USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 990 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 ASN : amide:sc= 0.479 X(o=-0.22,f=-0.47) USER MOD Set 1.2: A 60 GLN : amide:sc= -0.698 K(o=-0.22,f=-5.8!) USER MOD Set 2.1: A 35 SER OG : rot -163:sc= 1.75 USER MOD Set 2.2: A 62 SER OG : rot 114:sc= 0.619 USER MOD Set 3.1: A 5 MET CE :methyl 174:sc= -0.516 (180deg=-0.656) USER MOD Set 3.2: A 73 TYR OH : rot 30:sc= 0 USER MOD Single : A 1 MET CE :methyl 164:sc= 0 (180deg=-0.109) USER MOD Single : A 1 MET N :NH3+ 153:sc= 0.004 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -163:sc= 1.25 (180deg=1.2) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -38:sc= 0.25 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 130:sc=-0.00856 USER MOD Single : A 16 GLN : amide:sc= 0.838 K(o=0.84,f=-9.9!) USER MOD Single : A 17 MET CE :methyl -173:sc= -1.3 (180deg=-1.44) USER MOD Single : A 23 LYS NZ :NH3+ 178:sc= 2.18 (180deg=2.05) USER MOD Single : A 24 THR OG1 : rot -150:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 74:sc= 0.572 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0378 USER MOD Single : A 40 SER OG : rot 27:sc= 0.634 USER MOD Single : A 43 HIS : no HD1:sc= -0.466 X(o=-0.47,f=-0.2) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 133:sc= -1.43 (180deg=-1.62) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0363 USER MOD Single : A 61 THR OG1 : rot 52:sc= 0.0841 USER MOD Single : A 67 ASN : amide:sc= 1.18 K(o=1.2,f=-0.0082) USER MOD Single : A 69 ASN : amide:sc= 0.311 K(o=0.31,f=-6.7!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.15 X(o=-0.15,f=-0.15) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0296 USER MOD Single : A 93 GLN : amide:sc= 0.118 K(o=0.12,f=-4.6!) USER MOD Single : A 100 GLN : amide:sc= -0.226 K(o=-0.23,f=-5!) USER MOD Single : A 107 GLN : amide:sc= 0.0621 K(o=0.062,f=-0.98) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 85:sc= 0.65 USER MOD Single : A 118 GLN : amide:sc= 0.998 K(o=1,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.391 K(o=-0.39,f=-3!) USER MOD Single : A 129 LYS NZ :NH3+ -167:sc= 1.29 (180deg=1.26) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.754 -0.266 0.868 1.00 0.00 N ATOM 2 CA MET A 1 2.489 -0.145 -0.432 1.00 0.00 C ATOM 3 C MET A 1 2.587 -1.515 -1.128 1.00 0.00 C ATOM 4 O MET A 1 2.803 -2.530 -0.464 1.00 0.00 O ATOM 5 CB MET A 1 3.910 0.463 -0.247 1.00 0.00 C ATOM 6 CG MET A 1 4.139 1.768 -1.020 1.00 0.00 C ATOM 7 SD MET A 1 5.518 2.760 -0.385 1.00 0.00 S ATOM 8 CE MET A 1 5.825 3.803 -1.835 1.00 0.00 C ATOM 0 H1 MET A 1 2.070 0.483 1.516 1.00 0.00 H new ATOM 0 H2 MET A 1 0.732 -0.170 0.699 1.00 0.00 H new ATOM 0 H3 MET A 1 1.949 -1.195 1.292 1.00 0.00 H new ATOM 0 HA MET A 1 1.917 0.537 -1.061 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.079 0.647 0.814 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.651 -0.270 -0.565 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.326 1.531 -2.068 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.228 2.365 -0.986 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.437 4.658 -1.546 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.348 3.224 -2.596 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.875 4.156 -2.237 1.00 0.00 H new ATOM 18 N LYS A 2 2.502 -1.562 -2.467 1.00 0.00 N ATOM 19 CA LYS A 2 2.764 -2.790 -3.239 1.00 0.00 C ATOM 20 C LYS A 2 4.278 -2.901 -3.335 1.00 0.00 C ATOM 21 O LYS A 2 4.886 -1.986 -3.882 1.00 0.00 O ATOM 22 CB LYS A 2 2.077 -2.754 -4.627 1.00 0.00 C ATOM 23 CG LYS A 2 0.634 -2.212 -4.589 1.00 0.00 C ATOM 24 CD LYS A 2 0.014 -2.131 -5.992 1.00 0.00 C ATOM 25 CE LYS A 2 -1.076 -1.045 -6.093 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.368 -1.441 -5.461 1.00 0.00 N ATOM 0 H LYS A 2 2.252 -0.758 -3.042 1.00 0.00 H new ATOM 0 HA LYS A 2 2.344 -3.669 -2.750 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.670 -2.136 -5.301 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.067 -3.761 -5.044 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.021 -2.856 -3.958 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.630 -1.222 -4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.798 -1.924 -6.721 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.416 -3.098 -6.252 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.714 -0.132 -5.620 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.250 -0.812 -7.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.056 -0.668 -5.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.735 -2.295 -5.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.215 -1.636 -4.451 1.00 0.00 H new ATOM 40 N LYS A 3 4.904 -3.942 -2.789 1.00 0.00 N ATOM 41 CA LYS A 3 6.358 -4.104 -2.928 1.00 0.00 C ATOM 42 C LYS A 3 6.645 -4.730 -4.277 1.00 0.00 C ATOM 43 O LYS A 3 5.876 -5.592 -4.707 1.00 0.00 O ATOM 44 CB LYS A 3 7.001 -4.884 -1.777 1.00 0.00 C ATOM 45 CG LYS A 3 6.616 -4.278 -0.427 1.00 0.00 C ATOM 46 CD LYS A 3 7.433 -4.889 0.709 1.00 0.00 C ATOM 47 CE LYS A 3 7.001 -4.174 1.990 1.00 0.00 C ATOM 48 NZ LYS A 3 7.618 -4.789 3.192 1.00 0.00 N ATOM 0 H LYS A 3 4.441 -4.677 -2.254 1.00 0.00 H new ATOM 0 HA LYS A 3 6.819 -3.118 -2.874 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.684 -5.926 -1.816 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.085 -4.876 -1.888 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.774 -3.200 -0.452 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.554 -4.441 -0.242 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.252 -5.961 0.784 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.501 -4.758 0.533 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.282 -3.122 1.933 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.915 -4.209 2.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.100 -4.486 4.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.576 -5.825 3.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.611 -4.487 3.266 1.00 0.00 H new ATOM 62 N VAL A 4 7.735 -4.314 -4.912 1.00 0.00 N ATOM 63 CA VAL A 4 8.034 -4.641 -6.296 1.00 0.00 C ATOM 64 C VAL A 4 9.481 -5.121 -6.448 1.00 0.00 C ATOM 65 O VAL A 4 10.392 -4.604 -5.802 1.00 0.00 O ATOM 66 CB VAL A 4 7.753 -3.423 -7.206 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.510 -3.841 -8.664 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.571 -2.544 -6.786 1.00 0.00 C ATOM 0 H VAL A 4 8.445 -3.731 -4.470 1.00 0.00 H new ATOM 0 HA VAL A 4 7.383 -5.459 -6.605 1.00 0.00 H new ATOM 0 HB VAL A 4 8.663 -2.832 -7.101 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.317 -2.955 -9.269 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.391 -4.356 -9.046 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.650 -4.509 -8.713 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.462 -1.720 -7.491 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.658 -3.140 -6.780 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.750 -2.146 -5.787 1.00 0.00 H new ATOM 78 N MET A 5 9.691 -6.066 -7.359 1.00 0.00 N ATOM 79 CA MET A 5 11.004 -6.501 -7.841 1.00 0.00 C ATOM 80 C MET A 5 10.945 -6.669 -9.358 1.00 0.00 C ATOM 81 O MET A 5 9.934 -7.143 -9.874 1.00 0.00 O ATOM 82 CB MET A 5 11.461 -7.839 -7.248 1.00 0.00 C ATOM 83 CG MET A 5 11.756 -7.812 -5.751 1.00 0.00 C ATOM 84 SD MET A 5 13.084 -8.966 -5.298 1.00 0.00 S ATOM 85 CE MET A 5 13.065 -8.755 -3.502 1.00 0.00 C ATOM 0 H MET A 5 8.923 -6.572 -7.801 1.00 0.00 H new ATOM 0 HA MET A 5 11.715 -5.735 -7.531 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.690 -8.586 -7.438 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.358 -8.165 -7.774 1.00 0.00 H new ATOM 0 HG2 MET A 5 12.037 -6.801 -5.455 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.851 -8.066 -5.199 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.749 -9.470 -3.044 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.379 -7.742 -3.251 1.00 0.00 H new ATOM 0 HE3 MET A 5 12.056 -8.926 -3.126 1.00 0.00 H new ATOM 95 N PHE A 6 12.042 -6.362 -10.051 1.00 0.00 N ATOM 96 CA PHE A 6 12.266 -6.642 -11.461 1.00 0.00 C ATOM 97 C PHE A 6 13.667 -7.222 -11.526 1.00 0.00 C ATOM 98 O PHE A 6 14.624 -6.541 -11.163 1.00 0.00 O ATOM 99 CB PHE A 6 12.186 -5.381 -12.329 1.00 0.00 C ATOM 100 CG PHE A 6 10.901 -4.595 -12.264 1.00 0.00 C ATOM 101 CD1 PHE A 6 10.672 -3.730 -11.183 1.00 0.00 C ATOM 102 CD2 PHE A 6 9.967 -4.683 -13.313 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.499 -2.961 -11.142 1.00 0.00 C ATOM 104 CE2 PHE A 6 8.800 -3.899 -13.277 1.00 0.00 C ATOM 105 CZ PHE A 6 8.563 -3.045 -12.185 1.00 0.00 C ATOM 0 H PHE A 6 12.835 -5.888 -9.619 1.00 0.00 H new ATOM 0 HA PHE A 6 11.501 -7.317 -11.845 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.004 -4.720 -12.044 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.356 -5.670 -13.366 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.396 -3.656 -10.385 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.146 -5.350 -14.143 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.316 -2.303 -10.306 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.087 -3.953 -14.086 1.00 0.00 H new ATOM 0 HZ PHE A 6 7.660 -2.453 -12.149 1.00 0.00 H new ATOM 115 N VAL A 7 13.805 -8.469 -11.961 1.00 0.00 N ATOM 116 CA VAL A 7 15.071 -9.168 -11.825 1.00 0.00 C ATOM 117 C VAL A 7 15.214 -10.203 -12.939 1.00 0.00 C ATOM 118 O VAL A 7 14.230 -10.661 -13.513 1.00 0.00 O ATOM 119 CB VAL A 7 15.147 -9.730 -10.378 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.858 -10.444 -9.926 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.351 -10.645 -10.115 1.00 0.00 C ATOM 0 H VAL A 7 13.063 -9.010 -12.406 1.00 0.00 H new ATOM 0 HA VAL A 7 15.931 -8.510 -11.952 1.00 0.00 H new ATOM 0 HB VAL A 7 15.277 -8.830 -9.777 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.983 -10.810 -8.907 1.00 0.00 H new ATOM 0 HG12 VAL A 7 13.023 -9.744 -9.960 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.655 -11.283 -10.591 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.326 -10.992 -9.082 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.310 -11.502 -10.787 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.274 -10.091 -10.289 1.00 0.00 H new ATOM 131 N CYS A 8 16.452 -10.549 -13.265 1.00 0.00 N ATOM 132 CA CYS A 8 16.856 -11.650 -14.122 1.00 0.00 C ATOM 133 C CYS A 8 18.108 -12.235 -13.458 1.00 0.00 C ATOM 134 O CYS A 8 18.757 -11.543 -12.667 1.00 0.00 O ATOM 135 CB CYS A 8 17.135 -11.127 -15.544 1.00 0.00 C ATOM 136 SG CYS A 8 17.781 -12.356 -16.725 1.00 0.00 S ATOM 0 H CYS A 8 17.255 -10.029 -12.911 1.00 0.00 H new ATOM 0 HA CYS A 8 16.087 -12.415 -14.229 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.211 -10.714 -15.947 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.848 -10.306 -15.476 1.00 0.00 H new ATOM 141 N LYS A 9 18.467 -13.488 -13.761 1.00 0.00 N ATOM 142 CA LYS A 9 19.743 -14.049 -13.304 1.00 0.00 C ATOM 143 C LYS A 9 20.888 -13.154 -13.796 1.00 0.00 C ATOM 144 O LYS A 9 20.801 -12.607 -14.893 1.00 0.00 O ATOM 145 CB LYS A 9 19.898 -15.528 -13.723 1.00 0.00 C ATOM 146 CG LYS A 9 19.943 -15.784 -15.240 1.00 0.00 C ATOM 147 CD LYS A 9 20.159 -17.273 -15.549 1.00 0.00 C ATOM 148 CE LYS A 9 20.254 -17.493 -17.069 1.00 0.00 C ATOM 149 NZ LYS A 9 20.552 -18.910 -17.420 1.00 0.00 N ATOM 0 H LYS A 9 17.898 -14.127 -14.316 1.00 0.00 H new ATOM 0 HA LYS A 9 19.771 -14.059 -12.214 1.00 0.00 H new ATOM 0 HB2 LYS A 9 20.813 -15.920 -13.278 1.00 0.00 H new ATOM 0 HB3 LYS A 9 19.069 -16.096 -13.300 1.00 0.00 H new ATOM 0 HG2 LYS A 9 19.012 -15.447 -15.695 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.746 -15.198 -15.686 1.00 0.00 H new ATOM 0 HD2 LYS A 9 21.071 -17.623 -15.066 1.00 0.00 H new ATOM 0 HD3 LYS A 9 19.336 -17.860 -15.140 1.00 0.00 H new ATOM 0 HE2 LYS A 9 19.315 -17.196 -17.536 1.00 0.00 H new ATOM 0 HE3 LYS A 9 21.032 -16.849 -17.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 20.606 -19.008 -18.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.461 -19.188 -16.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 19.797 -19.525 -17.053 1.00 0.00 H new ATOM 163 N ARG A 10 21.936 -13.005 -12.975 1.00 0.00 N ATOM 164 CA ARG A 10 23.021 -12.030 -13.171 1.00 0.00 C ATOM 165 C ARG A 10 22.437 -10.627 -13.396 1.00 0.00 C ATOM 166 O ARG A 10 22.444 -10.128 -14.517 1.00 0.00 O ATOM 167 CB ARG A 10 24.006 -12.501 -14.269 1.00 0.00 C ATOM 168 CG ARG A 10 24.717 -13.794 -13.837 1.00 0.00 C ATOM 169 CD ARG A 10 25.743 -14.288 -14.860 1.00 0.00 C ATOM 170 NE ARG A 10 26.424 -15.477 -14.329 1.00 0.00 N ATOM 171 CZ ARG A 10 27.553 -16.038 -14.770 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.117 -15.642 -15.911 1.00 0.00 N ATOM 173 NH2 ARG A 10 28.109 -16.998 -14.043 1.00 0.00 N ATOM 0 H ARG A 10 22.057 -13.572 -12.136 1.00 0.00 H new ATOM 0 HA ARG A 10 23.624 -11.963 -12.266 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.467 -12.670 -15.201 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.743 -11.722 -14.463 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.217 -13.625 -12.883 1.00 0.00 H new ATOM 0 HG3 ARG A 10 23.973 -14.573 -13.673 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.249 -14.528 -15.801 1.00 0.00 H new ATOM 0 HD3 ARG A 10 26.469 -13.503 -15.072 1.00 0.00 H new ATOM 0 HE ARG A 10 25.982 -15.928 -13.528 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.686 -14.900 -16.462 1.00 0.00 H new ATOM 0 HH12 ARG A 10 28.979 -16.081 -16.233 1.00 0.00 H new ATOM 0 HH21 ARG A 10 27.674 -17.292 -13.169 1.00 0.00 H new ATOM 0 HH22 ARG A 10 28.971 -17.442 -14.358 1.00 0.00 H new ATOM 187 N ASN A 11 21.933 -10.019 -12.302 1.00 0.00 N ATOM 188 CA ASN A 11 21.175 -8.747 -12.245 1.00 0.00 C ATOM 189 C ASN A 11 21.552 -7.714 -13.304 1.00 0.00 C ATOM 190 O ASN A 11 20.667 -7.110 -13.903 1.00 0.00 O ATOM 191 CB ASN A 11 21.320 -8.066 -10.870 1.00 0.00 C ATOM 192 CG ASN A 11 20.413 -6.831 -10.750 1.00 0.00 C ATOM 193 OD1 ASN A 11 19.246 -6.957 -10.405 1.00 0.00 O ATOM 194 ND2 ASN A 11 20.896 -5.631 -11.045 1.00 0.00 N ATOM 0 H ASN A 11 22.051 -10.427 -11.375 1.00 0.00 H new ATOM 0 HA ASN A 11 20.149 -9.060 -12.438 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.072 -8.778 -10.083 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.358 -7.771 -10.717 1.00 0.00 H new ATOM 0 HD21 ASN A 11 20.294 -4.810 -10.984 1.00 0.00 H new ATOM 0 HD22 ASN A 11 21.869 -5.530 -11.332 1.00 0.00 H new ATOM 201 N SER A 12 22.848 -7.484 -13.504 1.00 0.00 N ATOM 202 CA SER A 12 23.366 -6.471 -14.403 1.00 0.00 C ATOM 203 C SER A 12 22.729 -6.578 -15.794 1.00 0.00 C ATOM 204 O SER A 12 22.381 -5.548 -16.368 1.00 0.00 O ATOM 205 CB SER A 12 24.891 -6.616 -14.456 1.00 0.00 C ATOM 206 OG SER A 12 25.409 -6.894 -13.157 1.00 0.00 O ATOM 0 H SER A 12 23.580 -8.013 -13.031 1.00 0.00 H new ATOM 0 HA SER A 12 23.110 -5.478 -14.033 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.163 -7.418 -15.142 1.00 0.00 H new ATOM 0 HB3 SER A 12 25.337 -5.700 -14.844 1.00 0.00 H new ATOM 0 HG SER A 12 24.907 -6.383 -12.488 1.00 0.00 H new ATOM 212 N SER A 13 22.475 -7.788 -16.301 1.00 0.00 N ATOM 213 CA SER A 13 21.761 -7.986 -17.546 1.00 0.00 C ATOM 214 C SER A 13 20.276 -7.658 -17.350 1.00 0.00 C ATOM 215 O SER A 13 19.597 -8.285 -16.539 1.00 0.00 O ATOM 216 CB SER A 13 21.969 -9.429 -18.021 1.00 0.00 C ATOM 217 OG SER A 13 23.357 -9.727 -18.115 1.00 0.00 O ATOM 0 H SER A 13 22.764 -8.656 -15.850 1.00 0.00 H new ATOM 0 HA SER A 13 22.147 -7.316 -18.314 1.00 0.00 H new ATOM 0 HB2 SER A 13 21.489 -10.119 -17.327 1.00 0.00 H new ATOM 0 HB3 SER A 13 