USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 992 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 78 SER OG : rot -115:sc= 1.39 USER MOD Set 1.2: A 80 CYS SG : rot 91:sc= -0.412 USER MOD Set 2.1: A 16 GLN : amide:sc= 1.29 K(o=3.5,f=-2.9) USER MOD Set 2.2: A 34 SER OG : rot -69:sc= -0.538 USER MOD Set 2.3: A 40 SER OG : rot 180:sc= 0.831 USER MOD Set 2.4: A 60 GLN : amide:sc= 1.21 K(o=3.5,f=-1.2!) USER MOD Set 2.5: A 62 SER OG : rot 153:sc= 0.702 USER MOD Set 3.1: A 43 HIS : no HE2:sc= 0.718 K(o=1.9,f=-2.6) USER MOD Set 3.2: A 45 THR OG1 : rot 96:sc= 1.18 USER MOD Set 4.1: A 8 CYS SG : rot 76:sc= 0.631 USER MOD Set 4.2: A 15 SER OG : rot 118:sc= -0.224 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 141:sc= 0.00483 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 167:sc= 1.26 (180deg=1.19) USER MOD Single : A 5 MET CE :methyl -160:sc= 0 (180deg=-1.22) USER MOD Single : A 9 LYS NZ :NH3+ -170:sc= 0.566 (180deg=0.508) USER MOD Single : A 11 ASN : amide:sc= 1.03 K(o=1,f=-7.5!) USER MOD Single : A 12 SER OG : rot 180:sc= 0.731 USER MOD Single : A 13 CYS SG : rot 170:sc= -0.148 USER MOD Single : A 17 MET CE :methyl 152:sc= -0.759 (180deg=-2.69) USER MOD Single : A 23 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.18) USER MOD Single : A 24 THR OG1 : rot 74:sc= 0.027 USER MOD Single : A 29 LYS NZ :NH3+ -178:sc= 0.827 (180deg=0.822) USER MOD Single : A 33 THR OG1 : rot -160:sc= -0.0134 USER MOD Single : A 35 CYS SG : rot 114:sc= -0.0599 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0839 USER MOD Single : A 49 MET CE :methyl -150:sc=-0.00232 (180deg=-0.281) USER MOD Single : A 50 MET CE :methyl -120:sc= 0 (180deg=-0.131) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0134 USER MOD Single : A 67 ASN : amide:sc= 2.6 K(o=2.6,f=0.15) USER MOD Single : A 69 ASN : amide:sc= 0.994 K(o=0.99,f=-0.13) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 CYS SG : rot 180:sc= 0.0716 USER MOD Single : A 85 ASN : amide:sc=-0.00352 K(o=-0.0035,f=-1.1) USER MOD Single : A 92 THR OG1 : rot -43:sc= 0.189 USER MOD Single : A 93 GLN : amide:sc= -0.375! C(o=-0.38!,f=-5.6!) USER MOD Single : A 100 GLN : amide:sc= 1.4 K(o=1.4,f=-0.69) USER MOD Single : A 107 GLN : amide:sc= 1.8 K(o=1.8,f=0) USER MOD Single : A 108 SER OG : rot 180:sc=-0.00736 USER MOD Single : A 114 THR OG1 : rot 78:sc= 1.21 USER MOD Single : A 118 GLN : amide:sc= -0.044 X(o=-0.044,f=-0.044) USER MOD Single : A 120 LYS NZ :NH3+ -150:sc= 1.3 (180deg=1.18) USER MOD Single : A 125 ASN : amide:sc= 0.401 X(o=0.4,f=-0.0052) USER MOD Single : A 129 LYS NZ :NH3+ 172:sc= 1.25 (180deg=1.13) USER MOD Single : A 131 SER OG : rot 62:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.176 2.204 1.599 1.00 0.00 N ATOM 2 CA MET A 1 4.250 2.052 0.108 1.00 0.00 C ATOM 3 C MET A 1 5.060 0.800 -0.282 1.00 0.00 C ATOM 4 O MET A 1 6.107 0.554 0.313 1.00 0.00 O ATOM 5 CB MET A 1 4.841 3.326 -0.559 1.00 0.00 C ATOM 6 CG MET A 1 4.812 3.313 -2.096 1.00 0.00 C ATOM 7 SD MET A 1 3.175 3.088 -2.836 1.00 0.00 S ATOM 8 CE MET A 1 2.476 4.754 -2.657 1.00 0.00 C ATOM 0 H1 MET A 1 4.261 3.210 1.850 1.00 0.00 H new ATOM 0 H2 MET A 1 3.265 1.838 1.940 1.00 0.00 H new ATOM 0 H3 MET A 1 4.951 1.670 2.041 1.00 0.00 H new ATOM 0 HA MET A 1 3.233 1.923 -0.262 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.288 4.196 -0.205 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.873 3.448 -0.229 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.231 4.252 -2.459 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.465 2.515 -2.449 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.467 4.771 -3.069 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.441 5.023 -1.601 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.099 5.470 -3.193 1.00 0.00 H new ATOM 18 N LYS A 2 4.630 0.032 -1.304 1.00 0.00 N ATOM 19 CA LYS A 2 5.388 -1.126 -1.825 1.00 0.00 C ATOM 20 C LYS A 2 6.642 -0.677 -2.566 1.00 0.00 C ATOM 21 O LYS A 2 6.575 0.248 -3.376 1.00 0.00 O ATOM 22 CB LYS A 2 4.540 -2.011 -2.758 1.00 0.00 C ATOM 23 CG LYS A 2 3.319 -2.670 -2.099 1.00 0.00 C ATOM 24 CD LYS A 2 2.460 -3.392 -3.157 1.00 0.00 C ATOM 25 CE LYS A 2 1.535 -2.468 -3.973 1.00 0.00 C ATOM 26 NZ LYS A 2 0.307 -2.066 -3.222 1.00 0.00 N ATOM 0 H LYS A 2 3.749 0.196 -1.791 1.00 0.00 H new ATOM 0 HA LYS A 2 5.671 -1.718 -0.955 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.198 -1.404 -3.596 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.178 -2.793 -3.170 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.647 -3.381 -1.341 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.721 -1.914 -1.590 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.121 -3.920 -3.844 1.00 0.00 H new ATOM 0 HD3 LYS A 2 1.851 -4.146 -2.658 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.087 -1.574 -4.263 1.00 0.00 H new ATOM 0 HE3 LYS A 2 1.243 -2.975 -4.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.277 -1.446 -3.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.237 -2.915 -2.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.580 -1.557 -2.357 1.00 0.00 H new ATOM 40 N LYS A 3 7.752 -1.380 -2.362 1.00 0.00 N ATOM 41 CA LYS A 3 9.015 -1.169 -3.084 1.00 0.00 C ATOM 42 C LYS A 3 9.328 -2.342 -4.013 1.00 0.00 C ATOM 43 O LYS A 3 9.359 -3.495 -3.585 1.00 0.00 O ATOM 44 CB LYS A 3 10.117 -0.884 -2.054 1.00 0.00 C ATOM 45 CG LYS A 3 11.381 -0.239 -2.645 1.00 0.00 C ATOM 46 CD LYS A 3 12.429 0.074 -1.562 1.00 0.00 C ATOM 47 CE LYS A 3 11.897 1.033 -0.485 1.00 0.00 C ATOM 48 NZ LYS A 3 12.950 1.373 0.514 1.00 0.00 N ATOM 0 H LYS A 3 7.806 -2.132 -1.675 1.00 0.00 H new ATOM 0 HA LYS A 3 8.939 -0.305 -3.744 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.716 -0.228 -1.281 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.394 -1.819 -1.567 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.816 -0.908 -3.388 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.110 0.681 -3.164 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.748 -0.856 -1.090 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.310 0.512 -2.030 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.534 1.946 -0.957 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.047 0.576 0.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.634 2.179 1.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.122 0.553 1.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.830 1.624 0.019 1.00 0.00 H new ATOM 62 N VAL A 4 9.546 -2.029 -5.288 1.00 0.00 N ATOM 63 CA VAL A 4 9.862 -2.974 -6.369 1.00 0.00 C ATOM 64 C VAL A 4 11.377 -3.051 -6.572 1.00 0.00 C ATOM 65 O VAL A 4 11.977 -2.069 -6.998 1.00 0.00 O ATOM 66 CB VAL A 4 9.160 -2.549 -7.675 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.475 -3.505 -8.835 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.633 -2.509 -7.515 1.00 0.00 C ATOM 0 H VAL A 4 9.506 -1.064 -5.617 1.00 0.00 H new ATOM 0 HA VAL A 4 9.498 -3.963 -6.091 1.00 0.00 H new ATOM 0 HB VAL A 4 9.542 -1.553 -7.898 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.960 -3.168 -9.735 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.550 -3.517 -9.015 1.00 0.00 H new ATOM 0 HG13 VAL A 4 9.139 -4.510 -8.580 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.176 -2.205 -8.457 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.270 -3.499 -7.238 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.367 -1.794 -6.736 1.00 0.00 H new ATOM 78 N MET A 5 12.007 -4.195 -6.298 1.00 0.00 N ATOM 79 CA MET A 5 13.412 -4.433 -6.675 1.00 0.00 C ATOM 80 C MET A 5 13.500 -5.202 -7.995 1.00 0.00 C ATOM 81 O MET A 5 12.948 -6.298 -8.110 1.00 0.00 O ATOM 82 CB MET A 5 14.172 -5.207 -5.589 1.00 0.00 C ATOM 83 CG MET A 5 15.663 -5.378 -5.916 1.00 0.00 C ATOM 84 SD MET A 5 16.641 -3.856 -5.878 1.00 0.00 S ATOM 85 CE MET A 5 17.293 -3.961 -4.187 1.00 0.00 C ATOM 0 H MET A 5 11.568 -4.978 -5.814 1.00 0.00 H new ATOM 0 HA MET A 5 13.876 -3.454 -6.792 1.00 0.00 H new ATOM 0 HB2 MET A 5 14.071 -4.684 -4.638 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.717 -6.189 -5.463 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.095 -6.086 -5.208 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.752 -5.823 -6.907 1.00 0.00 H new ATOM 0 HE1 MET A 5 17.615 -2.973 -3.859 1.00 0.00 H new ATOM 0 HE2 MET A 5 16.514 -4.329 -3.519 1.00 0.00 H new ATOM 0 HE3 MET A 5 18.142 -4.645 -4.166 1.00 0.00 H new ATOM 95 N PHE A 6 14.238 -4.662 -8.963 1.00 0.00 N ATOM 96 CA PHE A 6 14.616 -5.368 -10.183 1.00 0.00 C ATOM 97 C PHE A 6 15.977 -6.048 -9.963 1.00 0.00 C ATOM 98 O PHE A 6 16.933 -5.373 -9.583 1.00 0.00 O ATOM 99 CB PHE A 6 14.620 -4.379 -11.354 1.00 0.00 C ATOM 100 CG PHE A 6 13.243 -3.853 -11.713 1.00 0.00 C ATOM 101 CD1 PHE A 6 12.247 -4.742 -12.156 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.945 -2.486 -11.603 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.964 -4.278 -12.486 1.00 0.00 C ATOM 104 CE2 PHE A 6 11.671 -2.016 -11.969 1.00 0.00 C ATOM 105 CZ PHE A 6 10.677 -2.908 -12.407 1.00 0.00 C ATOM 0 H PHE A 6 14.595 -3.707 -8.920 1.00 0.00 H new ATOM 0 HA PHE A 6 13.899 -6.151 -10.428 1.00 0.00 H new ATOM 0 HB2 PHE A 6 15.267 -3.538 -11.105 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.052 -4.866 -12.228 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.472 -5.795 -12.243 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.692 -1.797 -11.238 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.200 -4.974 -12.800 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.454 -0.959 -11.913 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.699 -2.541 -12.681 1.00 0.00 H new ATOM 115 N VAL A 7 16.076 -7.368 -10.162 1.00 0.00 N ATOM 116 CA VAL A 7 17.304 -8.157 -9.923 1.00 0.00 C ATOM 117 C VAL A 7 17.798 -8.865 -11.184 1.00 0.00 C ATOM 118 O VAL A 7 17.027 -9.513 -11.888 1.00 0.00 O ATOM 119 CB VAL A 7 17.199 -9.122 -8.717 1.00 0.00 C ATOM 120 CG1 VAL A 7 16.826 -8.360 -7.441 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.181 -10.256 -8.882 1.00 0.00 C ATOM 0 H VAL A 7 15.296 -7.933 -10.499 1.00 0.00 H new ATOM 0 HA VAL A 7 18.064 -7.426 -9.648 1.00 0.00 H new ATOM 0 HB VAL A 7 18.190 -9.571 -8.653 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.758 -9.058 -6.607 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.590 -7.613 -7.227 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.864 -7.866 -7.580 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.180 -10.878 -7.987 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.187 -9.834 -9.031 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.450 -10.864 -9.746 1.00 0.00 H new ATOM 131 N CYS A 8 19.096 -8.755 -11.479 1.00 0.00 N ATOM 132 CA CYS A 8 19.718 -9.400 -12.648 1.00 0.00 C ATOM 133 C CYS A 8 21.093 -10.028 -12.358 1.00 0.00 C ATOM 134 O CYS A 8 21.679 -9.812 -11.301 1.00 0.00 O ATOM 135 CB CYS A 8 19.788 -8.353 -13.775 1.00 0.00 C ATOM 136 SG CYS A 8 20.963 -7.022 -13.363 1.00 0.00 S ATOM 0 H CYS A 8 19.751 -8.215 -10.914 1.00 0.00 H new ATOM 0 HA CYS A 8 19.101 -10.248 -12.947 1.00 0.00 H new ATOM 0 HB2 CYS A 8 20.091 -8.835 -14.705 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.798 -7.929 -13.944 1.00 0.00 H new ATOM 0 HG CYS A 8 22.179 -7.453 -13.520 1.00 0.00 H new ATOM 142 N LYS A 9 21.648 -10.773 -13.324 1.00 0.00 N ATOM 143 CA LYS A 9 23.048 -11.257 -13.295 1.00 0.00 C ATOM 144 C LYS A 9 24.036 -10.110 -13.589 1.00 0.00 C ATOM 145 O LYS A 9 23.628 -9.023 -13.992 1.00 0.00 O ATOM 146 CB LYS A 9 23.202 -12.465 -14.248 1.00 0.00 C ATOM 147 CG LYS A 9 22.449 -13.687 -13.696 1.00 0.00 C ATOM 148 CD LYS A 9 22.673 -14.949 -14.548 1.00 0.00 C ATOM 149 CE LYS A 9 21.963 -16.146 -13.893 1.00 0.00 C ATOM 150 NZ LYS A 9 22.185 -17.418 -14.640 1.00 0.00 N ATOM 0 H LYS A 9 21.138 -11.063 -14.159 1.00 0.00 H new ATOM 0 HA LYS A 9 23.296 -11.608 -12.293 1.00 0.00 H new ATOM 0 HB2 LYS A 9 22.817 -12.208 -15.235 1.00 0.00 H new ATOM 0 HB3 LYS A 9 24.258 -12.706 -14.371 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.775 -13.880 -12.674 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.383 -13.465 -13.654 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.289 -14.792 -15.556 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.740 -15.152 -14.641 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.321 -16.262 -12.870 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.894 -15.944 -13.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 21.556 -18.156 -14.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.979 -17.269 -15.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 23.175 -17.717 -14.530 1.00 0.00 H new ATOM 164 N ARG A 10 25.337 -10.348 -13.378 1.00 0.00 N ATOM 165 CA ARG A 10 26.400 -9.313 -13.390 1.00 0.00 C ATOM 166 C ARG A 10 26.544 -8.564 -14.719 1.00 0.00 C ATOM 167 O ARG A 10 26.626 -7.339 -14.737 1.00 0.00 O ATOM 168 CB ARG A 10 27.737 -9.952 -12.944 1.00 0.00 C ATOM 169 CG ARG A 10 28.518 -9.090 -11.941 1.00 0.00 C ATOM 170 CD ARG A 10 29.107 -7.786 -12.487 1.00 0.00 C ATOM 171 NE ARG A 10 29.800 -7.066 -11.402 1.00 0.00 N ATOM 172 CZ ARG A 10 30.760 -6.166 -11.498 1.00 0.00 C ATOM 173 NH1 ARG A 10 31.210 -5.741 -12.647 1.00 0.00 N ATOM 174 NH2 ARG A 10 31.288 -5.669 -10.417 1.00 0.00 N ATOM 0 H ARG A 10 25.696 -11.284 -13.189 1.00 0.00 H new ATOM 0 HA ARG A 10 26.100 -8.541 -12.681 1.00 0.00 H new ATOM 0 HB2 ARG A 10 27.535 -10.925 -12.496 1.00 0.00 H new ATOM 0 HB3 ARG A 10 28.358 -10.128 -13.822 1.00 0.00 H new ATOM 0 HG2 ARG A 10 27.856 -8.846 -11.110 1.00 0.00 H new ATOM 0 HG3 ARG A 10 29.332 -9.690 -11.534 1.00 0.00 H new ATOM 0 HD2 ARG A 10 29.803 -8.001 -13.298 1.00 0.00 H new ATOM 0 HD3 ARG A 10 28.315 -7.163 -12.903 1.00 0.00 H new ATOM 0 HE ARG A 10 29.498 -7.293 -10.455 1.00 0.00 H new ATOM 0 HH11 ARG A 10 30.818 -6.106 -13.515 1.00 0.00 H new ATOM 0 HH12 ARG A 10 31.954 -5.044 -12.677 1.00 0.00 H new ATOM 0 HH21 ARG A 10 30.959 -5.976 -9.501 1.00 0.00 H new ATOM 0 HH22 ARG A 10 32.030 -4.973 -10.486 1.00 0.00 H new ATOM 188 N ASN A 11 26.566 -9.292 -15.836 1.00 0.00 N ATOM 189 CA ASN A 11 26.785 -8.733 -17.180 1.00 0.00 C ATOM 190 C ASN A 11 25.460 -8.261 -17.818 1.00 0.00 C ATOM 191 O ASN A 11 25.003 -8.813 -18.820 1.00 0.00 O ATOM 192 CB ASN A 11 27.584 -9.751 -18.018 1.00 0.00 C ATOM 193 CG ASN A 11 28.139 -9.153 -19.305 1.00 0.00 C ATOM 194 OD1 ASN A 11 28.276 -7.944 -19.452 1.00 0.00 O ATOM 195 ND2 ASN A 11 28.517 -9.973 -20.257 1.00 0.00 N ATOM 0 H ASN A 11 26.431 -10.303 -15.838 1.00 0.00 H new ATOM 0 HA ASN A 11 27.388 -7.826 -17.126 1.00 0.00 H new ATOM 0 HB2 ASN A 11 28.408 -10.140 -17.419 1.00 0.00 H new ATOM 0 HB3 ASN A 11 26.941 -10.596 -18.264 1.00 0.00 H new ATOM 0 HD21 ASN A 11 28.924 -9.604 -21.116 1.00 0.00 H new ATOM 0 HD22 ASN A 11 28.404 -10.980 -20.138 1.00 0.00 H new ATOM 202 N SER A 12 24.801 -7.292 -17.174 1.00 0.00 N ATOM 203 CA SER A 12 23.447 -6.842 -17.521 1.00 0.00 C ATOM 204 C SER A 12 23.192 -5.369 -17.192 1.00 0.00 C ATOM 205 O SER A 12 23.704 -4.835 -16.205 1.00 0.00 O ATOM 206 CB SER A 12 22.433 -7.687 -16.753 1.00 0.00 C ATOM 207 OG SER A 12 21.116 -7.428 -17.225 1.00 0.00 O ATOM 0 H SER A 12 25.200 -6.788 -16.382 1.00 0.00 H new ATOM 0 HA SER A 12 23.344 -6.958 -18.600 1.00 0.00 H new ATOM 0 HB2 SER A 12 22.667 -8.745 -16.871 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.495 -7.463 -15.688 1.00 0.00 