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 92 THR OG1 : rot -34:sc= 0.144 USER MOD Set 1.2: A 93 GLN : amide:sc= 1.04 K(o=1.2,f=0.0013) USER MOD Set 2.1: A 5 MET CE :methyl 168:sc= -0.0621 (180deg=-0.613) USER MOD Set 2.2: A 35 CYS SG : rot -90:sc= 0.127 USER MOD Set 2.3: A 69 ASN : amide:sc= 0.232 K(o=0.43,f=-0.49) USER MOD Set 2.4: A 73 TYR OH : rot -119:sc= 0.131 USER MOD Set 3.1: A 16 GLN : amide:sc= 2.15 K(o=5.7,f=-2.6) USER MOD Set 3.2: A 23 LYS NZ :NH3+ -178:sc= 1.67 (180deg=0.846) USER MOD Set 3.3: A 60 GLN : amide:sc= 1.86 K(o=5.7,f=-0.53) USER MOD Set 4.1: A 11 ASN : amide:sc= 0.761 K(o=3.5,f=-4.5!) USER MOD Set 4.2: A 15 SER OG : rot -16:sc= 1.01 USER MOD Set 4.3: A 34 SER OG : rot -92:sc= 1.71 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 142:sc= 1.21 (180deg=0.552) USER MOD Single : A 2 LYS NZ :NH3+ 159:sc= 1.31 (180deg=1.14) USER MOD Single : A 3 LYS NZ :NH3+ -162:sc= 0.936 (180deg=0.547) USER MOD Single : A 8 CYS SG : rot 64:sc= 0.187 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 160:sc= 0.0427 USER MOD Single : A 13 CYS SG : rot 147:sc= 0.934 USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.0444 USER MOD Single : A 29 LYS NZ :NH3+ -169:sc= 0.895 (180deg=0.806) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0974 USER MOD Single : A 40 SER OG : rot 120:sc= 0.65 USER MOD Single : A 43 HIS : no HD1:sc= -0.0305 K(o=-0.03,f=-2.4) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 173:sc= -0.285 (180deg=-0.422) USER MOD Single : A 50 MET CE :methyl -139:sc= -0.257 (180deg=-2.59) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.688 USER MOD Single : A 62 SER OG : rot -112:sc= 0.653 USER MOD Single : A 67 ASN : amide:sc= 0.815 K(o=0.82,f=-0.2) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 GLN : amide:sc= 1.21 K(o=1.2,f=-0.34) USER MOD Single : A 107 GLN : amide:sc= 0.242 K(o=0.24,f=-0.82) USER MOD Single : A 108 SER OG : rot 32:sc= 0.833 USER MOD Single : A 114 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 118 GLN : amide:sc= 0.886 K(o=0.89,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= 0.38 X(o=0.38,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 82:sc= 1.27 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.667 -0.029 1.176 1.00 0.00 N ATOM 2 CA MET A 1 2.145 0.242 -0.208 1.00 0.00 C ATOM 3 C MET A 1 2.192 1.745 -0.506 1.00 0.00 C ATOM 4 O MET A 1 1.171 2.423 -0.420 1.00 0.00 O ATOM 5 CB MET A 1 1.331 -0.530 -1.281 1.00 0.00 C ATOM 6 CG MET A 1 1.790 -0.219 -2.719 1.00 0.00 C ATOM 7 SD MET A 1 1.072 -1.249 -4.031 1.00 0.00 S ATOM 8 CE MET A 1 2.058 -2.760 -3.846 1.00 0.00 C ATOM 0 H1 MET A 1 1.060 -0.873 1.174 1.00 0.00 H new ATOM 0 H2 MET A 1 2.483 -0.191 1.800 1.00 0.00 H new ATOM 0 H3 MET A 1 1.124 0.788 1.522 1.00 0.00 H new ATOM 0 HA MET A 1 3.166 -0.135 -0.263 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.423 -1.601 -1.099 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.275 -0.279 -1.179 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.556 0.823 -2.935 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.875 -0.318 -2.761 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.738 -3.496 -4.584 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.112 -2.528 -3.999 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.917 -3.166 -2.844 1.00 0.00 H new ATOM 18 N LYS A 2 3.368 2.245 -0.916 1.00 0.00 N ATOM 19 CA LYS A 2 3.599 3.601 -1.464 1.00 0.00 C ATOM 20 C LYS A 2 4.372 3.521 -2.791 1.00 0.00 C ATOM 21 O LYS A 2 4.897 2.462 -3.136 1.00 0.00 O ATOM 22 CB LYS A 2 4.301 4.479 -0.405 1.00 0.00 C ATOM 23 CG LYS A 2 3.335 4.844 0.736 1.00 0.00 C ATOM 24 CD LYS A 2 3.982 5.744 1.799 1.00 0.00 C ATOM 25 CE LYS A 2 2.924 6.131 2.843 1.00 0.00 C ATOM 26 NZ LYS A 2 3.508 6.921 3.960 1.00 0.00 N ATOM 0 H LYS A 2 4.226 1.694 -0.875 1.00 0.00 H new ATOM 0 HA LYS A 2 2.645 4.076 -1.694 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.163 3.948 -0.001 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.677 5.389 -0.873 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.463 5.350 0.320 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.977 3.930 1.210 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.810 5.223 2.279 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.395 6.639 1.333 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.135 6.710 2.363 1.00 0.00 H new ATOM 0 HE3 LYS A 2 2.460 5.229 3.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 2.755 7.455 4.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 3.962 6.278 4.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.216 7.583 3.584 1.00 0.00 H new ATOM 40 N LYS A 3 4.408 4.616 -3.552 1.00 0.00 N ATOM 41 CA LYS A 3 5.028 4.699 -4.892 1.00 0.00 C ATOM 42 C LYS A 3 6.327 5.503 -4.837 1.00 0.00 C ATOM 43 O LYS A 3 6.402 6.519 -4.149 1.00 0.00 O ATOM 44 CB LYS A 3 4.045 5.271 -5.939 1.00 0.00 C ATOM 45 CG LYS A 3 2.784 4.417 -6.191 1.00 0.00 C ATOM 46 CD LYS A 3 1.628 4.556 -5.180 1.00 0.00 C ATOM 47 CE LYS A 3 1.084 5.991 -5.120 1.00 0.00 C ATOM 48 NZ LYS A 3 0.284 6.242 -3.889 1.00 0.00 N ATOM 0 H LYS A 3 3.997 5.500 -3.252 1.00 0.00 H new ATOM 0 HA LYS A 3 5.276 3.687 -5.211 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.733 6.264 -5.617 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.576 5.394 -6.883 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.400 4.665 -7.180 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.085 3.370 -6.219 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.823 3.874 -5.454 1.00 0.00 H new ATOM 0 HD3 LYS A 3 1.974 4.258 -4.190 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.916 6.694 -5.160 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.465 6.179 -5.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.305 7.089 -4.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.327 5.422 -3.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.924 6.391 -3.083 1.00 0.00 H new ATOM 62 N VAL A 4 7.333 5.064 -5.592 1.00 0.00 N ATOM 63 CA VAL A 4 8.644 5.743 -5.700 1.00 0.00 C ATOM 64 C VAL A 4 8.966 6.035 -7.169 1.00 0.00 C ATOM 65 O VAL A 4 8.700 5.211 -8.040 1.00 0.00 O ATOM 66 CB VAL A 4 9.790 4.980 -4.994 1.00 0.00 C ATOM 67 CG1 VAL A 4 11.064 5.830 -4.900 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.419 4.497 -3.585 1.00 0.00 C ATOM 0 H VAL A 4 7.270 4.217 -6.157 1.00 0.00 H new ATOM 0 HA VAL A 4 8.563 6.690 -5.166 1.00 0.00 H new ATOM 0 HB VAL A 4 9.972 4.105 -5.618 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.846 5.260 -4.398 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.397 6.098 -5.903 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.855 6.737 -4.332 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.266 3.970 -3.146 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.163 5.354 -2.962 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.564 3.823 -3.645 1.00 0.00 H new ATOM 78 N MET A 5 9.557 7.194 -7.448 1.00 0.00 N ATOM 79 CA MET A 5 9.958 7.609 -8.797 1.00 0.00 C ATOM 80 C MET A 5 11.384 8.153 -8.788 1.00 0.00 C ATOM 81 O MET A 5 11.755 8.937 -7.918 1.00 0.00 O ATOM 82 CB MET A 5 8.929 8.599 -9.361 1.00 0.00 C ATOM 83 CG MET A 5 9.375 9.344 -10.627 1.00 0.00 C ATOM 84 SD MET A 5 9.799 8.340 -12.077 1.00 0.00 S ATOM 85 CE MET A 5 8.368 8.666 -13.143 1.00 0.00 C ATOM 0 H MET A 5 9.776 7.887 -6.732 1.00 0.00 H new ATOM 0 HA MET A 5 9.969 6.748 -9.466 1.00 0.00 H new ATOM 0 HB2 MET A 5 8.009 8.058 -9.581 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.692 9.332 -8.590 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.578 10.030 -10.913 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.243 9.952 -10.372 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.572 8.298 -14.149 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.492 8.157 -12.741 1.00 0.00 H new ATOM 0 HE3 MET A 5 8.179 9.739 -13.181 1.00 0.00 H new ATOM 95 N PHE A 6 12.174 7.746 -9.777 1.00 0.00 N ATOM 96 CA PHE A 6 13.605 8.056 -9.887 1.00 0.00 C ATOM 97 C PHE A 6 13.893 8.968 -11.091 1.00 0.00 C ATOM 98 O PHE A 6 13.797 8.517 -12.230 1.00 0.00 O ATOM 99 CB PHE A 6 14.390 6.731 -9.962 1.00 0.00 C ATOM 100 CG PHE A 6 14.042 5.720 -8.882 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.558 5.853 -7.580 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.195 4.640 -9.186 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.191 4.938 -6.573 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.822 3.733 -8.180 1.00 0.00 C ATOM 105 CZ PHE A 6 13.296 3.894 -6.869 1.00 0.00 C ATOM 0 H PHE A 6 11.831 7.174 -10.549 1.00 0.00 H new ATOM 0 HA PHE A 6 13.929 8.611 -9.007 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.213 6.275 -10.936 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.456 6.953 -9.902 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.238 6.660 -7.351 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.831 4.507 -10.194 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.596 5.038 -5.577 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.167 2.908 -8.417 1.00 0.00 H new ATOM 0 HZ PHE A 6 12.975 3.219 -6.090 1.00 0.00 H new ATOM 115 N VAL A 7 14.274 10.226 -10.849 1.00 0.00 N ATOM 116 CA VAL A 7 14.757 11.209 -11.843 1.00 0.00 C ATOM 117 C VAL A 7 16.267 11.097 -12.053 1.00 0.00 C ATOM 118 O VAL A 7 17.022 10.856 -11.121 1.00 0.00 O ATOM 119 CB VAL A 7 14.330 12.661 -11.464 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.349 13.771 -11.778 1.00 0.00 C ATOM 121 CG2 VAL A 7 13.053 13.038 -12.220 1.00 0.00 C ATOM 0 H VAL A 7 14.255 10.614 -9.906 1.00 0.00 H new ATOM 0 HA VAL A 7 14.282 10.973 -12.795 1.00 0.00 H new ATOM 0 HB VAL A 7 14.213 12.619 -10.381 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.943 14.735 -11.471 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.275 13.579 -11.236 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.552 13.787 -12.849 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.758 14.053 -11.953 1.00 0.00 H new ATOM 0 HG22 VAL A 7 13.236 12.984 -13.293 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.254 12.346 -11.953 1.00 0.00 H new ATOM 131 N CYS A 8 16.725 11.339 -13.278 1.00 0.00 N ATOM 132 CA CYS A 8 18.131 11.516 -13.673 1.00 0.00 C ATOM 133 C CYS A 8 18.173 12.578 -14.797 1.00 0.00 C ATOM 134 O CYS A 8 17.124 13.105 -15.151 1.00 0.00 O ATOM 135 CB CYS A 8 18.660 10.121 -14.056 1.00 0.00 C ATOM 136 SG CYS A 8 20.451 10.116 -14.378 1.00 0.00 S ATOM 0 H CYS A 8 16.092 11.423 -14.073 1.00 0.00 H new ATOM 0 HA CYS A 8 18.783 11.894 -12.886 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.437 9.419 -13.253 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.134 9.768 -14.943 1.00 0.00 H new ATOM 0 HG CYS A 8 21.089 10.423 -13.288 1.00 0.00 H new ATOM 142 N LYS A 9 19.322 12.894 -15.418 1.00 0.00 N ATOM 143 CA LYS A 9 19.323 13.802 -16.595 1.00 0.00 C ATOM 144 C LYS A 9 18.545 13.192 -17.769 1.00 0.00 C ATOM 145 O LYS A 9 17.472 13.667 -18.106 1.00 0.00 O ATOM 146 CB LYS A 9 20.745 14.232 -17.020 1.00 0.00 C ATOM 147 CG LYS A 9 21.502 15.063 -15.973 1.00 0.00 C ATOM 148 CD LYS A 9 22.705 15.802 -16.591 1.00 0.00 C ATOM 149 CE LYS A 9 23.655 14.907 -17.420 1.00 0.00 C ATOM 150 NZ LYS A 9 24.814 15.691 -17.948 1.00 0.00 N ATOM 0 H LYS A 9 20.241 12.550 -15.141 1.00 0.00 H new ATOM 0 HA LYS A 9 18.809 14.712 -16.286 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.328 13.339 -17.246 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.675 14.810 -17.942 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.823 15.787 -15.523 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.849 14.410 -15.172 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.333 16.603 -17.229 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.276 16.272 -15.790 1.00 0.00 H new ATOM 0 HE2 LYS A 9 24.019 14.087 -16.801 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.107 14.461 -18.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.434 15.065 -18.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.465 16.458 -18.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.350 16.096 -17.154 1.00 0.00 H new ATOM 164 N ARG A 10 19.067 12.085 -18.321 1.00 0.00 N ATOM 165 CA ARG A 10 18.609 11.435 -19.581 1.00 0.00 C ATOM 166 C ARG A 10 17.962 10.050 -19.431 1.00 0.00 C ATOM 167 O ARG A 10 17.620 9.414 -20.420 1.00 0.00 O ATOM 168 CB ARG A 10 19.720 11.524 -20.658 1.00 0.00 C ATOM 169 CG ARG A 10 20.963 10.614 -20.520 1.00 0.00 C ATOM 170 CD ARG A 10 21.894 10.927 -19.332 1.00 0.00 C ATOM 171 NE ARG A 10 23.134 10.113 -19.281 1.00 0.00 N ATOM 172 CZ ARG A 10 24.102 9.984 -20.176 1.00 0.00 C ATOM 173 NH1 ARG A 10 24.146 10.640 -21.295 1.00 0.00 N ATOM 174 NH2 ARG A 10 25.073 9.158 -19.964 1.00 0.00 N ATOM 0 H ARG A 10 19.850 11.591 -17.893 1.00 0.00 H new ATOM 0 HA ARG A 10 17.755 12.013 -19.933 1.00 0.00 H new ATOM 0 HB2 ARG A 10 19.261 11.313 -21.624 1.00 0.00 H new ATOM 0 HB3 ARG A 10 20.068 12.556 -20.689 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.626 9.581 -20.431 1.00 0.00 H new ATOM 0 HG3 ARG A 10 21.544 10.682 -21.440 1.00 0.00 H new ATOM 0 HD2 ARG A 10 22.169 11.981 -19.372 1.00 0.00 H new ATOM 0 HD3 ARG A 10 21.340 10.778 -18.405 1.00 0.00 H new ATOM 0 HE ARG A 10 23.260 9.570 -18.427 1.00 0.00 H new ATOM 0 HH11 ARG A 10 23.406 11.302 -21.528 1.00 0.00 H new ATOM 0 HH12 ARG A 10 24.921 10.494 -21.942 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.094 8.605 -19.107 1.00 0.00 H new ATOM 0 HH22 ARG A 10 25.818 9.059 -20.654 1.00 0.00 H new ATOM 188 N ASN A 11 17.815 9.579 -18.187 1.00 0.00 N ATOM 189 CA ASN A 11 17.208 8.290 -17.781 1.00 0.00 C ATOM 190 C ASN A 11 17.804 7.054 -18.480 1.00 0.00 C ATOM 191 O ASN A 11 17.105 6.079 -18.732 1.00 0.00 O ATOM 192 CB ASN A 11 15.680 8.460 -17.868 1.00 0.00 C ATOM 193 CG ASN A 11 14.813 7.317 -17.342 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.836 6.956 -17.970 1.00 0.00 O ATOM 195 ND2 ASN A 11 15.068 6.743 -16.189 1.00 0.00 N ATOM 0 H ASN A 11 18.134 10.116 -17.381 1.00 0.00 H new ATOM 0 HA ASN A 11 17.465 8.056 -16.748 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.411 9.365 -17.323 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.419 8.627 -18.913 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.452 6.010 -15.837 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.882 7.030 -15.645 1.00 0.00 H new ATOM 202 N SER A 12 19.101 7.105 -18.797 1.00 0.00 N ATOM 203 CA SER A 12 19.831 6.048 -19.517 1.00 0.00 C ATOM 204 C SER A 12 20.355 4.953 -18.584 1.00 0.00 C ATOM 205 O SER A 12 20.292 3.774 -18.913 1.00 0.00 O ATOM 206 CB SER A 12 20.996 6.685 -20.269 1.00 0.00 C ATOM 207 OG SER A 12 21.722 7.454 -19.326 1.00 0.00 O ATOM 0 H SER A 12 19.691 7.901 -18.555 1.00 0.00 H new ATOM 0 HA SER A 12 19.136 5.569 -20.207 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.632 5.921 -20.716 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.633 7.313 -21.083 1.00 0.00 H new ATOM 0 HG SER A 12 22.628 7.615 -19.663 1.00 0.00 H new ATOM 213 N CYS A 13 20.864 5.354 -17.416 