21.494 -9.571 -18.992 1.00 0.00 H new ATOM 0 HG SER A 13 23.473 -10.652 -18.418 1.00 0.00 H new ATOM 223 N ARG A 14 19.756 -6.710 -18.135 1.00 0.00 N ATOM 224 CA ARG A 14 18.379 -6.198 -18.247 1.00 0.00 C ATOM 225 C ARG A 14 17.724 -5.664 -16.971 1.00 0.00 C ATOM 226 O ARG A 14 16.873 -4.785 -17.084 1.00 0.00 O ATOM 227 CB ARG A 14 17.455 -7.106 -19.093 1.00 0.00 C ATOM 228 CG ARG A 14 17.169 -8.522 -18.555 1.00 0.00 C ATOM 229 CD ARG A 14 18.091 -9.591 -19.161 1.00 0.00 C ATOM 230 NE ARG A 14 17.692 -9.940 -20.538 1.00 0.00 N ATOM 231 CZ ARG A 14 18.173 -10.931 -21.300 1.00 0.00 C ATOM 232 NH1 ARG A 14 19.122 -11.749 -20.853 1.00 0.00 N ATOM 233 NH2 ARG A 14 17.677 -11.091 -22.520 1.00 0.00 N ATOM 0 H ARG A 14 20.364 -6.220 -18.791 1.00 0.00 H new ATOM 0 HA ARG A 14 18.521 -5.280 -18.816 1.00 0.00 H new ATOM 0 HB2 ARG A 14 16.501 -6.594 -19.218 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.896 -7.205 -20.085 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.284 -8.523 -17.471 1.00 0.00 H new ATOM 0 HG3 ARG A 14 16.132 -8.782 -18.766 1.00 0.00 H new ATOM 0 HD2 ARG A 14 19.119 -9.227 -19.161 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.069 -10.485 -18.538 1.00 0.00 H new ATOM 0 HE ARG A 14 16.966 -9.360 -20.958 1.00 0.00 H new ATOM 0 HH11 ARG A 14 19.498 -11.628 -19.913 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.474 -12.497 -21.451 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.945 -10.466 -22.859 1.00 0.00 H new ATOM 0 HH22 ARG A 14 18.027 -11.839 -23.119 1.00 0.00 H new ATOM 247 N SER A 15 18.130 -6.068 -15.768 1.00 0.00 N ATOM 248 CA SER A 15 17.578 -5.490 -14.535 1.00 0.00 C ATOM 249 C SER A 15 18.135 -4.086 -14.277 1.00 0.00 C ATOM 250 O SER A 15 17.566 -3.348 -13.477 1.00 0.00 O ATOM 251 CB SER A 15 17.712 -6.447 -13.339 1.00 0.00 C ATOM 252 OG SER A 15 17.580 -7.804 -13.749 1.00 0.00 O ATOM 0 H SER A 15 18.835 -6.789 -15.617 1.00 0.00 H new ATOM 0 HA SER A 15 16.505 -5.361 -14.674 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.680 -6.301 -12.860 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.950 -6.213 -12.595 1.00 0.00 H new ATOM 0 HG SER A 15 18.326 -8.328 -13.390 1.00 0.00 H new ATOM 258 N GLN A 16 19.173 -3.659 -15.004 1.00 0.00 N ATOM 259 CA GLN A 16 19.753 -2.319 -14.959 1.00 0.00 C ATOM 260 C GLN A 16 18.903 -1.253 -15.669 1.00 0.00 C ATOM 261 O GLN A 16 19.443 -0.316 -16.242 1.00 0.00 O ATOM 262 CB GLN A 16 21.196 -2.380 -15.483 1.00 0.00 C ATOM 263 CG GLN A 16 21.325 -2.680 -16.987 1.00 0.00 C ATOM 264 CD GLN A 16 22.789 -2.821 -17.413 1.00 0.00 C ATOM 265 OE1 GLN A 16 23.702 -2.512 -16.651 1.00 0.00 O ATOM 266 NE2 GLN A 16 23.053 -3.266 -18.628 1.00 0.00 N ATOM 0 H GLN A 16 19.651 -4.268 -15.668 1.00 0.00 H new ATOM 0 HA GLN A 16 19.766 -1.991 -13.920 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.684 -1.428 -15.274 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.738 -3.145 -14.927 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.788 -3.599 -17.222 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.855 -1.880 -17.559 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.290 -3.521 -19.255 1.00 0.00 H new ATOM 0 HE22 GLN A 16 24.020 -3.355 -18.940 1.00 0.00 H new ATOM 275 N MET A 17 17.581 -1.389 -15.705 1.00 0.00 N ATOM 276 CA MET A 17 16.688 -0.378 -16.258 1.00 0.00 C ATOM 277 C MET A 17 15.298 -0.425 -15.616 1.00 0.00 C ATOM 278 O MET A 17 14.854 0.582 -15.077 1.00 0.00 O ATOM 279 CB MET A 17 16.649 -0.509 -17.799 1.00 0.00 C ATOM 280 CG MET A 17 16.493 0.845 -18.507 1.00 0.00 C ATOM 281 SD MET A 17 15.254 1.982 -17.850 1.00 0.00 S ATOM 282 CE MET A 17 16.159 3.113 -16.732 1.00 0.00 C ATOM 0 H MET A 17 17.096 -2.212 -15.348 1.00 0.00 H new ATOM 0 HA MET A 17 17.079 0.610 -16.016 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.565 -0.990 -18.142 1.00 0.00 H new ATOM 0 HB3 MET A 17 15.822 -1.160 -18.083 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.459 1.350 -18.487 1.00 0.00 H new ATOM 0 HG3 MET A 17 16.255 0.654 -19.553 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.448 3.749 -16.204 1.00 0.00 H new ATOM 0 HE2 MET A 17 16.730 2.530 -16.009 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.838 3.734 -17.315 1.00 0.00 H new ATOM 292 N ALA A 18 14.627 -1.583 -15.614 1.00 0.00 N ATOM 293 CA ALA A 18 13.205 -1.671 -15.238 1.00 0.00 C ATOM 294 C ALA A 18 12.899 -1.191 -13.825 1.00 0.00 C ATOM 295 O ALA A 18 12.001 -0.374 -13.640 1.00 0.00 O ATOM 296 CB ALA A 18 12.718 -3.107 -15.466 1.00 0.00 C ATOM 0 H ALA A 18 15.045 -2.477 -15.869 1.00 0.00 H new ATOM 0 HA ALA A 18 12.657 -0.982 -15.881 1.00 0.00 H new ATOM 0 HB1 ALA A 18 11.666 -3.183 -15.190 1.00 0.00 H new ATOM 0 HB2 ALA A 18 12.837 -3.369 -16.517 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.304 -3.792 -14.853 1.00 0.00 H new ATOM 302 N GLU A 19 13.666 -1.633 -12.827 1.00 0.00 N ATOM 303 CA GLU A 19 13.449 -1.166 -11.458 1.00 0.00 C ATOM 304 C GLU A 19 13.743 0.327 -11.362 1.00 0.00 C ATOM 305 O GLU A 19 13.066 1.038 -10.622 1.00 0.00 O ATOM 306 CB GLU A 19 14.253 -2.035 -10.481 1.00 0.00 C ATOM 307 CG GLU A 19 15.739 -1.697 -10.325 1.00 0.00 C ATOM 308 CD GLU A 19 15.987 -0.533 -9.355 1.00 0.00 C ATOM 309 OE1 GLU A 19 15.651 -0.640 -8.155 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.559 0.489 -9.789 1.00 0.00 O ATOM 0 H GLU A 19 14.429 -2.301 -12.937 1.00 0.00 H new ATOM 0 HA GLU A 19 12.403 -1.279 -11.172 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.784 -1.968 -9.500 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.172 -3.073 -10.803 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.272 -2.579 -9.970 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.154 -1.445 -11.301 1.00 0.00 H new ATOM 317 N GLY A 20 14.681 0.798 -12.190 1.00 0.00 N ATOM 318 CA GLY A 20 15.018 2.196 -12.365 1.00 0.00 C ATOM 319 C GLY A 20 13.782 3.002 -12.734 1.00 0.00 C ATOM 320 O GLY A 20 13.391 3.897 -11.989 1.00 0.00 O ATOM 0 H GLY A 20 15.244 0.182 -12.776 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.454 2.588 -11.446 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.772 2.299 -13.145 1.00 0.00 H new ATOM 324 N PHE A 21 13.115 2.670 -13.844 1.00 0.00 N ATOM 325 CA PHE A 21 11.867 3.365 -14.182 1.00 0.00 C ATOM 326 C PHE A 21 10.786 3.171 -13.144 1.00 0.00 C ATOM 327 O PHE A 21 9.981 4.079 -12.951 1.00 0.00 O ATOM 328 CB PHE A 21 11.298 2.944 -15.539 1.00 0.00 C ATOM 329 CG PHE A 21 11.760 3.837 -16.657 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.602 5.237 -16.583 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.410 3.253 -17.744 1.00 0.00 C ATOM 332 CE1 PHE A 21 12.148 6.043 -17.599 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.985 4.058 -18.734 1.00 0.00 C ATOM 334 CZ PHE A 21 12.838 5.456 -18.674 1.00 0.00 C ATOM 0 H PHE A 21 13.405 1.949 -14.505 1.00 0.00 H new ATOM 0 HA PHE A 21 12.151 4.417 -14.219 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.595 1.917 -15.752 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.209 2.958 -15.493 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.069 5.684 -15.757 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.470 2.177 -17.822 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.037 7.116 -17.553 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.541 3.607 -19.543 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.255 6.077 -19.453 1.00 0.00 H new ATOM 344 N ALA A 22 10.730 2.024 -12.474 1.00 0.00 N ATOM 345 CA ALA A 22 9.612 1.738 -11.590 1.00 0.00 C ATOM 346 C ALA A 22 9.567 2.722 -10.424 1.00 0.00 C ATOM 347 O ALA A 22 8.478 3.160 -10.067 1.00 0.00 O ATOM 348 CB ALA A 22 9.698 0.294 -11.115 1.00 0.00 C ATOM 0 H ALA A 22 11.436 1.289 -12.526 1.00 0.00 H new ATOM 0 HA ALA A 22 8.678 1.863 -12.139 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.860 0.079 -10.452 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.662 -0.375 -11.975 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.634 0.143 -10.577 1.00 0.00 H new ATOM 354 N LYS A 23 10.717 3.151 -9.887 1.00 0.00 N ATOM 355 CA LYS A 23 10.703 4.152 -8.810 1.00 0.00 C ATOM 356 C LYS A 23 10.249 5.531 -9.304 1.00 0.00 C ATOM 357 O LYS A 23 9.739 6.315 -8.513 1.00 0.00 O ATOM 358 CB LYS A 23 12.050 4.188 -8.053 1.00 0.00 C ATOM 359 CG LYS A 23 13.234 4.850 -8.794 1.00 0.00 C ATOM 360 CD LYS A 23 14.421 3.925 -9.115 1.00 0.00 C ATOM 361 CE LYS A 23 15.089 3.318 -7.868 1.00 0.00 C ATOM 362 NZ LYS A 23 16.389 2.662 -8.175 1.00 0.00 N ATOM 0 H LYS A 23 11.644 2.833 -10.169 1.00 0.00 H new ATOM 0 HA LYS A 23 9.951 3.841 -8.084 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.899 4.714 -7.110 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.331 3.164 -7.805 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.864 5.273 -9.728 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.598 5.681 -8.190 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.076 3.117 -9.761 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.166 4.487 -9.678 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.248 4.102 -7.128 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.415 2.588 -7.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.811 2.300 -7.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.233 1.873 -8.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.033 3.354 -8.610 1.00 0.00 H new ATOM 376 N THR A 24 10.406 5.819 -10.600 1.00 0.00 N ATOM 377 CA THR A 24 9.990 7.054 -11.242 1.00 0.00 C ATOM 378 C THR A 24 8.486 7.021 -11.544 1.00 0.00 C ATOM 379 O THR A 24 7.743 7.908 -11.133 1.00 0.00 O ATOM 380 CB THR A 24 10.919 7.262 -12.454 1.00 0.00 C ATOM 381 OG1 THR A 24 12.118 7.864 -12.003 1.00 0.00 O ATOM 382 CG2 THR A 24 10.332 8.115 -13.575 1.00 0.00 C ATOM 0 H THR A 24 10.845 5.167 -11.250 1.00 0.00 H new ATOM 0 HA THR A 24 10.098 7.928 -10.600 1.00 0.00 H new ATOM 0 HB THR A 24 11.082 6.274 -12.885 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.494 8.420 -12.717 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.059 8.205 -14.383 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.425 7.644 -13.954 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.093 9.107 -13.191 1.00 0.00 H new ATOM 390 N LEU A 25 8.030 5.973 -12.233 1.00 0.00 N ATOM 391 CA LEU A 25 6.656 5.862 -12.726 1.00 0.00 C ATOM 392 C LEU A 25 5.702 5.557 -11.571 1.00 0.00 C ATOM 393 O LEU A 25 4.583 6.059 -11.536 1.00 0.00 O ATOM 394 CB LEU A 25 6.586 4.739 -13.777 1.00 0.00 C ATOM 395 CG LEU A 25 7.400 4.974 -15.059 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.439 3.665 -15.851 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.824 6.100 -15.921 1.00 0.00 C ATOM 0 H LEU A 25 8.611 5.168 -12.467 1.00 0.00 H new ATOM 0 HA LEU A 25 6.358 6.807 -13.180 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.929 3.813 -13.316 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.542 4.590 -14.054 1.00 0.00 H new ATOM 0 HG LEU A 25 8.406 5.285 -14.778 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.013 3.810 -16.766 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.909 2.888 -15.247 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.423 3.363 -16.104 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.437 6.224 -16.814 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.804 5.850 -16.213 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.821 7.029 -15.351 1.00 0.00 H new ATOM 409 N GLY A 26 6.150 4.727 -10.625 1.00 0.00 N ATOM 410 CA GLY A 26 5.376 4.260 -9.484 1.00 0.00 C ATOM 411 C GLY A 26 5.626 5.078 -8.219 1.00 0.00 C ATOM 412 O GLY A 26 5.276 4.611 -7.136 1.00 0.00 O ATOM 0 H GLY A 26 7.098 4.351 -10.638 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.315 4.298 -9.731 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.620 3.216 -9.289 1.00 0.00 H new ATOM 416 N ALA A 27 6.256 6.253 -8.336 1.00 0.00 N ATOM 417 CA ALA A 27 6.662 7.095 -7.214 1.00 0.00 C ATOM 418 C ALA A 27 5.480 7.335 -6.268 1.00 0.00 C ATOM 419 O ALA A 27 4.426 7.815 -6.692 1.00 0.00 O ATOM 420 CB ALA A 27 7.207 8.431 -7.739 1.00 0.00 C ATOM 0 H ALA A 27 6.503 6.652 -9.242 1.00 0.00 H new ATOM 0 HA ALA A 27 7.448 6.586 -6.656 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.509 9.056 -6.899 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.068 8.246 -8.381 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.431 8.941 -8.311 1.00 0.00 H new ATOM 426 N GLY A 28 5.654 6.985 -4.989 1.00 0.00 N ATOM 427 CA GLY A 28 4.640 7.144 -3.945 1.00 0.00 C ATOM 428 C GLY A 28 3.512 6.103 -3.993 1.00 0.00 C ATOM 429 O GLY A 28 2.711 6.044 -3.057 1.00 0.00 O ATOM 0 H GLY A 28 6.522 6.575 -4.645 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.127 7.090 -2.971 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.203 8.139 -4.028 1.00 0.00 H new ATOM 433 N LYS A 29 3.441 5.261 -5.033 1.00 0.00 N ATOM 434 CA LYS A 29 2.408 4.228 -5.177 1.00 0.00 C ATOM 435 C LYS A 29 2.939 2.879 -4.703 1.00 0.00 C ATOM 436 O LYS A 29 2.278 2.187 -3.928 1.00 0.00 O ATOM 437 CB LYS A 29 1.905 4.136 -6.637 1.00 0.00 C ATOM 438 CG LYS A 29 1.413 5.480 -7.200 1.00 0.00 C ATOM 439 CD LYS A 29 0.838 5.310 -8.617 1.00 0.00 C ATOM 440 CE LYS A 29 0.501 6.656 -9.282 1.00 0.00 C ATOM 441 NZ LYS A 29 -0.648 7.359 -8.644 1.00 0.00 N ATOM 0 H LYS A 29 4.107 5.279 -5.806 1.00 0.00 H new ATOM 0 HA LYS A 29 1.560 4.508 -4.553 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.710 3.759 -7.268 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.094 3.410 -6.689 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.650 5.896 -6.542 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.238 6.192 -7.222 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.557 4.773 -9.235 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.062 4.697 -8.569 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.379 7.301 -9.245 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.275 6.486 -10.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.823 8.257 -9.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.497 6.761 -8.