H new ATOM 0 HG SER A 12 20.476 -7.977 -16.726 1.00 0.00 H new ATOM 213 N CYS A 13 22.327 -4.749 -17.997 1.00 0.00 N ATOM 214 CA CYS A 13 21.741 -3.420 -17.782 1.00 0.00 C ATOM 215 C CYS A 13 20.219 -3.489 -17.540 1.00 0.00 C ATOM 216 O CYS A 13 19.583 -2.466 -17.299 1.00 0.00 O ATOM 217 CB CYS A 13 22.075 -2.536 -18.996 1.00 0.00 C ATOM 218 SG CYS A 13 23.874 -2.375 -19.159 1.00 0.00 S ATOM 0 H CYS A 13 21.998 -5.180 -18.861 1.00 0.00 H new ATOM 0 HA CYS A 13 22.170 -2.985 -16.879 1.00 0.00 H new ATOM 0 HB2 CYS A 13 21.656 -2.973 -19.902 1.00 0.00 H new ATOM 0 HB3 CYS A 13 21.621 -1.552 -18.877 1.00 0.00 H new ATOM 0 HG CYS A 13 24.158 -1.813 -20.296 1.00 0.00 H new ATOM 224 N ARG A 14 19.614 -4.687 -17.576 1.00 0.00 N ATOM 225 CA ARG A 14 18.159 -4.928 -17.586 1.00 0.00 C ATOM 226 C ARG A 14 17.472 -4.423 -16.327 1.00 0.00 C ATOM 227 O ARG A 14 16.484 -3.718 -16.453 1.00 0.00 O ATOM 228 CB ARG A 14 17.884 -6.426 -17.855 1.00 0.00 C ATOM 229 CG ARG A 14 18.273 -6.825 -19.291 1.00 0.00 C ATOM 230 CD ARG A 14 18.205 -8.344 -19.502 1.00 0.00 C ATOM 231 NE ARG A 14 19.453 -9.015 -19.072 1.00 0.00 N ATOM 232 CZ ARG A 14 19.721 -10.308 -19.163 1.00 0.00 C ATOM 233 NH1 ARG A 14 18.846 -11.168 -19.594 1.00 0.00 N ATOM 234 NH2 ARG A 14 20.900 -10.762 -18.838 1.00 0.00 N ATOM 0 H ARG A 14 20.149 -5.555 -17.600 1.00 0.00 H new ATOM 0 HA ARG A 14 17.721 -4.347 -18.398 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.444 -7.033 -17.144 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.827 -6.638 -17.692 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.607 -6.330 -19.998 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.283 -6.474 -19.504 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.362 -8.751 -18.943 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.022 -8.557 -20.555 1.00 0.00 H new ATOM 0 HE ARG A 14 20.177 -8.423 -18.666 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.917 -10.853 -19.876 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.088 -12.157 -19.651 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.622 -10.119 -18.511 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.100 -11.760 -18.910 1.00 0.00 H new ATOM 248 N SER A 15 18.011 -4.677 -15.136 1.00 0.00 N ATOM 249 CA SER A 15 17.440 -4.114 -13.895 1.00 0.00 C ATOM 250 C SER A 15 17.524 -2.588 -13.855 1.00 0.00 C ATOM 251 O SER A 15 16.566 -1.935 -13.453 1.00 0.00 O ATOM 252 CB SER A 15 18.141 -4.669 -12.662 1.00 0.00 C ATOM 253 OG SER A 15 17.960 -6.057 -12.620 1.00 0.00 O ATOM 0 H SER A 15 18.834 -5.262 -14.995 1.00 0.00 H new ATOM 0 HA SER A 15 16.390 -4.408 -13.890 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.204 -4.429 -12.693 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.737 -4.209 -11.760 1.00 0.00 H new ATOM 0 HG SER A 15 18.831 -6.502 -12.672 1.00 0.00 H new ATOM 259 N GLN A 16 18.629 -2.012 -14.336 1.00 0.00 N ATOM 260 CA GLN A 16 18.818 -0.557 -14.363 1.00 0.00 C ATOM 261 C GLN A 16 17.829 0.104 -15.331 1.00 0.00 C ATOM 262 O GLN A 16 17.184 1.089 -14.975 1.00 0.00 O ATOM 263 CB GLN A 16 20.273 -0.219 -14.747 1.00 0.00 C ATOM 264 CG GLN A 16 21.322 -0.755 -13.750 1.00 0.00 C ATOM 265 CD GLN A 16 21.248 -0.125 -12.364 1.00 0.00 C ATOM 266 OE1 GLN A 16 20.675 0.933 -12.161 1.00 0.00 O ATOM 267 NE2 GLN A 16 21.830 -0.751 -11.365 1.00 0.00 N ATOM 0 H GLN A 16 19.416 -2.538 -14.717 1.00 0.00 H new ATOM 0 HA GLN A 16 18.622 -0.162 -13.366 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.482 -0.629 -15.735 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.377 0.863 -14.822 1.00 0.00 H new ATOM 0 HG2 GLN A 16 21.197 -1.833 -13.653 1.00 0.00 H new ATOM 0 HG3 GLN A 16 22.317 -0.585 -14.161 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.311 -1.636 -11.528 1.00 0.00 H new ATOM 0 HE22 GLN A 16 21.801 -0.352 -10.427 1.00 0.00 H new ATOM 276 N MET A 17 17.652 -0.474 -16.523 1.00 0.00 N ATOM 277 CA MET A 17 16.676 -0.011 -17.518 1.00 0.00 C ATOM 278 C MET A 17 15.232 -0.245 -17.058 1.00 0.00 C ATOM 279 O MET A 17 14.384 0.631 -17.223 1.00 0.00 O ATOM 280 CB MET A 17 16.968 -0.681 -18.876 1.00 0.00 C ATOM 281 CG MET A 17 17.236 0.341 -19.983 1.00 0.00 C ATOM 282 SD MET A 17 15.778 1.254 -20.550 1.00 0.00 S ATOM 283 CE MET A 17 15.776 2.749 -19.517 1.00 0.00 C ATOM 0 H MET A 17 18.188 -1.286 -16.829 1.00 0.00 H new ATOM 0 HA MET A 17 16.781 1.068 -17.634 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.831 -1.339 -18.776 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.121 -1.306 -19.159 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.977 1.056 -19.626 1.00 0.00 H new ATOM 0 HG3 MET A 17 17.677 -0.176 -20.835 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.294 3.564 -20.057 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.230 2.553 -18.594 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.802 3.028 -19.279 1.00 0.00 H new ATOM 293 N ALA A 18 14.961 -1.384 -16.412 1.00 0.00 N ATOM 294 CA ALA A 18 13.661 -1.639 -15.777 1.00 0.00 C ATOM 295 C ALA A 18 13.344 -0.608 -14.673 1.00 0.00 C ATOM 296 O ALA A 18 12.261 -0.026 -14.686 1.00 0.00 O ATOM 297 CB ALA A 18 13.627 -3.075 -15.251 1.00 0.00 C ATOM 0 H ALA A 18 15.628 -2.149 -16.314 1.00 0.00 H new ATOM 0 HA ALA A 18 12.877 -1.523 -16.525 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.663 -3.267 -14.779 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.770 -3.769 -16.079 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.423 -3.213 -14.519 1.00 0.00 H new ATOM 303 N GLU A 19 14.290 -0.290 -13.777 1.00 0.00 N ATOM 304 CA GLU A 19 14.123 0.801 -12.801 1.00 0.00 C ATOM 305 C GLU A 19 13.843 2.132 -13.516 1.00 0.00 C ATOM 306 O GLU A 19 12.944 2.854 -13.100 1.00 0.00 O ATOM 307 CB GLU A 19 15.340 0.947 -11.873 1.00 0.00 C ATOM 308 CG GLU A 19 15.029 1.895 -10.698 1.00 0.00 C ATOM 309 CD GLU A 19 16.274 2.405 -9.942 1.00 0.00 C ATOM 310 OE1 GLU A 19 17.235 1.632 -9.730 1.00 0.00 O ATOM 311 OE2 GLU A 19 16.258 3.578 -9.493 1.00 0.00 O ATOM 0 H GLU A 19 15.184 -0.775 -13.707 1.00 0.00 H new ATOM 0 HA GLU A 19 13.266 0.539 -12.180 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.628 -0.032 -11.489 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.189 1.330 -12.439 1.00 0.00 H new ATOM 0 HG2 GLU A 19 14.473 2.752 -11.077 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.378 1.378 -9.993 1.00 0.00 H new ATOM 318 N GLY A 20 14.533 2.415 -14.628 1.00 0.00 N ATOM 319 CA GLY A 20 14.339 3.613 -15.448 1.00 0.00 C ATOM 320 C GLY A 20 12.894 3.823 -15.897 1.00 0.00 C ATOM 321 O GLY A 20 12.256 4.789 -15.484 1.00 0.00 O ATOM 0 H GLY A 20 15.261 1.799 -14.990 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.665 4.486 -14.883 1.00 0.00 H new ATOM 0 HA3 GLY A 20 14.978 3.547 -16.329 1.00 0.00 H new ATOM 325 N PHE A 21 12.333 2.914 -16.705 1.00 0.00 N ATOM 326 CA PHE A 21 10.926 3.055 -17.122 1.00 0.00 C ATOM 327 C PHE A 21 9.965 2.991 -15.928 1.00 0.00 C ATOM 328 O PHE A 21 8.970 3.714 -15.893 1.00 0.00 O ATOM 329 CB PHE A 21 10.552 1.997 -18.170 1.00 0.00 C ATOM 330 CG PHE A 21 11.022 2.292 -19.571 1.00 0.00 C ATOM 331 CD1 PHE A 21 10.268 3.157 -20.383 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.159 1.655 -20.093 1.00 0.00 C ATOM 333 CE1 PHE A 21 10.656 3.397 -21.711 1.00 0.00 C ATOM 334 CE2 PHE A 21 12.538 1.889 -21.423 1.00 0.00 C ATOM 335 CZ PHE A 21 11.794 2.765 -22.232 1.00 0.00 C ATOM 0 H PHE A 21 12.813 2.094 -17.076 1.00 0.00 H new ATOM 0 HA PHE A 21 10.825 4.042 -17.574 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.966 1.038 -17.859 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.468 1.888 -18.182 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.387 3.639 -19.984 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.739 0.988 -19.473 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.079 4.067 -22.330 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.407 1.393 -21.828 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.098 2.951 -23.252 1.00 0.00 H new ATOM 345 N ALA A 22 10.271 2.183 -14.910 1.00 0.00 N ATOM 346 CA ALA A 22 9.439 2.089 -13.717 1.00 0.00 C ATOM 347 C ALA A 22 9.425 3.372 -12.874 1.00 0.00 C ATOM 348 O ALA A 22 8.372 3.702 -12.343 1.00 0.00 O ATOM 349 CB ALA A 22 9.906 0.896 -12.895 1.00 0.00 C ATOM 0 H ALA A 22 11.095 1.582 -14.893 1.00 0.00 H new ATOM 0 HA ALA A 22 8.407 1.951 -14.039 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.294 0.811 -11.997 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.810 -0.014 -13.487 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.949 1.036 -12.611 1.00 0.00 H new ATOM 355 N LYS A 23 10.514 4.145 -12.781 1.00 0.00 N ATOM 356 CA LYS A 23 10.490 5.428 -12.053 1.00 0.00 C ATOM 357 C LYS A 23 9.670 6.504 -12.786 1.00 0.00 C ATOM 358 O LYS A 23 9.077 7.361 -12.140 1.00 0.00 O ATOM 359 CB LYS A 23 11.903 5.910 -11.657 1.00 0.00 C ATOM 360 CG LYS A 23 12.820 6.332 -12.820 1.00 0.00 C ATOM 361 CD LYS A 23 13.865 7.387 -12.430 1.00 0.00 C ATOM 362 CE LYS A 23 14.941 6.853 -11.477 1.00 0.00 C ATOM 363 NZ LYS A 23 15.852 7.949 -11.035 1.00 0.00 N ATOM 0 H LYS A 23 11.416 3.911 -13.195 1.00 0.00 H new ATOM 0 HA LYS A 23 9.967 5.242 -11.115 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.800 6.755 -10.976 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.396 5.112 -11.102 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.333 5.451 -13.205 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.206 6.724 -13.631 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.345 7.764 -13.333 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.361 8.231 -11.960 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.468 6.395 -10.608 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.518 6.073 -11.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.602 7.555 -10.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.280 8.402 -11.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 15.310 8.655 -10.497 1.00 0.00 H new ATOM 377 N THR A 24 9.578 6.424 -14.119 1.00 0.00 N ATOM 378 CA THR A 24 8.744 7.314 -14.952 1.00 0.00 C ATOM 379 C THR A 24 7.255 6.937 -14.897 1.00 0.00 C ATOM 380 O THR A 24 6.405 7.808 -14.722 1.00 0.00 O ATOM 381 CB THR A 24 9.229 7.291 -16.415 1.00 0.00 C ATOM 382 OG1 THR A 24 10.625 7.469 -16.480 1.00 0.00 O ATOM 383 CG2 THR A 24 8.596 8.379 -17.281 1.00 0.00 C ATOM 0 H THR A 24 10.088 5.728 -14.663 1.00 0.00 H new ATOM 0 HA THR A 24 8.848 8.320 -14.545 1.00 0.00 H new ATOM 0 HB THR A 24 8.930 6.316 -16.799 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.073 6.647 -16.190 1.00 0.00 H new ATOM 0 HG21 THR A 24 8.982 8.305 -18.298 1.00 0.00 H new ATOM 0 HG22 THR A 24 7.514 8.251 -17.293 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.841 9.359 -16.871 1.00 0.00 H new ATOM 391 N LEU A 25 6.924 5.643 -15.026 1.00 0.00 N ATOM 392 CA LEU A 25 5.536 5.155 -15.186 1.00 0.00 C ATOM 393 C LEU A 25 4.896 4.703 -13.864 1.00 0.00 C ATOM 394 O LEU A 25 3.685 4.801 -13.688 1.00 0.00 O ATOM 395 CB LEU A 25 5.524 4.035 -16.248 1.00 0.00 C ATOM 396 CG LEU A 25 6.143 4.447 -17.598 1.00 0.00 C ATOM 397 CD1 LEU A 25 6.150 3.258 -18.551 1.00 0.00 C ATOM 398 CD2 LEU A 25 5.396 5.597 -18.276 1.00 0.00 C ATOM 0 H LEU A 25 7.616 4.894 -15.023 1.00 0.00 H new ATOM 0 HA LEU A 25 4.917 5.986 -15.524 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.066 3.173 -15.859 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.495 3.716 -16.414 1.00 0.00 H new ATOM 0 HG LEU A 25 7.155 4.785 -17.378 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.589 3.557 -19.503 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.738 2.449 -18.119 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.128 2.917 -18.714 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.882 5.839 -19.221 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.364 5.300 -18.464 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.409 6.472 -17.627 1.00 0.00 H new ATOM 410 N GLY A 26 5.729 4.258 -12.921 1.00 0.00 N ATOM 411 CA GLY A 26 5.407 3.971 -11.519 1.00 0.00 C ATOM 412 C GLY A 26 5.476 5.198 -10.612 1.00 0.00 C ATOM 413 O GLY A 26 5.254 5.056 -9.410 1.00 0.00 O ATOM 0 H GLY A 26 6.711 4.076 -13.129 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.405 3.545 -11.465 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.096 3.214 -11.145 1.00 0.00 H new ATOM 417 N ALA A 27 5.769 6.385 -11.165 1.00 0.00 N ATOM 418 CA ALA A 27 5.831 7.650 -10.419 1.00 0.00 C ATOM 419 C ALA A 27 4.594 7.863 -9.515 1.00 0.00 C ATOM 420 O ALA A 27 3.471 8.002 -10.002 1.00 0.00 O ATOM 421 CB ALA A 27 5.980 8.808 -11.422 1.00 0.00 C ATOM 0 H ALA A 27 5.973 6.494 -12.159 1.00 0.00 H new ATOM 0 HA ALA A 27 6.694 7.616 -9.754 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.027 9.753 -10.882 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.895 8.674 -11.999 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.124 8.818 -12.096 1.00 0.00 H new ATOM 427 N GLY A 28 4.807 7.879 -8.192 1.00 0.00 N ATOM 428 CA GLY A 28 3.748 8.053 -7.190 1.00 0.00 C ATOM 429 C GLY A 28 2.797 6.854 -7.010 1.00 0.00 C ATOM 430 O GLY A 28 1.719 7.030 -6.436 1.00 0.00 O ATOM 0 H GLY A 28 5.735 7.770 -7.782 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.214 8.271 -6.229 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.155 8.926 -7.462 1.00 0.00 H new ATOM 434 N LYS A 29 3.162 5.649 -7.486 1.00 0.00 N ATOM 435 CA LYS A 29 2.323 4.430 -7.440 1.00 0.00 C ATOM 436 C LYS A 29 2.981 3.316 -6.632 1.00 0.00 C ATOM 437 O LYS A 29 2.303 2.572 -5.931 1.00 0.00 O ATOM 438 CB LYS A 29 2.066 3.919 -8.865 1.00 0.00 C ATOM 439 CG LYS A 29 1.320 4.926 -9.754 1.00 0.00 C ATOM 440 CD LYS A 29 1.206 4.431 -11.203 1.00 0.00 C ATOM 441 CE LYS A 29 0.653 5.551 -12.104 1.00 0.00 C ATOM 442 NZ LYS A 29 0.797 5.217 -13.550 1.00 0.00 N ATOM 0 H LYS A 29 4.069 5.489 -7.924 1.00 0.00 H new ATOM 0 HA LYS A 29 1.385 4.701 -6.955 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.020 3.672 -9.331 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.489 2.996 -8.812 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.323 5.099 -9.349 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.842 5.883 -9.737 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.184 4.113 -11.564 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.551 3.561 -11.248 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.399 5.719 -11.872 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.179 6.482 -11.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.445 6.008 -14.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.800 5.048 -13.