USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 992 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 29 LYS NZ :NH3+ 149:sc= 1.24 (180deg=-0.107) USER MOD Set 1.2: A 131 SER OG : rot 77:sc= 2.23 USER MOD Set 2.1: A 92 THR OG1 : rot -63:sc= 1.24 USER MOD Set 2.2: A 93 GLN : amide:sc= -0.81 K(o=0.43,f=-5!) USER MOD Set 3.1: A 5 MET CE :methyl -138:sc= -0.316 (180deg=-2.26) USER MOD Set 3.2: A 35 CYS SG : rot -85:sc= 0.65 USER MOD Set 3.3: A 73 TYR OH : rot -171:sc= 1.24 USER MOD Set 4.1: A 11 ASN : amide:sc= 1.84 K(o=8.9,f=-4) USER MOD Set 4.2: A 16 GLN : amide:sc= 1.54 K(o=8.9,f=-1.8) USER MOD Set 4.3: A 23 LYS NZ :NH3+ -166:sc= 0.998 (180deg=0) USER MOD Set 4.4: A 34 SER OG : rot 180:sc= 0.61 USER MOD Set 4.5: A 60 GLN : amide:sc= 2.62 K(o=8.9,f=1.3) USER MOD Set 4.6: A 62 SER OG : rot -170:sc= 1.25 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 134:sc= 0.0319 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -158:sc= 2.37 (180deg=1.51) USER MOD Single : A 3 LYS NZ :NH3+ 174:sc= 1.19 (180deg=1.04) USER MOD Single : A 8 CYS SG : rot -129:sc= -0.52 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -52:sc= 1.11 USER MOD Single : A 13 CYS SG : rot 169:sc= 1.04 USER MOD Single : A 15 SER OG : rot 66:sc= 0.943 USER MOD Single : A 17 MET CE :methyl 180:sc= -0.12 (180deg=-0.12) USER MOD Single : A 24 THR OG1 : rot 82:sc= 1.18 USER MOD Single : A 33 THR OG1 : rot 3:sc= 0.449 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0625 USER MOD Single : A 40 SER OG : rot 21:sc= 1.08 USER MOD Single : A 43 HIS : no HD1:sc= -1.45 X(o=-1.4,f=-1.7) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.00147 USER MOD Single : A 49 MET CE :methyl -106:sc= -0.561 (180deg=-2.18) USER MOD Single : A 50 MET CE :methyl -132:sc= -4.53 (180deg=-13.6!) USER MOD Single : A 58 SER OG : rot 100:sc= 1.26 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 1.11 K(o=1.1,f=-0.49) USER MOD Single : A 69 ASN : amide:sc= 0.902 K(o=0.9,f=-0.0054) USER MOD Single : A 78 SER OG : rot 50:sc= 0 USER MOD Single : A 80 CYS SG : rot 180:sc= 0.00507 USER MOD Single : A 82 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.494 X(o=-0.49,f=-0.089) USER MOD Single : A 100 GLN : amide:sc= 0.915 K(o=0.91,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.898 K(o=0.9,f=-1.2) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 66:sc= 1.28 USER MOD Single : A 118 GLN : amide:sc= 1.01 K(o=1,f=-0.87) USER MOD Single : A 120 LYS NZ :NH3+ -175:sc= 1.27 (180deg=1.13) USER MOD Single : A 125 ASN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 166:sc= 0.452 (180deg=0.353) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.272 -0.866 -3.115 1.00 0.00 N ATOM 2 CA MET A 1 2.261 0.242 -3.110 1.00 0.00 C ATOM 3 C MET A 1 3.558 -0.207 -2.427 1.00 0.00 C ATOM 4 O MET A 1 3.537 -1.008 -1.490 1.00 0.00 O ATOM 5 CB MET A 1 1.672 1.519 -2.464 1.00 0.00 C ATOM 6 CG MET A 1 2.657 2.699 -2.395 1.00 0.00 C ATOM 7 SD MET A 1 1.915 4.312 -2.012 1.00 0.00 S ATOM 8 CE MET A 1 1.219 4.770 -3.628 1.00 0.00 C ATOM 0 H1 MET A 1 0.344 -0.504 -2.818 1.00 0.00 H new ATOM 0 H2 MET A 1 1.199 -1.261 -4.074 1.00 0.00 H new ATOM 0 H3 MET A 1 1.581 -1.610 -2.457 1.00 0.00 H new ATOM 0 HA MET A 1 2.502 0.499 -4.142 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.792 1.827 -3.029 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.336 1.281 -1.455 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.411 2.477 -1.640 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.175 2.774 -3.351 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.729 5.741 -3.551 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.019 4.825 -4.366 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.491 4.020 -3.936 1.00 0.00 H new ATOM 18 N LYS A 2 4.696 0.333 -2.878 1.00 0.00 N ATOM 19 CA LYS A 2 6.023 0.123 -2.293 1.00 0.00 C ATOM 20 C LYS A 2 6.608 1.500 -2.000 1.00 0.00 C ATOM 21 O LYS A 2 6.363 2.445 -2.753 1.00 0.00 O ATOM 22 CB LYS A 2 6.902 -0.655 -3.292 1.00 0.00 C ATOM 23 CG LYS A 2 6.434 -2.089 -3.601 1.00 0.00 C ATOM 24 CD LYS A 2 6.457 -3.014 -2.380 1.00 0.00 C ATOM 25 CE LYS A 2 6.983 -4.409 -2.760 1.00 0.00 C ATOM 26 NZ LYS A 2 7.292 -5.242 -1.576 1.00 0.00 N ATOM 0 H LYS A 2 4.718 0.950 -3.690 1.00 0.00 H new ATOM 0 HA LYS A 2 5.971 -0.460 -1.373 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.945 -0.095 -4.226 1.00 0.00 H new ATOM 0 HB3 LYS A 2 7.918 -0.698 -2.900 1.00 0.00 H new ATOM 0 HG2 LYS A 2 5.421 -2.054 -4.002 1.00 0.00 H new ATOM 0 HG3 LYS A 2 7.070 -2.511 -4.379 1.00 0.00 H new ATOM 0 HD2 LYS A 2 7.088 -2.582 -1.603 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.453 -3.100 -1.964 1.00 0.00 H new ATOM 0 HE2 LYS A 2 6.241 -4.918 -3.374 1.00 0.00 H new ATOM 0 HE3 LYS A 2 7.881 -4.301 -3.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 7.966 -5.988 -1.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 7.710 -4.647 -0.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 6.417 -5.677 -1.220 1.00 0.00 H new ATOM 40 N LYS A 3 7.360 1.628 -0.908 1.00 0.00 N ATOM 41 CA LYS A 3 7.955 2.899 -0.512 1.00 0.00 C ATOM 42 C LYS A 3 9.417 2.911 -0.886 1.00 0.00 C ATOM 43 O LYS A 3 10.161 2.068 -0.390 1.00 0.00 O ATOM 44 CB LYS A 3 7.737 3.156 0.989 1.00 0.00 C ATOM 45 CG LYS A 3 6.497 4.045 1.121 1.00 0.00 C ATOM 46 CD LYS A 3 6.093 4.262 2.577 1.00 0.00 C ATOM 47 CE LYS A 3 5.036 5.363 2.677 1.00 0.00 C ATOM 48 NZ LYS A 3 4.631 5.596 4.082 1.00 0.00 N ATOM 0 H LYS A 3 7.572 0.856 -0.276 1.00 0.00 H new ATOM 0 HA LYS A 3 7.465 3.714 -1.046 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.596 2.217 1.524 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.608 3.644 1.426 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.693 5.010 0.653 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.667 3.590 0.580 1.00 0.00 H new ATOM 0 HD2 LYS A 3 5.702 3.334 2.995 1.00 0.00 H new ATOM 0 HD3 LYS A 3 6.968 4.534 3.167 1.00 0.00 H new ATOM 0 HE2 LYS A 3 5.429 6.287 2.252 1.00 0.00 H new ATOM 0 HE3 LYS A 3 4.163 5.086 2.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 3.991 6.414 4.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 4.142 4.754 4.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 5.475 5.784 4.660 1.00 0.00 H new ATOM 62 N VAL A 4 9.830 3.853 -1.726 1.00 0.00 N ATOM 63 CA VAL A 4 11.225 4.034 -2.078 1.00 0.00 C ATOM 64 C VAL A 4 11.832 5.176 -1.275 1.00 0.00 C ATOM 65 O VAL A 4 11.216 6.229 -1.085 1.00 0.00 O ATOM 66 CB VAL A 4 11.362 4.219 -3.603 1.00 0.00 C ATOM 67 CG1 VAL A 4 10.674 5.462 -4.176 1.00 0.00 C ATOM 68 CG2 VAL A 4 12.834 4.245 -4.038 1.00 0.00 C ATOM 0 H VAL A 4 9.200 4.513 -2.182 1.00 0.00 H new ATOM 0 HA VAL A 4 11.793 3.141 -1.816 1.00 0.00 H new ATOM 0 HB VAL A 4 10.845 3.350 -4.010 1.00 0.00 H new ATOM 0 HG11 VAL A 4 10.830 5.500 -5.254 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.606 5.416 -3.965 1.00 0.00 H new ATOM 0 HG13 VAL A 4 11.097 6.356 -3.717 1.00 0.00 H new ATOM 0 HG21 VAL A 4 12.892 4.377 -5.118 1.00 0.00 H new ATOM 0 HG22 VAL A 4 13.345 5.071 -3.544 1.00 0.00 H new ATOM 0 HG23 VAL A 4 13.312 3.305 -3.761 1.00 0.00 H new ATOM 78 N MET A 5 13.072 4.957 -0.853 1.00 0.00 N ATOM 79 CA MET A 5 13.921 5.981 -0.264 1.00 0.00 C ATOM 80 C MET A 5 15.184 6.097 -1.110 1.00 0.00 C ATOM 81 O MET A 5 15.740 5.076 -1.514 1.00 0.00 O ATOM 82 CB MET A 5 14.241 5.628 1.196 1.00 0.00 C ATOM 83 CG MET A 5 15.196 6.642 1.832 1.00 0.00 C ATOM 84 SD MET A 5 14.555 8.333 1.965 1.00 0.00 S ATOM 85 CE MET A 5 13.904 8.289 3.653 1.00 0.00 C ATOM 0 H MET A 5 13.523 4.044 -0.913 1.00 0.00 H new ATOM 0 HA MET A 5 13.412 6.945 -0.254 1.00 0.00 H new ATOM 0 HB2 MET A 5 13.316 5.590 1.771 1.00 0.00 H new ATOM 0 HB3 MET A 5 14.685 4.634 1.240 1.00 0.00 H new ATOM 0 HG2 MET A 5 15.460 6.292 2.830 1.00 0.00 H new ATOM 0 HG3 MET A 5 16.116 6.665 1.249 1.00 0.00 H new ATOM 0 HE1 MET A 5 12.939 8.795 3.684 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.781 7.253 3.969 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.599 8.793 4.324 1.00 0.00 H new ATOM 95 N PHE A 6 15.667 7.323 -1.316 1.00 0.00 N ATOM 96 CA PHE A 6 16.971 7.614 -1.913 1.00 0.00 C ATOM 97 C PHE A 6 17.841 8.238 -0.810 1.00 0.00 C ATOM 98 O PHE A 6 17.402 9.205 -0.190 1.00 0.00 O ATOM 99 CB PHE A 6 16.834 8.532 -3.129 1.00 0.00 C ATOM 100 CG PHE A 6 15.902 7.988 -4.190 1.00 0.00 C ATOM 101 CD1 PHE A 6 16.389 7.090 -5.162 1.00 0.00 C ATOM 102 CD2 PHE A 6 14.543 8.357 -4.187 1.00 0.00 C ATOM 103 CE1 PHE A 6 15.527 6.566 -6.142 1.00 0.00 C ATOM 104 CE2 PHE A 6 13.680 7.807 -5.150 1.00 0.00 C ATOM 105 CZ PHE A 6 14.170 6.922 -6.125 1.00 0.00 C ATOM 0 H PHE A 6 15.147 8.164 -1.065 1.00 0.00 H new ATOM 0 HA PHE A 6 17.439 6.703 -2.286 1.00 0.00 H new ATOM 0 HB2 PHE A 6 16.470 9.506 -2.801 1.00 0.00 H new ATOM 0 HB3 PHE A 6 17.819 8.691 -3.568 1.00 0.00 H new ATOM 0 HD1 PHE A 6 17.430 6.803 -5.154 1.00 0.00 H new ATOM 0 HD2 PHE A 6 14.168 9.055 -3.453 1.00 0.00 H new ATOM 0 HE1 PHE A 6 15.906 5.896 -6.900 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.632 8.067 -5.141 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.498 6.513 -6.866 1.00 0.00 H new ATOM 115 N VAL A 7 19.045 7.730 -0.540 1.00 0.00 N ATOM 116 CA VAL A 7 19.857 8.111 0.621 1.00 0.00 C ATOM 117 C VAL A 7 21.255 8.477 0.133 1.00 0.00 C ATOM 118 O VAL A 7 21.893 7.667 -0.535 1.00 0.00 O ATOM 119 CB VAL A 7 19.969 6.934 1.621 1.00 0.00 C ATOM 120 CG1 VAL A 7 20.633 7.417 2.918 1.00 0.00 C ATOM 121 CG2 VAL A 7 18.632 6.267 1.965 1.00 0.00 C ATOM 0 H VAL A 7 19.492 7.030 -1.132 1.00 0.00 H new ATOM 0 HA VAL A 7 19.386 8.955 1.125 1.00 0.00 H new ATOM 0 HB VAL A 7 20.574 6.178 1.120 1.00 0.00 H new ATOM 0 HG11 VAL A 7 20.710 6.586 3.619 1.00 0.00 H new ATOM 0 HG12 VAL A 7 21.630 7.798 2.696 1.00 0.00 H new ATOM 0 HG13 VAL A 7 20.031 8.211 3.361 1.00 0.00 H new ATOM 0 HG21 VAL A 7 18.802 5.454 2.671 1.00 0.00 H new ATOM 0 HG22 VAL A 7 17.963 7.002 2.413 1.00 0.00 H new ATOM 0 HG23 VAL A 7 18.179 5.870 1.056 1.00 0.00 H new ATOM 131 N CYS A 8 21.773 9.659 0.474 1.00 0.00 N ATOM 132 CA CYS A 8 23.056 10.099 -0.057 1.00 0.00 C ATOM 133 C CYS A 8 23.959 10.688 1.010 1.00 0.00 C ATOM 134 O CYS A 8 23.496 11.228 2.009 1.00 0.00 O ATOM 135 CB CYS A 8 22.775 11.123 -1.162 1.00 0.00 C ATOM 136 SG CYS A 8 24.254 11.495 -2.128 1.00 0.00 S ATOM 0 H CYS A 8 21.326 10.320 1.109 1.00 0.00 H new ATOM 0 HA CYS A 8 23.592 9.237 -0.454 1.00 0.00 H new ATOM 0 HB2 CYS A 8 21.997 10.740 -1.822 1.00 0.00 H new ATOM 0 HB3 CYS A 8 22.392 12.041 -0.717 1.00 0.00 H new ATOM 0 HG CYS A 8 24.421 12.783 -2.187 1.00 0.00 H new ATOM 142 N LYS A 9 25.267 10.663 0.748 1.00 0.00 N ATOM 143 CA LYS A 9 26.277 11.369 1.535 1.00 0.00 C ATOM 144 C LYS A 9 25.982 12.880 1.603 1.00 0.00 C ATOM 145 O LYS A 9 26.420 13.542 2.543 1.00 0.00 O ATOM 146 CB LYS A 9 27.667 11.081 0.923 1.00 0.00 C ATOM 147 CG LYS A 9 28.440 10.042 1.746 1.00 0.00 C ATOM 148 CD LYS A 9 29.817 9.769 1.129 1.00 0.00 C ATOM 149 CE LYS A 9 30.635 8.839 2.038 1.00 0.00 C ATOM 150 NZ LYS A 9 32.035 8.682 1.565 1.00 0.00 N ATOM 0 H LYS A 9 25.661 10.140 -0.034 1.00 0.00 H new ATOM 0 HA LYS A 9 26.257 11.009 2.564 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.548 10.722 -0.099 1.00 0.00 H new ATOM 0 HB3 LYS A 9 28.241 12.006 0.871 1.00 0.00 H new ATOM 0 HG2 LYS A 9 28.560 10.399 2.769 1.00 0.00 H new ATOM 0 HG3 LYS A 9 27.869 9.115 1.796 1.00 0.00 H new ATOM 0 HD2 LYS A 9 29.698 9.315 0.145 1.00 0.00 H new ATOM 0 HD3 LYS A 9 30.351 10.708 0.984 1.00 0.00 H new ATOM 0 HE2 LYS A 9 30.638 9.236 3.053 1.00 0.00 H new ATOM 0 HE3 LYS A 9 30.156 7.861 2.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 32.549 8.047 2.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 32.034 8.278 0.