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.427 7.550 -7.646 1.00 0.00 H new ATOM 455 N ILE A 30 4.130 2.494 -5.178 1.00 0.00 N ATOM 456 CA ILE A 30 4.685 1.148 -5.013 1.00 0.00 C ATOM 457 C ILE A 30 6.173 1.233 -4.652 1.00 0.00 C ATOM 458 O ILE A 30 6.843 2.209 -4.988 1.00 0.00 O ATOM 459 CB ILE A 30 4.393 0.317 -6.291 1.00 0.00 C ATOM 460 CG1 ILE A 30 5.119 0.868 -7.540 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.877 0.261 -6.552 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.790 0.159 -8.863 1.00 0.00 C ATOM 0 H ILE A 30 4.745 3.121 -5.697 1.00 0.00 H new ATOM 0 HA ILE A 30 4.207 0.628 -4.183 1.00 0.00 H new ATOM 0 HB ILE A 30 4.777 -0.687 -6.110 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.875 1.925 -7.644 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.194 0.804 -7.371 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.684 -0.324 -7.451 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.378 -0.204 -5.702 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.494 1.272 -6.688 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.352 0.623 -9.674 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.062 -0.894 -8.789 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.722 0.244 -9.066 1.00 0.00 H new ATOM 474 N ALA A 31 6.672 0.221 -3.941 1.00 0.00 N ATOM 475 CA ALA A 31 7.993 0.216 -3.322 1.00 0.00 C ATOM 476 C ALA A 31 8.872 -0.805 -4.028 1.00 0.00 C ATOM 477 O ALA A 31 8.753 -1.999 -3.770 1.00 0.00 O ATOM 478 CB ALA A 31 7.827 -0.121 -1.834 1.00 0.00 C ATOM 0 H ALA A 31 6.152 -0.641 -3.777 1.00 0.00 H new ATOM 0 HA ALA A 31 8.472 1.191 -3.411 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.804 -0.130 -1.352 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.195 0.630 -1.359 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.363 -1.102 -1.733 1.00 0.00 H new ATOM 484 N VAL A 32 9.718 -0.370 -4.953 1.00 0.00 N ATOM 485 CA VAL A 32 10.619 -1.271 -5.670 1.00 0.00 C ATOM 486 C VAL A 32 11.927 -1.433 -4.878 1.00 0.00 C ATOM 487 O VAL A 32 12.509 -0.446 -4.422 1.00 0.00 O ATOM 488 CB VAL A 32 10.768 -0.794 -7.130 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.397 0.595 -7.296 1.00 0.00 C ATOM 490 CG2 VAL A 32 11.555 -1.811 -7.953 1.00 0.00 C ATOM 0 H VAL A 32 9.801 0.609 -5.228 1.00 0.00 H new ATOM 0 HA VAL A 32 10.212 -2.280 -5.743 1.00 0.00 H new ATOM 0 HB VAL A 32 9.746 -0.708 -7.498 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.460 0.842 -8.356 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.781 1.336 -6.787 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.398 0.595 -6.864 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.648 -1.455 -8.979 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.548 -1.938 -7.521 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.032 -2.767 -7.947 1.00 0.00 H new ATOM 500 N THR A 33 12.401 -2.674 -4.738 1.00 0.00 N ATOM 501 CA THR A 33 13.694 -3.019 -4.164 1.00 0.00 C ATOM 502 C THR A 33 14.105 -4.314 -4.855 1.00 0.00 C ATOM 503 O THR A 33 13.690 -5.394 -4.442 1.00 0.00 O ATOM 504 CB THR A 33 13.574 -3.237 -2.645 1.00 0.00 C ATOM 505 OG1 THR A 33 12.889 -2.177 -1.988 1.00 0.00 O ATOM 506 CG2 THR A 33 14.948 -3.446 -1.990 1.00 0.00 C ATOM 0 H THR A 33 11.871 -3.493 -5.034 1.00 0.00 H new ATOM 0 HA THR A 33 14.427 -2.225 -4.311 1.00 0.00 H new ATOM 0 HB THR A 33 12.981 -4.144 -2.526 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.839 -2.365 -1.028 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.821 -3.596 -0.918 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.429 -4.322 -2.425 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.570 -2.568 -2.162 1.00 0.00 H new ATOM 514 N SER A 34 14.854 -4.221 -5.951 1.00 0.00 N ATOM 515 CA SER A 34 15.095 -5.398 -6.771 1.00 0.00 C ATOM 516 C SER A 34 16.417 -6.054 -6.393 1.00 0.00 C ATOM 517 O SER A 34 17.464 -5.755 -6.979 1.00 0.00 O ATOM 518 CB SER A 34 14.993 -5.054 -8.253 1.00 0.00 C ATOM 519 OG SER A 34 13.683 -4.562 -8.505 1.00 0.00 O ATOM 0 H SER A 34 15.294 -3.363 -6.284 1.00 0.00 H new ATOM 0 HA SER A 34 14.318 -6.137 -6.575 1.00 0.00 H new ATOM 0 HB2 SER A 34 15.739 -4.306 -8.522 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.192 -5.935 -8.863 1.00 0.00 H new ATOM 0 HG SER A 34 13.599 -3.655 -8.143 1.00 0.00 H new ATOM 525 N SER A 35 16.351 -6.936 -5.398 1.00 0.00 N ATOM 526 CA SER A 35 17.446 -7.827 -5.051 1.00 0.00 C ATOM 527 C SER A 35 17.774 -8.748 -6.239 1.00 0.00 C ATOM 528 O SER A 35 16.996 -8.865 -7.192 1.00 0.00 O ATOM 529 CB SER A 35 17.038 -8.632 -3.819 1.00 0.00 C ATOM 530 OG SER A 35 16.971 -7.813 -2.670 1.00 0.00 O ATOM 0 H SER A 35 15.527 -7.050 -4.807 1.00 0.00 H new ATOM 0 HA SER A 35 18.346 -7.255 -4.823 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.069 -9.099 -3.992 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.755 -9.436 -3.654 1.00 0.00 H new ATOM 0 HG SER A 35 16.982 -8.375 -1.867 1.00 0.00 H new ATOM 536 N GLY A 36 18.928 -9.413 -6.185 1.00 0.00 N ATOM 537 CA GLY A 36 19.453 -10.292 -7.209 1.00 0.00 C ATOM 538 C GLY A 36 20.054 -11.496 -6.491 1.00 0.00 C ATOM 539 O GLY A 36 19.888 -11.644 -5.280 1.00 0.00 O ATOM 0 H GLY A 36 19.549 -9.344 -5.379 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.663 -10.604 -7.892 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.208 -9.782 -7.806 1.00 0.00 H new ATOM 543 N LEU A 37 20.711 -12.381 -7.237 1.00 0.00 N ATOM 544 CA LEU A 37 21.161 -13.675 -6.763 1.00 0.00 C ATOM 545 C LEU A 37 22.662 -13.789 -6.981 1.00 0.00 C ATOM 546 O LEU A 37 23.444 -13.481 -6.083 1.00 0.00 O ATOM 547 CB LEU A 37 20.294 -14.762 -7.418 1.00 0.00 C ATOM 548 CG LEU A 37 18.933 -14.907 -6.707 1.00 0.00 C ATOM 549 CD1 LEU A 37 17.856 -15.326 -7.714 1.00 0.00 C ATOM 550 CD2 LEU A 37 19.028 -15.957 -5.595 1.00 0.00 C ATOM 0 H LEU A 37 20.948 -12.207 -8.214 1.00 0.00 H new ATOM 0 HA LEU A 37 21.026 -13.807 -5.689 1.00 0.00 H new ATOM 0 HB2 LEU A 37 20.133 -14.516 -8.468 1.00 0.00 H new ATOM 0 HB3 LEU A 37 20.822 -15.715 -7.391 1.00 0.00 H new ATOM 0 HG LEU A 37 18.664 -13.945 -6.271 1.00 0.00 H new ATOM 0 HD11 LEU A 37 16.899 -15.426 -7.202 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.773 -14.569 -8.494 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.129 -16.281 -8.162 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.062 -16.051 -5.100 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.310 -16.918 -6.025 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.780 -15.650 -4.868 1.00 0.00 H new ATOM 562 N GLU A 38 23.071 -14.170 -8.193 1.00 0.00 N ATOM 563 CA GLU A 38 24.486 -14.253 -8.564 1.00 0.00 C ATOM 564 C GLU A 38 25.132 -12.858 -8.648 1.00 0.00 C ATOM 565 O GLU A 38 26.340 -12.712 -8.446 1.00 0.00 O ATOM 566 CB GLU A 38 24.605 -14.992 -9.912 1.00 0.00 C ATOM 567 CG GLU A 38 25.708 -16.052 -9.839 1.00 0.00 C ATOM 568 CD GLU A 38 26.047 -16.684 -11.206 1.00 0.00 C ATOM 569 OE1 GLU A 38 25.191 -16.724 -12.118 1.00 0.00 O ATOM 570 OE2 GLU A 38 27.199 -17.142 -11.401 1.00 0.00 O ATOM 0 H GLU A 38 22.432 -14.429 -8.944 1.00 0.00 H new ATOM 0 HA GLU A 38 25.022 -14.805 -7.792 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.654 -15.463 -10.162 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.827 -14.280 -10.707 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.609 -15.600 -9.424 1.00 0.00 H new ATOM 0 HG3 GLU A 38 25.400 -16.839 -9.150 1.00 0.00 H new ATOM 577 N SER A 39 24.319 -11.836 -8.942 1.00 0.00 N ATOM 578 CA SER A 39 24.697 -10.425 -9.014 1.00 0.00 C ATOM 579 C SER A 39 23.527 -9.604 -8.491 1.00 0.00 C ATOM 580 O SER A 39 22.488 -10.155 -8.145 1.00 0.00 O ATOM 581 CB SER A 39 25.043 -10.022 -10.460 1.00 0.00 C ATOM 582 OG SER A 39 25.697 -11.051 -11.190 1.00 0.00 O ATOM 0 H SER A 39 23.330 -11.981 -9.146 1.00 0.00 H new ATOM 0 HA SER A 39 25.586 -10.244 -8.410 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.127 -9.743 -10.981 1.00 0.00 H new ATOM 0 HB3 SER A 39 25.681 -9.138 -10.441 1.00 0.00 H new ATOM 0 HG SER A 39 25.889 -10.737 -12.098 1.00 0.00 H new ATOM 588 N SER A 40 23.679 -8.282 -8.464 1.00 0.00 N ATOM 589 CA SER A 40 22.770 -7.338 -7.807 1.00 0.00 C ATOM 590 C SER A 40 23.030 -5.881 -8.243 1.00 0.00 C ATOM 591 O SER A 40 22.150 -5.042 -8.069 1.00 0.00 O ATOM 592 CB SER A 40 22.971 -7.509 -6.292 1.00 0.00 C ATOM 593 OG SER A 40 22.197 -8.592 -5.799 1.00 0.00 O ATOM 0 H SER A 40 24.468 -7.819 -8.915 1.00 0.00 H new ATOM 0 HA SER A 40 21.740 -7.550 -8.092 1.00 0.00 H new ATOM 0 HB2 SER A 40 24.026 -7.683 -6.078 1.00 0.00 H new ATOM 0 HB3 SER A 40 22.689 -6.591 -5.777 1.00 0.00 H new ATOM 0 HG SER A 40 22.057 -9.247 -6.515 1.00 0.00 H new ATOM 599 N ARG A 41 24.204 -5.557 -8.814 1.00 0.00 N ATOM 600 CA ARG A 41 24.517 -4.217 -9.340 1.00 0.00 C ATOM 601 C ARG A 41 24.354 -4.195 -10.860 1.00 0.00 C ATOM 602 O ARG A 41 23.624 -5.023 -11.403 1.00 0.00 O ATOM 603 CB ARG A 41 25.886 -3.727 -8.798 1.00 0.00 C ATOM 604 CG ARG A 41 25.765 -2.298 -8.235 1.00 0.00 C ATOM 605 CD ARG A 41 27.041 -1.848 -7.514 1.00 0.00 C ATOM 606 NE ARG A 41 26.839 -0.528 -6.888 1.00 0.00 N ATOM 607 CZ ARG A 41 27.725 0.138 -6.134 1.00 0.00 C ATOM 608 NH1 ARG A 41 28.946 -0.351 -5.920 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.379 1.305 -5.599 1.00 0.00 N ATOM 0 H ARG A 41 24.968 -6.224 -8.924 1.00 0.00 H new ATOM 0 HA ARG A 41 23.801 -3.481 -8.974 1.00 0.00 H new ATOM 0 HB2 ARG A 41 26.238 -4.403 -8.018 1.00 0.00 H new ATOM 0 HB3 ARG A 41 26.628 -3.748 -9.596 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.547 -1.606 -9.049 1.00 0.00 H new ATOM 0 HG3 ARG A 41 24.924 -2.252 -7.543 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.314 -2.580 -6.754 1.00 0.00 H new ATOM 0 HD3 ARG A 41 27.868 -1.799 -8.222 1.00 0.00 H new ATOM 0 HE ARG A 41 25.937 -0.078 -7.044 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.217 -1.244 -6.332 1.00 0.00 H new ATOM 0 HH12 ARG A 41 29.609 0.167 -5.344 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.447 1.685 -5.764 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.046 1.820 -5.024 1.00 0.00 H new ATOM 623 N VAL A 42 24.933 -3.202 -11.527 1.00 0.00 N ATOM 624 CA VAL A 42 24.723 -2.896 -12.933 1.00 0.00 C ATOM 625 C VAL A 42 26.053 -2.616 -13.650 1.00 0.00 C ATOM 626 O VAL A 42 27.101 -2.516 -13.004 1.00 0.00 O ATOM 627 CB VAL A 42 23.768 -1.700 -13.010 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.438 -1.996 -12.318 1.00 0.00 C ATOM 629 CG2 VAL A 42 24.317 -0.392 -12.427 1.00 0.00 C ATOM 0 H VAL A 42 25.590 -2.562 -11.080 1.00 0.00 H new ATOM 0 HA VAL A 42 24.283 -3.752 -13.445 1.00 0.00 H new ATOM 0 HB VAL A 42 23.634 -1.553 -14.082 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.787 -1.125 -12.393 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.960 -2.849 -12.799 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.617 -2.225 -11.268 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.569 0.394 -12.528 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.553 -0.535 -11.372 1.00 0.00 H new ATOM 0 HG23 VAL A 42 25.220 -0.104 -12.965 1.00 0.00 H new ATOM 639 N HIS A 43 26.004 -2.450 -14.974 1.00 0.00 N ATOM 640 CA HIS A 43 27.139 -2.050 -15.809 1.00 0.00 C ATOM 641 C HIS A 43 27.297 -0.515 -15.798 1.00 0.00 C ATOM 642 O HIS A 43 26.314 0.192 -15.562 1.00 0.00 O ATOM 643 CB HIS A 43 26.940 -2.612 -17.230 1.00 0.00 C ATOM 644 CG HIS A 43 26.982 -4.121 -17.288 1.00 0.00 C ATOM 645 ND1 HIS A 43 28.116 -4.902 -17.327 1.00 0.00 N ATOM 646 CD2 HIS A 43 25.911 -4.977 -17.328 1.00 0.00 C ATOM 647 CE1 HIS A 43 27.736 -6.191 -17.399 1.00 0.00 C ATOM 648 NE2 HIS A 43 26.394 -6.289 -17.393 1.00 0.00 N ATOM 0 H HIS A 43 25.148 -2.594 -15.510 1.00 0.00 H new ATOM 0 HA HIS A 43 28.066 -2.463 -15.410 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.982 -2.267 -17.619 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.713 -2.209 -17.884 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.871 -4.687 -17.312 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.414 -7.030 -17.454 1.00 0.00 H new ATOM 0 HE2 HIS A 43 25.841 -7.145 -17.429 1.00 0.00 H new ATOM 656 N PRO A 44 28.496 0.036 -16.078 1.00 0.00 N ATOM 657 CA PRO A 44 28.784 1.468 -15.959 1.00 0.00 C ATOM 658 C PRO A 44 27.935 2.339 -16.889 1.00 0.00 C ATOM 659 O PRO A 44 27.291 3.286 -16.434 1.00 0.00 O ATOM 660 CB PRO A 44 30.278 1.621 -16.281 1.00 0.00 C ATOM 661 CG PRO A 44 30.594 0.377 -17.116 1.00 0.00 C ATOM 662 CD PRO A 44 29.720 -0.671 -16.440 1.00 0.00 C ATOM 0 HA PRO A 44 28.536 1.813 -14.955 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.477 2.538 -16.836 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.882 1.660 -15.374 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.336 0.511 -18.166 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.652 0.115 -17.079 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.511 -1.504 -17.112 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.211 -1.087 -15.560 1.00 0.00 H new ATOM 670 N THR A 45 27.898 2.018 -18.185 1.00 0.00 N ATOM 671 CA THR A 45 27.249 2.859 -19.192 1.00 0.00 C ATOM 672 C THR A 45 25.734 2.919 -18.962 1.00 0.00 C ATOM 673 O THR A 45 25.112 3.926 -19.301 1.00 0.00 O ATOM 674 CB THR A 45 27.639 2.360 -20.593 1.00 0.00 C ATOM 675 OG1 THR A 45 29.038 2.099 -20.631 1.00 0.00 O ATOM 676 CG2 THR A 45 27.268 3.333 -21.720 1.00 0.00 C ATOM 0 H THR A 45 28.317 1.169 -18.564 1.00 0.00 H new ATOM 0 HA THR A 45 27.597 3.888 -19.104 1.00 0.00 H new ATOM 0 HB THR A 45 27.067 1.449 -20.769 1.00 0.00 H new ATOM 0 HG1 THR A 45 29.287 1.779 -21.523 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.574 2.913 -22.678 1.00 0.00 H new ATOM 0 HG22 THR A 45 26.190 3.494 -21.722 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.776 4.284 -21.562 1.00 0.00 H new ATOM 684 N ALA A 46 25.148 1.898 -18.307 1.00 0.00 N ATOM 685 CA ALA A 46 23.746 1.932 -17.916 1.00 0.00 C ATOM 686 C ALA A 46 23.491 3.163 -17.084 1.00 0.00 C ATOM 687 O ALA A 46 22.617 3.949 -17.415 1.00 0.00 O ATOM 688 CB ALA A 46 23.349 0.677 -17.112 1.00 0.00 C ATOM 0 H ALA A 46 25.635 1.042 -18.042 1.00 0.00 H new ATOM 0 HA ALA A 46 23.141 1.955 -18.823 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.296 0.739 -16.838 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.514 -0.212 -17.720 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.956 0.617 -16.209 1.00 0.00 H new ATOM 694 N ILE A 47 24.278 3.348 -16.030 1.00 0.00 N ATOM 695 CA ILE A 47 24.003 4.376 -15.041 1.00 0.00 C ATOM 696 C ILE A 47 24.006 5.727 -15.737 1.00 0.00 C ATOM 697 O ILE A 47 23.119 6.524 -15.470 1.00 0.00 O ATOM 698 CB ILE A 47 25.067 4.327 -13.914 1.00 0.00 C ATOM 699 CG1 ILE A 47 25.007 2.996 -13.129 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.910 5.526 -12.960 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.283 2.712 -12.323 1.00 0.00 C ATOM 0 H ILE A 47 25.114 2.795 -15.841 1.00 0.00 H new ATOM 0 HA ILE A 47 23.028 4.210 -14.583 1.00 0.00 H new ATOM 0 HB ILE A 47 26.047 4.387 -14.388 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.154 3.020 -12.451 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.836 2.177 -13.828 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.667 5.470 -12.178 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.033 6.454 -13.519 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.919 5.504 -12.508 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.177 1.764 -11.795 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.136 2.657 -12.999 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.443 3.513 -11.601 1.00 0.00 H new ATOM 713 N ALA A 48 24.933 5.962 -16.664 1.00 0.00 N ATOM 714 CA ALA A 48 24.995 7.226 -17.369 1.00 0.00 C ATOM 715 C ALA A 48 23.724 7.459 -18.191 1.00 0.00 C ATOM 716 O ALA A 48 23.131 8.527 -18.098 1.00 0.00 O ATOM 717 CB ALA A 48 26.254 7.276 -18.242 1.00 0.00 C ATOM 0 H ALA A 48 25.648 5.289 -16.939 1.00 0.00 H new ATOM 0 HA ALA A 48 25.055 8.035 -16.641 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.294 8.229 -18.769 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.138 7.172 -17.612 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.227 6.462 -18.966 1.00 0.00 H new ATOM 723 N MET A 49 23.262 6.464 -18.948 1.00 0.00 N ATOM 724 CA MET A 49 22.071 6.598 -19.792 1.00 0.00 C ATOM 725 C MET A 49 20.810 6.751 -18.935 1.00 0.00 C ATOM 726 O MET A 49 19.897 7.537 -19.220 1.00 0.00 O ATOM 727 CB MET A 49 21.966 5.344 -20.675 1.00 0.00 C ATOM 728 CG MET A 49 23.135 5.269 -21.662 1.00 0.00 C ATOM 729 SD MET A 49 23.094 6.558 -22.928 1.00 0.00 S ATOM 730 CE MET A 49 24.755 7.212 -22.647 1.00 0.00 C ATOM 0 H MET A 49 23.700 5.544 -18.995 1.00 0.00 H new ATOM 0 HA MET A 49 22.158 7.490 -20.412 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.957 4.453 -20.048 1.00 0.00 H new ATOM 0 HB3 MET A 49 21.023 5.358 -21.222 1.00 0.00 H new ATOM 0 HG2 MET A 49 24.072 5.343 -21.110 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.128 4.293 -22.148 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.944 8.035 -23.337 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.835 