USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 976 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 5 MET CE :methyl 169:sc= -0.25 (180deg=-0.697) USER MOD Set 1.2: A 35 CYS SG : rot -97:sc= 0.603 USER MOD Set 1.3: A 69 ASN : amide:sc= 0.419 K(o=1,f=0.08) USER MOD Set 1.4: A 73 TYR OH : rot -112:sc= 0.268 USER MOD Set 2.1: A 40 SER OG : rot -62:sc= 0.919 USER MOD Set 2.2: A 62 SER OG : rot -127:sc= 0.374 USER MOD Set 3.1: A 29 LYS NZ :NH3+ 140:sc= 0.815 (180deg=0) USER MOD Set 3.2: A 131 SER OG : rot 62:sc= 1.92 USER MOD Set 4.1: A 16 GLN : amide:sc= 1.95 K(o=5.1,f=-5.4) USER MOD Set 4.2: A 23 LYS NZ :NH3+ 159:sc= 1.74 (180deg=1.17) USER MOD Set 4.3: A 60 GLN : amide:sc= 1.37 K(o=5.1,f=-2.4!) USER MOD Set 5.1: A 11 ASN : amide:sc= 0.469 K(o=1.7,f=-5.6!) USER MOD Set 5.2: A 15 SER OG : rot -55:sc= 0.607 USER MOD Set 5.3: A 34 SER OG : rot 180:sc= 0.667 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 150:sc= 1.26 (180deg=0.586) USER MOD Single : A 2 LYS NZ :NH3+ 150:sc= 1.26 (180deg=1.09) USER MOD Single : A 3 LYS NZ :NH3+ -175:sc= 1.18 (180deg=1.15) USER MOD Single : A 8 CYS SG : rot 177:sc= 0.295 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 90:sc= 0.844 USER MOD Single : A 13 CYS SG : rot 180:sc= 0.368 USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 92:sc= 0.951 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0.363 K(o=0.36,f=-2) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 173:sc= -0.561 (180deg=-0.744) USER MOD Single : A 50 MET CE :methyl -139:sc= -0.241 (180deg=-3.23!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.357 USER MOD Single : A 67 ASN : amide:sc= 0.81 K(o=0.81,f=-0.21) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0071 X(o=-0.0071,f=-0.0071) USER MOD Single : A 92 THR OG1 : rot -49:sc= 0.442 USER MOD Single : A 93 GLN : amide:sc= -1.29! C(o=-1.3!,f=-7.8!) USER MOD Single : A 100 GLN : amide:sc= 0.889 K(o=0.89,f=-2!) USER MOD Single : A 107 GLN : amide:sc= 0.239 K(o=0.24,f=-0.84) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 76:sc= 1.07 USER MOD Single : A 118 GLN : amide:sc= 1.48 K(o=1.5,f=-0.2) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= 0.871 K(o=0.87,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.944 -0.387 1.325 1.00 0.00 N ATOM 2 CA MET A 1 2.457 -0.130 -0.049 1.00 0.00 C ATOM 3 C MET A 1 2.432 1.366 -0.387 1.00 0.00 C ATOM 4 O MET A 1 1.371 1.983 -0.339 1.00 0.00 O ATOM 5 CB MET A 1 1.716 -0.960 -1.126 1.00 0.00 C ATOM 6 CG MET A 1 2.237 -0.687 -2.553 1.00 0.00 C ATOM 7 SD MET A 1 1.531 -1.701 -3.884 1.00 0.00 S ATOM 8 CE MET A 1 2.437 -3.251 -3.636 1.00 0.00 C ATOM 0 H1 MET A 1 1.500 -1.327 1.360 1.00 0.00 H new ATOM 0 H2 MET A 1 2.732 -0.351 2.002 1.00 0.00 H new ATOM 0 H3 MET A 1 1.240 0.337 1.574 1.00 0.00 H new ATOM 0 HA MET A 1 3.496 -0.460 -0.058 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.826 -2.021 -0.900 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.651 -0.734 -1.083 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.052 0.361 -2.789 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.318 -0.828 -2.554 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.117 -3.982 -4.378 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.506 -3.069 -3.744 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.233 -3.636 -2.637 1.00 0.00 H new ATOM 18 N LYS A 2 3.584 1.930 -0.781 1.00 0.00 N ATOM 19 CA LYS A 2 3.737 3.288 -1.360 1.00 0.00 C ATOM 20 C LYS A 2 4.537 3.236 -2.672 1.00 0.00 C ATOM 21 O LYS A 2 5.136 2.209 -2.987 1.00 0.00 O ATOM 22 CB LYS A 2 4.364 4.235 -0.314 1.00 0.00 C ATOM 23 CG LYS A 2 3.402 4.504 0.856 1.00 0.00 C ATOM 24 CD LYS A 2 4.006 5.446 1.906 1.00 0.00 C ATOM 25 CE LYS A 2 2.960 5.743 2.992 1.00 0.00 C ATOM 26 NZ LYS A 2 3.532 6.558 4.097 1.00 0.00 N ATOM 0 H LYS A 2 4.475 1.439 -0.705 1.00 0.00 H new ATOM 0 HA LYS A 2 2.756 3.688 -1.615 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.287 3.798 0.067 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.631 5.178 -0.790 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.479 4.937 0.471 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.137 3.559 1.330 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.890 4.991 2.353 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.329 6.374 1.434 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.116 6.271 2.549 1.00 0.00 H new ATOM 0 HE3 LYS A 2 2.575 4.805 3.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 2.786 7.150 4.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 3.923 5.928 4.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.288 7.166 3.724 1.00 0.00 H new ATOM 40 N LYS A 3 4.526 4.321 -3.455 1.00 0.00 N ATOM 41 CA LYS A 3 5.163 4.406 -4.785 1.00 0.00 C ATOM 42 C LYS A 3 6.427 5.270 -4.759 1.00 0.00 C ATOM 43 O LYS A 3 6.456 6.321 -4.122 1.00 0.00 O ATOM 44 CB LYS A 3 4.170 4.884 -5.869 1.00 0.00 C ATOM 45 CG LYS A 3 2.929 3.979 -6.041 1.00 0.00 C ATOM 46 CD LYS A 3 1.726 4.293 -5.130 1.00 0.00 C ATOM 47 CE LYS A 3 1.173 5.696 -5.410 1.00 0.00 C ATOM 48 NZ LYS A 3 0.476 6.276 -4.233 1.00 0.00 N ATOM 0 H LYS A 3 4.064 5.188 -3.180 1.00 0.00 H new ATOM 0 HA LYS A 3 5.470 3.395 -5.053 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.838 5.892 -5.621 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.694 4.946 -6.823 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.599 4.043 -7.078 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.231 2.946 -5.866 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.943 3.552 -5.288 1.00 0.00 H new ATOM 0 HD3 LYS A 3 2.028 4.220 -4.085 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.991 6.354 -5.705 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.482 5.650 -6.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.048 7.186 -4.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.268 5.623 -3.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.160 6.425 -3.464 1.00 0.00 H new ATOM 62 N VAL A 4 7.451 4.854 -5.502 1.00 0.00 N ATOM 63 CA VAL A 4 8.724 5.591 -5.664 1.00 0.00 C ATOM 64 C VAL A 4 8.981 5.862 -7.146 1.00 0.00 C ATOM 65 O VAL A 4 8.727 5.009 -7.994 1.00 0.00 O ATOM 66 CB VAL A 4 9.924 4.882 -4.990 1.00 0.00 C ATOM 67 CG1 VAL A 4 11.169 5.777 -4.964 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.622 4.438 -3.552 1.00 0.00 C ATOM 0 H VAL A 4 7.428 3.978 -6.023 1.00 0.00 H new ATOM 0 HA VAL A 4 8.622 6.544 -5.144 1.00 0.00 H new ATOM 0 HB VAL A 4 10.112 3.998 -5.599 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.990 5.245 -4.483 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.452 6.036 -5.984 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.951 6.688 -4.406 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.499 3.947 -3.131 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.368 5.309 -2.948 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.783 3.742 -3.555 1.00 0.00 H new ATOM 78 N MET A 5 9.496 7.046 -7.471 1.00 0.00 N ATOM 79 CA MET A 5 9.803 7.455 -8.845 1.00 0.00 C ATOM 80 C MET A 5 11.207 8.049 -8.911 1.00 0.00 C ATOM 81 O MET A 5 11.575 8.891 -8.092 1.00 0.00 O ATOM 82 CB MET A 5 8.724 8.424 -9.350 1.00 0.00 C ATOM 83 CG MET A 5 9.067 9.125 -10.671 1.00 0.00 C ATOM 84 SD MET A 5 9.368 8.059 -12.105 1.00 0.00 S ATOM 85 CE MET A 5 8.013 8.577 -13.192 1.00 0.00 C ATOM 0 H MET A 5 9.716 7.761 -6.778 1.00 0.00 H new ATOM 0 HA MET A 5 9.794 6.588 -9.506 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.791 7.875 -9.476 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.548 9.181 -8.586 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.251 9.804 -10.917 1.00 0.00 H new ATOM 0 HG3 MET A 5 9.954 9.738 -10.511 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.167 8.162 -14.188 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.066 8.216 -12.790 1.00 0.00 H new ATOM 0 HE3 MET A 5 7.990 9.665 -13.252 1.00 0.00 H new ATOM 95 N PHE A 6 11.982 7.619 -9.901 1.00 0.00 N ATOM 96 CA PHE A 6 13.381 8.032 -10.084 1.00 0.00 C ATOM 97 C PHE A 6 13.526 8.995 -11.270 1.00 0.00 C ATOM 98 O PHE A 6 13.040 8.700 -12.357 1.00 0.00 O ATOM 99 CB PHE A 6 14.250 6.770 -10.234 1.00 0.00 C ATOM 100 CG PHE A 6 14.010 5.728 -9.156 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.553 5.885 -7.867 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.190 4.621 -9.436 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.239 4.969 -6.847 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.862 3.714 -8.412 1.00 0.00 C ATOM 105 CZ PHE A 6 13.371 3.897 -7.115 1.00 0.00 C ATOM 0 H PHE A 6 11.657 6.964 -10.612 1.00 0.00 H new ATOM 0 HA PHE A 6 13.724 8.586 -9.210 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.058 6.322 -11.209 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.301 7.060 -10.218 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.214 6.713 -7.660 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.812 4.467 -10.436 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.664 5.089 -5.861 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.217 2.874 -8.623 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.095 3.214 -6.325 1.00 0.00 H new ATOM 115 N VAL A 7 14.226 10.114 -11.077 1.00 0.00 N ATOM 116 CA VAL A 7 14.629 11.088 -12.107 1.00 0.00 C ATOM 117 C VAL A 7 16.138 11.008 -12.339 1.00 0.00 C ATOM 118 O VAL A 7 16.914 11.068 -11.396 1.00 0.00 O ATOM 119 CB VAL A 7 14.174 12.528 -11.740 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.070 13.638 -12.307 1.00 0.00 C ATOM 121 CG2 VAL A 7 12.774 12.798 -12.294 1.00 0.00 C ATOM 0 H VAL A 7 14.548 10.385 -10.148 1.00 0.00 H new ATOM 0 HA VAL A 7 14.127 10.834 -13.041 1.00 0.00 H new ATOM 0 HB VAL A 7 14.218 12.558 -10.651 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.681 14.610 -12.004 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.084 13.518 -11.925 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.082 13.576 -13.395 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.467 13.810 -12.030 1.00 0.00 H new ATOM 0 HG22 VAL A 7 12.786 12.694 -13.379 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.070 12.083 -11.868 1.00 0.00 H new ATOM 131 N CYS A 8 16.571 10.947 -13.597 1.00 0.00 N ATOM 132 CA CYS A 8 17.974 11.092 -14.023 1.00 0.00 C ATOM 133 C CYS A 8 18.041 12.113 -15.177 1.00 0.00 C ATOM 134 O CYS A 8 17.000 12.530 -15.681 1.00 0.00 O ATOM 135 CB CYS A 8 18.488 9.671 -14.332 1.00 0.00 C ATOM 136 SG CYS A 8 20.212 9.626 -14.909 1.00 0.00 S ATOM 0 H CYS A 8 15.937 10.790 -14.380 1.00 0.00 H new ATOM 0 HA CYS A 8 18.637 11.504 -13.263 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.399 9.059 -13.435 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.848 9.220 -15.091 1.00 0.00 H new ATOM 0 HG CYS A 8 20.582 8.391 -15.074 1.00 0.00 H new ATOM 142 N LYS A 9 19.235 12.535 -15.623 1.00 0.00 N ATOM 143 CA LYS A 9 19.377 13.669 -16.570 1.00 0.00 C ATOM 144 C LYS A 9 18.729 13.386 -17.938 1.00 0.00 C ATOM 145 O LYS A 9 17.875 14.150 -18.364 1.00 0.00 O ATOM 146 CB LYS A 9 20.860 14.101 -16.650 1.00 0.00 C ATOM 147 CG LYS A 9 20.997 15.563 -17.118 1.00 0.00 C ATOM 148 CD LYS A 9 22.455 16.034 -17.269 1.00 0.00 C ATOM 149 CE LYS A 9 23.192 15.369 -18.447 1.00 0.00 C ATOM 150 NZ LYS A 9 24.552 15.954 -18.643 1.00 0.00 N ATOM 0 H LYS A 9 20.121 12.112 -15.347 1.00 0.00 H new ATOM 0 HA LYS A 9 18.814 14.520 -16.186 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.327 13.985 -15.672 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.394 13.446 -17.338 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.487 15.678 -18.075 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.487 16.212 -16.406 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.468 17.115 -17.406 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.995 15.823 -16.346 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.278 14.298 -18.265 1.00 0.00 H new ATOM 0 HE3 LYS A 9 22.607 15.491 -19.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.020 15.484 -19.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.467 16.971 -18.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.117 15.815 -17.781 1.00 0.00 H new ATOM 164 N ARG A 10 19.054 12.235 -18.558 1.00 0.00 N ATOM 165 CA ARG A 10 18.428 11.738 -19.821 1.00 0.00 C ATOM 166 C ARG A 10 17.756 10.353 -19.741 1.00 0.00 C ATOM 167 O ARG A 10 17.519 9.711 -20.757 1.00 0.00 O ATOM 168 CB ARG A 10 19.358 11.964 -21.036 1.00 0.00 C ATOM 169 CG ARG A 10 20.608 11.077 -21.189 1.00 0.00 C ATOM 170 CD ARG A 10 21.780 11.426 -20.255 1.00 0.00 C ATOM 171 NE ARG A 10 23.062 11.509 -20.993 1.00 0.00 N ATOM 172 CZ ARG A 10 23.891 10.528 -21.315 1.00 0.00 C ATOM 173 NH1 ARG A 10 23.658 9.276 -21.080 1.00 0.00 N ATOM 174 NH2 ARG A 10 25.023 10.759 -21.904 1.00 0.00 N ATOM 0 H ARG A 10 19.771 11.606 -18.197 1.00 0.00 H new ATOM 0 HA ARG A 10 17.553 12.367 -19.988 1.00 0.00 H new ATOM 0 HB2 ARG A 10 18.757 11.846 -21.938 1.00 0.00 H new ATOM 0 HB3 ARG A 10 19.691 13.002 -21.008 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.321 10.040 -21.013 1.00 0.00 H new ATOM 0 HG3 ARG A 10 20.955 11.141 -22.220 1.00 0.00 H new ATOM 0 HD2 ARG A 10 21.582 12.378 -19.762 1.00 0.00 H new ATOM 0 HD3 ARG A 10 21.859 10.672 -19.472 1.00 0.00 H new ATOM 0 HE ARG A 10 23.342 12.443 -21.292 1.00 0.00 H new ATOM 0 HH11 ARG A 10 22.792 8.996 -20.620 1.00 0.00 H new ATOM 0 HH12 ARG A 10 24.341 8.570 -21.355 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.294 11.716 -22.131 1.00 0.00 H new ATOM 0 HH22 ARG A 10 25.642 9.984 -22.141 1.00 0.00 H new ATOM 188 N ASN A 11 17.508 9.881 -18.514 1.00 0.00 N ATOM 189 CA ASN A 11 16.936 8.570 -18.122 1.00 0.00 C ATOM 190 C ASN A 11 17.633 7.318 -18.691 1.00 0.00 C ATOM 191 O ASN A 11 17.038 6.247 -18.763 1.00 0.00 O ATOM 192 CB ASN A 11 15.411 8.630 -18.319 1.00 0.00 C ATOM 193 CG ASN A 11 14.596 7.525 -17.652 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.583 7.103 -18.175 1.00 0.00 O ATOM 195 ND2 ASN A 11 14.934 7.057 -16.469 1.00 0.00 N ATOM 0 H ASN A 11 17.717 10.449 -17.693 1.00 0.00 H new ATOM 0 HA ASN A 11 17.149 8.416 -17.064 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.056 9.590 -17.944 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.204 8.609 -19.389 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.351 6.356 -16.012 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.779 7.395 -16.009 1.00 0.00 H new ATOM 202 N SER A 12 18.911 7.445 -19.057 1.00 0.00 N ATOM 203 CA SER A 12 19.704 6.381 -19.685 1.00 0.00 C ATOM 204 C SER A 12 20.291 5.380 -18.683 1.00 0.00 C ATOM 205 O SER A 12 20.465 4.215 -19.024 1.00 0.00 O ATOM 206 CB SER A 12 20.803 7.053 -20.515 1.00 0.00 C ATOM 207 OG SER A 12 21.460 8.034 -19.712 1.00 0.00 O ATOM 0 H SER A 12 19.436 8.309 -18.923 1.00 0.00 H new ATOM 0 HA SER A 12 19.048 5.783 -20.317 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.520 6.309 -20.862 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.373 7.519 -21.402 1.00 0.00 H new ATOM 0 HG SER A 12 22.214 7.621 -19.242 1.00 0.00 H new ATOM 213 N