1.00 0.00 N ATOM 214 CA CYS A 13 21.399 4.506 -16.343 1.00 0.00 C ATOM 215 C CYS A 13 20.898 5.032 -14.977 1.00 0.00 C ATOM 216 O CYS A 13 19.823 5.625 -14.929 1.00 0.00 O ATOM 217 CB CYS A 13 22.933 4.475 -16.531 1.00 0.00 C ATOM 218 SG CYS A 13 23.682 3.123 -15.568 1.00 0.00 S ATOM 0 H CYS A 13 20.918 6.344 -17.177 1.00 0.00 H new ATOM 0 HA CYS A 13 21.049 3.474 -16.378 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.171 4.349 -17.587 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.360 5.428 -16.220 1.00 0.00 H new ATOM 0 HG CYS A 13 24.717 2.659 -16.203 1.00 0.00 H new ATOM 224 N ARG A 14 21.622 4.814 -13.864 1.00 0.00 N ATOM 225 CA ARG A 14 21.313 5.298 -12.482 1.00 0.00 C ATOM 226 C ARG A 14 19.865 5.031 -12.051 1.00 0.00 C ATOM 227 O ARG A 14 19.556 3.956 -11.564 1.00 0.00 O ATOM 228 CB ARG A 14 21.794 6.771 -12.310 1.00 0.00 C ATOM 229 CG ARG A 14 23.326 6.907 -12.318 1.00 0.00 C ATOM 230 CD ARG A 14 23.807 8.351 -12.097 1.00 0.00 C ATOM 231 NE ARG A 14 23.674 9.202 -13.307 1.00 0.00 N ATOM 232 CZ ARG A 14 23.929 10.500 -13.381 1.00 0.00 C ATOM 233 NH1 ARG A 14 24.439 11.172 -12.398 1.00 0.00 N ATOM 234 NH2 ARG A 14 23.701 11.152 -14.481 1.00 0.00 N ATOM 0 H ARG A 14 22.484 4.269 -13.892 1.00 0.00 H new ATOM 0 HA ARG A 14 21.885 4.701 -11.772 1.00 0.00 H new ATOM 0 HB2 ARG A 14 21.376 7.380 -13.112 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.404 7.168 -11.373 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.745 6.268 -11.541 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.712 6.544 -13.271 1.00 0.00 H new ATOM 0 HD2 ARG A 14 23.236 8.797 -11.282 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.851 8.336 -11.784 1.00 0.00 H new ATOM 0 HE ARG A 14 23.356 8.744 -14.161 1.00 0.00 H new ATOM 0 HH11 ARG A 14 24.662 10.702 -11.520 1.00 0.00 H new ATOM 0 HH12 ARG A 14 24.618 12.171 -12.502 1.00 0.00 H new ATOM 0 HH21 ARG A 14 23.324 10.665 -15.294 1.00 0.00 H new ATOM 0 HH22 ARG A 14 23.899 12.151 -14.532 1.00 0.00 H new ATOM 248 N SER A 15 18.957 5.963 -12.337 1.00 0.00 N ATOM 249 CA SER A 15 17.485 5.839 -12.205 1.00 0.00 C ATOM 250 C SER A 15 16.896 4.521 -12.740 1.00 0.00 C ATOM 251 O SER A 15 16.045 3.923 -12.089 1.00 0.00 O ATOM 252 CB SER A 15 16.847 7.032 -12.930 1.00 0.00 C ATOM 253 OG SER A 15 17.207 7.023 -14.313 1.00 0.00 O ATOM 0 H SER A 15 19.232 6.880 -12.688 1.00 0.00 H new ATOM 0 HA SER A 15 17.257 5.833 -11.139 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.762 6.990 -12.829 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.174 7.964 -12.468 1.00 0.00 H new ATOM 0 HG SER A 15 17.971 6.424 -14.448 1.00 0.00 H new ATOM 259 N GLN A 16 17.410 4.007 -13.863 1.00 0.00 N ATOM 260 CA GLN A 16 16.992 2.707 -14.423 1.00 0.00 C ATOM 261 C GLN A 16 17.418 1.525 -13.531 1.00 0.00 C ATOM 262 O GLN A 16 16.636 0.604 -13.324 1.00 0.00 O ATOM 263 CB GLN A 16 17.574 2.550 -15.842 1.00 0.00 C ATOM 264 CG GLN A 16 17.023 3.578 -16.844 1.00 0.00 C ATOM 265 CD GLN A 16 15.618 3.270 -17.369 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.994 2.260 -17.075 1.00 0.00 O ATOM 267 NE2 GLN A 16 15.096 4.130 -18.207 1.00 0.00 N ATOM 0 H GLN A 16 18.129 4.477 -14.413 1.00 0.00 H new ATOM 0 HA GLN A 16 15.903 2.693 -14.467 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.659 2.645 -15.795 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.358 1.546 -16.207 1.00 0.00 H new ATOM 0 HG2 GLN A 16 17.011 4.559 -16.368 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.706 3.642 -17.691 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.610 4.975 -18.457 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.175 3.955 -18.610 1.00 0.00 H new ATOM 276 N MET A 17 18.619 1.564 -12.933 1.00 0.00 N ATOM 277 CA MET A 17 19.055 0.571 -11.926 1.00 0.00 C ATOM 278 C MET A 17 18.214 0.660 -10.646 1.00 0.00 C ATOM 279 O MET A 17 17.908 -0.363 -10.046 1.00 0.00 O ATOM 280 CB MET A 17 20.547 0.752 -11.576 1.00 0.00 C ATOM 281 CG MET A 17 21.524 0.441 -12.715 1.00 0.00 C ATOM 282 SD MET A 17 23.241 0.647 -12.180 1.00 0.00 S ATOM 283 CE MET A 17 24.068 -0.328 -13.459 1.00 0.00 C ATOM 0 H MET A 17 19.317 2.281 -13.130 1.00 0.00 H new ATOM 0 HA MET A 17 18.911 -0.414 -12.369 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.706 1.781 -11.252 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.786 0.110 -10.728 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.369 -0.581 -13.062 1.00 0.00 H new ATOM 0 HG3 MET A 17 21.322 1.099 -13.560 1.00 0.00 H new ATOM 0 HE1 MET A 17 25.144 -0.314 -13.288 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.708 -1.356 -13.422 1.00 0.00 H new ATOM 0 HE3 MET A 17 23.851 0.098 -14.439 1.00 0.00 H new ATOM 293 N ALA A 18 17.789 1.864 -10.246 1.00 0.00 N ATOM 294 CA ALA A 18 16.940 2.059 -9.060 1.00 0.00 C ATOM 295 C ALA A 18 15.566 1.404 -9.235 1.00 0.00 C ATOM 296 O ALA A 18 15.126 0.641 -8.378 1.00 0.00 O ATOM 297 CB ALA A 18 16.852 3.560 -8.760 1.00 0.00 C ATOM 0 H ALA A 18 18.022 2.730 -10.732 1.00 0.00 H new ATOM 0 HA ALA A 18 17.388 1.562 -8.200 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.225 3.720 -7.883 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.851 3.952 -8.569 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.417 4.077 -9.615 1.00 0.00 H new ATOM 303 N GLU A 19 14.940 1.592 -10.399 1.00 0.00 N ATOM 304 CA GLU A 19 13.732 0.849 -10.781 1.00 0.00 C ATOM 305 C GLU A 19 14.029 -0.655 -10.887 1.00 0.00 C ATOM 306 O GLU A 19 13.252 -1.466 -10.394 1.00 0.00 O ATOM 307 CB GLU A 19 13.191 1.450 -12.087 1.00 0.00 C ATOM 308 CG GLU A 19 11.851 0.853 -12.537 1.00 0.00 C ATOM 309 CD GLU A 19 11.277 1.556 -13.787 1.00 0.00 C ATOM 310 OE1 GLU A 19 11.961 2.432 -14.368 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.130 1.239 -14.182 1.00 0.00 O ATOM 0 H GLU A 19 15.253 2.261 -11.103 1.00 0.00 H new ATOM 0 HA GLU A 19 12.962 0.944 -10.016 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.074 2.526 -11.959 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.928 1.301 -12.877 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.983 -0.208 -12.750 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.132 0.927 -11.721 1.00 0.00 H new ATOM 318 N GLY A 20 15.198 -1.023 -11.425 1.00 0.00 N ATOM 319 CA GLY A 20 15.705 -2.398 -11.518 1.00 0.00 C ATOM 320 C GLY A 20 15.768 -3.152 -10.189 1.00 0.00 C ATOM 321 O GLY A 20 15.312 -4.284 -10.120 1.00 0.00 O ATOM 0 H GLY A 20 15.844 -0.342 -11.824 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.072 -2.957 -12.207 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.704 -2.373 -11.953 1.00 0.00 H new ATOM 325 N PHE A 21 16.267 -2.542 -9.113 1.00 0.00 N ATOM 326 CA PHE A 21 16.267 -3.177 -7.785 1.00 0.00 C ATOM 327 C PHE A 21 14.935 -3.027 -7.055 1.00 0.00 C ATOM 328 O PHE A 21 14.480 -3.953 -6.396 1.00 0.00 O ATOM 329 CB PHE A 21 17.406 -2.598 -6.939 1.00 0.00 C ATOM 330 CG PHE A 21 18.765 -3.079 -7.378 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.106 -4.432 -7.200 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.686 -2.190 -7.953 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.376 -4.890 -7.583 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.952 -2.650 -8.342 1.00 0.00 C ATOM 335 CZ PHE A 21 21.298 -4.002 -8.154 1.00 0.00 C ATOM 0 H PHE A 21 16.678 -1.608 -9.130 1.00 0.00 H new ATOM 0 HA PHE A 21 16.419 -4.246 -7.936 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.376 -1.510 -6.994 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.250 -2.869 -5.895 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.391 -5.118 -6.769 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.420 -1.153 -8.096 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.643 -5.926 -7.438 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.662 -1.968 -8.786 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.275 -4.355 -8.450 1.00 0.00 H new ATOM 345 N ALA A 22 14.276 -1.876 -7.163 1.00 0.00 N ATOM 346 CA ALA A 22 13.018 -1.664 -6.453 1.00 0.00 C ATOM 347 C ALA A 22 11.880 -2.561 -6.978 1.00 0.00 C ATOM 348 O ALA A 22 11.076 -3.038 -6.180 1.00 0.00 O ATOM 349 CB ALA A 22 12.689 -0.173 -6.499 1.00 0.00 C ATOM 0 H ALA A 22 14.587 -1.085 -7.728 1.00 0.00 H new ATOM 0 HA ALA A 22 13.130 -1.966 -5.412 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.751 0.009 -5.974 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.489 0.391 -6.020 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.591 0.146 -7.537 1.00 0.00 H new ATOM 355 N LYS A 23 11.839 -2.881 -8.281 1.00 0.00 N ATOM 356 CA LYS A 23 10.811 -3.777 -8.853 1.00 0.00 C ATOM 357 C LYS A 23 10.890 -5.212 -8.312 1.00 0.00 C ATOM 358 O LYS A 23 9.868 -5.888 -8.221 1.00 0.00 O ATOM 359 CB LYS A 23 10.879 -3.740 -10.393 1.00 0.00 C ATOM 360 CG LYS A 23 12.111 -4.451 -10.974 1.00 0.00 C ATOM 361 CD LYS A 23 12.456 -4.089 -12.430 1.00 0.00 C ATOM 362 CE LYS A 23 11.410 -4.585 -13.441 1.00 0.00 C ATOM 363 NZ LYS A 23 11.881 -4.413 -14.850 1.00 0.00 N ATOM 0 H LYS A 23 12.509 -2.532 -8.966 1.00 0.00 H new ATOM 0 HA LYS A 23 9.838 -3.402 -8.534 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.979 -4.202 -10.799 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.881 -2.701 -10.723 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.972 -4.221 -10.346 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.951 -5.527 -10.913 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.550 -3.006 -12.516 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.427 -4.515 -12.683 1.00 0.00 H new ATOM 0 HE2 LYS A 23 11.194 -5.637 -13.255 1.00 0.00 H new ATOM 0 HE3 LYS A 23 10.478 -4.038 -13.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.137 -4.726 -15.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 12.096 -3.411 -15.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 12.738 -4.982 -15.001 1.00 0.00 H new ATOM 377 N THR A 24 12.093 -5.659 -7.941 1.00 0.00 N ATOM 378 CA THR A 24 12.365 -6.989 -7.355 1.00 0.00 C ATOM 379 C THR A 24 12.309 -6.987 -5.820 1.00 0.00 C ATOM 380 O THR A 24 11.528 -7.738 -5.235 1.00 0.00 O ATOM 381 CB THR A 24 13.702 -7.566 -7.846 1.00 0.00 C ATOM 382 OG1 THR A 24 14.766 -6.762 -7.401 1.00 0.00 O ATOM 383 CG2 THR A 24 13.815 -7.590 -9.367 1.00 0.00 C ATOM 0 H THR A 24 12.936 -5.093 -8.040 1.00 0.00 H new ATOM 0 HA THR A 24 11.562 -7.638 -7.705 1.00 0.00 H new ATOM 0 HB THR A 24 13.745 -8.582 -7.452 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.614 -7.138 -7.717 1.00 0.00 H new ATOM 0 HG21 THR A 24 14.780 -8.008 -9.654 1.00 0.00 H new ATOM 0 HG22 THR A 24 13.016 -8.205 -9.782 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.730 -6.575 -9.754 1.00 0.00 H new ATOM 391 N LEU A 25 13.080 -6.116 -5.156 1.00 0.00 N ATOM 392 CA LEU A 25 13.217 -6.056 -3.687 1.00 0.00 C ATOM 393 C LEU A 25 11.984 -5.443 -3.005 1.00 0.00 C ATOM 394 O LEU A 25 11.710 -5.709 -1.833 1.00 0.00 O ATOM 395 CB LEU A 25 14.509 -5.282 -3.324 1.00 0.00 C ATOM 396 CG LEU A 25 15.794 -5.817 -3.989 1.00 0.00 C ATOM 397 CD1 LEU A 25 16.975 -4.963 -3.553 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.090 -7.271 -3.616 1.00 0.00 C ATOM 0 H LEU A 25 13.643 -5.413 -5.635 1.00 0.00 H new ATOM 0 HA LEU A 25 13.290 -7.076 -3.310 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.380 -4.237 -3.605 1.00 0.00 H new ATOM 0 HB3 LEU A 25 14.639 -5.308 -2.242 1.00 0.00 H new ATOM 0 HG LEU A 25 15.641 -5.770 -5.067 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.886 -5.337 -4.020 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.809 -3.930 -3.857 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.077 -5.010 -2.469 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.005 -7.595 -4.112 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.215 -7.351 -2.536 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.261 -7.904 -3.934 1.00 0.00 H new ATOM 410 N GLY A 26 11.231 -4.624 -3.743 1.00 0.00 N ATOM 411 CA GLY A 26 9.977 -3.995 -3.330 1.00 0.00 C ATOM 412 C GLY A 26 8.712 -4.664 -3.870 1.00 0.00 C ATOM 413 O GLY A 26 7.630 -4.125 -3.660 1.00 0.00 O ATOM 0 H GLY A 26 11.495 -4.369 -4.695 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.931 -3.990 -2.241 1.00 0.00 H new ATOM 0 HA3 GLY A 26 9.986 -2.954 -3.653 1.00 0.00 H new ATOM 417 N ALA A 27 8.804 -5.811 -4.551 1.00 0.00 N ATOM 418 CA ALA A 27 7.654 -6.491 -5.163 1.00 0.00 C ATOM 419 C ALA A 27 6.524 -6.774 -4.148 1.00 0.00 C ATOM 420 O ALA A 27 6.701 -7.541 -3.199 1.00 0.00 O ATOM 421 CB ALA A 27 8.143 -7.789 -5.819 1.00 0.00 C ATOM 0 H ALA A 27 9.688 -6.300 -4.695 1.00 0.00 H new ATOM 0 HA ALA A 27 7.223 -5.831 -5.916 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.300 -8.305 -6.278 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.884 -7.554 -6.583 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.594 -8.432 -5.063 1.00 0.00 H new ATOM 427 N GLY A 28 5.365 -6.126 -4.329 1.00 0.00 N ATOM 428 CA GLY A 28 4.191 -6.253 -3.445 1.00 0.00 C ATOM 429 C GLY A 28 4.213 -5.320 -2.226 1.00 0.00 C ATOM 430 O GLY A 28 3.182 -5.118 -1.585 1.00 0.00 O ATOM 0 H GLY A 28 5.211 -5.486 -5.108 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.291 -6.052 -4.025 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.123 -7.284 -3.097 1.00 0.00 H new ATOM 434 N LYS A 29 5.367 -4.698 -1.945 1.00 0.00 N ATOM 435 CA LYS A 29 5.539 -3.612 -0.964 1.00 0.00 C ATOM 436 C LYS A 29 5.298 -2.253 -1.612 1.00 0.00 C ATOM 437 O LYS A 29 4.645 -1.401 -1.022 1.00 0.00 O ATOM 438 CB LYS A 29 6.952 -3.682 -0.359 1.00 0.00 C ATOM 439 CG LYS A 29 7.114 -4.864 0.609 1.00 0.00 C ATOM 440 CD LYS A 29 8.474 -5.569 0.502 1.00 0.00 C ATOM 441 CE LYS A 29 9.644 -4.733 1.046 1.00 0.00 C ATOM 442 NZ LYS A 29 10.926 -5.500 0.967 1.00 0.00 N ATOM 0 H LYS A 29 6.240 -4.945 -2.411 1.00 0.00 H new ATOM 0 HA LYS A 29 4.805 -3.736 -0.168 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.684 -3.769 -1.161 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.166 -2.752 0.168 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.979 -4.507 1.630 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.323 -5.589 0.418 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.429 -6.513 1.046 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.667 -5.812 -0.543 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.732 -3.808 0.476 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.446 -4.452 2.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.663 -5.000 1.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.788 -6.449 1.