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 32.502 9.611 1.549 1.00 0.00 H new ATOM 164 N ARG A 10 25.224 13.420 0.640 1.00 0.00 N ATOM 165 CA ARG A 10 24.660 14.760 0.624 1.00 0.00 C ATOM 166 C ARG A 10 23.360 14.629 -0.151 1.00 0.00 C ATOM 167 O ARG A 10 23.374 14.397 -1.358 1.00 0.00 O ATOM 168 CB ARG A 10 25.604 15.806 -0.003 1.00 0.00 C ATOM 169 CG ARG A 10 26.389 15.376 -1.260 1.00 0.00 C ATOM 170 CD ARG A 10 27.058 16.604 -1.895 1.00 0.00 C ATOM 171 NE ARG A 10 28.358 16.275 -2.501 1.00 0.00 N ATOM 172 CZ ARG A 10 29.555 16.389 -1.908 1.00 0.00 C ATOM 173 NH1 ARG A 10 29.667 16.793 -0.643 1.00 0.00 N ATOM 174 NH2 ARG A 10 30.644 16.075 -2.593 1.00 0.00 N ATOM 0 H ARG A 10 24.978 12.893 -0.198 1.00 0.00 H new ATOM 0 HA ARG A 10 24.499 15.129 1.637 1.00 0.00 H new ATOM 0 HB2 ARG A 10 25.014 16.686 -0.257 1.00 0.00 H new ATOM 0 HB3 ARG A 10 26.323 16.113 0.757 1.00 0.00 H new ATOM 0 HG2 ARG A 10 27.143 14.635 -0.994 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.717 14.904 -1.977 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.399 17.022 -2.656 1.00 0.00 H new ATOM 0 HD3 ARG A 10 27.197 17.374 -1.136 1.00 0.00 H new ATOM 0 HE ARG A 10 28.347 15.928 -3.460 1.00 0.00 H new ATOM 0 HH11 ARG A 10 28.831 17.023 -0.105 1.00 0.00 H new ATOM 0 HH12 ARG A 10 30.588 16.872 -0.213 1.00 0.00 H new ATOM 0 HH21 ARG A 10 30.565 15.752 -3.557 1.00 0.00 H new ATOM 0 HH22 ARG A 10 31.562 16.156 -2.156 1.00 0.00 H new ATOM 188 N ASN A 11 22.237 14.713 0.560 1.00 0.00 N ATOM 189 CA ASN A 11 20.883 14.614 -0.014 1.00 0.00 C ATOM 190 C ASN A 11 20.720 15.499 -1.263 1.00 0.00 C ATOM 191 O ASN A 11 20.059 15.113 -2.228 1.00 0.00 O ATOM 192 CB ASN A 11 19.813 15.021 1.012 1.00 0.00 C ATOM 193 CG ASN A 11 18.418 14.955 0.387 1.00 0.00 C ATOM 194 OD1 ASN A 11 17.733 15.962 0.279 1.00 0.00 O ATOM 195 ND2 ASN A 11 17.973 13.794 -0.059 1.00 0.00 N ATOM 0 H ASN A 11 22.235 14.854 1.570 1.00 0.00 H new ATOM 0 HA ASN A 11 20.749 13.570 -0.297 1.00 0.00 H new ATOM 0 HB2 ASN A 11 19.861 14.361 1.878 1.00 0.00 H new ATOM 0 HB3 ASN A 11 20.010 16.031 1.370 1.00 0.00 H new ATOM 0 HD21 ASN A 11 17.053 13.734 -0.496 1.00 0.00 H new ATOM 0 HD22 ASN A 11 18.549 12.957 0.034 1.00 0.00 H new ATOM 202 N SER A 12 21.361 16.664 -1.224 1.00 0.00 N ATOM 203 CA SER A 12 21.288 17.821 -2.101 1.00 0.00 C ATOM 204 C SER A 12 21.267 17.596 -3.616 1.00 0.00 C ATOM 205 O SER A 12 20.783 18.486 -4.319 1.00 0.00 O ATOM 206 CB SER A 12 22.521 18.668 -1.763 1.00 0.00 C ATOM 207 OG SER A 12 22.697 18.761 -0.357 1.00 0.00 O ATOM 0 H SER A 12 22.032 16.837 -0.475 1.00 0.00 H new ATOM 0 HA SER A 12 20.315 18.273 -1.910 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.408 18.225 -2.217 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.410 19.666 -2.187 1.00 0.00 H new ATOM 0 HG SER A 12 21.863 19.067 0.057 1.00 0.00 H new ATOM 213 N CYS A 13 21.790 16.479 -4.134 1.00 0.00 N ATOM 214 CA CYS A 13 22.010 16.308 -5.568 1.00 0.00 C ATOM 215 C CYS A 13 21.457 14.978 -6.090 1.00 0.00 C ATOM 216 O CYS A 13 20.367 14.949 -6.665 1.00 0.00 O ATOM 217 CB CYS A 13 23.517 16.506 -5.863 1.00 0.00 C ATOM 218 SG CYS A 13 24.569 15.524 -4.736 1.00 0.00 S ATOM 0 H CYS A 13 22.070 15.675 -3.572 1.00 0.00 H new ATOM 0 HA CYS A 13 21.449 17.065 -6.115 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.725 16.221 -6.894 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.770 17.562 -5.767 1.00 0.00 H new ATOM 0 HG CYS A 13 25.794 15.530 -5.170 1.00 0.00 H new ATOM 224 N ARG A 14 22.199 13.881 -5.887 1.00 0.00 N ATOM 225 CA ARG A 14 21.933 12.575 -6.503 1.00 0.00 C ATOM 226 C ARG A 14 20.509 12.119 -6.153 1.00 0.00 C ATOM 227 O ARG A 14 19.702 11.807 -7.029 1.00 0.00 O ATOM 228 CB ARG A 14 22.989 11.551 -6.037 1.00 0.00 C ATOM 229 CG ARG A 14 24.366 11.843 -6.659 1.00 0.00 C ATOM 230 CD ARG A 14 25.510 11.213 -5.858 1.00 0.00 C ATOM 231 NE ARG A 14 26.050 12.139 -4.838 1.00 0.00 N ATOM 232 CZ ARG A 14 26.948 11.819 -3.896 1.00 0.00 C ATOM 233 NH1 ARG A 14 27.277 10.554 -3.682 1.00 0.00 N ATOM 234 NH2 ARG A 14 27.533 12.784 -3.199 1.00 0.00 N ATOM 0 H ARG A 14 23.017 13.877 -5.278 1.00 0.00 H new ATOM 0 HA ARG A 14 22.004 12.656 -7.588 1.00 0.00 H new ATOM 0 HB2 ARG A 14 23.066 11.575 -4.950 1.00 0.00 H new ATOM 0 HB3 ARG A 14 22.670 10.546 -6.312 1.00 0.00 H new ATOM 0 HG2 ARG A 14 24.389 11.464 -7.681 1.00 0.00 H new ATOM 0 HG3 ARG A 14 24.516 12.921 -6.716 1.00 0.00 H new ATOM 0 HD2 ARG A 14 25.154 10.305 -5.371 1.00 0.00 H new ATOM 0 HD3 ARG A 14 26.309 10.918 -6.538 1.00 0.00 H new ATOM 0 HE ARG A 14 25.711 13.101 -4.853 1.00 0.00 H new ATOM 0 HH11 ARG A 14 26.846 9.814 -4.236 1.00 0.00 H new ATOM 0 HH12 ARG A 14 27.961 10.320 -2.963 1.00 0.00 H new ATOM 0 HH21 ARG A 14 27.298 13.760 -3.382 1.00 0.00 H new ATOM 0 HH22 ARG A 14 28.218 12.551 -2.480 1.00 0.00 H new ATOM 248 N SER A 15 20.205 12.133 -4.856 1.00 0.00 N ATOM 249 CA SER A 15 18.939 11.718 -4.259 1.00 0.00 C ATOM 250 C SER A 15 17.791 12.627 -4.690 1.00 0.00 C ATOM 251 O SER A 15 16.735 12.128 -5.062 1.00 0.00 O ATOM 252 CB SER A 15 19.073 11.746 -2.727 1.00 0.00 C ATOM 253 OG SER A 15 20.247 12.421 -2.306 1.00 0.00 O ATOM 0 H SER A 15 20.874 12.452 -4.155 1.00 0.00 H new ATOM 0 HA SER A 15 18.712 10.709 -4.602 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.200 12.236 -2.296 1.00 0.00 H new ATOM 0 HB3 SER A 15 19.086 10.725 -2.346 1.00 0.00 H new ATOM 0 HG SER A 15 20.184 13.369 -2.548 1.00 0.00 H new ATOM 259 N GLN A 16 17.982 13.949 -4.640 1.00 0.00 N ATOM 260 CA GLN A 16 16.918 14.912 -4.919 1.00 0.00 C ATOM 261 C GLN A 16 16.413 14.775 -6.356 1.00 0.00 C ATOM 262 O GLN A 16 15.203 14.799 -6.588 1.00 0.00 O ATOM 263 CB GLN A 16 17.434 16.332 -4.635 1.00 0.00 C ATOM 264 CG GLN A 16 17.299 16.690 -3.147 1.00 0.00 C ATOM 265 CD GLN A 16 15.863 16.983 -2.693 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.961 17.264 -3.481 1.00 0.00 O ATOM 267 NE2 GLN A 16 15.628 16.921 -1.396 1.00 0.00 N ATOM 0 H GLN A 16 18.877 14.378 -4.405 1.00 0.00 H new ATOM 0 HA GLN A 16 16.069 14.709 -4.266 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.479 16.408 -4.936 1.00 0.00 H new ATOM 0 HB3 GLN A 16 16.876 17.050 -5.236 1.00 0.00 H new ATOM 0 HG2 GLN A 16 17.695 15.868 -2.551 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.918 17.562 -2.938 1.00 0.00 H new ATOM 0 HE21 GLN A 16 16.383 16.687 -0.751 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.691 17.107 -1.038 1.00 0.00 H new ATOM 276 N MET A 17 17.320 14.575 -7.316 1.00 0.00 N ATOM 277 CA MET A 17 16.929 14.273 -8.686 1.00 0.00 C ATOM 278 C MET A 17 16.163 12.952 -8.762 1.00 0.00 C ATOM 279 O MET A 17 15.098 12.899 -9.377 1.00 0.00 O ATOM 280 CB MET A 17 18.167 14.223 -9.584 1.00 0.00 C ATOM 281 CG MET A 17 18.605 15.629 -10.010 1.00 0.00 C ATOM 282 SD MET A 17 19.643 15.693 -11.497 1.00 0.00 S ATOM 283 CE MET A 17 21.203 15.081 -10.819 1.00 0.00 C ATOM 0 H MET A 17 18.328 14.618 -7.165 1.00 0.00 H new ATOM 0 HA MET A 17 16.267 15.065 -9.035 1.00 0.00 H new ATOM 0 HB2 MET A 17 18.983 13.731 -9.055 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.953 13.623 -10.469 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.715 16.234 -10.181 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.150 16.089 -9.185 1.00 0.00 H new ATOM 0 HE1 MET A 17 21.957 15.056 -11.606 1.00 0.00 H new ATOM 0 HE2 MET A 17 21.536 15.742 -10.018 1.00 0.00 H new ATOM 0 HE3 MET A 17 21.058 14.076 -10.423 1.00 0.00 H new ATOM 293 N ALA A 18 16.679 11.892 -8.129 1.00 0.00 N ATOM 294 CA ALA A 18 16.042 10.582 -8.163 1.00 0.00 C ATOM 295 C ALA A 18 14.614 10.645 -7.611 1.00 0.00 C ATOM 296 O ALA A 18 13.710 10.027 -8.167 1.00 0.00 O ATOM 297 CB ALA A 18 16.890 9.578 -7.379 1.00 0.00 C ATOM 0 H ALA A 18 17.542 11.923 -7.585 1.00 0.00 H new ATOM 0 HA ALA A 18 15.973 10.253 -9.200 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.412 8.599 -7.406 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.881 9.510 -7.828 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.982 9.909 -6.345 1.00 0.00 H new ATOM 303 N GLU A 19 14.413 11.433 -6.556 1.00 0.00 N ATOM 304 CA GLU A 19 13.130 11.654 -5.901 1.00 0.00 C ATOM 305 C GLU A 19 12.157 12.309 -6.891 1.00 0.00 C ATOM 306 O GLU A 19 11.064 11.782 -7.117 1.00 0.00 O ATOM 307 CB GLU A 19 13.406 12.510 -4.649 1.00 0.00 C ATOM 308 CG GLU A 19 12.308 12.547 -3.576 1.00 0.00 C ATOM 309 CD GLU A 19 11.075 13.400 -3.927 1.00 0.00 C ATOM 310 OE1 GLU A 19 11.166 14.271 -4.817 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.033 13.242 -3.251 1.00 0.00 O ATOM 0 H GLU A 19 15.172 11.955 -6.118 1.00 0.00 H new ATOM 0 HA GLU A 19 12.654 10.725 -5.585 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.322 12.146 -4.184 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.598 13.533 -4.973 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.980 11.526 -3.380 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.740 12.926 -2.650 1.00 0.00 H new ATOM 318 N GLY A 20 12.575 13.401 -7.544 1.00 0.00 N ATOM 319 CA GLY A 20 11.751 14.097 -8.518 1.00 0.00 C ATOM 320 C GLY A 20 11.367 13.200 -9.700 1.00 0.00 C ATOM 321 O GLY A 20 10.207 13.217 -10.125 1.00 0.00 O ATOM 0 H GLY A 20 13.495 13.820 -7.406 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.846 14.461 -8.032 1.00 0.00 H new ATOM 0 HA3 GLY A 20 12.288 14.971 -8.887 1.00 0.00 H new ATOM 325 N PHE A 21 12.297 12.396 -10.235 1.00 0.00 N ATOM 326 CA PHE A 21 11.952 11.489 -11.328 1.00 0.00 C ATOM 327 C PHE A 21 10.997 10.422 -10.804 1.00 0.00 C ATOM 328 O PHE A 21 9.936 10.235 -11.382 1.00 0.00 O ATOM 329 CB PHE A 21 13.188 10.864 -12.006 1.00 0.00 C ATOM 330 CG PHE A 21 14.102 11.868 -12.690 1.00 0.00 C ATOM 331 CD1 PHE A 21 13.605 12.741 -13.681 1.00 0.00 C ATOM 332 CD2 PHE A 21 15.439 11.989 -12.273 1.00 0.00 C ATOM 333 CE1 PHE A 21 14.400 13.805 -14.146 1.00 0.00 C ATOM 334 CE2 PHE A 21 16.240 13.036 -12.762 1.00 0.00 C ATOM 335 CZ PHE A 21 15.708 13.964 -13.670 1.00 0.00 C ATOM 0 H PHE A 21 13.271 12.357 -9.934 1.00 0.00 H new ATOM 0 HA PHE A 21 11.460 12.069 -12.108 1.00 0.00 H new ATOM 0 HB2 PHE A 21 13.762 10.319 -11.257 1.00 0.00 H new ATOM 0 HB3 PHE A 21 12.853 10.134 -12.743 1.00 0.00 H new ATOM 0 HD1 PHE A 21 12.614 12.592 -14.083 1.00 0.00 H new ATOM 0 HD2 PHE A 21 15.852 11.276 -11.575 1.00 0.00 H new ATOM 0 HE1 PHE A 21 14.001 14.500 -14.871 1.00 0.00 H new ATOM 0 HE2 PHE A 21 17.266 13.126 -12.438 1.00 0.00 H new ATOM 0 HZ PHE A 21 16.306 14.800 -14.002 1.00 0.00 H new ATOM 345 N ALA A 22 11.302 9.767 -9.686 1.00 0.00 N ATOM 346 CA ALA A 22 10.504 8.676 -9.143 1.00 0.00 C ATOM 347 C ALA A 22 9.081 9.099 -8.833 1.00 0.00 C ATOM 348 O ALA A 22 8.168 8.314 -9.085 1.00 0.00 O ATOM 349 CB ALA A 22 11.191 8.090 -7.910 1.00 0.00 C ATOM 0 H ALA A 22 12.125 9.985 -9.124 1.00 0.00 H new ATOM 0 HA ALA A 22 10.433 7.903 -9.909 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.588 7.275 -7.510 1.00 0.00 H new ATOM 0 HB2 ALA A 22 12.175 7.711 -8.187 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.301 8.865 -7.152 1.00 0.00 H new ATOM 355 N LYS A 23 8.852 10.321 -8.351 1.00 0.00 N ATOM 356 CA LYS A 23 7.487 10.770 -8.154 1.00 0.00 C ATOM 357 C LYS A 23 6.816 11.047 -9.490 1.00 0.00 C ATOM 358 O LYS A 23 5.662 10.696 -9.660 1.00 0.00 O ATOM 359 CB LYS A 23 7.405 11.902 -7.122 1.00 0.00 C ATOM 360 CG LYS A 23 7.673 13.305 -7.651 1.00 0.00 C ATOM 361 CD LYS A 23 7.696 14.274 -6.465 1.00 0.00 C ATOM 362 CE LYS A 23 7.549 15.691 -7.011 1.00 0.00 C ATOM 363 NZ LYS A 23 7.692 16.725 -5.956 1.00 0.00 N ATOM 0 H LYS A 23 9.575 10.995 -8.098 1.00 0.00 H new ATOM 0 HA LYS A 23 6.901 9.968 -7.705 1.00 0.00 H new ATOM 0 HB2 LYS A 23 6.412 11.887 -6.673 1.00 0.00 H new ATOM 0 HB3 LYS A 23 8.118 11.693 -6.325 1.00 0.00 H new ATOM 0 HG2 LYS A 23 8.624 13.334 -8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 23 6.901 13.596 -8.363 1.00 0.00 H new ATOM 0 HD2 LYS A 23 6.886 14.047 -5.772 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.629 14.174 -5.910 1.00 0.00 H new ATOM 0 HE2 LYS A 23 8.299 15.859 -7.784 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.574 15.794 -7.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 7.355 17.640 -6.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 7.129 16.453 -5.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 8.693 16.808 -5.685 1.00 0.00 H new ATOM 377 N THR A 24 7.506 11.562 -10.496 1.00 0.00 N ATOM 378 CA THR A 24 6.863 11.759 -11.776 1.00 0.00 C ATOM 379 C THR A 24 6.511 10.404 -12.416 1.00 0.00 C ATOM 380 O THR A 24 5.425 10.222 -12.971 1.00 0.00 O ATOM 381 CB THR A 24 7.826 12.577 -12.647 1.00 0.00 C ATOM 382 OG1 THR A 24 8.213 13.762 -11.976 1.00 0.00 O ATOM 383 CG2 THR A 24 7.167 12.962 -13.962 1.00 0.00 C ATOM 0 H THR A 24 8.485 11.843 -10.451 1.00 0.00 H new ATOM 0 HA THR A 24 5.922 12.298 -11.667 1.00 0.00 H new ATOM 0 HB THR A 24 8.701 11.958 -12.843 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.938 13.560 -11.348 1.00 0.00 H new ATOM 0 HG21 THR A 24 7.867 13.541 -14.564 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.882 12.060 -14.504 1.00 0.00 H new ATOM 0 HG23 THR A 24 6.279 13.561 -13.762 1.00 0.00 H new ATOM 391 N LEU A 25 7.437 9.452 -12.322 1.00 0.00 N ATOM 392 CA LEU A 25 7.382 8.147 -12.953 1.00 0.00 C ATOM 393 C LEU A 25 6.418 7.216 -12.228 1.00 0.00 C ATOM 394 O LEU A 25 5.802 6.372 -12.880 1.00 0.00 O ATOM 395 CB LEU A 25 8.801 7.555 -13.010 1.00 0.00 C ATOM 396 CG LEU A 25 9.776 8.346 -13.912 1.00 0.00 C ATOM 397 CD1 LEU A 25 11.188 7.788 -13.739 1.00 0.00 C ATOM 398 CD2 LEU A 25 9.378 8.276 -15.391 1.00 0.00 C ATOM 0 H LEU A 25 8.287 9.583 -11.774 1.00 0.00 H new ATOM 0 HA LEU A 25 7.001 8.259 -13.968 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.208 7.515 -12.000 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.741 6.528 -13.370 1.00 0.00 H new ATOM 0 HG LEU A 25 9.738 9.392 -13.608 1.00 0.00 H new ATOM 0 HD11 LEU A 25 11.879 8.343 -14.374 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.493 7.887 -12.697 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.201 6.736 -14.023 1.00 0.00 H new ATOM 0 HD21 LEU A 25 10.091 8.846 -15.987 1.00 0.00 H new ATOM 0 HD22 LEU A 25 9.379 7.237 -15.719 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.380 8.696 -15.520 1.00 0.00 H new ATOM 410 N GLY A 26 6.270 7.369 -10.908 1.00 0.00 N ATOM 411 CA GLY A 26 5.538 6.406 -10.098 1.00 0.00 C ATOM 412 C GLY A 26 4.661 6.952 -8.971 1.00 0.00 C ATOM 413 O GLY A 26 4.085 6.128 -8.254 1.00 0.00 O ATOM 0 H GLY A 26 6.651 8.155 -10.382 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.904 5.820 -10.763 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.260 5.718 -9.659 1.00 0.00 H new ATOM 417 N ALA A 27 4.503 8.272 -8.797 1.00 0.00 N ATOM 418 CA ALA A 27 3.527 8.828 -7.858 1.00 0.00 C ATOM 419 C ALA A 27 2.139 8.284 -8.208 1.00 0.00 C ATOM 420 O ALA A 27 1.609 8.571 -9.285 1.00 0.00 O ATOM 421 CB ALA A 27 3.527 10.374 -7.851 1.00 0.00 C ATOM 0 H ALA A 27 5.044 8.976 -9.299 1.00 0.00 H new ATOM 0 HA ALA A 27 3.806 8.520 -6.851 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.786 10.735 -7.138 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.514 10.737 -7.563 1.00 0.00 H new ATOM 0 HB3 ALA A 27 3.282 10.742 -8.847 1.00 0.00 H new ATOM 427 N GLY A 28 1.579 7.474 -7.308 1.00 0.00 N ATOM 428 CA GLY A 28 0.311 6.777 -7.495 1.00 0.00 C ATOM 429 C GLY A 28 0.455 5.273 -7.264 1.00 0.00 C ATOM 430 O GLY A 28 -0.526 4.625 -6.896 1.00 0.00 O ATOM 0 H GLY A 28 2.010 7.281 -6.404 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.432 7.182 -6.808 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -0.058 6.957 -8.505 1.00 0.00 H new ATOM 434 N LYS A 29 1.665 4.715 -7.426 1.00 0.00 N ATOM 435 CA LYS A 29 1.942 3.290 -7.227 1.00 0.00 C ATOM 436 C LYS A 29 3.163 3.057 -6.341 1.00 0.00 C ATOM 437 O LYS A 29 3.281 1.986 -5.745 1.00 0.00 O ATOM 438 CB LYS A 29 1.964 2.541 -8.576 1.00 0.00 C ATOM 439 CG LYS A 29 2.715 3.191 -9.758 1.00 0.00 C ATOM 440 CD LYS A 29 4.238 3.042 -9.694 1.00 0.00 C ATOM 441 CE LYS A 29 4.720 1.599 -9.914 1.00 0.00 C ATOM 442 NZ LYS A 29 4.486 1.142 -11.310 1.00 0.00 N ATOM 0 H LYS A 29 2.487 5.251 -7.703 1.00 0.00 H new ATOM 0 HA LYS A 29 1.120 2.850 -6.662 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.401 1.557 -8.404 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.931 2.381 -8.885 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.357 2.749 -10.688 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.466 4.252 -9.792 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.691 3.687 -10.447 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.589 3.390 -8.723 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.783 1.533 -9.684 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.202 0.934 -9.