7.573 -21.622 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.489 6.424 -22.813 1.00 0.00 H new ATOM 740 N MET A 50 20.755 5.996 -17.847 1.00 0.00 N ATOM 741 CA MET A 50 19.575 5.966 -17.016 1.00 0.00 C ATOM 742 C MET A 50 19.551 7.287 -16.236 1.00 0.00 C ATOM 743 O MET A 50 18.491 7.891 -16.106 1.00 0.00 O ATOM 744 CB MET A 50 19.520 4.679 -16.169 1.00 0.00 C ATOM 745 CG MET A 50 19.653 3.326 -16.919 1.00 0.00 C ATOM 746 SD MET A 50 19.324 3.238 -18.710 1.00 0.00 S ATOM 747 CE MET A 50 19.899 1.541 -19.086 1.00 0.00 C ATOM 0 H MET A 50 21.517 5.399 -17.525 1.00 0.00 H new ATOM 0 HA MET A 50 18.654 5.910 -17.596 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.314 4.731 -15.424 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.575 4.672 -15.627 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.669 2.965 -16.758 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.983 2.618 -16.431 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.153 1.030 -19.694 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.841 1.589 -19.632 1.00 0.00 H new ATOM 0 HE3 MET A 50 20.046 0.992 -18.156 1.00 0.00 H new ATOM 757 N GLU A 51 20.707 7.826 -15.840 1.00 0.00 N ATOM 758 CA GLU A 51 20.814 9.128 -15.217 1.00 0.00 C ATOM 759 C GLU A 51 20.517 10.228 -16.237 1.00 0.00 C ATOM 760 O GLU A 51 20.051 11.299 -15.843 1.00 0.00 O ATOM 761 CB GLU A 51 22.193 9.291 -14.564 1.00 0.00 C ATOM 762 CG GLU A 51 22.334 10.601 -13.782 1.00 0.00 C ATOM 763 CD GLU A 51 23.657 10.640 -12.997 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.722 10.909 -13.604 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.640 10.423 -11.761 1.00 0.00 O ATOM 0 H GLU A 51 21.604 7.354 -15.950 1.00 0.00 H new ATOM 0 HA GLU A 51 20.070 9.215 -14.425 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.372 8.452 -13.892 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.962 9.251 -15.336 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.291 11.445 -14.470 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.496 10.709 -13.093 1.00 0.00 H new ATOM 772 N GLU A 52 20.692 9.965 -17.536 1.00 0.00 N ATOM 773 CA GLU A 52 20.289 10.919 -18.554 1.00 0.00 C ATOM 774 C GLU A 52 18.770 11.083 -18.553 1.00 0.00 C ATOM 775 O GLU A 52 18.291 12.185 -18.830 1.00 0.00 O ATOM 776 CB GLU A 52 20.863 10.598 -19.945 1.00 0.00 C ATOM 777 CG GLU A 52 22.333 11.021 -20.072 1.00 0.00 C ATOM 778 CD GLU A 52 22.470 12.536 -20.317 1.00 0.00 C ATOM 779 OE1 GLU A 52 22.438 12.971 -21.496 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.622 13.310 -19.338 1.00 0.00 O ATOM 0 H GLU A 52 21.107 9.106 -17.897 1.00 0.00 H new ATOM 0 HA GLU A 52 20.726 11.884 -18.297 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.776 9.528 -20.135 1.00 0.00 H new ATOM 0 HB3 GLU A 52 20.272 11.106 -20.707 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.870 10.749 -19.163 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.799 10.476 -20.893 1.00 0.00 H new ATOM 787 N VAL A 53 18.015 10.042 -18.171 1.00 0.00 N ATOM 788 CA VAL A 53 16.581 10.168 -17.919 1.00 0.00 C ATOM 789 C VAL A 53 16.249 10.326 -16.416 1.00 0.00 C ATOM 790 O VAL A 53 15.094 10.185 -16.010 1.00 0.00 O ATOM 791 CB VAL A 53 15.779 9.118 -18.703 1.00 0.00 C ATOM 792 CG1 VAL A 53 16.168 9.129 -20.189 1.00 0.00 C ATOM 793 CG2 VAL A 53 15.847 7.690 -18.161 1.00 0.00 C ATOM 0 H VAL A 53 18.381 9.100 -18.031 1.00 0.00 H new ATOM 0 HA VAL A 53 16.233 11.116 -18.329 1.00 0.00 H new ATOM 0 HB VAL A 53 14.742 9.426 -18.573 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.587 8.377 -20.723 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.964 10.113 -20.611 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.230 8.905 -20.289 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.246 7.033 -18.790 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.882 7.348 -18.165 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.462 7.669 -17.142 1.00 0.00 H new ATOM 803 N GLY A 54 17.247 10.676 -15.592 1.00 0.00 N ATOM 804 CA GLY A 54 17.090 11.073 -14.193 1.00 0.00 C ATOM 805 C GLY A 54 17.026 9.905 -13.200 1.00 0.00 C ATOM 806 O GLY A 54 16.580 10.094 -12.066 1.00 0.00 O ATOM 0 H GLY A 54 18.220 10.690 -15.897 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.922 11.721 -13.918 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.179 11.664 -14.097 1.00 0.00 H new ATOM 810 N ILE A 55 17.437 8.704 -13.609 1.00 0.00 N ATOM 811 CA ILE A 55 17.257 7.459 -12.857 1.00 0.00 C ATOM 812 C ILE A 55 18.521 7.103 -12.068 1.00 0.00 C ATOM 813 O ILE A 55 19.635 7.397 -12.502 1.00 0.00 O ATOM 814 CB ILE A 55 16.908 6.322 -13.833 1.00 0.00 C ATOM 815 CG1 ILE A 55 15.708 6.624 -14.748 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.741 4.935 -13.189 1.00 0.00 C ATOM 817 CD1 ILE A 55 14.339 6.461 -14.097 1.00 0.00 C ATOM 0 H ILE A 55 17.918 8.565 -14.498 1.00 0.00 H new ATOM 0 HA ILE A 55 16.444 7.596 -12.144 1.00 0.00 H new ATOM 0 HB ILE A 55 17.803 6.277 -14.453 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.799 7.647 -15.114 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.760 5.968 -15.617 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.496 4.203 -13.959 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.671 4.648 -12.698 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.937 4.970 -12.453 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.561 6.697 -14.823 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.218 5.433 -13.756 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.258 7.137 -13.246 1.00 0.00 H new ATOM 829 N ASP A 56 18.339 6.398 -10.948 1.00 0.00 N ATOM 830 CA ASP A 56 19.411 5.756 -10.196 1.00 0.00 C ATOM 831 C ASP A 56 19.187 4.254 -10.341 1.00 0.00 C ATOM 832 O ASP A 56 18.084 3.773 -10.074 1.00 0.00 O ATOM 833 CB ASP A 56 19.412 6.169 -8.721 1.00 0.00 C ATOM 834 CG ASP A 56 20.584 5.501 -7.974 1.00 0.00 C ATOM 835 OD1 ASP A 56 20.553 4.264 -7.766 1.00 0.00 O ATOM 836 OD2 ASP A 56 21.538 6.219 -7.591 1.00 0.00 O ATOM 0 H ASP A 56 17.418 6.257 -10.532 1.00 0.00 H new ATOM 0 HA ASP A 56 20.383 6.059 -10.585 1.00 0.00 H new ATOM 0 HB2 ASP A 56 19.493 7.253 -8.641 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.468 5.884 -8.257 1.00 0.00 H new ATOM 841 N ILE A 57 20.213 3.529 -10.773 1.00 0.00 N ATOM 842 CA ILE A 57 20.279 2.062 -10.793 1.00 0.00 C ATOM 843 C ILE A 57 21.571 1.577 -10.124 1.00 0.00 C ATOM 844 O ILE A 57 21.632 0.463 -9.617 1.00 0.00 O ATOM 845 CB ILE A 57 20.195 1.512 -12.230 1.00 0.00 C ATOM 846 CG1 ILE A 57 21.008 2.378 -13.207 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.747 1.283 -12.699 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.363 1.616 -14.470 1.00 0.00 C ATOM 0 H ILE A 57 21.062 3.962 -11.136 1.00 0.00 H new ATOM 0 HA ILE A 57 19.421 1.686 -10.236 1.00 0.00 H new ATOM 0 HB ILE A 57 20.654 0.523 -12.221 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.435 3.268 -13.468 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.921 2.718 -12.719 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.752 0.895 -13.718 1.00 0.00 H new ATOM 0 HG22 ILE A 57 18.260 0.565 -12.039 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.202 2.227 -12.672 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.937 2.261 -15.135 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.958 0.740 -14.211 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.449 1.298 -14.972 1.00 0.00 H new ATOM 860 N SER A 58 22.599 2.422 -10.102 1.00 0.00 N ATOM 861 CA SER A 58 23.844 2.305 -9.357 1.00 0.00 C ATOM 862 C SER A 58 23.640 1.742 -7.941 1.00 0.00 C ATOM 863 O SER A 58 24.426 0.909 -7.485 1.00 0.00 O ATOM 864 CB SER A 58 24.447 3.726 -9.271 1.00 0.00 C ATOM 865 OG SER A 58 23.849 4.624 -10.208 1.00 0.00 O ATOM 0 H SER A 58 22.577 3.279 -10.654 1.00 0.00 H new ATOM 0 HA SER A 58 24.504 1.606 -9.870 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.313 4.115 -8.262 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.520 3.675 -9.454 1.00 0.00 H new ATOM 0 HG SER A 58 24.258 5.510 -10.119 1.00 0.00 H new ATOM 871 N GLY A 59 22.576 2.172 -7.262 1.00 0.00 N ATOM 872 CA GLY A 59 22.221 1.773 -5.909 1.00 0.00 C ATOM 873 C GLY A 59 21.290 0.559 -5.848 1.00 0.00 C ATOM 874 O GLY A 59 20.621 0.381 -4.827 1.00 0.00 O ATOM 0 H GLY A 59 21.913 2.836 -7.661 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.133 1.548 -5.355 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.741 2.613 -5.406 1.00 0.00 H new ATOM 878 N GLN A 60 21.188 -0.268 -6.904 1.00 0.00 N ATOM 879 CA GLN A 60 20.311 -1.444 -6.883 1.00 0.00 C ATOM 880 C GLN A 60 20.700 -2.452 -5.811 1.00 0.00 C ATOM 881 O GLN A 60 19.841 -3.216 -5.368 1.00 0.00 O ATOM 882 CB GLN A 60 20.324 -2.171 -8.238 1.00 0.00 C ATOM 883 CG GLN A 60 19.170 -1.631 -9.090 1.00 0.00 C ATOM 884 CD GLN A 60 19.126 -2.162 -10.518 1.00 0.00 C ATOM 885 OE1 GLN A 60 19.576 -1.523 -11.450 1.00 0.00 O ATOM 886 NE2 GLN A 60 18.533 -3.316 -10.769 1.00 0.00 N ATOM 0 H GLN A 60 21.701 -0.142 -7.777 1.00 0.00 H new ATOM 0 HA GLN A 60 19.316 -1.059 -6.662 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.276 -2.011 -8.745 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.217 -3.246 -8.092 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.229 -1.875 -8.598 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.240 -0.544 -9.124 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.148 -3.869 -10.003 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.460 -3.654 -11.729 1.00 0.00 H new ATOM 895 N THR A 61 21.978 -2.494 -5.440 1.00 0.00 N ATOM 896 CA THR A 61 22.490 -3.526 -4.567 1.00 0.00 C ATOM 897 C THR A 61 21.781 -3.450 -3.203 1.00 0.00 C ATOM 898 O THR A 61 21.705 -2.373 -2.598 1.00 0.00 O ATOM 899 CB THR A 61 24.027 -3.400 -4.442 1.00 0.00 C ATOM 900 OG1 THR A 61 24.499 -2.110 -4.825 1.00 0.00 O ATOM 901 CG2 THR A 61 24.746 -4.413 -5.330 1.00 0.00 C ATOM 0 H THR A 61 22.677 -1.814 -5.739 1.00 0.00 H new ATOM 0 HA THR A 61 22.282 -4.509 -4.989 1.00 0.00 H new ATOM 0 HB THR A 61 24.244 -3.581 -3.389 1.00 0.00 H new ATOM 0 HG1 THR A 61 23.998 -1.421 -4.340 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.824 -4.296 -5.217 1.00 0.00 H new ATOM 0 HG22 THR A 61 24.458 -5.423 -5.037 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.470 -4.245 -6.371 1.00 0.00 H new ATOM 909 N SER A 62 21.262 -4.583 -2.722 1.00 0.00 N ATOM 910 CA SER A 62 20.440 -4.653 -1.518 1.00 0.00 C ATOM 911 C SER A 62 20.786 -5.920 -0.739 1.00 0.00 C ATOM 912 O SER A 62 21.410 -5.845 0.324 1.00 0.00 O ATOM 913 CB SER A 62 18.948 -4.583 -1.897 1.00 0.00 C ATOM 914 OG SER A 62 18.661 -5.440 -2.993 1.00 0.00 O ATOM 0 H SER A 62 21.405 -5.489 -3.167 1.00 0.00 H new ATOM 0 HA SER A 62 20.646 -3.802 -0.870 1.00 0.00 H new ATOM 0 HB2 SER A 62 18.338 -4.866 -1.040 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.682 -3.557 -2.153 1.00 0.00 H new ATOM 0 HG SER A 62 18.073 -6.166 -2.696 1.00 0.00 H new ATOM 920 N ASP A 63 20.411 -7.086 -1.270 1.00 0.00 N ATOM 921 CA ASP A 63 20.555 -8.385 -0.621 1.00 0.00 C ATOM 922 C ASP A 63 20.554 -9.512 -1.688 1.00 0.00 C ATOM 923 O ASP A 63 20.075 -9.282 -2.803 1.00 0.00 O ATOM 924 CB ASP A 63 19.434 -8.579 0.429 1.00 0.00 C ATOM 925 CG ASP A 63 18.498 -9.728 0.060 1.00 0.00 C ATOM 926 OD1 ASP A 63 17.638 -9.507 -0.817 1.00 0.00 O ATOM 927 OD2 ASP A 63 18.689 -10.847 0.595 1.00 0.00 O ATOM 0 H ASP A 63 19.985 -7.151 -2.194 1.00 0.00 H new ATOM 0 HA ASP A 63 21.509 -8.430 -0.095 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.880 -8.774 1.404 1.00 0.00 H new ATOM 0 HB3 ASP A 63 18.859 -7.658 0.520 1.00 0.00 H new ATOM 932 N PRO A 64 21.045 -10.728 -1.368 1.00 0.00 N ATOM 933 CA PRO A 64 20.978 -11.919 -2.221 1.00 0.00 C ATOM 934 C PRO A 64 19.570 -12.524 -2.464 1.00 0.00 C ATOM 935 O PRO A 64 19.466 -13.744 -2.629 1.00 0.00 O ATOM 936 CB PRO A 64 21.902 -12.953 -1.554 1.00 0.00 C ATOM 937 CG PRO A 64 22.830 -12.129 -0.672 1.00 0.00 C ATOM 938 CD PRO A 64 21.909 -11.002 -0.226 1.00 0.00 C ATOM 0 HA PRO A 64 21.284 -11.627 -3.226 1.00 0.00 H new ATOM 0 HB2 PRO A 64 21.332 -13.672 -0.966 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.462 -13.521 -2.297 1.00 0.00 H new ATOM 0 HG2 PRO A 64 23.211 -12.704 0.172 1.00 0.00 H new ATOM 0 HG3 PRO A 64 23.695 -11.758 -1.222 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.325 -11.295 0.646 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.480 -10.117 0.055 1.00 0.00 H new ATOM 946 N ILE A 65 18.495 -11.730 -2.438 1.00 0.00 N ATOM 947 CA ILE A 65 17.069 -12.086 -2.432 1.00 0.00 C ATOM 948 C ILE A 65 16.620 -12.853 -1.173 1.00 0.00 C ATOM 949 O ILE A 65 15.454 -12.797 -0.779 1.00 0.00 O ATOM 950 CB ILE A 65 16.614 -12.723 -3.776 1.00 0.00 C ATOM 951 CG1 ILE A 65 15.302 -12.074 -4.270 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.434 -14.254 -3.711 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.841 -12.523 -5.661 1.00 0.00 C ATOM 0 H ILE A 65 18.612 -10.717 -2.419 1.00 0.00 H new ATOM 0 HA ILE A 65 16.523 -11.146 -2.360 1.00 0.00 H new ATOM 0 HB ILE A 65 17.423 -12.528 -4.480 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.512 -12.296 -3.553 1.00 0.00 H new ATOM 0 HG13 ILE A 65 15.430 -10.992 -4.278 1.00 0.00 H new ATOM 0 HG21 ILE A 65 16.116 -14.625 -4.685 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.380 -14.720 -3.437 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.678 -14.500 -2.965 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.913 -12.013 -5.919 1.00 0.00 H new ATOM 0 HD12 ILE A 65 15.607 -12.276 -6.396 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.675 -13.600 -5.659 1.00 0.00 H new ATOM 965 N GLU A 66 17.535 -13.565 -0.523 1.00 0.00 N ATOM 966 CA GLU A 66 17.330 -14.513 0.526 1.00 0.00 C ATOM 967 C GLU A 66 16.854 -13.925 1.861 1.00 0.00 C ATOM 968 O GLU A 66 16.144 -14.607 2.611 1.00 0.00 O ATOM 969 CB GLU A 66 18.710 -15.180 0.626 1.00 0.00 C ATOM 970 CG GLU A 66 18.789 -16.146 1.786 1.00 0.00 C ATOM 971 CD GLU A 66 20.087 -16.975 1.777 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.115 -16.512 2.327 1.00 0.00 O ATOM 973 OE2 GLU A 66 20.083 -18.107 1.238 1.00 0.00 O ATOM 0 H GLU A 66 18.525 -13.472 -0.751 1.00 0.00 H new ATOM 0 HA GLU A 66 16.512 -15.198 0.301 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.925 -15.710 -0.302 1.00 0.00 H new ATOM 0 HB3 GLU A 66 19.476 -14.413 0.740 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.723 -15.591 2.722 1.00 0.00 H new ATOM 0 HG3 GLU A 66 17.932 -16.819 1.753 1.00 0.00 H new ATOM 980 N ASN A 67 17.230 -12.686 2.177 1.00 0.00 N ATOM 981 CA ASN A 67 16.896 -12.060 3.456 1.00 0.00 C ATOM 982 C ASN A 67 15.398 -11.767 3.583 1.00 0.00 C ATOM 983 O ASN A 67 14.915 -11.533 4.696 1.00 0.00 O ATOM 984 CB ASN A 67 17.696 -10.766 3.689 1.00 0.00 C ATOM 985 CG ASN A 67 19.159 -11.050 4.014 1.00 0.00 C ATOM 986 OD1 ASN A 67 19.548 -11.118 5.178 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.993 -11.254 3.006 1.00 0.00 N ATOM 0 H ASN A 67 17.774 -12.089 1.554 1.00 0.00 H new ATOM 0 HA ASN A 67 17.171 -12.784 4.223 1.00 0.00 H new ATOM 0 HB2 ASN A 67 17.637 -10.138 2.800 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.245 -10.203 4.507 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.972 -11.471 3.190 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.656 -11.194 2.045 1.00 0.00 H new ATOM 994 N PHE A 68 14.663 -11.760 2.467 1.00 0.00 N ATOM 995 CA PHE A 68 13.245 -11.436 2.410 1.00 0.00 C ATOM 996 C PHE A 68 12.388 -12.670 2.228 1.00 0.00 C ATOM 997 O PHE A 68 12.859 -13.713 1.762 1.00 0.00 O ATOM 998 CB PHE A 68 12.973 -10.517 1.219 1.00 0.00 C ATOM 999 CG PHE A 68 13.719 -9.219 1.322 1.00 0.00 C ATOM 1000 CD1 PHE A 68 13.368 -8.310 2.330 1.00 0.00 C ATOM 1001 CD2 PHE A 68 14.803 -8.970 0.468 1.00 0.00 C ATOM 1002 CE1 PHE A 68 14.110 -7.122 2.486 1.00 0.00 C ATOM 1003 CE2 PHE A 68 15.513 -7.762 0.596 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.188 -6.854 1.617 1.00 0.00 C ATOM 0 H PHE A 68 15.056 -11.987 1.554 1.00 0.00 H new ATOM 0 HA PHE A 68 12.992 -10.956 3.355 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.257 -11.025 0.298 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.904 -10.315 1.155 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.534 -8.519 2.983 1.00 0.00 H new ATOM 0 HD2 PHE A 68 15.089 -9.696 -0.278 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.855 -6.421 3.267 1.00 0.00 H new ATOM 0 HE2 PHE A 68 16.311 -7.532 -0.094 1.00 0.00 H new ATOM 0 HZ PHE A 68 15.765 -5.949 1.737 1.00 0.00 H new ATOM 1014 N ASN A 69 11.100 -12.521 2.559 1.00 0.00 N ATOM 1015 CA ASN A 69 10.104 -13.502 2.217 1.00 0.00 C ATOM 1016 C ASN A 69 9.470 -13.025 0.928 1.00 0.00 C ATOM 1017 O ASN A 69 9.079 -11.858 0.843 1.00 0.00 O ATOM 1018 CB ASN A 69 9.033 -13.684 3.295 1.00 0.00 C ATOM 1019 CG ASN A 69 8.185 -14.940 3.091 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.163 -15.534 2.016 1.00 0.00 O ATOM 1021 ND2 ASN A 69 7.451 -15.364 4.108 1.00 0.00 N ATOM 0 H ASN A 69 10.736 -11.716 3.069 1.00 0.00 H new ATOM 0 HA ASN A 69 10.578 -14.478 2.116 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.514 -13.732 4.272 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.382 -12.810 3.303 1.00 0.00 H new ATOM 0 HD21 ASN A 69 6.862 -16.190 4.002 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.475 -14.865 4.997 1.00 0.00 H new ATOM 1028 N ALA A 70 9.293 -13.908 -0.045 1.00 0.00 N ATOM 1029 CA ALA A 70 8.689 -13.510 -1.285 1.00 0.00 C ATOM 1030 C ALA A 70 7.204 -13.279 -1.056 1.00 0.00 C ATOM 1031 O ALA A 70 6.585 -12.464 -1.737 1.00 0.00 O ATOM 1032 CB ALA A 70 8.937 -14.567 -2.356 1.00 0.00 C ATOM 0 H ALA A 70 9.559 -14.891 0.009 1.00 0.00 H new ATOM 0 HA ALA A 70 9.136 -12.581 -1.639 1.00 0.00 H new ATOM 0 HB1 ALA A 70 8.474 -14.253 -3.291 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.010 -14.689 -2.505 1.00 0.00 H new ATOM 0 HB3 ALA A 70 8.505 -15.516 -2.038 1.00 0.00 H new ATOM 1038 N ASP A 71 6.628 -13.971 -0.069 1.00 0.00 N ATOM 1039 CA ASP A 71 5.217 -13.844 0.227 1.00 0.00 C ATOM 1040 C ASP A 71 4.872 -12.445 0.769 1.00 0.00 C ATOM 1041 O ASP A 71 3.719 -12.012 0.681 1.00 0.00 O ATOM 1042 CB ASP A 71 4.793 -14.923 1.229 1.00 0.00 C ATOM 1043 CG ASP A 71 3.286 -14.867 1.524 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.479 -15.198 0.621 1.00 0.00 O ATOM 1045 OD2 ASP A 71 2.907 -14.547 2.677 1.00 0.00 O ATOM 0 H ASP A 71 7.127 -14.624 0.535 1.00 0.00 H new ATOM 0 HA ASP A 71 4.666 -13.980 -0.704 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.050 -15.906 0.835 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.350 -14.796 2.157 1.00 0.00 H new ATOM 1050 N ASP A 72 5.866 -11.714 1.299 1.00 0.00 N ATOM 1051 CA ASP A 72 5.683 -10.342 1.763 1.00 0.00 C ATOM 1052 C ASP A 72 5.523 -9.366 0.591 1.00 0.00 C ATOM 1053 O ASP A 72 4.853 -8.336 0.713 1.00 0.00 O ATOM 1054 CB ASP A 72 6.873 -9.902 2.619 1.00 0.00 C ATOM 1055 CG ASP A 72 6.602 -8.539 3.286 1.00 0.00 C ATOM 1056 OD1 ASP A 72 5.670 -8.453 4.121 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.347 -7.564 3.028 1.00 0.00 O ATOM 0 H ASP A 72 6.817 -12.064 1.415 1.00 0.00 H new ATOM 0 HA ASP A 72 4.771 -10.324 2.360 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.071 -10.652 3.385 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.767 -9.836 1.998 1.00 0.00 H new ATOM 1062 N TYR A 73 6.136 -9.694 -0.552 1.00 0.00 N ATOM 1063 CA TYR A 73 6.076 -8.897 -1.761 1.00 0.00 C ATOM 1064 C TYR A 73 4.733 -9.099 -2.464 1.00 0.00 C ATOM 1065 O TYR A 73 4.188 -10.205 -2.487 1.00 0.00 O ATOM 1066 CB TYR A 73 7.263 -9.182 -2.699 1.00 0.00 C ATOM 1067 CG TYR A 73 8.543 -8.464 -2.302 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.206 -8.808 -1.108 1.00 0.00 C ATOM 1069 CD2 TYR A 73 9.054 -7.433 -3.114 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.347 -8.098 -0.703 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.204 -6.722 -2.717 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.848 -7.047 -1.500 1.00 0.00 C ATOM 1073 OH TYR A 73 11.955 -6.369 -1.088 1.00 0.00 O ATOM 0 H TYR A 73 6.697 -10.540 -0.654 1.00 0.00 H new ATOM 0 HA TYR A 73 6.156 -7.848 -1.477 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.450 -10.256 -2.717 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.992 -8.888 -3.713 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.835 -9.621 -0.502 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.563 -7.187 -4.044 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.843 -8.357 0.221 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.593 -5.931 -3.341 1.00 0.00 H new ATOM 0 HH TYR A 73 12.527 -6.966 -0.562 1.00 0.00 H new ATOM 1083 N ASP A 74 4.222 -8.026 -3.074 1.00 0.00 N ATOM 1084 CA ASP A 74 2.971 -8.071 -3.834 1.00 0.00 C ATOM 1085 C ASP A 74 3.248 -8.317 -5.319 1.00 0.00 C ATOM 1086 O ASP A 74 2.462 -8.991 -5.984 1.00 0.00 O ATOM 1087 CB ASP A 74 2.180 -6.778 -3.629 1.00 0.00 C ATOM 1088 CG ASP A 74 0.789 -6.883 -4.283 1.00 0.00 C ATOM 1089 OD1 ASP A 74 -0.064 -7.628 -3.744 1.00 0.00 O ATOM 1090 OD2 ASP A 74 0.526 -6.170 -5.279 1.00 0.00 O ATOM 0 H ASP A 74 4.662 -7.106 -3.055 1.00 0.00 H new ATOM 0 HA ASP A 74 2.369 -8.902 -3.466 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.072 -6.576 -2.563 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.727 -5.939 -4.058 1.00 0.00 H new ATOM 1095 N VAL A 75 4.386 -7.821 -5.828 1.00 0.00 N ATOM 1096 CA VAL A 75 4.701 -7.813 -7.243 1.00 0.00 C ATOM 1097 C VAL A 75 6.153 -8.216 -7.451 1.00 0.00 C ATOM 1098 O VAL A 75 7.065 -7.641 -6.854 1.00 0.00 O ATOM 1099 CB VAL A 75 4.485 -6.400 -7.806 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.627 -6.435 -9.332 1.00 0.00 C ATOM 1101 CG2 VAL A 75 3.162 -5.746 -7.377 1.00 0.00 C ATOM 0 H VAL A 75 5.118 -7.410 -5.248 1.00 0.00 H new ATOM 0 HA VAL A 75 4.051 -8.520 -7.758 1.00 0.00 H new ATOM 0 HB VAL A 75 5.258 -5.763 -7.375 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.474 -5.434 -9.735 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.625 -6.784 -9.597 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.883 -7.112 -9.751 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.088 -4.752 -7.817 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.327 -6.357 -7.719 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.132 -5.665 -6.290 1.00 0.00 H new ATOM 1111 N VAL A 76 6.396 -9.155 -8.356 1.00 0.00 N ATOM 1112 CA VAL A 76 7.739 -9.555 -8.731 1.00 0.00 C ATOM 1113 C VAL A 76 7.684 -9.898 -10.217 1.00 0.00 C ATOM 1114 O VAL A 76 6.714 -10.496 -10.685 1.00 0.00 O ATOM 1115 CB VAL A 76 8.164 -10.744 -7.860 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.475 -11.374 -8.360 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.375 -10.409 -6.365 1.00 0.00 C ATOM 0 H VAL A 76 5.661 -9.661 -8.851 1.00 0.00 H new ATOM 0 HA VAL A 76 8.480 -8.772 -8.572 1.00 0.00 H new ATOM 0 HB VAL A 76 7.323 -11.432 -7.947 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.744 -12.213 -7.718 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.342 -11.728 -9.382 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.270 -10.629 -8.335 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.673 -11.310 -5.829 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.155 -9.654 -6.268 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.445 -10.027 -5.943 1.00 0.00 H new ATOM 1127 N ILE A 77 8.715 -9.500 -10.956 1.00 0.00 N ATOM 1128 CA ILE A 77 8.761 -9.539 -12.403 1.00 0.00 C ATOM 1129 C ILE A 77 10.069 -10.205 -12.794 1.00 0.00 C ATOM 1130 O ILE A 77 11.138 -9.719 -12.406 1.00 0.00 O ATOM 1131 CB ILE A 77 8.699 -8.090 -12.942 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.506 -7.262 -12.402 1.00 0.00 C ATOM 1133 CG2 ILE A 77 8.759 -8.057 -14.478 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.120 -7.772 -12.791 1.00 0.00 C ATOM 0 H ILE A 77 9.570 -9.129 -10.542 1.00 0.00 H new ATOM 0 HA ILE A 77 7.923 -10.097 -12.821 1.00 0.00 H new ATOM 0 HB ILE A 77 9.591 -7.599 -12.552 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.570 -7.232 -11.314 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.609 -6.236 -12.756 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.713 -7.024 -14.822 1.00 0.00 H new ATOM 0 HG22 ILE A 77 9.691 -8.511 -14.816 1.00 0.00 H new ATOM 0 HG23 ILE A 77 7.916 -8.613 -14.887 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.359 -7.121 -12.361 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.025 -7.775 -13.877 1.00 0.00 H new ATOM 0 HD13 ILE A 77 5.986 -8.785 -12.413 1.00 0.00 H new ATOM 1146 N SER A 78 9.997 -11.279 -13.573 1.00 0.00 N ATOM 1147 CA SER A 78 11.178 -11.843 -14.184 1.00 0.00 C ATOM 1148 C SER A 78 11.333 -11.163 -15.539 1.00 0.00 C ATOM 1149 O SER A 78 10.490 -11.286 -16.429 1.00 0.00 O ATOM 1150 CB SER A 78 11.092 -13.361 -14.289 1.00 0.00 C ATOM 1151 OG SER A 78 11.183 -13.927 -12.990 1.00 0.00 O ATOM 0 H SER A 78 9.130 -11.771 -13.791 1.00 0.00 H new ATOM 0 HA SER A 78 12.061 -11.661 -13.572 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.153 -13.652 -14.760 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.896 -13.740 -14.920 1.00 0.00 H new ATOM 0 HG SER A 78 11.126 -14.903 -13.054 1.00 0.00 H new ATOM 1157 N LEU A 79 12.423 -10.411 -15.679 1.00 0.00 N ATOM 1158 CA LEU A 79 12.754 -9.680 -16.900 1.00 0.00 C ATOM 1159 C LEU A 79 13.330 -10.610 -17.969 1.00 0.00 C ATOM 1160 O LEU A 79 13.581 -10.162 -19.089 1.00 0.00 O ATOM 1161 CB LEU A 79 13.760 -8.571 -16.568 1.00 0.00 C ATOM 1162 CG LEU A 79 13.195 -7.459 -15.671 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.402 -6.676 -15.168 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.272 -6.521 -16.453 1.00 0.00 C ATOM 0 H LEU A 79 13.111 -10.291 -14.936 1.00 0.00 H new ATOM 0 HA LEU A 79 11.839 -9.243 -17.301 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.625 -9.015 -16.076 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.115 -8.127 -17.498 1.00 0.00 H new ATOM 0 HG LEU A 79 12.605 -7.886 -14.860 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.066 -5.866 -14.521 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.059 -7.341 -14.607 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.946 -6.261 -16.017 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.891 -5.747 -15.787 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.829 -6.057 -17.267 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.438 -7.090 -16.863 1.00 0.00 H new ATOM 1176 N CYS A 80 13.591 -11.865 -17.611 1.00 0.00 N ATOM 1177 CA CYS A 80 13.931 -12.929 -18.524 1.00 0.00 C ATOM 1178 C CYS A 80 13.203 -14.179 -18.036 1.00 0.00 C ATOM 1179 O CYS A 80 13.269 -14.489 -16.843 1.00 0.00 O ATOM 1180 CB CYS A 80 15.455 -13.114 -18.583 1.00 0.00 C ATOM 1181 SG CYS A 80 16.255 -13.658 -17.040 1.00 0.00 S ATOM 0 H CYS A 80 13.568 -12.170 -16.638 1.00 0.00 H new ATOM 0 HA CYS A 80 13.619 -12.704 -19.544 1.00 0.00 H new ATOM 0 HB2 CYS A 80 15.683 -13.841 -19.363 1.00 0.00 H new ATOM 0 HB3 CYS A 80 15.904 -12.169 -18.888 1.00 0.00 H new ATOM 1186 N GLY A 81 12.544 -14.886 -18.953 1.00 0.00 N ATOM 1187 CA GLY A 81 11.960 -16.206 -18.748 1.00 0.00 C ATOM 1188 C GLY A 81 11.055 -16.351 -17.512 1.00 0.00 C ATOM 1189 O GLY A 81 10.498 -15.386 -16.979 1.00 0.00 O ATOM 0 H GLY A 81 12.397 -14.537 -19.900 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.380 -16.468 -19.633 1.00 0.00 H new ATOM 0 HA3 GLY A 81 12.769 -16.933 -18.671 1.00 0.00 H new ATOM 1193 N SER A 82 10.948 -17.602 -17.054 1.00 0.00 N ATOM 1194 CA SER A 82 10.205 -18.019 -15.868 1.00 0.00 C ATOM 1195 C SER A 82 11.104 -18.980 -15.087 1.00 0.00 C ATOM 1196 O SER A 82 11.788 -19.809 -15.695 1.00 0.00 O ATOM 1197 CB SER A 82 8.890 -18.713 -16.263 1.00 0.00 C ATOM 1198 OG SER A 82 8.120 -17.915 -17.153 1.00 0.00 O ATOM 0 H SER A 82 11.400 -18.386 -17.525 1.00 0.00 H new ATOM 0 HA SER A 82 9.942 -17.154 -15.259 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.111 -19.671 -16.733 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.307 -18.924 -15.367 1.00 0.00 H new ATOM 0 HG SER A 82 7.293 -18.388 -17.384 1.00 0.00 H new ATOM 1204 N GLY A 83 11.130 -18.876 -13.756 1.00 0.00 N ATOM 1205 CA GLY A 83 12.037 -19.653 -12.914 1.00 0.00 C ATOM 1206 C GLY A 83 13.454 -19.107 -13.019 1.00 0.00 C ATOM 1207 O GLY A 83 13.914 -18.429 -12.108 1.00 0.00 O ATOM 0 H GLY A 83 10.520 -18.248 -13.232 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.702 -19.617 -11.877 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.020 -20.699 -13.218 1.00 0.00 H new ATOM 1211 N VAL A 84 14.147 -19.383 -14.129 1.00 0.00 N ATOM 1212 CA VAL A 84 15.498 -18.892 -14.450 1.00 0.00 C ATOM 1213 C VAL A 84 16.505 -19.063 -13.290 1.00 0.00 C ATOM 1214 O VAL A 84 17.383 -18.228 -13.088 1.00 0.00 O ATOM 1215 CB VAL A 84 15.461 -17.498 -15.135 1.00 0.00 C ATOM 1216 CG1 VAL A 84 14.695 -17.566 -16.467 1.00 0.00 C ATOM 1217 CG2 VAL A 84 14.871 -16.364 -14.284 1.00 0.00 C ATOM 0 H VAL A 84 13.767 -19.981 -14.863 1.00 0.00 H new ATOM 0 HA VAL A 84 15.917 -19.548 -15.213 1.00 0.00 H new ATOM 0 HB VAL A 84 16.511 -17.250 -15.293 1.00 0.00 H new ATOM 0 HG11 VAL A 84 14.681 -16.579 -16.930 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.188 -18.273 -17.134 1.00 0.00 H new ATOM 0 HG13 VAL A 84 13.672 -17.894 -16.282 1.00 0.00 H new ATOM 0 HG21 VAL A 84 14.891 -15.434 -14.853 1.00 0.00 H new ATOM 0 HG22 VAL A 84 13.842 -16.606 -14.019 1.00 0.00 H new ATOM 0 HG23 VAL A 84 15.461 -16.246 -13.375 1.00 0.00 H new ATOM 1227 N ASN A 85 16.373 -20.171 -12.543 1.00 0.00 N ATOM 1228 CA ASN A 85 17.202 -20.590 -11.398 1.00 0.00 C ATOM 1229 C ASN A 85 17.005 -19.714 -10.152 1.00 0.00 C ATOM 1230 O ASN A 85 17.591 -19.973 -9.099 1.00 0.00 O ATOM 1231 CB ASN A 85 18.681 -20.744 -11.797 1.00 0.00 C ATOM 1232 CG ASN A 85 19.505 -21.478 -10.737 1.00 0.00 C ATOM 1233 OD1 ASN A 85 20.370 -20.893 -10.087 1.00 0.00 O ATOM 1234 ND2 ASN A 85 19.287 -22.774 -10.553 1.00 0.00 N ATOM 0 H ASN A 85 15.633 -20.846 -12.736 1.00 0.00 H new ATOM 0 HA ASN A 85 16.848 -21.578 -11.104 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.744 -21.287 -12.740 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.112 -19.757 -11.967 1.00 0.00 H new ATOM 0 HD21 ASN A 85 19.838 -23.292 -9.869 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.568 -23.252 -11.096 1.00 0.00 H new ATOM 1241 N LEU A 86 16.139 -18.708 -10.247 1.00 0.00 N ATOM 1242 CA LEU A 86 15.668 -17.921 -9.124 1.00 0.00 C ATOM 1243 C LEU A 86 14.614 -18.764 -8.366 1.00 0.00 C ATOM 1244 O LEU A 86 13.938 -19.585 -9.000 1.00 0.00 O ATOM 1245 CB LEU A 86 15.221 -16.546 -9.676 1.00 0.00 C ATOM 1246 CG LEU A 86 14.000 -15.902 -9.008 1.00 0.00 C ATOM 1247 CD1 LEU A 86 14.023 -14.382 -9.216 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.716 -16.452 -9.653 1.00 0.00 C ATOM 0 H LEU A 86 15.737 -18.414 -11.137 1.00 0.00 H new ATOM 0 HA LEU A 86 16.423 -17.688 -8.373 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.060 -15.855 -9.590 1.00 0.00 H new ATOM 0 HB3 LEU A 86 15.008 -16.659 -10.739 1.00 0.00 H new ATOM 0 HG LEU A 86 14.025 -16.131 -7.943 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.151 -13.936 -8.737 1.00 0.00 H new ATOM 0 HD12 LEU A 86 14.930 -13.968 -8.776 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.004 -14.160 -10.283 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.847 -15.996 -9.180 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.714 -16.218 -10.718 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.676 -17.533 -9.519 1.00 0.00 H new ATOM 1260 N PRO A 87 14.469 -18.641 -7.030 1.00 0.00 N ATOM 1261 CA PRO A 87 13.570 -19.515 -6.276 1.00 0.00 C ATOM 1262 C PRO A 87 12.083 -19.307 -6.637 1.00 0.00 C ATOM 1263 O PRO A 87 11.665 -18.166 -6.849 1.00 0.00 O ATOM 1264 CB PRO A 87 13.870 -19.272 -4.790 1.00 0.00 C ATOM 1265 CG PRO A 87 15.279 -18.688 -4.794 1.00 0.00 C ATOM 1266 CD PRO A 87 15.333 -17.910 -6.110 1.00 0.00 C ATOM 0 HA PRO A 87 13.749 -20.559 -6.533 1.00 0.00 H new ATOM 0 HB2 PRO A 87 13.153 -18.583 -4.345 1.00 0.00 H new ATOM 0 HB3 PRO A 87 13.822 -20.197 -4.216 1.00 0.00 H new ATOM 0 HG2 PRO A 87 15.448 -18.038 -3.935 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.038 -19.469 -4.757 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.985 -16.886 -5.975 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.353 -17.853 -6.491 1.00 0.00 H new ATOM 1274 N PRO A 88 11.257 -20.366 -6.697 1.00 0.00 N ATOM 1275 CA PRO A 88 9.893 -20.294 -7.220 1.00 0.00 C ATOM 1276 C PRO A 88 8.940 -19.469 -6.369 1.00 0.00 C ATOM 1277 O PRO A 88 7.958 -18.990 -6.927 1.00 0.00 O ATOM 1278 CB PRO A 88 9.425 -21.746 -7.358 1.00 0.00 C ATOM 1279 CG PRO A 88 10.253 -22.485 -6.308 1.00 0.00 C ATOM 1280 CD PRO A 88 11.587 -21.741 -6.356 1.00 0.00 C ATOM 0 HA PRO A 88 9.892 -19.769 -8.175 1.00 0.00 H new ATOM 0 HB2 PRO A 88 8.356 -21.844 -7.169 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.608 -22.134 -8.360 1.00 0.00 H new ATOM 0 HG2 PRO A 88 9.795 -22.434 -5.320 1.00 0.00 H new ATOM 0 HG3 PRO A 88 10.368 -23.541 -6.552 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.100 -21.794 -5.396 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.254 -22.180 -7.098 1.00 0.00 H new ATOM 1288 N GLU A 89 9.201 -19.210 -5.087 1.00 0.00 N ATOM 1289 CA GLU A 89 8.336 -18.326 -4.322 1.00 0.00 C ATOM 1290 C GLU A 89 8.339 -16.897 -4.895 1.00 0.00 C ATOM 1291 O GLU A 89 7.400 -16.144 -4.641 1.00 0.00 O ATOM 1292 CB GLU A 89 8.673 -18.372 -2.822 1.00 0.00 C ATOM 1293 CG GLU A 89 10.114 -17.976 -2.455 1.00 0.00 C ATOM 1294 CD GLU A 89 11.024 -19.210 -2.280 1.00 0.00 C ATOM 1295 OE1 GLU A 89 11.154 -20.017 -3.231 1.00 0.00 O ATOM 1296 OE2 GLU A 89 11.607 -19.377 -1.179 1.00 0.00 O ATOM 0 H GLU A 89 9.991 -19.594 -4.568 1.00 0.00 H new ATOM 0 HA GLU A 89 7.313 -18.690 -4.419 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.987 -17.711 -2.293 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.488 -19.382 -2.456 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.523 -17.331 -3.233 1.00 0.00 H new ATOM 0 HG3 GLU A 89 10.107 -17.396 -1.532 1.00 0.00 H new ATOM 1303 N TRP A 90 9.341 -16.532 -5.700 1.00 0.00 N ATOM 1304 CA TRP A 90 9.426 -15.268 -6.425 1.00 0.00 C ATOM 1305 C TRP A 90 8.754 -15.327 -7.805 1.00 0.00 C ATOM 1306 O TRP A 90 8.689 -14.328 -8.519 1.00 0.00 O ATOM 1307 CB TRP A 90 10.899 -14.921 -6.588 1.00 0.00 C ATOM 1308 CG TRP A 90 11.629 -14.688 -5.300 1.00 0.00 C ATOM 1309 CD1 TRP A 90 12.455 -15.560 -4.685 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.541 -13.543 -4.405 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.835 -15.061 -3.452 1.00 0.00 N ATOM 1312 CE2 TRP A 90 12.267 -13.825 -3.212 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.877 -12.306 -4.475 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 12.284 -12.937 -2.125 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.882 -11.407 -3.394 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.581 -11.724 -2.217 1.00 0.00 C ATOM 0 H TRP A 90 10.146 -17.136 -5.869 1.00 0.00 H new ATOM 0 HA TRP A 90 8.895 -14.507 -5.853 1.00 0.00 H new ATOM 0 HB2 TRP A 90 11.392 -15.729 -7.129 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.982 -14.026 -7.205 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.772 -16.507 -5.095 1.00 0.00 H new ATOM 0 HE1 TRP A 90 13.456 -15.544 -2.803 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.351 -12.040 -5.380 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.832 -13.184 -1.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.348 -10.471 -3.468 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.578 -11.036 -1.384 1.00 0.00 H new ATOM 1327 N VAL A 91 8.298 -16.501 -8.226 1.00 0.00 N ATOM 1328 CA VAL A 91 7.523 -16.701 -9.431 1.00 0.00 C ATOM 1329 C VAL A 91 6.032 -16.671 -9.080 1.00 0.00 C ATOM 1330 O VAL A 91 5.194 -16.631 -9.979 1.00 0.00 O ATOM 1331 CB VAL A 91 8.003 -17.973 -10.140 1.00 0.00 C ATOM 1332 CG1 VAL A 91 7.346 -18.245 -11.501 1.00 0.00 C ATOM 1333 CG2 VAL A 91 9.528 -17.975 -10.366 1.00 0.00 C ATOM 0 H VAL A 91 8.467 -17.367 -7.715 1.00 0.00 H new ATOM 0 HA VAL A 91 7.672 -15.896 -10.150 1.00 0.00 H new ATOM 0 HB VAL A 91 7.702 -18.761 -9.450 1.00 0.00 H new ATOM 0 HG11 VAL A 91 7.750 -19.165 -11.923 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.269 -18.348 -11.371 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.552 -17.415 -12.177 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.820 -18.896 -10.871 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.806 -17.120 -10.982 1.00 0.00 H new ATOM 0 HG23 VAL A 91 10.038 -17.911 -9.405 1.00 0.00 H new ATOM 1343 N THR A 92 5.679 -16.663 -7.788 1.00 0.00 N ATOM 1344 CA THR A 92 4.297 -16.865 -7.363 1.00 0.00 C ATOM 1345 C THR A 92 3.659 -15.717 -6.573 1.00 0.00 C ATOM 1346 O THR A 92 2.867 -15.953 -5.653 1.00 0.00 O ATOM 1347 CB THR A 92 4.241 -18.227 -6.651 1.00 0.00 C ATOM 1348 OG1 THR A 92 5.103 -18.255 -5.523 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.709 -19.325 -7.606 1.00 0.00 C ATOM 0 H THR A 92 6.336 -16.518 -7.021 1.00 0.00 H new ATOM 0 HA THR A 92 3.661 -16.867 -8.248 1.00 0.00 H new ATOM 0 HB THR A 92 3.211 -18.387 -6.333 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.046 -19.132 -5.089 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.669 -20.289 -7.099 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.060 -19.347 -8.481 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.733 -19.122 -7.919 1.00 0.00 H new ATOM 1357 N GLN A 93 3.973 -14.470 -6.925 1.00 0.00 N ATOM 1358 CA GLN A 93 3.324 -13.315 -6.328 1.00 0.00 C ATOM 1359 C GLN A 93 1.871 -13.176 -6.803 1.00 0.00 C ATOM 1360 O GLN A 93 1.431 -13.898 -7.703 1.00 0.00 O ATOM 1361 CB GLN A 93 4.160 -12.047 -6.597 1.00 0.00 C ATOM 1362 CG GLN A 93 5.181 -11.849 -5.476 1.00 0.00 C ATOM 1363 CD GLN A 93 6.130 -13.040 -5.374 1.00 0.00 C ATOM 1364 OE1 GLN A 93 6.719 -13.463 -6.362 1.00 0.00 O ATOM 1365 NE2 GLN A 93 6.236 -13.664 -4.216 1.00 0.00 N ATOM 0 H GLN A 93 4.678 -14.239 -7.625 1.00 0.00 H new ATOM 0 HA GLN A 93 3.273 -13.457 -5.248 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.672 -12.135 -7.555 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.506 -11.177 -6.663 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.753 -10.940 -5.659 1.00 0.00 H new ATOM 0 HG3 GLN A 93 4.661 -11.713 -4.528 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.743 -13.307 -3.397 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.811 -14.503 -4.140 1.00 0.00 H new ATOM 1374 N GLU A 94 1.128 -12.222 -6.221 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.252 -11.948 -6.632 1.00 0.00 C ATOM 1376 C GLU A 94 -0.283 -11.541 -8.113 1.00 0.00 C ATOM 1377 O GLU A 94 -1.262 -11.804 -8.814 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.882 -10.850 -5.757 1.00 0.00 C ATOM 1379 CG GLU A 94 -1.141 -11.293 -4.309 1.00 0.00 C ATOM 1380 CD GLU A 94 -2.189 -12.420 -4.220 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.406 -12.137 -4.339 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.809 -13.599 -4.021 1.00 0.00 O ATOM 0 H GLU A 94 1.463 -11.628 -5.463 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.840 -12.857 -6.500 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.225 -9.980 -5.750 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.824 -10.535 -6.206 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.206 -11.633 -3.863 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.480 -10.438 -3.725 1.00 0.00 H new ATOM 1389 N ILE A 95 0.808 -10.939 -8.592 1.00 0.00 N ATOM 1390 CA ILE A 95 1.084 -10.683 -9.990 1.00 0.00 C ATOM 1391 C ILE A 95 2.532 -11.121 -10.207 1.00 0.00 C ATOM 1392 O ILE A 95 3.457 -10.590 -9.583 1.00 0.00 O ATOM 1393 CB ILE A 95 0.798 -9.214 -10.396 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.402 -8.904 -11.792 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.277 -8.232 -9.313 1.00 0.00 C ATOM 1396 CD1 ILE A 95 0.930 -7.591 -12.439 1.00 0.00 C ATOM 0 H ILE A 95 1.552 -10.605 -7.979 1.00 0.00 H new ATOM 0 HA ILE A 95 0.418 -11.246 -10.644 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.281 -9.081 -10.477 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.488 -8.874 -11.701 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.161 -9.728 -12.464 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.062 -7.211 -9.627 1.00 0.00 H new ATOM 0 HG22 ILE A 95 0.758 -8.440 -8.378 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.351 -8.348 -9.166 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.411 -7.470 -13.410 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.152 -7.619 -12.571 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.196 -6.752 -11.796 1.00 0.00 H new ATOM 1408 N PHE A 96 2.702 -12.127 -11.059 1.00 0.00 N ATOM 1409 CA PHE A 96 3.993 -12.527 -11.586 1.00 0.00 C ATOM 1410 C PHE A 96 3.957 -12.099 -13.059 1.00 0.00 C ATOM 1411 O PHE A 96 2.893 -12.191 -13.684 1.00 0.00 O ATOM 1412 CB PHE A 96 4.260 -14.027 -11.430 1.00 0.00 C ATOM 1413 CG PHE A 96 5.508 -14.445 -12.179 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.767 -14.035 -11.703 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.412 -15.161 -13.387 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.926 -14.346 -12.429 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.575 -15.464 -14.119 1.00 0.00 C ATOM 1418 CZ PHE A 96 7.830 -15.055 -13.641 1.00 0.00 C ATOM 0 H PHE A 96 1.929 -12.695 -11.406 1.00 0.00 H new ATOM 0 HA PHE A 96 4.810 -12.057 -11.039 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.369 -14.271 -10.373 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.404 -14.591 -11.801 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.841 -13.481 -10.779 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.446 -15.478 -13.752 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.893 -14.041 -12.058 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.502 -16.011 -15.048 1.00 0.00 H new ATOM 0 HZ PHE A 96 8.723 -15.285 -14.204 1.00 0.00 H new ATOM 1428 N GLU A 97 5.078 -11.669 -13.638 1.00 0.00 N ATOM 1429 CA GLU A 97 5.180 -11.451 -15.077 1.00 0.00 C ATOM 1430 C GLU A 97 6.488 -12.053 -15.570 1.00 0.00 C ATOM 1431 O GLU A 97 7.534 -11.914 -14.926 1.00 0.00 O ATOM 1432 CB GLU A 97 5.122 -9.966 -15.471 1.00 0.00 C ATOM 1433 CG GLU A 97 3.796 -9.242 -15.188 1.00 0.00 C ATOM 1434 CD GLU A 97 2.642 -9.604 -16.147 1.00 0.00 C ATOM 1435 OE1 GLU A 97 2.680 -10.644 -16.851 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.662 -8.822 -16.203 1.00 0.00 O ATOM 0 H GLU A 97 5.935 -11.464 -13.125 1.00 0.00 H new ATOM 0 HA GLU A 97 4.320 -11.933 -15.542 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.919 -9.440 -14.945 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.336 -9.885 -16.537 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.486 -9.468 -14.168 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.968 -8.167 -15.238 1.00 0.00 H new ATOM 1443 N ASP A 98 6.400 -12.682 -16.736 1.00 0.00 N ATOM 1444 CA ASP A 98 7.509 -13.166 -17.538 1.00 0.00 C ATOM 1445 C ASP A 98 7.601 -12.217 -18.725 1.00 0.00 C ATOM 1446 O ASP A 98 6.678 -12.156 -19.550 1.00 0.00 O ATOM 1447 CB ASP A 98 7.245 -14.611 -17.987 1.00 0.00 C ATOM 1448 CG ASP A 98 7.818 -14.944 -19.384 1.00 0.00 C ATOM 1449 OD1 ASP A 98 8.999 -14.647 -19.683 1.00 0.00 O ATOM 1450 OD2 ASP A 98 7.064 -15.529 -20.205 1.00 0.00 O ATOM 0 H ASP A 98 5.498 -12.878 -17.169 1.00 0.00 H new ATOM 0 HA ASP A 98 8.446 -13.183 -16.982 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.677 -15.294 -17.255 1.00 0.00 H new ATOM 0 HB3 ASP A 98 6.170 -14.789 -17.994 1.00 0.00 H new ATOM 1455 N TRP A 99 8.691 -11.457 -18.785 1.00 0.00 N ATOM 1456 CA TRP A 99 9.067 -10.652 -19.932 1.00 0.00 C ATOM 1457 C TRP A 99 10.412 -11.176 -20.464 1.00 0.00 C ATOM 1458 O TRP A 99 11.121 -11.911 -19.773 1.00 0.00 O ATOM 1459 CB TRP A 99 9.181 -9.167 -19.557 1.00 0.00 C ATOM 1460 CG TRP A 99 8.052 -8.458 -18.859 1.00 0.00 C ATOM 1461 CD1 TRP A 99 8.222 -7.618 -17.811 1.00 0.00 C ATOM 1462 CD2 TRP A 99 6.630 -8.375 -19.189 1.00 0.00 C ATOM 1463 NE1 TRP A 99 7.022 -7.032 -17.469 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.009 -7.441 -18.303 1.00 0.00 C ATOM 1465 CE3 TRP A 99 5.803 -8.953 -20.176 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 4.657 -7.085 -18.397 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 4.436 -8.623 -20.269 1.00 0.00 C ATOM 1468 CH2 TRP A 99 3.864 -7.684 -19.392 1.00 0.00 C ATOM 0 H TRP A 99 9.353 -11.386 -18.012 1.00 0.00 H new ATOM 0 HA TRP A 99 8.298 -10.732 -20.700 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.063 -9.063 -18.925 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.382 -8.619 -20.478 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.163 -7.433 -17.314 1.00 0.00 H new ATOM 0 HE1 TRP A 99 6.901 -6.378 -16.696 1.00 0.00 H new ATOM 0 HE3 TRP A 99 6.226 -9.661 -20.873 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.231 -6.363 -17.717 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 3.822 -9.096 -21.021 1.00 0.00 H new ATOM 0 HH2 TRP A 99 2.820 -7.424 -19.482 1.00 0.00 H new ATOM 1479 N GLN A 100 10.794 -10.754 -21.674 1.00 0.00 N ATOM 1480 CA GLN A 100 12.089 -11.055 -22.279 1.00 0.00 C ATOM 1481 C GLN A 100 12.699 -9.723 -22.735 1.00 0.00 C ATOM 1482 O GLN A 100 12.598 -9.353 -23.907 1.00 0.00 O ATOM 1483 CB GLN A 100 11.919 -12.062 -23.442 1.00 0.00 C ATOM 1484 CG GLN A 100 11.339 -13.441 -23.070 1.00 0.00 C ATOM 1485 CD GLN A 100 12.311 -14.373 -22.335 1.00 0.00 C ATOM 1486 OE1 GLN A 100 13.263 -13.954 -21.679 1.00 0.00 O ATOM 1487 NE2 GLN A 100 12.095 -15.679 -22.417 1.00 0.00 N ATOM 0 H GLN A 100 10.196 -10.182 -22.270 1.00 0.00 H new ATOM 0 HA GLN A 100 12.762 -11.531 -21.566 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.273 -11.610 -24.194 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.892 -12.214 -23.908 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.458 -13.292 -22.445 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.003 -13.936 -23.981 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.307 -16.033 -22.960 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.717 -16.330 -21.937 1.00 0.00 H new ATOM 1496 N LEU A 101 13.258 -8.953 -21.791 1.00 0.00 N ATOM 1497 CA LEU A 101 13.863 -7.654 -22.105 1.00 0.00 C ATOM 1498 C LEU A 101 15.226 -7.878 -22.741 1.00 0.00 C ATOM 1499 O LEU A 101 15.930 -8.821 -22.386 1.00 0.00 O ATOM 1500 CB LEU A 101 13.976 -6.744 -20.866 1.00 0.00 C ATOM 1501 CG LEU A 101 12.718 -5.934 -20.511 1.00 0.00 C ATOM 1502 CD1 LEU A 101 12.215 -5.015 -21.635 1.00 0.00 C ATOM 1503 CD2 LEU A 101 11.577 -6.843 -20.067 1.00 0.00 C ATOM 0 H LEU A 101 13.303 -9.208 -20.805 1.00 0.00 H new ATOM 0 HA LEU A 101 13.210 -7.136 -22.807 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.241 -7.362 -20.008 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.800 -6.048 -21.024 1.00 0.00 H new ATOM 0 HG LEU A 101 13.033 -5.291 -19.689 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.325 -4.482 -21.299 1.00 0.00 H new ATOM 0 HD12 LEU A 101 12.993 -4.296 -21.893 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.969 -5.614 -22.512 1.00 0.00 H new ATOM 0 HD21 LEU A 101 10.704 -6.238 -19.824 1.00 0.00 H new ATOM 0 HD22 LEU A 101 11.327 -7.533 -20.873 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.884 -7.408 -19.187 1.00 0.00 H new ATOM 1515 N GLU A 102 15.628 -6.980 -23.636 1.00 0.00 N ATOM 1516 CA GLU A 102 16.974 -6.909 -24.186 1.00 0.00 C ATOM 1517 C GLU A 102 17.877 -6.177 -23.185 1.00 0.00 C ATOM 1518 O GLU A 102 17.380 -5.566 -22.236 1.00 0.00 O ATOM 1519 CB GLU A 102 16.924 -6.223 -25.562 1.00 0.00 C ATOM 1520 CG GLU A 102 16.201 -7.094 -26.600 1.00 0.00 C ATOM 1521 CD GLU A 102 15.952 -6.327 -27.908 1.00 0.00 C ATOM 1522 OE1 GLU A 102 14.930 -5.603 -27.988 1.00 0.00 O ATOM 1523 OE2 GLU A 102 16.766 -6.450 -28.855 1.00 0.00 O ATOM 0 H GLU A 102 15.007 -6.262 -24.008 1.00 0.00 H new ATOM 0 HA GLU A 102 17.393 -7.903 -24.341 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.415 -5.263 -25.473 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.938 -6.015 -25.903 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.796 -7.984 -26.807 1.00 0.00 H new ATOM 0 HG3 GLU A 102 15.250 -7.435 -26.191 1.00 0.00 H new ATOM 1530 N ASP A 103 19.198 -6.213 -23.385 1.00 0.00 N ATOM 1531 CA ASP A 103 20.168 -5.532 -22.541 1.00 0.00 C ATOM 1532 C ASP A 103 21.207 -4.788 -23.389 1.00 0.00 C ATOM 1533 O ASP A 103 21.714 -5.367 -24.355 1.00 0.00 O ATOM 1534 CB ASP A 103 20.861 -6.509 -21.597 1.00 0.00 C ATOM 1535 CG ASP A 103 21.791 -5.692 -20.702 1.00 0.00 C ATOM 1536 OD1 ASP A 103 21.272 -5.070 -19.749 1.00 0.00 O ATOM 1537 OD2 ASP A 103 23.000 -5.612 -20.989 1.00 0.00 O ATOM 0 H ASP A 103 19.625 -6.728 -24.155 1.00 0.00 H new ATOM 0 HA ASP A 103 19.624 -4.803 -21.940 1.00 0.00 H new ATOM 0 HB2 ASP A 103 20.128 -7.050 -20.998 1.00 0.00 H new ATOM 0 HB3 ASP A 103 21.425 -7.253 -22.160 1.00 0.00 H new ATOM 1542 N PRO A 104 21.525 -3.518 -23.063 1.00 0.00 N ATOM 1543 CA PRO A 104 22.407 -2.690 -23.874 1.00 0.00 C ATOM 1544 C PRO A 104 23.902 -2.780 -23.518 1.00 0.00 C ATOM 1545 O PRO A 104 24.695 -2.130 -24.198 1.00 0.00 O ATOM 1546 CB PRO A 104 21.864 -1.278 -23.685 1.00 0.00 C ATOM 1547 CG PRO A 104 21.426 -1.278 -22.225 1.00 0.00 C ATOM 1548 CD PRO A 104 20.845 -2.680 -22.075 1.00 0.00 C ATOM 0 HA PRO A 104 22.396 -3.030 -24.910 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.625 -0.522 -23.879 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.031 -1.071 -24.357 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.262 -1.107 -21.547 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.686 -0.504 -22.020 1.00 0.00 H new ATOM 0 HD2 PRO A 104 21.006 -3.061 -21.066 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.768 -2.674 -22.246 1.00 0.00 H new ATOM 1556 N ASP A 105 24.331 -3.534 -22.498 1.00 0.00 N ATOM 1557 CA ASP A 105 25.751 -3.575 -22.140 1.00 0.00 C ATOM 1558 C ASP A 105 26.583 -4.093 -23.318 1.00 0.00 C ATOM 1559 O ASP A 105 26.275 -5.146 -23.892 1.00 0.00 O ATOM 1560 CB ASP A 105 26.041 -4.436 -20.912 1.00 0.00 C ATOM 1561 CG ASP A 105 27.565 -4.518 -20.720 1.00 0.00 C ATOM 1562 OD1 ASP A 105 28.192 -3.457 -20.485 1.00 0.00 O ATOM 1563 OD2 ASP A 105 28.144 -5.623 -20.863 1.00 0.00 O ATOM 0 H ASP A 105 23.726 -4.114 -21.916 1.00 0.00 H new ATOM 0 HA ASP A 105 26.028 -2.550 -21.895 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.571 -4.005 -20.028 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.622 -5.434 -21.042 1.00 0.00 H new ATOM 1568 N GLY A 106 27.629 -3.345 -23.685 1.00 0.00 N ATOM 1569 CA GLY A 106 28.530 -3.696 -24.776 1.00 0.00 C ATOM 1570 C GLY A 106 27.910 -3.516 -26.166 1.00 0.00 C ATOM 1571 O GLY A 106 28.589 -3.768 -27.166 1.00 0.00 O ATOM 0 H GLY A 106 27.872 -2.469 -23.224 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.428 -3.083 -24.706 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.843 -4.734 -24.658 1.00 0.00 H new ATOM 1575 N GLN A 107 26.650 -3.078 -26.254 1.00 0.00 N ATOM 1576 CA GLN A 107 25.990 -2.754 -27.511 1.00 0.00 C ATOM 1577 C GLN A 107 26.300 -1.302 -27.900 1.00 0.00 C ATOM 1578 O GLN A 107 26.861 -0.532 -27.110 1.00 0.00 O ATOM 1579 CB GLN A 107 24.466 -2.944 -27.399 1.00 0.00 C ATOM 1580 CG GLN A 107 23.940 -4.195 -26.679 1.00 0.00 C ATOM 1581 CD GLN A 107 24.169 -5.548 -27.338 1.00 0.00 C ATOM 1582 OE1 GLN A 107 24.876 -5.700 -28.333 1.00 0.00 O ATOM 1583 NE2 GLN A 107 23.526 -6.559 -26.774 1.00 0.00 N ATOM 0 H GLN A 107 26.055 -2.938 -25.437 1.00 0.00 H new ATOM 0 HA GLN A 107 26.366 -3.429 -28.279 1.00 0.00 H new ATOM 0 HB2 GLN A 107 24.058 -2.071 -26.889 1.00 0.00 H new ATOM 0 HB3 GLN A 107 24.056 -2.944 -28.409 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.393 -4.225 -25.688 1.00 0.00 H new ATOM 0 HG3 GLN A 107 22.867 -4.071 -26.535 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.948 -6.399 -25.949 1.00 0.00 H new ATOM 0 HE22 GLN A 107 23.609 -7.498 -27.164 1.00 0.00 H new ATOM 1592 N SER A 108 25.884 -0.908 -29.105 1.00 0.00 N ATOM 1593 CA SER A 108 25.937 0.473 -29.569 1.00 0.00 C ATOM 1594 C SER A 108 24.930 1.348 -28.802 1.00 0.00 C ATOM 1595 O SER A 108 23.945 0.852 -28.248 1.00 0.00 O ATOM 1596 CB SER A 108 25.701 0.496 -31.089 1.00 0.00 C ATOM 1597 OG SER A 108 26.585 -0.407 -31.747 1.00 0.00 O ATOM 0 H SER A 108 25.495 -1.552 -29.794 1.00 0.00 H new ATOM 0 HA SER A 108 26.921 0.897 -29.369 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.668 0.225 -31.306 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.853 1.506 -31.471 1.00 0.00 H new ATOM 0 HG SER A 108 26.420 -0.381 -32.713 1.00 0.00 H new ATOM 1603 N LEU A 109 25.153 2.666 -28.811 1.00 0.00 N ATOM 1604 CA LEU A 109 24.375 3.681 -28.090 1.00 0.00 C ATOM 1605 C LEU A 109 22.888 3.655 -28.439 1.00 0.00 C ATOM 1606 O LEU A 109 22.047 3.931 -27.585 1.00 0.00 O ATOM 1607 CB LEU A 109 25.000 5.051 -28.418 1.00 0.00 C ATOM 1608 CG LEU A 109 24.449 6.228 -27.592 1.00 0.00 C ATOM 1609 CD1 LEU A 109 24.701 6.032 -26.093 1.00 0.00 C ATOM 1610 CD2 LEU A 109 25.140 7.516 -28.059 1.00 0.00 C ATOM 0 H LEU A 109 25.918 3.075 -29.347 1.00 0.00 H new ATOM 0 HA LEU A 109 24.418 3.474 -27.021 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.077 4.989 -28.263 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.842 5.263 -29.476 1.00 0.00 H new ATOM 0 HG LEU A 109 23.371 6.287 -27.744 1.00 0.00 H new ATOM 0 HD11 LEU A 109 24.299 6.882 -25.542 1.00 0.00 H new ATOM 0 HD12 LEU A 109 24.211 5.118 -25.758 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.773 5.956 -25.911 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.761 8.361 -27.484 1.00 0.00 H new ATOM 0 HD22 LEU A 109 26.216 7.427 -27.908 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.934 7.676 -29.117 1.00 0.00 H new ATOM 1622 N GLU A 110 22.554 3.263 -29.670 1.00 0.00 N ATOM 1623 CA GLU A 110 21.176 3.096 -30.124 1.00 0.00 C ATOM 1624 C GLU A 110 20.412 2.118 -29.233 1.00 0.00 C ATOM 1625 O GLU A 110 19.222 2.304 -28.991 1.00 0.00 O ATOM 1626 CB GLU A 110 21.134 2.643 -31.599 1.00 0.00 C ATOM 1627 CG GLU A 110 22.086 1.499 -31.974 1.00 0.00 C ATOM 1628 CD GLU A 110 21.941 1.120 -33.460 1.00 0.00 C ATOM 1629 OE1 GLU A 110 21.098 0.251 -33.791 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.682 1.679 -34.307 1.00 0.00 O ATOM 0 H GLU A 110 23.245 3.050 -30.389 1.00 0.00 H new ATOM 0 HA GLU A 110 20.683 4.066 -30.051 1.00 0.00 H new ATOM 0 HB2 GLU A 110 20.116 2.335 -31.836 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.362 3.502 -32.230 1.00 0.00 H new ATOM 0 HG2 GLU A 110 23.115 1.796 -31.770 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.877 0.629 -31.352 1.00 0.00 H new ATOM 1637 N VAL A 111 21.078 1.092 -28.710 1.00 0.00 N ATOM 1638 CA VAL A 111 20.421 0.049 -27.938 1.00 0.00 C ATOM 1639 C VAL A 111 20.121 0.542 -26.523 1.00 0.00 C ATOM 1640 O VAL A 111 19.021 0.300 -26.050 1.00 0.00 O ATOM 1641 CB VAL A 111 21.210 -1.270 -27.998 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.348 -2.442 -27.499 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.666 -1.582 -29.437 1.00 0.00 C ATOM 0 H VAL A 111 22.085 0.963 -28.811 1.00 0.00 H new ATOM 0 HA VAL A 111 19.454 -0.180 -28.386 1.00 0.00 H new ATOM 0 HB VAL A 111 22.084 -1.150 -27.357 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.925 -3.365 -27.550 1.00 0.00 H new ATOM 0 HG12 VAL A 111 20.047 -2.259 -26.468 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.461 -2.534 -28.126 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.221 -2.520 -29.447 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.793 -1.669 -30.084 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.306 -0.777 -29.798 1.00 0.00 H new ATOM 1653 N PHE A 112 21.010 1.298 -25.867 1.00 0.00 N ATOM 1654 CA PHE A 112 20.689 1.972 -24.597 1.00 0.00 C ATOM 1655 C PHE A 112 19.463 2.875 -24.793 1.00 0.00 C ATOM 1656 O PHE A 112 18.498 2.792 -24.034 1.00 0.00 O ATOM 1657 CB PHE A 112 21.884 2.814 -24.116 1.00 0.00 C ATOM 1658 CG PHE A 112 23.047 2.035 -23.521 1.00 0.00 C ATOM 1659 CD1 PHE A 112 23.013 1.649 -22.166 1.00 0.00 C ATOM 1660 CD2 PHE A 112 24.165 1.699 -24.307 1.00 0.00 C ATOM 1661 CE1 PHE A 112 24.072 0.903 -21.613 1.00 0.00 C ATOM 1662 CE2 PHE A 112 25.224 0.959 -23.754 1.00 0.00 C ATOM 1663 CZ PHE A 112 25.175 0.552 -22.410 1.00 0.00 C ATOM 0 H PHE A 112 21.962 1.460 -26.194 1.00 0.00 H new ATOM 0 HA PHE A 112 20.471 1.217 -23.842 1.00 0.00 H new ATOM 0 HB2 PHE A 112 22.255 3.397 -24.958 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.527 3.524 -23.370 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.171 1.926 -21.549 1.00 0.00 H new ATOM 0 HD2 PHE A 112 24.209 2.011 -25.340 1.00 0.00 H new ATOM 0 HE1 PHE A 112 24.036 0.601 -20.577 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.078 0.702 -24.364 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.983 -0.029 -21.991 1.00 0.00 H new ATOM 1673 N ARG A 113 19.464 3.685 -25.857 1.00 0.00 N ATOM 1674 CA ARG A 113 18.360 4.599 -26.174 1.00 0.00 C ATOM 1675 C ARG A 113 17.057 3.823 -26.410 1.00 0.00 C ATOM 1676 O ARG A 113 16.012 4.211 -25.890 1.00 0.00 O ATOM 1677 CB ARG A 113 18.747 5.441 -27.405 1.00 0.00 C ATOM 1678 CG ARG A 113 19.838 6.481 -27.085 1.00 0.00 C ATOM 1679 CD ARG A 113 20.488 7.018 -28.367 1.00 0.00 C ATOM 1680 NE ARG A 113 21.287 8.233 -28.104 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.863 9.011 -29.031 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.803 8.692 -30.324 1.00 0.00 N ATOM 1683 NH2 ARG A 113 22.507 10.113 -28.658 1.00 0.00 N ATOM 0 H ARG A 113 20.233 3.726 -26.526 1.00 0.00 H new ATOM 0 HA ARG A 113 18.183 5.266 -25.330 1.00 0.00 H new ATOM 0 HB2 ARG A 113 19.099 4.781 -28.197 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.862 5.952 -27.785 1.00 0.00 H new ATOM 0 HG2 ARG A 113 19.403 7.307 -26.522 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.600 6.029 -26.450 1.00 0.00 H new ATOM 0 HD2 ARG A 113 21.127 6.249 -28.802 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.714 7.242 -29.101 1.00 0.00 H new ATOM 0 HE ARG A 113 21.411 8.504 -27.129 1.00 0.00 H new ATOM 0 HH11 ARG A 113 21.314 7.847 -30.619 1.00 0.00 H new ATOM 0 HH12 ARG A 113 22.246 9.293 -31.019 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.561 10.363 -27.670 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.947 10.709 -29.359 1.00 0.00 H new ATOM 1697 N THR A 114 17.118 2.706 -27.133 1.00 0.00 N ATOM 1698 CA THR A 114 15.983 1.865 -27.447 1.00 0.00 C ATOM 1699 C THR A 114 15.454 1.194 -26.181 1.00 0.00 C ATOM 1700 O THR A 114 14.258 1.250 -25.909 1.00 0.00 O ATOM 1701 CB THR A 114 16.477 0.855 -28.499 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.613 1.487 -29.760 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.600 -0.382 -28.642 1.00 0.00 C ATOM 0 H THR A 114 17.992 2.357 -27.526 1.00 0.00 H new ATOM 0 HA THR A 114 15.144 2.434 -27.848 1.00 0.00 H new ATOM 0 HB THR A 114 17.444 0.505 -28.136 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.489 1.924 -29.814 1.00 0.00 H new ATOM 0 HG21 THR A 114 16.020 -1.040 -29.403 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.558 -0.910 -27.689 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.594 -0.083 -28.936 1.00 0.00 H new ATOM 1711 N VAL A 115 16.325 0.575 -25.381 1.00 0.00 N ATOM 1712 CA VAL A 115 15.895 -0.271 -24.279 1.00 0.00 C ATOM 1713 C VAL A 115 15.254 0.573 -23.187 1.00 0.00 C ATOM 1714 O VAL A 115 14.292 0.103 -22.592 1.00 0.00 O ATOM 1715 CB VAL A 115 17.037 -1.217 -23.839 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.696 -2.015 -22.571 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.309 -2.242 -24.953 1.00 0.00 C ATOM 0 H VAL A 115 17.337 0.648 -25.482 1.00 0.00 H new ATOM 0 HA VAL A 115 15.103 -0.950 -24.595 1.00 0.00 H new ATOM 0 HB VAL A 115 17.901 -0.584 -23.637 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.535 -2.661 -22.311 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.500 -1.326 -21.749 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.811 -2.625 -22.752 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.114 -2.910 -24.645 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.407 -2.824 -25.140 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.600 -1.720 -25.865 1.00 0.00 H new ATOM 1727 N ARG A 116 15.650 1.837 -22.999 1.00 0.00 N ATOM 1728 CA ARG A 116 14.906 2.735 -22.111 1.00 0.00 C ATOM 1729 C ARG A 116 13.441 2.836 -22.559 1.00 0.00 C ATOM 1730 O ARG A 116 12.551 2.658 -21.734 1.00 0.00 O ATOM 1731 CB ARG A 116 15.565 4.130 -22.062 1.00 0.00 C ATOM 1732 CG ARG A 116 16.839 4.176 -21.204 1.00 0.00 C ATOM 1733 CD ARG A 116 17.299 5.616 -20.922 1.00 0.00 C ATOM 1734 NE ARG A 116 18.049 6.237 -22.038 1.00 0.00 N ATOM 1735 CZ ARG A 116 17.608 7.094 -22.974 1.00 0.00 C ATOM 1736 NH1 ARG A 116 16.315 7.338 -23.146 1.00 0.00 N ATOM 1737 NH2 ARG A 116 18.487 7.712 -23.756 1.00 0.00 N ATOM 0 H ARG A 116 16.468 2.255 -23.442 1.00 0.00 H new ATOM 0 HA ARG A 116 14.929 2.320 -21.103 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.808 4.444 -23.077 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.846 4.849 -21.670 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.657 3.663 -20.260 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.637 3.635 -21.712 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.425 6.229 -20.699 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.926 5.618 -20.030 1.00 0.00 H new ATOM 0 HE ARG A 116 19.034 5.979 -22.105 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.625 6.869 -22.559 1.00 0.00 H new ATOM 0 HH12 ARG A 116 16.011 7.994 -23.865 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.485 7.534 -23.642 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.164 8.365 -24.470 1.00 0.00 H new ATOM 1751 N GLY A 117 13.185 3.041 -23.851 1.00 0.00 N ATOM 1752 CA GLY A 117 11.831 3.139 -24.397 1.00 0.00 C ATOM 1753 C GLY A 117 11.051 1.839 -24.214 1.00 0.00 C ATOM 1754 O GLY A 117 9.933 1.862 -23.694 1.00 0.00 O ATOM 0 H GLY A 117 13.917 3.145 -24.554 