CYS A 13 20.605 5.826 -17.458 1.00 0.00 N ATOM 214 CA CYS A 13 21.282 5.043 -16.407 1.00 0.00 C ATOM 215 C CYS A 13 20.835 5.502 -15.002 1.00 0.00 C ATOM 216 O CYS A 13 19.976 6.373 -14.885 1.00 0.00 O ATOM 217 CB CYS A 13 22.804 5.179 -16.652 1.00 0.00 C ATOM 218 SG CYS A 13 23.754 3.920 -15.737 1.00 0.00 S ATOM 0 H CYS A 13 20.388 6.776 -17.158 1.00 0.00 H new ATOM 0 HA CYS A 13 21.011 3.988 -16.452 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.010 5.086 -17.718 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.133 6.173 -16.350 1.00 0.00 H new ATOM 0 HG CYS A 13 25.022 4.074 -15.977 1.00 0.00 H new ATOM 224 N ARG A 14 21.393 4.933 -13.924 1.00 0.00 N ATOM 225 CA ARG A 14 21.050 5.164 -12.490 1.00 0.00 C ATOM 226 C ARG A 14 19.585 4.892 -12.143 1.00 0.00 C ATOM 227 O ARG A 14 19.269 3.824 -11.648 1.00 0.00 O ATOM 228 CB ARG A 14 21.582 6.544 -12.016 1.00 0.00 C ATOM 229 CG ARG A 14 23.115 6.587 -12.013 1.00 0.00 C ATOM 230 CD ARG A 14 23.676 7.843 -11.331 1.00 0.00 C ATOM 231 NE ARG A 14 23.279 9.071 -12.052 1.00 0.00 N ATOM 232 CZ ARG A 14 23.950 9.704 -12.997 1.00 0.00 C ATOM 233 NH1 ARG A 14 25.172 9.420 -13.301 1.00 0.00 N ATOM 234 NH2 ARG A 14 23.390 10.658 -13.676 1.00 0.00 N ATOM 0 H ARG A 14 22.146 4.253 -14.023 1.00 0.00 H new ATOM 0 HA ARG A 14 21.574 4.407 -11.906 1.00 0.00 H new ATOM 0 HB2 ARG A 14 21.197 7.327 -12.669 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.210 6.753 -11.013 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.497 5.702 -11.504 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.477 6.545 -13.040 1.00 0.00 H new ATOM 0 HD2 ARG A 14 23.318 7.891 -10.303 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.763 7.780 -11.287 1.00 0.00 H new ATOM 0 HE ARG A 14 22.381 9.477 -11.789 1.00 0.00 H new ATOM 0 HH11 ARG A 14 25.662 8.677 -12.803 1.00 0.00 H new ATOM 0 HH12 ARG A 14 25.647 9.938 -14.040 1.00 0.00 H new ATOM 0 HH21 ARG A 14 22.425 10.924 -13.481 1.00 0.00 H new ATOM 0 HH22 ARG A 14 23.915 11.142 -14.404 1.00 0.00 H new ATOM 248 N SER A 15 18.688 5.809 -12.491 1.00 0.00 N ATOM 249 CA SER A 15 17.208 5.701 -12.349 1.00 0.00 C ATOM 250 C SER A 15 16.644 4.342 -12.787 1.00 0.00 C ATOM 251 O SER A 15 15.850 3.722 -12.091 1.00 0.00 O ATOM 252 CB SER A 15 16.568 6.819 -13.185 1.00 0.00 C ATOM 253 OG SER A 15 17.028 6.745 -14.536 1.00 0.00 O ATOM 0 H SER A 15 18.970 6.699 -12.902 1.00 0.00 H new ATOM 0 HA SER A 15 16.969 5.798 -11.290 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.482 6.729 -13.157 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.819 7.791 -12.760 1.00 0.00 H new ATOM 0 HG SER A 15 18.008 6.770 -14.550 1.00 0.00 H new ATOM 259 N GLN A 16 17.133 3.829 -13.915 1.00 0.00 N ATOM 260 CA GLN A 16 16.722 2.533 -14.490 1.00 0.00 C ATOM 261 C GLN A 16 17.190 1.340 -13.634 1.00 0.00 C ATOM 262 O GLN A 16 16.426 0.398 -13.432 1.00 0.00 O ATOM 263 CB GLN A 16 17.264 2.461 -15.934 1.00 0.00 C ATOM 264 CG GLN A 16 16.797 3.619 -16.845 1.00 0.00 C ATOM 265 CD GLN A 16 15.353 3.501 -17.323 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.561 2.713 -16.825 1.00 0.00 O ATOM 267 NE2 GLN A 16 14.977 4.291 -18.296 1.00 0.00 N ATOM 0 H GLN A 16 17.841 4.307 -14.472 1.00 0.00 H new ATOM 0 HA GLN A 16 15.634 2.466 -14.501 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.353 2.456 -15.901 1.00 0.00 H new ATOM 0 HB3 GLN A 16 16.954 1.516 -16.380 1.00 0.00 H new ATOM 0 HG2 GLN A 16 16.913 4.559 -16.306 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.452 3.668 -17.715 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.642 4.946 -18.707 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.019 4.252 -18.643 1.00 0.00 H new ATOM 276 N MET A 17 18.396 1.413 -13.049 1.00 0.00 N ATOM 277 CA MET A 17 18.891 0.444 -12.047 1.00 0.00 C ATOM 278 C MET A 17 18.118 0.554 -10.726 1.00 0.00 C ATOM 279 O MET A 17 17.859 -0.459 -10.088 1.00 0.00 O ATOM 280 CB MET A 17 20.388 0.668 -11.751 1.00 0.00 C ATOM 281 CG MET A 17 21.354 0.441 -12.916 1.00 0.00 C ATOM 282 SD MET A 17 23.071 0.668 -12.375 1.00 0.00 S ATOM 283 CE MET A 17 23.945 0.007 -13.815 1.00 0.00 C ATOM 0 H MET A 17 19.066 2.153 -13.258 1.00 0.00 H new ATOM 0 HA MET A 17 18.741 -0.548 -12.474 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.517 1.690 -11.395 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.677 0.007 -10.934 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.222 -0.565 -13.314 1.00 0.00 H new ATOM 0 HG3 MET A 17 21.127 1.136 -13.725 1.00 0.00 H new ATOM 0 HE1 MET A 17 25.020 0.071 -13.649 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.662 -1.035 -13.965 1.00 0.00 H new ATOM 0 HE3 MET A 17 23.679 0.586 -14.699 1.00 0.00 H new ATOM 293 N ALA A 18 17.706 1.764 -10.333 1.00 0.00 N ATOM 294 CA ALA A 18 16.929 1.995 -9.107 1.00 0.00 C ATOM 295 C ALA A 18 15.557 1.321 -9.200 1.00 0.00 C ATOM 296 O ALA A 18 15.157 0.613 -8.279 1.00 0.00 O ATOM 297 CB ALA A 18 16.838 3.506 -8.862 1.00 0.00 C ATOM 0 H ALA A 18 17.902 2.616 -10.858 1.00 0.00 H new ATOM 0 HA ALA A 18 17.427 1.542 -8.249 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.264 3.694 -7.955 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.841 3.917 -8.748 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.344 3.983 -9.709 1.00 0.00 H new ATOM 303 N GLU A 19 14.890 1.427 -10.357 1.00 0.00 N ATOM 304 CA GLU A 19 13.683 0.638 -10.636 1.00 0.00 C ATOM 305 C GLU A 19 13.997 -0.863 -10.637 1.00 0.00 C ATOM 306 O GLU A 19 13.272 -1.619 -10.006 1.00 0.00 O ATOM 307 CB GLU A 19 13.034 1.081 -11.958 1.00 0.00 C ATOM 308 CG GLU A 19 11.555 0.659 -12.023 1.00 0.00 C ATOM 309 CD GLU A 19 11.011 0.612 -13.464 1.00 0.00 C ATOM 310 OE1 GLU A 19 10.839 1.685 -14.088 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.727 -0.509 -13.953 1.00 0.00 O ATOM 0 H GLU A 19 15.166 2.051 -11.115 1.00 0.00 H new ATOM 0 HA GLU A 19 12.963 0.821 -9.838 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.110 2.164 -12.058 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.576 0.644 -12.796 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.442 -0.323 -11.564 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.957 1.356 -11.436 1.00 0.00 H new ATOM 318 N GLY A 20 15.107 -1.288 -11.254 1.00 0.00 N ATOM 319 CA GLY A 20 15.576 -2.686 -11.258 1.00 0.00 C ATOM 320 C GLY A 20 15.735 -3.312 -9.871 1.00 0.00 C ATOM 321 O GLY A 20 15.205 -4.392 -9.615 1.00 0.00 O ATOM 0 H GLY A 20 15.719 -0.660 -11.776 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.874 -3.288 -11.835 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.535 -2.732 -11.774 1.00 0.00 H new ATOM 325 N PHE A 21 16.398 -2.630 -8.936 1.00 0.00 N ATOM 326 CA PHE A 21 16.510 -3.121 -7.560 1.00 0.00 C ATOM 327 C PHE A 21 15.184 -3.029 -6.820 1.00 0.00 C ATOM 328 O PHE A 21 14.767 -4.007 -6.211 1.00 0.00 O ATOM 329 CB PHE A 21 17.628 -2.373 -6.828 1.00 0.00 C ATOM 330 CG PHE A 21 18.995 -2.816 -7.286 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.394 -4.148 -7.077 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.856 -1.916 -7.932 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.654 -4.581 -7.510 1.00 0.00 C ATOM 334 CE2 PHE A 21 21.119 -2.348 -8.370 1.00 0.00 C ATOM 335 CZ PHE A 21 21.517 -3.684 -8.158 1.00 0.00 C ATOM 0 H PHE A 21 16.865 -1.739 -9.105 1.00 0.00 H new ATOM 0 HA PHE A 21 16.771 -4.179 -7.590 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.518 -1.302 -6.996 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.533 -2.539 -5.755 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.728 -4.839 -6.582 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.548 -0.893 -8.092 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.961 -5.603 -7.345 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.784 -1.658 -8.868 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.487 -4.017 -8.495 1.00 0.00 H new ATOM 345 N ALA A 22 14.474 -1.909 -6.915 1.00 0.00 N ATOM 346 CA ALA A 22 13.220 -1.729 -6.186 1.00 0.00 C ATOM 347 C ALA A 22 12.117 -2.703 -6.633 1.00 0.00 C ATOM 348 O ALA A 22 11.447 -3.281 -5.781 1.00 0.00 O ATOM 349 CB ALA A 22 12.809 -0.261 -6.314 1.00 0.00 C ATOM 0 H ALA A 22 14.745 -1.111 -7.490 1.00 0.00 H new ATOM 0 HA ALA A 22 13.374 -1.973 -5.135 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.874 -0.097 -5.778 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.587 0.373 -5.889 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.673 -0.012 -7.366 1.00 0.00 H new ATOM 355 N LYS A 23 11.974 -2.982 -7.935 1.00 0.00 N ATOM 356 CA LYS A 23 10.949 -3.920 -8.456 1.00 0.00 C ATOM 357 C LYS A 23 11.197 -5.378 -8.046 1.00 0.00 C ATOM 358 O LYS A 23 10.268 -6.172 -7.953 1.00 0.00 O ATOM 359 CB LYS A 23 10.809 -3.750 -9.981 1.00 0.00 C ATOM 360 CG LYS A 23 11.952 -4.354 -10.815 1.00 0.00 C ATOM 361 CD LYS A 23 12.073 -3.754 -12.228 1.00 0.00 C ATOM 362 CE LYS A 23 10.892 -4.081 -13.152 1.00 0.00 C ATOM 363 NZ LYS A 23 10.923 -3.236 -14.380 1.00 0.00 N ATOM 0 H LYS A 23 12.559 -2.570 -8.662 1.00 0.00 H new ATOM 0 HA LYS A 23 9.997 -3.661 -7.992 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.870 -4.206 -10.297 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.739 -2.686 -10.207 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.893 -4.206 -10.286 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.799 -5.430 -10.899 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.166 -2.671 -12.144 1.00 0.00 H new ATOM 0 HD3 LYS A 23 12.992 -4.118 -12.688 1.00 0.00 H new ATOM 0 HE2 LYS A 23 10.925 -5.134 -13.430 1.00 0.00 H new ATOM 0 HE3 LYS A 23 9.954 -3.921 -12.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 10.363 -3.691 -15.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 10.522 -2.300 -14.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 11.906 -3.126 -14.701 1.00 0.00 H new ATOM 377 N THR A 24 12.462 -5.697 -7.770 1.00 0.00 N ATOM 378 CA THR A 24 12.928 -7.013 -7.288 1.00 0.00 C ATOM 379 C THR A 24 12.869 -7.135 -5.755 1.00 0.00 C ATOM 380 O THR A 24 12.238 -8.047 -5.228 1.00 0.00 O ATOM 381 CB THR A 24 14.360 -7.282 -7.779 1.00 0.00 C ATOM 382 OG1 THR A 24 14.442 -7.095 -9.175 1.00 0.00 O ATOM 383 CG2 THR A 24 14.818 -8.713 -7.499 1.00 0.00 C ATOM 0 H THR A 24 13.224 -5.027 -7.877 1.00 0.00 H new ATOM 0 HA THR A 24 12.250 -7.761 -7.699 1.00 0.00 H new ATOM 0 HB THR A 24 14.998 -6.583 -7.238 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.702 -6.170 -9.366 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.835 -8.848 -7.866 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.792 -8.900 -6.425 1.00 0.00 H new ATOM 0 HG23 THR A 24 14.154 -9.413 -8.005 1.00 0.00 H new ATOM 391 N LEU A 25 13.512 -6.208 -5.029 1.00 0.00 N ATOM 392 CA LEU A 25 13.697 -6.251 -3.565 1.00 0.00 C ATOM 393 C LEU A 25 12.452 -5.761 -2.809 1.00 0.00 C ATOM 394 O LEU A 25 12.159 -6.223 -1.708 1.00 0.00 O ATOM 395 CB LEU A 25 14.944 -5.411 -3.185 1.00 0.00 C ATOM 396 CG LEU A 25 16.244 -5.829 -3.900 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.366 -4.888 -3.482 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.668 -7.258 -3.564 1.00 0.00 C ATOM 0 H LEU A 25 13.931 -5.381 -5.455 1.00 0.00 H new ATOM 0 HA LEU A 25 13.850 -7.288 -3.268 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.742 -4.364 -3.410 1.00 0.00 H new ATOM 0 HB3 LEU A 25 15.099 -5.482 -2.108 1.00 0.00 H new ATOM 0 HG LEU A 25 16.053 -5.777 -4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 25 18.289 -5.177 -3.984 1.00 0.00 H new ATOM 0 HD12 LEU A 25 17.107 -3.866 -3.760 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.506 -4.946 -2.403 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.589 -7.499 -4.095 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.835 -7.345 -2.490 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.883 -7.951 -3.867 1.00 0.00 H new ATOM 410 N GLY A 26 11.711 -4.834 -3.424 1.00 0.00 N ATOM 411 CA GLY A 26 10.445 -4.280 -2.944 1.00 0.00 C ATOM 412 C GLY A 26 9.201 -4.926 -3.549 1.00 0.00 C ATOM 413 O GLY A 26 8.114 -4.384 -3.370 1.00 0.00 O ATOM 0 H GLY A 26 11.995 -4.430 -4.317 1.00 0.00 H new ATOM 0 HA2 GLY A 26 10.404 -4.387 -1.860 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.425 -3.212 -3.160 1.00 0.00 H new ATOM 417 N ALA A 27 9.322 -6.056 -4.253 1.00 0.00 N ATOM 418 CA ALA A 27 8.185 -6.772 -4.848 1.00 0.00 C ATOM 419 C ALA A 27 7.061 -7.052 -3.822 1.00 0.00 C ATOM 420 O ALA A 27 7.244 -7.818 -2.875 1.00 0.00 O ATOM 421 CB ALA A 27 8.704 -8.079 -5.464 1.00 0.00 C ATOM 0 H ALA A 27 10.221 -6.505 -4.429 1.00 0.00 H new ATOM 0 HA ALA A 27 7.740 -6.142 -5.618 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.874 -8.625 -5.911 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.444 -7.851 -6.231 1.00 0.00 H new ATOM 0 HB3 ALA A 27 9.164 -8.690 -4.687 1.00 0.00 H new ATOM 427 N GLY A 28 5.899 -6.404 -3.993 1.00 0.00 N ATOM 428 CA GLY A 28 4.735 -6.527 -3.095 1.00 0.00 C ATOM 429 C GLY A 28 4.754 -5.564 -1.897 1.00 0.00 C ATOM 430 O GLY A 28 3.717 -5.340 -1.270 1.00 0.00 O ATOM 0 H GLY A 28 5.736 -5.767 -4.773 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.826 -6.353 -3.671 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.685 -7.550 -2.723 1.00 0.00 H new ATOM 434 N LYS A 29 5.905 -4.936 -1.620 1.00 0.00 N ATOM 435 CA LYS A 29 6.062 -3.825 -0.662 1.00 0.00 C ATOM 436 C LYS A 29 5.768 -2.486 -1.334 1.00 0.00 C ATOM 437 O LYS A 29 5.120 -1.633 -0.737 1.00 0.00 O ATOM 438 CB LYS A 29 7.489 -3.849 -0.072 1.00 0.00 C ATOM 439 CG LYS A 29 7.667 -4.998 0.934 1.00 0.00 C ATOM 440 CD LYS A 29 9.119 -5.480 1.092 1.00 0.00 C ATOM 441 CE LYS A 29 10.103 -4.476 1.715 1.00 0.00 C ATOM 442 NZ LYS A 29 9.796 -4.212 3.154 1.00 0.00 N ATOM 0 H LYS A 29 6.783 -5.193 -2.070 1.00 0.00 H new ATOM 0 HA LYS A 29 5.345 -3.949 0.150 1.00 0.00 H new ATOM 0 HB2 LYS A 29 8.215 -3.955 -0.878 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.696 -2.899 0.420 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.296 -4.675 1.907 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.049 -5.839 0.620 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.116 -6.382 1.704 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.495 -5.763 0.109 1.00 0.00 H new ATOM 0 HE2 LYS A 29 11.119 -4.861 1.625 1.00 0.00 H new ATOM 0 HE3 LYS A 29 10.067 -3.539 1.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.683 -4.151 3.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.276 -3.315 3.