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.224 0.461 -11.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.554 0.685 -11.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.516 1.959 -11.952 1.00 0.00 H new ATOM 456 N ILE A 30 4.019 4.063 -6.171 1.00 0.00 N ATOM 457 CA ILE A 30 5.093 4.081 -5.190 1.00 0.00 C ATOM 458 C ILE A 30 4.989 5.407 -4.451 1.00 0.00 C ATOM 459 O ILE A 30 4.545 6.412 -5.015 1.00 0.00 O ATOM 460 CB ILE A 30 6.486 3.868 -5.827 1.00 0.00 C ATOM 461 CG1 ILE A 30 6.829 4.848 -6.971 1.00 0.00 C ATOM 462 CG2 ILE A 30 6.597 2.416 -6.317 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.335 5.014 -7.219 1.00 0.00 C ATOM 0 H ILE A 30 3.979 4.914 -6.732 1.00 0.00 H new ATOM 0 HA ILE A 30 4.984 3.248 -4.496 1.00 0.00 H new ATOM 0 HB ILE A 30 7.217 4.077 -5.046 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.356 4.499 -7.889 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.399 5.823 -6.742 1.00 0.00 H new ATOM 0 HG21 ILE A 30 7.577 2.258 -6.768 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.472 1.737 -5.474 1.00 0.00 H new ATOM 0 HG23 ILE A 30 5.821 2.222 -7.058 1.00 0.00 H new ATOM 0 HD11 ILE A 30 8.494 5.717 -8.037 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.813 5.394 -6.316 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.769 4.049 -7.481 1.00 0.00 H new ATOM 475 N ALA A 31 5.408 5.402 -3.190 1.00 0.00 N ATOM 476 CA ALA A 31 5.568 6.605 -2.400 1.00 0.00 C ATOM 477 C ALA A 31 7.067 6.788 -2.224 1.00 0.00 C ATOM 478 O ALA A 31 7.775 5.884 -1.786 1.00 0.00 O ATOM 479 CB ALA A 31 4.806 6.482 -1.078 1.00 0.00 C ATOM 0 H ALA A 31 5.648 4.548 -2.687 1.00 0.00 H new ATOM 0 HA ALA A 31 5.147 7.486 -2.884 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.937 7.395 -0.496 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.746 6.330 -1.282 1.00 0.00 H new ATOM 0 HB3 ALA A 31 5.192 5.633 -0.513 1.00 0.00 H new ATOM 485 N VAL A 32 7.549 7.947 -2.635 1.00 0.00 N ATOM 486 CA VAL A 32 8.932 8.292 -2.774 1.00 0.00 C ATOM 487 C VAL A 32 9.293 9.367 -1.757 1.00 0.00 C ATOM 488 O VAL A 32 8.495 10.257 -1.452 1.00 0.00 O ATOM 489 CB VAL A 32 9.102 8.718 -4.247 1.00 0.00 C ATOM 490 CG1 VAL A 32 7.867 9.293 -4.959 1.00 0.00 C ATOM 491 CG2 VAL A 32 10.272 9.674 -4.467 1.00 0.00 C ATOM 0 H VAL A 32 6.933 8.717 -2.896 1.00 0.00 H new ATOM 0 HA VAL A 32 9.617 7.471 -2.563 1.00 0.00 H new ATOM 0 HB VAL A 32 9.299 7.751 -4.711 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.126 9.551 -5.986 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.070 8.550 -4.961 1.00 0.00 H new ATOM 0 HG13 VAL A 32 7.528 10.187 -4.435 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.336 9.934 -5.524 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.118 10.579 -3.879 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.199 9.192 -4.155 1.00 0.00 H new ATOM 501 N THR A 33 10.510 9.283 -1.231 1.00 0.00 N ATOM 502 CA THR A 33 11.154 10.294 -0.416 1.00 0.00 C ATOM 503 C THR A 33 12.667 10.136 -0.627 1.00 0.00 C ATOM 504 O THR A 33 13.131 9.091 -1.089 1.00 0.00 O ATOM 505 CB THR A 33 10.725 10.081 1.057 1.00 0.00 C ATOM 506 OG1 THR A 33 9.324 10.252 1.183 1.00 0.00 O ATOM 507 CG2 THR A 33 11.379 11.023 2.074 1.00 0.00 C ATOM 0 H THR A 33 11.100 8.463 -1.372 1.00 0.00 H new ATOM 0 HA THR A 33 10.868 11.310 -0.688 1.00 0.00 H new ATOM 0 HB THR A 33 11.056 9.068 1.287 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.933 10.414 0.299 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.012 10.791 3.074 1.00 0.00 H new ATOM 0 HG22 THR A 33 12.461 10.894 2.046 1.00 0.00 H new ATOM 0 HG23 THR A 33 11.130 12.055 1.826 1.00 0.00 H new ATOM 515 N SER A 34 13.449 11.166 -0.318 1.00 0.00 N ATOM 516 CA SER A 34 14.891 11.086 -0.244 1.00 0.00 C ATOM 517 C SER A 34 15.373 11.696 1.069 1.00 0.00 C ATOM 518 O SER A 34 14.646 12.459 1.714 1.00 0.00 O ATOM 519 CB SER A 34 15.506 11.727 -1.480 1.00 0.00 C ATOM 520 OG SER A 34 15.474 13.146 -1.471 1.00 0.00 O ATOM 0 H SER A 34 13.084 12.095 -0.109 1.00 0.00 H new ATOM 0 HA SER A 34 15.220 10.047 -0.241 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.541 11.398 -1.571 1.00 0.00 H new ATOM 0 HB3 SER A 34 14.979 11.368 -2.364 1.00 0.00 H new ATOM 0 HG SER A 34 15.886 13.488 -2.292 1.00 0.00 H new ATOM 526 N CYS A 35 16.599 11.366 1.466 1.00 0.00 N ATOM 527 CA CYS A 35 17.240 11.904 2.644 1.00 0.00 C ATOM 528 C CYS A 35 18.751 11.836 2.417 1.00 0.00 C ATOM 529 O CYS A 35 19.209 11.564 1.299 1.00 0.00 O ATOM 530 CB CYS A 35 16.768 11.129 3.886 1.00 0.00 C ATOM 531 SG CYS A 35 17.330 9.405 3.835 1.00 0.00 S ATOM 0 H CYS A 35 17.182 10.700 0.959 1.00 0.00 H new ATOM 0 HA CYS A 35 16.971 12.945 2.821 1.00 0.00 H new ATOM 0 HB2 CYS A 35 17.149 11.612 4.786 1.00 0.00 H new ATOM 0 HB3 CYS A 35 15.680 11.158 3.945 1.00 0.00 H new ATOM 0 HG CYS A 35 16.493 8.696 3.137 1.00 0.00 H new ATOM 537 N GLY A 36 19.550 12.066 3.452 1.00 0.00 N ATOM 538 CA GLY A 36 20.976 11.829 3.365 1.00 0.00 C ATOM 539 C GLY A 36 21.598 11.669 4.734 1.00 0.00 C ATOM 540 O GLY A 36 20.962 11.985 5.743 1.00 0.00 O ATOM 0 H GLY A 36 19.231 12.415 4.356 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.161 10.932 2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.452 12.659 2.843 1.00 0.00 H new ATOM 544 N LEU A 37 22.842 11.181 4.741 1.00 0.00 N ATOM 545 CA LEU A 37 23.651 10.974 5.945 1.00 0.00 C ATOM 546 C LEU A 37 23.692 12.259 6.776 1.00 0.00 C ATOM 547 O LEU A 37 23.643 12.214 8.004 1.00 0.00 O ATOM 548 CB LEU A 37 25.081 10.531 5.575 1.00 0.00 C ATOM 549 CG LEU A 37 25.246 9.024 5.296 1.00 0.00 C ATOM 550 CD1 LEU A 37 24.447 8.512 4.092 1.00 0.00 C ATOM 551 CD2 LEU A 37 26.727 8.694 5.082 1.00 0.00 C ATOM 0 H LEU A 37 23.327 10.912 3.885 1.00 0.00 H new ATOM 0 HA LEU A 37 23.192 10.182 6.537 1.00 0.00 H new ATOM 0 HB2 LEU A 37 25.400 11.085 4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 37 25.753 10.810 6.387 1.00 0.00 H new ATOM 0 HG LEU A 37 24.846 8.518 6.175 1.00 0.00 H new ATOM 0 HD11 LEU A 37 24.621 7.443 3.968 1.00 0.00 H new ATOM 0 HD12 LEU A 37 23.385 8.690 4.258 1.00 0.00 H new ATOM 0 HD13 LEU A 37 24.767 9.038 3.193 1.00 0.00 H new ATOM 0 HD21 LEU A 37 26.837 7.628 4.885 1.00 0.00 H new ATOM 0 HD22 LEU A 37 27.107 9.261 4.232 1.00 0.00 H new ATOM 0 HD23 LEU A 37 27.292 8.958 5.976 1.00 0.00 H new ATOM 563 N GLU A 38 23.740 13.398 6.088 1.00 0.00 N ATOM 564 CA GLU A 38 23.570 14.737 6.617 1.00 0.00 C ATOM 565 C GLU A 38 22.801 15.495 5.531 1.00 0.00 C ATOM 566 O GLU A 38 23.000 15.244 4.334 1.00 0.00 O ATOM 567 CB GLU A 38 24.932 15.413 6.865 1.00 0.00 C ATOM 568 CG GLU A 38 25.788 14.785 7.979 1.00 0.00 C ATOM 569 CD GLU A 38 25.157 14.832 9.388 1.00 0.00 C ATOM 570 OE1 GLU A 38 24.277 15.679 9.663 1.00 0.00 O ATOM 571 OE2 GLU A 38 25.592 14.051 10.266 1.00 0.00 O ATOM 0 H GLU A 38 23.910 13.403 5.082 1.00 0.00 H new ATOM 0 HA GLU A 38 23.047 14.726 7.573 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.503 15.393 5.937 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.759 16.461 7.110 1.00 0.00 H new ATOM 0 HG2 GLU A 38 25.988 13.745 7.721 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.750 15.297 8.010 1.00 0.00 H new ATOM 578 N SER A 39 21.915 16.403 5.929 1.00 0.00 N ATOM 579 CA SER A 39 21.200 17.277 5.010 1.00 0.00 C ATOM 580 C SER A 39 22.044 18.512 4.658 1.00 0.00 C ATOM 581 O SER A 39 22.929 18.930 5.413 1.00 0.00 O ATOM 582 CB SER A 39 19.860 17.677 5.649 1.00 0.00 C ATOM 583 OG SER A 39 19.998 17.950 7.037 1.00 0.00 O ATOM 0 H SER A 39 21.672 16.553 6.908 1.00 0.00 H new ATOM 0 HA SER A 39 21.007 16.748 4.077 1.00 0.00 H new ATOM 0 HB2 SER A 39 19.464 18.558 5.143 1.00 0.00 H new ATOM 0 HB3 SER A 39 19.136 16.875 5.506 1.00 0.00 H new ATOM 0 HG SER A 39 19.127 18.202 7.409 1.00 0.00 H new ATOM 589 N SER A 40 21.757 19.106 3.500 1.00 0.00 N ATOM 590 CA SER A 40 22.235 20.396 3.007 1.00 0.00 C ATOM 591 C SER A 40 21.282 20.768 1.864 1.00 0.00 C ATOM 592 O SER A 40 20.706 19.862 1.248 1.00 0.00 O ATOM 593 CB SER A 40 23.684 20.280 2.511 1.00 0.00 C ATOM 594 OG SER A 40 24.574 20.132 3.605 1.00 0.00 O ATOM 0 H SER A 40 21.133 18.660 2.828 1.00 0.00 H new ATOM 0 HA SER A 40 22.240 21.159 3.786 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.778 19.426 1.841 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.950 21.167 1.936 1.00 0.00 H new ATOM 0 HG SER A 40 24.080 19.807 4.387 1.00 0.00 H new ATOM 600 N ARG A 41 21.067 22.062 1.592 1.00 0.00 N ATOM 601 CA ARG A 41 20.021 22.514 0.669 1.00 0.00 C ATOM 602 C ARG A 41 20.155 21.867 -0.706 1.00 0.00 C ATOM 603 O ARG A 41 21.246 21.468 -1.112 1.00 0.00 O ATOM 604 CB ARG A 41 19.977 24.051 0.563 1.00 0.00 C ATOM 605 CG ARG A 41 21.157 24.680 -0.201 1.00 0.00 C ATOM 606 CD ARG A 41 20.868 26.157 -0.488 1.00 0.00 C ATOM 607 NE ARG A 41 21.916 26.780 -1.314 1.00 0.00 N ATOM 608 CZ ARG A 41 21.966 26.803 -2.654 1.00 0.00 C ATOM 609 NH1 ARG A 41 21.133 26.068 -3.392 1.00 0.00 N ATOM 610 NH2 ARG A 41 22.863 27.577 -3.257 1.00 0.00 N ATOM 0 H ARG A 41 21.611 22.820 2.004 1.00 0.00 H new ATOM 0 HA ARG A 41 19.069 22.188 1.089 1.00 0.00 H new ATOM 0 HB2 ARG A 41 19.048 24.341 0.071 1.00 0.00 H new ATOM 0 HB3 ARG A 41 19.949 24.470 1.569 1.00 0.00 H new ATOM 0 HG2 ARG A 41 22.071 24.587 0.385 1.00 0.00 H new ATOM 0 HG3 ARG A 41 21.322 24.145 -1.136 1.00 0.00 H new ATOM 0 HD2 ARG A 41 19.908 26.245 -0.996 1.00 0.00 H new ATOM 0 HD3 ARG A 41 20.781 26.698 0.454 1.00 0.00 H new ATOM 0 HE ARG A 41 22.680 27.240 -0.818 1.00 0.00 H new ATOM 0 HH11 ARG A 41 20.440 25.473 -2.938 1.00 0.00 H new ATOM 0 HH12 ARG A 41 21.189 26.101 -4.410 1.00 0.00 H new ATOM 0 HH21 ARG A 41 23.503 28.144 -2.701 1.00 0.00 H new ATOM 0 HH22 ARG A 41 22.911 27.603 -4.276 1.00 0.00 H new ATOM 624 N VAL A 42 19.045 21.811 -1.434 1.00 0.00 N ATOM 625 CA VAL A 42 19.015 21.258 -2.782 1.00 0.00 C ATOM 626 C VAL A 42 19.955 22.095 -3.655 1.00 0.00 C ATOM 627 O VAL A 42 19.963 23.330 -3.569 1.00 0.00 O ATOM 628 CB VAL A 42 17.572 21.206 -3.325 1.00 0.00 C ATOM 629 CG1 VAL A 42 17.540 20.463 -4.670 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.627 20.502 -2.334 1.00 0.00 C ATOM 0 H VAL A 42 18.140 22.148 -1.105 1.00 0.00 H new ATOM 0 HA VAL A 42 19.364 20.225 -2.786 1.00 0.00 H new ATOM 0 HB VAL A 42 17.232 22.232 -3.461 1.00 0.00 H new ATOM 0 HG11 VAL A 42 16.517 20.432 -5.044 1.00 0.00 H new ATOM 0 HG12 VAL A 42 18.174 20.983 -5.388 1.00 0.00 H new ATOM 0 HG13 VAL A 42 17.907 19.446 -4.533 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.618 20.481 -2.746 1.00 0.00 H new ATOM 0 HG22 VAL A 42 16.971 19.482 -2.166 1.00 0.00 H new ATOM 0 HG23 VAL A 42 16.622 21.044 -1.388 1.00 0.00 H new ATOM 640 N HIS A 43 20.770 21.418 -4.463 1.00 0.00 N ATOM 641 CA HIS A 43 21.731 22.051 -5.351 1.00 0.00 C ATOM 642 C HIS A 43 20.977 22.706 -6.524 1.00 0.00 C ATOM 643 O HIS A 43 19.992 22.131 -6.992 1.00 0.00 O ATOM 644 CB HIS A 43 22.734 20.972 -5.787 1.00 0.00 C ATOM 645 CG HIS A 43 24.027 21.537 -6.303 1.00 0.00 C ATOM 646 ND1 HIS A 43 24.383 21.672 -7.622 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.053 22.049 -5.553 1.00 0.00 C ATOM 648 CE1 HIS A 43 25.595 22.250 -7.668 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.048 22.503 -6.429 1.00 0.00 N ATOM 0 H HIS A 43 20.777 20.399 -4.516 1.00 0.00 H new ATOM 0 HA HIS A 43 22.289 22.850 -4.864 1.00 0.00 H new ATOM 0 HB2 HIS A 43 22.943 20.317 -4.941 1.00 0.00 H new ATOM 0 HB3 HIS A 43 22.280 20.355 -6.563 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.089 22.095 -4.475 1.00 0.00 H new ATOM 0 HE1 HIS A 43 26.132 22.480 -8.577 1.00 0.00 H new ATOM 0 HE2 HIS A 43 26.936 22.937 -6.177 1.00 0.00 H new ATOM 657 N PRO A 44 21.392 23.880 -7.037 1.00 0.00 N ATOM 658 CA PRO A 44 20.572 24.629 -7.984 1.00 0.00 C ATOM 659 C PRO A 44 20.576 24.028 -9.385 1.00 0.00 C ATOM 660 O PRO A 44 19.522 23.908 -9.993 1.00 0.00 O ATOM 661 CB PRO A 44 21.130 26.055 -7.959 1.00 0.00 C ATOM 662 CG PRO A 44 22.605 25.862 -7.601 1.00 0.00 C ATOM 663 CD PRO A 44 22.616 24.606 -6.726 1.00 0.00 C ATOM 0 HA PRO A 44 19.521 24.602 -7.697 1.00 0.00 H new ATOM 0 HB2 PRO A 44 21.014 26.547 -8.924 1.00 0.00 H new ATOM 0 HB3 PRO A 44 20.617 26.673 -7.222 1.00 0.00 H new ATOM 0 HG2 PRO A 44 23.218 25.732 -8.493 1.00 0.00 H new ATOM 0 