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.219 -5.585 -0.027 1.00 0.00 H new ATOM 456 N ILE A 30 5.808 -2.043 -2.828 1.00 0.00 N ATOM 457 CA ILE A 30 5.772 -0.759 -3.546 1.00 0.00 C ATOM 458 C ILE A 30 5.484 -0.912 -5.048 1.00 0.00 C ATOM 459 O ILE A 30 5.434 -2.022 -5.579 1.00 0.00 O ATOM 460 CB ILE A 30 7.082 0.042 -3.291 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.416 -0.610 -3.716 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.256 0.361 -1.799 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.553 -1.003 -5.190 1.00 0.00 C ATOM 0 H ILE A 30 6.272 -2.781 -3.359 1.00 0.00 H new ATOM 0 HA ILE A 30 4.932 -0.193 -3.143 1.00 0.00 H new ATOM 0 HB ILE A 30 6.920 0.912 -3.927 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.224 0.079 -3.472 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.565 -1.504 -3.111 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.180 0.921 -1.652 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.411 0.957 -1.453 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.301 -0.568 -1.231 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.533 -1.449 -5.358 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.777 -1.724 -5.448 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.446 -0.116 -5.814 1.00 0.00 H new ATOM 475 N ALA A 31 5.316 0.226 -5.727 1.00 0.00 N ATOM 476 CA ALA A 31 5.270 0.339 -7.189 1.00 0.00 C ATOM 477 C ALA A 31 6.258 1.440 -7.630 1.00 0.00 C ATOM 478 O ALA A 31 6.412 2.446 -6.935 1.00 0.00 O ATOM 479 CB ALA A 31 3.826 0.567 -7.652 1.00 0.00 C ATOM 0 H ALA A 31 5.204 1.125 -5.259 1.00 0.00 H new ATOM 0 HA ALA A 31 5.588 -0.586 -7.671 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.801 0.650 -8.739 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.206 -0.273 -7.338 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.443 1.486 -7.209 1.00 0.00 H new ATOM 485 N VAL A 32 6.983 1.240 -8.736 1.00 0.00 N ATOM 486 CA VAL A 32 8.110 2.092 -9.141 1.00 0.00 C ATOM 487 C VAL A 32 8.159 2.433 -10.627 1.00 0.00 C ATOM 488 O VAL A 32 7.739 1.650 -11.480 1.00 0.00 O ATOM 489 CB VAL A 32 9.444 1.450 -8.742 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.810 1.940 -7.345 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.497 -0.080 -8.830 1.00 0.00 C ATOM 0 H VAL A 32 6.803 0.473 -9.384 1.00 0.00 H new ATOM 0 HA VAL A 32 7.946 3.030 -8.610 1.00 0.00 H new ATOM 0 HB VAL A 32 10.179 1.768 -9.481 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.757 1.495 -7.040 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.905 3.026 -7.354 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.030 1.650 -6.642 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.484 -0.428 -8.526 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.742 -0.509 -8.171 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.302 -0.392 -9.856 1.00 0.00 H new ATOM 501 N THR A 33 8.759 3.596 -10.898 1.00 0.00 N ATOM 502 CA THR A 33 8.967 4.166 -12.238 1.00 0.00 C ATOM 503 C THR A 33 10.289 4.943 -12.263 1.00 0.00 C ATOM 504 O THR A 33 10.722 5.448 -11.226 1.00 0.00 O ATOM 505 CB THR A 33 7.802 5.123 -12.583 1.00 0.00 C ATOM 506 OG1 THR A 33 6.545 4.560 -12.246 1.00 0.00 O ATOM 507 CG2 THR A 33 7.714 5.462 -14.069 1.00 0.00 C ATOM 0 H THR A 33 9.130 4.194 -10.159 1.00 0.00 H new ATOM 0 HA THR A 33 9.003 3.360 -12.971 1.00 0.00 H new ATOM 0 HB THR A 33 8.018 6.021 -12.003 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.832 5.191 -12.476 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.875 6.137 -14.239 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.638 5.944 -14.387 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.566 4.547 -14.643 1.00 0.00 H new ATOM 515 N SER A 34 10.957 5.065 -13.409 1.00 0.00 N ATOM 516 CA SER A 34 12.100 5.970 -13.591 1.00 0.00 C ATOM 517 C SER A 34 11.881 6.915 -14.779 1.00 0.00 C ATOM 518 O SER A 34 11.159 6.595 -15.728 1.00 0.00 O ATOM 519 CB SER A 34 13.427 5.216 -13.705 1.00 0.00 C ATOM 520 OG SER A 34 13.523 4.476 -14.902 1.00 0.00 O ATOM 0 H SER A 34 10.721 4.535 -14.248 1.00 0.00 H new ATOM 0 HA SER A 34 12.167 6.581 -12.691 1.00 0.00 H new ATOM 0 HB2 SER A 34 14.252 5.927 -13.653 1.00 0.00 H new ATOM 0 HB3 SER A 34 13.533 4.542 -12.855 1.00 0.00 H new ATOM 0 HG SER A 34 13.195 3.565 -14.751 1.00 0.00 H new ATOM 526 N CYS A 35 12.478 8.105 -14.704 1.00 0.00 N ATOM 527 CA CYS A 35 12.398 9.142 -15.726 1.00 0.00 C ATOM 528 C CYS A 35 13.617 10.071 -15.671 1.00 0.00 C ATOM 529 O CYS A 35 14.534 9.871 -14.873 1.00 0.00 O ATOM 530 CB CYS A 35 11.082 9.910 -15.545 1.00 0.00 C ATOM 531 SG CYS A 35 11.103 11.000 -14.100 1.00 0.00 S ATOM 0 H CYS A 35 13.048 8.380 -13.904 1.00 0.00 H new ATOM 0 HA CYS A 35 12.407 8.685 -16.715 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.886 10.502 -16.439 1.00 0.00 H new ATOM 0 HB3 CYS A 35 10.262 9.199 -15.447 1.00 0.00 H new ATOM 0 HG CYS A 35 10.661 10.354 -13.062 1.00 0.00 H new ATOM 537 N GLY A 36 13.666 11.087 -16.526 1.00 0.00 N ATOM 538 CA GLY A 36 14.658 12.155 -16.422 1.00 0.00 C ATOM 539 C GLY A 36 14.117 13.502 -16.864 1.00 0.00 C ATOM 540 O GLY A 36 13.088 13.557 -17.525 1.00 0.00 O ATOM 0 H GLY A 36 13.022 11.195 -17.309 1.00 0.00 H new ATOM 0 HA2 GLY A 36 15.002 12.227 -15.390 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.526 11.900 -17.030 1.00 0.00 H new ATOM 544 N LEU A 37 14.790 14.603 -16.522 1.00 0.00 N ATOM 545 CA LEU A 37 14.355 15.934 -16.998 1.00 0.00 C ATOM 546 C LEU A 37 14.457 16.093 -18.529 1.00 0.00 C ATOM 547 O LEU A 37 13.868 17.005 -19.113 1.00 0.00 O ATOM 548 CB LEU A 37 14.995 17.093 -16.223 1.00 0.00 C ATOM 549 CG LEU A 37 16.531 17.023 -16.108 1.00 0.00 C ATOM 550 CD1 LEU A 37 17.160 18.412 -16.172 1.00 0.00 C ATOM 551 CD2 LEU A 37 16.907 16.402 -14.765 1.00 0.00 C ATOM 0 H LEU A 37 15.621 14.610 -15.931 1.00 0.00 H new ATOM 0 HA LEU A 37 13.290 15.991 -16.771 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.723 18.030 -16.709 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.570 17.119 -15.219 1.00 0.00 H new ATOM 0 HG LEU A 37 16.900 16.424 -16.941 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.243 18.325 -16.088 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.906 18.883 -17.122 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.780 19.022 -15.352 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.992 16.350 -14.679 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.508 17.014 -13.956 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.490 15.397 -14.699 1.00 0.00 H new ATOM 563 N GLU A 38 15.166 15.169 -19.166 1.00 0.00 N ATOM 564 CA GLU A 38 15.232 14.945 -20.612 1.00 0.00 C ATOM 565 C GLU A 38 15.277 13.425 -20.879 1.00 0.00 C ATOM 566 O GLU A 38 15.351 12.617 -19.949 1.00 0.00 O ATOM 567 CB GLU A 38 16.396 15.730 -21.256 1.00 0.00 C ATOM 568 CG GLU A 38 17.797 15.372 -20.746 1.00 0.00 C ATOM 569 CD GLU A 38 18.871 16.121 -21.556 1.00 0.00 C ATOM 570 OE1 GLU A 38 19.241 17.259 -21.179 1.00 0.00 O ATOM 571 OE2 GLU A 38 19.359 15.577 -22.576 1.00 0.00 O ATOM 0 H GLU A 38 15.752 14.509 -18.654 1.00 0.00 H new ATOM 0 HA GLU A 38 14.337 15.337 -21.094 1.00 0.00 H new ATOM 0 HB2 GLU A 38 16.368 15.567 -22.333 1.00 0.00 H new ATOM 0 HB3 GLU A 38 16.229 16.794 -21.090 1.00 0.00 H new ATOM 0 HG2 GLU A 38 17.883 15.629 -19.690 1.00 0.00 H new ATOM 0 HG3 GLU A 38 17.956 14.297 -20.826 1.00 0.00 H new ATOM 578 N SER A 39 15.207 13.012 -22.145 1.00 0.00 N ATOM 579 CA SER A 39 15.216 11.597 -22.538 1.00 0.00 C ATOM 580 C SER A 39 16.201 11.347 -23.683 1.00 0.00 C ATOM 581 O SER A 39 16.328 12.165 -24.599 1.00 0.00 O ATOM 582 CB SER A 39 13.810 11.168 -22.951 1.00 0.00 C ATOM 583 OG SER A 39 13.778 9.769 -23.146 1.00 0.00 O ATOM 0 H SER A 39 15.142 13.653 -22.935 1.00 0.00 H new ATOM 0 HA SER A 39 15.539 11.005 -21.682 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.091 11.455 -22.183 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.518 11.680 -23.868 1.00 0.00 H new ATOM 0 HG SER A 39 12.874 9.496 -23.409 1.00 0.00 H new ATOM 589 N SER A 40 16.885 10.200 -23.633 1.00 0.00 N ATOM 590 CA SER A 40 17.738 9.692 -24.720 1.00 0.00 C ATOM 591 C SER A 40 17.408 8.222 -25.040 1.00 0.00 C ATOM 592 O SER A 40 16.452 7.956 -25.773 1.00 0.00 O ATOM 593 CB SER A 40 19.216 9.978 -24.412 1.00 0.00 C ATOM 594 OG SER A 40 20.035 9.553 -25.486 1.00 0.00 O ATOM 0 H SER A 40 16.863 9.584 -22.821 1.00 0.00 H new ATOM 0 HA SER A 40 17.525 10.228 -25.645 1.00 0.00 H new ATOM 0 HB2 SER A 40 19.358 11.045 -24.238 1.00 0.00 H new ATOM 0 HB3 SER A 40 19.510 9.464 -23.497 1.00 0.00 H new ATOM 0 HG SER A 40 20.528 10.320 -25.845 1.00 0.00 H new ATOM 600 N ARG A 41 18.159 7.270 -24.471 1.00 0.00 N ATOM 601 CA ARG A 41 17.932 5.813 -24.545 1.00 0.00 C ATOM 602 C ARG A 41 18.569 5.108 -23.346 1.00 0.00 C ATOM 603 O ARG A 41 19.565 5.597 -22.816 1.00 0.00 O ATOM 604 CB ARG A 41 18.459 5.237 -25.881 1.00 0.00 C ATOM 605 CG ARG A 41 19.990 5.157 -26.078 1.00 0.00 C ATOM 606 CD ARG A 41 20.716 6.508 -26.025 1.00 0.00 C ATOM 607 NE ARG A 41 22.131 6.384 -26.423 1.00 0.00 N ATOM 608 CZ ARG A 41 23.029 7.356 -26.440 1.00 0.00 C ATOM 609 NH1 ARG A 41 22.735 8.575 -26.085 1.00 0.00 N ATOM 610 NH2 ARG A 41 24.250 7.113 -26.821 1.00 0.00 N ATOM 0 H ARG A 41 18.984 7.502 -23.918 1.00 0.00 H new ATOM 0 HA ARG A 41 16.858 5.632 -24.510 1.00 0.00 H new ATOM 0 HB2 ARG A 41 18.054 4.232 -25.995 1.00 0.00 H new ATOM 0 HB3 ARG A 41 18.048 5.840 -26.691 1.00 0.00 H new ATOM 0 HG2 ARG A 41 20.408 4.505 -25.310 1.00 0.00 H new ATOM 0 HG3 ARG A 41 20.195 4.688 -27.040 1.00 0.00 H new ATOM 0 HD2 ARG A 41 20.214 7.217 -26.683 1.00 0.00 H new ATOM 0 HD3 ARG A 41 20.656 6.914 -25.015 1.00 0.00 H new ATOM 0 HE ARG A 41 22.448 5.459 -26.713 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.788 8.804 -25.782 1.00 0.00 H new ATOM 0 HH12 ARG A 41 23.452 9.300 -26.110 1.00 0.00 H new ATOM 0 HH21 ARG A 41 24.517 6.171 -27.108 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.940 7.864 -26.833 1.00 0.00 H new ATOM 624 N VAL A 42 18.055 3.941 -22.952 1.00 0.00 N ATOM 625 CA VAL A 42 18.725 3.086 -21.955 1.00 0.00 C ATOM 626 C VAL A 42 20.115 2.672 -22.443 1.00 0.00 C ATOM 627 O VAL A 42 20.301 2.316 -23.608 1.00 0.00 O ATOM 628 CB VAL A 42 17.843 1.893 -21.533 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.501 0.514 -21.539 1.00 0.00 C ATOM 630 CG2 VAL A 42 17.370 2.136 -20.102 1.00 0.00 C ATOM 0 H VAL A 42 17.177 3.561 -23.305 1.00 0.00 H new ATOM 0 HA VAL A 42 18.873 3.670 -21.047 1.00 0.00 H new ATOM 0 HB VAL A 42 17.054 1.859 -22.284 1.00 0.00 H new ATOM 0 HG11 VAL A 42 17.776 -0.236 -21.223 1.00 0.00 H new ATOM 0 HG12 VAL A 42 18.849 0.281 -22.545 1.00 0.00 H new ATOM 0 HG13 VAL A 42 19.348 0.512 -20.852 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.743 1.304 -19.780 1.00 0.00 H new ATOM 0 HG22 VAL A 42 18.234 2.216 -19.442 1.00 0.00 H new ATOM 0 HG23 VAL A 42 16.795 3.061 -20.061 1.00 0.00 H new ATOM 640 N HIS A 43 21.099 2.730 -21.540 1.00 0.00 N ATOM 641 CA HIS A 43 22.474 2.338 -21.845 1.00 0.00 C ATOM 642 C HIS A 43 22.584 0.809 -21.840 1.00 0.00 C ATOM 643 O HIS A 43 22.128 0.182 -20.881 1.00 0.00 O ATOM 644 CB HIS A 43 23.428 2.992 -20.838 1.00 0.00 C ATOM 645 CG HIS A 43 24.853 2.938 -21.300 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.701 1.840 -21.184 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.503 3.943 -21.951 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.868 2.228 -21.732 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.770 3.476 -22.216 1.00 0.00 N ATOM 0 H HIS A 43 20.963 3.049 -20.581 1.00 0.00 H new ATOM 0 HA HIS A 43 22.756 2.685 -22.839 1.00 0.00 H new ATOM 0 HB2 HIS A 43 23.136 4.031 -20.683 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.339 2.489 -19.875 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.103 4.913 -22.208 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.759 1.620 -21.776 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.508 3.990 -22.697 1.00 0.00 H new ATOM 657 N PRO A 44 23.173 0.167 -22.862 1.00 0.00 N ATOM 658 CA PRO A 44 23.090 -1.286 -22.976 1.00 0.00 C ATOM 659 C PRO A 44 23.927 -2.000 -21.901 1.00 0.00 C ATOM 660 O PRO A 44 23.566 -3.090 -21.454 1.00 0.00 O ATOM 661 CB PRO A 44 23.551 -1.589 -24.404 1.00 0.00 C ATOM 662 CG PRO A 44 24.523 -0.450 -24.717 1.00 0.00 C ATOM 663 CD PRO A 44 23.883 0.737 -24.000 1.00 0.00 C ATOM 0 HA PRO A 44 22.081 -1.659 -22.802 1.00 0.00 H new ATOM 0 HB2 PRO A 44 24.038 -2.562 -24.470 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.713 -1.604 -25.101 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.525 -0.658 -24.343 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.613 -0.276 -25.789 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.638 1.452 -23.673 1.00 0.00 H new ATOM 0 HD3 PRO A 44 23.201 1.273 -24.660 1.00 0.00 H new ATOM 671 N THR A 45 24.984 -1.355 -21.392 1.00 0.00 N ATOM 672 CA THR A 45 25.794 -1.886 -20.282 1.00 0.00 C ATOM 673 C THR A 45 25.043 -1.826 -18.950 1.00 0.00 C ATOM 674 O THR A 45 25.269 -2.677 -18.099 1.00 0.00 O ATOM 675 CB THR A 45 27.155 -1.174 -20.214 1.00 0.00 C ATOM 676 OG1 THR A 45 27.803 -1.301 -21.466 1.00 0.00 O ATOM 677 CG2 THR A 45 28.092 -1.759 -19.156 1.00 0.00 C ATOM 0 H THR A 45 25.304 -0.450 -21.736 1.00 0.00 H new ATOM 0 HA THR A 45 25.984 -2.941 -20.479 1.00 0.00 H new ATOM 0 HB THR A 45 26.950 -0.136 -19.951 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.671 -0.848 -21.432 1.00 0.00 H new ATOM 0 HG21 THR A 45 29.034 -1.211 -19.161 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.629 -1.675 -18.173 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.282 -2.809 -19.379 1.00 0.00 H new ATOM 685 N ALA A 46 24.062 -0.926 -18.780 1.00 0.00 N ATOM 686 CA ALA A 46 23.199 -0.913 -17.592 1.00 0.00 C ATOM 687 C ALA A 46 22.448 -2.242 -17.435 1.00 0.00 C ATOM 688 O ALA A 46 22.491 -2.864 -16.377 1.00 0.00 O ATOM 689 CB ALA A 46 22.208 0.256 -17.701 1.00 0.00 C ATOM 0 H ALA A 46 23.847 -0.194 -19.456 1.00 0.00 H new ATOM 0 HA ALA A 46 23.821 -0.783 -16.707 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.564 0.271 -16.821 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.758 1.195 -17.764 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.597 0.133 -18.595 1.00 0.00 H new ATOM 695 N ILE A 47 21.833 -2.723 -18.520 1.00 0.00 N ATOM 696 CA ILE A 47 21.160 -4.031 -18.562 1.00 0.00 C ATOM 697 C ILE A 47 22.159 -5.146 -18.248 1.00 0.00 C ATOM 698 O ILE A 47 21.888 -5.964 -17.373 1.00 0.00 O ATOM 699 CB ILE A 47 20.515 -4.243 -19.948 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.402 -3.206 -20.227 1.00 0.00 C ATOM 701 CG2 ILE A 47 19.924 -5.656 -20.099 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.485 -2.667 -21.652 1.00 0.00 C ATOM 0 H ILE A 47 21.786 -2.214 -19.402 1.00 0.00 H new ATOM 0 HA ILE A 47 20.374 -4.057 -17.808 1.00 0.00 H new ATOM 0 HB ILE A 47 21.318 -4.114 -20.674 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.427 -3.665 -20.067 1.00 0.00 H new ATOM 0 HG13 ILE A 47 19.486 -2.381 -19.519 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.481 -5.761 -21.089 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.714 -6.396 -19.975 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.158 -5.813 -19.340 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.688 -1.941 -21.813 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.451 -2.185 -21.803 1.00 0.00 H new ATOM 0 HD13 ILE A 47 19.375 -3.489 -22.359 1.00 0.00 H new ATOM 714 N ALA A 48 23.343 -5.135 -18.866 1.00 0.00 N ATOM 715 CA