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.214 -4.986 3.533 1.00 0.00 H new ATOM 456 N ILE A 30 6.231 -2.296 -2.574 1.00 0.00 N ATOM 457 CA ILE A 30 6.145 -1.029 -3.319 1.00 0.00 C ATOM 458 C ILE A 30 5.799 -1.214 -4.807 1.00 0.00 C ATOM 459 O ILE A 30 5.741 -2.332 -5.317 1.00 0.00 O ATOM 460 CB ILE A 30 7.454 -0.206 -3.134 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.771 -0.863 -3.595 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.671 0.158 -1.658 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.854 -1.286 -5.063 1.00 0.00 C ATOM 0 H ILE A 30 6.689 -3.037 -3.104 1.00 0.00 H new ATOM 0 HA ILE A 30 5.311 -0.469 -2.896 1.00 0.00 H new ATOM 0 HB ILE A 30 7.269 0.650 -3.783 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.586 -0.167 -3.395 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.946 -1.744 -2.977 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.592 0.732 -1.556 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.830 0.754 -1.303 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.745 -0.754 -1.065 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.829 -1.733 -5.258 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.071 -2.014 -5.277 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.721 -0.413 -5.701 1.00 0.00 H new ATOM 475 N ALA A 31 5.593 -0.088 -5.497 1.00 0.00 N ATOM 476 CA ALA A 31 5.488 0.004 -6.955 1.00 0.00 C ATOM 477 C ALA A 31 6.410 1.141 -7.440 1.00 0.00 C ATOM 478 O ALA A 31 6.562 2.149 -6.746 1.00 0.00 O ATOM 479 CB ALA A 31 4.022 0.166 -7.368 1.00 0.00 C ATOM 0 H ALA A 31 5.491 0.817 -5.038 1.00 0.00 H new ATOM 0 HA ALA A 31 5.826 -0.913 -7.438 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.955 0.233 -8.454 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.449 -0.694 -7.022 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.617 1.074 -6.922 1.00 0.00 H new ATOM 485 N VAL A 32 7.084 0.976 -8.581 1.00 0.00 N ATOM 486 CA VAL A 32 8.152 1.874 -9.028 1.00 0.00 C ATOM 487 C VAL A 32 8.130 2.204 -10.517 1.00 0.00 C ATOM 488 O VAL A 32 7.731 1.388 -11.351 1.00 0.00 O ATOM 489 CB VAL A 32 9.523 1.291 -8.669 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.924 1.782 -7.284 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.643 -0.234 -8.769 1.00 0.00 C ATOM 0 H VAL A 32 6.902 0.208 -9.227 1.00 0.00 H new ATOM 0 HA VAL A 32 7.970 2.811 -8.501 1.00 0.00 H new ATOM 0 HB VAL A 32 10.213 1.655 -9.430 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.899 1.372 -7.021 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.977 2.871 -7.285 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.184 1.455 -6.554 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.653 -0.538 -8.493 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.926 -0.700 -8.093 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.435 -0.549 -9.792 1.00 0.00 H new ATOM 501 N THR A 33 8.643 3.400 -10.820 1.00 0.00 N ATOM 502 CA THR A 33 8.735 3.973 -12.169 1.00 0.00 C ATOM 503 C THR A 33 10.070 4.710 -12.329 1.00 0.00 C ATOM 504 O THR A 33 10.580 5.284 -11.364 1.00 0.00 O ATOM 505 CB THR A 33 7.545 4.926 -12.411 1.00 0.00 C ATOM 506 OG1 THR A 33 6.323 4.318 -12.029 1.00 0.00 O ATOM 507 CG2 THR A 33 7.371 5.322 -13.878 1.00 0.00 C ATOM 0 H THR A 33 9.021 4.021 -10.105 1.00 0.00 H new ATOM 0 HA THR A 33 8.693 3.175 -12.910 1.00 0.00 H new ATOM 0 HB THR A 33 7.775 5.808 -11.814 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.584 4.941 -12.190 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.517 5.992 -13.975 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.271 5.828 -14.227 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.201 4.428 -14.478 1.00 0.00 H new ATOM 515 N SER A 34 10.648 4.713 -13.531 1.00 0.00 N ATOM 516 CA SER A 34 11.857 5.462 -13.889 1.00 0.00 C ATOM 517 C SER A 34 11.581 6.514 -14.977 1.00 0.00 C ATOM 518 O SER A 34 10.835 6.254 -15.923 1.00 0.00 O ATOM 519 CB SER A 34 12.921 4.473 -14.350 1.00 0.00 C ATOM 520 OG SER A 34 14.125 5.180 -14.546 1.00 0.00 O ATOM 0 H SER A 34 10.274 4.174 -14.312 1.00 0.00 H new ATOM 0 HA SER A 34 12.207 6.007 -13.012 1.00 0.00 H new ATOM 0 HB2 SER A 34 13.058 3.688 -13.606 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.612 3.986 -15.275 1.00 0.00 H new ATOM 0 HG SER A 34 14.824 4.560 -14.842 1.00 0.00 H new ATOM 526 N CYS A 35 12.176 7.702 -14.838 1.00 0.00 N ATOM 527 CA CYS A 35 12.052 8.824 -15.772 1.00 0.00 C ATOM 528 C CYS A 35 13.277 9.759 -15.743 1.00 0.00 C ATOM 529 O CYS A 35 14.250 9.542 -15.019 1.00 0.00 O ATOM 530 CB CYS A 35 10.753 9.578 -15.461 1.00 0.00 C ATOM 531 SG CYS A 35 10.886 10.568 -13.954 1.00 0.00 S ATOM 0 H CYS A 35 12.779 7.916 -14.044 1.00 0.00 H new ATOM 0 HA CYS A 35 12.014 8.431 -16.788 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.501 10.227 -16.300 1.00 0.00 H new ATOM 0 HB3 CYS A 35 9.936 8.864 -15.354 1.00 0.00 H new ATOM 0 HG CYS A 35 10.379 9.908 -12.955 1.00 0.00 H new ATOM 537 N GLY A 36 13.257 10.830 -16.532 1.00 0.00 N ATOM 538 CA GLY A 36 14.261 11.894 -16.457 1.00 0.00 C ATOM 539 C GLY A 36 13.735 13.235 -16.921 1.00 0.00 C ATOM 540 O GLY A 36 12.729 13.296 -17.613 1.00 0.00 O ATOM 0 H GLY A 36 12.544 10.987 -17.244 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.612 11.983 -15.429 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.122 11.617 -17.065 1.00 0.00 H new ATOM 544 N LEU A 37 14.406 14.329 -16.557 1.00 0.00 N ATOM 545 CA LEU A 37 13.984 15.668 -17.003 1.00 0.00 C ATOM 546 C LEU A 37 14.148 15.883 -18.521 1.00 0.00 C ATOM 547 O LEU A 37 13.542 16.782 -19.103 1.00 0.00 O ATOM 548 CB LEU A 37 14.584 16.802 -16.167 1.00 0.00 C ATOM 549 CG LEU A 37 16.123 16.815 -16.098 1.00 0.00 C ATOM 550 CD1 LEU A 37 16.645 18.242 -15.951 1.00 0.00 C ATOM 551 CD2 LEU A 37 16.597 16.025 -14.879 1.00 0.00 C ATOM 0 H LEU A 37 15.234 14.321 -15.962 1.00 0.00 H new ATOM 0 HA LEU A 37 12.911 15.708 -16.817 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.245 17.754 -16.577 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.190 16.733 -15.153 1.00 0.00 H new ATOM 0 HG LEU A 37 16.499 16.371 -17.020 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.734 18.228 -15.904 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.326 18.836 -16.807 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.248 18.682 -15.036 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.686 16.039 -14.837 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.193 16.477 -13.973 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.250 14.995 -14.956 1.00 0.00 H new ATOM 563 N GLU A 38 14.929 15.008 -19.146 1.00 0.00 N ATOM 564 CA GLU A 38 15.082 14.836 -20.591 1.00 0.00 C ATOM 565 C GLU A 38 15.011 13.331 -20.904 1.00 0.00 C ATOM 566 O GLU A 38 15.137 12.494 -20.003 1.00 0.00 O ATOM 567 CB GLU A 38 16.396 15.449 -21.112 1.00 0.00 C ATOM 568 CG GLU A 38 16.556 16.938 -20.781 1.00 0.00 C ATOM 569 CD GLU A 38 17.803 17.520 -21.476 1.00 0.00 C ATOM 570 OE1 GLU A 38 17.713 17.903 -22.667 1.00 0.00 O ATOM 571 OE2 GLU A 38 18.878 17.618 -20.834 1.00 0.00 O ATOM 0 H GLU A 38 15.512 14.355 -18.623 1.00 0.00 H new ATOM 0 HA GLU A 38 14.278 15.366 -21.102 1.00 0.00 H new ATOM 0 HB2 GLU A 38 17.236 14.899 -20.688 1.00 0.00 H new ATOM 0 HB3 GLU A 38 16.443 15.319 -22.193 1.00 0.00 H new ATOM 0 HG2 GLU A 38 15.668 17.484 -21.100 1.00 0.00 H new ATOM 0 HG3 GLU A 38 16.641 17.069 -19.702 1.00 0.00 H new ATOM 578 N SER A 39 14.832 12.969 -22.176 1.00 0.00 N ATOM 579 CA SER A 39 14.784 11.573 -22.624 1.00 0.00 C ATOM 580 C SER A 39 15.755 11.304 -23.777 1.00 0.00 C ATOM 581 O SER A 39 15.956 12.151 -24.655 1.00 0.00 O ATOM 582 CB SER A 39 13.354 11.200 -23.020 1.00 0.00 C ATOM 583 OG SER A 39 13.289 9.799 -23.216 1.00 0.00 O ATOM 0 H SER A 39 14.715 13.643 -22.933 1.00 0.00 H new ATOM 0 HA SER A 39 15.100 10.945 -21.791 1.00 0.00 H new ATOM 0 HB2 SER A 39 12.654 11.506 -22.242 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.066 11.723 -23.932 1.00 0.00 H new ATOM 0 HG SER A 39 12.377 9.546 -23.469 1.00 0.00 H new ATOM 589 N SER A 40 16.353 10.111 -23.768 1.00 0.00 N ATOM 590 CA SER A 40 17.256 9.605 -24.813 1.00 0.00 C ATOM 591 C SER A 40 16.950 8.133 -25.159 1.00 0.00 C ATOM 592 O SER A 40 16.000 7.857 -25.894 1.00 0.00 O ATOM 593 CB SER A 40 18.714 9.875 -24.411 1.00 0.00 C ATOM 594 OG SER A 40 19.019 9.214 -23.195 1.00 0.00 O ATOM 0 H SER A 40 16.219 9.444 -23.008 1.00 0.00 H new ATOM 0 HA SER A 40 17.086 10.146 -25.744 1.00 0.00 H new ATOM 0 HB2 SER A 40 19.385 9.531 -25.198 1.00 0.00 H new ATOM 0 HB3 SER A 40 18.875 10.947 -24.300 1.00 0.00 H new ATOM 0 HG SER A 40 18.447 9.564 -22.480 1.00 0.00 H new ATOM 600 N ARG A 41 17.726 7.190 -24.608 1.00 0.00 N ATOM 601 CA ARG A 41 17.533 5.729 -24.637 1.00 0.00 C ATOM 602 C ARG A 41 18.235 5.082 -23.438 1.00 0.00 C ATOM 603 O ARG A 41 19.226 5.624 -22.948 1.00 0.00 O ATOM 604 CB ARG A 41 18.028 5.133 -25.977 1.00 0.00 C ATOM 605 CG ARG A 41 19.551 5.106 -26.230 1.00 0.00 C ATOM 606 CD ARG A 41 20.273 6.465 -26.292 1.00 0.00 C ATOM 607 NE ARG A 41 19.751 7.325 -27.377 1.00 0.00 N ATOM 608 CZ ARG A 41 20.263 8.468 -27.801 1.00 0.00 C ATOM 609 NH1 ARG A 41 21.313 9.008 -27.250 1.00 0.00 N ATOM 610 NH2 ARG A 41 19.711 9.103 -28.794 1.00 0.00 N ATOM 0 H ARG A 41 18.568 7.444 -24.092 1.00 0.00 H new ATOM 0 HA ARG A 41 16.467 5.513 -24.562 1.00 0.00 H new ATOM 0 HB2 ARG A 41 17.658 4.110 -26.046 1.00 0.00 H new ATOM 0 HB3 ARG A 41 17.563 5.696 -26.787 1.00 0.00 H new ATOM 0 HG2 ARG A 41 20.015 4.511 -25.443 1.00 0.00 H new ATOM 0 HG3 ARG A 41 19.729 4.584 -27.170 1.00 0.00 H new ATOM 0 HD2 ARG A 41 20.160 6.979 -25.337 1.00 0.00 H new ATOM 0 HD3 ARG A 41 21.340 6.301 -26.442 1.00 0.00 H new ATOM 0 HE ARG A 41 18.906 7.002 -27.848 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.770 8.547 -26.463 1.00 0.00 H new ATOM 0 HH12 ARG A 41 21.678 9.891 -27.606 1.00 0.00 H new ATOM 0 HH21 ARG A 41 18.882 8.719 -29.247 1.00 0.00 H new ATOM 0 HH22 ARG A 41 20.108 9.985 -29.119 1.00 0.00 H new ATOM 624 N VAL A 42 17.789 3.903 -22.998 1.00 0.00 N ATOM 625 CA VAL A 42 18.538 3.121 -21.991 1.00 0.00 C ATOM 626 C VAL A 42 19.947 2.775 -22.487 1.00 0.00 C ATOM 627 O VAL A 42 20.132 2.369 -23.637 1.00 0.00 O ATOM 628 CB VAL A 42 17.747 1.880 -21.522 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.540 0.584 -21.334 1.00 0.00 C ATOM 630 CG2 VAL A 42 17.151 2.205 -20.154 1.00 0.00 C ATOM 0 H VAL A 42 16.923 3.466 -23.314 1.00 0.00 H new ATOM 0 HA VAL A 42 18.663 3.750 -21.110 1.00 0.00 H new ATOM 0 HB VAL A 42 17.031 1.690 -22.322 1.00 0.00 H new ATOM 0 HG11 VAL A 42 17.869 -0.209 -21.003 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.000 0.299 -22.280 1.00 0.00 H new ATOM 0 HG13 VAL A 42 19.316 0.738 -20.585 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.584 1.348 -19.791 1.00 0.00 H new ATOM 0 HG22 VAL A 42 17.953 2.432 -19.452 1.00 0.00 H new ATOM 0 HG23 VAL A 42 16.490 3.067 -20.241 1.00 0.00 H new ATOM 640 N HIS A 43 20.936 2.935 -21.606 1.00 0.00 N ATOM 641 CA HIS A 43 22.326 2.567 -21.879 1.00 0.00 C ATOM 642 C HIS A 43 22.450 1.041 -21.880 1.00 0.00 C ATOM 643 O HIS A 43 22.031 0.410 -20.909 1.00 0.00 O ATOM 644 CB HIS A 43 23.233 3.222 -20.830 1.00 0.00 C ATOM 645 CG HIS A 43 24.663 3.307 -21.276 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.593 2.267 -21.260 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.245 4.421 -21.794 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.731 2.796 -21.754 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.544 4.085 -22.082 1.00 0.00 N ATOM 0 H HIS A 43 20.793 3.327 -20.675 1.00 0.00 H new ATOM 0 HA HIS A 43 22.639 2.926 -22.860 1.00 0.00 H new ATOM 0 HB2 HIS A 43 22.864 4.224 -20.611 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.179 2.653 -19.902 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.777 5.382 -21.949 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.661 2.259 -21.869 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.248 4.708 -22.478 1.00 0.00 H new ATOM 657 N PRO A 44 23.008 0.403 -22.922 1.00 0.00 N ATOM 658 CA PRO A 44 22.926 -1.049 -23.041 1.00 0.00 C ATOM 659 C PRO A 44 23.784 -1.780 -21.996 1.00 0.00 C ATOM 660 O PRO A 44 23.435 -2.880 -21.568 1.00 0.00 O ATOM 661 CB PRO A 44 23.350 -1.339 -24.485 1.00 0.00 C ATOM 662 CG PRO A 44 24.310 -0.197 -24.816 1.00 0.00 C ATOM 663 CD PRO A 44 23.691 0.984 -24.069 1.00 0.00 C ATOM 0 HA PRO A 44 21.922 -1.421 -22.837 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.837 -2.310 -24.572 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.494 -1.351 -25.159 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.323 -0.407 -24.474 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.367 -0.013 -25.889 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.456 1.693 -23.753 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.995 1.530 -24.706 1.00 0.00 H new ATOM 671 N THR A 45 24.854 -1.144 -21.500 1.00 0.00 N ATOM 672 CA THR A 45 25.690 -1.690 -20.416 1.00 0.00 C ATOM 673 C THR A 45 24.940 -1.732 -19.082 1.00 0.00 C ATOM 674 O THR A 45 25.211 -2.608 -18.267 1.00 0.00 O ATOM 675 CB THR A 45 26.998 -0.890 -20.284 1.00 0.00 C ATOM 676 OG1 THR A 45 27.625 -0.746 -21.549 1.00 0.00 O ATOM 677 CG2 THR A 45 28.009 -1.552 -19.345 1.00 0.00 C ATOM 0 H THR A 45 25.167 -0.234 -21.838 1.00 0.00 H new ATOM 0 HA THR A 45 25.937 -2.718 -20.680 1.00 0.00 H new ATOM 0 HB THR A 45 26.711 0.077 -19.871 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.454 -0.234 -21.447 1.00 0.00 H new ATOM 0 HG21 THR A 45 28.911 -0.942 -19.293 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.575 -1.644 -18.349 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.263 -2.542 -19.723 1.00 0.00 H new ATOM 685 N ALA A 46 23.929 -0.883 -18.865 1.00 0.00 N ATOM 686 CA ALA A 46 23.105 -0.917 -17.652 1.00 0.00 C ATOM 687 C ALA A 46 22.399 -2.268 -17.478 1.00 0.00 C ATOM 688 O ALA A 46 22.441 -2.865 -16.405 1.00 0.00 O ATOM 689 CB ALA A 46 22.077 0.221 -17.732 1.00 0.00 C ATOM 0 H ALA A 46 23.659 -0.154 -19.525 1.00 0.00 H new ATOM 0 HA ALA A 46 23.750 -0.785 -16.783 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.454 0.212 -16.838 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.597 1.177 -17.803 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.450 0.083 -18.613 1.00 0.00 H new ATOM 695 N ILE A 47 21.813 -2.790 -18.557 1.00 0.00 N ATOM 696 CA ILE A 47 21.162 -4.109 -18.581 1.00 0.00 C ATOM 697 C ILE A 47 22.177 -5.211 -18.272 1.00 0.00 C ATOM 698 O ILE A 47 21.907 -6.065 -17.434 1.00 0.00 O ATOM 699 CB ILE A 47 20.494 -4.322 -19.955 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.334 -3.321 -20.168 1.00 0.00 C ATOM 701 CG2 ILE A 47 19.959 -5.753 -20.123 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.332 -2.759 -21.587 1.00 0.00 C ATOM 0 H ILE A 47 21.775 -2.305 -19.453 1.00 0.00 H new ATOM 0 HA ILE A 47 20.392 -4.153 -17.811 1.00 0.00 H new ATOM 0 HB ILE A 47 21.268 -4.152 -20.704 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.384 -3.817 -19.971 1.00 0.00 H new ATOM 0 HG13 ILE A 47 19.422 -2.504 -19.452 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.497 -5.856 -21.105 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.782 -6.462 -20.033 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.218 -5.957 -19.350 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.504 -2.060 -21.700 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.273 -2.241 -21.774 1.00 0.00 H new ATOM 0 HD13 ILE A 47 19.218 -3.575 -22.301 1.00 0.00 H new ATOM 714 N ALA A 48 23.376 -5.150 -18.860 1.00 0.00 N ATOM 715 CA ALA A 48 24.441 -6.122 -18.597 