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 0.247 4.361 -13.765 1.00 0.00 H new ATOM 456 N ILE A 30 4.308 3.237 -6.747 1.00 0.00 N ATOM 457 CA ILE A 30 5.218 2.372 -5.996 1.00 0.00 C ATOM 458 C ILE A 30 6.600 3.036 -5.861 1.00 0.00 C ATOM 459 O ILE A 30 6.911 4.007 -6.550 1.00 0.00 O ATOM 460 CB ILE A 30 5.344 0.972 -6.657 1.00 0.00 C ATOM 461 CG1 ILE A 30 5.409 0.895 -8.201 1.00 0.00 C ATOM 462 CG2 ILE A 30 4.222 0.037 -6.175 1.00 0.00 C ATOM 463 CD1 ILE A 30 6.676 1.502 -8.818 1.00 0.00 C ATOM 0 H ILE A 30 4.811 3.819 -7.417 1.00 0.00 H new ATOM 0 HA ILE A 30 4.800 2.230 -4.999 1.00 0.00 H new ATOM 0 HB ILE A 30 6.333 0.658 -6.324 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.338 -0.150 -8.503 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.539 1.406 -8.614 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.331 -0.937 -6.651 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.285 -0.079 -5.093 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.254 0.464 -6.439 1.00 0.00 H new ATOM 0 HD11 ILE A 30 6.636 1.404 -9.903 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.741 2.557 -8.551 1.00 0.00 H new ATOM 0 HD13 ILE A 30 7.553 0.977 -8.439 1.00 0.00 H new ATOM 475 N ALA A 31 7.430 2.494 -4.970 1.00 0.00 N ATOM 476 CA ALA A 31 8.856 2.827 -4.860 1.00 0.00 C ATOM 477 C ALA A 31 9.648 1.808 -5.699 1.00 0.00 C ATOM 478 O ALA A 31 9.169 0.693 -5.902 1.00 0.00 O ATOM 479 CB ALA A 31 9.256 2.858 -3.378 1.00 0.00 C ATOM 0 H ALA A 31 7.127 1.797 -4.290 1.00 0.00 H new ATOM 0 HA ALA A 31 9.080 3.818 -5.254 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.314 3.105 -3.292 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.664 3.611 -2.857 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.074 1.880 -2.931 1.00 0.00 H new ATOM 485 N VAL A 32 10.839 2.136 -6.207 1.00 0.00 N ATOM 486 CA VAL A 32 11.545 1.245 -7.152 1.00 0.00 C ATOM 487 C VAL A 32 13.074 1.359 -7.119 1.00 0.00 C ATOM 488 O VAL A 32 13.627 2.441 -6.924 1.00 0.00 O ATOM 489 CB VAL A 32 10.970 1.433 -8.565 1.00 0.00 C ATOM 490 CG1 VAL A 32 11.303 2.778 -9.216 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.378 0.304 -9.504 1.00 0.00 C ATOM 0 H VAL A 32 11.336 3.000 -5.988 1.00 0.00 H new ATOM 0 HA VAL A 32 11.359 0.223 -6.822 1.00 0.00 H new ATOM 0 HB VAL A 32 9.891 1.414 -8.412 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.857 2.822 -10.209 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.905 3.587 -8.604 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.385 2.884 -9.299 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.949 0.479 -10.491 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.465 0.270 -9.581 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.012 -0.645 -9.112 1.00 0.00 H new ATOM 501 N THR A 33 13.754 0.220 -7.313 1.00 0.00 N ATOM 502 CA THR A 33 15.212 0.053 -7.162 1.00 0.00 C ATOM 503 C THR A 33 15.734 -1.048 -8.101 1.00 0.00 C ATOM 504 O THR A 33 14.972 -1.921 -8.517 1.00 0.00 O ATOM 505 CB THR A 33 15.549 -0.320 -5.701 1.00 0.00 C ATOM 506 OG1 THR A 33 14.848 0.501 -4.784 1.00 0.00 O ATOM 507 CG2 THR A 33 17.027 -0.189 -5.334 1.00 0.00 C ATOM 0 H THR A 33 13.289 -0.644 -7.590 1.00 0.00 H new ATOM 0 HA THR A 33 15.693 0.996 -7.422 1.00 0.00 H new ATOM 0 HB THR A 33 15.256 -1.368 -5.634 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.296 0.474 -3.913 1.00 0.00 H new ATOM 0 HG21 THR A 33 17.169 -0.471 -4.291 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.620 -0.845 -5.971 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.347 0.843 -5.478 1.00 0.00 H new ATOM 515 N SER A 34 17.030 -1.033 -8.423 1.00 0.00 N ATOM 516 CA SER A 34 17.737 -2.054 -9.208 1.00 0.00 C ATOM 517 C SER A 34 18.932 -2.631 -8.446 1.00 0.00 C ATOM 518 O SER A 34 19.576 -1.937 -7.658 1.00 0.00 O ATOM 519 CB SER A 34 18.176 -1.465 -10.551 1.00 0.00 C ATOM 520 OG SER A 34 19.126 -2.283 -11.216 1.00 0.00 O ATOM 0 H SER A 34 17.646 -0.274 -8.131 1.00 0.00 H new ATOM 0 HA SER A 34 17.048 -2.879 -9.390 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.303 -1.334 -11.190 1.00 0.00 H new ATOM 0 HB3 SER A 34 18.603 -0.475 -10.388 1.00 0.00 H new ATOM 0 HG SER A 34 19.974 -2.264 -10.725 1.00 0.00 H new ATOM 526 N CYS A 35 19.240 -3.901 -8.712 1.00 0.00 N ATOM 527 CA CYS A 35 20.345 -4.636 -8.109 1.00 0.00 C ATOM 528 C CYS A 35 20.847 -5.735 -9.061 1.00 0.00 C ATOM 529 O CYS A 35 20.081 -6.310 -9.837 1.00 0.00 O ATOM 530 CB CYS A 35 19.828 -5.197 -6.771 1.00 0.00 C ATOM 531 SG CYS A 35 20.933 -6.449 -6.050 1.00 0.00 S ATOM 0 H CYS A 35 18.707 -4.462 -9.376 1.00 0.00 H new ATOM 0 HA CYS A 35 21.205 -3.992 -7.925 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.706 -4.377 -6.063 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.842 -5.636 -6.924 1.00 0.00 H new ATOM 0 HG CYS A 35 21.436 -5.996 -4.940 1.00 0.00 H new ATOM 537 N GLY A 36 22.146 -6.023 -9.013 1.00 0.00 N ATOM 538 CA GLY A 36 22.744 -7.189 -9.667 1.00 0.00 C ATOM 539 C GLY A 36 23.208 -8.178 -8.597 1.00 0.00 C ATOM 540 O GLY A 36 23.707 -7.742 -7.560 1.00 0.00 O ATOM 0 H GLY A 36 22.823 -5.447 -8.513 1.00 0.00 H new ATOM 0 HA2 GLY A 36 22.018 -7.663 -10.328 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.587 -6.882 -10.286 1.00 0.00 H new ATOM 544 N LEU A 37 23.091 -9.493 -8.827 1.00 0.00 N ATOM 545 CA LEU A 37 23.517 -10.519 -7.854 1.00 0.00 C ATOM 546 C LEU A 37 24.949 -10.270 -7.332 1.00 0.00 C ATOM 547 O LEU A 37 25.197 -10.392 -6.134 1.00 0.00 O ATOM 548 CB LEU A 37 23.420 -11.929 -8.475 1.00 0.00 C ATOM 549 CG LEU A 37 22.028 -12.400 -8.934 1.00 0.00 C ATOM 550 CD1 LEU A 37 22.129 -13.852 -9.399 1.00 0.00 C ATOM 551 CD2 LEU A 37 20.969 -12.312 -7.838 1.00 0.00 C ATOM 0 H LEU A 37 22.701 -9.878 -9.687 1.00 0.00 H new ATOM 0 HA LEU A 37 22.839 -10.451 -7.003 1.00 0.00 H new ATOM 0 HB2 LEU A 37 24.090 -11.967 -9.334 1.00 0.00 H new ATOM 0 HB3 LEU A 37 23.796 -12.646 -7.746 1.00 0.00 H new ATOM 0 HG LEU A 37 21.715 -11.736 -9.740 1.00 0.00 H new ATOM 0 HD11 LEU A 37 21.149 -14.198 -9.727 1.00 0.00 H new ATOM 0 HD12 LEU A 37 22.834 -13.921 -10.228 1.00 0.00 H new ATOM 0 HD13 LEU A 37 22.476 -14.475 -8.575 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.012 -12.659 -8.228 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.265 -12.936 -6.995 1.00 0.00 H new ATOM 0 HD23 LEU A 37 20.873 -11.278 -7.507 1.00 0.00 H new ATOM 563 N GLU A 38 25.851 -9.822 -8.214 1.00 0.00 N ATOM 564 CA GLU A 38 27.211 -9.350 -7.894 1.00 0.00 C ATOM 565 C GLU A 38 27.444 -7.908 -8.411 1.00 0.00 C ATOM 566 O GLU A 38 28.514 -7.592 -8.933 1.00 0.00 O ATOM 567 CB GLU A 38 28.248 -10.360 -8.427 1.00 0.00 C ATOM 568 CG GLU A 38 28.163 -11.760 -7.797 1.00 0.00 C ATOM 569 CD GLU A 38 28.462 -11.791 -6.282 1.00 0.00 C ATOM 570 OE1 GLU A 38 29.225 -10.935 -5.772 1.00 0.00 O ATOM 571 OE2 GLU A 38 27.975 -12.722 -5.594 1.00 0.00 O ATOM 0 H GLU A 38 25.648 -9.775 -9.213 1.00 0.00 H new ATOM 0 HA GLU A 38 27.331 -9.297 -6.812 1.00 0.00 H new ATOM 0 HB2 GLU A 38 28.123 -10.454 -9.506 1.00 0.00 H new ATOM 0 HB3 GLU A 38 29.247 -9.959 -8.256 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.165 -12.163 -7.967 1.00 0.00 H new ATOM 0 HG3 GLU A 38 28.864 -12.419 -8.308 1.00 0.00 H new ATOM 578 N SER A 39 26.441 -7.027 -8.268 1.00 0.00 N ATOM 579 CA SER A 39 26.347 -5.676 -8.869 1.00 0.00 C ATOM 580 C SER A 39 26.050 -5.673 -10.386 1.00 0.00 C ATOM 581 O SER A 39 26.108 -6.710 -11.045 1.00 0.00 O ATOM 582 CB SER A 39 27.565 -4.818 -8.495 1.00 0.00 C ATOM 583 OG SER A 39 27.287 -3.449 -8.717 1.00 0.00 O ATOM 0 H SER A 39 25.624 -7.246 -7.698 1.00 0.00 H new ATOM 0 HA SER A 39 25.466 -5.210 -8.428 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.824 -4.979 -7.448 1.00 0.00 H new ATOM 0 HB3 SER A 39 28.428 -5.122 -9.087 1.00 0.00 H new ATOM 0 HG SER A 39 28.070 -2.912 -8.473 1.00 0.00 H new ATOM 589 N SER A 40 25.648 -4.518 -10.930 1.00 0.00 N ATOM 590 CA SER A 40 25.222 -4.285 -12.331 1.00 0.00 C ATOM 591 C SER A 40 25.567 -2.863 -12.820 1.00 0.00 C ATOM 592 O SER A 40 25.912 -1.996 -12.012 1.00 0.00 O ATOM 593 CB SER A 40 23.717 -4.559 -12.483 1.00 0.00 C ATOM 594 OG SER A 40 22.942 -3.664 -11.692 1.00 0.00 O ATOM 0 H SER A 40 25.606 -3.663 -10.376 1.00 0.00 H new ATOM 0 HA SER A 40 25.778 -4.981 -12.959 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.432 -4.461 -13.530 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.501 -5.586 -12.189 1.00 0.00 H new ATOM 0 HG SER A 40 21.990 -3.863 -11.811 1.00 0.00 H new ATOM 600 N ARG A 41 25.485 -2.603 -14.139 1.00 0.00 N ATOM 601 CA ARG A 41 25.901 -1.325 -14.773 1.00 0.00 C ATOM 602 C ARG A 41 24.781 -0.625 -15.538 1.00 0.00 C ATOM 603 O ARG A 41 23.916 -1.272 -16.118 1.00 0.00 O ATOM 604 CB ARG A 41 27.180 -1.541 -15.620 1.00 0.00 C ATOM 605 CG ARG A 41 26.980 -2.414 -16.876 1.00 0.00 C ATOM 606 CD ARG A 41 28.263 -2.502 -17.714 1.00 0.00 C ATOM 607 NE ARG A 41 28.051 -3.304 -18.938 1.00 0.00 N ATOM 608 CZ ARG A 41 28.224 -4.605 -19.093 1.00 0.00 C ATOM 609 NH1 ARG A 41 28.631 -5.391 -18.136 1.00 0.00 N ATOM 610 NH2 ARG A 41 27.994 -5.176 -20.232 1.00 0.00 N ATOM 0 H ARG A 41 25.123 -3.282 -14.809 1.00 0.00 H new ATOM 0 HA ARG A 41 26.144 -0.627 -13.971 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.565 -0.569 -15.927 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.942 -2.001 -14.992 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.670 -3.416 -16.578 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.176 -1.999 -17.484 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.592 -1.499 -17.986 1.00 0.00 H new ATOM 0 HD3 ARG A 41 29.059 -2.948 -17.118 1.00 0.00 H new ATOM 0 HE ARG A 41 27.733 -2.792 -19.761 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.833 -5.008 -17.212 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.748 -6.389 -18.311 1.00 0.00 H new ATOM 0 HH21 ARG A 41 27.675 -4.621 -21.026 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.132 -6.181 -20.336 1.00 0.00 H new ATOM 624 N VAL A 42 24.815 0.710 -15.552 1.00 0.00 N ATOM 625 CA VAL A 42 23.792 1.551 -16.219 1.00 0.00 C ATOM 626 C VAL A 42 23.994 1.667 -17.733 1.00 0.00 C ATOM 627 O VAL A 42 23.019 1.600 -18.468 1.00 0.00 O ATOM 628 CB VAL A 42 23.682 2.946 -15.574 1.00 0.00 C ATOM 629 CG1 VAL A 42 23.093 2.857 -14.164 1.00 0.00 C ATOM 630 CG2 VAL A 42 24.984 3.757 -15.516 1.00 0.00 C ATOM 0 H VAL A 42 25.553 1.250 -15.101 1.00 0.00 H new ATOM 0 HA VAL A 42 22.847 1.030 -16.068 1.00 0.00 H new ATOM 0 HB VAL A 42 23.017 3.487 -16.246 1.00 0.00 H new ATOM 0 HG11 VAL A 42 23.027 3.856 -13.733 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.097 2.417 -14.213 1.00 0.00 H new ATOM 0 HG13 VAL A 42 23.735 2.235 -13.540 1.00 0.00 H new ATOM 0 HG21 VAL A 42 24.792 4.720 -15.044 1.00 0.00 H new ATOM 0 HG22 VAL A 42 25.728 3.210 -14.936 1.00 0.00 H new ATOM 0 HG23 VAL A 42 25.358 3.917 -16.527 1.00 0.00 H new ATOM 640 N HIS A 43 25.255 1.768 -18.170 1.00 0.00 N ATOM 641 CA HIS A 43 25.750 1.868 -19.563 1.00 0.00 C ATOM 642 C HIS A 43 25.310 3.122 -20.366 1.00 0.00 C ATOM 643 O HIS A 43 24.112 3.320 -20.569 1.00 0.00 O ATOM 644 CB HIS A 43 25.449 0.567 -20.321 1.00 0.00 C ATOM 645 CG HIS A 43 26.090 0.558 -21.681 1.00 0.00 C ATOM 646 ND1 HIS A 43 27.467 0.522 -21.904 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.443 0.746 -22.867 1.00 0.00 C ATOM 648 CE1 HIS A 43 27.624 0.673 -23.229 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.431 0.822 -23.827 1.00 0.00 N ATOM 0 H HIS A 43 26.029 1.784 -17.506 1.00 0.00 H new ATOM 0 HA HIS A 43 26.827 2.010 -19.469 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.810 -0.284 -19.743 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.371 0.447 -20.426 1.00 0.00 H new ATOM 0 HD1 HIS A 43 28.201 0.405 -21.206 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.377 0.820 -23.023 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.575 0.674 -23.741 1.00 0.00 H new ATOM 657 N PRO A 44 26.236 3.941 -20.923 1.00 0.00 N ATOM 658 CA PRO A 44 25.908 5.186 -21.640 1.00 0.00 C ATOM 659 C PRO A 44 24.879 5.068 -22.773 1.00 0.00 C ATOM 660 O PRO A 44 23.992 5.913 -22.876 1.00 0.00 O ATOM 661 CB PRO A 44 27.247 5.728 -22.154 1.00 0.00 C ATOM 662 CG PRO A 44 28.223 5.261 -21.082 1.00 0.00 C ATOM 663 CD PRO A 44 27.684 3.879 -20.726 1.00 0.00 C ATOM 0 HA PRO A 44 25.404 5.858 -20.946 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.498 5.325 -23.135 1.00 0.00 H new ATOM 0 HB3 PRO A 44 27.236 6.814 -22.248 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.246 5.214 -21.457 1.00 0.00 H new ATOM 0 HG3 PRO A 44 28.230 5.929 -20.220 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.130 3.112 -21.359 1.00 0.00 H new ATOM 0 HD3 PRO A 44 27.926 3.621 -19.695 1.00 0.00 H new ATOM 671 N THR A 45 24.899 3.998 -23.577 1.00 0.00 N ATOM 672 CA THR A 45 23.897 3.807 -24.654 1.00 0.00 C ATOM 673 C THR A 45 22.483 3.635 -24.092 1.00 0.00 C ATOM 674 O THR A 45 21.537 4.145 -24.677 1.00 0.00 O ATOM 675 CB THR A 45 24.267 2.626 -25.571 1.00 0.00 C ATOM 676 OG1 THR A 45 25.639 2.665 -25.909 1.00 0.00 O ATOM 677 CG2 THR A 45 23.482 2.564 -26.876 1.00 0.00 C ATOM 0 H THR A 45 25.590 3.251 -23.510 1.00 0.00 H new ATOM 0 HA THR A 45 23.906 4.715 -25.257 1.00 0.00 H new ATOM 0 HB THR A 45 24.015 1.742 -24.985 1.00 0.00 H new ATOM 0 HG1 THR A 45 26.142 2.083 -25.302 1.00 0.00 H new ATOM 0 HG21 THR A 45 23.809 1.702 -27.457 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.418 2.471 -26.657 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.656 3.475 -27.449 1.00 0.00 H new ATOM 685 N ALA A 46 22.312 3.044 -22.904 1.00 0.00 N ATOM 686 CA ALA A 46 21.012 2.985 -22.226 1.00 0.00 C ATOM 687 C ALA A 46 20.624 4.299 -21.520 1.00 0.00 C ATOM 688 O ALA A 46 19.499 4.427 -21.051 1.00 0.00 O ATOM 689 CB ALA A 46 20.973 1.764 -21.303 1.00 0.00 C ATOM 0 H ALA A 46 23.068 2.595 -22.387 1.00 0.00 H new ATOM 0 HA ALA A 46 20.240 2.864 -22.986 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.008 1.720 -20.799 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.117 0.858 -21.892 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.767 1.844 -20.560 1.00 0.00 H new ATOM 695 N ILE A 47 21.525 5.283 -21.434 1.00 0.00 N ATOM 696 CA ILE A 47 21.165 6.643 -21.014 1.00 0.00 C ATOM 697 C ILE A 47 20.598 7.336 -22.269 1.00 0.00 C ATOM 698 O ILE A 47 19.446 7.768 -22.287 1.00 0.00 O ATOM 699 CB ILE A 47 22.361 7.409 -20.395 1.00 0.00 C ATOM 700 CG1 ILE A 47 23.021 6.603 -19.254 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.870 8.775 -19.879 1.00 0.00 C ATOM 702 CD1 ILE A 47 24.277 7.250 -18.653 1.00 0.00 C ATOM 0 H ILE A 47 22.514 5.163 -21.651 1.00 0.00 H new ATOM 0 HA ILE A 47 20.424 6.623 -20.215 1.00 0.00 H new ATOM 0 HB ILE A 47 23.119 7.557 -21.165 1.00 0.00 H new ATOM 0 HG12 ILE A 47 22.289 6.458 -18.460 1.00 0.00 H new ATOM 0 HG13 ILE A 47 23.283 5.614 -19.631 1.00 0.00 H new ATOM 0 HG21 ILE A 47 22.706 9.321 -19.442 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.456 9.349 -20.708 1.00 0.00 H new ATOM 0 HG23 ILE A 47 21.100 8.623 -19.122 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.670 6.613 -17.860 1.00 0.00 H new ATOM 0 HD12 ILE A 47 25.032 7.370 -19.430 1.00 0.00 H new ATOM 0 HD13 ILE A 47 24.022 8.226 -18.241 1.00 0.00 H new ATOM 714 N ALA A 48 21.358 7.329 -23.374 1.00 0.00 N ATOM 715 CA ALA A 48 21.048 8.111 -24.575 1.00 0.00 C ATOM 716 C ALA A 48 19.903 7.553 -25.446 1.00 0.00 C ATOM 717 O ALA A 48 19.127 8.329 -26.006 1.00 0.00 O ATOM 718 CB ALA A 48 22.344 8.263 -25.384 1.00 0.00 C ATOM 0 H ALA A 48 22.211 6.776 -23.458 1.00 0.00 H new ATOM 0 HA ALA A 48 20.667 9.077 -24.244 1.00 0.00 H new ATOM 0 HB1 ALA A 48 22.144 8.842 -26.286 1.00 0.00 H new ATOM 0 HB2 ALA A 48 23.091 8.778 -24.780 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.718 7.277 -25.661 1.00 0.00 H new ATOM 724 N MET A 49 19.737 6.225 -25.524 1.00 0.00 N ATOM 725 CA MET A 49 18.618 5.587 -26.249 1.00 0.00 C ATOM 726 C MET A 49 17.266 5.748 -25.540 1.00 0.00 C ATOM 727 O MET A 49 16.226 5.455 -26.127 1.00 0.00 O ATOM 728 CB MET A 49 18.913 4.091 -26.476 1.00 0.00 C ATOM 729 CG MET A 