HG3 PRO A 44 23.001 26.725 -7.065 1.00 0.00 H new ATOM 0 HD2 PRO A 44 23.494 23.995 -6.934 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.654 24.869 -5.669 1.00 0.00 H new ATOM 671 N THR A 45 21.708 23.579 -9.916 1.00 0.00 N ATOM 672 CA THR A 45 21.760 23.056 -11.282 1.00 0.00 C ATOM 673 C THR A 45 20.958 21.743 -11.429 1.00 0.00 C ATOM 674 O THR A 45 20.547 21.361 -12.530 1.00 0.00 O ATOM 675 CB THR A 45 23.250 22.903 -11.624 1.00 0.00 C ATOM 676 OG1 THR A 45 23.936 24.107 -11.316 1.00 0.00 O ATOM 677 CG2 THR A 45 23.547 22.510 -13.069 1.00 0.00 C ATOM 0 H THR A 45 22.602 23.565 -9.425 1.00 0.00 H new ATOM 0 HA THR A 45 21.283 23.735 -11.989 1.00 0.00 H new ATOM 0 HB THR A 45 23.602 22.071 -11.013 1.00 0.00 H new ATOM 0 HG1 THR A 45 24.886 24.007 -11.533 1.00 0.00 H new ATOM 0 HG21 THR A 45 24.625 22.428 -13.209 1.00 0.00 H new ATOM 0 HG22 THR A 45 23.078 21.551 -13.289 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.151 23.271 -13.742 1.00 0.00 H new ATOM 685 N ALA A 46 20.644 21.089 -10.305 1.00 0.00 N ATOM 686 CA ALA A 46 19.722 19.964 -10.263 1.00 0.00 C ATOM 687 C ALA A 46 18.366 20.349 -10.844 1.00 0.00 C ATOM 688 O ALA A 46 17.743 19.558 -11.552 1.00 0.00 O ATOM 689 CB ALA A 46 19.510 19.574 -8.803 1.00 0.00 C ATOM 0 H ALA A 46 21.030 21.334 -9.393 1.00 0.00 H new ATOM 0 HA ALA A 46 20.142 19.144 -10.845 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.821 18.731 -8.748 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.465 19.292 -8.359 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.093 20.420 -8.257 1.00 0.00 H new ATOM 695 N ILE A 47 17.916 21.573 -10.546 1.00 0.00 N ATOM 696 CA ILE A 47 16.658 22.095 -11.005 1.00 0.00 C ATOM 697 C ILE A 47 16.662 22.016 -12.530 1.00 0.00 C ATOM 698 O ILE A 47 15.721 21.501 -13.124 1.00 0.00 O ATOM 699 CB ILE A 47 16.516 23.550 -10.513 1.00 0.00 C ATOM 700 CG1 ILE A 47 16.531 23.653 -8.968 1.00 0.00 C ATOM 701 CG2 ILE A 47 15.259 24.181 -11.103 1.00 0.00 C ATOM 702 CD1 ILE A 47 16.844 25.070 -8.473 1.00 0.00 C ATOM 0 H ILE A 47 18.439 22.229 -9.966 1.00 0.00 H new ATOM 0 HA ILE A 47 15.813 21.527 -10.617 1.00 0.00 H new ATOM 0 HB ILE A 47 17.385 24.107 -10.864 1.00 0.00 H new ATOM 0 HG12 ILE A 47 15.562 23.342 -8.578 1.00 0.00 H new ATOM 0 HG13 ILE A 47 17.273 22.961 -8.569 1.00 0.00 H new ATOM 0 HG21 ILE A 47 15.167 25.208 -10.750 1.00 0.00 H new ATOM 0 HG22 ILE A 47 15.326 24.176 -12.191 1.00 0.00 H new ATOM 0 HG23 ILE A 47 14.384 23.611 -10.790 1.00 0.00 H new ATOM 0 HD11 ILE A 47 16.841 25.084 -7.383 1.00 0.00 H new ATOM 0 HD12 ILE A 47 17.825 25.374 -8.837 1.00 0.00 H new ATOM 0 HD13 ILE A 47 16.088 25.761 -8.846 1.00 0.00 H new ATOM 714 N ALA A 48 17.752 22.485 -13.147 1.00 0.00 N ATOM 715 CA ALA A 48 17.877 22.610 -14.581 1.00 0.00 C ATOM 716 C ALA A 48 17.742 21.259 -15.273 1.00 0.00 C ATOM 717 O ALA A 48 17.077 21.165 -16.297 1.00 0.00 O ATOM 718 CB ALA A 48 19.216 23.265 -14.928 1.00 0.00 C ATOM 0 H ALA A 48 18.583 22.792 -12.641 1.00 0.00 H new ATOM 0 HA ALA A 48 17.066 23.242 -14.942 1.00 0.00 H new ATOM 0 HB1 ALA A 48 19.306 23.357 -16.010 1.00 0.00 H new ATOM 0 HB2 ALA A 48 19.265 24.255 -14.474 1.00 0.00 H new ATOM 0 HB3 ALA A 48 20.031 22.650 -14.547 1.00 0.00 H new ATOM 724 N MET A 49 18.334 20.211 -14.701 1.00 0.00 N ATOM 725 CA MET A 49 18.227 18.851 -15.240 1.00 0.00 C ATOM 726 C MET A 49 16.774 18.385 -15.300 1.00 0.00 C ATOM 727 O MET A 49 16.277 17.859 -16.304 1.00 0.00 O ATOM 728 CB MET A 49 19.031 17.894 -14.352 1.00 0.00 C ATOM 729 CG MET A 49 20.524 18.118 -14.519 1.00 0.00 C ATOM 730 SD MET A 49 21.108 17.815 -16.210 1.00 0.00 S ATOM 731 CE MET A 49 21.885 19.402 -16.650 1.00 0.00 C ATOM 0 H MET A 49 18.899 20.278 -13.855 1.00 0.00 H new ATOM 0 HA MET A 49 18.623 18.853 -16.255 1.00 0.00 H new ATOM 0 HB2 MET A 49 18.753 18.041 -13.308 1.00 0.00 H new ATOM 0 HB3 MET A 49 18.784 16.863 -14.606 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.765 19.143 -14.237 1.00 0.00 H new ATOM 0 HG3 MET A 49 21.062 17.464 -13.833 1.00 0.00 H new ATOM 0 HE1 MET A 49 21.244 19.939 -17.349 1.00 0.00 H new ATOM 0 HE2 MET A 49 22.023 20.001 -15.750 1.00 0.00 H new ATOM 0 HE3 MET A 49 22.853 19.217 -17.115 1.00 0.00 H new ATOM 741 N MET A 50 16.081 18.584 -14.190 1.00 0.00 N ATOM 742 CA MET A 50 14.702 18.173 -14.071 1.00 0.00 C ATOM 743 C MET A 50 13.850 19.035 -14.991 1.00 0.00 C ATOM 744 O MET A 50 12.973 18.497 -15.659 1.00 0.00 O ATOM 745 CB MET A 50 14.299 18.203 -12.596 1.00 0.00 C ATOM 746 CG MET A 50 15.161 17.166 -11.853 1.00 0.00 C ATOM 747 SD MET A 50 14.309 16.228 -10.566 1.00 0.00 S ATOM 748 CE MET A 50 13.197 15.255 -11.581 1.00 0.00 C ATOM 0 H MET A 50 16.460 19.032 -13.356 1.00 0.00 H new ATOM 0 HA MET A 50 14.547 17.145 -14.399 1.00 0.00 H new ATOM 0 HB2 MET A 50 14.453 19.198 -12.178 1.00 0.00 H new ATOM 0 HB3 MET A 50 13.240 17.970 -12.484 1.00 0.00 H new ATOM 0 HG2 MET A 50 15.565 16.464 -12.583 1.00 0.00 H new ATOM 0 HG3 MET A 50 16.010 17.680 -11.402 1.00 0.00 H new ATOM 0 HE1 MET A 50 12.189 15.310 -11.171 1.00 0.00 H new ATOM 0 HE2 MET A 50 13.197 15.646 -12.598 1.00 0.00 H new ATOM 0 HE3 MET A 50 13.529 14.217 -11.592 1.00 0.00 H new ATOM 758 N GLU A 51 14.178 20.318 -15.146 1.00 0.00 N ATOM 759 CA GLU A 51 13.541 21.192 -16.120 1.00 0.00 C ATOM 760 C GLU A 51 13.754 20.692 -17.552 1.00 0.00 C ATOM 761 O GLU A 51 12.869 20.887 -18.386 1.00 0.00 O ATOM 762 CB GLU A 51 14.056 22.629 -15.966 1.00 0.00 C ATOM 763 CG GLU A 51 13.381 23.381 -14.809 1.00 0.00 C ATOM 764 CD GLU A 51 13.753 24.875 -14.808 1.00 0.00 C ATOM 765 OE1 GLU A 51 14.954 25.222 -14.736 1.00 0.00 O ATOM 766 OE2 GLU A 51 12.837 25.727 -14.883 1.00 0.00 O ATOM 0 H GLU A 51 14.900 20.780 -14.592 1.00 0.00 H new ATOM 0 HA GLU A 51 12.469 21.181 -15.926 1.00 0.00 H new ATOM 0 HB2 GLU A 51 15.133 22.609 -15.801 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.886 23.173 -16.895 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.299 23.275 -14.888 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.677 22.932 -13.861 1.00 0.00 H new ATOM 773 N GLU A 52 14.869 20.013 -17.844 1.00 0.00 N ATOM 774 CA GLU A 52 15.086 19.417 -19.160 1.00 0.00 C ATOM 775 C GLU A 52 14.067 18.308 -19.418 1.00 0.00 C ATOM 776 O GLU A 52 13.595 18.160 -20.548 1.00 0.00 O ATOM 777 CB GLU A 52 16.508 18.870 -19.384 1.00 0.00 C ATOM 778 CG GLU A 52 17.634 19.865 -19.072 1.00 0.00 C ATOM 779 CD GLU A 52 18.837 19.714 -20.015 1.00 0.00 C ATOM 780 OE1 GLU A 52 19.638 18.764 -19.854 1.00 0.00 O ATOM 781 OE2 GLU A 52 19.013 20.564 -20.916 1.00 0.00 O ATOM 0 H GLU A 52 15.633 19.864 -17.185 1.00 0.00 H new ATOM 0 HA GLU A 52 14.955 20.233 -19.871 1.00 0.00 H new ATOM 0 HB2 GLU A 52 16.643 17.983 -18.765 1.00 0.00 H new ATOM 0 HB3 GLU A 52 16.601 18.551 -20.422 1.00 0.00 H new ATOM 0 HG2 GLU A 52 17.246 20.881 -19.145 1.00 0.00 H new ATOM 0 HG3 GLU A 52 17.964 19.723 -18.043 1.00 0.00 H new ATOM 788 N VAL A 53 13.703 17.547 -18.380 1.00 0.00 N ATOM 789 CA VAL A 53 12.681 16.502 -18.516 1.00 0.00 C ATOM 790 C VAL A 53 11.263 17.102 -18.448 1.00 0.00 C ATOM 791 O VAL A 53 10.332 16.539 -19.027 1.00 0.00 O ATOM 792 CB VAL A 53 12.937 15.387 -17.480 1.00 0.00 C ATOM 793 CG1 VAL A 53 11.914 14.243 -17.533 1.00 0.00 C ATOM 794 CG2 VAL A 53 14.321 14.770 -17.734 1.00 0.00 C ATOM 0 H VAL A 53 14.097 17.633 -17.443 1.00 0.00 H new ATOM 0 HA VAL A 53 12.752 16.040 -19.501 1.00 0.00 H new ATOM 0 HB VAL A 53 12.860 15.863 -16.502 1.00 0.00 H new ATOM 0 HG11 VAL A 53 12.161 13.499 -16.776 1.00 0.00 H new ATOM 0 HG12 VAL A 53 10.916 14.638 -17.342 1.00 0.00 H new ATOM 0 HG13 VAL A 53 11.938 13.779 -18.519 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.507 13.982 -17.005 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.353 14.350 -18.739 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.086 15.541 -17.638 1.00 0.00 H new ATOM 804 N GLY A 54 11.092 18.256 -17.795 1.00 0.00 N ATOM 805 CA GLY A 54 9.805 18.924 -17.609 1.00 0.00 C ATOM 806 C GLY A 54 9.306 18.802 -16.167 1.00 0.00 C ATOM 807 O GLY A 54 8.096 18.787 -15.934 1.00 0.00 O ATOM 0 H GLY A 54 11.868 18.763 -17.370 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.900 19.977 -17.873 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.069 18.491 -18.286 1.00 0.00 H new ATOM 811 N ILE A 55 10.227 18.673 -15.209 1.00 0.00 N ATOM 812 CA ILE A 55 9.970 18.541 -13.775 1.00 0.00 C ATOM 813 C ILE A 55 10.737 19.687 -13.074 1.00 0.00 C ATOM 814 O ILE A 55 11.365 20.515 -13.737 1.00 0.00 O ATOM 815 CB ILE A 55 10.369 17.108 -13.325 1.00 0.00 C ATOM 816 CG1 ILE A 55 9.738 15.987 -14.194 1.00 0.00 C ATOM 817 CG2 ILE A 55 10.004 16.816 -11.853 1.00 0.00 C ATOM 818 CD1 ILE A 55 10.643 14.756 -14.232 1.00 0.00 C ATOM 0 H ILE A 55 11.224 18.657 -15.425 1.00 0.00 H new ATOM 0 HA ILE A 55 8.919 18.644 -13.506 1.00 0.00 H new ATOM 0 HB ILE A 55 11.452 17.095 -13.450 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.762 15.714 -13.792 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.574 16.355 -15.207 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.307 15.801 -11.597 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.520 17.523 -11.203 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.927 16.918 -11.718 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.181 13.983 -14.847 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.609 15.028 -14.657 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.785 14.378 -13.220 1.00 0.00 H new ATOM 830 N ASP A 56 10.688 19.778 -11.745 1.00 0.00 N ATOM 831 CA ASP A 56 11.341 20.816 -10.947 1.00 0.00 C ATOM 832 C ASP A 56 11.774 20.228 -9.599 1.00 0.00 C ATOM 833 O ASP A 56 11.176 19.252 -9.138 1.00 0.00 O ATOM 834 CB ASP A 56 10.352 21.969 -10.707 1.00 0.00 C ATOM 835 CG ASP A 56 10.898 22.963 -9.676 1.00 0.00 C ATOM 836 OD1 ASP A 56 12.013 23.484 -9.898 1.00 0.00 O ATOM 837 OD2 ASP A 56 10.266 23.151 -8.614 1.00 0.00 O ATOM 0 H ASP A 56 10.174 19.107 -11.174 1.00 0.00 H new ATOM 0 HA ASP A 56 12.217 21.188 -11.479 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.157 22.486 -11.647 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.399 21.568 -10.360 1.00 0.00 H new ATOM 842 N ILE A 57 12.775 20.843 -8.957 1.00 0.00 N ATOM 843 CA ILE A 57 13.166 20.548 -7.578 1.00 0.00 C ATOM 844 C ILE A 57 13.250 21.817 -6.709 1.00 0.00 C ATOM 845 O ILE A 57 13.253 21.700 -5.486 1.00 0.00 O ATOM 846 CB ILE A 57 14.462 19.709 -7.476 1.00 0.00 C ATOM 847 CG1 ILE A 57 14.958 19.036 -8.769 1.00 0.00 C ATOM 848 CG2 ILE A 57 14.269 18.645 -6.387 1.00 0.00 C ATOM 849 CD1 ILE A 57 16.256 18.260 -8.537 1.00 0.00 C ATOM 0 H ILE A 57 13.343 21.571 -9.390 1.00 0.00 H new ATOM 0 HA ILE A 57 12.364 19.928 -7.177 1.00 0.00 H new ATOM 0 HB ILE A 57 15.246 20.428 -7.236 1.00 0.00 H new ATOM 0 HG12 ILE A 57 14.191 18.359 -9.145 1.00 0.00 H new ATOM 0 HG13 ILE A 57 15.118 19.794 -9.536 1.00 0.00 H new ATOM 0 HG21 ILE A 57 15.174 18.044 -6.301 1.00 0.00 H new ATOM 0 HG22 ILE A 57 14.066 19.133 -5.434 1.00 0.00 H new ATOM 0 HG23 ILE A 57 13.430 18.002 -6.651 1.00 0.00 H new ATOM 0 HD11 ILE A 57 16.576 17.799 -9.471 1.00 0.00 H new ATOM 0 HD12 ILE A 57 17.030 18.942 -8.186 1.00 0.00 H new ATOM 0 HD13 ILE A 57 16.088 17.485 -7.789 1.00 0.00 H new ATOM 861 N SER A 58 13.261 23.019 -7.296 1.00 0.00 N ATOM 862 CA SER A 58 13.194 24.299 -6.579 1.00 0.00 C ATOM 863 C SER A 58 12.093 24.320 -5.504 1.00 0.00 C ATOM 864 O SER A 58 12.278 24.902 -4.433 1.00 0.00 O ATOM 865 CB SER A 58 12.896 25.452 -7.551 1.00 0.00 C ATOM 866 OG SER A 58 13.485 25.269 -8.813 1.00 0.00 O ATOM 0 H SER A 58 13.318 23.132 -8.308 1.00 0.00 H new ATOM 0 HA SER A 58 14.167 24.421 -6.103 1.00 0.00 H new ATOM 0 HB2 SER A 58 11.817 25.550 -7.670 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.256 26.386 -7.120 1.00 0.00 H new ATOM 0 HG SER A 58 12.814 24.929 -9.441 1.00 0.00 H new ATOM 872 N GLY A 59 10.943 23.702 -5.799 1.00 0.00 N ATOM 873 CA GLY A 59 9.747 23.751 -4.970 1.00 0.00 C ATOM 874 C GLY A 59 9.802 22.837 -3.744 1.00 0.00 C ATOM 875 O GLY A 59 8.875 22.882 -2.932 1.00 0.00 O ATOM 0 H GLY A 59 10.822 23.142 -6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.589 24.777 -4.639 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.885 23.476 -5.577 1.00 0.00 H new ATOM 879 N GLN A 60 10.850 22.020 -3.587 1.00 0.00 N ATOM 880 CA GLN A 60 11.013 21.080 -2.494 1.00 0.00 C ATOM 881 C GLN A 60 12.379 21.241 -1.817 1.00 0.00 C ATOM 882 O GLN A 60 13.269 21.920 -2.335 1.00 0.00 O ATOM 883 CB GLN A 60 10.726 19.662 -3.009 1.00 0.00 C ATOM 884 CG GLN A 60 11.728 19.101 -4.030 1.00 0.00 C ATOM 885 CD GLN A 60 11.342 17.698 -4.492 1.00 0.00 C ATOM 886 OE1 GLN A 60 10.177 17.412 -4.771 1.00 0.00 O ATOM 887 NE2 GLN A 60 12.303 16.799 -4.590 1.00 0.00 N ATOM 0 H GLN A 60 11.629 22.002 -4.245 1.00 0.00 H new ATOM 0 HA GLN A 60 10.291 21.288 -1.704 1.00 0.00 H new ATOM 0 HB2 GLN A 60 10.692 18.986 -2.154 1.00 0.00 H new ATOM 0 HB3 GLN A 60 9.734 19.655 -3.461 1.00 0.00 H new ATOM 0 HG2 GLN A 60 11.779 19.766 -4.892 1.00 0.00 H new ATOM 0 HG3 GLN A 60 12.723 19.077 -3.587 1.00 0.00 H new ATOM 0 HE21 GLN A 60 13.263 17.051 -4.355 1.00 0.00 H new ATOM 0 HE22 GLN A 60 12.086 15.852 -4.900 1.00 0.00 H new ATOM 896 N THR A 61 12.537 20.625 -0.647 1.00 0.00 N ATOM 897 CA THR A 61 13.669 20.831 0.248 1.00 0.00 C ATOM 898 C THR A 61 14.347 19.507 0.612 1.00 0.00 C ATOM 899 O THR A 61 13.811 18.418 0.370 1.00 0.00 O ATOM 900 CB THR A 61 13.157 21.577 1.498 1.00 0.00 C ATOM 901 OG1 THR A 61 11.972 20.974 1.998 1.00 0.00 O ATOM 902 CG2 THR A 61 12.831 23.031 1.150 1.00 0.00 C ATOM 0 H THR A 61 