1.00 0.00 C ATOM 716 C ALA A 48 24.877 -6.125 -17.121 1.00 0.00 C ATOM 717 O ALA A 48 25.107 -7.175 -16.525 1.00 0.00 O ATOM 718 CB ALA A 48 25.620 -5.800 -19.513 1.00 0.00 C ATOM 0 H ALA A 48 23.635 -4.426 -19.531 1.00 0.00 H new ATOM 0 HA ALA A 48 24.064 -7.124 -18.804 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.425 -6.512 -19.334 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.301 -5.867 -20.553 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.976 -4.791 -19.307 1.00 0.00 H new ATOM 724 N MET A 49 24.933 -4.938 -16.511 1.00 0.00 N ATOM 725 CA MET A 49 25.323 -4.730 -15.111 1.00 0.00 C ATOM 726 C MET A 49 24.226 -5.143 -14.130 1.00 0.00 C ATOM 727 O MET A 49 24.547 -5.590 -13.033 1.00 0.00 O ATOM 728 CB MET A 49 25.746 -3.268 -14.925 1.00 0.00 C ATOM 729 CG MET A 49 26.988 -2.926 -15.756 1.00 0.00 C ATOM 730 SD MET A 49 28.567 -3.323 -14.957 1.00 0.00 S ATOM 731 CE MET A 49 28.938 -4.947 -15.657 1.00 0.00 C ATOM 0 H MET A 49 24.702 -4.068 -16.991 1.00 0.00 H new ATOM 0 HA MET A 49 26.169 -5.378 -14.883 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.924 -2.612 -15.212 1.00 0.00 H new ATOM 0 HB3 MET A 49 25.950 -3.080 -13.871 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.932 -3.460 -16.705 1.00 0.00 H new ATOM 0 HG3 MET A 49 26.971 -1.861 -15.988 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.938 -5.256 -15.351 1.00 0.00 H new ATOM 0 HE2 MET A 49 28.208 -5.673 -15.299 1.00 0.00 H new ATOM 0 HE3 MET A 49 28.892 -4.893 -16.745 1.00 0.00 H new ATOM 741 N MET A 50 22.950 -5.050 -14.508 1.00 0.00 N ATOM 742 CA MET A 50 21.849 -5.628 -13.726 1.00 0.00 C ATOM 743 C MET A 50 21.747 -7.150 -13.924 1.00 0.00 C ATOM 744 O MET A 50 21.417 -7.873 -12.984 1.00 0.00 O ATOM 745 CB MET A 50 20.529 -4.920 -14.074 1.00 0.00 C ATOM 746 CG MET A 50 20.525 -3.436 -13.679 1.00 0.00 C ATOM 747 SD MET A 50 20.947 -3.045 -11.956 1.00 0.00 S ATOM 748 CE MET A 50 19.739 -4.078 -11.089 1.00 0.00 C ATOM 0 H MET A 50 22.649 -4.575 -15.359 1.00 0.00 H new ATOM 0 HA MET A 50 22.058 -5.466 -12.668 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.348 -5.006 -15.145 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.706 -5.427 -13.570 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.225 -2.910 -14.328 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.534 -3.032 -13.886 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.331 -3.527 -10.242 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.932 -4.345 -11.771 1.00 0.00 H new ATOM 0 HE3 MET A 50 20.226 -4.985 -10.731 1.00 0.00 H new ATOM 758 N GLU A 51 22.133 -7.672 -15.090 1.00 0.00 N ATOM 759 CA GLU A 51 22.173 -9.117 -15.338 1.00 0.00 C ATOM 760 C GLU A 51 23.285 -9.830 -14.545 1.00 0.00 C ATOM 761 O GLU A 51 23.128 -11.011 -14.233 1.00 0.00 O ATOM 762 CB GLU A 51 22.299 -9.398 -16.844 1.00 0.00 C ATOM 763 CG GLU A 51 20.965 -9.266 -17.591 1.00 0.00 C ATOM 764 CD GLU A 51 20.125 -10.558 -17.471 1.00 0.00 C ATOM 765 OE1 GLU A 51 19.518 -10.813 -16.403 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.072 -11.336 -18.455 1.00 0.00 O ATOM 0 H GLU A 51 22.426 -7.108 -15.888 1.00 0.00 H new ATOM 0 HA GLU A 51 21.230 -9.529 -14.979 1.00 0.00 H new ATOM 0 HB2 GLU A 51 23.022 -8.707 -17.278 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.692 -10.404 -16.989 1.00 0.00 H new ATOM 0 HG2 GLU A 51 20.402 -8.424 -17.188 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.154 -9.049 -18.642 1.00 0.00 H new ATOM 773 N GLU A 52 24.352 -9.130 -14.115 1.00 0.00 N ATOM 774 CA GLU A 52 25.345 -9.705 -13.185 1.00 0.00 C ATOM 775 C GLU A 52 24.719 -10.129 -11.838 1.00 0.00 C ATOM 776 O GLU A 52 25.191 -11.074 -11.203 1.00 0.00 O ATOM 777 CB GLU A 52 26.463 -8.708 -12.858 1.00 0.00 C ATOM 778 CG GLU A 52 27.351 -8.283 -14.033 1.00 0.00 C ATOM 779 CD GLU A 52 28.702 -7.740 -13.522 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.708 -6.940 -12.552 1.00 0.00 O ATOM 781 OE2 GLU A 52 29.764 -8.128 -14.061 1.00 0.00 O ATOM 0 H GLU A 52 24.549 -8.169 -14.395 1.00 0.00 H new ATOM 0 HA GLU A 52 25.742 -10.577 -13.704 1.00 0.00 H new ATOM 0 HB2 GLU A 52 26.011 -7.814 -12.428 1.00 0.00 H new ATOM 0 HB3 GLU A 52 27.099 -9.145 -12.088 1.00 0.00 H new ATOM 0 HG2 GLU A 52 27.521 -9.133 -14.694 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.844 -7.518 -14.621 1.00 0.00 H new ATOM 788 N VAL A 53 23.645 -9.443 -11.414 1.00 0.00 N ATOM 789 CA VAL A 53 22.861 -9.743 -10.198 1.00 0.00 C ATOM 790 C VAL A 53 21.521 -10.437 -10.509 1.00 0.00 C ATOM 791 O VAL A 53 20.682 -10.599 -9.625 1.00 0.00 O ATOM 792 CB VAL A 53 22.707 -8.497 -9.292 1.00 0.00 C ATOM 793 CG1 VAL A 53 24.069 -8.014 -8.783 1.00 0.00 C ATOM 794 CG2 VAL A 53 22.024 -7.320 -9.996 1.00 0.00 C ATOM 0 H VAL A 53 23.284 -8.636 -11.923 1.00 0.00 H new ATOM 0 HA VAL A 53 23.434 -10.471 -9.624 1.00 0.00 H new ATOM 0 HB VAL A 53 22.076 -8.821 -8.464 1.00 0.00 H new ATOM 0 HG11 VAL A 53 23.931 -7.138 -8.149 1.00 0.00 H new ATOM 0 HG12 VAL A 53 24.544 -8.808 -8.206 1.00 0.00 H new ATOM 0 HG13 VAL A 53 24.702 -7.752 -9.631 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.947 -6.479 -9.307 1.00 0.00 H new ATOM 0 HG22 VAL A 53 22.612 -7.025 -10.865 1.00 0.00 H new ATOM 0 HG23 VAL A 53 21.026 -7.618 -10.318 1.00 0.00 H new ATOM 804 N GLY A 54 21.319 -10.875 -11.761 1.00 0.00 N ATOM 805 CA GLY A 54 20.138 -11.625 -12.212 1.00 0.00 C ATOM 806 C GLY A 54 18.843 -10.804 -12.325 1.00 0.00 C ATOM 807 O GLY A 54 17.755 -11.380 -12.285 1.00 0.00 O ATOM 0 H GLY A 54 21.993 -10.712 -12.509 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.357 -12.064 -13.185 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.966 -12.451 -11.521 1.00 0.00 H new ATOM 811 N ILE A 55 18.946 -9.474 -12.429 1.00 0.00 N ATOM 812 CA ILE A 55 17.808 -8.542 -12.522 1.00 0.00 C ATOM 813 C ILE A 55 17.659 -8.036 -13.964 1.00 0.00 C ATOM 814 O ILE A 55 18.634 -7.607 -14.583 1.00 0.00 O ATOM 815 CB ILE A 55 17.974 -7.391 -11.505 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.898 -7.938 -10.060 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.921 -6.289 -11.716 1.00 0.00 C ATOM 818 CD1 ILE A 55 18.069 -6.889 -8.951 1.00 0.00 C ATOM 0 H ILE A 55 19.848 -8.999 -12.452 1.00 0.00 H new ATOM 0 HA ILE A 55 16.886 -9.063 -12.265 1.00 0.00 H new ATOM 0 HB ILE A 55 18.955 -6.945 -11.667 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.935 -8.431 -9.926 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.666 -8.701 -9.937 1.00 0.00 H new ATOM 0 HG21 ILE A 55 17.071 -5.497 -10.982 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.022 -5.877 -12.720 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.923 -6.711 -11.596 1.00 0.00 H new ATOM 0 HD11 ILE A 55 18.000 -7.374 -7.977 1.00 0.00 H new ATOM 0 HD12 ILE A 55 19.044 -6.411 -9.050 1.00 0.00 H new ATOM 0 HD13 ILE A 55 17.285 -6.136 -9.038 1.00 0.00 H new ATOM 830 N ASP A 56 16.428 -8.035 -14.485 1.00 0.00 N ATOM 831 CA ASP A 56 16.123 -7.573 -15.842 1.00 0.00 C ATOM 832 C ASP A 56 15.531 -6.152 -15.858 1.00 0.00 C ATOM 833 O ASP A 56 14.509 -5.884 -15.222 1.00 0.00 O ATOM 834 CB ASP A 56 15.198 -8.582 -16.539 1.00 0.00 C ATOM 835 CG ASP A 56 14.802 -8.129 -17.955 1.00 0.00 C ATOM 836 OD1 ASP A 56 15.636 -7.496 -18.645 1.00 0.00 O ATOM 837 OD2 ASP A 56 13.650 -8.392 -18.373 1.00 0.00 O ATOM 0 H ASP A 56 15.608 -8.358 -13.972 1.00 0.00 H new ATOM 0 HA ASP A 56 17.059 -7.514 -16.397 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.696 -9.550 -16.596 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.298 -8.721 -15.940 1.00 0.00 H new ATOM 842 N ILE A 57 16.157 -5.258 -16.637 1.00 0.00 N ATOM 843 CA ILE A 57 15.641 -3.912 -16.965 1.00 0.00 C ATOM 844 C ILE A 57 15.516 -3.667 -18.487 1.00 0.00 C ATOM 845 O ILE A 57 15.309 -2.535 -18.911 1.00 0.00 O ATOM 846 CB ILE A 57 16.432 -2.799 -16.230 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.916 -2.764 -16.652 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.307 -2.945 -14.701 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.638 -1.470 -16.255 1.00 0.00 C ATOM 0 H ILE A 57 17.060 -5.452 -17.070 1.00 0.00 H new ATOM 0 HA ILE A 57 14.620 -3.867 -16.587 1.00 0.00 H new ATOM 0 HB ILE A 57 15.986 -1.849 -16.524 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.433 -3.611 -16.202 1.00 0.00 H new ATOM 0 HG13 ILE A 57 17.981 -2.889 -17.733 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.872 -2.151 -14.212 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.258 -2.874 -14.413 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.703 -3.913 -14.394 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.676 -1.517 -16.584 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.146 -0.619 -16.727 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.606 -1.353 -15.172 1.00 0.00 H new ATOM 861 N SER A 58 15.626 -4.702 -19.331 1.00 0.00 N ATOM 862 CA SER A 58 15.611 -4.581 -20.803 1.00 0.00 C ATOM 863 C SER A 58 14.253 -4.118 -21.362 1.00 0.00 C ATOM 864 O SER A 58 14.193 -3.472 -22.412 1.00 0.00 O ATOM 865 CB SER A 58 16.025 -5.921 -21.428 1.00 0.00 C ATOM 866 OG SER A 58 16.333 -5.762 -22.806 1.00 0.00 O ATOM 0 H SER A 58 15.730 -5.664 -19.009 1.00 0.00 H new ATOM 0 HA SER A 58 16.326 -3.804 -21.072 1.00 0.00 H new ATOM 0 HB2 SER A 58 16.891 -6.321 -20.901 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.219 -6.646 -21.312 1.00 0.00 H new ATOM 0 HG SER A 58 16.596 -6.627 -23.184 1.00 0.00 H new ATOM 872 N GLY A 59 13.161 -4.371 -20.624 1.00 0.00 N ATOM 873 CA GLY A 59 11.815 -3.851 -20.912 1.00 0.00 C ATOM 874 C GLY A 59 11.616 -2.349 -20.625 1.00 0.00 C ATOM 875 O GLY A 59 10.512 -1.834 -20.820 1.00 0.00 O ATOM 0 H GLY A 59 13.190 -4.957 -19.790 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.588 -4.037 -21.962 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.091 -4.416 -20.324 1.00 0.00 H new ATOM 879 N GLN A 60 12.655 -1.645 -20.154 1.00 0.00 N ATOM 880 CA GLN A 60 12.658 -0.205 -19.879 1.00 0.00 C ATOM 881 C GLN A 60 13.544 0.542 -20.885 1.00 0.00 C ATOM 882 O GLN A 60 14.544 0.021 -21.379 1.00 0.00 O ATOM 883 CB GLN A 60 13.200 0.069 -18.464 1.00 0.00 C ATOM 884 CG GLN A 60 12.354 -0.488 -17.307 1.00 0.00 C ATOM 885 CD GLN A 60 13.198 -0.778 -16.066 1.00 0.00 C ATOM 886 OE1 GLN A 60 13.183 -1.882 -15.539 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.979 0.164 -15.572 1.00 0.00 N ATOM 0 H GLN A 60 13.552 -2.083 -19.946 1.00 0.00 H new ATOM 0 HA GLN A 60 11.630 0.147 -19.963 1.00 0.00 H new ATOM 0 HB2 GLN A 60 14.203 -0.351 -18.391 1.00 0.00 H new ATOM 0 HB3 GLN A 60 13.296 1.147 -18.334 1.00 0.00 H new ATOM 0 HG2 GLN A 60 11.571 0.227 -17.054 1.00 0.00 H new ATOM 0 HG3 GLN A 60 11.857 -1.403 -17.629 1.00 0.00 H new ATOM 0 HE21 GLN A 60 13.999 1.088 -16.004 1.00 0.00 H new ATOM 0 HE22 GLN A 60 14.562 -0.032 -14.759 1.00 0.00 H new ATOM 896 N THR A 61 13.207 1.805 -21.142 1.00 0.00 N ATOM 897 CA THR A 61 14.018 2.771 -21.871 1.00 0.00 C ATOM 898 C THR A 61 13.675 4.146 -21.306 1.00 0.00 C ATOM 899 O THR A 61 12.915 4.266 -20.338 1.00 0.00 O ATOM 900 CB THR A 61 13.874 2.662 -23.391 1.00 0.00 C ATOM 901 OG1 THR A 61 14.895 3.440 -23.987 1.00 0.00 O ATOM 902 CG2 THR A 61 12.516 3.107 -23.928 1.00 0.00 C ATOM 0 H THR A 61 12.318 2.198 -20.832 1.00 0.00 H new ATOM 0 HA THR A 61 15.079 2.569 -21.723 1.00 0.00 H new ATOM 0 HB THR A 61 13.960 1.606 -23.646 1.00 0.00 H new ATOM 0 HG1 THR A 61 14.822 3.383 -24.963 1.00 0.00 H new ATOM 0 HG21 THR A 61 12.500 2.997 -25.012 1.00 0.00 H new ATOM 0 HG22 THR A 61 11.731 2.491 -23.489 1.00 0.00 H new ATOM 0 HG23 THR A 61 12.346 4.151 -23.666 1.00 0.00 H new ATOM 910 N SER A 62 14.287 5.178 -21.855 1.00 0.00 N ATOM 911 CA SER A 62 14.124 6.537 -21.365 1.00 0.00 C ATOM 912 C SER A 62 12.704 7.089 -21.585 1.00 0.00 C ATOM 913 O SER A 62 12.137 6.936 -22.669 1.00 0.00 O ATOM 914 CB SER A 62 15.127 7.426 -22.053 1.00 0.00 C ATOM 915 OG SER A 62 16.442 7.038 -21.688 1.00 0.00 O ATOM 0 H SER A 62 14.914 5.099 -22.656 1.00 0.00 H new ATOM 0 HA SER A 62 14.290 6.521 -20.288 1.00 0.00 H new ATOM 0 HB2 SER A 62 15.005 7.359 -23.134 1.00 0.00 H new ATOM 0 HB3 SER A 62 14.955 8.466 -21.777 1.00 0.00 H new ATOM 0 HG SER A 62 16.934 7.819 -21.357 1.00 0.00 H new ATOM 921 N ASP A 63 12.156 7.775 -20.576 1.00 0.00 N ATOM 922 CA ASP A 63 10.894 8.533 -20.645 1.00 0.00 C ATOM 923 C ASP A 63 10.953 9.878 -19.874 1.00 0.00 C ATOM 924 O ASP A 63 11.594 9.954 -18.816 1.00 0.00 O ATOM 925 CB ASP A 63 9.714 7.691 -20.132 1.00 0.00 C ATOM 926 CG ASP A 63 9.257 6.638 -21.156 1.00 0.00 C ATOM 927 OD1 ASP A 63 8.677 7.026 -22.199 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.422 5.420 -20.902 1.00 0.00 O ATOM 0 H ASP A 63 12.591 7.822 -19.655 1.00 0.00 H new ATOM 0 HA ASP A 63 10.742 8.767 -21.699 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.002 7.193 -19.206 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.878 8.349 -19.893 1.00 0.00 H new ATOM 933 N PRO A 64 10.280 10.945 -20.360 1.00 0.00 N ATOM 934 CA PRO A 64 10.412 12.300 -19.813 1.00 0.00 C ATOM 935 C PRO A 64 9.487 12.592 -18.617 1.00 0.00 C ATOM 936 O PRO A 64 8.319 12.207 -18.598 1.00 0.00 O ATOM 937 CB PRO A 64 10.107 13.227 -20.997 1.00 0.00 C ATOM 938 CG PRO A 64 9.060 12.436 -21.783 1.00 0.00 C ATOM 939 CD PRO A 64 9.514 10.988 -21.602 1.00 0.00 C ATOM 0 HA PRO A 64 11.410 12.446 -19.400 1.00 0.00 H new ATOM 0 HB2 PRO A 64 9.722 14.192 -20.667 1.00 0.00 H new ATOM 0 HB3 PRO A 64 10.996 13.426 -21.595 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.056 12.596 -21.391 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.042 12.725 -22.834 1.00 0.00 H new ATOM 0 HD2 PRO A 64 8.657 10.316 -21.552 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.124 10.665 -22.445 1.00 0.00 H new ATOM 947 N ILE A 65 9.987 13.386 -17.664 1.00 0.00 N ATOM 948 CA ILE A 65 9.299 13.879 -16.457 1.00 0.00 C ATOM 949 C ILE A 65 7.975 14.584 -16.801 1.00 0.00 C ATOM 950 O ILE A 65 6.982 14.434 -16.096 1.00 0.00 O ATOM 951 CB ILE A 65 10.288 14.806 -15.693 1.00 0.00 C ATOM 952 CG1 ILE A 65 9.915 14.932 -14.214 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.435 16.214 -16.313 1.00 0.00 C ATOM 954 CD1 ILE A 65 10.922 15.741 -13.387 1.00 0.00 C ATOM 0 H ILE A 65 10.947 13.726 -17.715 1.00 0.00 H new ATOM 0 HA ILE A 65 9.018 13.043 -15.816 1.00 0.00 H new ATOM 0 HB ILE A 65 11.257 14.315 -15.785 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.934 15.401 -14.135 1.00 0.00 H new ATOM 0 HG13 ILE A 65 9.826 13.934 -13.785 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.141 16.799 -15.724 1.00 0.00 H new ATOM 0 HG22 ILE A 65 10.802 16.125 -17.335 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.466 16.712 -16.318 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.589 15.786 -12.350 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.900 15.261 -13.434 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.994 16.752 -13.789 1.00 0.00 H new ATOM 966 N GLU A 66 7.946 15.290 -17.938 1.00 0.00 N ATOM 967 CA GLU A 66 6.792 16.081 -18.400 1.00 0.00 C ATOM 968 