.623 1.00 0.00 C ATOM 900 OG1 THR A 61 23.789 -3.224 -2.843 1.00 0.00 O ATOM 901 CG2 THR A 61 23.221 -0.880 -2.761 1.00 0.00 C ATOM 0 H THR A 61 20.541 -1.112 -4.735 1.00 0.00 H new ATOM 0 HA THR A 61 22.356 -3.286 -5.041 1.00 0.00 H new ATOM 0 HB THR A 61 24.024 -1.921 -4.418 1.00 0.00 H new ATOM 0 HG1 THR A 61 24.615 -2.959 -2.387 1.00 0.00 H new ATOM 0 HG21 THR A 61 24.180 -0.703 -2.274 1.00 0.00 H new ATOM 0 HG22 THR A 61 22.970 -0.026 -3.390 1.00 0.00 H new ATOM 0 HG23 THR A 61 22.449 -1.012 -2.003 1.00 0.00 H new ATOM 909 N SER A 62 21.067 -4.254 -2.995 1.00 0.00 N ATOM 910 CA SER A 62 20.158 -5.008 -2.154 1.00 0.00 C ATOM 911 C SER A 62 20.885 -6.294 -1.762 1.00 0.00 C ATOM 912 O SER A 62 21.865 -6.708 -2.398 1.00 0.00 O ATOM 913 CB SER A 62 18.877 -5.380 -2.922 1.00 0.00 C ATOM 914 OG SER A 62 17.986 -4.284 -3.043 1.00 0.00 O ATOM 0 H SER A 62 21.911 -4.785 -3.207 1.00 0.00 H new ATOM 0 HA SER A 62 19.873 -4.414 -1.286 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.143 -5.741 -3.916 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.374 -6.200 -2.410 1.00 0.00 H new ATOM 0 HG SER A 62 18.496 -3.447 -3.052 1.00 0.00 H new ATOM 920 N ASP A 63 20.387 -6.925 -0.704 1.00 0.00 N ATOM 921 CA ASP A 63 20.786 -8.272 -0.315 1.00 0.00 C ATOM 922 C ASP A 63 20.326 -9.262 -1.404 1.00 0.00 C ATOM 923 O ASP A 63 19.427 -8.928 -2.191 1.00 0.00 O ATOM 924 CB ASP A 63 20.125 -8.605 1.026 1.00 0.00 C ATOM 925 CG ASP A 63 21.039 -8.281 2.219 1.00 0.00 C ATOM 926 OD1 ASP A 63 22.013 -9.033 2.462 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.793 -7.265 2.914 1.00 0.00 O ATOM 0 H ASP A 63 19.688 -6.511 -0.087 1.00 0.00 H new ATOM 0 HA ASP A 63 21.869 -8.342 -0.210 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.195 -8.044 1.120 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.863 -9.663 1.048 1.00 0.00 H new ATOM 932 N PRO A 64 20.889 -10.485 -1.466 1.00 0.00 N ATOM 933 CA PRO A 64 20.382 -11.513 -2.366 1.00 0.00 C ATOM 934 C PRO A 64 18.918 -11.814 -2.037 1.00 0.00 C ATOM 935 O PRO A 64 18.501 -11.732 -0.879 1.00 0.00 O ATOM 936 CB PRO A 64 21.278 -12.738 -2.144 1.00 0.00 C ATOM 937 CG PRO A 64 21.765 -12.559 -0.704 1.00 0.00 C ATOM 938 CD PRO A 64 21.906 -11.042 -0.586 1.00 0.00 C ATOM 0 HA PRO A 64 20.408 -11.203 -3.411 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.725 -13.669 -2.269 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.108 -12.763 -2.850 1.00 0.00 H new ATOM 0 HG2 PRO A 64 21.052 -12.957 0.018 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.713 -13.069 -0.530 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.757 -10.713 0.443 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.903 -10.717 -0.884 1.00 0.00 H new ATOM 946 N ILE A 65 18.138 -12.224 -3.040 1.00 0.00 N ATOM 947 CA ILE A 65 16.696 -12.441 -2.904 1.00 0.00 C ATOM 948 C ILE A 65 16.365 -13.455 -1.805 1.00 0.00 C ATOM 949 O ILE A 65 15.298 -13.397 -1.200 1.00 0.00 O ATOM 950 CB ILE A 65 16.129 -12.856 -4.275 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.597 -12.714 -4.317 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.563 -14.270 -4.692 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.017 -12.800 -5.737 1.00 0.00 C ATOM 0 H ILE A 65 18.492 -12.416 -3.977 1.00 0.00 H new ATOM 0 HA ILE A 65 16.221 -11.512 -2.589 1.00 0.00 H new ATOM 0 HB ILE A 65 16.555 -12.167 -5.005 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.150 -13.495 -3.702 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.315 -11.759 -3.874 1.00 0.00 H new ATOM 0 HG21 ILE A 65 16.135 -14.510 -5.665 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.650 -14.314 -4.753 1.00 0.00 H new ATOM 0 HG23 ILE A 65 16.212 -14.991 -3.954 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.933 -12.692 -5.694 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.437 -12.003 -6.350 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.269 -13.766 -6.175 1.00 0.00 H new ATOM 965 N GLU A 66 17.293 -14.369 -1.511 1.00 0.00 N ATOM 966 CA GLU A 66 17.084 -15.435 -0.539 1.00 0.00 C ATOM 967 C GLU A 66 16.916 -14.851 0.869 1.00 0.00 C ATOM 968 O GLU A 66 16.271 -15.444 1.735 1.00 0.00 O ATOM 969 CB GLU A 66 18.285 -16.396 -0.523 1.00 0.00 C ATOM 970 CG GLU A 66 18.866 -16.689 -1.911 1.00 0.00 C ATOM 971 CD GLU A 66 19.945 -17.786 -1.848 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.128 -17.461 -1.581 1.00 0.00 O ATOM 973 OE2 GLU A 66 19.621 -18.978 -2.066 1.00 0.00 O ATOM 0 H GLU A 66 18.215 -14.387 -1.946 1.00 0.00 H new ATOM 0 HA GLU A 66 16.182 -15.975 -0.829 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.068 -15.972 0.106 1.00 0.00 H new ATOM 0 HB3 GLU A 66 17.980 -17.335 -0.062 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.067 -17.001 -2.583 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.295 -15.778 -2.327 1.00 0.00 H new ATOM 980 N ASN A 67 17.527 -13.681 1.084 1.00 0.00 N ATOM 981 CA ASN A 67 17.488 -12.922 2.328 1.00 0.00 C ATOM 982 C ASN A 67 16.070 -12.419 2.643 1.00 0.00 C ATOM 983 O ASN A 67 15.715 -12.246 3.813 1.00 0.00 O ATOM 984 CB ASN A 67 18.430 -11.719 2.199 1.00 0.00 C ATOM 985 CG ASN A 67 18.788 -11.121 3.553 1.00 0.00 C ATOM 986 OD1 ASN A 67 18.081 -10.272 4.093 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.908 -11.547 4.121 1.00 0.00 N ATOM 0 H ASN A 67 18.084 -13.222 0.363 1.00 0.00 H new ATOM 0 HA ASN A 67 17.800 -13.578 3.141 1.00 0.00 H new ATOM 0 HB2 ASN A 67 19.342 -12.027 1.687 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.959 -10.956 1.580 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.198 -11.170 5.023 1.00 0.00 H new ATOM 0 HD22 ASN A 67 20.480 -12.252 3.656 1.00 0.00 H new ATOM 994 N PHE A 68 15.277 -12.164 1.601 1.00 0.00 N ATOM 995 CA PHE A 68 13.953 -11.566 1.686 1.00 0.00 C ATOM 996 C PHE A 68 12.867 -12.629 1.879 1.00 0.00 C ATOM 997 O PHE A 68 13.138 -13.835 1.870 1.00 0.00 O ATOM 998 CB PHE A 68 13.684 -10.766 0.405 1.00 0.00 C ATOM 999 CG PHE A 68 14.460 -9.481 0.293 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.749 -9.465 -0.268 1.00 0.00 C ATOM 1001 CD2 PHE A 68 13.871 -8.295 0.757 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.441 -8.247 -0.381 1.00 0.00 C ATOM 1003 CE2 PHE A 68 14.564 -7.078 0.643 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.851 -7.054 0.072 1.00 0.00 C ATOM 0 H PHE A 68 15.553 -12.378 0.643 1.00 0.00 H new ATOM 0 HA PHE A 68 13.924 -10.907 2.553 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.919 -11.393 -0.455 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.619 -10.538 0.352 1.00 0.00 H new ATOM 0 HD1 PHE A 68 16.204 -10.383 -0.610 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.887 -8.318 1.201 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.429 -8.227 -0.817 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.110 -6.162 0.993 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.385 -6.119 -0.018 1.00 0.00 H new ATOM 1014 N ASN A 69 11.620 -12.163 2.041 1.00 0.00 N ATOM 1015 CA ASN A 69 10.430 -12.985 2.013 1.00 0.00 C ATOM 1016 C ASN A 69 9.487 -12.377 0.995 1.00 0.00 C ATOM 1017 O ASN A 69 9.193 -11.177 1.073 1.00 0.00 O ATOM 1018 CB ASN A 69 9.734 -13.037 3.371 1.00 0.00 C ATOM 1019 CG ASN A 69 8.651 -14.110 3.480 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.094 -14.575 2.493 1.00 0.00 O ATOM 1021 ND2 ASN A 69 8.292 -14.492 4.696 1.00 0.00 N ATOM 0 H ASN A 69 11.420 -11.175 2.199 1.00 0.00 H new ATOM 0 HA ASN A 69 10.709 -14.006 1.754 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.482 -13.213 4.144 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.287 -12.064 3.575 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.547 -15.178 4.816 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.761 -14.100 5.513 1.00 0.00 H new ATOM 1028 N ALA A 70 8.984 -13.179 0.071 1.00 0.00 N ATOM 1029 CA ALA A 70 8.130 -12.669 -0.965 1.00 0.00 C ATOM 1030 C ALA A 70 6.769 -12.329 -0.392 1.00 0.00 C ATOM 1031 O ALA A 70 6.049 -11.528 -0.982 1.00 0.00 O ATOM 1032 CB ALA A 70 7.992 -13.674 -2.103 1.00 0.00 C ATOM 0 H ALA A 70 9.158 -14.183 0.025 1.00 0.00 H new ATOM 0 HA ALA A 70 8.582 -11.763 -1.370 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.340 -13.263 -2.874 1.00 0.00 H new ATOM 0 HB2 ALA A 70 8.974 -13.878 -2.529 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.563 -14.600 -1.721 1.00 0.00 H new ATOM 1038 N ASP A 71 6.430 -12.922 0.755 1.00 0.00 N ATOM 1039 CA ASP A 71 5.160 -12.692 1.396 1.00 0.00 C ATOM 1040 C ASP A 71 5.020 -11.236 1.867 1.00 0.00 C ATOM 1041 O ASP A 71 3.903 -10.722 1.975 1.00 0.00 O ATOM 1042 CB ASP A 71 4.975 -13.646 2.578 1.00 0.00 C ATOM 1043 CG ASP A 71 3.597 -13.459 3.237 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.572 -13.833 2.618 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.537 -12.990 4.400 1.00 0.00 O ATOM 0 H ASP A 71 7.037 -13.572 1.255 1.00 0.00 H new ATOM 0 HA ASP A 71 4.381 -12.883 0.658 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.081 -14.676 2.237 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.759 -13.472 3.315 1.00 0.00 H new ATOM 1050 N ASP A 72 6.146 -10.554 2.132 1.00 0.00 N ATOM 1051 CA ASP A 72 6.151 -9.144 2.504 1.00 0.00 C ATOM 1052 C ASP A 72 5.879 -8.242 1.292 1.00 0.00 C ATOM 1053 O ASP A 72 5.337 -7.141 1.425 1.00 0.00 O ATOM 1054 CB ASP A 72 7.501 -8.771 3.115 1.00 0.00 C ATOM 1055 CG ASP A 72 7.472 -7.324 3.638 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.779 -7.060 4.651 1.00 0.00 O ATOM 1057 OD2 ASP A 72 8.162 -6.446 3.071 1.00 0.00 O ATOM 0 H ASP A 72 7.076 -10.972 2.092 1.00 0.00 H new ATOM 0 HA ASP A 72 5.356 -8.991 3.234 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.740 -9.454 3.930 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.288 -8.879 2.368 1.00 0.00 H new ATOM 1062 N TYR A 73 6.257 -8.725 0.109 1.00 0.00 N ATOM 1063 CA TYR A 73 6.114 -8.051 -1.167 1.00 0.00 C ATOM 1064 C TYR A 73 4.715 -8.285 -1.746 1.00 0.00 C ATOM 1065 O TYR A 73 3.978 -9.175 -1.313 1.00 0.00 O ATOM 1066 CB TYR A 73 7.256 -8.467 -2.115 1.00 0.00 C ATOM 1067 CG TYR A 73 8.529 -7.696 -1.822 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.217 -7.916 -0.613 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.950 -6.667 -2.686 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.260 -7.060 -0.225 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.006 -5.815 -2.312 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.647 -5.992 -1.062 1.00 0.00 C ATOM 1073 OH TYR A 73 11.622 -5.144 -0.639 1.00 0.00 O ATOM 0 H TYR A 73 6.692 -9.643 0.017 1.00 0.00 H new ATOM 0 HA TYR A 73 6.203 -6.973 -1.030 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.445 -9.536 -2.012 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.954 -8.294 -3.148 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.941 -8.747 0.019 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.461 -6.531 -3.639 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.767 -7.219 0.715 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.327 -5.027 -2.978 1.00 0.00 H new ATOM 0 HH TYR A 73 12.384 -5.662 -0.306 1.00 0.00 H new ATOM 1083 N ASP A 74 4.341 -7.458 -2.728 1.00 0.00 N ATOM 1084 CA ASP A 74 3.049 -7.566 -3.408 1.00 0.00 C ATOM 1085 C ASP A 74 3.231 -8.097 -4.826 1.00 0.00 C ATOM 1086 O ASP A 74 2.422 -8.905 -5.285 1.00 0.00 O ATOM 1087 CB ASP A 74 2.348 -6.210 -3.423 1.00 0.00 C ATOM 1088 CG ASP A 74 0.968 -6.315 -4.098 1.00 0.00 C ATOM 1089 OD1 ASP A 74 -0.017 -6.624 -3.384 1.00 0.00 O ATOM 1090 OD2 ASP A 74 0.858 -6.036 -5.313 1.00 0.00 O ATOM 0 H ASP A 74 4.926 -6.696 -3.072 1.00 0.00 H new ATOM 0 HA ASP A 74 2.425 -8.272 -2.861 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.232 -5.844 -2.403 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.963 -5.483 -3.954 1.00 0.00 H new ATOM 1095 N VAL A 75 4.312 -7.696 -5.504 1.00 0.00 N ATOM 1096 CA VAL A 75 4.505 -7.968 -6.918 1.00 0.00 C ATOM 1097 C VAL A 75 5.976 -8.266 -7.205 1.00 0.00 C ATOM 1098 O VAL A 75 6.881 -7.627 -6.669 1.00 0.00 O ATOM 1099 CB VAL A 75 3.906 -6.797 -7.734 1.00 0.00 C ATOM 1100 CG1 VAL A 75 3.988 -5.388 -7.119 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.431 -6.776 -9.177 1.00 0.00 C ATOM 0 H VAL A 75 5.076 -7.172 -5.078 1.00 0.00 H new ATOM 0 HA VAL A 75 3.973 -8.867 -7.228 1.00 0.00 H new ATOM 0 HB VAL A 75 2.842 -7.032 -7.716 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.531 -4.668 -7.797 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.459 -5.376 -6.166 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.033 -5.122 -6.957 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.985 -5.939 -9.714 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.515 -6.666 -9.168 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.165 -7.709 -9.674 1.00 0.00 H new ATOM 1111 N VAL A 76 6.224 -9.250 -8.064 1.00 0.00 N ATOM 1112 CA VAL A 76 7.555 -9.730 -8.385 1.00 0.00 C ATOM 1113 C VAL A 76 7.563 -10.027 -9.882 1.00 0.00 C ATOM 1114 O VAL A 76 6.577 -10.531 -10.420 1.00 0.00 O ATOM 1115 CB VAL A 76 7.856 -10.977 -7.533 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.217 -11.589 -7.897 1.00 0.00 C ATOM 1117 CG2 VAL A 76 7.846 -10.694 -6.015 1.00 0.00 C ATOM 0 H VAL A 76 5.485 -9.744 -8.565 1.00 0.00 H new ATOM 0 HA VAL A 76 8.332 -8.999 -8.161 1.00 0.00 H new ATOM 0 HB VAL A 76 7.051 -11.676 -7.760 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.398 -12.467 -7.277 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.216 -11.880 -8.947 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.004 -10.855 -7.725 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.065 -11.613 -5.472 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.602 -9.945 -5.780 1.00 0.00 H new ATOM 0 HG23 VAL A 76 6.864 -10.324 -5.720 1.00 0.00 H new ATOM 1127 N ILE A 77 8.665 -9.702 -10.553 1.00 0.00 N ATOM 1128 CA ILE A 77 8.802 -9.794 -11.994 1.00 0.00 C ATOM 1129 C ILE A 77 10.125 -10.491 -12.261 1.00 0.00 C ATOM 1130 O ILE A 77 11.175 -9.977 -11.859 1.00 0.00 O ATOM 1131 CB ILE A 77 8.793 -8.369 -12.591 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.531 -7.558 -12.212 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.008 -8.386 -14.116 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.214 -8.137 -12.737 1.00 0.00 C ATOM 0 H ILE A 77 9.507 -9.359 -10.092 1.00 0.00 H new ATOM 0 HA ILE A 77 7.985 -10.352 -12.451 1.00 0.00 H new ATOM 0 HB ILE A 77 9.639 -7.852 -12.138 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.474 -7.488 -11.126 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.642 -6.542 -12.591 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.995 -7.365 -14.497 1.00 0.00 H new ATOM 0 HG22 ILE A 77 9.970 -8.845 -14.343 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.211 -8.960 -14.589 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.386 -7.502 -12.422 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.244 -8.180 -13.826 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.073 -9.141 -12.338 1.00 0.00 H new ATOM 1146 N SER A 78 10.089 -11.619 -12.961 1.00 0.00 N ATOM 1147 CA SER A 78 11.302 -12.234 -13.461 1.00 0.00 C ATOM 1148 C SER A 78 11.532 -11.672 -14.865 1.00 0.00 C ATOM 1149 O SER A 78 10.739 -11.874 -15.784 1.00 0.00 O ATOM 1150 CB SER A 78 11.202 -13.761 -13.420 1.00 0.00 C ATOM 1151 OG SER A 78 11.080 -14.218 -12.077 1.00 0.00 O ATOM 0 H SER A 78 9.232 -12.122 -13.192 1.00 0.00 H new ATOM 0 HA SER A 78 12.163 -11.998 -12.836 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.341 -14.090 -14.002 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.086 -14.202 -13.881 1.00 0.00 H new ATOM 0 HG SER A 78 10.157 -14.501 -11.910 1.00 0.00 H new ATOM 1157 N LEU A 79 12.626 -10.928 -15.023 1.00 0.00 N ATOM 1158 CA LEU A 79 12.995 -10.259 -16.274 1.00 0.00 C ATOM 1159 C LEU A 79 13.583 -11.241 -17.288 1.00 0.00 C ATOM 1160 O LEU A 79 13.775 -10.862 -18.446 1.00 0.00 O ATOM 1161 CB LEU A 79 14.041 -9.169 -15.966 1.00 0.00 C ATOM 1162 CG LEU A 79 13.531 -7.980 -15.133 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.756 -7.215 -14.631 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.668 -7.033 -15.974 1.00 0.00 C ATOM 0 H LEU A 79 13.296 -10.769 -14.270 1.00 0.00 H new ATOM 0 HA LEU A 79 12.094 -9.824 -16.707 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.876 -9.630 -15.437 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.432 -8.788 -16.909 1.00 0.00 H new ATOM 0 HG LEU A 79 12.918 -8.352 -14.312 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.433 -6.362 -14.034 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.371 -7.874 -14.018 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.339 -6.863 -15.482 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.325 -6.205 -15.353 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.258 -6.644 -16.804 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.806 -7.575 -16.364 1.00 0.00 H new ATOM 1176 N CYS A 80 13.943 -12.449 -16.842 1.00 0.00 N ATOM 1177 