11.861 19.951 -0.288 1.00 0.00 H new ATOM 0 HA THR A 61 14.432 21.430 -0.249 1.00 0.00 H new ATOM 0 HB THR A 61 13.943 21.531 2.251 1.00 0.00 H new ATOM 0 HG1 THR A 61 11.666 21.462 2.791 1.00 0.00 H new ATOM 0 HG21 THR A 61 12.471 23.546 2.040 1.00 0.00 H new ATOM 0 HG22 THR A 61 13.729 23.527 0.782 1.00 0.00 H new ATOM 0 HG23 THR A 61 12.061 23.057 0.379 1.00 0.00 H new ATOM 910 N SER A 62 15.548 19.611 1.183 1.00 0.00 N ATOM 911 CA SER A 62 16.313 18.482 1.689 1.00 0.00 C ATOM 912 C SER A 62 15.837 18.070 3.087 1.00 0.00 C ATOM 913 O SER A 62 15.180 18.854 3.779 1.00 0.00 O ATOM 914 CB SER A 62 17.793 18.867 1.715 1.00 0.00 C ATOM 915 OG SER A 62 18.215 19.370 0.463 1.00 0.00 O ATOM 0 H SER A 62 16.022 20.505 1.307 1.00 0.00 H new ATOM 0 HA SER A 62 16.165 17.624 1.033 1.00 0.00 H new ATOM 0 HB2 SER A 62 17.962 19.618 2.487 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.393 17.996 1.980 1.00 0.00 H new ATOM 0 HG SER A 62 19.192 19.452 0.456 1.00 0.00 H new ATOM 921 N ASP A 63 16.193 16.855 3.519 1.00 0.00 N ATOM 922 CA ASP A 63 15.819 16.322 4.834 1.00 0.00 C ATOM 923 C ASP A 63 16.853 15.281 5.292 1.00 0.00 C ATOM 924 O ASP A 63 17.394 14.573 4.437 1.00 0.00 O ATOM 925 CB ASP A 63 14.419 15.688 4.744 1.00 0.00 C ATOM 926 CG ASP A 63 13.648 15.833 6.062 1.00 0.00 C ATOM 927 OD1 ASP A 63 13.324 16.976 6.456 1.00 0.00 O ATOM 928 OD2 ASP A 63 13.329 14.804 6.688 1.00 0.00 O ATOM 0 H ASP A 63 16.753 16.209 2.962 1.00 0.00 H new ATOM 0 HA ASP A 63 15.799 17.130 5.565 1.00 0.00 H new ATOM 0 HB2 ASP A 63 13.856 16.160 3.939 1.00 0.00 H new ATOM 0 HB3 ASP A 63 14.513 14.632 4.491 1.00 0.00 H new ATOM 933 N PRO A 64 17.189 15.177 6.592 1.00 0.00 N ATOM 934 CA PRO A 64 18.189 14.227 7.068 1.00 0.00 C ATOM 935 C PRO A 64 17.587 12.827 7.241 1.00 0.00 C ATOM 936 O PRO A 64 16.402 12.673 7.545 1.00 0.00 O ATOM 937 CB PRO A 64 18.662 14.794 8.410 1.00 0.00 C ATOM 938 CG PRO A 64 17.419 15.498 8.952 1.00 0.00 C ATOM 939 CD PRO A 64 16.718 16.011 7.692 1.00 0.00 C ATOM 0 HA PRO A 64 19.010 14.111 6.360 1.00 0.00 H new ATOM 0 HB2 PRO A 64 19.003 14.006 9.082 1.00 0.00 H new ATOM 0 HB3 PRO A 64 19.494 15.487 8.283 1.00 0.00 H new ATOM 0 HG2 PRO A 64 16.783 14.814 9.514 1.00 0.00 H new ATOM 0 HG3 PRO A 64 17.682 16.314 9.625 1.00 0.00 H new ATOM 0 HD2 PRO A 64 15.635 15.943 7.795 1.00 0.00 H new ATOM 0 HD3 PRO A 64 16.956 17.060 7.514 1.00 0.00 H new ATOM 947 N ILE A 65 18.429 11.795 7.116 1.00 0.00 N ATOM 948 CA ILE A 65 18.044 10.401 7.357 1.00 0.00 C ATOM 949 C ILE A 65 17.458 10.222 8.766 1.00 0.00 C ATOM 950 O ILE A 65 16.529 9.441 8.972 1.00 0.00 O ATOM 951 CB ILE A 65 19.243 9.477 7.079 1.00 0.00 C ATOM 952 CG1 ILE A 65 18.746 8.020 7.057 1.00 0.00 C ATOM 953 CG2 ILE A 65 20.430 9.675 8.045 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.810 7.071 6.520 1.00 0.00 C ATOM 0 H ILE A 65 19.405 11.906 6.842 1.00 0.00 H new ATOM 0 HA ILE A 65 17.248 10.119 6.668 1.00 0.00 H new ATOM 0 HB ILE A 65 19.652 9.745 6.105 1.00 0.00 H new ATOM 0 HG12 ILE A 65 18.463 7.717 8.065 1.00 0.00 H new ATOM 0 HG13 ILE A 65 17.851 7.950 6.440 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.233 8.987 7.781 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.792 10.700 7.971 1.00 0.00 H new ATOM 0 HG23 ILE A 65 20.105 9.478 9.066 1.00 0.00 H new ATOM 0 HD11 ILE A 65 19.422 6.052 6.520 1.00 0.00 H new ATOM 0 HD12 ILE A 65 20.074 7.359 5.502 1.00 0.00 H new ATOM 0 HD13 ILE A 65 20.696 7.122 7.153 1.00 0.00 H new ATOM 966 N GLU A 66 17.982 10.998 9.720 1.00 0.00 N ATOM 967 CA GLU A 66 17.663 10.948 11.140 1.00 0.00 C ATOM 968 C GLU A 66 16.167 11.170 11.412 1.00 0.00 C ATOM 969 O GLU A 66 15.663 10.767 12.462 1.00 0.00 O ATOM 970 CB GLU A 66 18.491 12.017 11.882 1.00 0.00 C ATOM 971 CG GLU A 66 19.994 12.023 11.543 1.00 0.00 C ATOM 972 CD GLU A 66 20.789 12.871 12.553 1.00 0.00 C ATOM 973 OE1 GLU A 66 20.793 14.118 12.443 1.00 0.00 O ATOM 974 OE2 GLU A 66 21.425 12.298 13.467 1.00 0.00 O ATOM 0 H GLU A 66 18.676 11.714 9.505 1.00 0.00 H new ATOM 0 HA GLU A 66 17.912 9.951 11.503 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.078 12.999 11.653 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.376 11.865 12.955 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.374 11.001 11.543 1.00 0.00 H new ATOM 0 HG3 GLU A 66 20.141 12.417 10.538 1.00 0.00 H new ATOM 981 N ASN A 67 15.457 11.821 10.483 1.00 0.00 N ATOM 982 CA ASN A 67 14.049 12.171 10.630 1.00 0.00 C ATOM 983 C ASN A 67 13.106 10.997 10.313 1.00 0.00 C ATOM 984 O ASN A 67 11.897 11.125 10.511 1.00 0.00 O ATOM 985 CB ASN A 67 13.751 13.378 9.730 1.00 0.00 C ATOM 986 CG ASN A 67 12.379 14.001 9.983 1.00 0.00 C ATOM 987 OD1 ASN A 67 11.884 14.060 11.107 1.00 0.00 O ATOM 988 ND2 ASN A 67 11.760 14.527 8.945 1.00 0.00 N ATOM 0 H ASN A 67 15.857 12.122 9.594 1.00 0.00 H new ATOM 0 HA ASN A 67 13.864 12.424 11.674 1.00 0.00 H new ATOM 0 HB2 ASN A 67 14.520 14.135 9.885 1.00 0.00 H new ATOM 0 HB3 ASN A 67 13.814 13.068 8.687 1.00 0.00 H new ATOM 0 HD21 ASN A 67 10.860 14.990 9.069 1.00 0.00 H new ATOM 0 HD22 ASN A 67 12.181 14.471 8.018 1.00 0.00 H new ATOM 995 N PHE A 68 13.614 9.850 9.839 1.00 0.00 N ATOM 996 CA PHE A 68 12.805 8.719 9.410 1.00 0.00 C ATOM 997 C PHE A 68 13.217 7.423 10.118 1.00 0.00 C ATOM 998 O PHE A 68 14.159 7.381 10.911 1.00 0.00 O ATOM 999 CB PHE A 68 12.970 8.561 7.896 1.00 0.00 C ATOM 1000 CG PHE A 68 12.499 9.730 7.067 1.00 0.00 C ATOM 1001 CD1 PHE A 68 11.134 9.846 6.752 1.00 0.00 C ATOM 1002 CD2 PHE A 68 13.418 10.687 6.597 1.00 0.00 C ATOM 1003 CE1 PHE A 68 10.679 10.945 6.001 1.00 0.00 C ATOM 1004 CE2 PHE A 68 12.966 11.769 5.826 1.00 0.00 C ATOM 1005 CZ PHE A 68 11.596 11.909 5.543 1.00 0.00 C ATOM 0 H PHE A 68 14.617 9.688 9.745 1.00 0.00 H new ATOM 0 HA PHE A 68 11.764 8.910 9.669 1.00 0.00 H new ATOM 0 HB2 PHE A 68 14.024 8.385 7.679 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.426 7.671 7.580 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.436 9.093 7.086 1.00 0.00 H new ATOM 0 HD2 PHE A 68 14.468 10.589 6.829 1.00 0.00 H new ATOM 0 HE1 PHE A 68 9.628 11.049 5.776 1.00 0.00 H new ATOM 0 HE2 PHE A 68 13.671 12.495 5.450 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.247 12.758 4.973 1.00 0.00 H new ATOM 1015 N ASN A 69 12.509 6.351 9.762 1.00 0.00 N ATOM 1016 CA ASN A 69 12.779 4.959 10.093 1.00 0.00 C ATOM 1017 C ASN A 69 12.717 4.171 8.789 1.00 0.00 C ATOM 1018 O ASN A 69 11.827 4.404 7.969 1.00 0.00 O ATOM 1019 CB ASN A 69 11.762 4.396 11.110 1.00 0.00 C ATOM 1020 CG ASN A 69 10.303 4.846 10.956 1.00 0.00 C ATOM 1021 OD1 ASN A 69 9.626 5.093 11.949 1.00 0.00 O ATOM 1022 ND2 ASN A 69 9.775 4.983 9.748 1.00 0.00 N ATOM 0 H ASN A 69 11.669 6.445 9.191 1.00 0.00 H new ATOM 0 HA ASN A 69 13.759 4.876 10.563 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.789 3.308 11.050 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.097 4.669 12.111 1.00 0.00 H new ATOM 0 HD21 ASN A 69 8.809 5.293 9.646 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.335 4.779 8.920 1.00 0.00 H new ATOM 1029 N ALA A 70 13.632 3.225 8.613 1.00 0.00 N ATOM 1030 CA ALA A 70 13.745 2.409 7.413 1.00 0.00 C ATOM 1031 C ALA A 70 12.591 1.419 7.277 1.00 0.00 C ATOM 1032 O ALA A 70 12.305 0.970 6.172 1.00 0.00 O ATOM 1033 CB ALA A 70 15.063 1.640 7.452 1.00 0.00 C ATOM 0 H ALA A 70 14.333 3.000 9.319 1.00 0.00 H new ATOM 0 HA ALA A 70 13.711 3.078 6.553 1.00 0.00 H new ATOM 0 HB1 ALA A 70 15.153 1.027 6.555 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.894 2.344 7.495 1.00 0.00 H new ATOM 0 HB3 ALA A 70 15.084 0.999 8.333 1.00 0.00 H new ATOM 1039 N ASP A 71 11.926 1.080 8.384 1.00 0.00 N ATOM 1040 CA ASP A 71 10.856 0.083 8.430 1.00 0.00 C ATOM 1041 C ASP A 71 9.655 0.470 7.558 1.00 0.00 C ATOM 1042 O ASP A 71 8.886 -0.395 7.139 1.00 0.00 O ATOM 1043 CB ASP A 71 10.407 -0.105 9.885 1.00 0.00 C ATOM 1044 CG ASP A 71 9.287 -1.152 10.010 1.00 0.00 C ATOM 1045 OD1 ASP A 71 9.556 -2.359 9.814 1.00 0.00 O ATOM 1046 OD2 ASP A 71 8.142 -0.783 10.358 1.00 0.00 O ATOM 0 H ASP A 71 12.121 1.501 9.292 1.00 0.00 H new ATOM 0 HA ASP A 71 11.252 -0.850 8.029 1.00 0.00 H new ATOM 0 HB2 ASP A 71 11.260 -0.412 10.491 1.00 0.00 H new ATOM 0 HB3 ASP A 71 10.059 0.848 10.283 1.00 0.00 H new ATOM 1051 N ASP A 72 9.496 1.765 7.260 1.00 0.00 N ATOM 1052 CA ASP A 72 8.395 2.283 6.472 1.00 0.00 C ATOM 1053 C ASP A 72 8.697 2.152 4.980 1.00 0.00 C ATOM 1054 O ASP A 72 7.783 2.228 4.165 1.00 0.00 O ATOM 1055 CB ASP A 72 8.142 3.746 6.856 1.00 0.00 C ATOM 1056 CG ASP A 72 6.873 4.317 6.206 1.00 0.00 C ATOM 1057 OD1 ASP A 72 5.790 3.699 6.316 1.00 0.00 O ATOM 1058 OD2 ASP A 72 6.925 5.438 5.653 1.00 0.00 O ATOM 0 H ASP A 72 10.146 2.487 7.570 1.00 0.00 H new ATOM 0 HA ASP A 72 7.496 1.703 6.679 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.057 3.824 7.940 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.000 4.349 6.560 1.00 0.00 H new ATOM 1063 N TYR A 73 9.962 1.924 4.611 1.00 0.00 N ATOM 1064 CA TYR A 73 10.443 1.921 3.252 1.00 0.00 C ATOM 1065 C TYR A 73 10.655 0.482 2.790 1.00 0.00 C ATOM 1066 O TYR A 73 11.272 -0.323 3.487 1.00 0.00 O ATOM 1067 CB TYR A 73 11.697 2.801 3.163 1.00 0.00 C ATOM 1068 CG TYR A 73 11.395 4.265 3.454 1.00 0.00 C ATOM 1069 CD1 TYR A 73 10.817 5.059 2.448 1.00 0.00 C ATOM 1070 CD2 TYR A 73 11.635 4.820 4.729 1.00 0.00 C ATOM 1071 CE1 TYR A 73 10.468 6.391 2.714 1.00 0.00 C ATOM 1072 CE2 TYR A 73 11.308 6.164 5.009 1.00 0.00 C ATOM 1073 CZ TYR A 73 10.706 6.947 3.991 1.00 0.00 C ATOM 1074 OH TYR A 73 10.377 8.250 4.198 1.00 0.00 O ATOM 0 H TYR A 73 10.698 1.730 5.290 1.00 0.00 H new ATOM 0 HA TYR A 73 9.712 2.353 2.568 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.444 2.439 3.869 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.131 2.712 2.167 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.641 4.642 1.467 1.00 0.00 H new ATOM 0 HD2 TYR A 73 12.075 4.207 5.502 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.016 6.994 1.940 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.512 6.589 5.981 1.00 0.00 H new ATOM 0 HH TYR A 73 10.719 8.539 5.070 1.00 0.00 H new ATOM 1084 N ASP A 74 10.115 0.138 1.620 1.00 0.00 N ATOM 1085 CA ASP A 74 10.321 -1.171 1.011 1.00 0.00 C ATOM 1086 C ASP A 74 11.685 -1.254 0.331 1.00 0.00 C ATOM 1087 O ASP A 74 12.336 -2.299 0.370 1.00 0.00 O ATOM 1088 CB ASP A 74 9.257 -1.430 -0.050 1.00 0.00 C ATOM 1089 CG ASP A 74 9.481 -2.812 -0.673 1.00 0.00 C ATOM 1090 OD1 ASP A 74 9.076 -3.807 -0.032 1.00 0.00 O ATOM 1091 OD2 ASP A 74 9.951 -2.887 -1.827 1.00 0.00 O ATOM 0 H ASP A 74 9.523 0.761 1.070 1.00 0.00 H new ATOM 0 HA ASP A 74 10.261 -1.912 1.808 1.00 0.00 H new ATOM 0 HB2 ASP A 74 8.264 -1.377 0.396 1.00 0.00 H new ATOM 0 HB3 ASP A 74 9.302 -0.660 -0.821 1.00 0.00 H new ATOM 1096 N VAL A 75 12.123 -0.149 -0.278 1.00 0.00 N ATOM 1097 CA VAL A 75 13.309 -0.135 -1.122 1.00 0.00 C ATOM 1098 C VAL A 75 14.183 1.052 -0.759 1.00 0.00 C ATOM 1099 O VAL A 75 13.695 2.174 -0.622 1.00 0.00 O ATOM 1100 CB VAL A 75 12.913 -0.228 -2.613 1.00 0.00 C ATOM 1101 CG1 VAL A 75 11.714 0.589 -3.100 1.00 0.00 C ATOM 1102 CG2 VAL A 75 14.098 0.034 -3.558 1.00 0.00 C ATOM 0 H VAL A 75 11.662 0.757 -0.197 1.00 0.00 H new ATOM 0 HA VAL A 75 13.923 -1.017 -0.941 1.00 0.00 H new ATOM 0 HB VAL A 75 12.583 -1.266 -2.657 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.565 0.416 -4.166 1.00 0.00 H new ATOM 0 HG12 VAL A 75 10.821 0.285 -2.555 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.901 1.649 -2.927 1.00 0.00 H new ATOM 0 HG21 VAL A 75 13.763 -0.044 -4.592 1.00 0.00 H new ATOM 0 HG22 VAL A 75 14.492 1.034 -3.379 1.00 0.00 H new ATOM 0 HG23 VAL A 75 14.880 -0.702 -3.374 1.00 0.00 H new ATOM 1112 N VAL A 76 15.480 0.791 -0.605 1.00 0.00 N ATOM 1113 CA VAL A 76 16.444 1.759 -0.121 1.00 0.00 C ATOM 1114 C VAL A 76 17.588 1.868 -1.126 1.00 0.00 C ATOM 1115 O VAL A 76 18.412 0.968 -1.310 1.00 0.00 O ATOM 1116 CB VAL A 76 16.890 1.395 1.304 1.00 0.00 C ATOM 1117 CG1 VAL A 76 15.859 1.905 2.317 1.00 0.00 C ATOM 1118 CG2 VAL A 76 17.105 -0.106 1.530 1.00 0.00 C ATOM 0 H VAL A 76 15.891 -0.118 -0.819 1.00 0.00 H new ATOM 0 HA VAL A 76 15.998 2.751 -0.044 1.00 0.00 H new ATOM 0 HB VAL A 76 17.858 1.877 1.444 1.00 0.00 H new ATOM 0 HG11 VAL A 76 16.180 1.644 3.326 1.00 0.00 H new ATOM 0 HG12 VAL A 76 15.771 2.988 2.233 1.00 0.00 H new ATOM 0 HG13 VAL A 76 14.892 1.446 2.114 1.00 0.00 H new ATOM 0 HG21 VAL A 76 17.418 -0.278 2.560 1.00 0.00 H new ATOM 0 HG22 VAL A 76 16.174 -0.640 1.340 1.00 0.00 H new ATOM 0 HG23 VAL A 76 17.876 -0.469 0.851 1.00 0.00 H new ATOM 1128 N ILE A 77 17.601 2.997 -1.818 1.00 0.00 N ATOM 1129 CA ILE A 77 18.558 3.307 -2.849 1.00 0.00 C ATOM 1130 C ILE A 77 19.557 4.272 -2.256 1.00 0.00 C ATOM 1131 O ILE A 77 19.298 5.470 -2.156 1.00 0.00 O ATOM 1132 CB ILE A 77 17.832 3.886 -4.076 1.00 0.00 C ATOM 1133 CG1 ILE A 77 16.862 2.871 -4.713 1.00 0.00 C ATOM 1134 CG2 ILE A 77 18.841 4.390 -5.113 1.00 0.00 C ATOM 1135 CD1 ILE A 77 17.466 1.493 -5.013 1.00 0.00 C ATOM 0 H ILE A 77 16.920 3.741 -1.666 1.00 0.00 H new ATOM 0 HA ILE A 77 19.086 2.418 -3.195 1.00 0.00 H new ATOM 0 HB ILE A 77 17.234 4.728 -3.727 1.00 0.00 H new ATOM 0 HG12 ILE A 77 16.009 2.739 -4.047 1.00 0.00 H new ATOM 0 HG13 ILE A 77 16.478 3.292 -5.642 1.00 0.00 H new ATOM 0 HG21 ILE A 77 18.307 4.795 -5.973 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.460 5.170 -4.669 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.474 3.564 -5.436 1.00 0.00 H new ATOM 0 HD11 ILE A 77 16.706 0.852 -5.459 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.299 