49 20.093 3.809 -27.413 1.00 0.00 C ATOM 730 SD MET A 49 19.827 4.264 -29.149 1.00 0.00 S ATOM 731 CE MET A 49 20.688 5.859 -29.188 1.00 0.00 C ATOM 0 H MET A 49 20.373 5.558 -25.087 1.00 0.00 H new ATOM 0 HA MET A 49 18.538 6.103 -27.206 1.00 0.00 H new ATOM 0 HB2 MET A 49 19.111 3.623 -25.512 1.00 0.00 H new ATOM 0 HB3 MET A 49 18.021 3.616 -26.883 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.966 4.346 -27.043 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.329 2.746 -27.365 1.00 0.00 H new ATOM 0 HE1 MET A 49 20.219 6.508 -29.927 1.00 0.00 H new ATOM 0 HE2 MET A 49 20.631 6.327 -28.205 1.00 0.00 H new ATOM 0 HE3 MET A 49 21.733 5.702 -29.455 1.00 0.00 H new ATOM 741 N MET A 50 17.279 6.188 -24.276 1.00 0.00 N ATOM 742 CA MET A 50 16.112 6.195 -23.383 1.00 0.00 C ATOM 743 C MET A 50 15.756 7.608 -22.892 1.00 0.00 C ATOM 744 O MET A 50 14.579 7.900 -22.689 1.00 0.00 O ATOM 745 CB MET A 50 16.361 5.218 -22.218 1.00 0.00 C ATOM 746 CG MET A 50 17.074 3.916 -22.624 1.00 0.00 C ATOM 747 SD MET A 50 16.281 2.898 -23.885 1.00 0.00 S ATOM 748 CE MET A 50 17.447 1.503 -23.924 1.00 0.00 C ATOM 0 H MET A 50 18.121 6.558 -23.834 1.00 0.00 H new ATOM 0 HA MET A 50 15.241 5.858 -23.945 1.00 0.00 H new ATOM 0 HB2 MET A 50 16.957 5.723 -21.457 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.405 4.967 -21.759 1.00 0.00 H new ATOM 0 HG2 MET A 50 18.072 4.174 -22.977 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.200 3.307 -21.729 1.00 0.00 H new ATOM 0 HE1 MET A 50 17.869 1.409 -24.925 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.249 1.679 -23.207 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.923 0.583 -23.664 1.00 0.00 H new ATOM 758 N GLU A 51 16.719 8.536 -22.806 1.00 0.00 N ATOM 759 CA GLU A 51 16.426 9.952 -22.533 1.00 0.00 C ATOM 760 C GLU A 51 15.571 10.605 -23.638 1.00 0.00 C ATOM 761 O GLU A 51 14.798 11.520 -23.361 1.00 0.00 O ATOM 762 CB GLU A 51 17.708 10.754 -22.238 1.00 0.00 C ATOM 763 CG GLU A 51 18.565 11.069 -23.467 1.00 0.00 C ATOM 764 CD GLU A 51 19.803 11.904 -23.076 1.00 0.00 C ATOM 765 OE1 GLU A 51 19.689 13.151 -22.977 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.899 11.329 -22.875 1.00 0.00 O ATOM 0 H GLU A 51 17.712 8.331 -22.922 1.00 0.00 H new ATOM 0 HA GLU A 51 15.819 9.975 -21.628 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.431 11.691 -21.756 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.313 10.195 -21.524 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.883 10.141 -23.941 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.970 11.614 -24.200 1.00 0.00 H new ATOM 773 N GLU A 52 15.622 10.079 -24.872 1.00 0.00 N ATOM 774 CA GLU A 52 14.733 10.503 -25.971 1.00 0.00 C ATOM 775 C GLU A 52 13.262 10.057 -25.782 1.00 0.00 C ATOM 776 O GLU A 52 12.360 10.598 -26.424 1.00 0.00 O ATOM 777 CB GLU A 52 15.297 10.043 -27.329 1.00 0.00 C ATOM 778 CG GLU A 52 15.502 8.526 -27.426 1.00 0.00 C ATOM 779 CD GLU A 52 15.754 8.089 -28.872 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.895 8.185 -29.379 1.00 0.00 O ATOM 781 OE2 GLU A 52 14.824 7.538 -29.504 1.00 0.00 O ATOM 0 H GLU A 52 16.280 9.347 -25.138 1.00 0.00 H new ATOM 0 HA GLU A 52 14.710 11.593 -25.953 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.619 10.361 -28.121 1.00 0.00 H new ATOM 0 HB3 GLU A 52 16.250 10.542 -27.505 1.00 0.00 H new ATOM 0 HG2 GLU A 52 16.346 8.230 -26.802 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.623 8.013 -27.037 1.00 0.00 H new ATOM 788 N VAL A 53 13.011 9.111 -24.863 1.00 0.00 N ATOM 789 CA VAL A 53 11.677 8.689 -24.375 1.00 0.00 C ATOM 790 C VAL A 53 11.349 9.370 -23.022 1.00 0.00 C ATOM 791 O VAL A 53 10.319 9.105 -22.406 1.00 0.00 O ATOM 792 CB VAL A 53 11.586 7.136 -24.356 1.00 0.00 C ATOM 793 CG1 VAL A 53 10.185 6.589 -24.048 1.00 0.00 C ATOM 794 CG2 VAL A 53 11.983 6.536 -25.716 1.00 0.00 C ATOM 0 H VAL A 53 13.766 8.591 -24.415 1.00 0.00 H new ATOM 0 HA VAL A 53 10.900 9.027 -25.061 1.00 0.00 H new ATOM 0 HB VAL A 53 12.270 6.847 -23.558 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.210 5.499 -24.054 1.00 0.00 H new ATOM 0 HG12 VAL A 53 9.866 6.939 -23.066 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.483 6.940 -24.804 1.00 0.00 H new ATOM 0 HG21 VAL A 53 11.909 5.449 -25.670 1.00 0.00 H new ATOM 0 HG22 VAL A 53 11.314 6.913 -26.489 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.008 6.820 -25.954 1.00 0.00 H new ATOM 804 N GLY A 54 12.211 10.284 -22.556 1.00 0.00 N ATOM 805 CA GLY A 54 12.082 11.003 -21.282 1.00 0.00 C ATOM 806 C GLY A 54 12.535 10.205 -20.047 1.00 0.00 C ATOM 807 O GLY A 54 12.239 10.613 -18.923 1.00 0.00 O ATOM 0 H GLY A 54 13.047 10.552 -23.075 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.665 11.922 -21.338 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.040 11.294 -21.148 1.00 0.00 H new ATOM 811 N ILE A 55 13.223 9.072 -20.239 1.00 0.00 N ATOM 812 CA ILE A 55 13.615 8.149 -19.160 1.00 0.00 C ATOM 813 C ILE A 55 14.960 8.556 -18.538 1.00 0.00 C ATOM 814 O ILE A 55 15.843 9.087 -19.211 1.00 0.00 O ATOM 815 CB ILE A 55 13.626 6.681 -19.652 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.408 6.313 -20.527 1.00 0.00 C ATOM 817 CG2 ILE A 55 13.702 5.702 -18.470 1.00 0.00 C ATOM 818 CD1 ILE A 55 11.032 6.496 -19.867 1.00 0.00 C ATOM 0 H ILE A 55 13.529 8.764 -21.162 1.00 0.00 H new ATOM 0 HA ILE A 55 12.864 8.218 -18.373 1.00 0.00 H new ATOM 0 HB ILE A 55 14.517 6.594 -20.273 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.439 6.918 -21.433 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.507 5.272 -20.835 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.708 4.679 -18.845 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.615 5.886 -17.903 1.00 0.00 H new ATOM 0 HG23 ILE A 55 12.837 5.846 -17.822 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.250 6.208 -20.570 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.969 5.869 -18.978 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.900 7.540 -19.585 1.00 0.00 H new ATOM 830 N ASP A 56 15.126 8.267 -17.246 1.00 0.00 N ATOM 831 CA ASP A 56 16.326 8.567 -16.453 1.00 0.00 C ATOM 832 C ASP A 56 16.901 7.307 -15.787 1.00 0.00 C ATOM 833 O ASP A 56 16.194 6.625 -15.044 1.00 0.00 O ATOM 834 CB ASP A 56 15.976 9.633 -15.401 1.00 0.00 C ATOM 835 CG ASP A 56 17.081 9.768 -14.337 1.00 0.00 C ATOM 836 OD1 ASP A 56 18.225 10.115 -14.711 1.00 0.00 O ATOM 837 OD2 ASP A 56 16.818 9.487 -13.143 1.00 0.00 O ATOM 0 H ASP A 56 14.402 7.800 -16.700 1.00 0.00 H new ATOM 0 HA ASP A 56 17.099 8.949 -17.120 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.825 10.594 -15.893 1.00 0.00 H new ATOM 0 HB3 ASP A 56 15.035 9.371 -14.917 1.00 0.00 H new ATOM 842 N ILE A 57 18.193 7.025 -16.019 1.00 0.00 N ATOM 843 CA ILE A 57 18.961 5.988 -15.291 1.00 0.00 C ATOM 844 C ILE A 57 20.360 6.437 -14.827 1.00 0.00 C ATOM 845 O ILE A 57 21.020 5.688 -14.112 1.00 0.00 O ATOM 846 CB ILE A 57 19.062 4.660 -16.085 1.00 0.00 C ATOM 847 CG1 ILE A 57 19.915 4.778 -17.364 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.674 4.087 -16.394 1.00 0.00 C ATOM 849 CD1 ILE A 57 20.229 3.420 -18.007 1.00 0.00 C ATOM 0 H ILE A 57 18.745 7.513 -16.724 1.00 0.00 H new ATOM 0 HA ILE A 57 18.376 5.815 -14.388 1.00 0.00 H new ATOM 0 HB ILE A 57 19.585 3.959 -15.434 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.390 5.403 -18.087 1.00 0.00 H new ATOM 0 HG13 ILE A 57 20.850 5.284 -17.124 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.780 3.156 -16.951 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.145 3.893 -15.461 1.00 0.00 H new ATOM 0 HG23 ILE A 57 17.109 4.804 -16.990 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.832 3.572 -18.902 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.780 2.801 -17.299 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.298 2.921 -18.277 1.00 0.00 H new ATOM 861 N SER A 58 20.846 7.624 -15.210 1.00 0.00 N ATOM 862 CA SER A 58 22.253 8.026 -14.993 1.00 0.00 C ATOM 863 C SER A 58 22.622 8.223 -13.514 1.00 0.00 C ATOM 864 O SER A 58 23.767 7.989 -13.128 1.00 0.00 O ATOM 865 CB SER A 58 22.566 9.301 -15.786 1.00 0.00 C ATOM 866 OG SER A 58 21.751 10.376 -15.347 1.00 0.00 O ATOM 0 H SER A 58 20.283 8.334 -15.678 1.00 0.00 H new ATOM 0 HA SER A 58 22.864 7.198 -15.353 1.00 0.00 H new ATOM 0 HB2 SER A 58 23.617 9.562 -15.665 1.00 0.00 H new ATOM 0 HB3 SER A 58 22.402 9.124 -16.849 1.00 0.00 H new ATOM 0 HG SER A 58 21.966 11.181 -15.863 1.00 0.00 H new ATOM 872 N GLY A 59 21.648 8.591 -12.673 1.00 0.00 N ATOM 873 CA GLY A 59 21.801 8.723 -11.217 1.00 0.00 C ATOM 874 C GLY A 59 21.697 7.406 -10.430 1.00 0.00 C ATOM 875 O GLY A 59 21.828 7.423 -9.204 1.00 0.00 O ATOM 0 H GLY A 59 20.705 8.811 -12.994 1.00 0.00 H new ATOM 0 HA2 GLY A 59 22.769 9.178 -11.008 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.040 9.410 -10.848 1.00 0.00 H new ATOM 879 N GLN A 60 21.439 6.271 -11.094 1.00 0.00 N ATOM 880 CA GLN A 60 21.269 4.958 -10.446 1.00 0.00 C ATOM 881 C GLN A 60 22.617 4.279 -10.127 1.00 0.00 C ATOM 882 O GLN A 60 23.658 4.620 -10.691 1.00 0.00 O ATOM 883 CB GLN A 60 20.379 4.044 -11.309 1.00 0.00 C ATOM 884 CG GLN A 60 18.968 4.613 -11.527 1.00 0.00 C ATOM 885 CD GLN A 60 18.066 3.750 -12.418 1.00 0.00 C ATOM 886 OE1 GLN A 60 16.954 4.132 -12.747 1.00 0.00 O ATOM 887 NE2 GLN A 60 18.484 2.597 -12.884 1.00 0.00 N ATOM 0 H GLN A 60 21.341 6.236 -12.109 1.00 0.00 H new ATOM 0 HA GLN A 60 20.774 5.130 -9.490 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.856 3.890 -12.277 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.301 3.067 -10.833 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.487 4.739 -10.557 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.054 5.605 -11.971 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.408 2.249 -12.629 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.885 2.049 -13.502 1.00 0.00 H new ATOM 896 N THR A 61 22.583 3.295 -9.222 1.00 0.00 N ATOM 897 CA THR A 61 23.753 2.519 -8.771 1.00 0.00 C ATOM 898 C THR A 61 23.404 1.031 -8.592 1.00 0.00 C ATOM 899 O THR A 61 22.270 0.619 -8.854 1.00 0.00 O ATOM 900 CB THR A 61 24.344 3.160 -7.499 1.00 0.00 C ATOM 901 OG1 THR A 61 25.621 2.616 -7.233 1.00 0.00 O ATOM 902 CG2 THR A 61 23.481 2.979 -6.249 1.00 0.00 C ATOM 0 H THR A 61 21.717 3.005 -8.767 1.00 0.00 H new ATOM 0 HA THR A 61 24.524 2.549 -9.540 1.00 0.00 H new ATOM 0 HB THR A 61 24.395 4.228 -7.709 1.00 0.00 H new ATOM 0 HG1 THR A 61 25.991 3.029 -6.425 1.00 0.00 H new ATOM 0 HG21 THR A 61 23.967 3.458 -5.399 1.00 0.00 H new ATOM 0 HG22 THR A 61 22.504 3.434 -6.412 1.00 0.00 H new ATOM 0 HG23 THR A 61 23.357 1.916 -6.044 1.00 0.00 H new ATOM 910 N SER A 62 24.369 0.205 -8.184 1.00 0.00 N ATOM 911 CA SER A 62 24.183 -1.216 -7.861 1.00 0.00 C ATOM 912 C SER A 62 25.239 -1.718 -6.871 1.00 0.00 C ATOM 913 O SER A 62 26.288 -1.093 -6.683 1.00 0.00 O ATOM 914 CB SER A 62 24.244 -2.055 -9.131 1.00 0.00 C ATOM 915 OG SER A 62 23.630 -3.320 -8.920 1.00 0.00 O ATOM 0 H SER A 62 25.334 0.514 -8.065 1.00 0.00 H new ATOM 0 HA SER A 62 23.203 -1.318 -7.395 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.742 -1.531 -9.945 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.282 -2.193 -9.433 1.00 0.00 H new ATOM 0 HG SER A 62 23.292 -3.666 -9.772 1.00 0.00 H new ATOM 921 N ASP A 63 24.940 -2.841 -6.219 1.00 0.00 N ATOM 922 CA ASP A 63 25.813 -3.540 -5.269 1.00 0.00 C ATOM 923 C ASP A 63 25.339 -5.011 -5.144 1.00 0.00 C ATOM 924 O ASP A 63 24.164 -5.275 -5.434 1.00 0.00 O ATOM 925 CB ASP A 63 25.773 -2.801 -3.915 1.00 0.00 C ATOM 926 CG ASP A 63 27.053 -2.993 -3.080 1.00 0.00 C ATOM 927 OD1 ASP A 63 28.153 -2.648 -3.574 1.00 0.00 O ATOM 928 OD2 ASP A 63 26.966 -3.451 -1.916 1.00 0.00 O ATOM 0 H ASP A 63 24.043 -3.311 -6.342 1.00 0.00 H new ATOM 0 HA ASP A 63 26.846 -3.547 -5.616 1.00 0.00 H new ATOM 0 HB2 ASP A 63 25.620 -1.737 -4.094 1.00 0.00 H new ATOM 0 HB3 ASP A 63 24.916 -3.154 -3.341 1.00 0.00 H new ATOM 933 N PRO A 64 26.187 -5.986 -4.747 1.00 0.00 N ATOM 934 CA PRO A 64 25.797 -7.394 -4.627 1.00 0.00 C ATOM 935 C PRO A 64 24.557 -7.601 -3.747 1.00 0.00 C ATOM 936 O PRO A 64 24.460 -7.031 -2.659 1.00 0.00 O ATOM 937 CB PRO A 64 27.014 -8.124 -4.054 1.00 0.00 C ATOM 938 CG PRO A 64 28.184 -7.263 -4.520 1.00 0.00 C ATOM 939 CD PRO A 64 27.607 -5.852 -4.460 1.00 0.00 C ATOM 0 HA PRO A 64 25.512 -7.787 -5.603 1.00 0.00 H new ATOM 0 HB2 PRO A 64 26.970 -8.190 -2.967 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.088 -9.144 -4.432 1.00 0.00 H new ATOM 0 HG2 PRO A 64 29.052 -7.373 -3.870 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.505 -7.527 -5.528 1.00 0.00 H new ATOM 0 HD2 PRO A 64 27.766 -5.407 -3.478 1.00 0.00 H new ATOM 0 HD3 PRO A 64 28.092 -5.201 -5.187 1.00 0.00 H new ATOM 947 N ILE A 65 23.627 -8.451 -4.186 1.00 0.00 N ATOM 948 CA ILE A 65 22.295 -8.583 -3.568 1.00 0.00 C ATOM 949 C ILE A 65 22.309 -8.908 -2.064 1.00 0.00 C ATOM 950 O ILE A 65 21.469 -8.404 -1.322 1.00 0.00 O ATOM 951 CB ILE A 65 21.443 -9.587 -4.379 1.00 0.00 C ATOM 952 CG1 ILE A 65 19.955 -9.451 -3.997 1.00 0.00 C ATOM 953 CG2 ILE A 65 21.942 -11.038 -4.223 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.020 -10.262 -4.898 1.00 0.00 C ATOM 0 H ILE A 65 23.771 -9.072 -4.982 1.00 0.00 H new ATOM 0 HA ILE A 65 21.832 -7.597 -3.611 1.00 0.00 H new ATOM 0 HB ILE A 65 21.552 -9.341 -5.435 1.00 0.00 H new ATOM 0 HG12 ILE A 65 19.822 -9.773 -2.964 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.670 -8.400 -4.043 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.312 -11.705 -4.811 1.00 0.00 H new ATOM 0 HG22 ILE A 65 22.971 -11.108 -4.574 1.00 0.00 H new ATOM 0 HG23 ILE A 65 21.896 -11.328 -3.173 1.00 0.00 H new ATOM 0 HD11 ILE A 65 17.989 -10.121 -4.573 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.125 -9.925 -5.929 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.279 -11.319 -4.834 1.00 0.00 H new ATOM 966 N GLU A 66 23.296 -9.670 -1.579 1.00 0.00 N ATOM 967 CA GLU A 66 23.402 -10.050 -0.160 1.00 0.00 C ATOM 968 C GLU A 66 23.735 -8.871 0.783 1.00 0.00 C ATOM 969 O GLU A 66 23.596 -9.003 2.001 1.00 0.00 O ATOM 970 CB GLU A 66 24.422 -11.191 0.014 1.00 0.00 C ATOM 971 CG GLU A 66 23.995 -12.481 -0.700 1.00 0.00 C ATOM 972 CD GLU A 66 24.959 -13.633 -0.361 1.00 0.00 C ATOM 973 OE1 GLU A 66 26.001 -13.784 -1.045 1.00 0.00 O ATOM 974 OE2 GLU A 66 24.683 -14.401 0.593 1.00 0.00 O ATOM 0 H GLU A 66 24.048 -10.043 -2.159 1.00 0.00 H new ATOM 0 HA GLU A 66 22.411 -10.394 0.136 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.389 -10.870 -0.372 1.00 0.00 H new ATOM 0 HB3 GLU A 66 24.555 -11.395 1.076 1.00 0.00 H new ATOM 0 HG2 GLU A 66 22.981 -12.749 -0.403 1.00 0.00 H new ATOM 0 HG3 GLU A 66 23.979 -12.318 -1.778 1.00 0.00 H new ATOM 981 N ASN A 67 24.122 -7.700 0.249 1.00 0.00 N ATOM 982 CA ASN A 67 24.271 -6.472 1.039 1.00 0.00 C ATOM 983 C ASN A 67 22.904 -5.852 1.430 1.00 0.00 C ATOM 984 O ASN A 67 22.825 -5.121 2.422 1.00 0.00 O ATOM 985 CB ASN A 67 25.190 -5.471 0.302 1.00 0.00 C ATOM 986 CG ASN A 67 24.405 -4.342 -0.363 1.00 0.00 C ATOM 987 OD1 ASN A 67 24.263 -3.249 0.170 1.00 0.00 O ATOM 988 ND2 ASN A 67 23.789 -4.603 -1.487 1.00 0.00 N ATOM 0 H ASN A 67 24.339 -7.581 -0.740 1.00 0.00 H new ATOM 0 HA ASN A 67 24.751 -6.732 1.982 1.00 0.00 H new ATOM 0 HB2 ASN A 67 25.902 -5.047 1.010 1.00 