ALA A 48 24.364 -6.162 -18.631 1.00 0.00 C ATOM 716 C ALA A 48 24.818 -6.227 -17.160 1.00 0.00 C ATOM 717 O ALA A 48 25.028 -7.309 -16.611 1.00 0.00 O ATOM 718 CB ALA A 48 25.550 -5.888 -19.555 1.00 0.00 C ATOM 0 H ALA A 48 23.621 -4.420 -19.539 1.00 0.00 H new ATOM 0 HA ALA A 48 23.928 -7.136 -18.852 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.319 -6.643 -19.393 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.219 -5.924 -20.593 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.959 -4.901 -19.339 1.00 0.00 H new ATOM 724 N MET A 49 24.922 -5.071 -16.499 1.00 0.00 N ATOM 725 CA MET A 49 25.313 -4.955 -15.090 1.00 0.00 C ATOM 726 C MET A 49 24.178 -5.351 -14.140 1.00 0.00 C ATOM 727 O MET A 49 24.454 -5.852 -13.054 1.00 0.00 O ATOM 728 CB MET A 49 25.822 -3.533 -14.812 1.00 0.00 C ATOM 729 CG MET A 49 27.040 -3.178 -15.670 1.00 0.00 C ATOM 730 SD MET A 49 28.647 -3.561 -14.920 1.00 0.00 S ATOM 731 CE MET A 49 29.007 -5.161 -15.669 1.00 0.00 C ATOM 0 H MET A 49 24.733 -4.170 -16.937 1.00 0.00 H new ATOM 0 HA MET A 49 26.122 -5.660 -14.899 1.00 0.00 H new ATOM 0 HB2 MET A 49 25.022 -2.818 -15.005 1.00 0.00 H new ATOM 0 HB3 MET A 49 26.083 -3.442 -13.758 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.964 -3.709 -16.619 1.00 0.00 H new ATOM 0 HG3 MET A 49 27.007 -2.112 -15.897 1.00 0.00 H new ATOM 0 HE1 MET A 49 30.018 -5.468 -15.402 1.00 0.00 H new ATOM 0 HE2 MET A 49 28.295 -5.902 -15.305 1.00 0.00 H new ATOM 0 HE3 MET A 49 28.926 -5.082 -16.753 1.00 0.00 H new ATOM 741 N MET A 50 22.914 -5.180 -14.538 1.00 0.00 N ATOM 742 CA MET A 50 21.765 -5.726 -13.800 1.00 0.00 C ATOM 743 C MET A 50 21.609 -7.240 -14.024 1.00 0.00 C ATOM 744 O MET A 50 21.219 -7.957 -13.103 1.00 0.00 O ATOM 745 CB MET A 50 20.485 -4.961 -14.178 1.00 0.00 C ATOM 746 CG MET A 50 20.514 -3.486 -13.744 1.00 0.00 C ATOM 747 SD MET A 50 20.879 -3.143 -11.997 1.00 0.00 S ATOM 748 CE MET A 50 19.585 -4.128 -11.211 1.00 0.00 C ATOM 0 H MET A 50 22.656 -4.661 -15.378 1.00 0.00 H new ATOM 0 HA MET A 50 21.947 -5.588 -12.734 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.343 -5.013 -15.257 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.627 -5.452 -13.719 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.256 -2.969 -14.352 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.546 -3.045 -13.980 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.164 -3.573 -10.372 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.799 -4.341 -11.936 1.00 0.00 H new ATOM 0 HE3 MET A 50 20.010 -5.065 -10.850 1.00 0.00 H new ATOM 758 N GLU A 51 22.006 -7.768 -15.186 1.00 0.00 N ATOM 759 CA GLU A 51 22.001 -9.216 -15.433 1.00 0.00 C ATOM 760 C GLU A 51 23.047 -9.967 -14.584 1.00 0.00 C ATOM 761 O GLU A 51 22.838 -11.142 -14.287 1.00 0.00 O ATOM 762 CB GLU A 51 22.196 -9.523 -16.927 1.00 0.00 C ATOM 763 CG GLU A 51 20.942 -9.251 -17.765 1.00 0.00 C ATOM 764 CD GLU A 51 21.158 -9.698 -19.225 1.00 0.00 C ATOM 765 OE1 GLU A 51 21.921 -9.036 -19.972 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.565 -10.724 -19.641 1.00 0.00 O ATOM 0 H GLU A 51 22.337 -7.212 -15.975 1.00 0.00 H new ATOM 0 HA GLU A 51 21.020 -9.579 -15.126 1.00 0.00 H new ATOM 0 HB2 GLU A 51 23.020 -8.921 -17.311 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.483 -10.568 -17.043 1.00 0.00 H new ATOM 0 HG2 GLU A 51 20.091 -9.782 -17.339 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.702 -8.188 -17.736 1.00 0.00 H new ATOM 773 N GLU A 52 24.121 -9.309 -14.111 1.00 0.00 N ATOM 774 CA GLU A 52 25.082 -9.939 -13.179 1.00 0.00 C ATOM 775 C GLU A 52 24.433 -10.342 -11.841 1.00 0.00 C ATOM 776 O GLU A 52 24.862 -11.310 -11.209 1.00 0.00 O ATOM 777 CB GLU A 52 26.257 -9.007 -12.851 1.00 0.00 C ATOM 778 CG GLU A 52 27.079 -8.562 -14.062 1.00 0.00 C ATOM 779 CD GLU A 52 28.472 -8.079 -13.640 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.572 -7.166 -12.786 1.00 0.00 O ATOM 781 OE2 GLU A 52 29.481 -8.584 -14.183 1.00 0.00 O ATOM 0 H GLU A 52 24.347 -8.345 -14.356 1.00 0.00 H new ATOM 0 HA GLU A 52 25.434 -10.829 -13.701 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.870 -8.121 -12.346 1.00 0.00 H new ATOM 0 HB3 GLU A 52 26.918 -9.512 -12.147 1.00 0.00 H new ATOM 0 HG2 GLU A 52 27.176 -9.391 -14.763 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.557 -7.761 -14.585 1.00 0.00 H new ATOM 788 N VAL A 53 23.391 -9.608 -11.426 1.00 0.00 N ATOM 789 CA VAL A 53 22.581 -9.877 -10.220 1.00 0.00 C ATOM 790 C VAL A 53 21.241 -10.559 -10.552 1.00 0.00 C ATOM 791 O VAL A 53 20.379 -10.702 -9.684 1.00 0.00 O ATOM 792 CB VAL A 53 22.425 -8.610 -9.346 1.00 0.00 C ATOM 793 CG1 VAL A 53 23.784 -8.135 -8.812 1.00 0.00 C ATOM 794 CG2 VAL A 53 21.791 -7.436 -10.100 1.00 0.00 C ATOM 0 H VAL A 53 23.075 -8.782 -11.935 1.00 0.00 H new ATOM 0 HA VAL A 53 23.129 -10.600 -9.615 1.00 0.00 H new ATOM 0 HB VAL A 53 21.766 -8.905 -8.529 1.00 0.00 H new ATOM 0 HG11 VAL A 53 23.643 -7.243 -8.201 1.00 0.00 H new ATOM 0 HG12 VAL A 53 24.232 -8.923 -8.206 1.00 0.00 H new ATOM 0 HG13 VAL A 53 24.442 -7.902 -9.649 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.709 -6.577 -9.433 1.00 0.00 H new ATOM 0 HG22 VAL A 53 22.414 -7.173 -10.955 1.00 0.00 H new ATOM 0 HG23 VAL A 53 20.798 -7.721 -10.449 1.00 0.00 H new ATOM 804 N GLY A 54 21.062 -11.014 -11.801 1.00 0.00 N ATOM 805 CA GLY A 54 19.883 -11.756 -12.269 1.00 0.00 C ATOM 806 C GLY A 54 18.618 -10.912 -12.478 1.00 0.00 C ATOM 807 O GLY A 54 17.512 -11.455 -12.437 1.00 0.00 O ATOM 0 H GLY A 54 21.755 -10.871 -12.535 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.132 -12.246 -13.210 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.660 -12.543 -11.549 1.00 0.00 H new ATOM 811 N ILE A 55 18.763 -9.596 -12.676 1.00 0.00 N ATOM 812 CA ILE A 55 17.662 -8.627 -12.799 1.00 0.00 C ATOM 813 C ILE A 55 17.540 -8.126 -14.245 1.00 0.00 C ATOM 814 O ILE A 55 18.540 -7.883 -14.921 1.00 0.00 O ATOM 815 CB ILE A 55 17.856 -7.480 -11.779 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.772 -8.032 -10.335 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.837 -6.346 -11.987 1.00 0.00 C ATOM 818 CD1 ILE A 55 17.897 -6.984 -9.222 1.00 0.00 C ATOM 0 H ILE A 55 19.681 -9.159 -12.758 1.00 0.00 H new ATOM 0 HA ILE A 55 16.716 -9.115 -12.562 1.00 0.00 H new ATOM 0 HB ILE A 55 18.847 -7.055 -11.942 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.821 -8.551 -10.217 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.559 -8.775 -10.202 1.00 0.00 H new ATOM 0 HG21 ILE A 55 17.010 -5.562 -11.250 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.952 -5.933 -12.989 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.827 -6.738 -11.870 1.00 0.00 H new ATOM 0 HD11 ILE A 55 17.825 -7.474 -8.251 1.00 0.00 H new ATOM 0 HD12 ILE A 55 18.860 -6.480 -9.304 1.00 0.00 H new ATOM 0 HD13 ILE A 55 17.095 -6.252 -9.319 1.00 0.00 H new ATOM 830 N ASP A 56 16.302 -7.927 -14.707 1.00 0.00 N ATOM 831 CA ASP A 56 15.981 -7.481 -16.067 1.00 0.00 C ATOM 832 C ASP A 56 15.439 -6.041 -16.122 1.00 0.00 C ATOM 833 O ASP A 56 14.399 -5.722 -15.537 1.00 0.00 O ATOM 834 CB ASP A 56 15.007 -8.483 -16.709 1.00 0.00 C ATOM 835 CG ASP A 56 14.571 -8.063 -18.126 1.00 0.00 C ATOM 836 OD1 ASP A 56 15.369 -7.410 -18.841 1.00 0.00 O ATOM 837 OD2 ASP A 56 13.422 -8.376 -18.519 1.00 0.00 O ATOM 0 H ASP A 56 15.473 -8.075 -14.131 1.00 0.00 H new ATOM 0 HA ASP A 56 16.908 -7.456 -16.640 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.479 -9.464 -16.754 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.125 -8.583 -16.076 1.00 0.00 H new ATOM 842 N ILE A 57 16.126 -5.185 -16.887 1.00 0.00 N ATOM 843 CA ILE A 57 15.679 -3.830 -17.265 1.00 0.00 C ATOM 844 C ILE A 57 15.716 -3.608 -18.795 1.00 0.00 C ATOM 845 O ILE A 57 15.748 -2.470 -19.251 1.00 0.00 O ATOM 846 CB ILE A 57 16.424 -2.724 -16.476 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.946 -2.744 -16.723 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.133 -2.812 -14.967 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.605 -1.387 -16.451 1.00 0.00 C ATOM 0 H ILE A 57 17.040 -5.420 -17.275 1.00 0.00 H new ATOM 0 HA ILE A 57 14.631 -3.751 -16.974 1.00 0.00 H new ATOM 0 HB ILE A 57 16.040 -1.776 -16.852 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.404 -3.500 -16.086 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.139 -3.037 -17.755 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.672 -2.021 -14.446 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.063 -2.696 -14.795 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.458 -3.782 -14.590 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.676 -1.458 -16.641 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.170 -0.633 -17.107 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.439 -1.103 -15.412 1.00 0.00 H new ATOM 861 N SER A 58 15.711 -4.671 -19.606 1.00 0.00 N ATOM 862 CA SER A 58 15.739 -4.578 -21.081 1.00 0.00 C ATOM 863 C SER A 58 14.404 -4.095 -21.673 1.00 0.00 C ATOM 864 O SER A 58 14.378 -3.386 -22.682 1.00 0.00 O ATOM 865 CB SER A 58 16.126 -5.942 -21.670 1.00 0.00 C ATOM 866 OG SER A 58 16.451 -5.818 -23.046 1.00 0.00 O ATOM 0 H SER A 58 15.687 -5.631 -19.261 1.00 0.00 H new ATOM 0 HA SER A 58 16.484 -3.830 -21.350 1.00 0.00 H new ATOM 0 HB2 SER A 58 16.977 -6.351 -21.125 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.301 -6.644 -21.547 1.00 0.00 H new ATOM 0 HG SER A 58 16.697 -6.696 -23.405 1.00 0.00 H new ATOM 872 N GLY A 59 13.286 -4.413 -21.003 1.00 0.00 N ATOM 873 CA GLY A 59 11.923 -4.006 -21.384 1.00 0.00 C ATOM 874 C GLY A 59 11.548 -2.551 -21.054 1.00 0.00 C ATOM 875 O GLY A 59 10.378 -2.188 -21.181 1.00 0.00 O ATOM 0 H GLY A 59 13.305 -4.978 -20.154 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.804 -4.159 -22.457 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.213 -4.667 -20.887 1.00 0.00 H new ATOM 879 N GLN A 60 12.501 -1.730 -20.602 1.00 0.00 N ATOM 880 CA GLN A 60 12.321 -0.321 -20.220 1.00 0.00 C ATOM 881 C GLN A 60 13.443 0.544 -20.829 1.00 0.00 C ATOM 882 O GLN A 60 14.565 0.074 -21.014 1.00 0.00 O ATOM 883 CB GLN A 60 12.220 -0.198 -18.680 1.00 0.00 C ATOM 884 CG GLN A 60 13.371 -0.882 -17.919 1.00 0.00 C ATOM 885 CD GLN A 60 13.209 -0.853 -16.403 1.00 0.00 C ATOM 886 OE1 GLN A 60 12.715 -1.790 -15.786 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.648 0.188 -15.741 1.00 0.00 N ATOM 0 H GLN A 60 13.465 -2.042 -20.486 1.00 0.00 H new ATOM 0 HA GLN A 60 11.383 0.058 -20.626 1.00 0.00 H new ATOM 0 HB2 GLN A 60 12.198 0.858 -18.411 1.00 0.00 H new ATOM 0 HB3 GLN A 60 11.274 -0.630 -18.353 1.00 0.00 H new ATOM 0 HG2 GLN A 60 13.446 -1.919 -18.247 1.00 0.00 H new ATOM 0 HG3 GLN A 60 14.309 -0.395 -18.184 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.061 0.974 -16.243 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.577 0.213 -14.724 1.00 0.00 H new ATOM 896 N THR A 61 13.159 1.810 -21.155 1.00 0.00 N ATOM 897 CA THR A 61 14.129 2.763 -21.695 1.00 0.00 C ATOM 898 C THR A 61 13.859 4.149 -21.109 1.00 0.00 C ATOM 899 O THR A 61 13.017 4.309 -20.223 1.00 0.00 O ATOM 900 CB THR A 61 14.141 2.731 -23.233 1.00 0.00 C ATOM 901 OG1 THR A 61 15.263 3.441 -23.719 1.00 0.00 O ATOM 902 CG2 THR A 61 12.892 3.321 -23.879 1.00 0.00 C ATOM 0 H THR A 61 12.226 2.207 -21.047 1.00 0.00 H new ATOM 0 HA THR A 61 15.138 2.479 -21.395 1.00 0.00 H new ATOM 0 HB THR A 61 14.180 1.676 -23.503 1.00 0.00 H new ATOM 0 HG1 THR A 61 15.267 3.416 -24.699 1.00 0.00 H new ATOM 0 HG21 THR A 61 12.980 3.260 -24.964 1.00 0.00 H new ATOM 0 HG22 THR A 61 12.015 2.761 -23.554 1.00 0.00 H new ATOM 0 HG23 THR A 61 12.787 4.364 -23.582 1.00 0.00 H new ATOM 910 N SER A 62 14.614 5.135 -21.563 1.00 0.00 N ATOM 911 CA SER A 62 14.473 6.525 -21.159 1.00 0.00 C ATOM 912 C SER A 62 13.060 7.087 -21.393 1.00 0.00 C ATOM 913 O SER A 62 12.480 6.899 -22.466 1.00 0.00 O ATOM 914 CB SER A 62 15.429 7.357 -21.982 1.00 0.00 C ATOM 915 OG SER A 62 16.769 6.975 -21.731 1.00 0.00 O ATOM 0 H SER A 62 15.362 4.988 -22.241 1.00 0.00 H new ATOM 0 HA SER A 62 14.680 6.569 -20.090 1.00 0.00 H new ATOM 0 HB2 SER A 62 15.204 7.237 -23.042 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.296 8.413 -21.746 1.00 0.00 H new ATOM 0 HG SER A 62 17.233 7.699 -21.260 1.00 0.00 H new ATOM 921 N ASP A 63 12.540 7.840 -20.419 1.00 0.00 N ATOM 922 CA ASP A 63 11.302 8.634 -20.540 1.00 0.00 C ATOM 923 C ASP A 63 11.385 9.992 -19.794 1.00 0.00 C ATOM 924 O ASP A 63 12.033 10.075 -18.746 1.00 0.00 O ATOM 925 CB ASP A 63 10.085 7.836 -20.044 1.00 0.00 C ATOM 926 CG ASP A 63 9.580 6.823 -21.084 1.00 0.00 C ATOM 927 OD1 ASP A 63 9.071 7.255 -22.147 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.624 5.597 -20.818 1.00 0.00 O ATOM 0 H ASP A 63 12.975 7.920 -19.500 1.00 0.00 H new ATOM 0 HA ASP A 63 11.181 8.852 -21.601 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.350 7.309 -19.127 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.280 8.527 -19.794 1.00 0.00 H new ATOM 933 N PRO A 64 10.731 11.067 -20.292 1.00 0.00 N ATOM 934 CA PRO A 64 10.873 12.424 -19.755 1.00 0.00 C ATOM 935 C PRO A 64 9.908 12.751 -18.598 1.00 0.00 C ATOM 936 O PRO A 64 8.747 12.345 -18.596 1.00 0.00 O ATOM 937 CB PRO A 64 10.643 13.345 -20.958 1.00 0.00 C ATOM 938 CG PRO A 64 9.599 12.574 -21.766 1.00 0.00 C ATOM 939 CD PRO A 64 9.987 11.111 -21.546 1.00 0.00 C ATOM 0 HA PRO A 64 11.857 12.551 -19.303 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.278 14.326 -20.655 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.559 13.507 -21.527 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.588 12.778 -21.414 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.630 12.843 -22.822 1.00 0.00 H new ATOM 0 HD2 PRO A 64 9.101 10.478 -21.495 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.595 10.742 -22.372 1.00 0.00 H new ATOM 947 N ILE A 65 10.363 13.578 -17.652 1.00 0.00 N ATOM 948 CA ILE A 65 9.627 14.049 -16.465 1.00 0.00 C ATOM 949 C ILE A 65 8.314 14.753 -16.837 1.00 0.00 C ATOM 950 O ILE A 65 7.297 14.582 -16.172 1.00 0.00 O ATOM 951 CB ILE A 65 10.579 14.965 -15.644 1.00 0.00 C ATOM 952 CG1 ILE A 65 10.114 15.063 -14.187 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.765 16.376 -16.243 1.00 0.00 C ATOM 954 CD1 ILE A 65 11.044 15.903 -13.308 1.00 0.00 C ATOM 0 H ILE A 65 11.308 13.961 -17.692 1.00 0.00 H new ATOM 0 HA ILE A 65 9.327 13.196 -15.856 1.00 0.00 H new ATOM 0 HB ILE A 65 11.557 14.486 -15.687 1.00 0.00 H new ATOM 0 HG12 ILE A 65 9.113 15.495 -14.161 1.00 0.00 H new ATOM 0 HG13 ILE A 65 10.039 14.059 -13.769 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.442 16.952 -15.613 1.00 0.00 H new ATOM 0 HG22 ILE A 65 11.185 16.293 -17.246 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.800 16.880 -16.294 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.656 15.931 -12.290 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.040 15.460 -13.305 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.100 16.918 -13.703 1.00 0.00 H new ATOM 966 N GLU A 66 