C GLU A 66 5.524 15.247 -18.686 1.00 0.00 C ATOM 969 O GLU A 66 4.418 15.790 -18.623 1.00 0.00 O ATOM 970 CB GLU A 66 7.179 16.872 -19.663 1.00 0.00 C ATOM 971 CG GLU A 66 8.335 17.855 -19.436 1.00 0.00 C ATOM 972 CD GLU A 66 8.537 18.757 -20.671 1.00 0.00 C ATOM 973 OE1 GLU A 66 9.244 18.343 -21.622 1.00 0.00 O ATOM 974 OE2 GLU A 66 8.000 19.890 -20.695 1.00 0.00 O ATOM 0 H GLU A 66 8.739 15.330 -18.578 1.00 0.00 H new ATOM 0 HA GLU A 66 6.538 16.750 -17.578 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.457 16.171 -20.450 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.308 17.423 -20.019 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.128 18.470 -18.560 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.252 17.303 -19.229 1.00 0.00 H new ATOM 981 N ASN A 67 5.654 13.940 -18.974 1.00 0.00 N ATOM 982 CA ASN A 67 4.498 13.051 -19.195 1.00 0.00 C ATOM 983 C ASN A 67 3.953 12.409 -17.895 1.00 0.00 C ATOM 984 O ASN A 67 2.870 11.821 -17.907 1.00 0.00 O ATOM 985 CB ASN A 67 4.838 12.016 -20.297 1.00 0.00 C ATOM 986 CG ASN A 67 5.082 10.612 -19.765 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.291 9.698 -19.958 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.157 10.395 -19.048 1.00 0.00 N ATOM 0 H ASN A 67 6.556 13.472 -19.060 1.00 0.00 H new ATOM 0 HA ASN A 67 3.668 13.662 -19.549 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.021 11.985 -21.018 1.00 0.00 H new ATOM 0 HB3 ASN A 67 5.725 12.350 -20.835 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.330 9.470 -18.655 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.821 11.151 -18.883 1.00 0.00 H new ATOM 995 N PHE A 68 4.703 12.495 -16.790 1.00 0.00 N ATOM 996 CA PHE A 68 4.447 11.777 -15.537 1.00 0.00 C ATOM 997 C PHE A 68 3.753 12.648 -14.469 1.00 0.00 C ATOM 998 O PHE A 68 3.581 13.858 -14.635 1.00 0.00 O ATOM 999 CB PHE A 68 5.772 11.167 -15.051 1.00 0.00 C ATOM 1000 CG PHE A 68 6.273 9.968 -15.842 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.463 8.826 -15.996 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.564 9.977 -16.398 1.00 0.00 C ATOM 1003 CE1 PHE A 68 5.929 7.714 -16.718 1.00 0.00 C ATOM 1004 CE2 PHE A 68 8.028 8.865 -17.128 1.00 0.00 C ATOM 1005 CZ PHE A 68 7.213 7.732 -17.286 1.00 0.00 C ATOM 0 H PHE A 68 5.533 13.086 -16.743 1.00 0.00 H new ATOM 0 HA PHE A 68 3.732 10.976 -15.725 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.538 11.942 -15.075 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.653 10.869 -14.009 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.477 8.805 -15.556 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.202 10.838 -16.265 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.299 6.845 -16.836 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.014 8.884 -17.568 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.572 6.879 -17.842 1.00 0.00 H new ATOM 1015 N ASN A 69 3.330 12.013 -13.368 1.00 0.00 N ATOM 1016 CA ASN A 69 2.465 12.598 -12.329 1.00 0.00 C ATOM 1017 C ASN A 69 3.089 12.543 -10.917 1.00 0.00 C ATOM 1018 O ASN A 69 2.762 11.671 -10.108 1.00 0.00 O ATOM 1019 CB ASN A 69 1.063 11.950 -12.427 1.00 0.00 C ATOM 1020 CG ASN A 69 1.043 10.427 -12.544 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.663 9.868 -13.562 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.427 9.709 -11.515 1.00 0.00 N ATOM 0 H ASN A 69 3.587 11.047 -13.167 1.00 0.00 H new ATOM 0 HA ASN A 69 2.358 13.667 -12.512 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.489 12.236 -11.546 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.549 12.369 -13.292 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.407 8.691 -11.568 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.745 10.169 -10.662 1.00 0.00 H new ATOM 1029 N ALA A 70 3.960 13.506 -10.598 1.00 0.00 N ATOM 1030 CA ALA A 70 4.661 13.585 -9.307 1.00 0.00 C ATOM 1031 C ALA A 70 3.728 13.577 -8.080 1.00 0.00 C ATOM 1032 O ALA A 70 4.126 13.133 -7.003 1.00 0.00 O ATOM 1033 CB ALA A 70 5.538 14.839 -9.265 1.00 0.00 C ATOM 0 H ALA A 70 4.203 14.264 -11.236 1.00 0.00 H new ATOM 0 HA ALA A 70 5.266 12.681 -9.243 1.00 0.00 H new ATOM 0 HB1 ALA A 70 6.054 14.890 -8.306 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.272 14.797 -10.070 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.914 15.724 -9.389 1.00 0.00 H new ATOM 1039 N ASP A 71 2.498 14.066 -8.248 1.00 0.00 N ATOM 1040 CA ASP A 71 1.456 14.106 -7.218 1.00 0.00 C ATOM 1041 C ASP A 71 1.093 12.724 -6.640 1.00 0.00 C ATOM 1042 O ASP A 71 0.756 12.619 -5.458 1.00 0.00 O ATOM 1043 CB ASP A 71 0.211 14.745 -7.847 1.00 0.00 C ATOM 1044 CG ASP A 71 -0.929 14.919 -6.826 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -0.802 15.773 -5.915 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -1.968 14.224 -6.951 1.00 0.00 O ATOM 0 H ASP A 71 2.188 14.459 -9.137 1.00 0.00 H new ATOM 0 HA ASP A 71 1.839 14.684 -6.377 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.474 15.717 -8.265 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.135 14.126 -8.674 1.00 0.00 H new ATOM 1051 N ASP A 72 1.177 11.666 -7.455 1.00 0.00 N ATOM 1052 CA ASP A 72 0.820 10.300 -7.045 1.00 0.00 C ATOM 1053 C ASP A 72 1.999 9.497 -6.479 1.00 0.00 C ATOM 1054 O ASP A 72 1.797 8.633 -5.627 1.00 0.00 O ATOM 1055 CB ASP A 72 0.181 9.554 -8.219 1.00 0.00 C ATOM 1056 CG ASP A 72 -0.379 8.183 -7.791 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -1.287 8.139 -6.924 1.00 0.00 O ATOM 1058 OD2 ASP A 72 0.074 7.147 -8.332 1.00 0.00 O ATOM 0 H ASP A 72 1.496 11.732 -8.422 1.00 0.00 H new ATOM 0 HA ASP A 72 0.104 10.398 -6.229 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.622 10.159 -8.640 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.921 9.414 -9.007 1.00 0.00 H new ATOM 1063 N TYR A 73 3.232 9.772 -6.916 1.00 0.00 N ATOM 1064 CA TYR A 73 4.421 9.104 -6.396 1.00 0.00 C ATOM 1065 C TYR A 73 4.674 9.603 -4.971 1.00 0.00 C ATOM 1066 O TYR A 73 5.063 10.752 -4.775 1.00 0.00 O ATOM 1067 CB TYR A 73 5.625 9.350 -7.327 1.00 0.00 C ATOM 1068 CG TYR A 73 5.346 9.197 -8.812 1.00 0.00 C ATOM 1069 CD1 TYR A 73 4.573 8.126 -9.302 1.00 0.00 C ATOM 1070 CD2 TYR A 73 5.845 10.164 -9.705 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.243 8.059 -10.669 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.510 10.103 -11.071 1.00 0.00 C ATOM 1073 CZ TYR A 73 4.686 9.065 -11.551 1.00 0.00 C ATOM 1074 OH TYR A 73 4.317 9.048 -12.860 1.00 0.00 O ATOM 0 H TYR A 73 3.430 10.464 -7.639 1.00 0.00 H new ATOM 0 HA TYR A 73 4.270 8.025 -6.362 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.001 10.357 -7.148 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.422 8.659 -7.052 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.233 7.354 -8.627 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.486 10.954 -9.342 1.00 0.00 H new ATOM 0 HE1 TYR A 73 3.650 7.237 -11.042 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.885 10.853 -11.752 1.00 0.00 H new ATOM 0 HH TYR A 73 5.100 8.861 -13.418 1.00 0.00 H new ATOM 1084 N ASP A 74 4.457 8.749 -3.965 1.00 0.00 N ATOM 1085 CA ASP A 74 4.652 9.110 -2.553 1.00 0.00 C ATOM 1086 C ASP A 74 6.084 9.606 -2.288 1.00 0.00 C ATOM 1087 O ASP A 74 6.302 10.488 -1.457 1.00 0.00 O ATOM 1088 CB ASP A 74 4.348 7.890 -1.676 1.00 0.00 C ATOM 1089 CG ASP A 74 2.928 7.362 -1.901 1.00 0.00 C ATOM 1090 OD1 ASP A 74 1.965 7.888 -1.301 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.792 6.411 -2.706 1.00 0.00 O ATOM 0 H ASP A 74 4.142 7.789 -4.104 1.00 0.00 H new ATOM 0 HA ASP A 74 3.972 9.926 -2.308 1.00 0.00 H new ATOM 0 HB2 ASP A 74 5.067 7.100 -1.892 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.474 8.157 -0.627 1.00 0.00 H new ATOM 1096 N VAL A 75 7.051 9.085 -3.048 1.00 0.00 N ATOM 1097 CA VAL A 75 8.464 9.462 -2.980 1.00 0.00 C ATOM 1098 C VAL A 75 9.013 9.755 -4.376 1.00 0.00 C ATOM 1099 O VAL A 75 8.761 8.995 -5.313 1.00 0.00 O ATOM 1100 CB VAL A 75 9.286 8.341 -2.327 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.754 8.747 -2.170 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.717 7.933 -0.961 1.00 0.00 C ATOM 0 H VAL A 75 6.866 8.367 -3.749 1.00 0.00 H new ATOM 0 HA VAL A 75 8.544 10.364 -2.374 1.00 0.00 H new ATOM 0 HB VAL A 75 9.224 7.482 -2.995 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.309 7.932 -1.705 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.179 8.962 -3.150 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.821 9.636 -1.543 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.329 7.138 -0.535 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.724 8.794 -0.292 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.694 7.577 -1.084 1.00 0.00 H new ATOM 1112 N VAL A 76 9.825 10.806 -4.513 1.00 0.00 N ATOM 1113 CA VAL A 76 10.568 11.119 -5.751 1.00 0.00 C ATOM 1114 C VAL A 76 12.058 11.242 -5.447 1.00 0.00 C ATOM 1115 O VAL A 76 12.445 11.846 -4.452 1.00 0.00 O ATOM 1116 CB VAL A 76 10.026 12.396 -6.421 1.00 0.00 C ATOM 1117 CG1 VAL A 76 10.939 12.956 -7.519 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.674 12.126 -7.094 1.00 0.00 C ATOM 0 H VAL A 76 9.992 11.476 -3.762 1.00 0.00 H new ATOM 0 HA VAL A 76 10.425 10.301 -6.457 1.00 0.00 H new ATOM 0 HB VAL A 76 9.952 13.119 -5.608 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.490 13.854 -7.943 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.911 13.203 -7.093 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.066 12.209 -8.303 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.310 13.042 -7.560 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.794 11.354 -7.854 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.956 11.790 -6.346 1.00 0.00 H new ATOM 1128 N ILE A 77 12.906 10.683 -6.307 1.00 0.00 N ATOM 1129 CA ILE A 77 14.363 10.671 -6.145 1.00 0.00 C ATOM 1130 C ILE A 77 15.023 11.319 -7.362 1.00 0.00 C ATOM 1131 O ILE A 77 14.675 10.969 -8.484 1.00 0.00 O ATOM 1132 CB ILE A 77 14.858 9.220 -5.987 1.00 0.00 C ATOM 1133 CG1 ILE A 77 14.084 8.368 -4.952 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.362 9.186 -5.681 1.00 0.00 C ATOM 1135 CD1 ILE A 77 14.155 8.865 -3.505 1.00 0.00 C ATOM 0 H ILE A 77 12.594 10.214 -7.157 1.00 0.00 H new ATOM 0 HA ILE A 77 14.630 11.236 -5.252 1.00 0.00 H new ATOM 0 HB ILE A 77 14.658 8.755 -6.952 1.00 0.00 H new ATOM 0 HG12 ILE A 77 13.037 8.325 -5.252 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.467 7.348 -4.987 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.688 8.151 -5.574 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.910 9.657 -6.497 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.557 9.726 -4.754 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.580 8.198 -2.863 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.194 8.880 -3.176 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.741 9.872 -3.445 1.00 0.00 H new ATOM 1147 N SER A 78 16.004 12.198 -7.164 1.00 0.00 N ATOM 1148 CA SER A 78 16.866 12.719 -8.241 1.00 0.00 C ATOM 1149 C SER A 78 18.236 12.032 -8.242 1.00 0.00 C ATOM 1150 O SER A 78 18.823 11.803 -7.191 1.00 0.00 O ATOM 1151 CB SER A 78 17.017 14.234 -8.138 1.00 0.00 C ATOM 1152 OG SER A 78 17.761 14.681 -9.262 1.00 0.00 O ATOM 0 H SER A 78 16.231 12.577 -6.244 1.00 0.00 H new ATOM 0 HA SER A 78 16.380 12.491 -9.190 1.00 0.00 H new ATOM 0 HB2 SER A 78 16.038 14.713 -8.114 1.00 0.00 H new ATOM 0 HB3 SER A 78 17.526 14.504 -7.213 1.00 0.00 H new ATOM 0 HG SER A 78 17.869 15.654 -9.217 1.00 0.00 H new ATOM 1158 N LEU A 79 18.748 11.683 -9.424 1.00 0.00 N ATOM 1159 CA LEU A 79 20.014 10.971 -9.641 1.00 0.00 C ATOM 1160 C LEU A 79 20.762 11.616 -10.818 1.00 0.00 C ATOM 1161 O LEU A 79 21.176 10.934 -11.754 1.00 0.00 O ATOM 1162 CB LEU A 79 19.760 9.455 -9.868 1.00 0.00 C ATOM 1163 CG LEU A 79 18.887 8.705 -8.837 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.402 8.740 -9.198 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.256 7.220 -8.819 1.00 0.00 C ATOM 0 H LEU A 79 18.270 11.898 -10.299 1.00 0.00 H new ATOM 0 HA LEU A 79 20.640 11.054 -8.753 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.296 9.337 -10.847 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.728 8.957 -9.911 1.00 0.00 H new ATOM 0 HG LEU A 79 19.064 9.200 -7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 79 16.831 8.199 -8.443 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.062 9.775 -9.238 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.253 8.271 -10.170 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.635 6.700 -8.089 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.090 6.792 -9.808 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.306 7.109 -8.547 1.00 0.00 H new ATOM 1213 N VAL A 84 20.458 20.152 -11.219 1.00 0.00 N ATOM 1214 CA VAL A 84 19.015 19.833 -11.239 1.00 0.00 C ATOM 1215 C VAL A 84 18.402 20.015 -9.846 1.00 0.00 C ATOM 1216 O VAL A 84 18.939 19.497 -8.867 1.00 0.00 O ATOM 1217 CB VAL A 84 18.793 18.383 -11.722 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.307 18.006 -11.780 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.391 18.153 -13.116 1.00 0.00 C ATOM 0 HA VAL A 84 18.524 20.518 -11.930 1.00 0.00 H new ATOM 0 HB VAL A 84 19.297 17.754 -10.988 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.206 16.977 -12.125 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.869 18.100 -10.786 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.789 18.673 -12.469 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.215 17.122 -13.422 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.920 18.829 -13.830 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.464 18.345 -13.088 1.00 0.00 H new ATOM 1229 N ASN A 85 17.258 20.711 -9.764 1.00 0.00 N ATOM 1230 CA ASN A 85 16.557 20.996 -8.499 1.00 0.00 C ATOM 1231 C ASN A 85 15.039 20.673 -8.499 1.00 0.00 C ATOM 1232 O ASN A 85 14.408 20.793 -7.451 1.00 0.00 O ATOM 1233 CB ASN A 85 16.831 22.466 -8.123 1.00 0.00 C ATOM 1234 CG ASN A 85 18.313 22.773 -7.951 1.00 0.00 C ATOM 1235 OD1 ASN A 85 18.959 23.347 -8.817 1.00 0.00 O ATOM 1236 ND2 ASN A 85 18.911 22.380 -6.847 1.00 0.00 N ATOM 0 H ASN A 85 16.787 21.097 -10.582 1.00 0.00 H new ATOM 0 HA ASN A 85 16.956 20.318 -7.744 1.00 0.00 H new ATOM 0 HB2 ASN A 85 16.419 23.115 -8.896 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.307 22.701 -7.196 1.00 0.00 H new ATOM 0 HD21 ASN A 85 19.908 22.554 -6.717 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.378 21.901 -6.121 1.00 0.00 H new ATOM 1243 N LEU A 86 14.453 20.273 -9.644 1.00 0.00 N ATOM 1244 CA LEU A 86 13.012 19.972 -9.837 1.00 0.00 C ATOM 1245 C LEU A 86 12.038 20.983 -9.168 1.00 0.00 C ATOM 1246 O LEU A 86 11.267 20.597 -8.288 1.00 0.00 O ATOM 1247 CB LEU A 86 12.725 18.506 -9.435 1.00 0.00 C ATOM 1248 CG LEU A 86 13.519 17.384 -10.104 1.00 0.00 C ATOM 1249 CD1 LEU A 86 12.907 16.047 -9.681 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.449 17.508 -11.625 1.00 0.00 C ATOM 0 H LEU A 86 14.991 20.144 -10.501 1.00 0.00 H new ATOM 0 HA LEU A 86 