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.299 3.954 -23.906 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.884 3.385 -25.458 1.00 0.00 H new ATOM 1758 N GLN A 118 11.648 0.697 -24.583 1.00 0.00 N ATOM 1759 CA GLN A 118 10.966 -0.596 -24.489 1.00 0.00 C ATOM 1760 C GLN A 118 10.617 -0.904 -23.035 1.00 0.00 C ATOM 1761 O GLN A 118 9.507 -1.333 -22.716 1.00 0.00 O ATOM 1762 CB GLN A 118 11.813 -1.739 -25.072 1.00 0.00 C ATOM 1763 CG GLN A 118 12.253 -1.510 -26.526 1.00 0.00 C ATOM 1764 CD GLN A 118 12.704 -2.792 -27.226 1.00 0.00 C ATOM 1765 OE1 GLN A 118 12.340 -3.053 -28.370 1.00 0.00 O ATOM 1766 NE2 GLN A 118 13.524 -3.604 -26.572 1.00 0.00 N ATOM 0 H GLN A 118 12.599 0.645 -24.948 1.00 0.00 H new ATOM 0 HA GLN A 118 10.052 -0.524 -25.079 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.699 -1.874 -24.452 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.242 -2.666 -25.017 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.427 -1.070 -27.084 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.069 -0.788 -26.543 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.818 -3.375 -25.623 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.860 -4.457 -27.019 1.00 0.00 H new ATOM 1775 N VAL A 119 11.577 -0.657 -22.146 1.00 0.00 N ATOM 1776 CA VAL A 119 11.418 -0.937 -20.728 1.00 0.00 C ATOM 1777 C VAL A 119 10.343 -0.025 -20.141 1.00 0.00 C ATOM 1778 O VAL A 119 9.485 -0.529 -19.418 1.00 0.00 O ATOM 1779 CB VAL A 119 12.766 -0.804 -20.002 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.595 -0.848 -18.483 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.700 -1.959 -20.393 1.00 0.00 C ATOM 0 H VAL A 119 12.483 -0.258 -22.391 1.00 0.00 H new ATOM 0 HA VAL A 119 11.086 -1.966 -20.589 1.00 0.00 H new ATOM 0 HB VAL A 119 13.188 0.157 -20.297 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.569 -0.751 -18.004 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.951 -0.028 -18.165 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.142 -1.797 -18.195 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.651 -1.851 -19.871 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.240 -2.908 -20.117 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.873 -1.939 -21.469 1.00 0.00 H new ATOM 1791 N LYS A 120 10.351 1.277 -20.455 1.00 0.00 N ATOM 1792 CA LYS A 120 9.383 2.223 -19.900 1.00 0.00 C ATOM 1793 C LYS A 120 7.983 1.693 -20.137 1.00 0.00 C ATOM 1794 O LYS A 120 7.195 1.638 -19.202 1.00 0.00 O ATOM 1795 CB LYS A 120 9.519 3.594 -20.583 1.00 0.00 C ATOM 1796 CG LYS A 120 8.576 4.638 -19.950 1.00 0.00 C ATOM 1797 CD LYS A 120 8.684 5.983 -20.686 1.00 0.00 C ATOM 1798 CE LYS A 120 7.708 7.009 -20.087 1.00 0.00 C ATOM 1799 NZ LYS A 120 7.735 8.309 -20.812 1.00 0.00 N ATOM 0 H LYS A 120 11.024 1.698 -21.096 1.00 0.00 H new ATOM 0 HA LYS A 120 9.572 2.337 -18.833 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.550 3.939 -20.506 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.294 3.496 -21.645 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.548 4.278 -19.989 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.827 4.772 -18.898 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.704 6.360 -20.617 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.467 5.842 -21.745 1.00 0.00 H new ATOM 0 HE2 LYS A 120 6.697 6.603 -20.113 1.00 0.00 H new ATOM 0 HE3 LYS A 120 7.958 7.175 -19.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 7.061 8.967 -20.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.693 8.712 -20.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.471 8.158 -21.806 1.00 0.00 H new ATOM 1813 N GLU A 121 7.701 1.264 -21.360 1.00 0.00 N ATOM 1814 CA GLU A 121 6.382 0.811 -21.747 1.00 0.00 C ATOM 1815 C GLU A 121 5.967 -0.427 -20.942 1.00 0.00 C ATOM 1816 O GLU A 121 4.842 -0.484 -20.441 1.00 0.00 O ATOM 1817 CB GLU A 121 6.414 0.583 -23.261 1.00 0.00 C ATOM 1818 CG GLU A 121 5.064 0.110 -23.803 1.00 0.00 C ATOM 1819 CD GLU A 121 5.078 0.016 -25.339 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.433 -1.058 -25.884 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.719 1.014 -26.011 1.00 0.00 O ATOM 0 H GLU A 121 8.389 1.222 -22.112 1.00 0.00 H new ATOM 0 HA GLU A 121 5.617 1.554 -21.520 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.700 1.509 -23.760 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.178 -0.157 -23.499 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.821 -0.865 -23.379 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.281 0.799 -23.486 1.00 0.00 H new ATOM 1828 N ARG A 122 6.871 -1.396 -20.740 1.00 0.00 N ATOM 1829 CA ARG A 122 6.551 -2.584 -19.939 1.00 0.00 C ATOM 1830 C ARG A 122 6.336 -2.230 -18.474 1.00 0.00 C ATOM 1831 O ARG A 122 5.402 -2.739 -17.858 1.00 0.00 O ATOM 1832 CB ARG A 122 7.603 -3.688 -20.114 1.00 0.00 C ATOM 1833 CG ARG A 122 7.581 -4.257 -21.545 1.00 0.00 C ATOM 1834 CD ARG A 122 7.955 -5.739 -21.540 1.00 0.00 C ATOM 1835 NE ARG A 122 7.973 -6.285 -22.912 1.00 0.00 N ATOM 1836 CZ ARG A 122 6.958 -6.865 -23.571 1.00 0.00 C ATOM 1837 NH1 ARG A 122 5.780 -7.053 -22.983 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.131 -7.262 -24.827 1.00 0.00 N ATOM 0 H ARG A 122 7.819 -1.381 -21.116 1.00 0.00 H new ATOM 0 HA ARG A 122 5.608 -2.983 -20.313 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.593 -3.289 -19.894 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.416 -4.489 -19.399 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.589 -4.128 -21.978 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.278 -3.703 -22.173 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.935 -5.869 -21.080 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.241 -6.296 -20.933 1.00 0.00 H new ATOM 0 HE ARG A 122 8.857 -6.213 -23.416 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.638 -6.755 -22.018 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.018 -7.495 -23.497 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.032 -7.125 -25.286 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.363 -7.703 -25.333 1.00 0.00 H new ATOM 1852 N VAL A 123 7.160 -1.348 -17.910 1.00 0.00 N ATOM 1853 CA VAL A 123 7.006 -0.952 -16.511 1.00 0.00 C ATOM 1854 C VAL A 123 5.721 -0.125 -16.354 1.00 0.00 C ATOM 1855 O VAL A 123 4.983 -0.330 -15.392 1.00 0.00 O ATOM 1856 CB VAL A 123 8.281 -0.265 -16.001 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.197 0.126 -14.524 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.521 -1.163 -16.140 1.00 0.00 C ATOM 0 H VAL A 123 7.935 -0.897 -18.396 1.00 0.00 H new ATOM 0 HA VAL A 123 6.885 -1.827 -15.872 1.00 0.00 H new ATOM 0 HB VAL A 123 8.371 0.625 -16.624 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.127 0.607 -14.222 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.367 0.817 -14.377 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.037 -0.767 -13.920 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.397 -0.634 -15.766 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.375 -2.076 -15.563 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.671 -1.417 -17.189 1.00 0.00 H new ATOM 1868 N GLU A 124 5.389 0.741 -17.313 1.00 0.00 N ATOM 1869 CA GLU A 124 4.143 1.494 -17.316 1.00 0.00 C ATOM 1870 C GLU A 124 2.952 0.543 -17.337 1.00 0.00 C ATOM 1871 O GLU A 124 2.002 0.759 -16.593 1.00 0.00 O ATOM 1872 CB GLU A 124 4.067 2.466 -18.512 1.00 0.00 C ATOM 1873 CG GLU A 124 4.748 3.813 -18.261 1.00 0.00 C ATOM 1874 CD GLU A 124 4.390 4.837 -19.356 1.00 0.00 C ATOM 1875 OE1 GLU A 124 4.792 4.656 -20.530 1.00 0.00 O ATOM 1876 OE2 GLU A 124 3.702 5.839 -19.043 1.00 0.00 O ATOM 0 H GLU A 124 5.987 0.938 -18.116 1.00 0.00 H new ATOM 0 HA GLU A 124 4.114 2.088 -16.402 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.526 1.994 -19.381 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.020 2.640 -18.760 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.446 4.199 -17.287 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.829 3.676 -18.229 1.00 0.00 H new ATOM 1883 N ASN A 125 3.014 -0.521 -18.136 1.00 0.00 N ATOM 1884 CA ASN A 125 1.930 -1.494 -18.241 1.00 0.00 C ATOM 1885 C ASN A 125 1.718 -2.230 -16.915 1.00 0.00 C ATOM 1886 O ASN A 125 0.585 -2.337 -16.451 1.00 0.00 O ATOM 1887 CB ASN A 125 2.198 -2.487 -19.378 1.00 0.00 C ATOM 1888 CG ASN A 125 1.059 -3.496 -19.481 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.144 -4.602 -18.957 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.035 -3.135 -20.138 1.00 0.00 N ATOM 0 H ASN A 125 3.817 -0.732 -18.728 1.00 0.00 H new ATOM 0 HA ASN A 125 1.014 -0.950 -18.472 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.304 -1.950 -20.321 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.139 -3.008 -19.201 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.821 -3.781 -20.213 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.090 -2.212 -20.568 1.00 0.00 H new ATOM 1897 N LEU A 126 2.800 -2.677 -16.271 1.00 0.00 N ATOM 1898 CA LEU A 126 2.779 -3.316 -14.964 1.00 0.00 C ATOM 1899 C LEU A 126 2.127 -2.386 -13.937 1.00 0.00 C ATOM 1900 O LEU A 126 1.208 -2.800 -13.235 1.00 0.00 O ATOM 1901 CB LEU A 126 4.229 -3.688 -14.625 1.00 0.00 C ATOM 1902 CG LEU A 126 4.484 -4.320 -13.253 1.00 0.00 C ATOM 1903 CD1 LEU A 126 4.672 -3.272 -12.151 1.00 0.00 C ATOM 1904 CD2 LEU A 126 3.430 -5.356 -12.866 1.00 0.00 C ATOM 0 H LEU A 126 3.739 -2.599 -16.661 1.00 0.00 H new ATOM 0 HA LEU A 126 2.177 -4.224 -14.956 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.588 -4.379 -15.388 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.836 -2.786 -14.700 1.00 0.00 H new ATOM 0 HG LEU A 126 5.427 -4.858 -13.352 1.00 0.00 H new ATOM 0 HD11 LEU A 126 4.850 -3.773 -11.199 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.526 -2.639 -12.393 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.775 -2.658 -12.076 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.667 -5.767 -11.885 1.00 0.00 H new ATOM 0 HD22 LEU A 126 2.449 -4.882 -12.834 1.00 0.00 H new ATOM 0 HD23 LEU A 126 3.421 -6.159 -13.603 1.00 0.00 H new ATOM 1916 N ILE A 127 2.548 -1.123 -13.875 1.00 0.00 N ATOM 1917 CA ILE A 127 2.014 -0.139 -12.941 1.00 0.00 C ATOM 1918 C ILE A 127 0.535 0.080 -13.258 1.00 0.00 C ATOM 1919 O ILE A 127 -0.288 0.013 -12.351 1.00 0.00 O ATOM 1920 CB ILE A 127 2.875 1.129 -13.071 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.250 0.815 -12.454 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.233 2.338 -12.374 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.292 1.888 -12.727 1.00 0.00 C ATOM 0 H ILE A 127 3.280 -0.752 -14.481 1.00 0.00 H new ATOM 0 HA ILE A 127 2.060 -0.465 -11.902 1.00 0.00 H new ATOM 0 HB ILE A 127 2.970 1.399 -14.123 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.138 0.694 -11.377 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.608 -0.137 -12.847 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.876 3.210 -12.492 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.260 2.542 -12.821 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.106 2.122 -11.313 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.237 1.604 -12.264 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.432 1.994 -13.803 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.955 2.837 -12.310 1.00 0.00 H new ATOM 1935 N ALA A 128 0.180 0.284 -14.527 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.202 0.481 -14.949 1.00 0.00 C ATOM 1937 C ALA A 128 -2.106 -0.709 -14.574 1.00 0.00 C ATOM 1938 O ALA A 128 -3.305 -0.505 -14.357 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.239 0.736 -16.461 1.00 0.00 C ATOM 0 H ALA A 128 0.851 0.317 -15.295 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.596 1.348 -14.419 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.271 0.884 -16.780 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.656 1.627 -16.694 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.816 -0.121 -16.985 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.571 -1.936 -14.484 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.324 -3.078 -13.981 1.00 0.00 C ATOM 1947 C LYS A 129 -2.569 -2.940 -12.482 1.00 0.00 C ATOM 1948 O LYS A 129 -3.716 -3.020 -12.035 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.617 -4.413 -14.277 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.706 -4.854 -15.744 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.963 -6.185 -15.921 1.00 0.00 C ATOM 1952 CE LYS A 129 -1.073 -6.679 -17.371 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.634 -8.090 -17.516 1.00 0.00 N ATOM 0 H LYS A 129 -0.613 -2.156 -14.757 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.281 -3.086 -14.504 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.567 -4.326 -13.997 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.051 -5.190 -13.648 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.749 -4.965 -16.039 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.271 -4.093 -16.391 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.086 -6.060 -15.653 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.378 -6.932 -15.245 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -2.105 -6.585 -17.708 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.467 -6.043 -18.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.514 -8.314 -18.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.271 -8.225 -17.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.351 -8.721 -17.104 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.499 -2.770 -11.705 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.566 -2.857 -10.254 1.00 0.00 C ATOM 1969 C ILE A 130 -2.161 -1.628 -9.561 1.00 0.00 C ATOM 1970 O ILE A 130 -2.871 -1.783 -8.564 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.202 -3.272 -9.678 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.869 -2.188 -9.887 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.224 -4.628 -10.265 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.280 -2.563 -9.439 1.00 0.00 C ATOM 0 H ILE A 130 -0.567 -2.569 -12.066 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.288 -3.642 -10.029 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.306 -3.384 -8.599 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.899 -1.931 -10.946 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.562 -1.291 -9.350 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.191 -4.915 -9.852 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.518 -5.384 -10.010 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.302 -4.547 -11.349 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.956 -1.730 -9.631 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.275 -2.789 -8.373 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.617 -3.439 -9.994 1.00 0.00 H new ATOM 1986 N SER A 131 -1.860 -0.431 -10.049 1.00 0.00 N ATOM 1987 CA SER A 131 -2.148 0.836 -9.420 1.00 0.00 C ATOM 1988 C SER A 131 -3.402 1.444 -10.047 1.00 0.00 C ATOM 1989 O SER A 131 -4.438 1.527 -9.346 1.00 0.00 O ATOM 1990 CB SER A 131 -0.919 1.740 -9.522 1.00 0.00 C ATOM 1991 OG SER A 131 0.146 1.172 -8.765 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.368 1.823 -11.241 1.00 0.00 O ATOM 0 H SER A 131 -1.382 -0.321 -10.944 1.00 0.00 H new ATOM 0 HA SER A 131 -2.360 0.706 -8.359 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.621 1.852 -10.564 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.154 2.737 -9.149 1.00 0.00 H new ATOM 0 HG SER A 131 0.936 1.748 -8.829 1.00 0.00 H new TER 1998 SER A 131