0.00 H new ATOM 0 HB3 ASN A 67 25.769 -6.002 -0.454 1.00 0.00 H new ATOM 0 HD21 ASN A 67 23.192 -3.897 -1.917 1.00 0.00 H new ATOM 0 HD22 ASN A 67 23.906 -5.513 -1.933 1.00 0.00 H new ATOM 995 N PHE A 68 21.840 -6.130 0.665 1.00 0.00 N ATOM 996 CA PHE A 68 20.503 -5.558 0.848 1.00 0.00 C ATOM 997 C PHE A 68 19.596 -6.450 1.724 1.00 0.00 C ATOM 998 O PHE A 68 19.874 -7.629 1.958 1.00 0.00 O ATOM 999 CB PHE A 68 19.867 -5.273 -0.530 1.00 0.00 C ATOM 1000 CG PHE A 68 20.616 -4.311 -1.439 1.00 0.00 C ATOM 1001 CD1 PHE A 68 20.997 -3.031 -0.984 1.00 0.00 C ATOM 1002 CD2 PHE A 68 20.917 -4.693 -2.760 1.00 0.00 C ATOM 1003 CE1 PHE A 68 21.699 -2.158 -1.834 1.00 0.00 C ATOM 1004 CE2 PHE A 68 21.615 -3.816 -3.610 1.00 0.00 C ATOM 1005 CZ PHE A 68 22.007 -2.551 -3.148 1.00 0.00 C ATOM 0 H PHE A 68 21.889 -6.778 -0.121 1.00 0.00 H new ATOM 0 HA PHE A 68 20.607 -4.617 1.389 1.00 0.00 H new ATOM 0 HB2 PHE A 68 19.754 -6.221 -1.056 1.00 0.00 H new ATOM 0 HB3 PHE A 68 18.864 -4.878 -0.367 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.749 -2.721 0.020 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.611 -5.663 -3.122 1.00 0.00 H new ATOM 0 HE1 PHE A 68 22.002 -1.185 -1.477 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.850 -4.117 -4.620 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.545 -1.880 -3.801 1.00 0.00 H new ATOM 1015 N ASN A 69 18.478 -5.877 2.186 1.00 0.00 N ATOM 1016 CA ASN A 69 17.450 -6.543 3.000 1.00 0.00 C ATOM 1017 C ASN A 69 16.137 -6.701 2.214 1.00 0.00 C ATOM 1018 O ASN A 69 15.435 -5.721 1.971 1.00 0.00 O ATOM 1019 CB ASN A 69 17.265 -5.764 4.324 1.00 0.00 C ATOM 1020 CG ASN A 69 17.323 -4.239 4.223 1.00 0.00 C ATOM 1021 OD1 ASN A 69 18.097 -3.586 4.905 1.00 0.00 O ATOM 1022 ND2 ASN A 69 16.541 -3.623 3.363 1.00 0.00 N ATOM 0 H ASN A 69 18.255 -4.900 1.997 1.00 0.00 H new ATOM 0 HA ASN A 69 17.775 -7.554 3.247 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.303 -6.043 4.754 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.034 -6.091 5.024 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.585 -2.608 3.270 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.891 -4.160 2.789 1.00 0.00 H new ATOM 1029 N ALA A 70 15.758 -7.923 1.843 1.00 0.00 N ATOM 1030 CA ALA A 70 14.627 -8.181 0.943 1.00 0.00 C ATOM 1031 C ALA A 70 13.248 -7.829 1.533 1.00 0.00 C ATOM 1032 O ALA A 70 12.282 -7.635 0.797 1.00 0.00 O ATOM 1033 CB ALA A 70 14.666 -9.657 0.582 1.00 0.00 C ATOM 0 H ALA A 70 16.229 -8.771 2.159 1.00 0.00 H new ATOM 0 HA ALA A 70 14.740 -7.532 0.075 1.00 0.00 H new ATOM 0 HB1 ALA A 70 13.838 -9.890 -0.088 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.610 -9.886 0.086 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.578 -10.256 1.489 1.00 0.00 H new ATOM 1039 N ASP A 71 13.154 -7.719 2.860 1.00 0.00 N ATOM 1040 CA ASP A 71 11.904 -7.442 3.581 1.00 0.00 C ATOM 1041 C ASP A 71 11.342 -6.045 3.265 1.00 0.00 C ATOM 1042 O ASP A 71 10.136 -5.806 3.334 1.00 0.00 O ATOM 1043 CB ASP A 71 12.202 -7.522 5.081 1.00 0.00 C ATOM 1044 CG ASP A 71 10.924 -7.431 5.934 1.00 0.00 C ATOM 1045 OD1 ASP A 71 10.087 -8.364 5.871 1.00 0.00 O ATOM 1046 OD2 ASP A 71 10.768 -6.447 6.699 1.00 0.00 O ATOM 0 H ASP A 71 13.959 -7.822 3.478 1.00 0.00 H new ATOM 0 HA ASP A 71 11.158 -8.174 3.270 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.716 -8.459 5.298 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.880 -6.715 5.358 1.00 0.00 H new ATOM 1051 N ASP A 72 12.240 -5.133 2.890 1.00 0.00 N ATOM 1052 CA ASP A 72 11.957 -3.747 2.533 1.00 0.00 C ATOM 1053 C ASP A 72 11.608 -3.594 1.038 1.00 0.00 C ATOM 1054 O ASP A 72 11.289 -2.494 0.593 1.00 0.00 O ATOM 1055 CB ASP A 72 13.181 -2.924 2.945 1.00 0.00 C ATOM 1056 CG ASP A 72 12.926 -1.408 2.897 1.00 0.00 C ATOM 1057 OD1 ASP A 72 12.008 -0.922 3.602 1.00 0.00 O ATOM 1058 OD2 ASP A 72 13.676 -0.687 2.196 1.00 0.00 O ATOM 0 H ASP A 72 13.233 -5.355 2.825 1.00 0.00 H new ATOM 0 HA ASP A 72 11.073 -3.386 3.058 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.479 -3.206 3.955 1.00 0.00 H new ATOM 0 HB3 ASP A 72 14.015 -3.168 2.287 1.00 0.00 H new ATOM 1063 N TYR A 73 11.643 -4.702 0.283 1.00 0.00 N ATOM 1064 CA TYR A 73 11.237 -4.819 -1.114 1.00 0.00 C ATOM 1065 C TYR A 73 10.080 -5.808 -1.191 1.00 0.00 C ATOM 1066 O TYR A 73 10.259 -6.995 -1.463 1.00 0.00 O ATOM 1067 CB TYR A 73 12.428 -5.220 -1.993 1.00 0.00 C ATOM 1068 CG TYR A 73 13.596 -4.272 -1.852 1.00 0.00 C ATOM 1069 CD1 TYR A 73 13.687 -3.123 -2.653 1.00 0.00 C ATOM 1070 CD2 TYR A 73 14.552 -4.512 -0.854 1.00 0.00 C ATOM 1071 CE1 TYR A 73 14.749 -2.220 -2.463 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.601 -3.604 -0.636 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.704 -2.448 -1.446 1.00 0.00 C ATOM 1074 OH TYR A 73 16.716 -1.553 -1.263 1.00 0.00 O ATOM 0 H TYR A 73 11.976 -5.590 0.659 1.00 0.00 H new ATOM 0 HA TYR A 73 10.895 -3.859 -1.500 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.748 -6.228 -1.728 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.112 -5.250 -3.036 1.00 0.00 H new ATOM 0 HD1 TYR A 73 12.944 -2.933 -3.413 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.481 -5.403 -0.248 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.835 -1.349 -3.096 1.00 0.00 H new ATOM 0 HE2 TYR A 73 16.324 -3.787 0.145 1.00 0.00 H new ATOM 0 HH TYR A 73 17.287 -1.852 -0.525 1.00 0.00 H new ATOM 1084 N ASP A 74 8.880 -5.307 -0.904 1.00 0.00 N ATOM 1085 CA ASP A 74 7.611 -6.050 -0.886 1.00 0.00 C ATOM 1086 C ASP A 74 7.343 -6.816 -2.195 1.00 0.00 C ATOM 1087 O ASP A 74 6.604 -7.799 -2.207 1.00 0.00 O ATOM 1088 CB ASP A 74 6.451 -5.060 -0.674 1.00 0.00 C ATOM 1089 CG ASP A 74 6.753 -3.989 0.384 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.486 -3.032 0.035 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.262 -4.103 1.532 1.00 0.00 O ATOM 0 H ASP A 74 8.755 -4.323 -0.665 1.00 0.00 H new ATOM 0 HA ASP A 74 7.683 -6.777 -0.077 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.222 -4.571 -1.621 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.560 -5.613 -0.377 1.00 0.00 H new ATOM 1096 N VAL A 75 7.937 -6.349 -3.298 1.00 0.00 N ATOM 1097 CA VAL A 75 7.766 -6.878 -4.650 1.00 0.00 C ATOM 1098 C VAL A 75 9.146 -7.017 -5.310 1.00 0.00 C ATOM 1099 O VAL A 75 9.947 -6.083 -5.280 1.00 0.00 O ATOM 1100 CB VAL A 75 6.797 -5.953 -5.418 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.677 -6.355 -6.894 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.396 -5.973 -4.793 1.00 0.00 C ATOM 0 H VAL A 75 8.578 -5.556 -3.269 1.00 0.00 H new ATOM 0 HA VAL A 75 7.322 -7.874 -4.648 1.00 0.00 H new ATOM 0 HB VAL A 75 7.215 -4.949 -5.352 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.986 -5.680 -7.400 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.656 -6.294 -7.368 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.303 -7.376 -6.964 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.737 -5.312 -5.356 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.000 -6.988 -4.819 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.454 -5.633 -3.759 1.00 0.00 H new ATOM 1112 N VAL A 76 9.451 -8.174 -5.903 1.00 0.00 N ATOM 1113 CA VAL A 76 10.782 -8.459 -6.490 1.00 0.00 C ATOM 1114 C VAL A 76 10.636 -9.108 -7.866 1.00 0.00 C ATOM 1115 O VAL A 76 9.985 -10.139 -8.007 1.00 0.00 O ATOM 1116 CB VAL A 76 11.639 -9.334 -5.550 1.00 0.00 C ATOM 1117 CG1 VAL A 76 12.960 -9.763 -6.204 1.00 0.00 C ATOM 1118 CG2 VAL A 76 12.015 -8.605 -4.250 1.00 0.00 C ATOM 0 H VAL A 76 8.790 -8.945 -5.995 1.00 0.00 H new ATOM 0 HA VAL A 76 11.303 -7.510 -6.614 1.00 0.00 H new ATOM 0 HB VAL A 76 11.013 -10.200 -5.335 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.529 -10.377 -5.506 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.750 -10.339 -7.105 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.540 -8.878 -6.466 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.617 -9.264 -3.624 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.587 -7.708 -4.488 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.108 -8.325 -3.714 1.00 0.00 H new ATOM 1128 N ILE A 77 11.241 -8.503 -8.891 1.00 0.00 N ATOM 1129 CA ILE A 77 11.198 -8.958 -10.288 1.00 0.00 C ATOM 1130 C ILE A 77 12.623 -9.347 -10.703 1.00 0.00 C ATOM 1131 O ILE A 77 13.527 -8.510 -10.681 1.00 0.00 O ATOM 1132 CB ILE A 77 10.617 -7.846 -11.207 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.088 -7.575 -11.167 1.00 0.00 C ATOM 1134 CG2 ILE A 77 10.966 -8.090 -12.690 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.338 -7.918 -9.880 1.00 0.00 C ATOM 0 H ILE A 77 11.794 -7.654 -8.770 1.00 0.00 H new ATOM 0 HA ILE A 77 10.542 -9.823 -10.388 1.00 0.00 H new ATOM 0 HB ILE A 77 11.099 -6.969 -10.775 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.930 -6.517 -11.375 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.627 -8.133 -11.982 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.542 -7.292 -13.300 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.049 -8.103 -12.811 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.553 -9.047 -13.008 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.282 -7.676 -9.999 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.445 -8.982 -9.669 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.752 -7.341 -9.053 1.00 0.00 H new ATOM 1147 N SER A 78 12.832 -10.594 -11.115 1.00 0.00 N ATOM 1148 CA SER A 78 14.066 -11.062 -11.754 1.00 0.00 C ATOM 1149 C SER A 78 14.014 -10.784 -13.259 1.00 0.00 C ATOM 1150 O SER A 78 12.943 -10.813 -13.862 1.00 0.00 O ATOM 1151 CB SER A 78 14.291 -12.547 -11.446 1.00 0.00 C ATOM 1152 OG SER A 78 15.301 -13.090 -12.276 1.00 0.00 O ATOM 0 H SER A 78 12.132 -11.329 -11.013 1.00 0.00 H new ATOM 0 HA SER A 78 14.918 -10.515 -11.349 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.572 -12.666 -10.400 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.361 -13.097 -11.591 1.00 0.00 H new ATOM 0 HG SER A 78 14.911 -13.770 -12.864 1.00 0.00 H new ATOM 1158 N LEU A 79 15.161 -10.510 -13.887 1.00 0.00 N ATOM 1159 CA LEU A 79 15.287 -10.292 -15.341 1.00 0.00 C ATOM 1160 C LEU A 79 16.310 -11.240 -15.991 1.00 0.00 C ATOM 1161 O LEU A 79 16.907 -10.920 -17.016 1.00 0.00 O ATOM 1162 CB LEU A 79 15.547 -8.801 -15.654 1.00 0.00 C ATOM 1163 CG LEU A 79 14.467 -7.846 -15.109 1.00 0.00 C ATOM 1164 CD1 LEU A 79 14.841 -7.299 -13.734 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.302 -6.632 -16.015 1.00 0.00 C ATOM 0 H LEU A 79 16.050 -10.431 -13.393 1.00 0.00 H new ATOM 0 HA LEU A 79 14.333 -10.548 -15.801 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.513 -8.516 -15.236 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.617 -8.674 -16.734 1.00 0.00 H new ATOM 0 HG LEU A 79 13.550 -8.432 -15.057 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.056 -6.630 -13.383 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.954 -8.125 -13.032 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.780 -6.751 -13.804 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.534 -5.975 -15.607 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.247 -6.092 -16.075 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.007 -6.959 -17.012 1.00 0.00 H new ATOM 1177 N CYS A 80 16.544 -12.394 -15.361 1.00 0.00 N ATOM 1178 CA CYS A 80 17.607 -13.328 -15.742 1.00 0.00 C ATOM 1179 C CYS A 80 17.218 -14.283 -16.889 1.00 0.00 C ATOM 1180 O CYS A 80 18.105 -14.844 -17.536 1.00 0.00 O ATOM 1181 CB CYS A 80 18.018 -14.120 -14.494 1.00 0.00 C ATOM 1182 SG CYS A 80 18.525 -12.974 -13.175 1.00 0.00 S ATOM 0 H CYS A 80 15.994 -12.710 -14.562 1.00 0.00 H new ATOM 0 HA CYS A 80 18.441 -12.743 -16.130 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.186 -14.736 -14.153 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.838 -14.797 -14.735 1.00 0.00 H new ATOM 0 HG CYS A 80 17.493 -12.667 -12.446 1.00 0.00 H new ATOM 1188 N GLY A 81 15.917 -14.468 -17.147 1.00 0.00 N ATOM 1189 CA GLY A 81 15.404 -15.445 -18.109 1.00 0.00 C ATOM 1190 C GLY A 81 15.623 -16.888 -17.639 1.00 0.00 C ATOM 1191 O GLY A 81 16.314 -17.663 -18.308 1.00 0.00 O ATOM 0 H GLY A 81 15.182 -13.933 -16.685 1.00 0.00 H new ATOM 0 HA2 GLY A 81 14.339 -15.273 -18.266 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.896 -15.299 -19.071 1.00 0.00 H new ATOM 1195 N CYS A 82 15.046 -17.233 -16.481 1.00 0.00 N ATOM 1196 CA CYS A 82 15.265 -18.465 -15.716 1.00 0.00 C ATOM 1197 C CYS A 82 16.722 -18.629 -15.212 1.00 0.00 C ATOM 1198 O CYS A 82 17.611 -17.827 -15.515 1.00 0.00 O ATOM 1199 CB CYS A 82 14.714 -19.661 -16.516 1.00 0.00 C ATOM 1200 SG CYS A 82 14.307 -21.054 -15.418 1.00 0.00 S ATOM 0 H CYS A 82 14.371 -16.619 -16.025 1.00 0.00 H new ATOM 0 HA CYS A 82 14.702 -18.410 -14.784 1.00 0.00 H new ATOM 0 HB2 CYS A 82 13.824 -19.355 -17.066 1.00 0.00 H new ATOM 0 HB3 CYS A 82 15.451 -19.979 -17.254 1.00 0.00 H new ATOM 0 HG CYS A 82 13.844 -22.042 -16.124 1.00 0.00 H new ATOM 1206 N GLY A 83 16.967 -19.654 -14.386 1.00 0.00 N ATOM 1207 CA GLY A 83 18.304 -20.009 -13.886 1.00 0.00 C ATOM 1208 C GLY A 83 18.936 -18.967 -12.955 1.00 0.00 C ATOM 1209 O GLY A 83 20.151 -18.763 -13.002 1.00 0.00 O ATOM 0 H GLY A 83 16.231 -20.270 -14.040 1.00 0.00 H new ATOM 0 HA2 GLY A 83 18.238 -20.959 -13.355 1.00 0.00 H new ATOM 0 HA3 GLY A 83 18.966 -20.165 -14.738 1.00 0.00 H new ATOM 1213 N VAL A 84 18.128 -18.268 -12.145 1.00 0.00 N ATOM 1214 CA VAL A 84 18.593 -17.273 -11.160 1.00 0.00 C ATOM 1215 C VAL A 84 18.852 -17.914 -9.788 1.00 0.00 C ATOM 1216 O VAL A 84 18.056 -18.718 -9.300 1.00 0.00 O ATOM 1217 CB VAL A 84 17.635 -16.061 -11.090 1.00 0.00 C ATOM 1218 CG1 VAL A 84 16.273 -16.347 -10.445 1.00 0.00 C ATOM 1219 CG2 VAL A 84 18.285 -14.883 -10.356 1.00 0.00 C ATOM 0 H VAL A 84 17.114 -18.378 -12.154 1.00 0.00 H new ATOM 0 HA VAL A 84 19.554 -16.887 -11.499 1.00 0.00 H new ATOM 0 HB VAL A 84 17.445 -15.815 -12.135 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.673 -15.437 -10.442 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.756 -17.120 -11.014 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.420 -16.688 -9.420 1.00 0.00 H new ATOM 0 HG21 VAL A 84 17.588 -14.046 -10.323 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.540 -15.184 -9.340 1.00 0.00 H new ATOM 0 HG23 VAL A 84 19.190 -14.581 -10.883 1.00 0.00 H new ATOM 1229 N ASN A 85 19.962 -17.530 -9.151 1.00 0.00 N ATOM 1230 CA ASN A 85 20.277 -17.865 -7.757 1.00 0.00 C ATOM 1231 C ASN A 85 19.835 -16.709 -6.836 1.00 0.00 C ATOM 1232 O ASN A 85 20.268 -15.573 -7.028 1.00 0.00 O ATOM 1233 CB ASN A 85 21.785 -18.171 -7.655 1.00 0.00 C ATOM 1234 CG ASN A 85 22.227 -18.653 -6.278 1.00 0.00 C ATOM 1235 OD1 ASN A 85 21.435 -18.905 -5.379 1.00 0.00 O ATOM 1236 ND2 ASN A 85 23.515 -18.808 -6.071 1.00 0.00 N ATOM 0 H ASN A 85 20.683 -16.965 -9.599 1.00 0.00 H new ATOM 0 HA ASN A 85 19.734 -18.752 -7.431 1.00 0.00 H new ATOM 0 HB2 ASN A 85 22.042 -18.930 -8.394 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.346 -17.272 -7.912 1.00 0.00 H new ATOM 0 HD21 ASN A 85 23.850 -19.137 -5.165 1.00 0.00 H new ATOM 0 HD22 ASN A 85 24.180 -18.600 -6.816 1.00 0.00 H new ATOM 1243 N LEU A 86 18.975 -16.986 -5.851 1.00 0.00 N ATOM 1244 CA LEU A 86 18.471 -16.005 -4.885 1.00 0.00 C ATOM 1245 C LEU A 86 18.386 -16.597 -3.464 1.00 0.00 C ATOM 1246 O LEU A 86 17.889 -17.719 -3.314 