12.806 20.095 -10.900 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.881 18.423 -8.359 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.668 18.316 -9.619 1.00 0.00 H new ATOM 0 HG LEU A 86 14.564 17.448 -9.799 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.459 15.231 -10.147 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.961 15.949 -8.597 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.865 16.008 -9.997 1.00 0.00 H new ATOM 0 HD21 LEU A 86 14.020 16.700 -12.083 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.410 17.445 -11.948 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.867 18.467 -11.931 1.00 0.00 H new ATOM 1262 N PRO A 87 12.008 22.265 -9.599 1.00 0.00 N ATOM 1263 CA PRO A 87 11.121 23.292 -9.029 1.00 0.00 C ATOM 1264 C PRO A 87 9.604 22.989 -8.892 1.00 0.00 C ATOM 1265 O PRO A 87 8.999 23.595 -8.000 1.00 0.00 O ATOM 1266 CB PRO A 87 11.330 24.534 -9.903 1.00 0.00 C ATOM 1267 CG PRO A 87 12.765 24.376 -10.397 1.00 0.00 C ATOM 1268 CD PRO A 87 12.877 22.868 -10.606 1.00 0.00 C ATOM 0 HA PRO A 87 11.407 23.392 -7.982 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.621 24.568 -10.730 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.199 25.454 -9.333 1.00 0.00 H new ATOM 0 HG2 PRO A 87 12.940 24.928 -11.321 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.488 24.740 -9.667 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.564 22.588 -11.612 1.00 0.00 H new ATOM 0 HD3 PRO A 87 13.907 22.531 -10.487 1.00 0.00 H new ATOM 1276 N PRO A 88 8.947 22.131 -9.720 1.00 0.00 N ATOM 1277 CA PRO A 88 7.495 21.900 -9.629 1.00 0.00 C ATOM 1278 C PRO A 88 7.045 20.994 -8.460 1.00 0.00 C ATOM 1279 O PRO A 88 7.750 20.797 -7.473 1.00 0.00 O ATOM 1280 CB PRO A 88 7.084 21.330 -11.004 1.00 0.00 C ATOM 1281 CG PRO A 88 8.262 21.581 -11.931 1.00 0.00 C ATOM 1282 CD PRO A 88 9.443 21.565 -10.970 1.00 0.00 C ATOM 0 HA PRO A 88 6.991 22.839 -9.398 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.862 20.265 -10.934 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.184 21.819 -11.376 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.349 20.809 -12.695 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.174 22.535 -12.451 1.00 0.00 H new ATOM 0 HD2 PRO A 88 9.812 20.550 -10.820 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.274 22.151 -11.362 1.00 0.00 H new ATOM 1290 N GLU A 89 5.868 20.368 -8.599 1.00 0.00 N ATOM 1291 CA GLU A 89 5.355 19.307 -7.710 1.00 0.00 C ATOM 1292 C GLU A 89 6.326 18.125 -7.499 1.00 0.00 C ATOM 1293 O GLU A 89 6.171 17.354 -6.561 1.00 0.00 O ATOM 1294 CB GLU A 89 3.998 18.799 -8.239 1.00 0.00 C ATOM 1295 CG GLU A 89 4.037 18.273 -9.685 1.00 0.00 C ATOM 1296 CD GLU A 89 2.685 17.645 -10.097 1.00 0.00 C ATOM 1297 OE1 GLU A 89 1.703 18.405 -10.295 1.00 0.00 O ATOM 1298 OE2 GLU A 89 2.603 16.401 -10.247 1.00 0.00 O ATOM 0 H GLU A 89 5.223 20.591 -9.357 1.00 0.00 H new ATOM 0 HA GLU A 89 5.238 19.764 -6.727 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.642 18.003 -7.585 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.272 19.610 -8.179 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.282 19.090 -10.364 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.829 17.530 -9.782 1.00 0.00 H new ATOM 1305 N TRP A 90 7.377 17.992 -8.314 1.00 0.00 N ATOM 1306 CA TRP A 90 8.447 16.987 -8.211 1.00 0.00 C ATOM 1307 C TRP A 90 9.364 17.098 -6.975 1.00 0.00 C ATOM 1308 O TRP A 90 10.334 16.345 -6.864 1.00 0.00 O ATOM 1309 CB TRP A 90 9.233 17.003 -9.517 1.00 0.00 C ATOM 1310 CG TRP A 90 8.453 16.465 -10.670 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.676 17.174 -11.520 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.353 15.081 -11.102 1.00 0.00 C ATOM 1313 NE1 TRP A 90 7.000 16.301 -12.354 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.387 14.994 -12.144 1.00 0.00 C ATOM 1315 CE3 TRP A 90 9.019 13.898 -10.736 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 7.067 13.782 -12.766 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 8.754 12.689 -11.396 1.00 0.00 C ATOM 1318 CH2 TRP A 90 7.779 12.628 -12.403 1.00 0.00 C ATOM 0 H TRP A 90 7.514 18.616 -9.109 1.00 0.00 H new ATOM 0 HA TRP A 90 7.965 16.022 -8.053 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.540 18.025 -9.738 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.143 16.416 -9.395 1.00 0.00 H new ATOM 0 HD1 TRP A 90 7.596 18.251 -11.544 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.302 16.589 -13.040 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.744 13.921 -9.936 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.287 13.735 -13.511 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.304 11.799 -11.127 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.576 11.691 -12.900 1.00 0.00 H new ATOM 1329 N VAL A 91 9.048 17.999 -6.041 1.00 0.00 N ATOM 1330 CA VAL A 91 9.676 18.097 -4.710 1.00 0.00 C ATOM 1331 C VAL A 91 8.653 18.287 -3.572 1.00 0.00 C ATOM 1332 O VAL A 91 9.047 18.549 -2.437 1.00 0.00 O ATOM 1333 CB VAL A 91 10.778 19.176 -4.664 1.00 0.00 C ATOM 1334 CG1 VAL A 91 11.950 18.854 -5.590 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.249 20.587 -4.964 1.00 0.00 C ATOM 0 H VAL A 91 8.326 18.705 -6.190 1.00 0.00 H new ATOM 0 HA VAL A 91 10.154 17.133 -4.538 1.00 0.00 H new ATOM 0 HB VAL A 91 11.139 19.166 -3.635 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.697 19.645 -5.520 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.397 17.905 -5.294 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.593 18.783 -6.617 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.071 21.301 -4.917 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.809 20.606 -5.961 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.492 20.856 -4.228 1.00 0.00 H new ATOM 1345 N THR A 92 7.344 18.148 -3.837 1.00 0.00 N ATOM 1346 CA THR A 92 6.255 18.338 -2.846 1.00 0.00 C ATOM 1347 C THR A 92 5.713 17.010 -2.286 1.00 0.00 C ATOM 1348 O THR A 92 4.685 16.970 -1.607 1.00 0.00 O ATOM 1349 CB THR A 92 5.123 19.233 -3.381 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.444 18.601 -4.445 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.643 20.577 -3.904 1.00 0.00 C ATOM 0 H THR A 92 6.999 17.895 -4.763 1.00 0.00 H new ATOM 0 HA THR A 92 6.711 18.864 -2.007 1.00 0.00 H new ATOM 0 HB THR A 92 4.453 19.405 -2.538 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.096 18.259 -5.092 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.807 21.173 -4.271 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.144 21.112 -3.097 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.348 20.403 -4.717 1.00 0.00 H new ATOM 1359 N GLN A 93 6.426 15.914 -2.563 1.00 0.00 N ATOM 1360 CA GLN A 93 6.186 14.539 -2.118 1.00 0.00 C ATOM 1361 C GLN A 93 6.196 14.360 -0.591 1.00 0.00 C ATOM 1362 O GLN A 93 6.542 15.265 0.173 1.00 0.00 O ATOM 1363 CB GLN A 93 7.292 13.651 -2.723 1.00 0.00 C ATOM 1364 CG GLN A 93 7.025 13.337 -4.189 1.00 0.00 C ATOM 1365 CD GLN A 93 7.191 14.526 -5.105 1.00 0.00 C ATOM 1366 OE1 GLN A 93 8.038 15.379 -4.902 1.00 0.00 O ATOM 1367 NE2 GLN A 93 6.355 14.657 -6.102 1.00 0.00 N ATOM 0 H GLN A 93 7.255 15.972 -3.154 1.00 0.00 H new ATOM 0 HA GLN A 93 5.186 14.262 -2.453 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.254 14.154 -2.628 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.361 12.721 -2.159 1.00 0.00 H new ATOM 0 HG2 GLN A 93 7.701 12.545 -4.511 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.011 12.951 -4.290 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.647 13.943 -6.271 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.411 15.473 -6.711 1.00 0.00 H new ATOM 1376 N GLU A 94 5.885 13.137 -0.151 1.00 0.00 N ATOM 1377 CA GLU A 94 6.067 12.751 1.260 1.00 0.00 C ATOM 1378 C GLU A 94 7.567 12.680 1.610 1.00 0.00 C ATOM 1379 O GLU A 94 7.973 13.139 2.678 1.00 0.00 O ATOM 1380 CB GLU A 94 5.335 11.431 1.556 1.00 0.00 C ATOM 1381 CG GLU A 94 5.515 10.991 3.008 1.00 0.00 C ATOM 1382 CD GLU A 94 4.633 9.777 3.337 1.00 0.00 C ATOM 1383 OE1 GLU A 94 5.085 8.624 3.155 1.00 0.00 O ATOM 1384 OE2 GLU A 94 3.483 9.954 3.809 1.00 0.00 O ATOM 0 H GLU A 94 5.508 12.398 -0.744 1.00 0.00 H new ATOM 0 HA GLU A 94 5.623 13.514 1.899 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.273 11.549 1.342 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.709 10.652 0.892 1.00 0.00 H new ATOM 0 HG2 GLU A 94 6.561 10.743 3.188 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.264 11.817 3.674 1.00 0.00 H new ATOM 1391 N ILE A 95 8.394 12.176 0.679 1.00 0.00 N ATOM 1392 CA ILE A 95 9.864 12.214 0.755 1.00 0.00 C ATOM 1393 C ILE A 95 10.463 12.588 -0.613 1.00 0.00 C ATOM 1394 O ILE A 95 10.018 12.096 -1.650 1.00 0.00 O ATOM 1395 CB ILE A 95 10.446 10.858 1.259 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.758 10.342 2.547 1.00 0.00 C ATOM 1397 CG2 ILE A 95 11.970 10.963 1.472 1.00 0.00 C ATOM 1398 CD1 ILE A 95 10.305 9.011 3.083 1.00 0.00 C ATOM 0 H ILE A 95 8.051 11.720 -0.167 1.00 0.00 H new ATOM 0 HA ILE A 95 10.141 12.980 1.479 1.00 0.00 H new ATOM 0 HB ILE A 95 10.240 10.127 0.477 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.860 11.099 3.324 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.692 10.228 2.351 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.355 10.006 1.824 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.452 11.224 0.530 1.00 0.00 H new ATOM 0 HG23 ILE A 95 12.182 11.734 2.213 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.762 8.731 3.986 1.00 0.00 H new ATOM 0 HD12 ILE A 95 10.178 8.235 2.328 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.364 9.120 3.316 1.00 0.00 H new ATOM 1410 N PHE A 96 11.487 13.442 -0.612 1.00 0.00 N ATOM 1411 CA PHE A 96 12.333 13.725 -1.777 1.00 0.00 C ATOM 1412 C PHE A 96 13.806 13.566 -1.363 1.00 0.00 C ATOM 1413 O PHE A 96 14.209 14.040 -0.298 1.00 0.00 O ATOM 1414 CB PHE A 96 12.018 15.089 -2.424 1.00 0.00 C ATOM 1415 CG PHE A 96 13.012 15.487 -3.510 1.00 0.00 C ATOM 1416 CD1 PHE A 96 14.214 16.119 -3.134 1.00 0.00 C ATOM 1417 CD2 PHE A 96 12.788 15.189 -4.874 1.00 0.00 C ATOM 1418 CE1 PHE A 96 15.199 16.417 -4.092 1.00 0.00 C ATOM 1419 CE2 PHE A 96 13.787 15.463 -5.825 1.00 0.00 C ATOM 1420 CZ PHE A 96 14.991 16.078 -5.438 1.00 0.00 C ATOM 0 H PHE A 96 11.759 13.970 0.217 1.00 0.00 H new ATOM 0 HA PHE A 96 12.116 13.004 -2.566 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.016 15.057 -2.852 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.009 15.857 -1.650 1.00 0.00 H new ATOM 0 HD1 PHE A 96 14.380 16.377 -2.099 1.00 0.00 H new ATOM 0 HD2 PHE A 96 11.851 14.752 -5.185 1.00 0.00 H new ATOM 0 HE1 PHE A 96 16.114 16.906 -3.793 1.00 0.00 H new ATOM 0 HE2 PHE A 96 13.628 15.199 -6.860 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.753 16.289 -6.174 1.00 0.00 H new ATOM 1430 N GLU A 97 14.611 12.898 -2.194 1.00 0.00 N ATOM 1431 CA GLU A 97 16.060 12.723 -1.993 1.00 0.00 C ATOM 1432 C GLU A 97 16.834 12.970 -3.296 1.00 0.00 C ATOM 1433 O GLU A 97 16.301 12.778 -4.388 1.00 0.00 O ATOM 1434 CB GLU A 97 16.405 11.311 -1.487 1.00 0.00 C ATOM 1435 CG GLU A 97 15.783 10.918 -0.139 1.00 0.00 C ATOM 1436 CD GLU A 97 16.280 9.541 0.354 1.00 0.00 C ATOM 1437 OE1 GLU A 97 17.452 9.170 0.083 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.512 8.829 1.043 1.00 0.00 O ATOM 0 H GLU A 97 14.270 12.452 -3.046 1.00 0.00 H new ATOM 0 HA GLU A 97 16.353 13.455 -1.240 1.00 0.00 H new ATOM 0 HB2 GLU A 97 16.087 10.588 -2.238 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.489 11.229 -1.404 1.00 0.00 H new ATOM 0 HG2 GLU A 97 16.024 11.677 0.605 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.697 10.898 -0.234 1.00 0.00 H new ATOM 1445 N ASP A 98 18.116 13.328 -3.186 1.00 0.00 N ATOM 1446 CA ASP A 98 19.018 13.478 -4.329 1.00 0.00 C ATOM 1447 C ASP A 98 20.329 12.688 -4.139 1.00 0.00 C ATOM 1448 O ASP A 98 21.123 12.967 -3.239 1.00 0.00 O ATOM 1449 CB ASP A 98 19.211 14.962 -4.669 1.00 0.00 C ATOM 1450 CG ASP A 98 20.088 15.754 -3.676 1.00 0.00 C ATOM 1451 OD1 ASP A 98 19.688 15.931 -2.499 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.156 16.260 -4.098 1.00 0.00 O ATOM 0 H ASP A 98 18.561 13.524 -2.290 1.00 0.00 H new ATOM 0 HA ASP A 98 18.556 13.025 -5.206 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.656 15.036 -5.661 1.00 0.00 H new ATOM 0 HB3 ASP A 98 18.231 15.437 -4.723 1.00 0.00 H new ATOM 1457 N TRP A 99 20.540 11.668 -4.980 1.00 0.00 N ATOM 1458 CA TRP A 99 21.658 10.716 -4.913 1.00 0.00 C ATOM 1459 C TRP A 99 22.691 11.060 -5.990 1.00 0.00 C ATOM 1460 O TRP A 99 22.602 10.618 -7.137 1.00 0.00 O ATOM 1461 CB TRP A 99 21.129 9.272 -5.040 1.00 0.00 C ATOM 1462 CG TRP A 99 20.027 8.834 -4.116 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.653 9.420 -2.954 1.00 0.00 C ATOM 1464 CD2 TRP A 99 19.130 7.690 -4.276 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.566 8.755 -2.425 1.00 0.00 N ATOM 1466 CE2 TRP A 99 18.183 7.696 -3.213 1.00 0.00 C ATOM 1467 CE3 TRP A 99 19.020 6.645 -5.219 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.168 6.737 -3.099 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 18.002 5.676 -5.123 1.00 0.00 C ATOM 1470 CH2 TRP A 99 17.073 5.719 -4.066 1.00 0.00 C ATOM 0 H TRP A 99 19.910 11.475 -5.759 1.00 0.00 H new ATOM 0 HA TRP A 99 22.157 10.790 -3.947 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.779 9.135 -6.063 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.971 8.595 -4.897 1.00 0.00 H new ATOM 0 HD1 TRP A 99 20.133 10.279 -2.508 1.00 0.00 H new ATOM 0 HE1 TRP A 99 18.103 9.017 -1.555 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.731 6.587 -6.030 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.467 6.779 -2.279 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.934 4.895 -5.865 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.293 4.976 -3.998 1.00 0.00 H new ATOM 1481 N GLN A 100 23.671 11.889 -5.629 1.00 0.00 N ATOM 1482 CA GLN A 100 24.660 12.442 -6.561 1.00 0.00 C ATOM 1483 C GLN A 100 25.844 11.466 -6.730 1.00 0.00 C ATOM 1484 O GLN A 100 26.880 11.586 -6.071 1.00 0.00 O ATOM 1485 CB GLN A 100 25.080 13.850 -6.090 1.00 0.00 C ATOM 1486 CG GLN A 100 23.916 14.820 -5.794 1.00 0.00 C ATOM 1487 CD GLN A 100 22.970 15.097 -6.959 1.00 0.00 C ATOM 1488 OE1 GLN A 100 23.139 14.665 -8.089 1.00 0.00 O ATOM 1489 NE2 GLN A 100 21.924 15.854 -6.738 1.00 0.00 N ATOM 0 H GLN A 100 23.804 12.201 -4.667 1.00 0.00 H new ATOM 0 HA GLN A 100 24.224 12.557 -7.553 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.685 13.749 -5.189 1.00 0.00 H new ATOM 0 HB3 GLN A 100 25.718 14.296 -6.854 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.334 14.417 -4.966 1.00 0.00 H new ATOM 0 HG3 GLN A 100 24.335 15.768 -5.457 1.00 0.00 H new ATOM 0 HE21 GLN A 100 21.755 16.230 -5.805 1.00 0.00 H new ATOM 0 HE22 GLN A 100 21.279 16.067 -7.499 1.00 0.00 H new ATOM 1498 N LEU A 101 25.652 10.456 -7.586 1.00 0.00 N ATOM 1499 CA LEU A 101 26.611 9.379 -7.860 1.00 0.00 C ATOM 1500 