8.316 15.485 -17.956 1.00 0.00 N ATOM 967 CA GLU A 66 7.163 16.272 -18.428 1.00 0.00 C ATOM 968 C GLU A 66 5.921 15.427 -18.785 1.00 0.00 C ATOM 969 O GLU A 66 4.806 15.953 -18.762 1.00 0.00 O ATOM 970 CB GLU A 66 7.578 17.122 -19.642 1.00 0.00 C ATOM 971 CG GLU A 66 8.658 18.159 -19.303 1.00 0.00 C ATOM 972 CD GLU A 66 8.925 19.085 -20.508 1.00 0.00 C ATOM 973 OE1 GLU A 66 9.713 18.706 -21.409 1.00 0.00 O ATOM 974 OE2 GLU A 66 8.347 20.199 -20.566 1.00 0.00 O ATOM 0 H GLU A 66 9.128 15.551 -18.570 1.00 0.00 H new ATOM 0 HA GLU A 66 6.867 16.905 -17.591 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.946 16.465 -20.430 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.701 17.634 -20.038 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.342 18.753 -18.445 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.579 17.651 -19.017 1.00 0.00 H new ATOM 981 N ASN A 67 6.081 14.125 -19.082 1.00 0.00 N ATOM 982 CA ASN A 67 4.949 13.218 -19.349 1.00 0.00 C ATOM 983 C ASN A 67 4.364 12.566 -18.067 1.00 0.00 C ATOM 984 O ASN A 67 3.291 11.958 -18.123 1.00 0.00 O ATOM 985 CB ASN A 67 5.350 12.190 -20.436 1.00 0.00 C ATOM 986 CG ASN A 67 5.568 10.780 -19.905 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.799 9.862 -20.157 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.599 10.563 -19.125 1.00 0.00 N ATOM 0 H ASN A 67 6.993 13.673 -19.144 1.00 0.00 H new ATOM 0 HA ASN A 67 4.123 13.814 -19.737 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.573 12.163 -21.200 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.264 12.529 -20.923 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.756 9.634 -18.733 1.00 0.00 H new ATOM 0 HD22 ASN A 67 7.245 11.323 -18.910 1.00 0.00 H new ATOM 995 N PHE A 68 5.066 12.664 -16.931 1.00 0.00 N ATOM 996 CA PHE A 68 4.766 11.941 -15.688 1.00 0.00 C ATOM 997 C PHE A 68 4.024 12.798 -14.643 1.00 0.00 C ATOM 998 O PHE A 68 3.822 14.001 -14.820 1.00 0.00 O ATOM 999 CB PHE A 68 6.072 11.329 -15.152 1.00 0.00 C ATOM 1000 CG PHE A 68 6.573 10.110 -15.912 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.747 8.982 -16.086 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.881 10.091 -16.428 1.00 0.00 C ATOM 1003 CE1 PHE A 68 6.218 7.857 -16.784 1.00 0.00 C ATOM 1004 CE2 PHE A 68 8.352 8.964 -17.130 1.00 0.00 C ATOM 1005 CZ PHE A 68 7.522 7.846 -17.307 1.00 0.00 C ATOM 0 H PHE A 68 5.884 13.268 -16.849 1.00 0.00 H new ATOM 0 HA PHE A 68 4.061 11.140 -15.910 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.848 12.094 -15.171 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.924 11.052 -14.108 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.746 8.982 -15.681 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.527 10.944 -16.285 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.576 6.999 -16.919 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.354 8.960 -17.533 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.884 6.981 -17.843 1.00 0.00 H new ATOM 1015 N ASN A 69 3.597 12.155 -13.549 1.00 0.00 N ATOM 1016 CA ASN A 69 2.693 12.718 -12.538 1.00 0.00 C ATOM 1017 C ASN A 69 3.242 12.582 -11.102 1.00 0.00 C ATOM 1018 O ASN A 69 2.949 11.607 -10.407 1.00 0.00 O ATOM 1019 CB ASN A 69 1.298 12.076 -12.727 1.00 0.00 C ATOM 1020 CG ASN A 69 1.296 10.570 -12.989 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.923 10.108 -14.059 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.731 9.761 -12.051 1.00 0.00 N ATOM 0 H ASN A 69 3.880 11.198 -13.336 1.00 0.00 H new ATOM 0 HA ASN A 69 2.608 13.795 -12.684 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.703 12.273 -11.835 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.799 12.572 -13.559 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.756 8.755 -12.217 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.044 10.139 -11.157 1.00 0.00 H new ATOM 1029 N ALA A 70 3.999 13.580 -10.631 1.00 0.00 N ATOM 1030 CA ALA A 70 4.596 13.558 -9.289 1.00 0.00 C ATOM 1031 C ALA A 70 3.561 13.323 -8.167 1.00 0.00 C ATOM 1032 O ALA A 70 3.881 12.693 -7.160 1.00 0.00 O ATOM 1033 CB ALA A 70 5.328 14.870 -9.007 1.00 0.00 C ATOM 0 H ALA A 70 4.215 14.422 -11.165 1.00 0.00 H new ATOM 0 HA ALA A 70 5.292 12.719 -9.286 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.764 14.836 -8.009 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.119 15.011 -9.744 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.624 15.700 -9.067 1.00 0.00 H new ATOM 1039 N ASP A 71 2.329 13.804 -8.358 1.00 0.00 N ATOM 1040 CA ASP A 71 1.213 13.678 -7.412 1.00 0.00 C ATOM 1041 C ASP A 71 0.871 12.219 -7.028 1.00 0.00 C ATOM 1042 O ASP A 71 0.332 11.978 -5.944 1.00 0.00 O ATOM 1043 CB ASP A 71 -0.015 14.340 -8.048 1.00 0.00 C ATOM 1044 CG ASP A 71 -1.185 14.454 -7.056 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -1.060 15.201 -6.055 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -2.250 13.833 -7.289 1.00 0.00 O ATOM 0 H ASP A 71 2.071 14.310 -9.205 1.00 0.00 H new ATOM 0 HA ASP A 71 1.513 14.165 -6.484 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.254 15.333 -8.408 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.330 13.761 -8.916 1.00 0.00 H new ATOM 1051 N ASP A 72 1.205 11.248 -7.888 1.00 0.00 N ATOM 1052 CA ASP A 72 1.013 9.812 -7.640 1.00 0.00 C ATOM 1053 C ASP A 72 2.304 9.084 -7.213 1.00 0.00 C ATOM 1054 O ASP A 72 2.288 7.866 -7.056 1.00 0.00 O ATOM 1055 CB ASP A 72 0.362 9.139 -8.857 1.00 0.00 C ATOM 1056 CG ASP A 72 -1.024 9.719 -9.188 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -2.000 9.391 -8.471 1.00 0.00 O ATOM 1058 OD2 ASP A 72 -1.157 10.469 -10.187 1.00 0.00 O ATOM 0 H ASP A 72 1.626 11.443 -8.796 1.00 0.00 H new ATOM 0 HA ASP A 72 0.337 9.729 -6.789 1.00 0.00 H new ATOM 0 HB2 ASP A 72 1.015 9.253 -9.722 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.268 8.070 -8.668 1.00 0.00 H new ATOM 1063 N TYR A 73 3.414 9.796 -6.994 1.00 0.00 N ATOM 1064 CA TYR A 73 4.665 9.240 -6.476 1.00 0.00 C ATOM 1065 C TYR A 73 4.888 9.765 -5.050 1.00 0.00 C ATOM 1066 O TYR A 73 5.382 10.875 -4.858 1.00 0.00 O ATOM 1067 CB TYR A 73 5.845 9.550 -7.419 1.00 0.00 C ATOM 1068 CG TYR A 73 5.592 9.363 -8.906 1.00 0.00 C ATOM 1069 CD1 TYR A 73 4.855 8.264 -9.394 1.00 0.00 C ATOM 1070 CD2 TYR A 73 6.096 10.318 -9.809 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.574 8.156 -10.770 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.810 10.217 -11.181 1.00 0.00 C ATOM 1073 CZ TYR A 73 5.033 9.146 -11.663 1.00 0.00 C ATOM 1074 OH TYR A 73 4.730 9.080 -12.987 1.00 0.00 O ATOM 0 H TYR A 73 3.467 10.798 -7.177 1.00 0.00 H new ATOM 0 HA TYR A 73 4.599 8.153 -6.432 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.153 10.582 -7.252 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.685 8.917 -7.134 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.505 7.504 -8.711 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.705 11.132 -9.446 1.00 0.00 H new ATOM 0 HE1 TYR A 73 4.007 7.315 -11.141 1.00 0.00 H new ATOM 0 HE2 TYR A 73 6.187 10.962 -11.867 1.00 0.00 H new ATOM 0 HH TYR A 73 5.556 9.005 -13.508 1.00 0.00 H new ATOM 1084 N ASP A 74 4.512 8.974 -4.035 1.00 0.00 N ATOM 1085 CA ASP A 74 4.661 9.358 -2.618 1.00 0.00 C ATOM 1086 C ASP A 74 6.101 9.787 -2.288 1.00 0.00 C ATOM 1087 O ASP A 74 6.316 10.715 -1.507 1.00 0.00 O ATOM 1088 CB ASP A 74 4.277 8.174 -1.718 1.00 0.00 C ATOM 1089 CG ASP A 74 2.851 7.683 -1.965 1.00 0.00 C ATOM 1090 OD1 ASP A 74 1.880 8.319 -1.501 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.720 6.640 -2.646 1.00 0.00 O ATOM 0 H ASP A 74 4.097 8.052 -4.169 1.00 0.00 H new ATOM 0 HA ASP A 74 4.001 10.207 -2.438 1.00 0.00 H new ATOM 0 HB2 ASP A 74 4.974 7.353 -1.888 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.380 8.469 -0.674 1.00 0.00 H new ATOM 1096 N VAL A 75 7.083 9.149 -2.930 1.00 0.00 N ATOM 1097 CA VAL A 75 8.499 9.514 -2.856 1.00 0.00 C ATOM 1098 C VAL A 75 9.059 9.823 -4.246 1.00 0.00 C ATOM 1099 O VAL A 75 8.831 9.069 -5.194 1.00 0.00 O ATOM 1100 CB VAL A 75 9.309 8.389 -2.199 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.781 8.794 -2.051 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.725 8.001 -0.836 1.00 0.00 C ATOM 0 H VAL A 75 6.910 8.343 -3.531 1.00 0.00 H new ATOM 0 HA VAL A 75 8.583 10.413 -2.245 1.00 0.00 H new ATOM 0 HB VAL A 75 9.250 7.518 -2.851 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.337 7.981 -1.583 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.202 9.002 -3.035 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.852 9.687 -1.430 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.323 7.202 -0.398 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.738 8.867 -0.175 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.698 7.658 -0.964 1.00 0.00 H new ATOM 1112 N VAL A 76 9.874 10.873 -4.361 1.00 0.00 N ATOM 1113 CA VAL A 76 10.659 11.179 -5.572 1.00 0.00 C ATOM 1114 C VAL A 76 12.143 11.270 -5.225 1.00 0.00 C ATOM 1115 O VAL A 76 12.527 11.884 -4.238 1.00 0.00 O ATOM 1116 CB VAL A 76 10.151 12.462 -6.252 1.00 0.00 C ATOM 1117 CG1 VAL A 76 11.064 12.943 -7.390 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.761 12.232 -6.860 1.00 0.00 C ATOM 0 H VAL A 76 10.014 11.548 -3.609 1.00 0.00 H new ATOM 0 HA VAL A 76 10.529 10.368 -6.288 1.00 0.00 H new ATOM 0 HB VAL A 76 10.130 13.219 -5.468 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.651 13.851 -7.829 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.059 13.150 -6.995 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.131 12.169 -8.154 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.416 13.149 -7.337 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.816 11.435 -7.602 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.062 11.948 -6.073 1.00 0.00 H new ATOM 1128 N ILE A 77 12.990 10.667 -6.051 1.00 0.00 N ATOM 1129 CA ILE A 77 14.445 10.639 -5.877 1.00 0.00 C ATOM 1130 C ILE A 77 15.102 11.268 -7.102 1.00 0.00 C ATOM 1131 O ILE A 77 14.719 10.943 -8.224 1.00 0.00 O ATOM 1132 CB ILE A 77 14.939 9.184 -5.719 1.00 0.00 C ATOM 1133 CG1 ILE A 77 14.129 8.321 -4.728 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.429 9.149 -5.348 1.00 0.00 C ATOM 1135 CD1 ILE A 77 14.131 8.804 -3.274 1.00 0.00 C ATOM 0 H ILE A 77 12.679 10.169 -6.885 1.00 0.00 H new ATOM 0 HA ILE A 77 14.710 11.198 -4.980 1.00 0.00 H new ATOM 0 HB ILE A 77 14.782 8.733 -6.699 1.00 0.00 H new ATOM 0 HG12 ILE A 77 13.097 8.274 -5.075 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.521 7.304 -4.755 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.753 8.114 -5.242 1.00 0.00 H new ATOM 0 HG22 ILE A 77 17.011 9.633 -6.132 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.582 9.675 -4.406 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.533 8.126 -2.665 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.154 8.823 -2.898 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.707 9.807 -3.223 1.00 0.00 H new ATOM 1147 N SER A 78 16.110 12.114 -6.918 1.00 0.00 N ATOM 1148 CA SER A 78 16.973 12.605 -7.995 1.00 0.00 C ATOM 1149 C SER A 78 18.314 11.872 -7.955 1.00 0.00 C ATOM 1150 O SER A 78 18.846 11.595 -6.885 1.00 0.00 O ATOM 1151 CB SER A 78 17.166 14.116 -7.901 1.00 0.00 C ATOM 1152 OG SER A 78 17.898 14.546 -9.038 1.00 0.00 O ATOM 0 H SER A 78 16.357 12.486 -6.001 1.00 0.00 H new ATOM 0 HA SER A 78 16.491 12.401 -8.951 1.00 0.00 H new ATOM 0 HB2 SER A 78 16.200 14.620 -7.859 1.00 0.00 H new ATOM 0 HB3 SER A 78 17.700 14.374 -6.986 1.00 0.00 H new ATOM 0 HG SER A 78 18.030 15.516 -8.995 1.00 0.00 H new ATOM 1158 N LEU A 79 18.846 11.524 -9.127 1.00 0.00 N ATOM 1159 CA LEU A 79 20.130 10.841 -9.326 1.00 0.00 C ATOM 1160 C LEU A 79 20.946 11.567 -10.405 1.00 0.00 C ATOM 1161 O LEU A 79 21.501 10.943 -11.302 1.00 0.00 O ATOM 1162 CB LEU A 79 19.916 9.338 -9.634 1.00 0.00 C ATOM 1163 CG LEU A 79 19.112 8.534 -8.590 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.615 8.498 -8.902 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.575 7.074 -8.568 1.00 0.00 C ATOM 0 H LEU A 79 18.372 11.719 -10.009 1.00 0.00 H new ATOM 0 HA LEU A 79 20.710 10.880 -8.404 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.409 9.255 -10.595 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.894 8.869 -9.748 1.00 0.00 H new ATOM 0 HG LEU A 79 19.283 9.035 -7.637 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.098 7.920 -8.136 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.222 9.515 -8.917 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.457 8.034 -9.876 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.998 6.521 -7.827 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.423 6.629 -9.552 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.633 7.032 -8.310 1.00 0.00 H new ATOM 1213 N VAL A 84 20.427 20.368 -10.909 1.00 0.00 N ATOM 1214 CA VAL A 84 19.001 19.976 -10.912 1.00 0.00 C ATOM 1215 C VAL A 84 18.401 20.185 -9.517 1.00 0.00 C ATOM 1216 O VAL A 84 19.006 19.782 -8.524 1.00 0.00 O ATOM 1217 CB VAL A 84 18.846 18.497 -11.340 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.372 18.067 -11.395 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.466 18.234 -12.718 1.00 0.00 C ATOM 0 HA VAL A 84 18.468 20.601 -11.629 1.00 0.00 H new ATOM 0 HB VAL A 84 19.371 17.915 -10.582 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.309 17.022 -11.700 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.921 18.186 -10.410 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.839 18.688 -12.115 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.336 17.184 -12.981 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.974 18.859 -13.464 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.529 18.472 -12.690 1.00 0.00 H new ATOM 1229 N ASN A 85 17.199 20.775 -9.430 1.00 0.00 N ATOM 1230 CA ASN A 85 16.484 20.941 -8.150 1.00 0.00 C ATOM 1231 C ASN A 85 14.951 20.707 -8.205 1.00 0.00 C ATOM 1232 O ASN A 85 14.287 20.849 -7.182 1.00 0.00 O ATOM 1233 CB ASN A 85 16.866 22.322 -7.573 1.00 0.00 C ATOM 1234 CG ASN A 85 16.925 22.318 -6.053 1.00 0.00 C ATOM 1235 OD1 ASN A 85 16.099 22.897 -5.360 1.00 0.00 O ATOM 1236 ND2 ASN A 85 17.923 21.672 -5.487 1.00 0.00 N ATOM 0 H ASN A 85 16.697 21.148 -10.236 1.00 0.00 H new ATOM 0 HA ASN A 85 16.808 20.144 -7.481 1.00 0.00 H new ATOM 0 HB2 ASN A 85 17.835 22.624 -7.971 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.140 23.065 -7.904 1.00 0.00 H new ATOM 0 HD21 ASN A 85 18.008 21.654 -4.471 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.611 21.190 -6.065 1.00 0.00 H new ATOM 1243 N LEU A 86 14.398 20.340 -9.377 1.00 0.00 N ATOM 1244 CA LEU A 86 12.969 20.043 -9.623 1.00 0.00 C ATOM 1245 C LEU A 86 11.965 21.023 -8.949 1.00 0.00 C ATOM 1246 O LEU A 86 11.182 20.603 -8.099 1.00 0.00 O ATOM 1247 CB LEU A 86 12.679 18.568 -9.260 1.00 0.00 C ATOM 1248 CG LEU A 86 13.488 17.460 -9.938 1.00 0.00 C ATOM 1249 CD1 LEU A 86 12.888 16.118 -9.514 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.394 17.580 -11.456 1.00 0.00 C ATOM 