CA CYS A 80 14.705 -13.429 -17.596 1.00 0.00 C ATOM 1178 C CYS A 80 14.134 -14.818 -17.302 1.00 0.00 C ATOM 1179 O CYS A 80 14.581 -15.487 -16.369 1.00 0.00 O ATOM 1180 CB CYS A 80 16.180 -13.327 -17.159 1.00 0.00 C ATOM 1181 SG CYS A 80 16.948 -11.698 -17.365 1.00 0.00 S ATOM 0 H CYS A 80 13.698 -12.776 -15.908 1.00 0.00 H new ATOM 0 HA CYS A 80 14.641 -13.249 -18.669 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.250 -13.611 -16.109 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.759 -14.056 -17.726 1.00 0.00 H new ATOM 1186 N GLY A 81 13.136 -15.244 -18.078 1.00 0.00 N ATOM 1187 CA GLY A 81 12.440 -16.506 -17.857 1.00 0.00 C ATOM 1188 C GLY A 81 11.709 -16.488 -16.515 1.00 0.00 C ATOM 1189 O GLY A 81 11.380 -15.419 -15.995 1.00 0.00 O ATOM 0 H GLY A 81 12.789 -14.719 -18.880 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.728 -16.681 -18.663 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.153 -17.330 -17.878 1.00 0.00 H new ATOM 1193 N SER A 82 11.465 -17.670 -15.950 1.00 0.00 N ATOM 1194 CA SER A 82 10.787 -17.851 -14.670 1.00 0.00 C ATOM 1195 C SER A 82 11.297 -19.134 -14.008 1.00 0.00 C ATOM 1196 O SER A 82 11.685 -20.086 -14.694 1.00 0.00 O ATOM 1197 CB SER A 82 9.260 -17.871 -14.875 1.00 0.00 C ATOM 1198 OG SER A 82 8.867 -18.635 -16.014 1.00 0.00 O ATOM 0 H SER A 82 11.742 -18.551 -16.383 1.00 0.00 H new ATOM 0 HA SER A 82 11.009 -17.016 -14.006 1.00 0.00 H new ATOM 0 HB2 SER A 82 8.783 -18.282 -13.985 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.899 -16.849 -14.986 1.00 0.00 H new ATOM 0 HG SER A 82 7.891 -18.618 -16.099 1.00 0.00 H new ATOM 1204 N GLY A 83 11.328 -19.151 -12.668 1.00 0.00 N ATOM 1205 CA GLY A 83 11.803 -20.309 -11.906 1.00 0.00 C ATOM 1206 C GLY A 83 13.277 -20.621 -12.186 1.00 0.00 C ATOM 1207 O GLY A 83 13.677 -21.783 -12.122 1.00 0.00 O ATOM 0 H GLY A 83 11.027 -18.368 -12.088 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.669 -20.121 -10.841 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.196 -21.179 -12.154 1.00 0.00 H new ATOM 1211 N VAL A 84 14.078 -19.601 -12.531 1.00 0.00 N ATOM 1212 CA VAL A 84 15.447 -19.749 -13.031 1.00 0.00 C ATOM 1213 C VAL A 84 16.427 -19.988 -11.867 1.00 0.00 C ATOM 1214 O VAL A 84 17.260 -19.141 -11.548 1.00 0.00 O ATOM 1215 CB VAL A 84 15.806 -18.588 -13.994 1.00 0.00 C ATOM 1216 CG1 VAL A 84 15.051 -18.735 -15.326 1.00 0.00 C ATOM 1217 CG2 VAL A 84 15.523 -17.175 -13.442 1.00 0.00 C ATOM 0 H VAL A 84 13.781 -18.627 -12.467 1.00 0.00 H new ATOM 0 HA VAL A 84 15.533 -20.645 -13.645 1.00 0.00 H new ATOM 0 HB VAL A 84 16.884 -18.673 -14.128 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.317 -17.911 -15.988 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.323 -19.680 -15.796 1.00 0.00 H new ATOM 0 HG13 VAL A 84 13.977 -18.719 -15.139 1.00 0.00 H new ATOM 0 HG21 VAL A 84 15.806 -16.430 -14.186 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.461 -17.078 -13.217 1.00 0.00 H new ATOM 0 HG23 VAL A 84 16.102 -17.017 -12.532 1.00 0.00 H new ATOM 1227 N ASN A 85 16.297 -21.157 -11.221 1.00 0.00 N ATOM 1228 CA ASN A 85 17.016 -21.564 -10.008 1.00 0.00 C ATOM 1229 C ASN A 85 16.723 -20.538 -8.912 1.00 0.00 C ATOM 1230 O ASN A 85 17.612 -19.880 -8.372 1.00 0.00 O ATOM 1231 CB ASN A 85 18.509 -21.829 -10.287 1.00 0.00 C ATOM 1232 CG ASN A 85 19.171 -22.602 -9.146 1.00 0.00 C ATOM 1233 OD1 ASN A 85 19.402 -23.804 -9.254 1.00 0.00 O ATOM 1234 ND2 ASN A 85 19.488 -21.953 -8.037 1.00 0.00 N ATOM 0 H ASN A 85 15.655 -21.879 -11.548 1.00 0.00 H new ATOM 0 HA ASN A 85 16.659 -22.529 -9.646 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.611 -22.392 -11.215 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.026 -20.880 -10.431 1.00 0.00 H new ATOM 0 HD21 ASN A 85 19.928 -22.451 -7.263 1.00 0.00 H new ATOM 0 HD22 ASN A 85 19.292 -20.955 -7.956 1.00 0.00 H new ATOM 1241 N LEU A 86 15.425 -20.362 -8.656 1.00 0.00 N ATOM 1242 CA LEU A 86 14.845 -19.307 -7.837 1.00 0.00 C ATOM 1243 C LEU A 86 13.660 -19.898 -7.049 1.00 0.00 C ATOM 1244 O LEU A 86 12.947 -20.731 -7.616 1.00 0.00 O ATOM 1245 CB LEU A 86 14.471 -18.169 -8.815 1.00 0.00 C ATOM 1246 CG LEU A 86 13.382 -17.187 -8.346 1.00 0.00 C ATOM 1247 CD1 LEU A 86 13.606 -15.788 -8.927 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.022 -17.666 -8.870 1.00 0.00 C ATOM 0 H LEU A 86 14.716 -20.988 -9.037 1.00 0.00 H new ATOM 0 HA LEU A 86 15.519 -18.897 -7.085 1.00 0.00 H new ATOM 0 HB2 LEU A 86 15.373 -17.598 -9.034 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.143 -18.619 -9.752 1.00 0.00 H new ATOM 0 HG LEU A 86 13.417 -17.148 -7.257 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.820 -15.119 -8.577 1.00 0.00 H new ATOM 0 HD12 LEU A 86 14.576 -15.410 -8.603 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.582 -15.838 -10.016 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.243 -16.977 -8.543 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.043 -17.700 -9.959 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.812 -18.662 -8.480 1.00 0.00 H new ATOM 1260 N PRO A 87 13.428 -19.508 -5.777 1.00 0.00 N ATOM 1261 CA PRO A 87 12.352 -20.096 -4.976 1.00 0.00 C ATOM 1262 C PRO A 87 10.943 -19.744 -5.487 1.00 0.00 C ATOM 1263 O PRO A 87 10.730 -18.624 -5.956 1.00 0.00 O ATOM 1264 CB PRO A 87 12.577 -19.631 -3.530 1.00 0.00 C ATOM 1265 CG PRO A 87 14.059 -19.262 -3.496 1.00 0.00 C ATOM 1266 CD PRO A 87 14.327 -18.751 -4.909 1.00 0.00 C ATOM 0 HA PRO A 87 12.392 -21.183 -5.049 1.00 0.00 H new ATOM 0 HB2 PRO A 87 11.946 -18.778 -3.281 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.344 -20.420 -2.815 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.266 -18.498 -2.746 1.00 0.00 H new ATOM 0 HG3 PRO A 87 14.682 -20.123 -3.255 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.134 -17.681 -4.982 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.368 -18.907 -5.191 1.00 0.00 H new ATOM 1274 N PRO A 88 9.949 -20.643 -5.362 1.00 0.00 N ATOM 1275 CA PRO A 88 8.636 -20.452 -5.972 1.00 0.00 C ATOM 1276 C PRO A 88 7.790 -19.384 -5.287 1.00 0.00 C ATOM 1277 O PRO A 88 6.898 -18.844 -5.934 1.00 0.00 O ATOM 1278 CB PRO A 88 7.968 -21.831 -5.943 1.00 0.00 C ATOM 1279 CG PRO A 88 8.609 -22.504 -4.732 1.00 0.00 C ATOM 1280 CD PRO A 88 10.040 -21.968 -4.762 1.00 0.00 C ATOM 0 HA PRO A 88 8.741 -20.073 -6.989 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.886 -21.752 -5.834 1.00 0.00 H new ATOM 0 HB3 PRO A 88 8.156 -22.389 -6.860 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.098 -22.241 -3.806 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.583 -23.591 -4.813 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.460 -21.916 -3.758 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.690 -22.619 -5.346 1.00 0.00 H new ATOM 1288 N GLU A 89 8.090 -18.990 -4.046 1.00 0.00 N ATOM 1289 CA GLU A 89 7.388 -17.878 -3.397 1.00 0.00 C ATOM 1290 C GLU A 89 7.497 -16.590 -4.230 1.00 0.00 C ATOM 1291 O GLU A 89 6.617 -15.731 -4.164 1.00 0.00 O ATOM 1292 CB GLU A 89 7.899 -17.690 -1.957 1.00 0.00 C ATOM 1293 CG GLU A 89 9.335 -17.154 -1.860 1.00 0.00 C ATOM 1294 CD GLU A 89 9.818 -17.098 -0.401 1.00 0.00 C ATOM 1295 OE1 GLU A 89 10.311 -18.131 0.115 1.00 0.00 O ATOM 1296 OE2 GLU A 89 9.708 -16.019 0.231 1.00 0.00 O ATOM 0 H GLU A 89 8.813 -19.423 -3.471 1.00 0.00 H new ATOM 0 HA GLU A 89 6.327 -18.120 -3.338 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.232 -17.005 -1.434 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.845 -18.647 -1.437 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.002 -17.791 -2.441 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.383 -16.157 -2.299 1.00 0.00 H new ATOM 1303 N TRP A 90 8.541 -16.476 -5.061 1.00 0.00 N ATOM 1304 CA TRP A 90 8.766 -15.338 -5.933 1.00 0.00 C ATOM 1305 C TRP A 90 7.952 -15.427 -7.221 1.00 0.00 C ATOM 1306 O TRP A 90 7.520 -14.395 -7.733 1.00 0.00 O ATOM 1307 CB TRP A 90 10.273 -15.227 -6.184 1.00 0.00 C ATOM 1308 CG TRP A 90 11.050 -14.989 -4.927 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.799 -15.897 -4.267 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.059 -13.799 -4.091 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.225 -15.369 -3.064 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.756 -14.085 -2.883 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.513 -12.510 -4.230 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.868 -13.145 -1.847 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.600 -11.568 -3.196 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.270 -11.883 -2.003 1.00 0.00 C ATOM 0 H TRP A 90 9.263 -17.193 -5.140 1.00 0.00 H new ATOM 0 HA TRP A 90 8.416 -14.425 -5.451 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.627 -16.143 -6.658 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.462 -14.413 -6.883 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.031 -16.889 -4.626 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.812 -15.866 -2.394 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.017 -12.241 -5.