C LEU A 101 27.475 9.701 -9.084 1.00 0.00 C ATOM 1501 O LEU A 101 27.271 10.700 -9.780 1.00 0.00 O ATOM 1502 CB LEU A 101 25.849 8.048 -8.032 1.00 0.00 C ATOM 1503 CG LEU A 101 24.916 7.627 -6.881 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.358 6.241 -7.189 1.00 0.00 C ATOM 1505 CD2 LEU A 101 25.618 7.578 -5.530 1.00 0.00 C ATOM 0 H LEU A 101 24.793 10.363 -8.127 1.00 0.00 H new ATOM 0 HA LEU A 101 27.292 9.284 -7.015 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.256 8.112 -8.944 1.00 0.00 H new ATOM 0 HB3 LEU A 101 26.581 7.255 -8.183 1.00 0.00 H new ATOM 0 HG LEU A 101 24.128 8.377 -6.811 1.00 0.00 H new ATOM 0 HD11 LEU A 101 23.695 5.928 -6.382 1.00 0.00 H new ATOM 0 HD12 LEU A 101 23.801 6.273 -8.125 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.179 5.530 -7.280 1.00 0.00 H new ATOM 0 HD21 LEU A 101 24.907 7.275 -4.761 1.00 0.00 H new ATOM 0 HD22 LEU A 101 26.436 6.859 -5.571 1.00 0.00 H new ATOM 0 HD23 LEU A 101 26.014 8.565 -5.290 1.00 0.00 H new ATOM 1517 N GLU A 102 28.437 8.824 -9.358 1.00 0.00 N ATOM 1518 CA GLU A 102 29.277 8.849 -10.544 1.00 0.00 C ATOM 1519 C GLU A 102 28.452 8.632 -11.828 1.00 0.00 C ATOM 1520 O GLU A 102 27.274 8.264 -11.801 1.00 0.00 O ATOM 1521 CB GLU A 102 30.368 7.769 -10.401 1.00 0.00 C ATOM 1522 CG GLU A 102 31.367 7.939 -9.243 1.00 0.00 C ATOM 1523 CD GLU A 102 30.762 7.766 -7.828 1.00 0.00 C ATOM 1524 OE1 GLU A 102 29.831 6.943 -7.641 1.00 0.00 O ATOM 1525 OE2 GLU A 102 31.232 8.455 -6.888 1.00 0.00 O ATOM 0 H GLU A 102 28.658 8.048 -8.734 1.00 0.00 H new ATOM 0 HA GLU A 102 29.741 9.831 -10.631 1.00 0.00 H new ATOM 0 HB2 GLU A 102 29.876 6.803 -10.286 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.932 7.731 -11.333 1.00 0.00 H new ATOM 0 HG2 GLU A 102 32.173 7.216 -9.369 1.00 0.00 H new ATOM 0 HG3 GLU A 102 31.815 8.930 -9.312 1.00 0.00 H new ATOM 1532 N ASP A 103 29.083 8.862 -12.976 1.00 0.00 N ATOM 1533 CA ASP A 103 28.450 8.846 -14.304 1.00 0.00 C ATOM 1534 C ASP A 103 29.117 7.801 -15.225 1.00 0.00 C ATOM 1535 O ASP A 103 30.142 8.111 -15.834 1.00 0.00 O ATOM 1536 CB ASP A 103 28.453 10.285 -14.846 1.00 0.00 C ATOM 1537 CG ASP A 103 27.410 10.459 -15.956 1.00 0.00 C ATOM 1538 OD1 ASP A 103 26.206 10.516 -15.604 1.00 0.00 O ATOM 1539 OD2 ASP A 103 27.778 10.530 -17.150 1.00 0.00 O ATOM 0 H ASP A 103 30.080 9.072 -13.016 1.00 0.00 H new ATOM 0 HA ASP A 103 27.411 8.521 -14.248 1.00 0.00 H new ATOM 0 HB2 ASP A 103 28.245 10.983 -14.035 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.443 10.530 -15.231 1.00 0.00 H new ATOM 1544 N PRO A 104 28.583 6.555 -15.302 1.00 0.00 N ATOM 1545 CA PRO A 104 29.247 5.418 -15.966 1.00 0.00 C ATOM 1546 C PRO A 104 29.320 5.442 -17.501 1.00 0.00 C ATOM 1547 O PRO A 104 30.114 4.703 -18.078 1.00 0.00 O ATOM 1548 CB PRO A 104 28.485 4.175 -15.506 1.00 0.00 C ATOM 1549 CG PRO A 104 27.833 4.591 -14.200 1.00 0.00 C ATOM 1550 CD PRO A 104 27.472 6.040 -14.505 1.00 0.00 C ATOM 0 HA PRO A 104 30.298 5.449 -15.677 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.741 3.871 -16.242 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.156 3.328 -15.363 1.00 0.00 H new ATOM 0 HG2 PRO A 104 26.956 3.988 -13.966 1.00 0.00 H new ATOM 0 HG3 PRO A 104 28.514 4.505 -13.353 1.00 0.00 H new ATOM 0 HD2 PRO A 104 26.532 6.104 -15.053 1.00 0.00 H new ATOM 0 HD3 PRO A 104 27.346 6.615 -13.588 1.00 0.00 H new ATOM 1558 N ASP A 105 28.509 6.256 -18.178 1.00 0.00 N ATOM 1559 CA ASP A 105 28.417 6.291 -19.645 1.00 0.00 C ATOM 1560 C ASP A 105 29.773 6.668 -20.289 1.00 0.00 C ATOM 1561 O ASP A 105 30.211 7.824 -20.237 1.00 0.00 O ATOM 1562 CB ASP A 105 27.290 7.262 -20.034 1.00 0.00 C ATOM 1563 CG ASP A 105 27.029 7.390 -21.548 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.692 6.711 -22.369 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.111 8.172 -21.904 1.00 0.00 O ATOM 0 H ASP A 105 27.887 6.921 -17.719 1.00 0.00 H new ATOM 0 HA ASP A 105 28.177 5.299 -20.028 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.369 6.938 -19.549 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.529 8.249 -19.638 1.00 0.00 H new ATOM 1570 N GLY A 106 30.447 5.672 -20.885 1.00 0.00 N ATOM 1571 CA GLY A 106 31.768 5.827 -21.510 1.00 0.00 C ATOM 1572 C GLY A 106 32.953 5.647 -20.548 1.00 0.00 C ATOM 1573 O GLY A 106 34.082 5.984 -20.910 1.00 0.00 O ATOM 0 H GLY A 106 30.083 4.721 -20.947 1.00 0.00 H new ATOM 0 HA2 GLY A 106 31.860 5.103 -22.319 1.00 0.00 H new ATOM 0 HA3 GLY A 106 31.829 6.818 -21.960 1.00 0.00 H new ATOM 1577 N GLN A 107 32.707 5.131 -19.337 1.00 0.00 N ATOM 1578 CA GLN A 107 33.726 4.836 -18.320 1.00 0.00 C ATOM 1579 C GLN A 107 34.225 3.379 -18.458 1.00 0.00 C ATOM 1580 O GLN A 107 34.851 3.026 -19.461 1.00 0.00 O ATOM 1581 CB GLN A 107 33.200 5.165 -16.906 1.00 0.00 C ATOM 1582 CG GLN A 107 32.607 6.559 -16.692 1.00 0.00 C ATOM 1583 CD GLN A 107 33.582 7.729 -16.633 1.00 0.00 C ATOM 1584 OE1 GLN A 107 34.769 7.640 -16.918 1.00 0.00 O ATOM 1585 NE2 GLN A 107 33.088 8.881 -16.224 1.00 0.00 N ATOM 0 H GLN A 107 31.763 4.900 -19.028 1.00 0.00 H new ATOM 0 HA GLN A 107 34.591 5.479 -18.484 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.438 4.430 -16.649 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.020 5.034 -16.200 1.00 0.00 H new ATOM 0 HG2 GLN A 107 31.897 6.751 -17.496 1.00 0.00 H new ATOM 0 HG3 GLN A 107 32.039 6.545 -15.762 1.00 0.00 H new ATOM 0 HE21 GLN A 107 32.099 8.956 -15.986 1.00 0.00 H new ATOM 0 HE22 GLN A 107 33.695 9.697 -16.145 1.00 0.00 H new ATOM 1594 N SER A 108 33.928 2.534 -17.463 1.00 0.00 N ATOM 1595 CA SER A 108 34.337 1.122 -17.354 1.00 0.00 C ATOM 1596 C SER A 108 33.312 0.355 -16.518 1.00 0.00 C ATOM 1597 O SER A 108 32.595 0.952 -15.714 1.00 0.00 O ATOM 1598 CB SER A 108 35.720 1.000 -16.677 1.00 0.00 C ATOM 1599 OG SER A 108 36.735 1.732 -17.353 1.00 0.00 O ATOM 0 H SER A 108 33.364 2.831 -16.666 1.00 0.00 H new ATOM 0 HA SER A 108 34.395 0.706 -18.360 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.648 1.354 -15.649 1.00 0.00 H new ATOM 0 HB3 SER A 108 36.006 -0.051 -16.633 1.00 0.00 H new ATOM 0 HG SER A 108 37.587 1.621 -16.882 1.00 0.00 H new ATOM 1605 N LEU A 109 33.256 -0.973 -16.634 1.00 0.00 N ATOM 1606 CA LEU A 109 32.239 -1.782 -15.939 1.00 0.00 C ATOM 1607 C LEU A 109 32.441 -1.789 -14.417 1.00 0.00 C ATOM 1608 O LEU A 109 31.471 -1.854 -13.673 1.00 0.00 O ATOM 1609 CB LEU A 109 32.182 -3.193 -16.556 1.00 0.00 C ATOM 1610 CG LEU A 109 31.343 -3.284 -17.850 1.00 0.00 C ATOM 1611 CD1 LEU A 109 31.777 -2.335 -18.971 1.00 0.00 C ATOM 1612 CD2 LEU A 109 31.395 -4.710 -18.397 1.00 0.00 C ATOM 0 H LEU A 109 33.903 -1.518 -17.204 1.00 0.00 H new ATOM 0 HA LEU A 109 31.263 -1.320 -16.087 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.198 -3.525 -16.771 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.770 -3.883 -15.820 1.00 0.00 H new ATOM 0 HG LEU A 109 30.337 -2.986 -17.555 1.00 0.00 H new ATOM 0 HD11 LEU A 109 31.129 -2.473 -19.836 1.00 0.00 H new ATOM 0 HD12 LEU A 109 31.704 -1.304 -18.624 1.00 0.00 H new ATOM 0 HD13 LEU A 109 32.808 -2.551 -19.252 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.802 -4.771 -19.310 1.00 0.00 H new ATOM 0 HD22 LEU A 109 32.428 -4.978 -18.617 1.00 0.00 H new ATOM 0 HD23 LEU A 109 30.991 -5.399 -17.655 1.00 0.00 H new ATOM 1624 N GLU A 110 33.665 -1.577 -13.932 1.00 0.00 N ATOM 1625 CA GLU A 110 33.936 -1.347 -12.504 1.00 0.00 C ATOM 1626 C GLU A 110 33.288 -0.045 -11.994 1.00 0.00 C ATOM 1627 O GLU A 110 32.784 0.004 -10.873 1.00 0.00 O ATOM 1628 CB GLU A 110 35.459 -1.352 -12.289 1.00 0.00 C ATOM 1629 CG GLU A 110 35.846 -1.242 -10.809 1.00 0.00 C ATOM 1630 CD GLU A 110 37.370 -1.386 -10.630 1.00 0.00 C ATOM 1631 OE1 GLU A 110 38.103 -0.375 -10.757 1.00 0.00 O ATOM 1632 OE2 GLU A 110 37.854 -2.513 -10.358 1.00 0.00 O ATOM 0 H GLU A 110 34.501 -1.559 -14.516 1.00 0.00 H new ATOM 0 HA GLU A 110 33.485 -2.149 -11.919 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.878 -2.269 -12.703 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.903 -0.522 -12.839 1.00 0.00 H new ATOM 0 HG2 GLU A 110 35.518 -0.281 -10.413 1.00 0.00 H new ATOM 0 HG3 GLU A 110 35.333 -2.015 -10.236 1.00 0.00 H new ATOM 1639 N VAL A 111 33.207 0.990 -12.836 1.00 0.00 N ATOM 1640 CA VAL A 111 32.515 2.252 -12.513 1.00 0.00 C ATOM 1641 C VAL A 111 30.997 2.061 -12.562 1.00 0.00 C ATOM 1642 O VAL A 111 30.304 2.546 -11.670 1.00 0.00 O ATOM 1643 CB VAL A 111 33.002 3.393 -13.428 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.254 4.706 -13.191 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.495 3.661 -13.199 1.00 0.00 C ATOM 0 H VAL A 111 33.621 0.980 -13.768 1.00 0.00 H new ATOM 0 HA VAL A 111 32.765 2.542 -11.492 1.00 0.00 H new ATOM 0 HB VAL A 111 32.811 3.060 -14.448 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.641 5.472 -13.864 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.191 4.559 -13.382 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.397 5.025 -12.158 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.824 4.469 -13.852 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.658 3.945 -12.159 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.065 2.759 -13.422 1.00 0.00 H new ATOM 1655 N PHE A 112 30.470 1.272 -13.511 1.00 0.00 N ATOM 1656 CA PHE A 112 29.052 0.874 -13.476 1.00 0.00 C ATOM 1657 C PHE A 112 28.723 0.091 -12.195 1.00 0.00 C ATOM 1658 O PHE A 112 27.756 0.417 -11.520 1.00 0.00 O ATOM 1659 CB PHE A 112 28.682 0.030 -14.700 1.00 0.00 C ATOM 1660 CG PHE A 112 28.286 0.784 -15.950 1.00 0.00 C ATOM 1661 CD1 PHE A 112 26.937 1.138 -16.146 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.242 1.100 -16.933 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.543 1.802 -17.321 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.851 1.785 -18.096 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.507 2.142 -18.283 1.00 0.00 C ATOM 0 H PHE A 112 30.995 0.901 -14.303 1.00 0.00 H new ATOM 0 HA PHE A 112 28.463 1.791 -13.489 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.531 -0.609 -14.942 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.858 -0.627 -14.424 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.203 0.899 -15.391 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.275 0.816 -16.794 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.504 2.049 -17.483 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.586 2.037 -18.847 1.00 0.00 H new ATOM 0 HZ PHE A 112 27.213 2.681 -19.171 1.00 0.00 H new ATOM 1675 N ARG A 113 29.554 -0.886 -11.807 1.00 0.00 N ATOM 1676 CA ARG A 113 29.402 -1.673 -10.557 1.00 0.00 C ATOM 1677 C ARG A 113 29.476 -0.791 -9.306 1.00 0.00 C ATOM 1678 O ARG A 113 28.654 -0.936 -8.405 1.00 0.00 O ATOM 1679 CB ARG A 113 30.476 -2.782 -10.533 1.00 0.00 C ATOM 1680 CG ARG A 113 30.158 -3.898 -11.548 1.00 0.00 C ATOM 1681 CD ARG A 113 31.356 -4.795 -11.881 1.00 0.00 C ATOM 1682 NE ARG A 113 31.917 -5.462 -10.686 1.00 0.00 N ATOM 1683 CZ ARG A 113 31.672 -6.689 -10.254 1.00 0.00 C ATOM 1684 NH1 ARG A 113 30.781 -7.464 -10.800 1.00 0.00 N ATOM 1685 NH2 ARG A 113 32.332 -7.169 -9.240 1.00 0.00 N ATOM 0 H ARG A 113 30.367 -1.163 -12.356 1.00 0.00 H new ATOM 0 HA ARG A 113 28.411 -2.127 -10.545 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.451 -2.351 -10.759 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.539 -3.207 -9.531 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.352 -4.517 -11.152 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.789 -3.445 -12.468 1.00 0.00 H new ATOM 0 HD2 ARG A 113 31.049 -5.551 -12.604 1.00 0.00 H new ATOM 0 HD3 ARG A 113 32.133 -4.196 -12.356 1.00 0.00 H new ATOM 0 HE ARG A 113 32.570 -4.911 -10.129 1.00 0.00 H new ATOM 0 HH11 ARG A 113 30.236 -7.133 -11.596 1.00 0.00 H new ATOM 0 HH12 ARG A 113 30.627 -8.403 -10.432 1.00 0.00 H new ATOM 0 HH21 ARG A 113 33.040 -6.599 -8.776 1.00 0.00 H new ATOM 0 HH22 ARG A 113 32.141 -8.115 -8.909 1.00 0.00 H new ATOM 1699 N THR A 114 30.381 0.188 -9.302 1.00 0.00 N ATOM 1700 CA THR A 114 30.522 1.196 -8.228 1.00 0.00 C ATOM 1701 C THR A 114 29.250 2.032 -8.066 1.00 0.00 C ATOM 1702 O THR A 114 28.787 2.255 -6.950 1.00 0.00 O ATOM 1703 CB THR A 114 31.741 2.099 -8.497 1.00 0.00 C ATOM 1704 OG1 THR A 114 32.927 1.336 -8.432 1.00 0.00 O ATOM 1705 CG2 THR A 114 31.886 3.237 -7.487 1.00 0.00 C ATOM 0 H THR A 114 31.055 0.313 -10.057 1.00 0.00 H new ATOM 0 HA THR A 114 30.681 0.664 -7.290 1.00 0.00 H new ATOM 0 HB THR A 114 31.580 2.528 -9.486 1.00 0.00 H new ATOM 0 HG1 THR A 114 33.015 0.798 -9.246 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.764 3.834 -7.735 1.00 0.00 H new ATOM 0 HG22 THR A 114 30.998 3.868 -7.519 1.00 0.00 H new ATOM 0 HG23 THR A 114 32.000 2.822 -6.485 1.00 0.00 H new ATOM 1713 N VAL A 115 28.636 2.466 -9.172 1.00 0.00 N ATOM 1714 CA VAL A 115 27.331 3.161 -9.155 1.00 0.00 C ATOM 1715 C VAL A 115 26.194 2.226 -8.744 1.00 0.00 C ATOM 1716 O VAL A 115 25.426 2.565 -7.847 1.00 0.00 O ATOM 1717 CB VAL A 115 27.081 3.841 -10.514 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.654 4.353 -10.703 1.00 0.00 C ATOM 1719 CG2 VAL A 115 28.010 5.048 -10.615 1.00 0.00 C ATOM 0 H VAL A 115 29.025 2.348 -10.108 1.00 0.00 H new ATOM 0 HA VAL A 115 27.360 3.941 -8.394 1.00 0.00 H new ATOM 0 HB VAL A 115 27.261 3.085 -11.279 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.561 4.818 -11.685 1.00 0.00 H new ATOM 0 HG12 VAL A 115 24.956 3.519 -10.629 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.426 5.088 -9.931 1.00 0.00 H new ATOM 0 HG21 VAL A 115 27.853 5.549 -11.570 1.00 0.00 H new ATOM 0 HG22 VAL A 115 27.795 5.742 -9.802 1.00 0.00 H new ATOM 0 HG23 VAL A 115 29.046 4.717 -10.545 1.00 0.00 H new ATOM 1729 N ARG A 116 26.107 1.032 -9.342 1.00 0.00 N ATOM 1730 CA ARG A 116 25.052 0.027 -9.109 1.00 0.00 C ATOM 1731 C ARG A 116 24.886 -0.306 -7.626 1.00 0.00 C ATOM 1732 O ARG A 116 23.769 -0.282 -7.124 1.00 0.00 O ATOM 1733 CB ARG A 116 25.394 -1.221 -9.960 1.00 0.00 C ATOM 1734 CG ARG A 116 24.283 -2.278 -9.945 1.00 0.00 C ATOM 1735 CD ARG A 116 24.727 -3.614 -10.550 1.00 0.00 C ATOM 1736 NE ARG A 116 25.719 -4.297 -9.680 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.662 -5.139 -10.063 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.725 -5.557 -11.285 1.00 0.00 N ATOM 1739 NH2 ARG A 116 27.561 -5.569 -9.232 1.00 0.00 N ATOM 0 H ARG A 116 26.795 0.723 -10.029 1.00 0.00 H new ATOM 0 HA ARG A 116 24.086 0.427 -9.416 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.581 -0.913 -10.989 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.317 -1.666 -9.588 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.956 -2.440 -8.918 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.422 -1.902 -10.498 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.859 -4.258 -10.691 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.161 -3.443 -11.535 1.00 0.00 H new ATOM 0 HE ARG A 116 25.666 -4.094 -8.682 1.00 0.00 H new ATOM 0 HH11 ARG A 116 26.040 -5.237 -11.970 1.00 0.00 H new