1.00 0.00 O ATOM 1247 CB LEU A 86 17.061 -15.523 -5.298 1.00 0.00 C ATOM 1248 CG LEU A 86 16.978 -14.563 -6.495 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.512 -14.254 -6.804 1.00 0.00 C ATOM 1250 CD2 LEU A 86 17.675 -13.230 -6.225 1.00 0.00 C ATOM 0 H LEU A 86 18.601 -17.923 -5.700 1.00 0.00 H new ATOM 0 HA LEU A 86 19.172 -15.171 -4.880 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.455 -16.400 -5.524 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.604 -15.033 -4.438 1.00 0.00 H new ATOM 0 HG LEU A 86 17.474 -15.060 -7.329 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.455 -13.573 -7.653 1.00 0.00 H new ATOM 0 HD12 LEU A 86 14.988 -15.179 -7.045 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.047 -13.789 -5.934 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.587 -12.589 -7.102 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.207 -12.741 -5.370 1.00 0.00 H new ATOM 0 HD23 LEU A 86 18.729 -13.407 -6.010 1.00 0.00 H new ATOM 1262 N PRO A 87 18.804 -15.853 -2.416 1.00 0.00 N ATOM 1263 CA PRO A 87 18.539 -16.235 -1.025 1.00 0.00 C ATOM 1264 C PRO A 87 17.018 -16.273 -0.767 1.00 0.00 C ATOM 1265 O PRO A 87 16.278 -15.533 -1.423 1.00 0.00 O ATOM 1266 CB PRO A 87 19.263 -15.200 -0.149 1.00 0.00 C ATOM 1267 CG PRO A 87 20.312 -14.595 -1.082 1.00 0.00 C ATOM 1268 CD PRO A 87 19.663 -14.677 -2.461 1.00 0.00 C ATOM 0 HA PRO A 87 18.906 -17.235 -0.793 1.00 0.00 H new ATOM 0 HB2 PRO A 87 18.575 -14.441 0.223 1.00 0.00 H new ATOM 0 HB3 PRO A 87 19.724 -15.667 0.721 1.00 0.00 H new ATOM 0 HG2 PRO A 87 20.544 -13.565 -0.809 1.00 0.00 H new ATOM 0 HG3 PRO A 87 21.248 -15.152 -1.047 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.087 -13.778 -2.678 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.415 -14.770 -3.244 1.00 0.00 H new ATOM 1276 N PRO A 88 16.517 -17.076 0.191 1.00 0.00 N ATOM 1277 CA PRO A 88 15.079 -17.329 0.350 1.00 0.00 C ATOM 1278 C PRO A 88 14.252 -16.073 0.666 1.00 0.00 C ATOM 1279 O PRO A 88 13.093 -15.976 0.268 1.00 0.00 O ATOM 1280 CB PRO A 88 14.975 -18.396 1.449 1.00 0.00 C ATOM 1281 CG PRO A 88 16.277 -18.244 2.237 1.00 0.00 C ATOM 1282 CD PRO A 88 17.283 -17.857 1.155 1.00 0.00 C ATOM 0 HA PRO A 88 14.647 -17.670 -0.591 1.00 0.00 H new ATOM 0 HB2 PRO A 88 14.103 -18.232 2.083 1.00 0.00 H new ATOM 0 HB3 PRO A 88 14.879 -19.396 1.026 1.00 0.00 H new ATOM 0 HG2 PRO A 88 16.196 -17.477 3.008 1.00 0.00 H new ATOM 0 HG3 PRO A 88 16.558 -19.171 2.738 1.00 0.00 H new ATOM 0 HD2 PRO A 88 18.105 -17.275 1.571 1.00 0.00 H new ATOM 0 HD3 PRO A 88 17.721 -18.740 0.689 1.00 0.00 H new ATOM 1290 N GLU A 89 14.852 -15.053 1.291 1.00 0.00 N ATOM 1291 CA GLU A 89 14.173 -13.775 1.551 1.00 0.00 C ATOM 1292 C GLU A 89 13.831 -12.972 0.274 1.00 0.00 C ATOM 1293 O GLU A 89 12.930 -12.137 0.310 1.00 0.00 O ATOM 1294 CB GLU A 89 14.964 -12.948 2.578 1.00 0.00 C ATOM 1295 CG GLU A 89 16.364 -12.509 2.125 1.00 0.00 C ATOM 1296 CD GLU A 89 17.012 -11.568 3.165 1.00 0.00 C ATOM 1297 OE1 GLU A 89 17.687 -12.071 4.099 1.00 0.00 O ATOM 1298 OE2 GLU A 89 16.853 -10.326 3.060 1.00 0.00 O ATOM 0 H GLU A 89 15.814 -15.088 1.629 1.00 0.00 H new ATOM 0 HA GLU A 89 13.201 -14.017 1.981 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.385 -12.059 2.828 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.062 -13.532 3.493 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.995 -13.386 1.980 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.296 -12.002 1.163 1.00 0.00 H new ATOM 1305 N TRP A 90 14.481 -13.242 -0.868 1.00 0.00 N ATOM 1306 CA TRP A 90 14.255 -12.547 -2.152 1.00 0.00 C ATOM 1307 C TRP A 90 13.180 -13.178 -3.054 1.00 0.00 C ATOM 1308 O TRP A 90 12.882 -12.629 -4.114 1.00 0.00 O ATOM 1309 CB TRP A 90 15.589 -12.385 -2.893 1.00 0.00 C ATOM 1310 CG TRP A 90 16.514 -11.404 -2.250 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.534 -11.701 -1.416 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.451 -9.948 -2.299 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.103 -10.535 -0.943 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.442 -9.425 -1.420 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.604 -9.022 -2.945 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.537 -8.059 -1.136 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.700 -7.645 -2.675 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.649 -7.164 -1.754 1.00 0.00 C ATOM 0 H TRP A 90 15.196 -13.966 -0.930 1.00 0.00 H new ATOM 0 HA TRP A 90 13.846 -11.569 -1.899 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.084 -13.355 -2.950 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.390 -12.068 -3.917 1.00 0.00 H new ATOM 0 HD1 TRP A 90 17.856 -12.699 -1.158 1.00 0.00 H new ATOM 0 HE1 TRP A 90 18.910 -10.500 -0.320 1.00 0.00 H new ATOM 0 HE3 TRP A 90 14.872 -9.376 -3.656 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.286 -7.696 -0.448 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.041 -6.952 -3.178 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.694 -6.110 -1.523 1.00 0.00 H new ATOM 1329 N VAL A 91 12.599 -14.318 -2.658 1.00 0.00 N ATOM 1330 CA VAL A 91 11.546 -15.040 -3.416 1.00 0.00 C ATOM 1331 C VAL A 91 10.208 -15.169 -2.673 1.00 0.00 C ATOM 1332 O VAL A 91 9.213 -15.600 -3.254 1.00 0.00 O ATOM 1333 CB VAL A 91 12.039 -16.442 -3.825 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.195 -16.362 -4.828 1.00 0.00 C ATOM 1335 CG2 VAL A 91 12.492 -17.265 -2.612 1.00 0.00 C ATOM 0 H VAL A 91 12.847 -14.781 -1.784 1.00 0.00 H new ATOM 0 HA VAL A 91 11.355 -14.427 -4.297 1.00 0.00 H new ATOM 0 HB VAL A 91 11.188 -16.938 -4.293 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.517 -17.369 -5.094 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.863 -15.839 -5.725 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.029 -15.821 -4.380 1.00 0.00 H new ATOM 0 HG21 VAL A 91 12.832 -18.246 -2.944 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.309 -16.750 -2.107 1.00 0.00 H new ATOM 0 HG23 VAL A 91 11.657 -17.385 -1.921 1.00 0.00 H new ATOM 1345 N THR A 92 10.176 -14.817 -1.385 1.00 0.00 N ATOM 1346 CA THR A 92 9.047 -15.034 -0.453 1.00 0.00 C ATOM 1347 C THR A 92 8.077 -13.829 -0.366 1.00 0.00 C ATOM 1348 O THR A 92 7.100 -13.836 0.385 1.00 0.00 O ATOM 1349 CB THR A 92 9.614 -15.493 0.904 1.00 0.00 C ATOM 1350 OG1 THR A 92 8.608 -15.952 1.785 1.00 0.00 O ATOM 1351 CG2 THR A 92 10.425 -14.394 1.585 1.00 0.00 C ATOM 0 H THR A 92 10.966 -14.353 -0.936 1.00 0.00 H new ATOM 0 HA THR A 92 8.408 -15.827 -0.842 1.00 0.00 H new ATOM 0 HB THR A 92 10.275 -16.329 0.677 1.00 0.00 H new ATOM 0 HG1 THR A 92 7.838 -15.348 1.745 1.00 0.00 H new ATOM 0 HG21 THR A 92 10.806 -14.760 2.538 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.261 -14.109 0.946 1.00 0.00 H new ATOM 0 HG23 THR A 92 9.788 -13.526 1.758 1.00 0.00 H new ATOM 1359 N GLN A 93 8.335 -12.788 -1.164 1.00 0.00 N ATOM 1360 CA GLN A 93 7.518 -11.580 -1.348 1.00 0.00 C ATOM 1361 C GLN A 93 6.054 -11.872 -1.717 1.00 0.00 C ATOM 1362 O GLN A 93 5.729 -12.924 -2.271 1.00 0.00 O ATOM 1363 CB GLN A 93 8.157 -10.728 -2.463 1.00 0.00 C ATOM 1364 CG GLN A 93 9.286 -9.824 -1.954 1.00 0.00 C ATOM 1365 CD GLN A 93 10.566 -10.557 -1.554 1.00 0.00 C ATOM 1366 OE1 GLN A 93 10.799 -11.704 -1.908 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.439 -9.952 -0.782 1.00 0.00 N ATOM 0 H GLN A 93 9.177 -12.764 -1.739 1.00 0.00 H new ATOM 0 HA GLN A 93 7.497 -11.056 -0.392 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.548 -11.388 -3.237 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.387 -10.112 -2.928 1.00 0.00 H new ATOM 0 HG2 GLN A 93 9.528 -9.098 -2.730 1.00 0.00 H new ATOM 0 HG3 GLN A 93 8.922 -9.262 -1.094 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.269 -8.995 -0.472 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.287 -10.439 -0.492 1.00 0.00 H new ATOM 1376 N GLU A 94 5.171 -10.894 -1.473 1.00 0.00 N ATOM 1377 CA GLU A 94 3.751 -10.999 -1.851 1.00 0.00 C ATOM 1378 C GLU A 94 3.551 -11.111 -3.373 1.00 0.00 C ATOM 1379 O GLU A 94 2.655 -11.835 -3.818 1.00 0.00 O ATOM 1380 CB GLU A 94 2.917 -9.845 -1.263 1.00 0.00 C ATOM 1381 CG GLU A 94 3.365 -8.419 -1.620 1.00 0.00 C ATOM 1382 CD GLU A 94 2.336 -7.394 -1.107 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.417 -6.984 0.077 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.431 -6.996 -1.881 1.00 0.00 O ATOM 0 H GLU A 94 5.415 -10.017 -1.014 1.00 0.00 H new ATOM 0 HA GLU A 94 3.387 -11.929 -1.415 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.885 -9.970 -1.591 1.00 0.00 H new ATOM 0 HB3 GLU A 94 2.921 -9.941 -0.177 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.342 -8.216 -1.180 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.476 -8.325 -2.700 1.00 0.00 H new ATOM 1391 N ILE A 95 4.407 -10.448 -4.167 1.00 0.00 N ATOM 1392 CA ILE A 95 4.434 -10.557 -5.634 1.00 0.00 C ATOM 1393 C ILE A 95 5.879 -10.740 -6.122 1.00 0.00 C ATOM 1394 O ILE A 95 6.767 -9.948 -5.790 1.00 0.00 O ATOM 1395 CB ILE A 95 3.725 -9.344 -6.290 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.274 -9.210 -5.765 1.00 0.00 C ATOM 1397 CG2 ILE A 95 3.745 -9.464 -7.826 1.00 0.00 C ATOM 1398 CD1 ILE A 95 1.504 -7.989 -6.262 1.00 0.00 C ATOM 0 H ILE A 95 5.113 -9.809 -3.800 1.00 0.00 H new ATOM 0 HA ILE A 95 3.876 -11.441 -5.942 1.00 0.00 H new ATOM 0 HB ILE A 95 4.270 -8.441 -6.016 1.00 0.00 H new ATOM 0 HG12 ILE A 95 1.720 -10.106 -6.046 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.302 -9.181 -4.676 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.242 -8.602 -8.265 1.00 0.00 H new ATOM 0 HG22 ILE A 95 4.777 -9.498 -8.175 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.230 -10.376 -8.126 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.501 -7.992 -5.835 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.025 -7.081 -5.958 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.435 -8.020 -7.349 1.00 0.00 H new ATOM 1410 N PHE A 96 6.098 -11.776 -6.937 1.00 0.00 N ATOM 1411 CA PHE A 96 7.377 -12.093 -7.575 1.00 0.00 C ATOM 1412 C PHE A 96 7.196 -12.349 -9.084 1.00 0.00 C ATOM 1413 O PHE A 96 6.163 -12.871 -9.507 1.00 0.00 O ATOM 1414 CB PHE A 96 8.029 -13.291 -6.864 1.00 0.00 C ATOM 1415 CG PHE A 96 9.426 -13.634 -7.358 1.00 0.00 C ATOM 1416 CD1 PHE A 96 9.608 -14.519 -8.440 1.00 0.00 C ATOM 1417 CD2 PHE A 96 10.554 -13.066 -6.735 1.00 0.00 C ATOM 1418 CE1 PHE A 96 10.901 -14.819 -8.905 1.00 0.00 C ATOM 1419 CE2 PHE A 96 11.847 -13.370 -7.196 1.00 0.00 C ATOM 1420 CZ PHE A 96 12.022 -14.241 -8.285 1.00 0.00 C ATOM 0 H PHE A 96 5.363 -12.440 -7.179 1.00 0.00 H new ATOM 0 HA PHE A 96 8.044 -11.236 -7.480 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.077 -13.081 -5.795 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.389 -14.164 -6.989 1.00 0.00 H new ATOM 0 HD1 PHE A 96 8.749 -14.970 -8.915 1.00 0.00 H new ATOM 0 HD2 PHE A 96 10.425 -12.394 -5.899 1.00 0.00 H new ATOM 0 HE1 PHE A 96 11.032 -15.493 -9.738 1.00 0.00 H new ATOM 0 HE2 PHE A 96 12.708 -12.933 -6.712 1.00 0.00 H new ATOM 0 HZ PHE A 96 13.015 -14.466 -8.644 1.00 0.00 H new ATOM 1430 N GLU A 97 8.206 -12.015 -9.889 1.00 0.00 N ATOM 1431 CA GLU A 97 8.251 -12.290 -11.334 1.00 0.00 C ATOM 1432 C GLU A 97 9.661 -12.687 -11.802 1.00 0.00 C ATOM 1433 O GLU A 97 10.654 -12.333 -11.168 1.00 0.00 O ATOM 1434 CB GLU A 97 7.861 -11.040 -12.149 1.00 0.00 C ATOM 1435 CG GLU A 97 6.464 -10.437 -11.925 1.00 0.00 C ATOM 1436 CD GLU A 97 5.294 -11.344 -12.362 1.00 0.00 C ATOM 1437 OE1 GLU A 97 5.502 -12.379 -13.040 1.00 0.00 O ATOM 1438 OE2 GLU A 97 4.130 -10.972 -12.076 1.00 0.00 O ATOM 0 H GLU A 97 9.039 -11.533 -9.550 1.00 0.00 H new ATOM 0 HA GLU A 97 7.550 -13.108 -11.499 1.00 0.00 H new ATOM 0 HB2 GLU A 97 8.597 -10.263 -11.941 1.00 0.00 H new ATOM 0 HB3 GLU A 97 7.951 -11.290 -13.206 1.00 0.00 H new ATOM 0 HG2 GLU A 97 6.349 -10.203 -10.867 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.398 -9.495 -12.469 1.00 0.00 H new ATOM 1445 N ASP A 98 9.755 -13.360 -12.952 1.00 0.00 N ATOM 1446 CA ASP A 98 11.014 -13.603 -13.665 1.00 0.00 C ATOM 1447 C ASP A 98 10.793 -13.351 -15.164 1.00 0.00 C ATOM 1448 O ASP A 98 10.055 -14.077 -15.834 1.00 0.00 O ATOM 1449 CB ASP A 98 11.582 -15.000 -13.397 1.00 0.00 C ATOM 1450 CG ASP A 98 12.880 -15.213 -14.196 1.00 0.00 C ATOM 1451 OD1 ASP A 98 13.882 -14.511 -13.923 1.00 0.00 O ATOM 1452 OD2 ASP A 98 12.893 -16.070 -15.110 1.00 0.00 O ATOM 0 H ASP A 98 8.943 -13.759 -13.423 1.00 0.00 H new ATOM 0 HA ASP A 98 11.766 -12.909 -13.290 1.00 0.00 H new ATOM 0 HB2 ASP A 98 11.779 -15.121 -12.332 1.00 0.00 H new ATOM 0 HB3 ASP A 98 10.848 -15.757 -13.674 1.00 0.00 H new ATOM 1457 N TRP A 99 11.391 -12.281 -15.685 1.00 0.00 N ATOM 1458 CA TRP A 99 11.218 -11.821 -17.064 1.00 0.00 C ATOM 1459 C TRP A 99 12.215 -12.502 -18.015 1.00 0.00 C ATOM 1460 O TRP A 99 13.360 -12.773 -17.659 1.00 0.00 O ATOM 1461 CB TRP A 99 11.263 -10.278 -17.103 1.00 0.00 C ATOM 1462 CG TRP A 99 10.145 -9.558 -16.390 1.00 0.00 C ATOM 1463 CD1 TRP A 99 9.033 -10.136 -15.865 1.00 0.00 C ATOM 1464 CD2 TRP A 99 10.004 -8.123 -16.108 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.228 -9.177 -15.285 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.781 -7.927 -15.398 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.764 -6.958 -16.378 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.351 -6.672 -14.960 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.341 -5.689 -15.935 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.137 -5.545 -15.226 1.00 0.00 C ATOM 0 H TRP A 99 12.027 -11.693 -15.146 1.00 0.00 H new ATOM 0 HA TRP A 99 10.236 -12.119 -17.431 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.210 -9.952 -16.671 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.263 -9.962 -18.146 1.00 0.00 H new ATOM 0 HD1 TRP A 99 8.811 -11.193 -15.897 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.336 -9.373 -14.831 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.686 -7.044 -16.934 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.420 -6.572 -14.421 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.948 -4.820 -16.142 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.819 -4.570 -14.888 1.00 0.00 H new ATOM 1481 N GLN A 100 11.772 -12.753 -19.252 1.00 0.00 N ATOM 1482 CA GLN A 100 12.495 -13.523 -20.288 1.00 0.00 C ATOM 1483 C GLN A 100 13.056 -12.537 -21.329 1.00 0.00 C ATOM 1484 O GLN A 100 12.890 -12.678 -22.541 1.00 0.00 O ATOM 1485 CB GLN A 100 11.574 -14.615 -20.874 1.00 0.00 C ATOM 1486 CG GLN A 100 10.816 -15.471 -19.836 1.00 0.00 C ATOM 1487 CD GLN A 100 11.717 -16.135 -18.792 1.00 0.00 C ATOM 1488 OE1 GLN A 100 12.631 -16.888 -19.103 1.00 0.00 O ATOM 1489 NE2 GLN A 100 11.504 -15.872 -17.522 1.00 0.00 N ATOM 0 H GLN A 100 10.866 -12.416 -19.578 1.00 0.00 H new ATOM 0 HA GLN A 100 13.346 -14.059 -19.868 1.00 0.00 H new ATOM 0 HB2 GLN A 100 10.844 -14.138 -21.528 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.175 -15.278 -21.496 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.089 -14.841 -19.324 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.255 -16.245 -20.360 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.746 -15.246 -17.251 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.097 -16.294 -16.807 1.00 0.00 H new ATOM 1498 N LEU A 101 13.665 -11.474 -20.797 1.00 0.00 N ATOM 1499 CA LEU A 101 14.091 -10.256 -21.482 1.00 0.00 C ATOM 1500 C LEU A 101 15.606 -10.264 -21.749 1.00 0.00 C ATOM 1501 O LEU A 101 16.397 -10.568 -20.855 1.00 0.00 O ATOM 1502 CB LEU A 101 13.576 -9.126 -20.560 1.00 0.00 C ATOM 1503 CG LEU A 101 13.597 -7.667 -21.018 1.00 0.00 C ATOM 1504 CD1 LEU A 101 14.971 -7.031 -20.832 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.128 -7.476 -22.454 1.00 0.00 C ATOM 0 H LEU A 101 13.889 -11.442 -19.802 1.00 0.00 H new ATOM 0 HA LEU A 101 13.685 -10.134 -22.486 1.00 0.00 H new ATOM 0 HB2 LEU A 101 12.544 -9.366 -20.306 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.152 -9.179 -19.636 1.00 0.00 H new ATOM 0 HG LEU A 101 12.881 -7.158 -20.373 1.00 0.00 H new ATOM 0 HD11 LEU A 101 14.941 -5.995 -21.170 1.00 0.00 H new ATOM 0 HD12 LEU A 101 15.246 -7.061 -19.778 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.709 -7.582 -21.415 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.169 -6.418 -22.712 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.776 -8.039 -23.126 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.103 -7.835 -22.553 1.00 0.00 H new ATOM 1517 N GLU A 102 16.018 -9.929 -22.973 1.00 0.00 N ATOM 1518 CA GLU A 102 17.401 -10.003 -23.451 1.00 0.00 C ATOM 1519 C GLU A 102 18.169 -8.703 -23.210 1.00 0.00 C ATOM 1520 O GLU A 102 17.596 -7.617 -23.184 1.00 0.00 O ATOM 1521 CB GLU A 102 17.425 -10.410 -24.934 1.00 0.00 C ATOM 1522 CG GLU A 102 16.852 -9.358 -25.894 1.00 0.00 C ATOM 1523 CD GLU A 102 16.849 -9.898 -27.337 1.00 0.00 C ATOM 1524 OE1 GLU A 102 17.942 -9.997 -27.945 1.00 0.00 O ATOM 1525 OE2 GLU A 102 15.760 -10.228 -27.868 1.00 0.00 O ATOM 0 H GLU A 102 15.374 -9.586 -23.686 1.00 0.00 H new ATOM 0 HA GLU A 102 17.915 -10.770 -22.872 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.454 -10.624 -25.222 1.00 0.00 H new ATOM 0 HB3 GLU A 102 16.862 -11.336 -25.052 1.00 0.00 H new ATOM 0 HG2 GLU A 102 15.837 -9.096 -25.594 1.00 0.00 H new ATOM 0 HG3 GLU A 102 17.446 -8.445 -25.841 1.00 0.00 H new ATOM 1532 N ASP A 103 19.485 -8.804 -23.051 1.00 0.00 N ATOM 1533 CA ASP A 103 20.349 -7.634 -22.879 1.00 0.00 C ATOM 1534 C ASP A 103 20.841 -7.078 -24.234 1.00 0.00 C ATOM 1535 O ASP A 103 21.312 -7.851 -25.079 1.00 0.00 O ATOM 1536 CB ASP A 103 21.517 -7.955 -21.946 1.00 0.00 C ATOM 1537 CG ASP A 103 22.191 -6.649 -21.501 1.00 0.00 C ATOM 1538 OD1 ASP A 103 23.065 -6.156 -22.247 1.00 0.00 O ATOM 1539 OD2 ASP A 103 21.783 -6.108 -20.446 1.00 0.00 O ATOM 0 H ASP A 103 19.984 -9.694 -23.037 1.00 0.00 H new ATOM 0 HA ASP A 103 19.753 -6.849 -22.414 1.00 0.00 H new ATOM 0 HB2 ASP A 103 21.161 -8.507 -21.077 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.238 -8.594 -22.456 1.00 0.00 H new ATOM 1544 N PRO A 104 20.745 -5.756 -24.476 1.00 0.00 N ATOM 1545 CA PRO A 104 21.128 -5.158 -25.751 1.00 0.00 C ATOM 1546 C PRO A 104 22.618 -4.775 -25.881 1.00 0.00 C ATOM 1547 O PRO A 104 23.071 -4.555 -27.002 1.00 0.00 O ATOM 1548 CB PRO A 104 20.219 -3.936 -25.866 1.00 0.00 C ATOM 1549 CG PRO A 104 20.086 -3.461 -24.421 1.00 0.00 C ATOM 1550 CD PRO A 104 20.027 -4.784 -23.660 1.00 0.00 C ATOM 0 HA PRO A 104 21.006 -5.880 -26.559 1.00 0.00 H new ATOM 0 HB2 PRO A 104 20.656 -3.168 -26.504 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.251 -4.194 -26.296 1.00 0.00 H new ATOM 0 HG2 PRO A 104 20.934 -2.849 -24.112 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.188 -2.862 -24.269 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.486 -4.688 -22.676 1.00 0.00 H new ATOM 0 HD3 PRO A 104 18.995 -5.096 -23.501 1.00 0.00 H new ATOM 1558 N ASP A 105 23.410 -4.706 -24.802 1.00 0.00 N ATOM 1559 CA ASP A 105 24.797 -4.200 -24.863 1.00 0.00 C ATOM 1560 C ASP A 105 25.759 -5.147 -25.607 1.00 0.00 C ATOM 1561 O ASP A 105 26.688 -4.703 -26.286 1.00 0.00 O ATOM 1562 CB ASP A 105 25.293 -3.889 -23.445 1.00 0.00 C ATOM 1563 CG ASP A 105 26.721 -3.310 -23.415 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.061 -2.439 -24.250 1.00 0.00 O ATOM 1565 OD2 ASP A 105 27.505 -3.733 -22.530 1.00 0.00 O ATOM 0 H ASP A 105 23.116 -4.995 -23.869 1.00 0.00 H new ATOM 0 HA ASP A 105 24.786 -3.282 -25.451 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.611 -3.180 -22.976 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.265 -4.801 -22.849 1.00 0.00 H new ATOM 1570 N GLY A 106 25.495 -6.458 -25.563 1.00 0.00 N ATOM 1571 CA GLY A 106 26.187 -7.452 -26.394 1.00 0.00 C ATOM 1572 C GLY A 106 25.731 -7.467 -27.865 1.00 0.00 C ATOM 1573 O GLY A 106 26.157 -8.342 -28.622 1.00 0.00 O ATOM 0 H GLY A 106 24.791 -6.862 -24.946 1.00 0.00 H new ATOM 0 HA2 GLY A 106 27.259 -7.257 -26.359 1.00 0.00 H new ATOM 0 HA3 GLY A 106 26.029 -8.442 -25.965 1.00 0.00 H new ATOM 1577 N GLN A 107 24.838 -6.551 -28.267 1.00 0.00 N ATOM 1578 CA GLN A 107 24.130 -6.537 -29.555 1.00 0.00 C ATOM 1579 C GLN A 107 24.073 -5.132 -30.200 1.00 0.00 C ATOM 1580 O GLN A 107 24.791 -4.211 -29.796 1.00 0.00 O ATOM 1581 CB GLN A 107 22.725 -7.151 -29.347 1.00 0.00 C ATOM 1582 CG GLN A 107 22.738 -8.546 -28.694 1.00 0.00 C ATOM 1583 CD GLN A 107 21.348 -9.179 -28.705 1.00 0.00 C ATOM 1584 OE1 GLN A 107 20.902 -9.727 -29.705 1.00 0.00 O ATOM 1585 NE2 GLN A 107 20.602 -9.106 -27.625 1.00 0.00 N ATOM 0 H GLN A 107 24.578 -5.762 -27.675 1.00 0.00 H new ATOM 0 HA GLN A 107 24.688 -7.141 -30.270 1.00 0.00 H new ATOM 0 HB2 GLN A 107 22.134 -6.477 -28.727 1.00 0.00 H new ATOM 0 HB3 GLN A 107 22.223 -7.218 -30.312 1.00 0.00 H new ATOM 0 HG2 GLN A 107 23.438 -9.191 -29.225 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.095 -8.466 -27.667 1.00 0.00 H new ATOM 0 HE21 GLN A 107 20.963 -8.652 -26.786 1.00 0.00 H new ATOM 0 HE22 GLN A 107 19.663 -9.503 -27.626 1.00 0.00 H new ATOM 1594 N SER A 108 23.268 -4.983 -31.263 1.00 0.00 N ATOM 1595 CA SER A 108 23.174 -3.748 -32.058 1.00 0.00 C ATOM 1596 C SER A 108 22.341 -2.671 -31.356 1.00 0.00 C ATOM 1597 O SER A 108 21.514 -2.963 -30.492 1.00 0.00 O ATOM 1598 CB SER A 108 22.621 -4.073 -33.457 1.00 0.00 C ATOM 1599 OG SER A 108 22.597 -2.913 -34.276 1.00 0.00 O ATOM 0 H SER A 108 22.656 -5.726 -31.599 1.00 0.00 H new ATOM 0 HA SER A 108 24.176 -3.333 -32.165 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.236 -4.841 -33.926 1.00 0.00 H new ATOM 0 HB3 SER A 108 21.614 -4.481 -33.368 1.00 0.00 H new ATOM 0 HG SER A 108 22.244 -3.144 -35.160 1.00 0.00 H new ATOM 1605 N LEU A 109 22.491 -1.411 -31.770 1.00 0.00 N ATOM 1606 CA LEU A 109 21.720 -0.282 -31.234 1.00 0.00 C ATOM 1607 C LEU A 109 20.233 -0.385 -31.598 1.00 0.00 C ATOM 1608 O LEU A 109 19.381 0.034 -30.821 1.00 0.00 O ATOM 1609 CB LEU A 109 22.399 1.040 -31.634 1.00 0.00 C ATOM 1610 CG LEU A 109 23.539 1.428 -30.664 1.00 0.00 C ATOM 1611 CD1 LEU A 109 24.615 0.349 -30.451 1.00 0.00 C ATOM 1612 CD2 LEU A 109 24.228 2.696 -31.166 1.00 0.00 C ATOM 0 H LEU A 109 23.157 -1.141 -32.494 1.00 0.00 H new ATOM 0 HA LEU A 109 21.724 -0.311 -30.144 1.00 0.00 H new ATOM 0 HB2 LEU A 109 22.799 0.950 -32.644 1.00 0.00 H new ATOM 0 HB3 LEU A 109 21.655 1.837 -31.655 1.00 0.00 H new ATOM 0 HG LEU A 109 23.052 1.572 -29.700 1.00 0.00 H new ATOM 0 HD11 LEU A 109 25.368 0.719 -29.755 1.00 0.00 H new ATOM 0 HD12 LEU A 109 24.153 -0.550 -30.042 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.087 0.113 -31.405 1.00 0.00 H new ATOM 0 HD21 LEU A 109 25.031 2.969 -30.482 1.00 0.00 H new ATOM 0 HD22 LEU A 109 24.642 2.517 -32.158 1.00 0.00 H new ATOM 0 HD23 LEU A 109 23.503 3.508 -31.217 1.00 0.00 H new ATOM 1624 N GLU A 110 19.889 -1.076 -32.684 1.00 0.00 N ATOM 1625 CA GLU A 110 18.496 -1.426 -32.985 1.00 0.00 C ATOM 1626 C GLU A 110 17.916 -2.376 -31.918 1.00 0.00 C ATOM 1627 O GLU A 110 16.731 -2.298 -31.596 1.00 0.00 O ATOM 1628 CB GLU A 110 18.428 -2.035 -34.394 1.00 0.00 C ATOM 1629 CG GLU A 110 16.986 -2.252 -34.868 1.00 0.00 C ATOM 1630 CD GLU A 110 16.955 -2.729 -36.334 1.00 0.00 C ATOM 1631 OE1 GLU A 110 17.035 -3.956 -36.580 1.00 0.00 O ATOM 1632 OE2 GLU A 110 16.842 -1.882 -37.253 1.00 0.00 O ATOM 0 H GLU A 110 20.560 -1.408 -33.377 1.00 0.00 H new ATOM 0 HA GLU A 110 17.881 -0.526 -32.962 1.00 0.00 H new ATOM 0 HB2 GLU A 110 18.943 -1.379 -35.096 1.00 0.00 H new ATOM 0 HB3 GLU A 110 18.957 -2.988 -34.401 1.00 0.00 H new ATOM 0 HG2 GLU A 110 16.497 -2.989 -34.231 1.00 0.00 H new ATOM 0 HG3 GLU A 110 16.423 -1.323 -34.771 1.00 0.00 H new ATOM 1639 N VAL A 111 18.749 -3.211 -31.277 1.00 0.00 N ATOM 1640 CA VAL A 111 18.332 -4.061 -30.149 1.00 0.00 C ATOM 1641 C VAL A 111 18.093 -3.225 -28.890 1.00 0.00 C ATOM 1642 O VAL A 111 17.105 -3.470 -28.210 1.00 0.00 O ATOM 1643 CB VAL A 111 19.272 -5.260 -29.904 1.00 0.00 C ATOM 1644 CG1 VAL A 111 18.669 -6.223 -28.875 1.00 0.00 C ATOM 1645 CG2 VAL A 111 19.479 -6.060 -31.198 1.00 0.00 C ATOM 0 H VAL A 111 19.732 -3.316 -31.526 1.00 0.00 H new ATOM 0 HA VAL A 111 17.379 -4.510 -30.428 1.00 0.00 H new ATOM 0 HB VAL A 111 20.218 -4.854 -29.544 1.00 0.00 H new ATOM 0 HG11 VAL A 111 19.349 -7.060 -28.718 1.00 0.00 H new ATOM 0 HG12 VAL A 111 18.516 -5.698 -27.932 1.00 0.00 H new ATOM 0 HG13 VAL A 111 17.713 -6.596 -29.242 1.00 0.00 H new ATOM 0 HG21 VAL A 111 20.145 -6.901 -31.003 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.518 -6.433 -31.553 1.00 0.00 H new ATOM 0 HG23 VAL A 111 19.921 -5.415 -31.958 1.00 0.00 H new ATOM 1655 N PHE A 112 18.877 -2.170 -28.615 1.00 0.00 N ATOM 1656 CA PHE A 112 18.551 -1.200 -27.542 1.00 0.00 C ATOM 1657 C PHE A 112 17.182 -0.550 -27.803 1.00 0.00 C ATOM 1658 O PHE A 112 16.324 -0.518 -26.925 1.00 0.00 O ATOM 1659 CB PHE A 112 19.630 -0.098 -27.417 1.00 0.00 C ATOM 1660 CG PHE A 112 20.889 -0.451 -26.645 1.00 0.00 C ATOM 1661 CD1 PHE A 112 21.989 -1.039 -27.297 1.00 0.00 C ATOM 1662 CD2 PHE A 112 20.983 -0.146 -25.274 1.00 0.00 C ATOM 1663 CE1 PHE A 112 23.176 -1.298 -26.594 1.00 0.00 C ATOM 1664 CE2 PHE A 112 22.168 -0.423 -24.566 1.00 0.00 C ATOM 1665 CZ PHE A 112 23.267 -0.991 -25.228 1.00 0.00 C ATOM 0 H PHE A 112 19.741 -1.962 -29.116 1.00 0.00 H new ATOM 0 HA PHE A 112 18.520 -1.755 -26.604 1.00 0.00 H new ATOM 0 HB2 PHE A 112 19.923 0.205 -28.422 1.00 0.00 H new ATOM 0 HB3 PHE A 112 19.174 0.771 -26.942 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.919 -1.292 -28.345 1.00 0.00 H new ATOM 0 HD2 PHE A 112 20.143 0.302 -24.764 1.00 0.00 H new ATOM 0 HE1 PHE A 112 24.021 -1.735 -27.106 1.00 0.00 H new ATOM 0 HE2 PHE A 112 22.231 -0.198 -23.512 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.180 -1.191 -24.688 1.00 0.00 H new ATOM 1675 N ARG A 113 16.944 -0.102 -29.042 1.00 0.00 N ATOM 1676 CA ARG A 113 15.692 0.572 -29.455 1.00 0.00 C ATOM 1677 C ARG A 113 14.482 -0.376 -29.543 1.00 0.00 C ATOM 1678 O ARG A 113 13.348 0.083 -29.459 1.00 0.00 O ATOM 1679 CB ARG A 113 15.936 1.333 -30.779 1.00 0.00 C ATOM 1680 CG ARG A 113 17.026 2.411 -30.628 1.00 0.00 C ATOM 1681 CD ARG A 113 17.327 3.150 -31.941 1.00 0.00 C ATOM 1682 NE ARG A 113 16.325 4.200 -32.213 1.00 0.00 N ATOM 1683 CZ ARG A 113 16.232 5.378 -31.617 1.00 0.00 C ATOM 1684 NH1 ARG A 113 17.102 5.783 -30.741 1.00 0.00 N ATOM 1685 NH2 ARG A 113 15.241 6.180 -31.861 1.00 0.00 N ATOM 0 H ARG A 113 17.620 -0.195 -29.800 1.00 0.00 H new ATOM 0 HA ARG A 113 15.424 1.284 -28.674 1.00 0.00 H new ATOM 0 HB2 ARG A 113 16.229 0.626 -31.555 1.00 0.00 H new ATOM 0 HB3 ARG A 113 15.007 1.799 -31.107 1.00 0.00 H new ATOM 0 HG2 ARG A 113 16.712 3.134 -29.875 1.00 0.00 H new ATOM 0 HG3 ARG A 113 17.941 1.946 -30.262 1.00 0.00 H new ATOM 0 HD2 ARG A 113 18.319 3.598 -31.889 1.00 0.00 H new ATOM 0 HD3 ARG A 113 17.342 2.437 -32.766 1.00 0.00 H new ATOM 0 HE ARG A 113 15.633 3.996 -32.935 1.00 0.00 H new ATOM 0 HH11 ARG A 113 17.890 5.186 -30.492 1.00 0.00 H new ATOM 0 HH12 ARG A 113 16.997 6.698 -30.303 1.00 0.00 H new ATOM 0 HH21 ARG A 113 14.515 5.907 -32.523 1.00 0.00 H new ATOM 0 HH22 ARG A 113 15.188 7.084 -31.391 1.00 0.00 H new ATOM 1699 N THR A 114 14.720 -1.689 -29.619 1.00 0.00 N ATOM 1700 CA THR A 114 13.704 -2.753 -29.511 1.00 0.00 C ATOM 1701 C THR A 114 13.419 -3.127 -28.050 1.00 0.00 C ATOM 1702 O THR A 114 12.271 -3.088 -27.613 1.00 0.00 O ATOM 1703 CB THR A 114 14.116 -3.997 -30.324 1.00 0.00 C ATOM 1704 OG1 THR A 114 14.327 -3.651 -31.676 1.00 0.00 O ATOM 1705 CG2 THR A 114 13.049 -5.096 -30.320 1.00 0.00 C ATOM 0 H THR A 114 15.660 -2.059 -29.763 1.00 0.00 H new ATOM 0 HA THR A 114 12.780 -2.358 -29.933 1.00 0.00 H new ATOM 0 HB THR A 114 15.023 -4.369 -29.847 1.00 0.00 H new ATOM 0 HG1 THR A 114 15.199 -3.213 -31.769 1.00 0.00 H new ATOM 0 HG21 THR A 114 13.398 -5.944 -30.909 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.862 -5.418 -29.296 1.00 0.00 H new ATOM 0 HG23 THR A 114 12.126 -4.709 -30.753 1.00 0.00 H new ATOM 1713 N VAL A 115 14.456 -3.449 -27.263 1.00 0.00 N ATOM 1714 CA VAL A 115 14.344 -3.925 -25.865 1.00 0.00 C ATOM 1715 C VAL A 115 13.733 -2.867 -24.952 1.00 0.00 C ATOM 1716 O VAL A 115 12.960 -3.226 -24.071 1.00 0.00 O ATOM 1717 CB VAL A 115 15.708 -4.459 -25.354 1.00 0.00 C ATOM 1718 CG1 VAL A 115 15.715 -4.767 -23.853 1.00 0.00 C ATOM 1719 CG2 VAL A 115 16.076 -5.766 -26.069 1.00 0.00 C ATOM 0 H VAL A 115 15.422 -3.386 -27.583 1.00 0.00 H new ATOM 0 HA VAL A 115 13.650 -4.765 -25.845 1.00 0.00 H new ATOM 0 HB VAL A 115 16.422 -3.662 -25.561 1.00 0.00 H new ATOM 0 HG11 VAL A 115 16.698 -5.136 -23.562 1.00 0.00 H new ATOM 0 HG12 VAL A 115 15.488 -3.859 -23.294 1.00 0.00 H new ATOM 0 HG13 VAL A 115 14.963 -5.525 -23.634 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.036 -6.126 -25.698 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.308 -6.515 -25.876 1.00 0.00 H new ATOM 0 HG23 VAL A 115 16.146 -5.587 -27.142 1.00 0.00 H new ATOM 1729 N ARG A 116 13.952 -1.568 -25.204 1.00 0.00 N ATOM 1730 CA ARG A 116 13.344 -0.477 -24.405 1.00 0.00 C ATOM 1731 C ARG A 116 11.814 -0.574 -24.303 1.00 0.00 C ATOM 1732 O ARG A 116 11.259 -0.493 -23.216 1.00 0.00 O ATOM 1733 CB ARG A 116 13.853 0.883 -24.934 1.00 0.00 C ATOM 1734 CG ARG A 116 13.204 1.397 -26.225 1.00 0.00 C ATOM 1735 CD ARG A 116 13.860 2.700 -26.699 1.00 0.00 C ATOM 1736 NE ARG A 116 13.277 3.131 -27.987 1.00 0.00 N ATOM 1737 CZ ARG A 116 13.441 4.298 -28.587 1.00 0.00 C ATOM 1738 NH1 ARG A 116 14.259 5.202 -28.139 1.00 0.00 N ATOM 1739 NH2 ARG A 116 12.780 4.587 -29.667 1.00 0.00 N ATOM 0 H ARG A 116 14.551 -1.238 -25.961 1.00 0.00 H new ATOM 0 HA ARG A 116 13.670 -0.580 -23.370 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.703 1.631 -24.155 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.928 0.805 -25.099 1.00 0.00 H new ATOM 0 HG2 ARG A 116 13.290 0.640 -27.004 1.00 0.00 H new ATOM 0 HG3 ARG A 116 12.140 1.563 -26.058 1.00 0.00 H new ATOM 0 HD2 ARG A 116 13.719 3.479 -25.950 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.935 2.555 -26.809 1.00 0.00 H new ATOM 0 HE ARG A 116 12.683 2.454 -28.466 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.803 5.024 -27.295 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.357 6.090 -28.631 1.00 0.00 H new ATOM 0 HH21 ARG A 116 12.126 3.911 -30.061 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.915 5.490 -30.121 1.00 0.00 H new ATOM 1753 N GLY A 117 11.139 -0.874 -25.414 1.00 0.00 N ATOM 1754 CA GLY A 117 9.681 -1.063 -25.459 1.00 0.00 C ATOM 1755 C GLY A 117 9.227 -2.355 -24.772 1.00 0.00 C ATOM 1756 O GLY A 117 8.192 -2.364 -24.112 