1.604 -5.707 1.00 0.00 H new ATOM 0 HD13 ILE A 77 17.823 1.043 -4.087 1.00 0.00 H new ATOM 1147 N SER A 78 20.680 3.749 -1.800 1.00 0.00 N ATOM 1148 CA SER A 78 21.766 4.637 -1.470 1.00 0.00 C ATOM 1149 C SER A 78 22.355 5.138 -2.794 1.00 0.00 C ATOM 1150 O SER A 78 22.169 4.528 -3.854 1.00 0.00 O ATOM 1151 CB SER A 78 22.810 3.950 -0.611 1.00 0.00 C ATOM 1152 OG SER A 78 22.295 3.796 0.687 1.00 0.00 O ATOM 0 H SER A 78 20.857 2.755 -1.656 1.00 0.00 H new ATOM 0 HA SER A 78 21.405 5.476 -0.875 1.00 0.00 H new ATOM 0 HB2 SER A 78 23.067 2.979 -1.033 1.00 0.00 H new ATOM 0 HB3 SER A 78 23.727 4.539 -0.586 1.00 0.00 H new ATOM 0 HG SER A 78 21.403 3.393 0.639 1.00 0.00 H new ATOM 1158 N LEU A 79 23.035 6.279 -2.755 1.00 0.00 N ATOM 1159 CA LEU A 79 23.758 6.835 -3.895 1.00 0.00 C ATOM 1160 C LEU A 79 25.061 7.466 -3.388 1.00 0.00 C ATOM 1161 O LEU A 79 25.572 8.419 -3.972 1.00 0.00 O ATOM 1162 CB LEU A 79 22.889 7.788 -4.767 1.00 0.00 C ATOM 1163 CG LEU A 79 21.359 7.830 -4.527 1.00 0.00 C ATOM 1164 CD1 LEU A 79 21.059 8.902 -3.488 1.00 0.00 C ATOM 1165 CD2 LEU A 79 20.581 8.152 -5.806 1.00 0.00 C ATOM 0 H LEU A 79 23.101 6.854 -1.915 1.00 0.00 H new ATOM 0 HA LEU A 79 24.013 6.031 -4.585 1.00 0.00 H new ATOM 0 HB2 LEU A 79 23.272 8.800 -4.633 1.00 0.00 H new ATOM 0 HB3 LEU A 79 23.052 7.521 -5.811 1.00 0.00 H new ATOM 0 HG LEU A 79 21.045 6.844 -4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 79 19.985 8.944 -3.308 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.574 8.661 -2.558 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.404 9.869 -3.853 1.00 0.00 H new ATOM 0 HD21 LEU A 79 19.513 8.170 -5.588 1.00 0.00 H new ATOM 0 HD22 LEU A 79 20.891 9.126 -6.185 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.784 7.389 -6.557 1.00 0.00 H new ATOM 1177 N CYS A 80 25.579 6.977 -2.256 1.00 0.00 N ATOM 1178 CA CYS A 80 26.701 7.546 -1.520 1.00 0.00 C ATOM 1179 C CYS A 80 27.958 7.643 -2.388 1.00 0.00 C ATOM 1180 O CYS A 80 28.713 8.604 -2.241 1.00 0.00 O ATOM 1181 CB CYS A 80 26.929 6.722 -0.250 1.00 0.00 C ATOM 1182 SG CYS A 80 25.465 6.858 0.819 1.00 0.00 S ATOM 0 H CYS A 80 25.208 6.137 -1.813 1.00 0.00 H new ATOM 0 HA CYS A 80 26.464 8.570 -1.233 1.00 0.00 H new ATOM 0 HB2 CYS A 80 27.111 5.678 -0.507 1.00 0.00 H new ATOM 0 HB3 CYS A 80 27.814 7.080 0.277 1.00 0.00 H new ATOM 0 HG CYS A 80 25.650 6.159 1.899 1.00 0.00 H new ATOM 1188 N GLY A 81 28.158 6.698 -3.308 1.00 0.00 N ATOM 1189 CA GLY A 81 29.167 6.774 -4.358 1.00 0.00 C ATOM 1190 C GLY A 81 30.112 5.585 -4.327 1.00 0.00 C ATOM 1191 O GLY A 81 30.091 4.753 -5.233 1.00 0.00 O ATOM 0 H GLY A 81 27.608 5.839 -3.342 1.00 0.00 H new ATOM 0 HA2 GLY A 81 28.676 6.821 -5.330 1.00 0.00 H new ATOM 0 HA3 GLY A 81 29.739 7.695 -4.245 1.00 0.00 H new ATOM 1195 N CYS A 82 30.928 5.469 -3.277 1.00 0.00 N ATOM 1196 CA CYS A 82 32.029 4.501 -3.221 1.00 0.00 C ATOM 1197 C CYS A 82 31.564 3.104 -2.769 1.00 0.00 C ATOM 1198 O CYS A 82 32.290 2.399 -2.065 1.00 0.00 O ATOM 1199 CB CYS A 82 33.173 5.059 -2.355 1.00 0.00 C ATOM 1200 SG CYS A 82 33.797 6.624 -3.043 1.00 0.00 S ATOM 0 H CYS A 82 30.845 6.044 -2.439 1.00 0.00 H new ATOM 0 HA CYS A 82 32.411 4.359 -4.232 1.00 0.00 H new ATOM 0 HB2 CYS A 82 32.820 5.219 -1.336 1.00 0.00 H new ATOM 0 HB3 CYS A 82 33.983 4.331 -2.301 1.00 0.00 H new ATOM 0 HG CYS A 82 34.759 7.075 -2.294 1.00 0.00 H new ATOM 1206 N GLY A 83 30.339 2.719 -3.131 1.00 0.00 N ATOM 1207 CA GLY A 83 29.713 1.467 -2.719 1.00 0.00 C ATOM 1208 C GLY A 83 29.438 1.424 -1.215 1.00 0.00 C ATOM 1209 O GLY A 83 29.398 0.343 -0.626 1.00 0.00 O ATOM 0 H GLY A 83 29.742 3.285 -3.734 1.00 0.00 H new ATOM 0 HA2 GLY A 83 28.777 1.336 -3.261 1.00 0.00 H new ATOM 0 HA3 GLY A 83 30.359 0.633 -2.992 1.00 0.00 H new ATOM 1213 N VAL A 84 29.305 2.591 -0.580 1.00 0.00 N ATOM 1214 CA VAL A 84 29.107 2.727 0.852 1.00 0.00 C ATOM 1215 C VAL A 84 27.675 2.328 1.185 1.00 0.00 C ATOM 1216 O VAL A 84 26.728 3.072 0.918 1.00 0.00 O ATOM 1217 CB VAL A 84 29.461 4.141 1.334 1.00 0.00 C ATOM 1218 CG1 VAL A 84 29.212 4.313 2.840 1.00 0.00 C ATOM 1219 CG2 VAL A 84 30.925 4.490 1.027 1.00 0.00 C ATOM 0 H VAL A 84 29.334 3.487 -1.067 1.00 0.00 H new ATOM 0 HA VAL A 84 29.783 2.060 1.387 1.00 0.00 H new ATOM 0 HB VAL A 84 28.806 4.821 0.789 1.00 0.00 H new ATOM 0 HG11 VAL A 84 29.476 5.328 3.139 1.00 0.00 H new ATOM 0 HG12 VAL A 84 28.159 4.132 3.058 1.00 0.00 H new ATOM 0 HG13 VAL A 84 29.824 3.601 3.394 1.00 0.00 H new ATOM 0 HG21 VAL A 84 31.141 5.498 1.382 1.00 0.00 H new ATOM 0 HG22 VAL A 84 31.581 3.780 1.530 1.00 0.00 H new ATOM 0 HG23 VAL A 84 31.093 4.440 -0.049 1.00 0.00 H new ATOM 1229 N ASN A 85 27.521 1.132 1.749 1.00 0.00 N ATOM 1230 CA ASN A 85 26.260 0.723 2.331 1.00 0.00 C ATOM 1231 C ASN A 85 26.100 1.427 3.670 1.00 0.00 C ATOM 1232 O ASN A 85 27.065 1.844 4.312 1.00 0.00 O ATOM 1233 CB ASN A 85 26.153 -0.806 2.445 1.00 0.00 C ATOM 1234 CG ASN A 85 26.987 -1.364 3.592 1.00 0.00 C ATOM 1235 OD1 ASN A 85 28.090 -1.862 3.391 1.00 0.00 O ATOM 1236 ND2 ASN A 85 26.489 -1.274 4.811 1.00 0.00 N ATOM 0 H ASN A 85 28.261 0.432 1.812 1.00 0.00 H new ATOM 0 HA ASN A 85 25.438 1.018 1.679 1.00 0.00 H new ATOM 0 HB2 ASN A 85 25.109 -1.084 2.590 1.00 0.00 H new ATOM 0 HB3 ASN A 85 26.477 -1.261 1.509 1.00 0.00 H new ATOM 0 HD21 ASN A 85 27.023 -1.622 5.607 1.00 0.00 H new ATOM 0 HD22 ASN A 85 25.570 -0.856 4.957 1.00 0.00 H new ATOM 1243 N LEU A 86 24.844 1.536 4.077 1.00 0.00 N ATOM 1244 CA LEU A 86 24.419 2.211 5.292 1.00 0.00 C ATOM 1245 C LEU A 86 24.713 1.273 6.461 1.00 0.00 C ATOM 1246 O LEU A 86 24.272 0.125 6.412 1.00 0.00 O ATOM 1247 CB LEU A 86 22.926 2.567 5.140 1.00 0.00 C ATOM 1248 CG LEU A 86 22.636 3.399 3.867 1.00 0.00 C ATOM 1249 CD1 LEU A 86 21.164 3.784 3.805 1.00 0.00 C ATOM 1250 CD2 LEU A 86 23.525 4.644 3.748 1.00 0.00 C ATOM 0 H LEU A 86 24.065 1.142 3.550 1.00 0.00 H new ATOM 0 HA LEU A 86 24.951 3.144 5.478 1.00 0.00 H new ATOM 0 HB2 LEU A 86 22.339 1.649 5.110 1.00 0.00 H new ATOM 0 HB3 LEU A 86 22.599 3.126 6.017 1.00 0.00 H new ATOM 0 HG LEU A 86 22.878 2.762 3.016 1.00 0.00 H new ATOM 0 HD11 LEU A 86 20.978 4.368 2.904 1.00 0.00 H new ATOM 0 HD12 LEU A 86 20.553 2.882 3.785 1.00 0.00 H new ATOM 0 HD13 LEU A 86 20.906 4.378 4.682 1.00 0.00 H new ATOM 0 HD21 LEU A 86 23.274 5.185 2.836 1.00 0.00 H new ATOM 0 HD22 LEU A 86 23.362 5.291 4.610 1.00 0.00 H new ATOM 0 HD23 LEU A 86 24.572 4.342 3.714 1.00 0.00 H new ATOM 1262 N PRO A 87 25.496 1.693 7.473 1.00 0.00 N ATOM 1263 CA PRO A 87 25.626 0.943 8.712 1.00 0.00 C ATOM 1264 C PRO A 87 24.276 0.647 9.401 1.00 0.00 C ATOM 1265 O PRO A 87 24.143 -0.464 9.925 1.00 0.00 O ATOM 1266 CB PRO A 87 26.547 1.770 9.618 1.00 0.00 C ATOM 1267 CG PRO A 87 27.342 2.631 8.639 1.00 0.00 C ATOM 1268 CD PRO A 87 26.349 2.876 7.507 1.00 0.00 C ATOM 0 HA PRO A 87 26.041 -0.043 8.501 1.00 0.00 H new ATOM 0 HB2 PRO A 87 25.977 2.382 10.317 1.00 0.00 H new ATOM 0 HB3 PRO A 87 27.201 1.132 10.213 1.00 0.00 H new ATOM 0 HG2 PRO A 87 27.669 3.564 9.097 1.00 0.00 H new ATOM 0 HG3 PRO A 87 28.237 2.118 8.286 1.00 0.00 H new ATOM 0 HD2 PRO A 87 25.763 3.777 7.687 1.00 0.00 H new ATOM 0 HD3 PRO A 87 26.864 3.016 6.557 1.00 0.00 H new ATOM 1276 N PRO A 88 23.291 1.577 9.460 1.00 0.00 N ATOM 1277 CA PRO A 88 22.057 1.332 10.207 1.00 0.00 C ATOM 1278 C PRO A 88 21.073 0.411 9.466 1.00 0.00 C ATOM 1279 O PRO A 88 21.336 -0.065 8.364 1.00 0.00 O ATOM 1280 CB PRO A 88 21.477 2.727 10.482 1.00 0.00 C ATOM 1281 CG PRO A 88 21.934 3.533 9.271 1.00 0.00 C ATOM 1282 CD PRO A 88 23.321 2.980 9.022 1.00 0.00 C ATOM 0 HA PRO A 88 22.255 0.790 11.132 1.00 0.00 H new ATOM 0 HB2 PRO A 88 20.390 2.703 10.564 1.00 0.00 H new ATOM 0 HB3 PRO A 88 21.858 3.146 11.413 1.00 0.00 H new ATOM 0 HG2 PRO A 88 21.277 3.386 8.413 1.00 0.00 H new ATOM 0 HG3 PRO A 88 21.954 4.603 9.478 1.00 0.00 H new ATOM 0 HD2 PRO A 88 23.585 3.052 7.967 1.00 0.00 H new ATOM 0 HD3 PRO A 88 24.070 3.545 9.577 1.00 0.00 H new ATOM 1290 N GLU A 89 19.902 0.215 10.083 1.00 0.00 N ATOM 1291 CA GLU A 89 18.760 -0.612 9.680 1.00 0.00 C ATOM 1292 C GLU A 89 18.349 -0.472 8.216 1.00 0.00 C ATOM 1293 O GLU A 89 17.769 -1.399 7.657 1.00 0.00 O ATOM 1294 CB GLU A 89 17.559 -0.278 10.587 1.00 0.00 C ATOM 1295 CG GLU A 89 17.193 1.221 10.636 1.00 0.00 C ATOM 1296 CD GLU A 89 15.899 1.504 11.423 1.00 0.00 C ATOM 1297 OE1 GLU A 89 15.799 1.112 12.609 1.00 0.00 O ATOM 1298 OE2 GLU A 89 14.988 2.160 10.868 1.00 0.00 O ATOM 0 H GLU A 89 19.712 0.681 10.970 1.00 0.00 H new ATOM 0 HA GLU A 89 19.080 -1.648 9.793 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.691 -0.840 10.242 1.00 0.00 H new ATOM 0 HB3 GLU A 89 17.778 -0.619 11.599 1.00 0.00 H new ATOM 0 HG2 GLU A 89 18.015 1.775 11.090 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.081 1.595 9.618 1.00 0.00 H new ATOM 1305 N TRP A 90 18.691 0.653 7.595 1.00 0.00 N ATOM 1306 CA TRP A 90 18.496 1.019 6.197 1.00 0.00 C ATOM 1307 C TRP A 90 19.239 0.109 5.207 1.00 0.00 C ATOM 1308 O TRP A 90 19.362 0.439 4.027 1.00 0.00 O ATOM 1309 CB TRP A 90 18.939 2.468 6.007 1.00 0.00 C ATOM 1310 CG TRP A 90 18.237 3.495 6.827 1.00 0.00 C ATOM 1311 CD1 TRP A 90 18.546 3.866 8.085 1.00 0.00 C ATOM 1312 CD2 TRP A 90 17.074 4.287 6.460 1.00 0.00 C ATOM 1313 NE1 TRP A 90 17.730 4.890 8.488 1.00 0.00 N ATOM 1314 CE2 TRP A 90 16.747 5.149 7.549 1.00 0.00 C ATOM 1315 CE3 TRP A 90 16.239 4.314 5.325 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 15.637 6.005 7.502 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.109 5.145 5.281 1.00 0.00 C ATOM 1318 CH2 TRP A 90 14.813 5.988 6.361 1.00 0.00 C ATOM 0 H TRP A 90 19.156 1.402 8.108 1.00 0.00 H new ATOM 0 HA TRP A 90 17.436 0.896 5.975 1.00 0.00 H new ATOM 0 HB2 TRP A 90 20.005 2.529 6.225 1.00 0.00 H new ATOM 0 HB3 TRP A 90 18.813 2.727 4.956 1.00 0.00 H new ATOM 0 HD1 TRP A 90 19.324 3.421 8.688 1.00 0.00 H new ATOM 0 HE1 TRP A 90 17.834 5.396 9.367 1.00 0.00 H new ATOM 0 HE3 TRP A 90 16.472 3.687 4.477 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.418 6.666 8.327 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 14.466 5.135 4.413 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.945 6.630 6.317 1.00 0.00 H new ATOM 1329 N VAL A 91 19.769 -1.013 5.684 1.00 0.00 N ATOM 1330 CA VAL A 91 20.412 -2.035 4.877 1.00 0.00 C ATOM 1331 C VAL A 91 19.690 -3.393 4.999 1.00 0.00 C ATOM 1332 O VAL A 91 20.249 -4.417 4.605 1.00 0.00 O ATOM 1333 CB VAL A 91 21.926 -2.006 5.188 1.00 0.00 C ATOM 1334 CG1 VAL A 91 22.304 -2.714 6.500 1.00 0.00 C ATOM 1335 CG2 VAL A 91 22.778 -2.520 4.019 1.00 0.00 C ATOM 0 H VAL A 91 19.760 -1.240 6.678 1.00 0.00 H new ATOM 0 HA VAL A 91 20.324 -1.834 3.809 1.00 0.00 H new ATOM 0 HB VAL A 91 22.158 -0.950 5.330 1.00 0.00 H new ATOM 0 HG11 VAL A 91 23.382 -2.652 6.650 1.00 0.00 H new ATOM 0 HG12 VAL A 91 21.794 -2.232 7.334 1.00 0.00 H new ATOM 0 HG13 VAL A 91 22.005 -3.761 6.448 1.00 0.00 H new ATOM 0 HG21 VAL A 91 23.833 -2.478 4.291 1.00 0.00 H new ATOM 0 HG22 VAL A 91 22.502 -3.550 3.793 1.00 0.00 H new ATOM 0 HG23 VAL A 91 22.605 -1.897 3.141 1.00 0.00 H new ATOM 1345 N THR A 92 18.454 -3.432 5.525 1.00 0.00 N ATOM 1346 CA THR A 92 17.761 -4.685 5.856 1.00 0.00 C ATOM 1347 C THR A 92 16.328 -4.782 5.304 1.00 0.00 C ATOM 1348 O THR A 92 15.529 -5.616 5.738 1.00 0.00 O ATOM 1349 CB THR A 92 17.871 -4.970 7.372 1.00 0.00 C ATOM 1350 OG1 THR A 92 17.221 -3.988 8.157 1.00 0.00 O ATOM 1351 CG2 THR A 92 19.321 -5.077 7.864 1.00 0.00 C ATOM 0 H THR A 92 17.909 -2.595 5.732 1.00 0.00 H new ATOM 0 HA THR A 92 18.277 -5.488 5.330 1.00 0.00 H new ATOM 0 HB THR A 92 17.377 -5.934 7.497 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.655 -3.120 8.021 1.00 0.00 H new ATOM 0 HG21 THR A 92 19.328 -5.278 8.935 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.824 -5.889 7.339 1.00 0.00 H new ATOM 0 HG23 THR A 92 19.842 -4.140 7.667 1.00 0.00 H new ATOM 1359 N GLN A 93 16.005 -3.939 4.326 1.00 0.00 N ATOM 1360 CA GLN A 93 14.715 -3.892 3.642 1.00 0.00 C ATOM 1361 C GLN A 93 14.759 -4.800 2.403 1.00 0.00 C ATOM 1362 O GLN A 93 15.779 -5.432 2.113 1.00 0.00 O ATOM 1363 CB GLN A 93 14.380 -2.438 3.259 1.00 0.00 C ATOM 1364 CG GLN A 93 14.115 -1.502 4.447 1.00 0.00 C ATOM 1365 CD GLN A 93 15.311 -1.339 5.373 1.00 0.00 C ATOM 1366 OE1 GLN A 93 16.416 -1.042 4.933 1.00 0.00 O ATOM 1367 NE2 GLN A 93 15.144 -1.594 6.659 1.00 0.00 N ATOM 0 H GLN A 93 16.661 -3.242 3.974 1.00 0.00 H new ATOM 0 HA GLN A 93 13.930 -4.255 4.305 1.00 0.00 H new ATOM 0 HB2 GLN A 93 15.205 -2.033 2.673 1.00 0.00 H new ATOM 0 HB3 GLN A 93 13.501 -2.441 2.614 1.00 0.00 H new ATOM 0 HG2 GLN A 93 13.823 -0.522 4.069 1.00 0.00 H new ATOM 0 HG3 GLN A 93 13.272 -1.887 5.021 1.00 0.00 H new ATOM 0 HE21 GLN A 93 14.220 -1.840 7.014 1.00 0.00 H new ATOM 0 HE22 GLN A 93 15.939 -1.545 7.296 1.00 0.00 H new ATOM 1376 N GLU A 94 13.642 -4.879 1.677 1.00 0.00 N ATOM 1377 CA GLU A 94 13.437 -5.802 0.579 1.00 0.00 C ATOM 1378 C GLU A 94 14.416 -5.602 -0.578 1.00 0.00 C ATOM 1379 O GLU A 94 14.818 -6.585 -1.204 1.00 0.00 O ATOM 1380 CB GLU A 94 11.972 -5.689 0.122 1.00 0.00 C ATOM 1381 CG GLU A 94 11.469 -7.054 -0.348 1.00 0.00 C ATOM 1382 CD GLU A 94 9.952 -7.086 -0.618 1.00 0.00 C ATOM 1383 OE1 GLU A 94 9.172 -7.363 0.322 1.00 0.00 O ATOM 1384 OE2 GLU A 94 9.519 -6.904 -1.779 1.00 0.00 O ATOM 0 H GLU A 94 12.835 -4.280 1.849 1.00 0.00 H new ATOM 0 HA GLU A 94 13.641 -6.812 0.934 1.00 0.00 H new ATOM 0 HB2 GLU A 94 11.353 -5.326 0.942 1.00 0.00 H new ATOM 0 HB3 GLU A 94 11.889 -4.963 -0.686 1.00 0.00 H new ATOM 0 HG2 GLU A 94 11.999 -7.335 -1.258 1.00 0.00 H new ATOM 0 HG3 