0 H LEU A 86 14.961 20.237 -10.221 1.00 0.00 H new ATOM 0 HA LEU A 86 12.799 20.201 -10.688 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.815 18.462 -8.184 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.626 18.380 -9.468 1.00 0.00 H new ATOM 0 HG LEU A 86 14.535 17.539 -9.645 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.445 15.306 -9.982 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.946 16.020 -8.430 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.845 16.071 -9.827 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.976 16.784 -11.921 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.352 17.495 -11.764 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.787 18.547 -11.770 1.00 0.00 H new ATOM 1262 N PRO A 87 11.924 22.314 -9.345 1.00 0.00 N ATOM 1263 CA PRO A 87 11.010 23.316 -8.770 1.00 0.00 C ATOM 1264 C PRO A 87 9.495 22.985 -8.663 1.00 0.00 C ATOM 1265 O PRO A 87 8.864 23.552 -7.763 1.00 0.00 O ATOM 1266 CB PRO A 87 11.212 24.574 -9.620 1.00 0.00 C ATOM 1267 CG PRO A 87 12.657 24.452 -10.095 1.00 0.00 C ATOM 1268 CD PRO A 87 12.807 22.951 -10.317 1.00 0.00 C ATOM 0 HA PRO A 87 11.277 23.402 -7.717 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.515 24.609 -10.458 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.056 25.482 -9.037 1.00 0.00 H new ATOM 0 HG2 PRO A 87 12.832 25.017 -11.011 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.361 24.824 -9.351 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.530 22.677 -11.335 1.00 0.00 H new ATOM 0 HD3 PRO A 87 13.840 22.636 -10.172 1.00 0.00 H new ATOM 1276 N PRO A 88 8.865 22.144 -9.524 1.00 0.00 N ATOM 1277 CA PRO A 88 7.415 21.889 -9.468 1.00 0.00 C ATOM 1278 C PRO A 88 6.961 20.939 -8.332 1.00 0.00 C ATOM 1279 O PRO A 88 7.675 20.682 -7.363 1.00 0.00 O ATOM 1280 CB PRO A 88 7.044 21.342 -10.860 1.00 0.00 C ATOM 1281 CG PRO A 88 8.238 21.616 -11.762 1.00 0.00 C ATOM 1282 CD PRO A 88 9.396 21.611 -10.777 1.00 0.00 C ATOM 0 HA PRO A 88 6.891 22.814 -9.226 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.830 20.274 -10.813 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.148 21.830 -11.243 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.353 20.850 -12.529 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.147 22.572 -12.278 1.00 0.00 H new ATOM 0 HD2 PRO A 88 9.785 20.602 -10.638 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.221 22.223 -11.142 1.00 0.00 H new ATOM 1290 N GLU A 89 5.772 20.337 -8.489 1.00 0.00 N ATOM 1291 CA GLU A 89 5.210 19.278 -7.623 1.00 0.00 C ATOM 1292 C GLU A 89 6.140 18.066 -7.380 1.00 0.00 C ATOM 1293 O GLU A 89 5.948 17.301 -6.438 1.00 0.00 O ATOM 1294 CB GLU A 89 3.857 18.810 -8.195 1.00 0.00 C ATOM 1295 CG GLU A 89 3.894 18.410 -9.681 1.00 0.00 C ATOM 1296 CD GLU A 89 2.543 17.810 -10.128 1.00 0.00 C ATOM 1297 OE1 GLU A 89 1.562 18.577 -10.286 1.00 0.00 O ATOM 1298 OE2 GLU A 89 2.460 16.577 -10.345 1.00 0.00 O ATOM 0 H GLU A 89 5.145 20.583 -9.255 1.00 0.00 H new ATOM 0 HA GLU A 89 5.083 19.734 -6.641 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.506 17.959 -7.612 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.127 19.609 -8.065 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.127 19.283 -10.290 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.690 17.684 -9.846 1.00 0.00 H new ATOM 1305 N TRP A 90 7.201 17.919 -8.173 1.00 0.00 N ATOM 1306 CA TRP A 90 8.264 16.914 -8.029 1.00 0.00 C ATOM 1307 C TRP A 90 9.032 16.964 -6.696 1.00 0.00 C ATOM 1308 O TRP A 90 9.670 15.975 -6.339 1.00 0.00 O ATOM 1309 CB TRP A 90 9.183 17.042 -9.243 1.00 0.00 C ATOM 1310 CG TRP A 90 8.519 16.532 -10.483 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.751 17.245 -11.340 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.505 15.167 -10.989 1.00 0.00 C ATOM 1313 NE1 TRP A 90 7.143 16.384 -12.236 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.573 15.086 -12.064 1.00 0.00 C ATOM 1315 CE3 TRP A 90 9.224 14.001 -10.665 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 7.318 13.886 -12.740 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 9.042 12.816 -11.396 1.00 0.00 C ATOM 1318 CH2 TRP A 90 8.086 12.753 -12.423 1.00 0.00 C ATOM 0 H TRP A 90 7.354 18.528 -8.977 1.00 0.00 H new ATOM 0 HA TRP A 90 7.799 15.929 -7.996 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.463 18.086 -9.381 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.103 16.486 -9.065 1.00 0.00 H new ATOM 0 HD1 TRP A 90 7.632 18.318 -11.326 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.461 16.674 -12.937 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.925 14.018 -9.843 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.544 13.833 -13.492 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.641 11.947 -11.167 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.941 11.833 -12.970 1.00 0.00 H new ATOM 1329 N VAL A 91 8.933 18.059 -5.931 1.00 0.00 N ATOM 1330 CA VAL A 91 9.516 18.194 -4.576 1.00 0.00 C ATOM 1331 C VAL A 91 8.485 18.488 -3.476 1.00 0.00 C ATOM 1332 O VAL A 91 8.861 18.643 -2.315 1.00 0.00 O ATOM 1333 CB VAL A 91 10.684 19.203 -4.540 1.00 0.00 C ATOM 1334 CG1 VAL A 91 11.811 18.775 -5.479 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.239 20.638 -4.858 1.00 0.00 C ATOM 0 H VAL A 91 8.437 18.896 -6.236 1.00 0.00 H new ATOM 0 HA VAL A 91 9.919 17.208 -4.347 1.00 0.00 H new ATOM 0 HB VAL A 91 11.058 19.202 -3.516 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.620 19.504 -5.433 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.186 17.798 -5.176 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.432 18.717 -6.499 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.101 21.304 -4.818 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.801 20.671 -5.856 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.498 20.960 -4.126 1.00 0.00 H new ATOM 1345 N THR A 92 7.185 18.524 -3.799 1.00 0.00 N ATOM 1346 CA THR A 92 6.093 18.738 -2.817 1.00 0.00 C ATOM 1347 C THR A 92 5.523 17.429 -2.245 1.00 0.00 C ATOM 1348 O THR A 92 4.595 17.452 -1.431 1.00 0.00 O ATOM 1349 CB THR A 92 4.961 19.598 -3.403 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.317 18.899 -4.444 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.459 20.923 -3.982 1.00 0.00 C ATOM 0 H THR A 92 6.850 18.405 -4.755 1.00 0.00 H new ATOM 0 HA THR A 92 6.552 19.277 -1.988 1.00 0.00 H new ATOM 0 HB THR A 92 4.282 19.810 -2.577 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.972 18.352 -4.925 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.615 21.486 -4.381 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.944 21.503 -3.197 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.173 20.725 -4.781 1.00 0.00 H new ATOM 1359 N GLN A 93 6.077 16.281 -2.658 1.00 0.00 N ATOM 1360 CA GLN A 93 5.668 14.941 -2.220 1.00 0.00 C ATOM 1361 C GLN A 93 6.186 14.612 -0.805 1.00 0.00 C ATOM 1362 O GLN A 93 6.892 15.412 -0.181 1.00 0.00 O ATOM 1363 CB GLN A 93 6.084 13.899 -3.280 1.00 0.00 C ATOM 1364 CG GLN A 93 5.611 14.248 -4.704 1.00 0.00 C ATOM 1365 CD GLN A 93 4.131 14.647 -4.764 1.00 0.00 C ATOM 1366 OE1 GLN A 93 3.241 13.980 -4.245 1.00 0.00 O ATOM 1367 NE2 GLN A 93 3.817 15.796 -5.329 1.00 0.00 N ATOM 0 H GLN A 93 6.846 16.260 -3.327 1.00 0.00 H new ATOM 0 HA GLN A 93 4.582 14.911 -2.137 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.170 13.805 -3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 93 5.680 12.926 -3.000 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.218 15.066 -5.092 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.777 13.391 -5.356 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.542 16.365 -5.766 1.00 0.00 H new ATOM 0 HE22 GLN A 93 2.849 16.116 -5.330 1.00 0.00 H new ATOM 1376 N GLU A 94 5.821 13.443 -0.274 1.00 0.00 N ATOM 1377 CA GLU A 94 6.056 13.091 1.139 1.00 0.00 C ATOM 1378 C GLU A 94 7.553 12.993 1.489 1.00 0.00 C ATOM 1379 O GLU A 94 7.961 13.444 2.563 1.00 0.00 O ATOM 1380 CB GLU A 94 5.306 11.791 1.480 1.00 0.00 C ATOM 1381 CG GLU A 94 5.447 11.408 2.955 1.00 0.00 C ATOM 1382 CD GLU A 94 4.588 10.179 3.298 1.00 0.00 C ATOM 1383 OE1 GLU A 94 5.048 9.032 3.088 1.00 0.00 O ATOM 1384 OE2 GLU A 94 3.449 10.339 3.800 1.00 0.00 O ATOM 0 H GLU A 94 5.354 12.710 -0.807 1.00 0.00 H new ATOM 0 HA GLU A 94 5.663 13.900 1.754 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.250 11.909 1.237 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.687 10.981 0.859 1.00 0.00 H new ATOM 0 HG2 GLU A 94 6.493 11.198 3.180 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.149 12.249 3.581 1.00 0.00 H new ATOM 1391 N ILE A 95 8.378 12.463 0.576 1.00 0.00 N ATOM 1392 CA ILE A 95 9.846 12.432 0.703 1.00 0.00 C ATOM 1393 C ILE A 95 10.497 12.801 -0.638 1.00 0.00 C ATOM 1394 O ILE A 95 10.113 12.274 -1.687 1.00 0.00 O ATOM 1395 CB ILE A 95 10.355 11.047 1.202 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.619 10.535 2.463 1.00 0.00 C ATOM 1397 CG2 ILE A 95 11.880 11.079 1.435 1.00 0.00 C ATOM 1398 CD1 ILE A 95 10.070 9.151 2.955 1.00 0.00 C ATOM 0 H ILE A 95 8.041 12.036 -0.287 1.00 0.00 H new ATOM 0 HA ILE A 95 10.134 13.169 1.453 1.00 0.00 H new ATOM 0 HB ILE A 95 10.127 10.335 0.409 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.763 11.256 3.268 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.550 10.500 2.253 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.215 10.102 1.783 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.386 11.325 0.501 1.00 0.00 H new ATOM 0 HG23 ILE A 95 12.118 11.833 2.185 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.499 8.876 3.842 1.00 0.00 H new ATOM 0 HD12 ILE A 95 9.900 8.413 2.171 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.131 9.181 3.201 1.00 0.00 H new ATOM 1410 N PHE A 96 11.504 13.678 -0.598 1.00 0.00 N ATOM 1411 CA PHE A 96 12.389 13.971 -1.727 1.00 0.00 C ATOM 1412 C PHE A 96 13.859 13.810 -1.298 1.00 0.00 C ATOM 1413 O PHE A 96 14.258 14.323 -0.250 1.00 0.00 O ATOM 1414 CB PHE A 96 12.115 15.345 -2.357 1.00 0.00 C ATOM 1415 CG PHE A 96 13.098 15.684 -3.470 1.00 0.00 C ATOM 1416 CD1 PHE A 96 12.880 15.234 -4.789 1.00 0.00 C ATOM 1417 CD2 PHE A 96 14.283 16.385 -3.166 1.00 0.00 C ATOM 1418 CE1 PHE A 96 13.856 15.456 -5.779 1.00 0.00 C ATOM 1419 CE2 PHE A 96 15.244 16.626 -4.165 1.00 0.00 C ATOM 1420 CZ PHE A 96 15.033 16.155 -5.469 1.00 0.00 C ATOM 0 H PHE A 96 11.731 14.215 0.239 1.00 0.00 H new ATOM 0 HA PHE A 96 12.178 13.246 -2.513 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.100 15.363 -2.755 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.167 16.112 -1.584 1.00 0.00 H new ATOM 0 HD1 PHE A 96 11.964 14.719 -5.039 1.00 0.00 H new ATOM 0 HD2 PHE A 96 14.454 16.739 -2.160 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.698 15.087 -6.782 1.00 0.00 H new ATOM 0 HE2 PHE A 96 16.144 17.174 -3.928 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.775 16.330 -6.234 1.00 0.00 H new ATOM 1430 N GLU A 97 14.666 13.113 -2.103 1.00 0.00 N ATOM 1431 CA GLU A 97 16.104 12.907 -1.866 1.00 0.00 C ATOM 1432 C GLU A 97 16.938 13.103 -3.143 1.00 0.00 C ATOM 1433 O GLU A 97 16.447 12.895 -4.249 1.00 0.00 O ATOM 1434 CB GLU A 97 16.364 11.497 -1.307 1.00 0.00 C ATOM 1435 CG GLU A 97 15.764 11.218 0.080 1.00 0.00 C ATOM 1436 CD GLU A 97 16.331 12.112 1.207 1.00 0.00 C ATOM 1437 OE1 GLU A 97 17.466 12.638 1.082 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.663 12.252 2.259 1.00 0.00 O ATOM 0 H GLU A 97 14.334 12.665 -2.957 1.00 0.00 H new ATOM 0 HA GLU A 97 16.412 13.658 -1.139 1.00 0.00 H new ATOM 0 HB2 GLU A 97 15.965 10.766 -2.011 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.441 11.337 -1.257 1.00 0.00 H new ATOM 0 HG2 GLU A 97 14.684 11.356 0.031 1.00 0.00 H new ATOM 0 HG3 GLU A 97 15.941 10.173 0.337 1.00 0.00 H new ATOM 1445 N ASP A 98 18.221 13.449 -2.992 1.00 0.00 N ATOM 1446 CA ASP A 98 19.177 13.613 -4.098 1.00 0.00 C ATOM 1447 C ASP A 98 20.404 12.703 -3.896 1.00 0.00 C ATOM 1448 O ASP A 98 21.336 13.028 -3.158 1.00 0.00 O ATOM 1449 CB ASP A 98 19.538 15.100 -4.231 1.00 0.00 C ATOM 1450 CG ASP A 98 20.610 15.371 -5.306 1.00 0.00 C ATOM 1451 OD1 ASP A 98 20.654 14.653 -6.334 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.399 16.329 -5.128 1.00 0.00 O ATOM 0 H ASP A 98 18.635 13.627 -2.077 1.00 0.00 H new ATOM 0 HA ASP A 98 18.726 13.298 -5.039 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.638 15.665 -4.474 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.896 15.468 -3.269 1.00 0.00 H new ATOM 1457 N TRP A 99 20.377 11.524 -4.524 1.00 0.00 N ATOM 1458 CA TRP A 99 21.406 10.485 -4.438 1.00 0.00 C ATOM 1459 C TRP A 99 22.471 10.700 -5.523 1.00 0.00 C ATOM 1460 O TRP A 99 22.423 10.112 -6.605 1.00 0.00 O ATOM 1461 CB TRP A 99 20.751 9.096 -4.543 1.00 0.00 C ATOM 1462 CG TRP A 99 19.710 8.717 -3.531 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.366 9.397 -2.410 1.00 0.00 C ATOM 1464 CD2 TRP A 99 18.835 7.553 -3.573 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.337 8.732 -1.766 1.00 0.00 N ATOM 1466 CE2 TRP A 99 17.955 7.603 -2.454 1.00 0.00 C ATOM 1467 CE3 TRP A 99 18.681 6.471 -4.464 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 16.967 6.634 -2.232 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 17.674 5.504 -4.268 1.00 0.00 C ATOM 1470 CH2 TRP A 99 16.817 5.583 -3.153 1.00 0.00 C ATOM 0 H TRP A 99 19.603 11.256 -5.133 1.00 0.00 H new ATOM 0 HA TRP A 99 21.909 10.546 -3.473 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.297 9.017 -5.531 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.545 8.351 -4.497 1.00 0.00 H new ATOM 0 HD1 TRP A 99 19.824 10.315 -2.072 1.00 0.00 H new ATOM 0 HE1 TRP A 99 17.914 9.040 -0.890 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.346 6.382 -5.