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.406 -13.388 -0.943 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.149 -10.594 -3.318 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.326 -11.156 -1.206 1.00 0.00 H new ATOM 1327 N VAL A 91 7.682 -16.634 -7.729 1.00 0.00 N ATOM 1328 CA VAL A 91 6.880 -16.831 -8.927 1.00 0.00 C ATOM 1329 C VAL A 91 5.375 -16.758 -8.637 1.00 0.00 C ATOM 1330 O VAL A 91 4.573 -16.803 -9.571 1.00 0.00 O ATOM 1331 CB VAL A 91 7.302 -18.084 -9.727 1.00 0.00 C ATOM 1332 CG1 VAL A 91 8.827 -18.222 -9.842 1.00 0.00 C ATOM 1333 CG2 VAL A 91 6.711 -19.420 -9.253 1.00 0.00 C ATOM 0 H VAL A 91 8.019 -17.503 -7.313 1.00 0.00 H new ATOM 0 HA VAL A 91 7.090 -15.991 -9.589 1.00 0.00 H new ATOM 0 HB VAL A 91 6.865 -17.890 -10.707 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.069 -19.118 -10.413 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.234 -17.347 -10.349 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.262 -18.298 -8.845 1.00 0.00 H new ATOM 0 HG21 VAL A 91 7.077 -20.226 -9.889 1.00 0.00 H new ATOM 0 HG22 VAL A 91 7.012 -19.606 -8.222 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.623 -19.378 -9.311 1.00 0.00 H new ATOM 1343 N THR A 92 4.970 -16.665 -7.363 1.00 0.00 N ATOM 1344 CA THR A 92 3.560 -16.691 -6.989 1.00 0.00 C ATOM 1345 C THR A 92 3.236 -15.631 -5.917 1.00 0.00 C ATOM 1346 O THR A 92 3.105 -15.908 -4.723 1.00 0.00 O ATOM 1347 CB THR A 92 3.176 -18.160 -6.681 1.00 0.00 C ATOM 1348 OG1 THR A 92 1.770 -18.346 -6.688 1.00 0.00 O ATOM 1349 CG2 THR A 92 3.747 -18.722 -5.368 1.00 0.00 C ATOM 0 H THR A 92 5.609 -16.571 -6.573 1.00 0.00 H new ATOM 0 HA THR A 92 2.909 -16.380 -7.806 1.00 0.00 H new ATOM 0 HB THR A 92 3.640 -18.723 -7.491 1.00 0.00 H new ATOM 0 HG1 THR A 92 1.563 -19.284 -6.492 1.00 0.00 H new ATOM 0 HG21 THR A 92 3.422 -19.755 -5.243 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.836 -18.685 -5.400 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.388 -18.125 -4.530 1.00 0.00 H new ATOM 1357 N GLN A 93 3.136 -14.378 -6.369 1.00 0.00 N ATOM 1358 CA GLN A 93 2.614 -13.251 -5.605 1.00 0.00 C ATOM 1359 C GLN A 93 1.314 -12.779 -6.277 1.00 0.00 C ATOM 1360 O GLN A 93 0.806 -13.469 -7.167 1.00 0.00 O ATOM 1361 CB GLN A 93 3.700 -12.171 -5.404 1.00 0.00 C ATOM 1362 CG GLN A 93 4.818 -12.660 -4.467 1.00 0.00 C ATOM 1363 CD GLN A 93 4.285 -13.122 -3.100 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.377 -12.525 -2.523 1.00 0.00 O ATOM 1365 NE2 GLN A 93 4.801 -14.222 -2.570 1.00 0.00 N ATOM 0 H GLN A 93 3.428 -14.115 -7.311 1.00 0.00 H new ATOM 0 HA GLN A 93 2.350 -13.537 -4.587 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.127 -11.899 -6.369 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.246 -11.270 -4.991 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.351 -13.484 -4.942 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.540 -11.857 -4.319 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.554 -14.715 -3.050 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.445 -14.575 -1.682 1.00 0.00 H new ATOM 1374 N GLU A 94 0.739 -11.645 -5.851 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.584 -11.198 -6.314 1.00 0.00 C ATOM 1376 C GLU A 94 -0.607 -11.018 -7.841 1.00 0.00 C ATOM 1377 O GLU A 94 -1.647 -11.185 -8.481 1.00 0.00 O ATOM 1378 CB GLU A 94 -1.007 -9.906 -5.596 1.00 0.00 C ATOM 1379 CG GLU A 94 -1.222 -10.081 -4.083 1.00 0.00 C ATOM 1380 CD GLU A 94 -2.344 -11.088 -3.758 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.540 -10.728 -3.886 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -2.040 -12.241 -3.371 1.00 0.00 O ATOM 0 H GLU A 94 1.175 -11.014 -5.179 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.307 -11.974 -6.063 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.245 -9.144 -5.760 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.929 -9.537 -6.045 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.292 -10.417 -3.624 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.465 -9.115 -3.640 1.00 0.00 H new ATOM 1389 N ILE A 95 0.553 -10.710 -8.418 1.00 0.00 N ATOM 1390 CA ILE A 95 0.843 -10.720 -9.837 1.00 0.00 C ATOM 1391 C ILE A 95 2.267 -11.266 -9.939 1.00 0.00 C ATOM 1392 O ILE A 95 3.119 -10.983 -9.084 1.00 0.00 O ATOM 1393 CB ILE A 95 0.659 -9.321 -10.480 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.215 -9.269 -11.927 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.311 -8.240 -9.606 1.00 0.00 C ATOM 1396 CD1 ILE A 95 0.692 -8.084 -12.757 1.00 0.00 C ATOM 0 H ILE A 95 1.363 -10.430 -7.865 1.00 0.00 H new ATOM 0 HA ILE A 95 0.150 -11.344 -10.401 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.412 -9.126 -10.540 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.303 -9.218 -11.885 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.959 -10.198 -12.437 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.173 -7.264 -10.071 1.00 0.00 H new ATOM 0 HG22 ILE A 95 0.847 -8.241 -8.620 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.376 -8.447 -9.506 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.127 -8.119 -13.756 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.394 -8.144 -12.832 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.971 -7.149 -12.272 1.00 0.00 H new ATOM 1408 N PHE A 96 2.516 -12.047 -10.980 1.00 0.00 N ATOM 1409 CA PHE A 96 3.836 -12.483 -11.383 1.00 0.00 C ATOM 1410 C PHE A 96 3.904 -12.270 -12.897 1.00 0.00 C ATOM 1411 O PHE A 96 2.884 -12.437 -13.577 1.00 0.00 O ATOM 1412 CB PHE A 96 4.087 -13.939 -10.994 1.00 0.00 C ATOM 1413 CG PHE A 96 5.438 -14.432 -11.468 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.615 -13.868 -10.937 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.523 -15.408 -12.479 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.870 -14.284 -11.411 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.779 -15.827 -12.947 1.00 0.00 C ATOM 1418 CZ PHE A 96 7.952 -15.268 -12.412 1.00 0.00 C ATOM 0 H PHE A 96 1.776 -12.404 -11.585 1.00 0.00 H new ATOM 0 HA PHE A 96 4.616 -11.914 -10.877 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.025 -14.040 -9.910 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.304 -14.567 -11.418 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.552 -13.115 -10.165 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.622 -15.835 -12.895 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.772 -13.848 -11.007 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.843 -16.580 -13.719 1.00 0.00 H new ATOM 0 HZ PHE A 96 8.917 -15.594 -12.770 1.00 0.00 H new ATOM 1428 N GLU A 97 5.071 -11.912 -13.427 1.00 0.00 N ATOM 1429 CA GLU A 97 5.306 -11.851 -14.863 1.00 0.00 C ATOM 1430 C GLU A 97 6.663 -12.480 -15.142 1.00 0.00 C ATOM 1431 O GLU A 97 7.602 -12.322 -14.352 1.00 0.00 O ATOM 1432 CB GLU A 97 5.292 -10.414 -15.415 1.00 0.00 C ATOM 1433 CG GLU A 97 3.967 -9.651 -15.262 1.00 0.00 C ATOM 1434 CD GLU A 97 2.850 -10.100 -16.233 1.00 0.00 C ATOM 1435 OE1 GLU A 97 2.915 -11.189 -16.855 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.871 -9.327 -16.385 1.00 0.00 O ATOM 0 H GLU A 97 5.884 -11.655 -12.867 1.00 0.00 H new ATOM 0 HA GLU A 97 4.498 -12.387 -15.361 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.076 -9.846 -14.915 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.549 -10.449 -16.474 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.610 -9.770 -14.239 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.155 -8.588 -15.412 1.00 0.00 H new ATOM 1443 N ASP A 98 6.757 -13.149 -16.290 1.00 0.00 N ATOM 1444 CA ASP A 98 7.997 -13.644 -16.861 1.00 0.00 C ATOM 1445 C ASP A 98 8.212 -12.905 -18.179 1.00 0.00 C ATOM 1446 O ASP A 98 7.268 -12.735 -18.961 1.00 0.00 O ATOM 1447 CB ASP A 98 7.985 -15.166 -17.048 1.00 0.00 C ATOM 1448 CG ASP A 98 7.448 -15.624 -18.417 1.00 0.00 C ATOM 1449 OD1 ASP A 98 6.223 -15.877 -18.537 1.00 0.00 O ATOM 1450 OD2 ASP A 98 8.259 -15.800 -19.359 1.00 0.00 O ATOM 0 H ASP A 98 5.942 -13.366 -16.863 1.00 0.00 H new ATOM 0 HA ASP A 98 8.826 -13.451 -16.180 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.999 -15.545 -16.921 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.377 -15.614 -16.262 1.00 0.00 H new ATOM 1455 N TRP A 99 9.443 -12.455 -18.418 1.00 0.00 N ATOM 1456 CA TRP A 99 9.841 -11.750 -19.625 1.00 0.00 C ATOM 1457 C TRP A 99 11.219 -12.262 -20.065 1.00 0.00 C ATOM 1458 O TRP A 99 11.829 -13.096 -19.392 1.00 0.00 O ATOM 1459 CB TRP A 99 9.908 -10.233 -19.365 1.00 0.00 C ATOM 1460 CG TRP A 99 8.762 -9.512 -18.710 1.00 0.00 C ATOM 1461 CD1 TRP A 99 8.869 -8.761 -17.592 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.374 -9.353 -19.149 1.00 0.00 C ATOM 1463 NE1 TRP A 99 7.671 -8.130 -17.323 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.717 -8.446 -18.261 1.00 0.00 C ATOM 1465 CE3 TRP A 99 6.606 -9.851 -20.224 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.386 -8.040 -18.437 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 5.256 -9.480 -20.392 1.00 0.00 C ATOM 1468 CH2 TRP A 99 4.648 -8.571 -19.508 1.00 0.00 C ATOM 0 H TRP A 99 10.209 -12.577 -17.756 1.00 0.00 H new ATOM 0 HA TRP A 99 9.106 -11.933 -20.409 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.792 -10.052 -18.753 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.082 -9.751 -20.327 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.764 -8.668 -16.994 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.514 -7.509 -16.530 1.00 0.00 H new ATOM 0 HE3 TRP A 99 7.061 -10.529 -20.931 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.935 -7.330 -17.759 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 4.684 -9.898 -21.207 1.00 0.00 H new ATOM 0 HH2 TRP A 99 3.617 -8.282 -19.652 1.00 0.00 H new ATOM 1479 N GLN A 100 11.730 -11.737 -21.179 1.00 0.00 N ATOM 1480 CA GLN A 100 13.104 -11.941 -21.616 1.00 0.00 C ATOM 1481 C GLN A 100 13.590 -10.582 -22.131 1.00 0.00 C ATOM 1482 O GLN A 100 13.581 -10.323 -23.335 1.00 0.00 O ATOM 1483 CB GLN A 100 13.146 -13.083 -22.651 1.00 0.00 C ATOM 1484 CG GLN A 100 14.580 -13.499 -23.013 1.00 0.00 C ATOM 1485 CD GLN A 100 14.593 -14.610 -24.068 1.00 0.00 C ATOM 1486 OE1 GLN A 100 14.800 -14.361 -25.255 1.00 0.00 O ATOM 1487 NE2 GLN A 100 14.360 -15.855 -23.672 1.00 0.00 N ATOM 0 H GLN A 100 11.188 -11.148 -21.811 1.00 0.00 H new ATOM 0 HA GLN A 100 13.777 -12.263 -20.821 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.610 -13.946 -22.256 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.624 -12.769 -23.555 1.00 0.00 H new ATOM 0 HG2 GLN A 100 15.127 -12.634 -23.387 1.00 0.00 H new ATOM 0 HG3 GLN A 100 15.098 -13.841 -22.117 1.00 0.00 H new ATOM 0 HE21 GLN A 100 14.189 -16.053 -22.686 1.00 0.00 H new ATOM 0 HE22 GLN A 100 14.352 -16.614 -24.354 1.00 0.00 H new ATOM 1496 N LEU A 101 13.928 -9.676 -21.204 1.00 0.00 N ATOM 1497 CA LEU A 101 14.451 -8.355 -21.567 1.00 0.00 C ATOM 1498 C LEU A 101 15.836 -8.531 -22.185 1.00 0.00 C ATOM 1499 O LEU A 101 16.610 -9.391 -21.762 1.00 0.00 O ATOM 1500 CB LEU A 101 14.480 -7.372 -20.378 1.00 0.00 C ATOM 1501 CG LEU A 101 13.164 -6.623 -20.108 1.00 0.00 C ATOM 1502 CD1 LEU A 101 12.658 -5.773 -21.290 1.00 0.00 C ATOM 1503 CD2 LEU A 101 12.056 -7.575 -19.655 1.00 0.00 C ATOM 0 H LEU A 101 13.848 -9.834 -20.200 1.00 0.00 H new ATOM 0 HA LEU A 101 13.776 -7.905 -22.295 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.755 -7.924 -19.479 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.266 -6.638 -20.555 1.00 0.00 H new ATOM 0 HG LEU A 101 13.409 -5.929 -19.304 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.726 -5.281 -21.012 1.00 0.00 H new ATOM 0 HD12 LEU A 101 13.405 -5.020 -21.543 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.485 -6.416 -22.153 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.142 -7.010 -19.474 1.00 0.00 H new ATOM 0 HD22 LEU A 101 11.875 -8.318 -20.431 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.360 -8.077 -18.736 1.00 0.00 H new ATOM 1515 N GLU A 102 16.145 -7.701 -23.177 1.00 0.00 N ATOM 1516 CA GLU A 102 17.476 -7.563 -23.740 1.00 0.00 C ATOM 1517 C GLU A 102 18.275 -6.638 -22.817 1.00 0.00 C ATOM 1518 O GLU A 102 17.695 -5.966 -21.961 1.00 0.00 O ATOM 1519 CB GLU A 102 17.381 -7.025 -25.178 1.00 0.00 C ATOM 1520 CG GLU A 102 16.783 -8.074 -26.128 1.00 0.00 C ATOM 1521 CD GLU A 102 16.509 -7.480 -27.518 1.00 0.00 C ATOM 1522 OE1 GLU A 102 15.492 -6.759 -27.672 1.00 0.00 O ATOM 1523 OE2 GLU A 102 17.294 -7.744 -28.463 1.00 0.00 O ATOM 0 H GLU A 102 15.456 -7.092 -23.620 1.00 0.00 H new ATOM 0 HA GLU A 102 17.987 -8.524 -23.802 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.765 -6.126 -25.192 1.00 0.00 H new ATOM 0 HB3 GLU A 102 18.373 -6.738 -25.528 1.00 0.00 H new ATOM 0 HG2 GLU A 102 17.468 -8.917 -26.219 1.00 0.00 H new ATOM 0 HG3 GLU A 102 15.855 -8.462 -25.707 1.00 0.00 H new ATOM 1530 N ASP A 103 19.599 -6.579 -22.980 1.00 0.00 N ATOM 1531 CA ASP A 103 20.455 -5.720 -22.173 1.00 0.00 C ATOM 1532 C ASP A 103 21.588 -5.117 -23.015 1.00 0.00 C ATOM 1533 O ASP A 103 22.185 -5.825 -23.830 1.00 0.00 O ATOM 1534 CB ASP A 103 21.003 -6.485 -20.972 1.00 0.00 C ATOM 1535 CG ASP A 103 21.733 -5.528 -20.028 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.930 -5.256 -20.250 1.00 0.00 O ATOM 1537 OD2 ASP A 103 21.076 -5.031 -19.084 1.00 0.00 O ATOM 0 H ASP A 103 20.103 -7.127 -23.677 1.00 0.00 H new ATOM 0 HA ASP A 103 19.851 -4.893 -21.799 1.00 0.00 H new ATOM 0 HB2 ASP A 103 20.188 -6.979 -20.443 1.00 0.00 H new ATOM 0 HB3 ASP A 103 21.684 -7.266 -21.309 1.00 0.00 H new ATOM 1542 N PRO A 104 21.873 -3.810 -22.878 1.00 0.00 N ATOM 1543 CA PRO A 104 22.814 -3.097 -23.739 1.00 0.00 C ATOM 1544 C PRO A 104 24.297 -3.216 -23.323 1.00 0.00 C ATOM 1545 O PRO A 104 25.140 -2.601 -23.978 1.00 0.00 O ATOM 1546 CB PRO A 104 22.313 -1.661 -23.699 1.00 0.00 C ATOM 1547 CG PRO A 104 21.814 -1.515 -22.264 1.00 0.00 C ATOM 1548 CD PRO A 104 21.148 -2.861 -22.038 1.00 0.00 C ATOM 0 HA PRO A 104 22.829 -3.526 -24.741 1.00 0.00 H new ATOM 0 HB2 PRO A 104 23.107 -0.949 -23.925 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.516 -1.490 -24.423 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.629 -1.337 -21.562 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.113 -0.687 -22.155 1.00 0.00 H new ATOM 0 HD2 PRO A 104 21.198 -3.151 -20.988 1.00 0.00 H new ATOM 0 HD3 PRO A 104 20.093 -2.826 -22.309 1.00 0.00 H new ATOM 1556 N ASP A 105 24.642 -3.973 -22.273 1.00 0.00 N ATOM 1557 CA ASP A 105 26.026 -4.207 -21.842 1.00 0.00 C ATOM 1558 C ASP A 105 26.938 -4.533 -23.031 1.00 0.00 C ATOM 1559 O ASP A 105 26.692 -5.494 -23.772 1.00 0.00 O ATOM 1560 CB ASP A 105 26.090 -5.364 -20.833 1.00 0.00 C ATOM 1561 CG ASP A 105 27.507 -5.959 -20.704 1.00 0.00 C ATOM 1562 OD1 ASP A 105 28.447 -5.231 -20.308 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.682 -7.175 -20.967 1.00 0.00 O ATOM 0 H ASP A 105 23.954 -4.448 -21.689 1.00 0.00 H new ATOM 0 HA ASP A 105 26.375 -3.288 -21.372 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.758 -5.009 -19.857 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.397 -6.148 -21.140 1.00 0.00 H new ATOM 1568 N GLY A 106 27.997 -3.734 -23.201 1.00 0.00 N ATOM 1569 CA GLY A 106 29.072 -4.017 -24.143 1.00 0.00 C ATOM 1570 C GLY A 106 28.687 -3.867 -25.619 1.00 0.00 C ATOM 1571 O GLY A 106 29.446 -4.337 -26.474 1.00 0.00 O ATOM 0 H GLY A 106 28.128 -2.866 -22.681 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.908 -3.351 -23.930 1.00 0.00 H new ATOM 0 HA3 GLY A 106 29.425 -5.035 -23.975 1.00 0.00 H new ATOM 1575 N GLN A 107 27.546 -3.243 -25.942 1.00 0.00 N ATOM 1576 CA GLN A 107 27.126 -2.969 -27.320 1.00 0.00 C ATOM 1577 C GLN A 107 26.715 -1.497 -27.493 1.00 0.00 C ATOM 1578 O GLN A 107 26.928 -0.672 -26.600 1.00 0.00 O ATOM 1579 CB GLN A 107 26.096 -4.008 -27.797 1.00 0.00 C ATOM 1580 CG GLN A 107 24.795 -4.041 -26.993 1.00 0.00 C ATOM 1581 CD GLN A 107 23.889 -5.192 -27.459 1.00 0.00 C ATOM 1582 OE1 GLN A 107 23.817 -5.512 -28.644 1.00 0.00 O ATOM 1583 NE2 GLN A 107 23.172 -5.858 -26.560 1.00 0.00 N ATOM 0 H GLN A 107 26.881 -2.911 -25.243 1.00 0.00 H new ATOM 0 HA GLN A 107 27.973 -3.093 -27.994 1.00 0.00 H new ATOM 0 HB2 GLN A 107 25.856 -3.807 -28.841 1.00 0.00 H new ATOM 0 HB3 GLN A 107 26.554 -4.996 -27.760 1.00 0.00 H new ATOM 0 HG2 GLN A 107 25.021 -4.158 -25.933 1.00 0.00 H new ATOM 0 HG3 GLN A 107 24.270 -3.092 -27.104 1.00 0.00 H new ATOM 