GLU A 94 11.712 -7.802 0.406 1.00 0.00 H new ATOM 1391 N ILE A 95 14.831 -4.361 -0.845 1.00 0.00 N ATOM 1392 CA ILE A 95 15.722 -4.029 -1.952 1.00 0.00 C ATOM 1393 C ILE A 95 16.732 -3.020 -1.407 1.00 0.00 C ATOM 1394 O ILE A 95 16.321 -2.044 -0.776 1.00 0.00 O ATOM 1395 CB ILE A 95 14.896 -3.466 -3.119 1.00 0.00 C ATOM 1396 CG1 ILE A 95 13.899 -4.542 -3.614 1.00 0.00 C ATOM 1397 CG2 ILE A 95 15.815 -2.973 -4.261 1.00 0.00 C ATOM 1398 CD1 ILE A 95 13.219 -4.218 -4.938 1.00 0.00 C ATOM 0 H ILE A 95 14.553 -3.552 -0.290 1.00 0.00 H new ATOM 0 HA ILE A 95 16.252 -4.899 -2.339 1.00 0.00 H new ATOM 0 HB ILE A 95 14.329 -2.602 -2.772 1.00 0.00 H new ATOM 0 HG12 ILE A 95 14.428 -5.489 -3.715 1.00 0.00 H new ATOM 0 HG13 ILE A 95 13.132 -4.685 -2.853 1.00 0.00 H new ATOM 0 HG21 ILE A 95 15.205 -2.579 -5.074 1.00 0.00 H new ATOM 0 HG22 ILE A 95 16.471 -2.187 -3.886 1.00 0.00 H new ATOM 0 HG23 ILE A 95 16.417 -3.804 -4.628 1.00 0.00 H new ATOM 0 HD11 ILE A 95 12.539 -5.027 -5.205 1.00 0.00 H new ATOM 0 HD12 ILE A 95 12.657 -3.289 -4.841 1.00 0.00 H new ATOM 0 HD13 ILE A 95 13.973 -4.106 -5.717 1.00 0.00 H new ATOM 1410 N PHE A 96 18.022 -3.212 -1.697 1.00 0.00 N ATOM 1411 CA PHE A 96 19.080 -2.261 -1.420 1.00 0.00 C ATOM 1412 C PHE A 96 19.994 -2.220 -2.640 1.00 0.00 C ATOM 1413 O PHE A 96 20.333 -3.267 -3.198 1.00 0.00 O ATOM 1414 CB PHE A 96 19.894 -2.637 -0.166 1.00 0.00 C ATOM 1415 CG PHE A 96 21.093 -1.717 0.025 1.00 0.00 C ATOM 1416 CD1 PHE A 96 20.937 -0.492 0.699 1.00 0.00 C ATOM 1417 CD2 PHE A 96 22.317 -2.002 -0.619 1.00 0.00 C ATOM 1418 CE1 PHE A 96 21.980 0.449 0.701 1.00 0.00 C ATOM 1419 CE2 PHE A 96 23.347 -1.043 -0.645 1.00 0.00 C ATOM 1420 CZ PHE A 96 23.180 0.181 0.022 1.00 0.00 C ATOM 0 H PHE A 96 18.360 -4.064 -2.145 1.00 0.00 H new ATOM 0 HA PHE A 96 18.636 -1.286 -1.221 1.00 0.00 H new ATOM 0 HB2 PHE A 96 19.252 -2.585 0.713 1.00 0.00 H new ATOM 0 HB3 PHE A 96 20.237 -3.668 -0.250 1.00 0.00 H new ATOM 0 HD1 PHE A 96 20.014 -0.275 1.216 1.00 0.00 H new ATOM 0 HD2 PHE A 96 22.464 -2.961 -1.094 1.00 0.00 H new ATOM 0 HE1 PHE A 96 21.858 1.384 1.228 1.00 0.00 H new ATOM 0 HE2 PHE A 96 24.264 -1.248 -1.177 1.00 0.00 H new ATOM 0 HZ PHE A 96 23.972 0.915 0.013 1.00 0.00 H new ATOM 1430 N GLU A 97 20.422 -1.018 -3.011 1.00 0.00 N ATOM 1431 CA GLU A 97 21.463 -0.745 -3.991 1.00 0.00 C ATOM 1432 C GLU A 97 22.195 0.519 -3.539 1.00 0.00 C ATOM 1433 O GLU A 97 21.629 1.333 -2.810 1.00 0.00 O ATOM 1434 CB GLU A 97 20.859 -0.480 -5.382 1.00 0.00 C ATOM 1435 CG GLU A 97 20.491 -1.755 -6.143 1.00 0.00 C ATOM 1436 CD GLU A 97 19.843 -1.480 -7.512 1.00 0.00 C ATOM 1437 OE1 GLU A 97 19.160 -0.448 -7.690 1.00 0.00 O ATOM 1438 OE2 GLU A 97 19.925 -2.356 -8.404 1.00 0.00 O ATOM 0 H GLU A 97 20.030 -0.164 -2.614 1.00 0.00 H new ATOM 0 HA GLU A 97 22.129 -1.605 -4.060 1.00 0.00 H new ATOM 0 HB2 GLU A 97 19.967 0.137 -5.270 1.00 0.00 H new ATOM 0 HB3 GLU A 97 21.571 0.094 -5.975 1.00 0.00 H new ATOM 0 HG2 GLU A 97 21.389 -2.356 -6.288 1.00 0.00 H new ATOM 0 HG3 GLU A 97 19.806 -2.347 -5.537 1.00 0.00 H new ATOM 1445 N ASP A 98 23.423 0.702 -4.024 1.00 0.00 N ATOM 1446 CA ASP A 98 24.194 1.940 -3.904 1.00 0.00 C ATOM 1447 C ASP A 98 24.578 2.413 -5.305 1.00 0.00 C ATOM 1448 O ASP A 98 25.470 1.841 -5.934 1.00 0.00 O ATOM 1449 CB ASP A 98 25.429 1.849 -2.997 1.00 0.00 C ATOM 1450 CG ASP A 98 26.064 3.251 -2.878 1.00 0.00 C ATOM 1451 OD1 ASP A 98 25.357 4.182 -2.441 1.00 0.00 O ATOM 1452 OD2 ASP A 98 27.253 3.431 -3.225 1.00 0.00 O ATOM 0 H ASP A 98 23.925 -0.030 -4.527 1.00 0.00 H new ATOM 0 HA ASP A 98 23.550 2.665 -3.407 1.00 0.00 H new ATOM 0 HB2 ASP A 98 25.147 1.478 -2.012 1.00 0.00 H new ATOM 0 HB3 ASP A 98 26.149 1.142 -3.410 1.00 0.00 H new ATOM 1457 N TRP A 99 23.839 3.387 -5.841 1.00 0.00 N ATOM 1458 CA TRP A 99 24.028 3.915 -7.187 1.00 0.00 C ATOM 1459 C TRP A 99 25.300 4.770 -7.209 1.00 0.00 C ATOM 1460 O TRP A 99 25.304 5.907 -6.734 1.00 0.00 O ATOM 1461 CB TRP A 99 22.774 4.693 -7.638 1.00 0.00 C ATOM 1462 CG TRP A 99 21.492 3.911 -7.775 1.00 0.00 C ATOM 1463 CD1 TRP A 99 21.294 2.586 -7.567 1.00 0.00 C ATOM 1464 CD2 TRP A 99 20.185 4.428 -8.163 1.00 0.00 C ATOM 1465 NE1 TRP A 99 19.973 2.258 -7.799 1.00 0.00 N ATOM 1466 CE2 TRP A 99 19.224 3.369 -8.120 1.00 0.00 C ATOM 1467 CE3 TRP A 99 19.726 5.707 -8.537 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.859 3.586 -8.390 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 18.369 5.938 -8.808 1.00 0.00 C ATOM 1470 CH2 TRP A 99 17.446 4.885 -8.727 1.00 0.00 C ATOM 0 H TRP A 99 23.076 3.838 -5.337 1.00 0.00 H new ATOM 0 HA TRP A 99 24.158 3.103 -7.902 1.00 0.00 H new ATOM 0 HB2 TRP A 99 22.603 5.501 -6.926 1.00 0.00 H new ATOM 0 HB3 TRP A 99 22.992 5.157 -8.600 1.00 0.00 H new ATOM 0 HD1 TRP A 99 22.060 1.887 -7.263 1.00 0.00 H new ATOM 0 HE1 TRP A 99 19.598 1.311 -7.740 1.00 0.00 H new ATOM 0 HE3 TRP A 99 20.430 6.522 -8.616 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 17.148 2.774 -8.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 18.034 6.928 -9.079 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.402 5.076 -8.927 1.00 0.00 H new ATOM 1481 N GLN A 100 26.390 4.211 -7.743 1.00 0.00 N ATOM 1482 CA GLN A 100 27.666 4.891 -7.924 1.00 0.00 C ATOM 1483 C GLN A 100 27.516 5.969 -9.005 1.00 0.00 C ATOM 1484 O GLN A 100 27.635 5.682 -10.198 1.00 0.00 O ATOM 1485 CB GLN A 100 28.750 3.846 -8.241 1.00 0.00 C ATOM 1486 CG GLN A 100 30.142 4.460 -8.462 1.00 0.00 C ATOM 1487 CD GLN A 100 31.240 3.415 -8.267 1.00 0.00 C ATOM 1488 OE1 GLN A 100 31.828 2.908 -9.221 1.00 0.00 O ATOM 1489 NE2 GLN A 100 31.526 3.062 -7.025 1.00 0.00 N ATOM 0 H GLN A 100 26.404 3.245 -8.069 1.00 0.00 H new ATOM 0 HA GLN A 100 27.977 5.404 -7.014 1.00 0.00 H new ATOM 0 HB2 GLN A 100 28.803 3.128 -7.422 1.00 0.00 H new ATOM 0 HB3 GLN A 100 28.460 3.291 -9.133 1.00 0.00 H new ATOM 0 HG2 GLN A 100 30.205 4.875 -9.468 1.00 0.00 H new ATOM 0 HG3 GLN A 100 30.294 5.286 -7.767 1.00 0.00 H new ATOM 0 HE21 GLN A 100 31.029 3.492 -6.245 1.00 0.00 H new ATOM 0 HE22 GLN A 100 32.244 2.359 -6.847 1.00 0.00 H new ATOM 1498 N LEU A 101 27.216 7.199 -8.583 1.00 0.00 N ATOM 1499 CA LEU A 101 26.870 8.327 -9.440 1.00 0.00 C ATOM 1500 C LEU A 101 27.870 9.451 -9.246 1.00 0.00 C ATOM 1501 O LEU A 101 28.455 9.617 -8.174 1.00 0.00 O ATOM 1502 CB LEU A 101 25.460 8.827 -9.078 1.00 0.00 C ATOM 1503 CG LEU A 101 24.297 8.191 -9.866 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.520 6.780 -10.419 1.00 0.00 C ATOM 1505 CD2 LEU A 101 23.054 8.182 -8.976 1.00 0.00 C ATOM 0 H LEU A 101 27.208 7.443 -7.593 1.00 0.00 H new ATOM 0 HA LEU A 101 26.891 8.007 -10.482 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.294 8.649 -8.016 1.00 0.00 H new ATOM 0 HB3 LEU A 101 25.428 9.906 -9.229 1.00 0.00 H new ATOM 0 HG LEU A 101 24.192 8.815 -10.754 1.00 0.00 H new ATOM 0 HD11 LEU A 101 23.627 6.452 -10.950 1.00 0.00 H new ATOM 0 HD12 LEU A 101 25.368 6.788 -11.104 1.00 0.00 H new ATOM 0 HD13 LEU A 101 24.725 6.095 -9.596 1.00 0.00 H new ATOM 0 HD21 LEU A 101 22.221 7.735 -9.519 1.00 0.00 H new ATOM 0 HD22 LEU A 101 23.255 7.600 -8.076 1.00 0.00 H new ATOM 0 HD23 LEU A 101 22.799 9.204 -8.697 1.00 0.00 H new ATOM 1517 N GLU A 102 28.015 10.256 -10.293 1.00 0.00 N ATOM 1518 CA GLU A 102 29.027 11.293 -10.426 1.00 0.00 C ATOM 1519 C GLU A 102 28.583 12.604 -9.786 1.00 0.00 C ATOM 1520 O GLU A 102 28.584 13.653 -10.426 1.00 0.00 O ATOM 1521 CB GLU A 102 29.491 11.396 -11.893 1.00 0.00 C ATOM 1522 CG GLU A 102 30.284 10.146 -12.305 1.00 0.00 C ATOM 1523 CD GLU A 102 30.368 9.993 -13.832 1.00 0.00 C ATOM 1524 OE1 GLU A 102 31.265 10.599 -14.463 1.00 0.00 O ATOM 1525 OE2 GLU A 102 29.552 9.233 -14.400 1.00 0.00 O ATOM 0 H GLU A 102 27.403 10.199 -11.107 1.00 0.00 H new ATOM 0 HA GLU A 102 29.914 11.016 -9.856 1.00 0.00 H new ATOM 0 HB2 GLU A 102 28.626 11.514 -12.545 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.110 12.284 -12.021 1.00 0.00 H new ATOM 0 HG2 GLU A 102 31.291 10.203 -11.891 1.00 0.00 H new ATOM 0 HG3 GLU A 102 29.813 9.261 -11.878 1.00 0.00 H new ATOM 1532 N ASP A 103 28.192 12.482 -8.512 1.00 0.00 N ATOM 1533 CA ASP A 103 27.896 13.526 -7.529 1.00 0.00 C ATOM 1534 C ASP A 103 27.934 14.955 -8.099 1.00 0.00 C ATOM 1535 O ASP A 103 28.990 15.596 -8.100 1.00 0.00 O ATOM 1536 CB ASP A 103 28.861 13.389 -6.349 1.00 0.00 C ATOM 1537 CG ASP A 103 28.769 14.581 -5.392 1.00 0.00 C ATOM 1538 OD1 ASP A 103 27.644 14.923 -4.959 1.00 0.00 O ATOM 1539 OD2 ASP A 103 29.823 15.112 -4.987 1.00 0.00 O ATOM 0 H ASP A 103 28.063 11.556 -8.105 1.00 0.00 H new ATOM 0 HA ASP A 103 26.867 13.375 -7.204 1.00 0.00 H new ATOM 0 HB2 ASP A 103 28.641 12.470 -5.806 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.881 13.302 -6.723 1.00 0.00 H new ATOM 1544 N PRO A 104 26.807 15.435 -8.652 1.00 0.00 N ATOM 1545 CA PRO A 104 26.730 16.700 -9.369 1.00 0.00 C ATOM 1546 C PRO A 104 27.064 17.969 -8.572 1.00 0.00 C ATOM 1547 O PRO A 104 27.109 19.043 -9.164 1.00 0.00 O ATOM 1548 CB PRO A 104 25.332 16.764 -9.969 1.00 0.00 C ATOM 1549 CG PRO A 104 24.921 15.308 -10.088 1.00 0.00 C ATOM 1550 CD PRO A 104 25.630 14.630 -8.924 1.00 0.00 C ATOM 0 HA PRO A 104 27.519 16.700 -10.121 1.00 0.00 H new ATOM 0 HB2 PRO A 104 24.648 17.322 -9.330 1.00 0.00 H new ATOM 0 HB3 PRO A 104 25.336 17.259 -10.940 1.00 0.00 H new ATOM 0 HG2 PRO A 104 23.839 15.191 -10.019 1.00 0.00 H new ATOM 0 HG3 PRO A 104 25.227 14.883 -11.044 1.00 0.00 H new ATOM 0 HD2 PRO A 104 24.982 14.577 -8.049 1.00 0.00 H new ATOM 0 HD3 PRO A 104 25.907 13.607 -9.178 1.00 0.00 H new ATOM 1558 N ASP A 105 27.310 17.889 -7.263 1.00 0.00 N ATOM 1559 CA ASP A 105 27.680 19.023 -6.414 1.00 0.00 C ATOM 1560 C ASP A 105 28.907 19.787 -6.945 1.00 0.00 C ATOM 1561 O ASP A 105 30.056 19.436 -6.669 1.00 0.00 O ATOM 1562 CB ASP A 105 27.895 18.537 -4.976 1.00 0.00 C ATOM 1563 CG ASP A 105 28.392 19.667 -4.056 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.662 20.665 -3.874 1.00 0.00 O ATOM 1565 OD2 ASP A 105 29.494 19.549 -3.476 1.00 0.00 O ATOM 0 H ASP A 105 27.256 17.009 -6.750 1.00 0.00 H new ATOM 0 HA ASP A 105 26.858 19.738 -6.430 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.960 18.135 -4.585 1.00 0.00 H new ATOM 0 HB3 ASP A 105 28.618 17.722 -4.973 1.00 0.00 H new ATOM 1570 N GLY A 106 28.646 20.830 -7.736 1.00 0.00 N ATOM 1571 CA GLY A 106 29.616 21.793 -8.244 1.00 0.00 C ATOM 1572 C GLY A 106 30.155 21.439 -9.633 1.00 0.00 C ATOM 1573 O GLY A 106 31.216 21.944 -10.006 1.00 0.00 O ATOM 0 H GLY A 106 27.699 21.033 -8.055 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.152 22.779 -8.283 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.450 21.861 -7.545 1.00 0.00 H new ATOM 1577 N GLN A 107 29.480 20.561 -10.387 1.00 0.00 N ATOM 1578 CA GLN A 107 30.028 19.997 -11.622 1.00 0.00 C ATOM 1579 C GLN A 107 29.589 20.761 -12.878 1.00 0.00 C ATOM 1580 O GLN A 107 28.813 21.719 -12.820 1.00 0.00 O ATOM 1581 CB GLN A 107 29.635 18.518 -11.746 1.00 0.00 C ATOM 1582 CG GLN A 107 29.878 17.666 -10.499 1.00 0.00 C ATOM 1583 CD GLN A 107 31.327 17.323 -10.165 1.00 0.00 C ATOM 1584 OE1 GLN A 107 32.286 17.870 -10.704 1.00 0.00 O ATOM 1585 NE2 GLN A 107 31.497 16.368 -9.267 1.00 0.00 N ATOM 0 H GLN A 107 28.545 20.225 -10.158 1.00 0.00 H new ATOM 0 HA GLN A 107 31.112 20.092 -11.556 1.00 0.00 H new ATOM 0 HB2 GLN A 107 28.577 18.461 -12.003 1.00 0.00 H new ATOM 0 HB3 GLN A 107 30.189 18.081 -12.577 1.00 0.00 H new ATOM 0 HG2 GLN A 107 29.448 18.187 -9.644 1.00 0.00 H new ATOM 0 HG3 GLN A 107 29.327 16.733 -10.614 1.00 0.00 H new ATOM 0 HE21 GLN A 107 30.687 15.927 -8.832 1.00 0.00 H new ATOM 0 HE22 GLN A 107 32.438 16.072 -9.009 1.00 0.00 H new ATOM 1594 N SER A 108 30.095 20.303 -14.024 1.00 0.00 N ATOM 1595 CA SER A 108 29.761 20.781 -15.359 1.00 0.00 C ATOM 1596 C SER A 108 28.406 20.216 -15.798 1.00 0.00 C ATOM 1597 O SER A 108 28.015 19.137 -15.348 1.00 0.00 O ATOM 1598 CB SER A 108 30.860 20.283 -16.304 1.00 0.00 C ATOM 1599 OG SER A 108 32.136 20.747 -15.884 1.00 0.00 O ATOM 0 H SER A 108 30.783 19.551 -14.043 1.00 0.00 H new ATOM 0 HA SER A 108 29.695 21.869 -15.373 1.00 0.00 H new ATOM 0 HB2 SER A 108 30.855 19.193 -16.332 1.00 0.00 H new ATOM 0 HB3 SER A 108 30.658 20.629 -17.318 1.00 0.00 H new ATOM 0 HG SER A 108 32.823 20.416 -16.500 1.00 0.00 H new ATOM 1605 N LEU A 109 27.713 20.885 -16.729 1.00 0.00 N ATOM 1606 CA LEU A 109 26.397 20.443 -17.210 1.00 0.00 C ATOM 1607 C LEU A 109 26.456 19.050 -17.818 1.00 0.00 C ATOM 1608 O LEU A 109 25.488 18.305 -17.711 1.00 0.00 O ATOM 1609 CB LEU A 109 25.821 21.398 -18.266 1.00 0.00 C ATOM 1610 CG LEU A 109 25.451 22.787 -17.718 1.00 0.00 C ATOM 1611 CD1 LEU A 109 25.065 23.713 -18.877 1.00 0.00 C ATOM 1612 CD2 LEU A 109 24.292 22.730 -16.713 1.00 0.00 C ATOM 0 H LEU A 109 28.046 21.743 -17.168 1.00 0.00 H new ATOM 0 HA LEU A 109 25.751 20.435 -16.332 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.549 21.517 -19.069 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.933 20.944 -18.706 1.00 0.00 H new ATOM 0 HG LEU A 109 26.327 23.171 -17.195 1.00 0.00 H new ATOM 0 HD11 LEU A 109 24.803 24.696 -18.486 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.907 23.808 -19.563 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.210 23.295 -19.408 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.070 23.736 -16.356 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.409 22.314 -17.199 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.573 22.100 -15.869 1.00 0.00 H new ATOM 1624 N GLU A 110 27.576 18.688 -18.443 1.00 0.00 N ATOM 1625 CA GLU A 