ATOM 0 HH12 ARG A 116 27.460 -6.207 -11.564 1.00 0.00 H new ATOM 0 HH21 ARG A 116 27.549 -5.257 -8.261 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.280 -6.219 -9.550 1.00 0.00 H new ATOM 1753 N GLY A 117 25.989 -0.544 -6.917 1.00 0.00 N ATOM 1754 CA GLY A 117 25.978 -0.850 -5.477 1.00 0.00 C ATOM 1755 C GLY A 117 25.415 0.290 -4.620 1.00 0.00 C ATOM 1756 O GLY A 117 24.634 0.046 -3.702 1.00 0.00 O ATOM 0 H GLY A 117 26.924 -0.531 -7.324 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.386 -1.749 -5.308 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.994 -1.072 -5.152 1.00 0.00 H new ATOM 1760 N GLN A 118 25.720 1.543 -4.973 1.00 0.00 N ATOM 1761 CA GLN A 118 25.183 2.719 -4.274 1.00 0.00 C ATOM 1762 C GLN A 118 23.690 2.924 -4.586 1.00 0.00 C ATOM 1763 O GLN A 118 22.891 3.102 -3.670 1.00 0.00 O ATOM 1764 CB GLN A 118 26.016 3.968 -4.623 1.00 0.00 C ATOM 1765 CG GLN A 118 27.470 3.904 -4.125 1.00 0.00 C ATOM 1766 CD GLN A 118 28.299 5.059 -4.687 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.497 6.088 -4.056 1.00 0.00 O ATOM 1768 NE2 GLN A 118 28.780 4.936 -5.906 1.00 0.00 N ATOM 0 H GLN A 118 26.343 1.772 -5.747 1.00 0.00 H new ATOM 0 HA GLN A 118 25.259 2.549 -3.200 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.018 4.101 -5.705 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.533 4.846 -4.195 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.486 3.938 -3.036 1.00 0.00 H new ATOM 0 HG3 GLN A 118 27.917 2.955 -4.421 1.00 0.00 H new ATOM 0 HE21 GLN A 118 28.617 4.079 -6.435 1.00 0.00 H new ATOM 0 HE22 GLN A 118 29.316 5.698 -6.322 1.00 0.00 H new ATOM 1777 N VAL A 119 23.269 2.809 -5.856 1.00 0.00 N ATOM 1778 CA VAL A 119 21.834 2.849 -6.229 1.00 0.00 C ATOM 1779 C VAL A 119 21.033 1.763 -5.494 1.00 0.00 C ATOM 1780 O VAL A 119 19.974 2.053 -4.938 1.00 0.00 O ATOM 1781 CB VAL A 119 21.634 2.723 -7.756 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.154 2.768 -8.132 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.296 3.871 -8.519 1.00 0.00 C ATOM 0 H VAL A 119 23.900 2.687 -6.648 1.00 0.00 H new ATOM 0 HA VAL A 119 21.455 3.823 -5.920 1.00 0.00 H new ATOM 0 HB VAL A 119 22.085 1.768 -8.026 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.050 2.677 -9.213 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.630 1.945 -7.646 1.00 0.00 H new ATOM 0 HG13 VAL A 119 19.724 3.715 -7.805 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.130 3.741 -9.588 1.00 0.00 H new ATOM 0 HG22 VAL A 119 21.864 4.819 -8.197 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.367 3.873 -8.316 1.00 0.00 H new ATOM 1793 N LYS A 120 21.561 0.530 -5.434 1.00 0.00 N ATOM 1794 CA LYS A 120 20.960 -0.586 -4.685 1.00 0.00 C ATOM 1795 C LYS A 120 20.799 -0.240 -3.204 1.00 0.00 C ATOM 1796 O LYS A 120 19.692 -0.332 -2.682 1.00 0.00 O ATOM 1797 CB LYS A 120 21.832 -1.846 -4.853 1.00 0.00 C ATOM 1798 CG LYS A 120 21.169 -3.076 -4.216 1.00 0.00 C ATOM 1799 CD LYS A 120 22.076 -4.310 -4.296 1.00 0.00 C ATOM 1800 CE LYS A 120 21.302 -5.542 -3.801 1.00 0.00 C ATOM 1801 NZ LYS A 120 22.198 -6.716 -3.585 1.00 0.00 N ATOM 0 H LYS A 120 22.427 0.277 -5.910 1.00 0.00 H new ATOM 0 HA LYS A 120 19.965 -0.777 -5.087 1.00 0.00 H new ATOM 0 HB2 LYS A 120 22.005 -2.032 -5.913 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.807 -1.679 -4.396 1.00 0.00 H new ATOM 0 HG2 LYS A 120 20.933 -2.864 -3.173 1.00 0.00 H new ATOM 0 HG3 LYS A 120 20.225 -3.284 -4.720 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.410 -4.464 -5.322 1.00 0.00 H new ATOM 0 HD3 LYS A 120 22.969 -4.159 -3.689 1.00 0.00 H new ATOM 0 HE2 LYS A 120 20.792 -5.299 -2.869 1.00 0.00 H new ATOM 0 HE3 LYS A 120 20.532 -5.802 -4.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.636 -7.525 -3.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.666 -6.965 -4.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 22.917 -6.477 -2.873 1.00 0.00 H new ATOM 1815 N GLU A 121 21.868 0.199 -2.537 1.00 0.00 N ATOM 1816 CA GLU A 121 21.824 0.469 -1.092 1.00 0.00 C ATOM 1817 C GLU A 121 20.884 1.616 -0.742 1.00 0.00 C ATOM 1818 O GLU A 121 20.133 1.490 0.223 1.00 0.00 O ATOM 1819 CB GLU A 121 23.239 0.607 -0.490 1.00 0.00 C ATOM 1820 CG GLU A 121 23.822 2.023 -0.445 1.00 0.00 C ATOM 1821 CD GLU A 121 25.239 2.011 0.168 1.00 0.00 C ATOM 1822 OE1 GLU A 121 25.367 1.956 1.415 1.00 0.00 O ATOM 1823 OE2 GLU A 121 26.237 2.072 -0.591 1.00 0.00 O ATOM 0 H GLU A 121 22.774 0.376 -2.970 1.00 0.00 H new ATOM 0 HA GLU A 121 21.387 -0.405 -0.610 1.00 0.00 H new ATOM 0 HB2 GLU A 121 23.219 0.213 0.526 1.00 0.00 H new ATOM 0 HB3 GLU A 121 23.918 -0.024 -1.063 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.860 2.438 -1.452 1.00 0.00 H new ATOM 0 HG3 GLU A 121 23.172 2.671 0.143 1.00 0.00 H new ATOM 1830 N ARG A 122 20.812 2.680 -1.554 1.00 0.00 N ATOM 1831 CA ARG A 122 19.831 3.746 -1.316 1.00 0.00 C ATOM 1832 C ARG A 122 18.400 3.226 -1.464 1.00 0.00 C ATOM 1833 O ARG A 122 17.599 3.467 -0.566 1.00 0.00 O ATOM 1834 CB ARG A 122 20.097 4.953 -2.225 1.00 0.00 C ATOM 1835 CG ARG A 122 21.435 5.686 -2.011 1.00 0.00 C ATOM 1836 CD ARG A 122 21.708 6.156 -0.578 1.00 0.00 C ATOM 1837 NE ARG A 122 20.649 7.045 -0.043 1.00 0.00 N ATOM 1838 CZ ARG A 122 20.541 7.463 1.210 1.00 0.00 C ATOM 1839 NH1 ARG A 122 21.417 7.143 2.120 1.00 0.00 N ATOM 1840 NH2 ARG A 122 19.541 8.203 1.587 1.00 0.00 N ATOM 0 H ARG A 122 21.410 2.824 -2.367 1.00 0.00 H new ATOM 0 HA ARG A 122 19.945 4.084 -0.286 1.00 0.00 H new ATOM 0 HB2 ARG A 122 20.052 4.618 -3.261 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.288 5.670 -2.087 1.00 0.00 H new ATOM 0 HG2 ARG A 122 22.245 5.024 -2.318 1.00 0.00 H new ATOM 0 HG3 ARG A 122 21.464 6.553 -2.671 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.805 5.285 0.071 1.00 0.00 H new ATOM 0 HD3 ARG A 122 22.663 6.681 -0.551 1.00 0.00 H new ATOM 0 HE ARG A 122 19.937 7.365 -0.700 1.00 0.00 H new ATOM 0 HH11 ARG A 122 22.214 6.555 1.876 1.00 0.00 H new ATOM 0 HH12 ARG A 122 21.306 7.481 3.076 1.00 0.00 H new ATOM 0 HH21 ARG A 122 18.823 8.471 0.914 1.00 0.00 H new ATOM 0 HH22 ARG A 122 19.474 8.515 2.556 1.00 0.00 H new ATOM 1854 N VAL A 123 18.097 2.430 -2.490 1.00 0.00 N ATOM 1855 CA VAL A 123 16.785 1.775 -2.619 1.00 0.00 C ATOM 1856 C VAL A 123 16.455 0.840 -1.456 1.00 0.00 C ATOM 1857 O VAL A 123 15.375 0.986 -0.892 1.00 0.00 O ATOM 1858 CB VAL A 123 16.665 1.066 -3.986 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.561 0.011 -4.029 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.400 2.099 -5.081 1.00 0.00 C ATOM 0 H VAL A 123 18.743 2.219 -3.250 1.00 0.00 H new ATOM 0 HA VAL A 123 16.033 2.563 -2.573 1.00 0.00 H new ATOM 0 HB VAL A 123 17.612 0.552 -4.149 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.533 -0.446 -5.018 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.761 -0.755 -3.280 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.600 0.481 -3.820 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.316 1.595 -6.044 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.471 2.627 -4.866 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.224 2.812 -5.115 1.00 0.00 H new ATOM 1870 N GLU A 124 17.338 -0.073 -1.046 1.00 0.00 N ATOM 1871 CA GLU A 124 17.043 -0.968 0.091 1.00 0.00 C ATOM 1872 C GLU A 124 16.809 -0.200 1.391 1.00 0.00 C ATOM 1873 O GLU A 124 15.930 -0.565 2.174 1.00 0.00 O ATOM 1874 CB GLU A 124 18.145 -2.007 0.309 1.00 0.00 C ATOM 1875 CG GLU A 124 18.298 -2.982 -0.848 1.00 0.00 C ATOM 1876 CD GLU A 124 19.305 -4.083 -0.462 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.532 -3.873 -0.609 1.00 0.00 O ATOM 1878 OE2 GLU A 124 18.877 -5.166 0.010 1.00 0.00 O ATOM 0 H GLU A 124 18.253 -0.217 -1.473 1.00 0.00 H new ATOM 0 HA GLU A 124 16.121 -1.484 -0.177 1.00 0.00 H new ATOM 0 HB2 GLU A 124 19.093 -1.492 0.467 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.930 -2.567 1.219 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.333 -3.426 -1.093 1.00 0.00 H new ATOM 0 HG3 GLU A 124 18.642 -2.455 -1.738 1.00 0.00 H new ATOM 1885 N ASN A 125 17.531 0.905 1.585 1.00 0.00 N ATOM 1886 CA ASN A 125 17.336 1.738 2.765 1.00 0.00 C ATOM 1887 C ASN A 125 16.028 2.545 2.710 1.00 0.00 C ATOM 1888 O ASN A 125 15.434 2.816 3.751 1.00 0.00 O ATOM 1889 CB ASN A 125 18.605 2.573 3.034 1.00 0.00 C ATOM 1890 CG ASN A 125 18.392 4.077 3.056 1.00 0.00 C ATOM 1891 OD1 ASN A 125 18.338 4.716 4.095 1.00 0.00 O ATOM 1892 ND2 ASN A 125 18.255 4.680 1.898 1.00 0.00 N ATOM 0 H ASN A 125 18.250 1.239 0.943 1.00 0.00 H new ATOM 0 HA ASN A 125 17.199 1.097 3.635 1.00 0.00 H new ATOM 0 HB2 ASN A 125 19.027 2.267 3.991 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.345 2.337 2.270 1.00 0.00 H new ATOM 0 HD21 ASN A 125 18.102 5.688 1.863 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.301 4.141 1.034 1.00 0.00 H new ATOM 1899 N LEU A 126 15.564 2.899 1.509 1.00 0.00 N ATOM 1900 CA LEU A 126 14.319 3.631 1.298 1.00 0.00 C ATOM 1901 C LEU A 126 13.099 2.725 1.434 1.00 0.00 C ATOM 1902 O LEU A 126 12.188 3.054 2.189 1.00 0.00 O ATOM 1903 CB LEU A 126 14.393 4.326 -0.075 1.00 0.00 C ATOM 1904 CG LEU A 126 13.088 4.996 -0.537 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.602 6.074 0.430 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.324 5.619 -1.911 1.00 0.00 C ATOM 0 H LEU A 126 16.054 2.679 0.642 1.00 0.00 H new ATOM 0 HA LEU A 126 14.200 4.389 2.072 1.00 0.00 H new ATOM 0 HB2 LEU A 126 15.179 5.081 -0.041 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.690 3.590 -0.822 1.00 0.00 H new ATOM 0 HG LEU A 126 12.314 4.230 -0.575 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.678 6.512 0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.420 5.630 1.408 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.361 6.851 0.520 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.408 6.099 -2.255 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.119 6.361 -1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.614 4.842 -2.618 1.00 0.00 H new ATOM 1918 N ILE A 127 13.063 1.574 0.751 1.00 0.00 N ATOM 1919 CA ILE A 127 11.857 0.722 0.755 1.00 0.00 C ATOM 1920 C ILE A 127 11.512 0.225 2.154 1.00 0.00 C ATOM 1921 O ILE A 127 10.335 0.150 2.482 1.00 0.00 O ATOM 1922 CB ILE A 127 11.926 -0.435 -0.268 1.00 0.00 C ATOM 1923 CG1 ILE A 127 13.074 -1.441 -0.003 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.965 0.175 -1.684 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.380 -2.400 -1.159 1.00 0.00 C ATOM 0 H ILE A 127 13.838 1.212 0.196 1.00 0.00 H new ATOM 0 HA ILE A 127 11.038 1.363 0.428 1.00 0.00 H new ATOM 0 HB ILE A 127 11.031 -1.048 -0.162 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.979 -0.881 0.233 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.824 -2.029 0.880 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.014 -0.624 -2.423 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.065 0.768 -1.850 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.843 0.813 -1.781 1.00 0.00 H new ATOM 0 HD11 ILE A 127 14.197 -3.063 -0.875 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.494 -2.993 -1.384 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.667 -1.827 -2.041 1.00 0.00 H new ATOM 1937 N ALA A 128 12.500 0.003 3.020 1.00 0.00 N ATOM 1938 CA ALA A 128 12.245 -0.385 4.404 1.00 0.00 C ATOM 1939 C ALA A 128 11.583 0.731 5.254 1.00 0.00 C ATOM 1940 O ALA A 128 10.931 0.429 6.255 1.00 0.00 O ATOM 1941 CB ALA A 128 13.573 -0.855 5.010 1.00 0.00 C ATOM 0 H ALA A 128 13.489 0.086 2.784 1.00 0.00 H new ATOM 0 HA ALA A 128 11.514 -1.193 4.410 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.415 -1.152 6.047 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.951 -1.705 4.442 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.298 -0.042 4.972 1.00 0.00 H new ATOM 1947 N LYS A 129 11.706 2.008 4.844 1.00 0.00 N ATOM 1948 CA LYS A 129 11.033 3.163 5.475 1.00 0.00 C ATOM 1949 C LYS A 129 9.598 3.360 4.978 1.00 0.00 C ATOM 1950 O LYS A 129 8.724 3.697 5.779 1.00 0.00 O ATOM 1951 CB LYS A 129 11.847 4.453 5.240 1.00 0.00 C ATOM 1952 CG LYS A 129 13.239 4.414 5.889 1.00 0.00 C ATOM 1953 CD LYS A 129 14.050 5.671 5.530 1.00 0.00 C ATOM 1954 CE LYS A 129 15.507 5.604 6.018 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.621 5.676 7.507 1.00 0.00 N ATOM 0 H LYS A 129 12.288 2.272 4.049 1.00 0.00 H new ATOM 0 HA LYS A 129 10.979 2.947 6.542 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.957 4.616 4.168 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.292 5.303 5.636 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.137 4.339 6.972 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.774 3.524 5.557 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.040 5.807 4.449 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.566 6.546 5.965 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.961 4.677 5.667 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.072 6.424 5.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.623 5.627 7.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.214 6.572 7.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.106 4.880 7.934 1.00 0.00 H new ATOM 1969 N ILE A 130 9.357 3.163 3.674 1.00 0.00 N ATOM 1970 CA ILE A 130 8.079 3.515 3.010 1.00 0.00 C ATOM 1971 C ILE A 130 7.182 2.326 2.609 1.00 0.00 C ATOM 1972 O ILE A 130 6.106 2.549 2.057 1.00 0.00 O ATOM 1973 CB ILE A 130 8.276 4.570 1.890 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.206 4.155 0.730 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.830 5.868 2.504 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.659 3.053 -0.171 1.00 0.00 C ATOM 0 H ILE A 130 10.043 2.753 3.040 1.00 0.00 H new ATOM 0 HA ILE A 130 7.485 3.993 3.789 1.00 0.00 H new ATOM 0 HB ILE A 130 7.286 4.695 1.452 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.414 5.033 0.119 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.157 3.824 1.147 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.969 6.611 1.719 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.127 6.250 3.244 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.787 5.664 2.984 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.383 2.831 -0.955 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.478 2.156 0.421 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.724 3.384 -0.624 1.00 0.00 H new ATOM 1988 N SER A 131 7.588 1.082 2.898 1.00 0.00 N ATOM 1989 CA SER A 131 6.751 -0.130 2.747 1.00 0.00 C ATOM 1990 C SER A 131 5.372 0.016 3.415 1.00 0.00 C ATOM 1991 O SER A 131 5.315 0.311 4.634 1.00 0.00 O ATOM 1992 CB SER A 131 7.458 -1.332 3.359 1.00 0.00 C ATOM 1993 OG SER A 131 8.503 -1.741 2.503 1.00 0.00 O ATOM 1994 OXT SER A 131 4.346 -0.184 2.723 1.00 0.00 O ATOM 0 H SER A 131 8.524 0.880 3.250 1.00 0.00 H new ATOM 0 HA SER A 131 6.599 -0.272 1.677 1.00 0.00 H new ATOM 0 HB2 SER A 131 7.856 -1.074 4.341 1.00 0.00 H new ATOM 0 HB3 SER A 131 6.751 -2.149 3.506 1.00 0.00 H new ATOM 0 HG SER A 131 9.157 -1.017 2.417 1.00 0.00 H new