0 HE21 GLN A 107 23.224 -5.601 -25.574 1.00 0.00 H new ATOM 0 HE22 GLN A 107 22.570 -6.626 -26.856 1.00 0.00 H new ATOM 1592 N SER A 108 26.163 -1.158 -28.662 1.00 0.00 N ATOM 1593 CA SER A 108 25.948 0.218 -29.091 1.00 0.00 C ATOM 1594 C SER A 108 24.884 1.011 -28.320 1.00 0.00 C ATOM 1595 O SER A 108 23.933 0.449 -27.772 1.00 0.00 O ATOM 1596 CB SER A 108 25.689 0.231 -30.609 1.00 0.00 C ATOM 1597 OG SER A 108 26.583 -0.648 -31.285 1.00 0.00 O ATOM 0 H SER A 108 25.849 -1.848 -29.345 1.00 0.00 H new ATOM 0 HA SER A 108 26.864 0.756 -28.848 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.660 -0.067 -30.809 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.808 1.244 -30.994 1.00 0.00 H new ATOM 0 HG SER A 108 26.399 -0.625 -32.247 1.00 0.00 H new ATOM 1603 N LEU A 109 25.002 2.347 -28.356 1.00 0.00 N ATOM 1604 CA LEU A 109 24.090 3.293 -27.695 1.00 0.00 C ATOM 1605 C LEU A 109 22.685 3.201 -28.278 1.00 0.00 C ATOM 1606 O LEU A 109 21.715 3.434 -27.565 1.00 0.00 O ATOM 1607 CB LEU A 109 24.609 4.746 -27.768 1.00 0.00 C ATOM 1608 CG LEU A 109 25.913 5.082 -27.002 1.00 0.00 C ATOM 1609 CD1 LEU A 109 25.984 4.441 -25.611 1.00 0.00 C ATOM 1610 CD2 LEU A 109 27.178 4.701 -27.781 1.00 0.00 C ATOM 0 H LEU A 109 25.756 2.813 -28.860 1.00 0.00 H new ATOM 0 HA LEU A 109 24.049 3.009 -26.643 1.00 0.00 H new ATOM 0 HB2 LEU A 109 24.763 4.995 -28.818 1.00 0.00 H new ATOM 0 HB3 LEU A 109 23.822 5.403 -27.396 1.00 0.00 H new ATOM 0 HG LEU A 109 25.877 6.165 -26.885 1.00 0.00 H new ATOM 0 HD11 LEU A 109 26.923 4.717 -25.130 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.149 4.793 -25.005 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.931 3.357 -25.707 1.00 0.00 H new ATOM 0 HD21 LEU A 109 28.059 4.960 -27.194 1.00 0.00 H new ATOM 0 HD22 LEU A 109 27.175 3.629 -27.977 1.00 0.00 H new ATOM 0 HD23 LEU A 109 27.200 5.243 -28.727 1.00 0.00 H new ATOM 1622 N GLU A 110 22.553 2.797 -29.543 1.00 0.00 N ATOM 1623 CA GLU A 110 21.254 2.538 -30.155 1.00 0.00 C ATOM 1624 C GLU A 110 20.521 1.431 -29.390 1.00 0.00 C ATOM 1625 O GLU A 110 19.307 1.497 -29.215 1.00 0.00 O ATOM 1626 CB GLU A 110 21.482 2.164 -31.627 1.00 0.00 C ATOM 1627 CG GLU A 110 20.196 2.077 -32.462 1.00 0.00 C ATOM 1628 CD GLU A 110 19.573 3.464 -32.721 1.00 0.00 C ATOM 1629 OE1 GLU A 110 18.748 3.934 -31.903 1.00 0.00 O ATOM 1630 OE2 GLU A 110 19.898 4.093 -33.758 1.00 0.00 O ATOM 0 H GLU A 110 23.343 2.641 -30.169 1.00 0.00 H new ATOM 0 HA GLU A 110 20.623 3.426 -30.110 1.00 0.00 H new ATOM 0 HB2 GLU A 110 22.146 2.901 -32.079 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.996 1.204 -31.671 1.00 0.00 H new ATOM 0 HG2 GLU A 110 20.416 1.596 -33.415 1.00 0.00 H new ATOM 0 HG3 GLU A 110 19.472 1.446 -31.946 1.00 0.00 H new ATOM 1637 N VAL A 111 21.252 0.437 -28.872 1.00 0.00 N ATOM 1638 CA VAL A 111 20.670 -0.658 -28.108 1.00 0.00 C ATOM 1639 C VAL A 111 20.273 -0.148 -26.724 1.00 0.00 C ATOM 1640 O VAL A 111 19.161 -0.431 -26.300 1.00 0.00 O ATOM 1641 CB VAL A 111 21.588 -1.896 -28.047 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.769 -3.123 -27.616 1.00 0.00 C ATOM 1643 CG2 VAL A 111 22.276 -2.203 -29.391 1.00 0.00 C ATOM 0 H VAL A 111 22.265 0.375 -28.974 1.00 0.00 H new ATOM 0 HA VAL A 111 19.773 -1.003 -28.622 1.00 0.00 H new ATOM 0 HB VAL A 111 22.371 -1.672 -27.322 1.00 0.00 H new ATOM 0 HG11 VAL A 111 21.419 -3.997 -27.573 1.00 0.00 H new ATOM 0 HG12 VAL A 111 20.336 -2.944 -26.632 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.971 -3.299 -28.337 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.908 -3.085 -29.283 1.00 0.00 H new ATOM 0 HG22 VAL A 111 21.519 -2.390 -30.153 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.888 -1.352 -29.689 1.00 0.00 H new ATOM 1653 N PHE A 112 21.096 0.668 -26.047 1.00 0.00 N ATOM 1654 CA PHE A 112 20.681 1.327 -24.798 1.00 0.00 C ATOM 1655 C PHE A 112 19.374 2.092 -25.029 1.00 0.00 C ATOM 1656 O PHE A 112 18.406 1.890 -24.304 1.00 0.00 O ATOM 1657 CB PHE A 112 21.769 2.300 -24.293 1.00 0.00 C ATOM 1658 CG PHE A 112 22.979 1.673 -23.625 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.978 1.458 -22.231 1.00 0.00 C ATOM 1660 CD2 PHE A 112 24.118 1.320 -24.372 1.00 0.00 C ATOM 1661 CE1 PHE A 112 24.080 0.843 -21.609 1.00 0.00 C ATOM 1662 CE2 PHE A 112 25.225 0.725 -23.749 1.00 0.00 C ATOM 1663 CZ PHE A 112 25.196 0.461 -22.374 1.00 0.00 C ATOM 0 H PHE A 112 22.048 0.887 -26.341 1.00 0.00 H new ATOM 0 HA PHE A 112 20.531 0.558 -24.040 1.00 0.00 H new ATOM 0 HB2 PHE A 112 22.115 2.894 -25.139 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.308 2.990 -23.586 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.129 1.766 -21.639 1.00 0.00 H new ATOM 0 HD2 PHE A 112 24.140 1.509 -25.435 1.00 0.00 H new ATOM 0 HE1 PHE A 112 24.069 0.664 -20.544 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.099 0.471 -24.330 1.00 0.00 H new ATOM 0 HZ PHE A 112 26.030 -0.036 -21.902 1.00 0.00 H new ATOM 1673 N ARG A 113 19.309 2.918 -26.074 1.00 0.00 N ATOM 1674 CA ARG A 113 18.152 3.775 -26.344 1.00 0.00 C ATOM 1675 C ARG A 113 16.923 2.944 -26.726 1.00 0.00 C ATOM 1676 O ARG A 113 15.819 3.272 -26.292 1.00 0.00 O ATOM 1677 CB ARG A 113 18.558 4.799 -27.421 1.00 0.00 C ATOM 1678 CG ARG A 113 19.516 5.850 -26.822 1.00 0.00 C ATOM 1679 CD ARG A 113 20.269 6.646 -27.886 1.00 0.00 C ATOM 1680 NE ARG A 113 21.106 7.700 -27.272 1.00 0.00 N ATOM 1681 CZ ARG A 113 22.074 8.384 -27.897 1.00 0.00 C ATOM 1682 NH1 ARG A 113 22.376 8.143 -29.174 1.00 0.00 N ATOM 1683 NH2 ARG A 113 22.739 9.320 -27.236 1.00 0.00 N ATOM 0 H ARG A 113 20.059 3.012 -26.759 1.00 0.00 H new ATOM 0 HA ARG A 113 17.857 4.319 -25.446 1.00 0.00 H new ATOM 0 HB2 ARG A 113 19.041 4.289 -28.255 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.670 5.290 -27.819 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.947 6.538 -26.197 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.235 5.350 -26.173 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.897 5.974 -28.471 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.558 7.099 -28.577 1.00 0.00 H new ATOM 0 HE ARG A 113 20.932 7.925 -26.292 1.00 0.00 H new ATOM 0 HH11 ARG A 113 21.867 7.427 -29.692 1.00 0.00 H new ATOM 0 HH12 ARG A 113 23.116 8.675 -29.632 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.512 9.514 -26.261 1.00 0.00 H new ATOM 0 HH22 ARG A 113 23.478 9.846 -27.702 1.00 0.00 H new ATOM 1697 N THR A 114 17.103 1.830 -27.434 1.00 0.00 N ATOM 1698 CA THR A 114 16.058 0.865 -27.704 1.00 0.00 C ATOM 1699 C THR A 114 15.567 0.261 -26.388 1.00 0.00 C ATOM 1700 O THR A 114 14.363 0.229 -26.139 1.00 0.00 O ATOM 1701 CB THR A 114 16.665 -0.188 -28.650 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.795 0.339 -29.959 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.876 -1.489 -28.690 1.00 0.00 C ATOM 0 H THR A 114 18.003 1.575 -27.842 1.00 0.00 H new ATOM 0 HA THR A 114 15.187 1.317 -28.179 1.00 0.00 H new ATOM 0 HB THR A 114 17.649 -0.429 -28.247 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.643 0.825 -30.033 1.00 0.00 H new ATOM 0 HG21 THR A 114 16.358 -2.186 -29.375 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.843 -1.926 -27.692 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.861 -1.288 -29.032 1.00 0.00 H new ATOM 1711 N VAL A 115 16.475 -0.211 -25.527 1.00 0.00 N ATOM 1712 CA VAL A 115 16.098 -0.969 -24.346 1.00 0.00 C ATOM 1713 C VAL A 115 15.413 -0.051 -23.336 1.00 0.00 C ATOM 1714 O VAL A 115 14.520 -0.532 -22.650 1.00 0.00 O ATOM 1715 CB VAL A 115 17.290 -1.815 -23.831 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.971 -2.562 -22.528 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.645 -2.901 -24.867 1.00 0.00 C ATOM 0 H VAL A 115 17.480 -0.076 -25.634 1.00 0.00 H new ATOM 0 HA VAL A 115 15.343 -1.720 -24.581 1.00 0.00 H new ATOM 0 HB VAL A 115 18.105 -1.111 -23.661 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.843 -3.137 -22.216 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.713 -1.843 -21.750 1.00 0.00 H new ATOM 0 HG13 VAL A 115 16.131 -3.237 -22.692 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.484 -3.493 -24.501 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.783 -3.550 -25.024 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.919 -2.428 -25.810 1.00 0.00 H new ATOM 1727 N ARG A 116 15.687 1.262 -23.317 1.00 0.00 N ATOM 1728 CA ARG A 116 14.882 2.195 -22.516 1.00 0.00 C ATOM 1729 C ARG A 116 13.412 2.097 -22.937 1.00 0.00 C ATOM 1730 O ARG A 116 