1.00 0.00 O ATOM 0 H GLY A 117 11.591 -0.995 -26.320 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.194 -0.213 -24.981 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.353 -1.075 -26.498 1.00 0.00 H new ATOM 1760 N GLN A 118 10.048 -3.414 -24.825 1.00 0.00 N ATOM 1761 CA GLN A 118 9.767 -4.682 -24.140 1.00 0.00 C ATOM 1762 C GLN A 118 9.889 -4.523 -22.620 1.00 0.00 C ATOM 1763 O GLN A 118 9.042 -4.997 -21.873 1.00 0.00 O ATOM 1764 CB GLN A 118 10.681 -5.806 -24.668 1.00 0.00 C ATOM 1765 CG GLN A 118 10.678 -5.999 -26.195 1.00 0.00 C ATOM 1766 CD GLN A 118 9.277 -6.050 -26.808 1.00 0.00 C ATOM 1767 OE1 GLN A 118 8.502 -6.966 -26.571 1.00 0.00 O ATOM 1768 NE2 GLN A 118 8.899 -5.066 -27.601 1.00 0.00 N ATOM 0 H GLN A 118 10.926 -3.414 -25.345 1.00 0.00 H new ATOM 0 HA GLN A 118 8.737 -4.966 -24.358 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.702 -5.601 -24.347 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.382 -6.744 -24.200 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.237 -5.184 -26.656 1.00 0.00 H new ATOM 0 HG3 GLN A 118 11.204 -6.923 -26.436 1.00 0.00 H new ATOM 0 HE21 GLN A 118 9.540 -4.299 -27.803 1.00 0.00 H new ATOM 0 HE22 GLN A 118 7.966 -5.072 -28.012 1.00 0.00 H new ATOM 1777 N VAL A 119 10.894 -3.774 -22.158 1.00 0.00 N ATOM 1778 CA VAL A 119 11.037 -3.371 -20.746 1.00 0.00 C ATOM 1779 C VAL A 119 9.856 -2.504 -20.320 1.00 0.00 C ATOM 1780 O VAL A 119 9.248 -2.807 -19.302 1.00 0.00 O ATOM 1781 CB VAL A 119 12.378 -2.649 -20.519 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.513 -2.078 -19.103 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.553 -3.608 -20.715 1.00 0.00 C ATOM 0 H VAL A 119 11.642 -3.424 -22.756 1.00 0.00 H new ATOM 0 HA VAL A 119 11.037 -4.266 -20.124 1.00 0.00 H new ATOM 0 HB VAL A 119 12.394 -1.837 -21.246 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.478 -1.581 -19.002 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.714 -1.359 -18.923 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.444 -2.887 -18.376 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.489 -3.075 -20.549 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.473 -4.431 -20.005 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.535 -4.003 -21.731 1.00 0.00 H new ATOM 1793 N LYS A 120 9.473 -1.486 -21.101 1.00 0.00 N ATOM 1794 CA LYS A 120 8.321 -0.607 -20.827 1.00 0.00 C ATOM 1795 C LYS A 120 7.016 -1.380 -20.684 1.00 0.00 C ATOM 1796 O LYS A 120 6.348 -1.183 -19.684 1.00 0.00 O ATOM 1797 CB LYS A 120 8.266 0.476 -21.924 1.00 0.00 C ATOM 1798 CG LYS A 120 7.207 1.566 -21.693 1.00 0.00 C ATOM 1799 CD LYS A 120 5.858 1.301 -22.388 1.00 0.00 C ATOM 1800 CE LYS A 120 4.966 2.546 -22.263 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.637 2.339 -22.903 1.00 0.00 N ATOM 0 H LYS A 120 9.964 -1.242 -21.961 1.00 0.00 H new ATOM 0 HA LYS A 120 8.455 -0.123 -19.859 1.00 0.00 H new ATOM 0 HB2 LYS A 120 9.245 0.949 -21.999 1.00 0.00 H new ATOM 0 HB3 LYS A 120 8.070 -0.005 -22.882 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.036 1.668 -20.621 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.602 2.519 -22.045 1.00 0.00 H new ATOM 0 HD2 LYS A 120 6.019 1.059 -23.439 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.366 0.440 -21.935 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.828 2.791 -21.210 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.464 3.398 -22.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.277 3.248 -23.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.733 1.673 -23.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.972 1.951 -22.204 1.00 0.00 H new ATOM 1815 N GLU A 121 6.648 -2.290 -21.582 1.00 0.00 N ATOM 1816 CA GLU A 121 5.393 -3.053 -21.405 1.00 0.00 C ATOM 1817 C GLU A 121 5.455 -4.048 -20.235 1.00 0.00 C ATOM 1818 O GLU A 121 4.446 -4.311 -19.575 1.00 0.00 O ATOM 1819 CB GLU A 121 4.952 -3.720 -22.717 1.00 0.00 C ATOM 1820 CG GLU A 121 5.838 -4.873 -23.196 1.00 0.00 C ATOM 1821 CD GLU A 121 5.269 -5.481 -24.494 1.00 0.00 C ATOM 1822 OE1 GLU A 121 5.461 -4.900 -25.590 1.00 0.00 O ATOM 1823 OE2 GLU A 121 4.604 -6.545 -24.420 1.00 0.00 O ATOM 0 H GLU A 121 7.178 -2.521 -22.422 1.00 0.00 H new ATOM 0 HA GLU A 121 4.624 -2.330 -21.133 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.935 -4.093 -22.592 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.919 -2.960 -23.498 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.852 -4.514 -23.369 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.899 -5.639 -22.423 1.00 0.00 H new ATOM 1830 N ARG A 122 6.654 -4.550 -19.910 1.00 0.00 N ATOM 1831 CA ARG A 122 6.887 -5.392 -18.724 1.00 0.00 C ATOM 1832 C ARG A 122 6.728 -4.596 -17.426 1.00 0.00 C ATOM 1833 O ARG A 122 5.933 -4.997 -16.578 1.00 0.00 O ATOM 1834 CB ARG A 122 8.228 -6.132 -18.861 1.00 0.00 C ATOM 1835 CG ARG A 122 8.091 -7.262 -19.899 1.00 0.00 C ATOM 1836 CD ARG A 122 9.435 -7.940 -20.190 1.00 0.00 C ATOM 1837 NE ARG A 122 9.256 -9.088 -21.108 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.756 -10.287 -20.852 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.381 -10.654 -19.658 1.00 0.00 N ATOM 1840 NH2 ARG A 122 8.635 -11.160 -21.808 1.00 0.00 N ATOM 0 H ARG A 122 7.495 -4.384 -20.463 1.00 0.00 H new ATOM 0 HA ARG A 122 6.118 -6.162 -18.666 1.00 0.00 H new ATOM 0 HB2 ARG A 122 9.009 -5.436 -19.167 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.528 -6.544 -17.897 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.381 -8.005 -19.535 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.681 -6.857 -20.824 1.00 0.00 H new ATOM 0 HD2 ARG A 122 10.123 -7.219 -20.632 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.885 -8.281 -19.258 1.00 0.00 H new ATOM 0 HE ARG A 122 9.560 -8.934 -22.070 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.468 -10.006 -18.875 1.00 0.00 H new ATOM 0 HH12 ARG A 122 8.001 -11.589 -19.508 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.925 -10.921 -22.756 1.00 0.00 H new ATOM 0 HH22 ARG A 122 8.250 -12.083 -21.610 1.00 0.00 H new ATOM 1854 N VAL A 123 7.356 -3.422 -17.304 1.00 0.00 N ATOM 1855 CA VAL A 123 7.103 -2.511 -16.169 1.00 0.00 C ATOM 1856 C VAL A 123 5.653 -2.021 -16.122 1.00 0.00 C ATOM 1857 O VAL A 123 5.062 -2.035 -15.049 1.00 0.00 O ATOM 1858 CB VAL A 123 8.112 -1.349 -16.081 1.00 0.00 C ATOM 1859 CG1 VAL A 123 9.543 -1.857 -15.875 1.00 0.00 C ATOM 1860 CG2 VAL A 123 8.152 -0.364 -17.226 1.00 0.00 C ATOM 0 H VAL A 123 8.043 -3.075 -17.973 1.00 0.00 H new ATOM 0 HA VAL A 123 7.262 -3.112 -15.274 1.00 0.00 H new ATOM 0 HB VAL A 123 7.726 -0.801 -15.221 1.00 0.00 H new ATOM 0 HG11 VAL A 123 10.225 -1.009 -15.818 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.596 -2.429 -14.949 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.827 -2.495 -16.712 1.00 0.00 H new ATOM 0 HG21 VAL A 123 8.907 0.396 -17.026 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.401 -0.888 -18.149 1.00 0.00 H new ATOM 0 HG23 VAL A 123 7.177 0.112 -17.331 1.00 0.00 H new ATOM 1870 N GLU A 124 5.030 -1.659 -17.245 1.00 0.00 N ATOM 1871 CA GLU A 124 3.666 -1.143 -17.274 1.00 0.00 C ATOM 1872 C GLU A 124 2.641 -2.174 -16.797 1.00 0.00 C ATOM 1873 O GLU A 124 1.866 -1.876 -15.892 1.00 0.00 O ATOM 1874 CB GLU A 124 3.341 -0.673 -18.699 1.00 0.00 C ATOM 1875 CG GLU A 124 2.266 0.403 -18.668 1.00 0.00 C ATOM 1876 CD GLU A 124 1.574 0.552 -20.039 1.00 0.00 C ATOM 1877 OE1 GLU A 124 2.259 0.877 -21.038 1.00 0.00 O ATOM 1878 OE2 GLU A 124 0.337 0.352 -20.124 1.00 0.00 O ATOM 0 H GLU A 124 5.464 -1.717 -18.166 1.00 0.00 H new ATOM 0 HA GLU A 124 3.604 -0.304 -16.581 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.241 -0.284 -19.175 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.003 -1.517 -19.299 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.523 0.155 -17.910 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.711 1.355 -18.379 1.00 0.00 H new ATOM 1885 N ASN A 125 2.657 -3.402 -17.335 1.00 0.00 N ATOM 1886 CA ASN A 125 1.662 -4.413 -16.941 1.00 0.00 C ATOM 1887 C ASN A 125 1.869 -4.899 -15.490 1.00 0.00 C ATOM 1888 O ASN A 125 0.892 -5.183 -14.797 1.00 0.00 O ATOM 1889 CB ASN A 125 1.576 -5.553 -17.976 1.00 0.00 C ATOM 1890 CG ASN A 125 2.454 -6.746 -17.639 1.00 0.00 C ATOM 1891 OD1 ASN A 125 2.040 -7.693 -16.991 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.705 -6.710 -18.020 1.00 0.00 N ATOM 0 H ASN A 125 3.333 -3.716 -18.031 1.00 0.00 H new ATOM 0 HA ASN A 125 0.682 -3.936 -16.942 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.541 -5.885 -18.054 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.862 -5.167 -18.954 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.335 -7.474 -17.775 1.00 0.00 H new ATOM 0 HD22 ASN A 125 4.051 -5.918 -18.562 1.00 0.00 H new ATOM 1899 N LEU A 126 3.123 -4.917 -15.005 1.00 0.00 N ATOM 1900 CA LEU A 126 3.439 -5.158 -13.594 1.00 0.00 C ATOM 1901 C LEU A 126 2.889 -4.032 -12.716 1.00 0.00 C ATOM 1902 O LEU A 126 2.205 -4.291 -11.732 1.00 0.00 O ATOM 1903 CB LEU A 126 4.966 -5.349 -13.458 1.00 0.00 C ATOM 1904 CG LEU A 126 5.555 -5.620 -12.054 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.747 -4.363 -11.206 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.741 -6.639 -11.258 1.00 0.00 C ATOM 0 H LEU A 126 3.947 -4.764 -15.587 1.00 0.00 H new ATOM 0 HA LEU A 126 2.954 -6.068 -13.241 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.255 -6.178 -14.104 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.448 -4.455 -13.852 1.00 0.00 H new ATOM 0 HG LEU A 126 6.541 -6.034 -12.264 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.164 -4.638 -10.237 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.429 -3.682 -11.714 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.785 -3.871 -11.061 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.201 -6.789 -10.281 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.724 -6.270 -11.127 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.716 -7.586 -11.797 1.00 0.00 H new ATOM 1918 N ILE A 127 3.149 -2.773 -13.060 1.00 0.00 N ATOM 1919 CA ILE A 127 2.750 -1.644 -12.212 1.00 0.00 C ATOM 1920 C ILE A 127 1.227 -1.471 -12.209 1.00 0.00 C ATOM 1921 O ILE A 127 0.638 -1.286 -11.146 1.00 0.00 O ATOM 1922 CB ILE A 127 3.527 -0.384 -12.645 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.022 -0.557 -12.275 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.983 0.912 -12.017 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.973 0.405 -12.993 1.00 0.00 C ATOM 0 H ILE A 127 3.633 -2.505 -13.917 1.00 0.00 H new ATOM 0 HA ILE A 127 3.014 -1.839 -11.173 1.00 0.00 H new ATOM 0 HB ILE A 127 3.402 -0.283 -13.723 1.00 0.00 H new ATOM 0 HG12 ILE A 127 5.134 -0.422 -11.199 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.322 -1.580 -12.501 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.574 1.760 -12.363 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.943 1.050 -12.312 1.00 0.00 H new ATOM 0 HG23 ILE A 127 3.046 0.845 -10.931 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.997 0.211 -12.673 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.896 0.257 -14.070 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.704 1.433 -12.748 1.00 0.00 H new ATOM 1937 N ALA A 128 0.570 -1.623 -13.361 1.00 0.00 N ATOM 1938 CA ALA A 128 -0.879 -1.458 -13.509 1.00 0.00 C ATOM 1939 C ALA A 128 -1.708 -2.462 -12.683 1.00 0.00 C ATOM 1940 O ALA A 128 -2.830 -2.141 -12.283 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.221 -1.538 -15.003 1.00 0.00 C ATOM 0 H ALA A 128 1.038 -1.869 -14.233 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.152 -0.483 -13.106 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.296 -1.418 -15.137 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.698 -0.746 -15.539 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.913 -2.507 -15.395 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.157 -3.655 -12.390 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.809 -4.665 -11.535 1.00 0.00 C ATOM 1949 C LYS A 129 -1.509 -4.521 -10.033 1.00 0.00 C ATOM 1950 O LYS A 129 -2.270 -5.065 -9.230 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.563 -6.091 -12.066 1.00 0.00 C ATOM 1952 CG LYS A 129 -0.143 -6.615 -11.829 1.00 0.00 C ATOM 1953 CD LYS A 129 0.017 -8.039 -12.369 1.00 0.00 C ATOM 1954 CE LYS A 129 1.448 -8.529 -12.112 1.00 0.00 C ATOM 1955 NZ LYS A 129 1.605 -9.958 -12.513 1.00 0.00 N ATOM 0 H LYS A 129 -0.245 -3.946 -12.741 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.879 -4.468 -11.605 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.272 -6.770 -11.592 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.771 -6.109 -13.136 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.577 -5.956 -12.314 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.080 -6.600 -10.762 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.698 -8.705 -11.886 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -0.199 -8.060 -13.437 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.153 -7.912 -12.669 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.691 -8.415 -11.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.608 -10.226 -12.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.050 -10.561 -11.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.267 -10.084 -13.488 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.439 -3.804 -9.640 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.067 -3.643 -8.210 1.00 0.00 C ATOM 1971 C ILE A 130 -0.385 -2.259 -7.614 1.00 0.00 C ATOM 1972 O ILE A 130 -0.429 -2.127 -6.390 1.00 0.00 O ATOM 1973 CB ILE A 130 1.395 -4.063 -7.930 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.431 -3.037 -8.428 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.661 -5.461 -8.513 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.875 -3.387 -8.047 1.00 0.00 C ATOM 0 H ILE A 130 0.186 -3.325 -10.288 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.721 -4.337 -7.683 1.00 0.00 H new ATOM 0 HB ILE A 130 1.517 -4.098 -6.847 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.359 -2.958 -9.513 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.184 -2.057 -8.020 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.693 -5.749 -8.311 1.00 0.00 H new ATOM 0 HG22 ILE A 130 0.986 -6.182 -8.052 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.493 -5.444 -9.590 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.548 -2.621 -8.431 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.963 -3.437 -6.962 1.00 0.00 H new ATOM 0 HD13 ILE A 130 4.141 -4.352 -8.477 1.00 0.00 H new ATOM 1988 N SER A 131 -0.594 -1.240 -8.459 1.00 0.00 N ATOM 1989 CA SER A 131 -0.928 0.140 -8.049 1.00 0.00 C ATOM 1990 C SER A 131 -2.234 0.234 -7.247 1.00 0.00 C ATOM 1991 O SER A 131 -3.265 -0.334 -7.684 1.00 0.00 O ATOM 1992 CB SER A 131 -1.035 1.058 -9.263 1.00 0.00 C ATOM 1993 OG SER A 131 0.203 1.099 -9.947 1.00 0.00 O ATOM 1994 OXT SER A 131 -2.234 0.901 -6.186 1.00 0.00 O ATOM 0 H SER A 131 -0.535 -1.350 -9.471 1.00 0.00 H new ATOM 0 HA SER A 131 -0.111 0.459 -7.401 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.818 0.701 -9.932 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.319 2.062 -8.947 1.00 0.00 H new ATOM 0 HG SER A 131 0.426 0.202 -10.273 1.00 0.00 H new TER 2000 SER A 131