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.328 6.694 -1.363 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.559 4.698 -4.977 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.048 4.839 -3.006 1.00 0.00 H new ATOM 1481 N GLN A 100 23.436 11.576 -5.240 1.00 0.00 N ATOM 1482 CA GLN A 100 24.473 11.959 -6.201 1.00 0.00 C ATOM 1483 C GLN A 100 25.464 10.802 -6.442 1.00 0.00 C ATOM 1484 O GLN A 100 26.181 10.389 -5.529 1.00 0.00 O ATOM 1485 CB GLN A 100 25.188 13.237 -5.724 1.00 0.00 C ATOM 1486 CG GLN A 100 24.223 14.425 -5.547 1.00 0.00 C ATOM 1487 CD GLN A 100 24.916 15.764 -5.285 1.00 0.00 C ATOM 1488 OE1 GLN A 100 26.133 15.886 -5.196 1.00 0.00 O ATOM 1489 NE2 GLN A 100 24.153 16.827 -5.162 1.00 0.00 N ATOM 0 H GLN A 100 23.521 12.041 -4.336 1.00 0.00 H new ATOM 0 HA GLN A 100 24.001 12.174 -7.160 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.689 13.037 -4.777 1.00 0.00 H new ATOM 0 HB3 GLN A 100 25.962 13.506 -6.443 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.609 14.516 -6.443 1.00 0.00 H new ATOM 0 HG3 GLN A 100 23.548 14.210 -4.718 1.00 0.00 H new ATOM 0 HE21 GLN A 100 23.139 16.738 -5.234 1.00 0.00 H new ATOM 0 HE22 GLN A 100 24.574 17.741 -4.994 1.00 0.00 H new ATOM 1498 N LEU A 101 25.502 10.289 -7.680 1.00 0.00 N ATOM 1499 CA LEU A 101 26.400 9.232 -8.159 1.00 0.00 C ATOM 1500 C LEU A 101 26.812 9.575 -9.595 1.00 0.00 C ATOM 1501 O LEU A 101 26.022 10.181 -10.323 1.00 0.00 O ATOM 1502 CB LEU A 101 25.684 7.861 -8.111 1.00 0.00 C ATOM 1503 CG LEU A 101 25.400 7.275 -6.711 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.610 5.976 -6.849 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.680 6.952 -5.945 1.00 0.00 C ATOM 0 H LEU A 101 24.873 10.619 -8.412 1.00 0.00 H new ATOM 0 HA LEU A 101 27.284 9.168 -7.524 1.00 0.00 H new ATOM 0 HB2 LEU A 101 24.735 7.954 -8.640 1.00 0.00 H new ATOM 0 HB3 LEU A 101 26.288 7.142 -8.664 1.00 0.00 H new ATOM 0 HG LEU A 101 24.840 8.032 -6.162 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.411 5.564 -5.860 1.00 0.00 H new ATOM 0 HD12 LEU A 101 23.666 6.176 -7.355 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.189 5.258 -7.431 1.00 0.00 H new ATOM 0 HD21 LEU A 101 26.425 6.543 -4.967 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.264 6.220 -6.504 1.00 0.00 H new ATOM 0 HD23 LEU A 101 27.266 7.862 -5.816 1.00 0.00 H new ATOM 1517 N GLU A 102 28.010 9.185 -10.029 1.00 0.00 N ATOM 1518 CA GLU A 102 28.489 9.453 -11.384 1.00 0.00 C ATOM 1519 C GLU A 102 27.724 8.650 -12.432 1.00 0.00 C ATOM 1520 O GLU A 102 27.165 7.594 -12.154 1.00 0.00 O ATOM 1521 CB GLU A 102 30.003 9.213 -11.497 1.00 0.00 C ATOM 1522 CG GLU A 102 30.455 7.762 -11.279 1.00 0.00 C ATOM 1523 CD GLU A 102 31.996 7.684 -11.225 1.00 0.00 C ATOM 1524 OE1 GLU A 102 32.663 7.962 -12.253 1.00 0.00 O ATOM 1525 OE2 GLU A 102 32.552 7.353 -10.149 1.00 0.00 O ATOM 0 H GLU A 102 28.676 8.674 -9.450 1.00 0.00 H new ATOM 0 HA GLU A 102 28.299 10.507 -11.587 1.00 0.00 H new ATOM 0 HB2 GLU A 102 30.332 9.534 -12.485 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.510 9.847 -10.770 1.00 0.00 H new ATOM 0 HG2 GLU A 102 30.032 7.377 -10.351 1.00 0.00 H new ATOM 0 HG3 GLU A 102 30.080 7.132 -12.086 1.00 0.00 H new ATOM 1532 N ASP A 103 27.715 9.162 -13.657 1.00 0.00 N ATOM 1533 CA ASP A 103 27.064 8.509 -14.795 1.00 0.00 C ATOM 1534 C ASP A 103 28.012 7.476 -15.452 1.00 0.00 C ATOM 1535 O ASP A 103 29.057 7.879 -15.978 1.00 0.00 O ATOM 1536 CB ASP A 103 26.546 9.581 -15.765 1.00 0.00 C ATOM 1537 CG ASP A 103 25.447 9.036 -16.684 1.00 0.00 C ATOM 1538 OD1 ASP A 103 25.714 8.102 -17.470 1.00 0.00 O ATOM 1539 OD2 ASP A 103 24.303 9.545 -16.624 1.00 0.00 O ATOM 0 H ASP A 103 28.161 10.048 -13.894 1.00 0.00 H new ATOM 0 HA ASP A 103 26.199 7.936 -14.460 1.00 0.00 H new ATOM 0 HB2 ASP A 103 26.159 10.427 -15.198 1.00 0.00 H new ATOM 0 HB3 ASP A 103 27.373 9.954 -16.369 1.00 0.00 H new ATOM 1544 N PRO A 104 27.699 6.158 -15.420 1.00 0.00 N ATOM 1545 CA PRO A 104 28.625 5.105 -15.865 1.00 0.00 C ATOM 1546 C PRO A 104 28.859 5.001 -17.381 1.00 0.00 C ATOM 1547 O PRO A 104 29.775 4.304 -17.810 1.00 0.00 O ATOM 1548 CB PRO A 104 28.047 3.801 -15.325 1.00 0.00 C ATOM 1549 CG PRO A 104 27.196 4.227 -14.142 1.00 0.00 C ATOM 1550 CD PRO A 104 26.610 5.528 -14.679 1.00 0.00 C ATOM 0 HA PRO A 104 29.617 5.345 -15.483 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.450 3.288 -16.079 1.00 0.00 H new ATOM 0 HB3 PRO A 104 28.835 3.113 -15.020 1.00 0.00 H new ATOM 0 HG2 PRO A 104 26.426 3.494 -13.899 1.00 0.00 H new ATOM 0 HG3 PRO A 104 27.787 4.380 -13.239 1.00 0.00 H new ATOM 0 HD2 PRO A 104 25.753 5.337 -15.324 1.00 0.00 H new ATOM 0 HD3 PRO A 104 26.263 6.168 -13.868 1.00 0.00 H new ATOM 1558 N ASP A 105 28.063 5.693 -18.196 1.00 0.00 N ATOM 1559 CA ASP A 105 28.176 5.736 -19.662 1.00 0.00 C ATOM 1560 C ASP A 105 29.610 6.068 -20.126 1.00 0.00 C ATOM 1561 O ASP A 105 30.103 7.184 -19.930 1.00 0.00 O ATOM 1562 CB ASP A 105 27.176 6.787 -20.157 1.00 0.00 C ATOM 1563 CG ASP A 105 27.296 7.195 -21.637 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.800 6.411 -22.475 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.837 8.322 -21.954 1.00 0.00 O ATOM 0 H ASP A 105 27.292 6.261 -17.845 1.00 0.00 H new ATOM 0 HA ASP A 105 27.951 4.756 -20.082 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.168 6.408 -19.987 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.288 7.682 -19.545 1.00 0.00 H new ATOM 1570 N GLY A 106 30.274 5.085 -20.749 1.00 0.00 N ATOM 1571 CA GLY A 106 31.636 5.217 -21.277 1.00 0.00 C ATOM 1572 C GLY A 106 32.736 5.253 -20.207 1.00 0.00 C ATOM 1573 O GLY A 106 33.864 5.638 -20.521 1.00 0.00 O ATOM 0 H GLY A 106 29.872 4.160 -20.902 1.00 0.00 H new ATOM 0 HA2 GLY A 106 31.832 4.384 -21.953 1.00 0.00 H new ATOM 0 HA3 GLY A 106 31.695 6.129 -21.870 1.00 0.00 H new ATOM 1577 N GLN A 107 32.428 4.872 -18.959 1.00 0.00 N ATOM 1578 CA GLN A 107 33.389 4.853 -17.844 1.00 0.00 C ATOM 1579 C GLN A 107 34.181 3.528 -17.820 1.00 0.00 C ATOM 1580 O GLN A 107 35.185 3.385 -18.520 1.00 0.00 O ATOM 1581 CB GLN A 107 32.706 5.175 -16.496 1.00 0.00 C ATOM 1582 CG GLN A 107 31.888 6.471 -16.435 1.00 0.00 C ATOM 1583 CD GLN A 107 32.646 7.786 -16.578 1.00 0.00 C ATOM 1584 OE1 GLN A 107 33.863 7.860 -16.702 1.00 0.00 O ATOM 1585 NE2 GLN A 107 31.920 8.885 -16.553 1.00 0.00 N ATOM 0 H GLN A 107 31.493 4.564 -18.691 1.00 0.00 H new ATOM 0 HA GLN A 107 34.116 5.649 -18.007 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.048 4.344 -16.240 1.00 0.00 H new ATOM 0 HB3 GLN A 107 33.476 5.221 -15.726 1.00 0.00 H new ATOM 0 HG2 GLN A 107 31.133 6.430 -17.220 1.00 0.00 H new ATOM 0 HG3 GLN A 107 31.357 6.490 -15.483 1.00 0.00 H new ATOM 0 HE21 GLN A 107 30.907 8.825 -16.450 1.00 0.00 H new ATOM 0 HE22 GLN A 107 32.371 9.796 -16.637 1.00 0.00 H new ATOM 1594 N SER A 108 33.738 2.554 -17.015 1.00 0.00 N ATOM 1595 CA SER A 108 34.273 1.180 -16.900 1.00 0.00 C ATOM 1596 C SER A 108 33.263 0.302 -16.163 1.00 0.00 C ATOM 1597 O SER A 108 32.441 0.818 -15.407 1.00 0.00 O ATOM 1598 CB SER A 108 35.602 1.176 -16.122 1.00 0.00 C ATOM 1599 OG SER A 108 36.681 1.572 -16.951 1.00 0.00 O ATOM 0 H SER A 108 32.949 2.707 -16.386 1.00 0.00 H new ATOM 0 HA SER A 108 34.449 0.792 -17.903 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.529 1.850 -15.268 1.00 0.00 H new ATOM 0 HB3 SER A 108 35.791 0.179 -15.725 1.00 0.00 H new ATOM 0 HG SER A 108 36.363 2.220 -17.614 1.00 0.00 H new ATOM 1605 N LEU A 109 33.334 -1.026 -16.300 1.00 0.00 N ATOM 1606 CA LEU A 109 32.383 -1.937 -15.632 1.00 0.00 C ATOM 1607 C LEU A 109 32.465 -1.843 -14.111 1.00 0.00 C ATOM 1608 O LEU A 109 31.449 -1.806 -13.433 1.00 0.00 O ATOM 1609 CB LEU A 109 32.608 -3.386 -16.106 1.00 0.00 C ATOM 1610 CG LEU A 109 32.528 -3.620 -17.626 1.00 0.00 C ATOM 1611 CD1 LEU A 109 32.662 -5.119 -17.880 1.00 0.00 C ATOM 1612 CD2 LEU A 109 31.221 -3.119 -18.239 1.00 0.00 C ATOM 0 H LEU A 109 34.038 -1.499 -16.866 1.00 0.00 H new ATOM 0 HA LEU A 109 31.377 -1.625 -15.914 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.589 -3.712 -15.759 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.870 -4.025 -15.621 1.00 0.00 H new ATOM 0 HG LEU A 109 33.332 -3.055 -18.097 1.00 0.00 H new ATOM 0 HD11 LEU A 109 32.608 -5.313 -18.951 1.00 0.00 H new ATOM 0 HD12 LEU A 109 33.620 -5.469 -17.495 1.00 0.00 H new ATOM 0 HD13 LEU A 109 31.853 -5.647 -17.375 1.00 0.00 H new ATOM 0 HD21 LEU A 109 31.225 -3.312 -19.312 1.00 0.00 H new ATOM 0 HD22 LEU A 109 30.381 -3.639 -17.779 1.00 0.00 H new ATOM 0 HD23 LEU A 109 31.124 -2.048 -18.064 1.00 0.00 H new ATOM 1624 N GLU A 110 33.666 -1.679 -13.565 1.00 0.00 N ATOM 1625 CA GLU A 110 33.865 -1.434 -12.123 1.00 0.00 C ATOM 1626 C GLU A 110 33.179 -0.144 -11.633 1.00 0.00 C ATOM 1627 O GLU A 110 32.686 -0.098 -10.508 1.00 0.00 O ATOM 1628 CB GLU A 110 35.366 -1.466 -11.779 1.00 0.00 C ATOM 1629 CG GLU A 110 36.193 -0.335 -12.406 1.00 0.00 C ATOM 1630 CD GLU A 110 37.687 -0.504 -12.068 1.00 0.00 C ATOM 1631 OE1 GLU A 110 38.144 0.021 -11.023 1.00 0.00 O ATOM 1632 OE2 GLU A 110 38.419 -1.162 -12.847 1.00 0.00 O ATOM 0 H GLU A 110 34.533 -1.710 -14.101 1.00 0.00 H new ATOM 0 HA GLU A 110 33.374 -2.243 -11.581 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.477 -1.421 -10.696 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.779 -2.422 -12.103 1.00 0.00 H new ATOM 0 HG2 GLU A 110 36.057 -0.334 -13.487 1.00 0.00 H new ATOM 0 HG3 GLU A 110 35.838 0.628 -12.040 1.00 0.00 H new ATOM 1639 N VAL A 111 33.042 0.871 -12.498 1.00 0.00 N ATOM 1640 CA VAL A 111 32.280 2.101 -12.203 1.00 0.00 C ATOM 1641 C VAL A 111 30.779 1.835 -12.264 1.00 0.00 C ATOM 1642 O VAL A 111 30.065 2.252 -11.355 1.00 0.00 O ATOM 1643 CB VAL A 111 32.695 3.258 -13.131 1.00 0.00 C ATOM 1644 CG1 VAL A 111 31.835 4.510 -12.939 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.158 3.645 -12.883 1.00 0.00 C ATOM 0 H VAL A 111 33.458 0.865 -13.429 1.00 0.00 H new ATOM 0 HA VAL A 111 32.520 2.410 -11.186 1.00 0.00 H new ATOM 0 HB VAL A 111 32.555 2.893 -14.149 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.173 5.292 -13.619 1.00 0.00 H new ATOM 0 HG12 VAL A 111 30.793 4.271 -13.150 1.00 0.00 H new ATOM 0 HG13 VAL A 111 31.926 4.860 -11.911 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.435 4.464 -13.547 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.280 3.960 -11.847 1.00 0.00 H new ATOM 0 HG23 VAL A 111 34.800 2.786 -13.079 1.00 0.00 H new ATOM 1655 N PHE A 112 30.288 1.070 -13.248 1.00 0.00 N ATOM 1656 CA PHE A 112 28.882 0.639 -13.267 1.00 0.00 C ATOM 1657 C PHE A 112 28.530 -0.157 -12.009 1.00 0.00 C ATOM 1658 O PHE A 112 27.524 0.129 -11.374 1.00 0.00 O ATOM 1659 CB PHE A 112 28.601 -0.229 -14.495 1.00 0.00 C ATOM 1660 CG PHE A 112 28.179 0.490 -15.755 1.00 0.00 C ATOM 1661 CD1 PHE A 112 26.812 0.729 -15.988 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.132 0.858 -16.721 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.395 1.301 -17.203 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.718 1.458 -17.922 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.353 1.688 -18.156 1.00 0.00 C ATOM 0 H PHE A 112 30.840 0.737 -14.039 1.00 0.00 H new ATOM 0 HA PHE A 112 28.268 1.539 -13.304 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.500 -0.805 -14.717 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.821 -0.944 -14.234 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.083 0.473 -15.233 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.182 0.680 -16.540 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.343 1.442 -17.403 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.449 1.742 -18.664 1.00 0.00 H new ATOM 0 HZ PHE A 112 27.038 2.164 -19.072 1.00 0.00 H new ATOM 1675 N ARG A 113 29.376 -1.107 -11.599 1.00 0.00 N ATOM 1676 CA ARG A 113 29.193 -1.923 -10.381 1.00 0.00 C ATOM 1677 C ARG A 113 29.245 -1.077 -9.101 1.00 0.00 C ATOM 1678 O ARG A 113 28.412 -1.253 -8.214 1.00 0.00 O ATOM 1679 CB ARG A 113 30.256 -3.037 -10.365 1.00 0.00 C ATOM 1680 CG ARG A 113 30.073 -4.052 -11.508 1.00 0.00 C ATOM 1681 CD ARG A 113 31.256 -5.019 -11.555 1.00 0.00 C ATOM 1682 NE ARG A 113 31.154 -5.984 -12.667 1.00 0.00 N ATOM 1683 CZ ARG A 113 32.135 -6.424 -13.435 1.00 0.00 C ATOM 1684 NH1 ARG A 113 33.359 -5.978 -13.351 1.00 0.00 N ATOM 1685 NH2 ARG A 113 31.901 -7.337 -14.324 1.00 0.00 N ATOM 0 H ARG A 113 30.227 -1.340 -12.111 1.00 0.00 H new ATOM 0 HA ARG A 113 28.198 -2.369 -10.404 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.247 -2.589 -10.438 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.213 -3.560 -9.410 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.146 -4.608 -11.365 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.986 -3.527 -12.459 1.00 0.00 H new ATOM 0 HD2 ARG A 113 32.181 -4.451 -11.655 1.00 0.00 H new ATOM 0 HD3 ARG A 113 31.315 -5.562 -10.612 1.00 0.00 H new ATOM 0 HE ARG A 113 30.223 -6.352 -12.864 1.00 0.00 H new ATOM 0 HH11 ARG A 113 33.593 -5.257 -12.669 1.00 0.00 H new ATOM 0 HH12 ARG A 113 34.081 -6.351 -13.967 1.00 0.00 H new ATOM 0 HH21 ARG A 113 30.960 -7.716 -14.431 1.00 0.00 H new ATOM 0 HH22 ARG A 113 32.658 -7.677 -14.917 1.00 0.00 H new ATOM 1699 N THR A 114 30.148 -0.093 -9.053 1.00 0.00 N ATOM 1700 CA THR A 114 30.260 0.878 -7.942 1.00 0.00 C ATOM 1701 C THR A 114 29.002 1.743 -7.811 1.00 0.00 C ATOM 1702 O THR A 114 28.556 2.031 -6.700 1.00 0.00 O ATOM 1703 CB THR A 114 31.509 1.763 -8.134 1.00 0.00 C ATOM 1704 OG1 THR A 114 32.674 0.979 -8.000 1.00 0.00 O ATOM 1705 CG2 THR A 114 31.631 2.899 -7.120 1.00 0.00 C ATOM 0 H THR A 114 30.835 0.060 -9.791 1.00 0.00 H new ATOM 0 HA THR A 114 30.362 0.313 -7.016 1.00 0.00 H new ATOM 0 HB THR A 114 31.401 2.197 -9.128 1.00 0.00 H new ATOM 0 HG1 THR A 114 32.843 0.498 -8.837 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.535 3.473 -7.324 1.00 0.00 H new ATOM 0 HG22 THR A 114 30.761 3.551 -7.198 1.00 0.00 H new ATOM 0 HG23 THR A 114 31.684 2.484 -6.113 1.00 0.00 H new ATOM 1713 N VAL A 115 28.391 2.133 -8.933 1.00 0.00 N ATOM 1714 CA VAL A 115 27.113 2.867 -8.957 1.00 0.00 C ATOM 1715 C VAL A 115 25.946 1.944 -8.597 1.00 0.00 C ATOM 1716 O VAL A 115 25.180 2.261 -7.691 1.00 0.00 O ATOM 1717 CB VAL A 115 26.958 3.589 -10.315 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.561 4.172 -10.555 1.00 0.00 C ATOM 1719 CG2 VAL A 115 27.958 4.752 -10.355 1.00 0.00 C ATOM 0 H VAL A 115 28.770 1.948 -9.862 1.00 0.00 H new ATOM 0 HA VAL A 115 27.108 3.642 -8.190 1.00 0.00 H new ATOM 0 HB VAL A 115 27.135 2.842 -11.089 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.533 4.662 -11.528 1.00 0.00 H new ATOM 0 HG12 VAL A 115 24.823 3.370 -10.531 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.332 4.899 -9.776 1.00 0.00 H new ATOM 0 HG21 VAL A 115 27.867 5.277 -11.306 1.00 0.00 H new ATOM 0 HG22 VAL A 115 27.747 5.442 -9.538 1.00 0.00 H new ATOM 0 HG23 VAL A 115 28.971 4.364 -10.250 1.00 0.00 H new ATOM 1729 N ARG A 116 25.859 0.762 -9.218 1.00 0.00 N ATOM 1730 CA ARG A 116 24.831 -0.276 -8.994 1.00 0.00 C ATOM 1731 C ARG A 116 24.648 -0.610 -7.515 1.00 0.00 C ATOM 1732 O ARG A 116 23.527 -0.568 -7.028 1.00 0.00 O ATOM 1733 CB ARG A 116 25.226 -1.520 -9.828 1.00 0.00 C ATOM 1734 CG ARG A 116 24.172 -2.635 -9.818 1.00 0.00 C ATOM 1735 CD ARG A 116 24.666 -3.929 -10.477 1.00 0.00 C ATOM 1736 NE ARG A 116 25.720 -4.590 -9.669 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.652 -5.416 -10.113 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.665 -5.827 -11.342 1.00 0.00 N ATOM 1739 NH2 ARG A 116 27.604 -5.837 -9.338 1.00 0.00 N ATOM 0 H ARG A 116 26.536 0.484 -9.928 1.00 0.00 H new ATOM 0 HA ARG A 116 23.860 0.097 -9.319 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.406 -1.213 -10.858 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.166 -1.918 -9.446 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.882 -2.845 -8.788 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.278 -2.288 -10.336 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.827 -4.613 -10.610 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.056 -3.706 -11.470 1.00 0.00 H new ATOM 0 HE ARG A 116 25.726 -4.387 -8.670 1.00 0.00 H new ATOM 0 HH11 ARG A 116 25.945 -5.513 -11.992 1.00 0.00 H new ATOM 0 HH12 ARG A 116 27.396 -6.464 -11.659 1.00 0.00 H new ATOM 0 HH21 ARG A 116 27.643 -5.531 -8.366 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.313 -6.474 -9.701 1.00 0.00 H new ATOM 1753 N GLY A 117 25.737 -0.883 -6.796 1.00 0.00 N ATOM 1754 CA GLY A 117 25.695 -1.243 -5.369 1.00 0.00 C ATOM 1755 C GLY A 117 25.132 -0.130 -4.479 1.00 0.00 C ATOM 1756 O GLY A 117 24.319 -0.393 -3.593 1.00 0.00 O ATOM 0 H GLY A 117 26.680 -0.862 -7.184 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.088 -2.140 -5.245 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.702 -1.492 -5.034 1.00 0.00 H new ATOM 1760 N GLN A 118 25.484 1.129 -4.763 1.00 0.00 N ATOM 1761 CA GLN A 118 24.990 2.285 -4.001 1.00 0.00 C ATOM 1762 C GLN A 118 23.529 2.615 -4.346 1.00 0.00 C ATOM 1763 O GLN A 118 22.725 2.840 -3.444 1.00 0.00 O ATOM 1764 CB GLN A 118 25.927 3.487 -4.215 1.00 0.00 C ATOM 1765 CG GLN A 118 27.287 3.255 -3.536 1.00 0.00 C ATOM 1766 CD GLN A 118 28.277 4.376 -3.839 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.441 5.328 -3.086 1.00 0.00 O ATOM 1768 NE2 GLN A 118 28.967 4.312 -4.958 1.00 0.00 N ATOM 0 H GLN A 118 26.117 1.376 -5.524 1.00 0.00 H new ATOM 0 HA GLN A 118 24.997 2.033 -2.940 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.073 3.653 -5.282 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.465 4.389 -3.813 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.145 3.178 -2.458 1.00 0.00 H new ATOM 0 HG3 GLN A 118 27.702 2.305 -3.871 1.00 0.00 H new ATOM 0 HE21 GLN A 118 28.838 3.524 -5.592 1.00 0.00 H new ATOM 0 HE22 GLN A 118 29.631 5.051 -5.191 1.00 0.00 H new ATOM 1777 N VAL A 119 23.137 2.549 -5.627 1.00 0.00 N ATOM 1778 CA VAL A 119 21.718 2.636 -6.037 1.00 0.00 C ATOM 1779 C VAL A 119 20.873 1.541 -5.365 1.00 0.00 C ATOM 1780 O VAL A 119 19.813 1.846 -4.812 1.00 0.00 O ATOM 1781 CB VAL A 119 21.574 2.593 -7.572 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.108 2.632 -7.991 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.238 3.798 -8.245 1.00 0.00 C ATOM 0 H VAL A 119 23.785 2.435 -6.406 1.00 0.00 H new ATOM 0 HA VAL A 119 21.337 3.599 -5.698 1.00 0.00 H new ATOM 0 HB VAL A 119 22.054 1.665 -7.883 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.039 2.600 -9.078 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.586 1.773 -7.569 1.00 0.00 H new ATOM 0 HG13 VAL A 119 19.649 3.551 -7.625 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.112 3.726 -9.325 1.00 0.00 H new ATOM 0 HG22 VAL A 119 21.774 4.717 -7.886 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.301 3.810 -8.004 1.00 0.00 H new ATOM 1793 N LYS A 120 21.356 0.289 -5.341 1.00 0.00 N ATOM 1794 CA LYS A 120 20.696 -0.840 -4.658 1.00 0.00 C ATOM 1795 C LYS A 120 20.499 -0.550 -3.171 1.00 0.00 C ATOM 1796 O LYS A 120 19.372 -0.602 -2.687 1.00 0.00 O ATOM 1797 CB LYS A 120 21.525 -2.125 -4.844 1.00 0.00 C ATOM 1798 CG LYS A 120 20.798 -3.351 -4.276 1.00 0.00 C ATOM 1799 CD LYS A 120 21.673 -4.610 -4.332 1.00 0.00 C ATOM 1800 CE LYS A 120 20.839 -5.816 -3.873 1.00 0.00 C ATOM 1801 NZ LYS A 120 21.683 -7.029 -3.663 1.00 0.00 N ATOM 0 H LYS A 120 22.228 0.027 -5.801 1.00 0.00 H new ATOM 0 HA LYS A 120 19.712 -0.979 -5.106 1.00 0.00 H new ATOM 0 HB2 LYS A 120 21.726 -2.279 -5.904 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.490 -2.011 -4.350 1.00 0.00 H new ATOM 0 HG2 LYS A 120 20.508 -3.156 -3.244 1.00 0.00 H new ATOM 0 HG3 LYS A 120 19.880 -3.521 -4.838 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.040 -4.769 -5.346 1.00 0.00 H new ATOM 0 HD3 LYS A 120 22.547 -4.490 -3.692 1.00 0.00 H new ATOM 0 HE2 LYS A 120 20.322 -5.568 -2.946 1.00 0.00 H new ATOM 0 HE3 LYS A 120 20.072 -6.032 -4.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.083 -7.820 -3.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.156 -7.281 -4.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 22.399 -6.832 -2.934 1.00 0.00 H new ATOM 1815 N GLU A 121 21.569 -0.208 -2.450 1.00 0.00 N ATOM 1816 CA GLU A 121 21.493 0.000 -0.998 1.00 0.00 C ATOM 1817 C GLU A 121 20.604 1.177 -0.632 1.00 0.00 C ATOM 1818 O GLU A 121 19.817 1.050 0.304 1.00 0.00 O ATOM 1819 CB GLU A 121 22.894 0.051 -0.349 1.00 0.00 C ATOM 1820 CG GLU A 121 23.537 1.439 -0.251 1.00 0.00 C ATOM 1821 CD GLU A 121 24.936 1.350 0.390 1.00 0.00 C ATOM 1822 OE1 GLU A 121 25.030 1.296 1.640 1.00 0.00 O ATOM 1823 OE2 GLU A 121 25.951 1.351 -0.347 1.00 0.00 O ATOM 0 H GLU A 121 22.499 -0.069 -2.845 1.00 0.00 H new ATOM 0 HA GLU A 121 21.003 -0.874 -0.568 1.00 0.00 H new ATOM 0 HB2 GLU A 121 22.823 -0.367 0.655 1.00 0.00 H new ATOM 0 HB3 GLU A 121 23.560 -0.597 -0.918 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.615 1.880 -1.245 1.00 0.00 H new ATOM 0 HG3 GLU A 121 22.902 2.098 0.341 1.00 0.00 H new ATOM 1830 N ARG A 122 20.610 2.272 -1.403 1.00 0.00 N ATOM 1831 CA ARG A 122 19.692 3.380 -1.124 1.00 0.00 C ATOM 1832 C ARG A 122 18.237 2.993 -1.379 1.00 0.00 C ATOM 1833 O ARG A 122 17.404 3.305 -0.534 1.00 0.00 O ATOM 1834 CB ARG A 122 20.145 4.668 -1.819 1.00 0.00 C ATOM 1835 CG ARG A 122 21.480 5.158 -1.230 1.00 0.00 C ATOM 1836 CD ARG A 122 21.631 6.668 -1.406 1.00 0.00 C ATOM 1837 NE ARG A 122 22.935 7.141 -0.891 1.00 0.00 N ATOM 1838 CZ ARG A 122 23.203 8.308 -0.331 1.00 0.00 C ATOM 1839 NH1 ARG A 122 22.286 9.212 -0.134 1.00 0.00 N ATOM 1840 NH2 ARG A 122 24.419 8.593 0.041 1.00 0.00 N ATOM 0 H ARG A 122 21.224 2.412 -2.205 1.00 0.00 H new ATOM 0 HA ARG A 122 19.733 3.602 -0.058 1.00 0.00 H new ATOM 0 HB2 ARG A 122 20.256 4.491 -2.889 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.384 5.439 -1.701 1.00 0.00 H new ATOM 0 HG2 ARG A 122 21.530 4.904 -0.171 1.00 0.00 H new ATOM 0 HG3 ARG A 122 22.308 4.646 -1.720 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.540 6.924 -2.462 1.00 0.00 H new ATOM 0 HD3 ARG A 122 20.823 7.180 -0.883 1.00 0.00 H new ATOM 0 HE ARG A 122 23.717 6.492 -0.978 1.00 0.00 H new ATOM 0 HH11 ARG A 122 21.322 9.031 -0.415 1.00 0.00 H new ATOM 0 HH12 ARG A 122 22.532 10.101 0.301 1.00 0.00 H new ATOM 0 HH21 ARG A 122 25.168 7.915 -0.100 1.00 0.00 H new ATOM 0 HH22 ARG A 122 24.622 9.494 0.473 1.00 0.00 H new ATOM 1854 N VAL A 123 17.930 2.200 -2.406 1.00 0.00 N ATOM 1855 CA VAL A 123 16.586 1.608 -2.576 1.00 0.00 C ATOM 1856 C VAL A 123 16.204 0.691 -1.414 1.00 0.00 C ATOM 1857 O VAL A 123 15.122 0.873 -0.863 1.00 0.00 O ATOM 1858 CB VAL A 123 16.457 0.881 -3.931 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.276 -0.092 -3.992 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.308 1.898 -5.063 1.00 0.00 C ATOM 0 H VAL A 123 18.591 1.947 -3.140 1.00 0.00 H new ATOM 0 HA VAL A 123 15.876 2.435 -2.572 1.00 0.00 H new ATOM 0 HB VAL A 123 17.371 0.298 -4.045 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.246 -0.567 -4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.393 -0.855 -3.222 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.347 0.453 -3.824 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.218 1.373 -6.014 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.416 2.501 -4.895 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.184 2.546 -5.088 1.00 0.00 H new ATOM 1870 N GLU A 124 17.046 -0.255 -0.995 1.00 0.00 N ATOM 1871 CA GLU A 124 16.710 -1.149 0.131 1.00 0.00 C ATOM 1872 C GLU A 124 16.493 -0.388 1.434 1.00 0.00 C ATOM 1873 O GLU A 124 15.585 -0.712 2.201 1.00 0.00 O ATOM 1874 CB GLU A 124 17.782 -2.221 0.337 1.00 0.00 C ATOM 1875 CG GLU A 124 17.887 -3.191 -0.829 1.00 0.00 C ATOM 1876 CD GLU A 124 18.883 -4.319 -0.481 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.112 -4.123 -0.641 1.00 0.00 O ATOM 1878 OE2 GLU A 124 18.444 -5.402 -0.022 1.00 0.00 O ATOM 0 H GLU A 124 17.961 -0.427 -1.411 1.00 0.00 H new ATOM 0 HA GLU A 124 15.771 -1.632 -0.140 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.747 -1.737 0.487 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.560 -2.779 1.247 1.00 0.00 H new ATOM 0 HG2 GLU A 124 16.907 -3.614 -1.052 1.00 0.00 H new ATOM 0 HG3 GLU A 124 18.218 -2.664 -1.724 1.00 0.00 H new ATOM 1885 N ASN A 125 17.267 0.677 1.647 1.00 0.00 N ATOM 1886 CA ASN A 125 17.105 1.516 2.825 1.00 0.00 C ATOM 1887 C ASN A 125 15.826 2.370 2.756 1.00 0.00 C ATOM 1888 O ASN A 125 15.227 2.658 3.790 1.00 0.00 O ATOM 1889 CB ASN A 125 18.401 2.321 3.067 1.00 0.00 C ATOM 1890 CG ASN A 125 18.221 3.824 3.110 1.00 0.00 C ATOM 1891 OD1 ASN A 125 18.148 4.451 4.158 1.00 0.00 O ATOM 1892 ND2 ASN A 125 18.137 4.435 1.951 1.00 0.00 N ATOM 0 H ASN A 125 18.011 0.975 1.016 1.00 0.00 H new ATOM 0 HA ASN A 125 16.955 0.888 3.703 1.00 0.00 H new ATOM 0 HB2 ASN A 125 18.843 1.996 4.009 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.115 2.078 2.280 1.00 0.00 H new ATOM 0 HD21 ASN A 125 18.009 5.446 1.916 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.200 3.898 1.086 1.00 0.00 H new ATOM 1899 N LEU A 126 15.389 2.746 1.548 1.00 0.00 N ATOM 1900 CA LEU A 126 14.171 3.519 1.328 1.00 0.00 C ATOM 1901 C LEU A 126 12.925 2.653 1.476 1.00 0.00 C ATOM 1902 O LEU A 126 12.033 3.015 2.237 1.00 0.00 O ATOM 1903 CB LEU A 126 14.262 4.199 -0.052 1.00 0.00 C ATOM 1904 CG LEU A 126 12.968 4.891 -0.505 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.544 6.011 0.443 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.190 5.478 -1.892 1.00 0.00 C ATOM 0 H LEU A 126 15.883 2.516 0.686 1.00 0.00 H new ATOM 0 HA LEU A 126 14.081 4.292 2.091 1.00 0.00 H new ATOM 0 HB2 LEU A 126 15.065 4.936 -0.028 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.539 3.451 -0.795 1.00 0.00 H new ATOM 0 HG LEU A 126 12.174 4.144 -0.510 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.624 6.468 0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.375 5.601 1.439 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.330 6.765 0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.279 5.973 -2.228 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.004 6.202 -1.855 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.446 4.680 -2.588 1.00 0.00 H new ATOM 1918 N ILE A 127 12.841 1.507 0.791 1.00 0.00 N ATOM 1919 CA ILE A 127 11.610 0.693 0.820 1.00 0.00 C ATOM 1920 C ILE A 127 11.276 0.218 2.230 1.00 0.00 C ATOM 1921 O ILE A 127 10.108 0.212 2.596 1.00 0.00 O ATOM 1922 CB ILE A 127 11.622 -0.466 -0.203 1.00 0.00 C ATOM 1923 CG1 ILE A 127 12.756 -1.493 0.028 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.635 0.137 -1.623 1.00 0.00 C ATOM 1925 CD1 ILE A 127 12.979 -2.471 -1.126 1.00 0.00 C ATOM 0 H ILE A 127 13.593 1.123 0.218 1.00 0.00 H new ATOM 0 HA ILE A 127 10.803 1.354 0.505 1.00 0.00 H new ATOM 0 HB ILE A 127 10.715 -1.055 -0.068 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.685 -0.953 0.213 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.534 -2.062 0.931 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.644 -0.667 -2.359 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.746 0.751 -1.766 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.525 0.754 -1.748 1.00 0.00 H new ATOM 0 HD11 ILE A 127 13.792 -3.152 -0.874 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.068 -3.043 -1.299 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.236 -1.916 -2.028 1.00 0.00 H new ATOM 1937 N ALA A 128 12.275 -0.052 3.071 1.00 0.00 N ATOM 1938 CA ALA A 128 12.038 -0.425 4.464 1.00 0.00 C ATOM 1939 C ALA A 128 11.390 0.700 5.311 1.00 0.00 C ATOM 1940 O ALA A 128 10.749 0.408 6.324 1.00 0.00 O ATOM 1941 CB ALA A 128 13.369 -0.896 5.059 1.00 0.00 C ATOM 0 H ALA A 128 13.260 -0.019 2.809 1.00 0.00 H new ATOM 0 HA ALA A 128 11.305 -1.231 4.486 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.221 -1.181 6.101 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.736 -1.754 4.496 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.098 -0.088 5.004 1.00 0.00 H new ATOM 1947 N LYS A 129 11.511 1.974 4.889 1.00 0.00 N ATOM 1948 CA LYS A 129 10.854 3.138 5.522 1.00 0.00 C ATOM 1949 C LYS A 129 9.416 3.360 5.029 1.00 0.00 C ATOM 1950 O LYS A 129 8.548 3.695 5.835 1.00 0.00 O ATOM 1951 CB LYS A 129 11.679 4.416 5.277 1.00 0.00 C ATOM 1952 CG LYS A 129 13.081 4.379 5.904 1.00 0.00 C ATOM 1953 CD LYS A 129 13.886 5.624 5.491 1.00 0.00 C ATOM 1954 CE LYS A 129 15.352 5.583 5.949 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.500 5.681 7.430 1.00 0.00 N ATOM 0 H LYS A 129 12.080 2.229 4.082 1.00 0.00 H new ATOM 0 HA LYS A 129 10.803 2.918 6.588 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.776 4.574 4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.135 5.271 5.678 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.000 4.334 6.990 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.605 3.477 5.586 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.855 5.724 4.406 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.408 6.511 5.907 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.810 4.656 5.604 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.897 6.402 5.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.509 5.648 7.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.090 6.577 7.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.005 4.886 7.882 1.00 0.00 H new ATOM 1969 N ILE A 130 9.166 3.184 3.723 1.00 0.00 N ATOM 1970 CA ILE A 130 7.894 3.573 3.068 1.00 0.00 C ATOM 1971 C ILE A 130 6.961 2.419 2.637 1.00 0.00 C ATOM 1972 O ILE A 130 5.883 2.696 2.107 1.00 0.00 O ATOM 1973 CB ILE A 130 8.128 4.624 1.954 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.073 4.208 0.809 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.675 5.915 2.585 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.543 3.104 -0.099 1.00 0.00 C ATOM 0 H ILE A 130 9.840 2.766 3.082 1.00 0.00 H new ATOM 0 HA ILE A 130 7.316 4.045 3.862 1.00 0.00 H new ATOM 0 HB ILE A 130 7.150 4.754 1.491 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.289 5.086 0.200 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.019 3.879 1.240 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.842 6.659 1.806 1.00 0.00 H new ATOM 0 HG22 ILE A 130 7.955 6.301 3.307 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.617 5.702 3.091 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.280 2.883 -0.872 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.356 2.207 0.491 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.614 3.432 -0.566 1.00 0.00 H new ATOM 1988 N SER A 131 7.340 1.152 2.854 1.00 0.00 N ATOM 1989 CA SER A 131 6.491 -0.030 2.574 1.00 0.00 C ATOM 1990 C SER A 131 5.126 0.031 3.283 1.00 0.00 C ATOM 1991 O SER A 131 4.085 -0.053 2.586 1.00 0.00 O ATOM 1992 CB SER A 131 7.209 -1.314 2.982 1.00 0.00 C ATOM 1993 OG SER A 131 8.268 -1.572 2.086 1.00 0.00 O ATOM 1994 OXT SER A 131 5.093 0.146 4.531 1.00 0.00 O ATOM 0 H SER A 131 8.255 0.909 3.234 1.00 0.00 H new ATOM 0 HA SER A 131 6.308 -0.025 1.500 1.00 0.00 H new ATOM 0 HB2 SER A 131 7.594 -1.220 3.997 1.00 0.00 H new ATOM 0 HB3 SER A 131 6.509 -2.149 2.983 1.00 0.00 H new ATOM 0 HG SER A 131 9.048 -1.034 2.338 1.00 0.00 H new