12.562 1.900 -22.078 1.00 0.00 O ATOM 1731 CB ARG A 116 15.388 3.656 -22.602 1.00 0.00 C ATOM 1732 CG ARG A 116 16.799 3.831 -22.018 1.00 0.00 C ATOM 1733 CD ARG A 116 17.105 5.260 -21.545 1.00 0.00 C ATOM 1734 NE ARG A 116 16.988 6.300 -22.600 1.00 0.00 N ATOM 1735 CZ ARG A 116 17.957 6.810 -23.371 1.00 0.00 C ATOM 1736 NH1 ARG A 116 19.169 6.274 -23.412 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.733 7.889 -24.107 1.00 0.00 N ATOM 0 H ARG A 116 16.448 1.697 -23.839 1.00 0.00 H new ATOM 0 HA ARG A 116 14.983 1.903 -21.471 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.389 3.975 -23.644 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.695 4.308 -22.069 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.921 3.147 -21.178 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.532 3.544 -22.772 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.427 5.511 -20.729 1.00 0.00 H new ATOM 0 HD3 ARG A 116 18.116 5.285 -21.139 1.00 0.00 H new ATOM 0 HE ARG A 116 16.051 6.672 -22.757 1.00 0.00 H new ATOM 0 HH11 ARG A 116 19.383 5.452 -22.847 1.00 0.00 H new ATOM 0 HH12 ARG A 116 19.888 6.684 -24.009 1.00 0.00 H new ATOM 0 HH21 ARG A 116 16.817 8.337 -24.089 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.477 8.271 -24.691 1.00 0.00 H new ATOM 1751 N GLY A 117 13.119 2.141 -24.237 1.00 0.00 N ATOM 1752 CA GLY A 117 11.753 2.033 -24.752 1.00 0.00 C ATOM 1753 C GLY A 117 11.126 0.676 -24.425 1.00 0.00 C ATOM 1754 O GLY A 117 10.022 0.628 -23.878 1.00 0.00 O ATOM 0 H GLY A 117 13.824 2.253 -24.965 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.141 2.828 -24.326 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.760 2.179 -25.832 1.00 0.00 H new ATOM 1758 N GLN A 118 11.838 -0.428 -24.690 1.00 0.00 N ATOM 1759 CA GLN A 118 11.306 -1.775 -24.445 1.00 0.00 C ATOM 1760 C GLN A 118 11.000 -1.978 -22.965 1.00 0.00 C ATOM 1761 O GLN A 118 9.925 -2.456 -22.603 1.00 0.00 O ATOM 1762 CB GLN A 118 12.261 -2.871 -24.939 1.00 0.00 C ATOM 1763 CG GLN A 118 12.592 -2.768 -26.435 1.00 0.00 C ATOM 1764 CD GLN A 118 13.148 -4.068 -27.020 1.00 0.00 C ATOM 1765 OE1 GLN A 118 12.780 -4.467 -28.123 1.00 0.00 O ATOM 1766 NE2 GLN A 118 14.053 -4.740 -26.322 1.00 0.00 N ATOM 0 H GLN A 118 12.783 -0.414 -25.074 1.00 0.00 H new ATOM 0 HA GLN A 118 10.380 -1.858 -25.014 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.187 -2.820 -24.366 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.816 -3.846 -24.740 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.692 -2.487 -26.981 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.318 -1.969 -26.586 1.00 0.00 H new ATOM 0 HE21 GLN A 118 14.349 -4.398 -25.408 1.00 0.00 H new ATOM 0 HE22 GLN A 118 14.453 -5.599 -26.699 1.00 0.00 H new ATOM 1775 N VAL A 119 11.941 -1.591 -22.109 1.00 0.00 N ATOM 1776 CA VAL A 119 11.779 -1.737 -20.671 1.00 0.00 C ATOM 1777 C VAL A 119 10.627 -0.848 -20.200 1.00 0.00 C ATOM 1778 O VAL A 119 9.775 -1.335 -19.460 1.00 0.00 O ATOM 1779 CB VAL A 119 13.097 -1.447 -19.930 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.885 -1.395 -18.418 1.00 0.00 C ATOM 1781 CG2 VAL A 119 14.132 -2.545 -20.204 1.00 0.00 C ATOM 0 H VAL A 119 12.827 -1.172 -22.391 1.00 0.00 H new ATOM 0 HA VAL A 119 11.525 -2.770 -20.434 1.00 0.00 H new ATOM 0 HB VAL A 119 13.451 -0.483 -20.295 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.835 -1.189 -17.924 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.172 -0.606 -18.177 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.497 -2.353 -18.072 1.00 0.00 H new ATOM 0 HG21 VAL A 119 15.054 -2.317 -19.669 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.743 -3.505 -19.864 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.335 -2.595 -21.274 1.00 0.00 H new ATOM 1791 N LYS A 120 10.564 0.419 -20.638 1.00 0.00 N ATOM 1792 CA LYS A 120 9.516 1.343 -20.211 1.00 0.00 C ATOM 1793 C LYS A 120 8.164 0.714 -20.479 1.00 0.00 C ATOM 1794 O LYS A 120 7.337 0.689 -19.582 1.00 0.00 O ATOM 1795 CB LYS A 120 9.610 2.671 -20.984 1.00 0.00 C ATOM 1796 CG LYS A 120 8.614 3.715 -20.452 1.00 0.00 C ATOM 1797 CD LYS A 120 8.704 5.019 -21.260 1.00 0.00 C ATOM 1798 CE LYS A 120 7.681 6.044 -20.743 1.00 0.00 C ATOM 1799 NZ LYS A 120 7.672 7.292 -21.555 1.00 0.00 N ATOM 0 H LYS A 120 11.234 0.824 -21.292 1.00 0.00 H new ATOM 0 HA LYS A 120 9.641 1.546 -19.147 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.624 3.064 -20.908 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.417 2.490 -22.041 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.600 3.318 -20.507 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.820 3.918 -19.401 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.710 5.431 -21.186 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.521 4.814 -22.315 1.00 0.00 H new ATOM 0 HE2 LYS A 120 6.686 5.599 -20.754 1.00 0.00 H new ATOM 0 HE3 LYS A 120 7.909 6.290 -19.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 6.967 7.952 -21.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.613 7.733 -21.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.429 7.064 -22.540 1.00 0.00 H new ATOM 1813 N GLU A 121 7.955 0.180 -21.678 1.00 0.00 N ATOM 1814 CA GLU A 121 6.657 -0.320 -22.086 1.00 0.00 C ATOM 1815 C GLU A 121 6.232 -1.514 -21.216 1.00 0.00 C ATOM 1816 O GLU A 121 5.087 -1.566 -20.759 1.00 0.00 O ATOM 1817 CB GLU A 121 6.742 -0.645 -23.580 1.00 0.00 C ATOM 1818 CG GLU A 121 5.401 -1.138 -24.136 1.00 0.00 C ATOM 1819 CD GLU A 121 5.472 -1.357 -25.657 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.846 -2.473 -26.094 1.00 0.00 O ATOM 1821 OE2 GLU A 121 5.134 -0.428 -26.430 1.00 0.00 O ATOM 0 H GLU A 121 8.681 0.084 -22.388 1.00 0.00 H new ATOM 0 HA GLU A 121 5.876 0.426 -21.938 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.057 0.243 -24.127 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.504 -1.407 -23.743 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.122 -2.070 -23.645 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.621 -0.412 -23.907 1.00 0.00 H new ATOM 1828 N ARG A 122 7.151 -2.445 -20.920 1.00 0.00 N ATOM 1829 CA ARG A 122 6.831 -3.590 -20.059 1.00 0.00 C ATOM 1830 C ARG A 122 6.560 -3.139 -18.627 1.00 0.00 C ATOM 1831 O ARG A 122 5.592 -3.588 -18.015 1.00 0.00 O ATOM 1832 CB ARG A 122 7.924 -4.668 -20.131 1.00 0.00 C ATOM 1833 CG ARG A 122 8.020 -5.280 -21.541 1.00 0.00 C ATOM 1834 CD ARG A 122 8.463 -6.739 -21.460 1.00 0.00 C ATOM 1835 NE ARG A 122 8.683 -7.306 -22.807 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.766 -7.890 -23.597 1.00 0.00 C ATOM 1837 NH1 ARG A 122 6.514 -8.061 -23.182 1.00 0.00 N ATOM 1838 NH2 ARG A 122 8.116 -8.298 -24.813 1.00 0.00 N ATOM 0 H ARG A 122 8.112 -2.427 -21.261 1.00 0.00 H new ATOM 0 HA ARG A 122 5.914 -4.047 -20.431 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.885 -4.233 -19.856 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.710 -5.453 -19.406 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.053 -5.214 -22.039 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.728 -4.711 -22.144 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.382 -6.811 -20.878 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.707 -7.323 -20.936 1.00 0.00 H new ATOM 0 HE ARG A 122 9.632 -7.248 -23.176 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.238 -7.747 -22.252 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.830 -8.506 -23.794 1.00 0.00 H new ATOM 0 HH21 ARG A 122 9.074 -8.167 -25.139 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.427 -8.742 -25.420 1.00 0.00 H new ATOM 1852 N VAL A 123 7.376 -2.230 -18.102 1.00 0.00 N ATOM 1853 CA VAL A 123 7.205 -1.716 -16.748 1.00 0.00 C ATOM 1854 C VAL A 123 5.893 -0.924 -16.656 1.00 0.00 C ATOM 1855 O VAL A 123 5.151 -1.097 -15.690 1.00 0.00 O ATOM 1856 CB VAL A 123 8.458 -0.928 -16.347 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.315 -0.232 -14.994 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.701 -1.827 -16.257 1.00 0.00 C ATOM 0 H VAL A 123 8.171 -1.831 -18.601 1.00 0.00 H new ATOM 0 HA VAL A 123 7.110 -2.525 -16.023 1.00 0.00 H new ATOM 0 HB VAL A 123 8.576 -0.185 -17.135 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.233 0.309 -14.764 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.481 0.468 -15.031 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.129 -0.976 -14.220 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.564 -1.227 -15.970 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.535 -2.604 -15.510 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.887 -2.289 -17.226 1.00 0.00 H new ATOM 1868 N GLU A 124 5.550 -0.113 -17.661 1.00 0.00 N ATOM 1869 CA GLU A 124 4.305 0.638 -17.703 1.00 0.00 C ATOM 1870 C GLU A 124 3.122 -0.314 -17.637 1.00 0.00 C ATOM 1871 O GLU A 124 2.190 -0.072 -16.877 1.00 0.00 O ATOM 1872 CB GLU A 124 4.193 1.484 -18.990 1.00 0.00 C ATOM 1873 CG GLU A 124 4.879 2.849 -18.916 1.00 0.00 C ATOM 1874 CD GLU A 124 4.587 3.695 -20.173 1.00 0.00 C ATOM 1875 OE1 GLU A 124 4.916 3.271 -21.308 1.00 0.00 O ATOM 1876 OE2 GLU A 124 4.023 4.807 -20.029 1.00 0.00 O ATOM 0 H GLU A 124 6.142 0.038 -18.477 1.00 0.00 H new ATOM 0 HA GLU A 124 4.299 1.309 -16.844 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.623 0.920 -19.818 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.138 1.634 -19.220 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.537 3.382 -18.029 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.955 2.712 -18.810 1.00 0.00 H new ATOM 1883 N ASN A 125 3.163 -1.405 -18.402 1.00 0.00 N ATOM 1884 CA ASN A 125 2.073 -2.371 -18.450 1.00 0.00 C ATOM 1885 C ASN A 125 1.849 -3.012 -17.077 1.00 0.00 C ATOM 1886 O ASN A 125 0.712 -3.105 -16.618 1.00 0.00 O ATOM 1887 CB ASN A 125 2.356 -3.442 -19.512 1.00 0.00 C ATOM 1888 CG ASN A 125 1.223 -4.459 -19.569 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.308 -5.530 -18.974 1.00 0.00 O ATOM 1890 ND2 ASN A 125 0.139 -4.146 -20.262 1.00 0.00 N ATOM 0 H ASN A 125 3.952 -1.641 -19.003 1.00 0.00 H new ATOM 0 HA ASN A 125 1.160 -1.844 -18.726 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.477 -2.971 -20.487 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.294 -3.948 -19.284 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.643 -4.799 -20.308 1.00 0.00 H new ATOM 0 HD22 ASN A 125 0.086 -3.252 -20.750 1.00 0.00 H new ATOM 1897 N LEU A 126 2.930 -3.384 -16.386 1.00 0.00 N ATOM 1898 CA LEU A 126 2.886 -3.942 -15.043 1.00 0.00 C ATOM 1899 C LEU A 126 2.229 -2.957 -14.074 1.00 0.00 C ATOM 1900 O LEU A 126 1.302 -3.321 -13.353 1.00 0.00 O ATOM 1901 CB LEU A 126 4.323 -4.325 -14.653 1.00 0.00 C ATOM 1902 CG LEU A 126 4.517 -4.964 -13.270 1.00 0.00 C ATOM 1903 CD1 LEU A 126 4.785 -3.931 -12.170 1.00 0.00 C ATOM 1904 CD2 LEU A 126 3.390 -5.919 -12.871 1.00 0.00 C ATOM 0 H LEU A 126 3.877 -3.302 -16.757 1.00 0.00 H new ATOM 0 HA LEU A 126 2.269 -4.839 -15.001 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.706 -5.016 -15.404 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.939 -3.427 -14.702 1.00 0.00 H new ATOM 0 HG LEU A 126 5.416 -5.573 -13.372 1.00 0.00 H new ATOM 0 HD11 LEU A 126 4.914 -4.441 -11.215 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.690 -3.373 -12.408 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.942 -3.244 -12.103 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.595 -6.332 -11.883 1.00 0.00 H new ATOM 0 HD22 LEU A 126 2.445 -5.377 -12.848 1.00 0.00 H new ATOM 0 HD23 LEU A 126 3.326 -6.730 -13.597 1.00 0.00 H new ATOM 1916 N ILE A 127 2.654 -1.695 -14.079 1.00 0.00 N ATOM 1917 CA ILE A 127 2.139 -0.656 -13.197 1.00 0.00 C ATOM 1918 C ILE A 127 0.666 -0.404 -13.533 1.00 0.00 C ATOM 1919 O ILE A 127 -0.151 -0.330 -12.622 1.00 0.00 O ATOM 1920 CB ILE A 127 3.046 0.571 -13.370 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.436 0.187 -12.823 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.494 1.794 -12.622 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.495 1.228 -13.137 1.00 0.00 C ATOM 0 H ILE A 127 3.382 -1.362 -14.711 1.00 0.00 H new ATOM 0 HA ILE A 127 2.159 -0.937 -12.144 1.00 0.00 H new ATOM 0 HB ILE A 127 3.100 0.849 -14.423 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.373 0.053 -11.743 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.737 -0.771 -13.246 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.163 2.642 -12.768 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.505 2.041 -13.008 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.422 1.568 -11.558 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.453 0.907 -12.729 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.581 1.345 -14.217 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.212 2.181 -12.691 1.00 0.00 H new ATOM 1935 N ALA A 128 0.310 -0.344 -14.818 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.065 -0.153 -15.260 1.00 0.00 C ATOM 1937 C ALA A 128 -1.976 -1.302 -14.793 1.00 0.00 C ATOM 1938 O ALA A 128 -3.163 -1.067 -14.552 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.096 -0.010 -16.786 1.00 0.00 C ATOM 0 H ALA A 128 0.977 -0.428 -15.585 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.451 0.760 -14.808 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.125 0.133 -17.117 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.496 0.850 -17.083 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.689 -0.911 -17.244 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.449 -2.528 -14.640 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.207 -3.628 -14.058 1.00 0.00 C ATOM 1947 C LYS A 129 -2.441 -3.379 -12.573 1.00 0.00 C ATOM 1948 O LYS A 129 -3.590 -3.412 -12.125 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.524 -4.986 -14.283 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.658 -5.483 -15.730 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.907 -6.809 -15.900 1.00 0.00 C ATOM 1952 CE LYS A 129 -1.063 -7.317 -17.339 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.557 -8.702 -17.505 1.00 0.00 N ATOM 0 H LYS A 129 -0.498 -2.774 -14.915 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.170 -3.669 -14.567 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.468 -4.904 -14.028 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.959 -5.723 -13.608 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.710 -5.617 -15.982 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.258 -4.738 -16.418 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.149 -6.672 -15.666 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.295 -7.549 -15.200 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -2.115 -7.280 -17.623 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.527 -6.653 -18.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.269 -8.850 -18.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.261 -8.850 -16.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.308 -9.378 -17.258 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.370 -3.167 -11.808 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.471 -3.145 -10.358 1.00 0.00 C ATOM 1969 C ILE A 130 -2.118 -1.874 -9.797 1.00 0.00 C ATOM 1970 O ILE A 130 -2.906 -1.967 -8.852 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.117 -3.460 -9.705 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.967 -2.419 -10.033 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.326 -4.879 -10.096 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.352 -2.730 -9.472 1.00 0.00 C ATOM 0 H ILE A 130 -0.430 -3.009 -12.170 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.163 -3.942 -10.088 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.252 -3.410 -8.625 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.043 -2.325 -11.116 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.646 -1.450 -9.651 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.287 -5.101 -9.632 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.417 -5.599 -9.754 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.423 -4.944 -11.180 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.046 -1.939 -9.756 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.299 -2.792 -8.385 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.702 -3.681 -9.873 1.00 0.00 H new ATOM 1986 N SER A 131 -1.782 -0.711 -10.347 1.00 0.00 N ATOM 1987 CA SER A 131 -2.108 0.600 -9.837 1.00 0.00 C ATOM 1988 C SER A 131 -3.154 1.243 -10.749 1.00 0.00 C ATOM 1989 O SER A 131 -2.801 2.075 -11.617 1.00 0.00 O ATOM 1990 CB SER A 131 -0.818 1.404 -9.691 1.00 0.00 C ATOM 1991 OG SER A 131 0.015 0.795 -8.711 1.00 0.00 O ATOM 1992 OXT SER A 131 -4.350 0.896 -10.601 1.00 0.00 O ATOM 0 H SER A 131 -1.243 -0.665 -11.212 1.00 0.00 H new ATOM 0 HA SER A 131 -2.557 0.555 -8.845 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.297 1.452 -10.647 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.047 2.430 -9.402 1.00 0.00 H new ATOM 0 HG SER A 131 0.843 1.311 -8.619 1.00 0.00 H new