110 27.769 17.357 -19.002 1.00 0.00 C ATOM 1626 C GLU A 110 27.730 16.295 -17.895 1.00 0.00 C ATOM 1627 O GLU A 110 27.130 15.236 -18.082 1.00 0.00 O ATOM 1628 CB GLU A 110 29.091 17.342 -19.781 1.00 0.00 C ATOM 1629 CG GLU A 110 29.322 16.017 -20.522 1.00 0.00 C ATOM 1630 CD GLU A 110 30.603 16.065 -21.374 1.00 0.00 C ATOM 1631 OE1 GLU A 110 31.699 15.752 -20.856 1.00 0.00 O ATOM 1632 OE2 GLU A 110 30.527 16.397 -22.580 1.00 0.00 O ATOM 0 H GLU A 110 28.373 19.311 -18.574 1.00 0.00 H new ATOM 0 HA GLU A 110 26.959 17.113 -19.690 1.00 0.00 H new ATOM 0 HB2 GLU A 110 29.095 18.162 -20.499 1.00 0.00 H new ATOM 0 HB3 GLU A 110 29.917 17.518 -19.092 1.00 0.00 H new ATOM 0 HG2 GLU A 110 29.393 15.203 -19.801 1.00 0.00 H new ATOM 0 HG3 GLU A 110 28.466 15.802 -21.162 1.00 0.00 H new ATOM 1639 N VAL A 111 28.311 16.580 -16.724 1.00 0.00 N ATOM 1640 CA VAL A 111 28.269 15.669 -15.584 1.00 0.00 C ATOM 1641 C VAL A 111 26.831 15.588 -15.077 1.00 0.00 C ATOM 1642 O VAL A 111 26.329 14.488 -14.858 1.00 0.00 O ATOM 1643 CB VAL A 111 29.242 16.119 -14.480 1.00 0.00 C ATOM 1644 CG1 VAL A 111 29.156 15.211 -13.245 1.00 0.00 C ATOM 1645 CG2 VAL A 111 30.692 16.135 -14.990 1.00 0.00 C ATOM 0 H VAL A 111 28.820 17.445 -16.544 1.00 0.00 H new ATOM 0 HA VAL A 111 28.592 14.675 -15.893 1.00 0.00 H new ATOM 0 HB VAL A 111 28.947 17.129 -14.197 1.00 0.00 H new ATOM 0 HG11 VAL A 111 29.857 15.560 -12.487 1.00 0.00 H new ATOM 0 HG12 VAL A 111 28.143 15.239 -12.843 1.00 0.00 H new ATOM 0 HG13 VAL A 111 29.406 14.188 -13.527 1.00 0.00 H new ATOM 0 HG21 VAL A 111 31.356 16.457 -14.188 1.00 0.00 H new ATOM 0 HG22 VAL A 111 30.974 15.134 -15.315 1.00 0.00 H new ATOM 0 HG23 VAL A 111 30.775 16.826 -15.829 1.00 0.00 H new ATOM 1655 N PHE A 112 26.146 16.728 -14.945 1.00 0.00 N ATOM 1656 CA PHE A 112 24.747 16.744 -14.539 1.00 0.00 C ATOM 1657 C PHE A 112 23.889 15.903 -15.489 1.00 0.00 C ATOM 1658 O PHE A 112 23.159 15.035 -15.021 1.00 0.00 O ATOM 1659 CB PHE A 112 24.224 18.178 -14.463 1.00 0.00 C ATOM 1660 CG PHE A 112 24.441 18.865 -13.144 1.00 0.00 C ATOM 1661 CD1 PHE A 112 25.621 19.589 -12.912 1.00 0.00 C ATOM 1662 CD2 PHE A 112 23.448 18.783 -12.147 1.00 0.00 C ATOM 1663 CE1 PHE A 112 25.829 20.195 -11.668 1.00 0.00 C ATOM 1664 CE2 PHE A 112 23.655 19.394 -10.903 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.861 20.070 -10.663 1.00 0.00 C ATOM 0 H PHE A 112 26.544 17.652 -15.115 1.00 0.00 H new ATOM 0 HA PHE A 112 24.679 16.301 -13.545 1.00 0.00 H new ATOM 0 HB2 PHE A 112 24.705 18.766 -15.245 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.156 18.171 -14.680 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.365 19.678 -13.690 1.00 0.00 H new ATOM 0 HD2 PHE A 112 22.529 18.250 -12.342 1.00 0.00 H new ATOM 0 HE1 PHE A 112 26.733 20.757 -11.483 1.00 0.00 H new ATOM 0 HE2 PHE A 112 22.895 19.345 -10.137 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.046 20.500 -9.690 1.00 0.00 H new ATOM 1675 N ARG A 113 23.991 16.106 -16.807 1.00 0.00 N ATOM 1676 CA ARG A 113 23.274 15.312 -17.809 1.00 0.00 C ATOM 1677 C ARG A 113 23.621 13.831 -17.707 1.00 0.00 C ATOM 1678 O ARG A 113 22.713 13.002 -17.781 1.00 0.00 O ATOM 1679 CB ARG A 113 23.566 15.867 -19.217 1.00 0.00 C ATOM 1680 CG ARG A 113 22.630 17.041 -19.550 1.00 0.00 C ATOM 1681 CD ARG A 113 23.268 18.094 -20.452 1.00 0.00 C ATOM 1682 NE ARG A 113 22.294 19.140 -20.807 1.00 0.00 N ATOM 1683 CZ ARG A 113 22.564 20.268 -21.473 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.804 20.539 -21.880 1.00 0.00 N ATOM 1685 NH2 ARG A 113 21.584 21.124 -21.728 1.00 0.00 N ATOM 0 H ARG A 113 24.580 16.834 -17.212 1.00 0.00 H new ATOM 0 HA ARG A 113 22.204 15.394 -17.617 1.00 0.00 H new ATOM 0 HB2 ARG A 113 24.603 16.196 -19.274 1.00 0.00 H new ATOM 0 HB3 ARG A 113 23.441 15.076 -19.957 1.00 0.00 H new ATOM 0 HG2 ARG A 113 21.734 16.654 -20.035 1.00 0.00 H new ATOM 0 HG3 ARG A 113 22.311 17.515 -18.622 1.00 0.00 H new ATOM 0 HD2 ARG A 113 24.122 18.543 -19.946 1.00 0.00 H new ATOM 0 HD3 ARG A 113 23.647 17.621 -21.358 1.00 0.00 H new ATOM 0 HE ARG A 113 21.327 18.991 -20.519 1.00 0.00 H new ATOM 0 HH11 ARG A 113 24.560 19.883 -21.684 1.00 0.00 H new ATOM 0 HH12 ARG A 113 23.997 21.403 -22.387 1.00 0.00 H new ATOM 0 HH21 ARG A 113 20.634 20.919 -21.417 1.00 0.00 H new ATOM 0 HH22 ARG A 113 21.780 21.987 -22.235 1.00 0.00 H new ATOM 1699 N THR A 114 24.890 13.481 -17.501 1.00 0.00 N ATOM 1700 CA THR A 114 25.308 12.106 -17.339 1.00 0.00 C ATOM 1701 C THR A 114 24.613 11.501 -16.113 1.00 0.00 C ATOM 1702 O THR A 114 23.991 10.443 -16.219 1.00 0.00 O ATOM 1703 CB THR A 114 26.842 12.096 -17.247 1.00 0.00 C ATOM 1704 OG1 THR A 114 27.410 12.602 -18.439 1.00 0.00 O ATOM 1705 CG2 THR A 114 27.380 10.694 -17.018 1.00 0.00 C ATOM 0 H THR A 114 25.654 14.154 -17.443 1.00 0.00 H new ATOM 0 HA THR A 114 25.018 11.483 -18.185 1.00 0.00 H new ATOM 0 HB THR A 114 27.115 12.725 -16.400 1.00 0.00 H new ATOM 0 HG1 THR A 114 27.184 13.551 -18.532 1.00 0.00 H new ATOM 0 HG21 THR A 114 28.468 10.727 -16.958 1.00 0.00 H new ATOM 0 HG22 THR A 114 26.977 10.298 -16.086 1.00 0.00 H new ATOM 0 HG23 THR A 114 27.081 10.050 -17.845 1.00 0.00 H new ATOM 1713 N VAL A 115 24.653 12.180 -14.964 1.00 0.00 N ATOM 1714 CA VAL A 115 24.012 11.696 -13.752 1.00 0.00 C ATOM 1715 C VAL A 115 22.500 11.652 -13.925 1.00 0.00 C ATOM 1716 O VAL A 115 21.904 10.669 -13.495 1.00 0.00 O ATOM 1717 CB VAL A 115 24.462 12.502 -12.530 1.00 0.00 C ATOM 1718 CG1 VAL A 115 23.700 12.114 -11.252 1.00 0.00 C ATOM 1719 CG2 VAL A 115 25.957 12.270 -12.282 1.00 0.00 C ATOM 0 H VAL A 115 25.129 13.075 -14.854 1.00 0.00 H new ATOM 0 HA VAL A 115 24.331 10.670 -13.568 1.00 0.00 H new ATOM 0 HB VAL A 115 24.253 13.549 -12.749 1.00 0.00 H new ATOM 0 HG11 VAL A 115 24.059 12.716 -10.417 1.00 0.00 H new ATOM 0 HG12 VAL A 115 22.634 12.292 -11.396 1.00 0.00 H new ATOM 0 HG13 VAL A 115 23.866 11.059 -11.036 1.00 0.00 H new ATOM 0 HG21 VAL A 115 26.275 12.845 -11.412 1.00 0.00 H new ATOM 0 HG22 VAL A 115 26.136 11.210 -12.102 1.00 0.00 H new ATOM 0 HG23 VAL A 115 26.525 12.590 -13.156 1.00 0.00 H new ATOM 1729 N ARG A 116 21.866 12.627 -14.590 1.00 0.00 N ATOM 1730 CA ARG A 116 20.435 12.565 -14.858 1.00 0.00 C ATOM 1731 C ARG A 116 20.127 11.270 -15.584 1.00 0.00 C ATOM 1732 O ARG A 116 19.203 10.569 -15.182 1.00 0.00 O ATOM 1733 CB ARG A 116 19.925 13.773 -15.672 1.00 0.00 C ATOM 1734 CG ARG A 116 18.413 13.583 -15.888 1.00 0.00 C ATOM 1735 CD ARG A 116 17.666 14.711 -16.590 1.00 0.00 C ATOM 1736 NE ARG A 116 17.824 14.673 -18.060 1.00 0.00 N ATOM 1737 CZ ARG A 116 18.405 15.604 -18.830 1.00 0.00 C ATOM 1738 NH1 ARG A 116 19.123 16.580 -18.294 1.00 0.00 N ATOM 1739 NH2 ARG A 116 18.267 15.566 -20.150 1.00 0.00 N ATOM 0 H ARG A 116 22.326 13.464 -14.949 1.00 0.00 H new ATOM 0 HA ARG A 116 19.913 12.599 -13.901 1.00 0.00 H new ATOM 0 HB2 ARG A 116 20.122 14.704 -15.140 1.00 0.00 H new ATOM 0 HB3 ARG A 116 20.444 13.837 -16.629 1.00 0.00 H new ATOM 0 HG2 ARG A 116 18.266 12.669 -16.464 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.949 13.424 -14.914 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.607 14.650 -16.341 1.00 0.00 H new ATOM 0 HD3 ARG A 116 18.027 15.669 -16.215 1.00 0.00 H new ATOM 0 HE ARG A 116 17.452 13.852 -18.538 1.00 0.00 H new ATOM 0 HH11 ARG A 116 19.240 16.630 -17.282 1.00 0.00 H new ATOM 0 HH12 ARG A 116 19.559 17.281 -18.893 1.00 0.00 H new ATOM 0 HH21 ARG A 116 17.716 14.825 -20.584 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.712 16.278 -20.730 1.00 0.00 H new ATOM 1753 N GLY A 117 20.886 10.957 -16.631 1.00 0.00 N ATOM 1754 CA GLY A 117 20.649 9.750 -17.395 1.00 0.00 C ATOM 1755 C GLY A 117 20.810 8.528 -16.508 1.00 0.00 C ATOM 1756 O GLY A 117 19.902 7.703 -16.483 1.00 0.00 O ATOM 0 H GLY A 117 21.666 11.524 -16.964 1.00 0.00 H new ATOM 0 HA2 GLY A 117 19.645 9.771 -17.819 1.00 0.00 H new ATOM 0 HA3 GLY A 117 21.347 9.697 -18.230 1.00 0.00 H new ATOM 1760 N GLN A 118 21.893 8.445 -15.724 1.00 0.00 N ATOM 1761 CA GLN A 118 22.148 7.318 -14.834 1.00 0.00 C ATOM 1762 C GLN A 118 20.968 7.125 -13.875 1.00 0.00 C ATOM 1763 O GLN A 118 20.373 6.048 -13.820 1.00 0.00 O ATOM 1764 CB GLN A 118 23.459 7.541 -14.051 1.00 0.00 C ATOM 1765 CG GLN A 118 24.728 7.440 -14.919 1.00 0.00 C ATOM 1766 CD GLN A 118 25.990 8.025 -14.263 1.00 0.00 C ATOM 1767 OE1 GLN A 118 25.961 8.633 -13.194 1.00 0.00 O ATOM 1768 NE2 GLN A 118 27.133 7.866 -14.911 1.00 0.00 N ATOM 0 H GLN A 118 22.616 9.164 -15.693 1.00 0.00 H new ATOM 0 HA GLN A 118 22.257 6.413 -15.432 1.00 0.00 H new ATOM 0 HB2 GLN A 118 23.428 8.525 -13.582 1.00 0.00 H new ATOM 0 HB3 GLN A 118 23.521 6.807 -13.248 1.00 0.00 H new ATOM 0 HG2 GLN A 118 24.909 6.392 -15.157 1.00 0.00 H new ATOM 0 HG3 GLN A 118 24.551 7.956 -15.863 1.00 0.00 H new ATOM 0 HE21 GLN A 118 27.151 7.361 -15.797 1.00 0.00 H new ATOM 0 HE22 GLN A 118 27.996 8.248 -14.524 1.00 0.00 H new ATOM 1777 N VAL A 119 20.638 8.183 -13.140 1.00 0.00 N ATOM 1778 CA VAL A 119 19.567 8.261 -12.158 1.00 0.00 C ATOM 1779 C VAL A 119 18.228 7.879 -12.783 1.00 0.00 C ATOM 1780 O VAL A 119 17.555 7.010 -12.236 1.00 0.00 O ATOM 1781 CB VAL A 119 19.520 9.686 -11.550 1.00 0.00 C ATOM 1782 CG1 VAL A 119 18.284 9.907 -10.674 1.00 0.00 C ATOM 1783 CG2 VAL A 119 20.733 9.976 -10.654 1.00 0.00 C ATOM 0 H VAL A 119 21.146 9.064 -13.222 1.00 0.00 H new ATOM 0 HA VAL A 119 19.766 7.549 -11.357 1.00 0.00 H new ATOM 0 HB VAL A 119 19.505 10.350 -12.414 1.00 0.00 H new ATOM 0 HG11 VAL A 119 18.299 10.920 -10.272 1.00 0.00 H new ATOM 0 HG12 VAL A 119 17.384 9.767 -11.273 1.00 0.00 H new ATOM 0 HG13 VAL A 119 18.288 9.191 -9.852 1.00 0.00 H new ATOM 0 HG21 VAL A 119 20.655 10.986 -10.251 1.00 0.00 H new ATOM 0 HG22 VAL A 119 20.759 9.259 -9.833 1.00 0.00 H new ATOM 0 HG23 VAL A 119 21.648 9.889 -11.240 1.00 0.00 H new ATOM 1793 N LYS A 120 17.807 8.512 -13.886 1.00 0.00 N ATOM 1794 CA LYS A 120 16.448 8.338 -14.393 1.00 0.00 C ATOM 1795 C LYS A 120 16.221 6.888 -14.799 1.00 0.00 C ATOM 1796 O LYS A 120 15.240 6.272 -14.391 1.00 0.00 O ATOM 1797 CB LYS A 120 16.219 9.326 -15.547 1.00 0.00 C ATOM 1798 CG LYS A 120 14.869 9.103 -16.237 1.00 0.00 C ATOM 1799 CD LYS A 120 14.610 10.177 -17.302 1.00 0.00 C ATOM 1800 CE LYS A 120 13.317 9.878 -18.071 1.00 0.00 C ATOM 1801 NZ LYS A 120 13.423 8.698 -18.967 1.00 0.00 N ATOM 0 H LYS A 120 18.387 9.144 -14.438 1.00 0.00 H new ATOM 0 HA LYS A 120 15.716 8.558 -13.616 1.00 0.00 H new ATOM 0 HB2 LYS A 120 16.267 10.346 -15.165 1.00 0.00 H new ATOM 0 HB3 LYS A 120 17.021 9.221 -16.278 1.00 0.00 H new ATOM 0 HG2 LYS A 120 14.852 8.116 -16.699 1.00 0.00 H new ATOM 0 HG3 LYS A 120 14.070 9.121 -15.495 1.00 0.00 H new ATOM 0 HD2 LYS A 120 14.539 11.156 -16.828 1.00 0.00 H new ATOM 0 HD3 LYS A 120 15.450 10.219 -17.995 1.00 0.00 H new ATOM 0 HE2 LYS A 120 12.509 9.712 -17.358 1.00 0.00 H new ATOM 0 HE3 LYS A 120 13.045 10.752 -18.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 12.547 8.601 -19.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.227 8.825 -19.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 13.569 7.841 -18.396 1.00 0.00 H new ATOM 1815 N GLU A 121 17.164 6.333 -15.551 1.00 0.00 N ATOM 1816 CA GLU A 121 17.167 4.928 -15.942 1.00 0.00 C ATOM 1817 C GLU A 121 17.085 4.018 -14.716 1.00 0.00 C ATOM 1818 O GLU A 121 16.381 3.006 -14.728 1.00 0.00 O ATOM 1819 CB GLU A 121 18.438 4.663 -16.778 1.00 0.00 C ATOM 1820 CG GLU A 121 19.361 3.507 -16.369 1.00 0.00 C ATOM 1821 CD GLU A 121 20.505 3.297 -17.379 1.00 0.00 C ATOM 1822 OE1 GLU A 121 20.266 2.730 -18.470 1.00 0.00 O ATOM 1823 OE2 GLU A 121 21.663 3.666 -17.071 1.00 0.00 O ATOM 0 H GLU A 121 17.962 6.856 -15.913 1.00 0.00 H new ATOM 0 HA GLU A 121 16.289 4.703 -16.547 1.00 0.00 H new ATOM 0 HB2 GLU A 121 18.126 4.488 -17.808 1.00 0.00 H new ATOM 0 HB3 GLU A 121 19.032 5.577 -16.775 1.00 0.00 H new ATOM 0 HG2 GLU A 121 19.780 3.709 -15.383 1.00 0.00 H new ATOM 0 HG3 GLU A 121 18.778 2.590 -16.286 1.00 0.00 H new ATOM 1830 N ARG A 122 17.819 4.356 -13.657 1.00 0.00 N ATOM 1831 CA ARG A 122 17.856 3.534 -12.454 1.00 0.00 C ATOM 1832 C ARG A 122 16.534 3.628 -11.696 1.00 0.00 C ATOM 1833 O ARG A 122 16.030 2.582 -11.302 1.00 0.00 O ATOM 1834 CB ARG A 122 19.079 3.883 -11.602 1.00 0.00 C ATOM 1835 CG ARG A 122 20.361 3.267 -12.171 1.00 0.00 C ATOM 1836 CD ARG A 122 21.616 4.002 -11.677 1.00 0.00 C ATOM 1837 NE ARG A 122 22.853 3.461 -12.280 1.00 0.00 N ATOM 1838 CZ ARG A 122 23.173 3.470 -13.584 1.00 0.00 C ATOM 1839 NH1 ARG A 122 22.385 4.081 -14.461 1.00 0.00 N ATOM 1840 NH2 ARG A 122 24.274 2.861 -14.008 1.00 0.00 N ATOM 0 H ARG A 122 18.396 5.196 -13.610 1.00 0.00 H new ATOM 0 HA ARG A 122 17.969 2.487 -12.733 1.00 0.00 H new ATOM 0 HB2 ARG A 122 19.188 4.966 -11.549 1.00 0.00 H new ATOM 0 HB3 ARG A 122 18.926 3.528 -10.583 1.00 0.00 H new ATOM 0 HG2 ARG A 122 20.418 2.217 -11.884 1.00 0.00 H new ATOM 0 HG3 ARG A 122 20.327 3.298 -13.260 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.531 5.062 -11.915 1.00 0.00 H new ATOM 0 HD3 ARG A 122 21.678 3.923 -10.592 1.00 0.00 H new ATOM 0 HE ARG A 122 23.529 3.040 -11.643 1.00 0.00 H new ATOM 0 HH11 ARG A 122 21.534 4.545 -14.145 1.00 0.00 H new ATOM 0 HH12 ARG A 122 22.631 4.086 -15.451 1.00 0.00 H new ATOM 0 HH21 ARG A 122 24.881 2.383 -13.342 1.00 0.00 H new ATOM 0 HH22 ARG A 122 24.513 2.871 -15.000 1.00 0.00 H new ATOM 1854 N VAL A 123 15.919 4.805 -11.538 1.00 0.00 N ATOM 1855 CA VAL A 123 14.561 4.933 -11.030 1.00 0.00 C ATOM 1856 C VAL A 123 13.615 4.046 -11.849 1.00 0.00 C ATOM 1857 O VAL A 123 12.835 3.299 -11.259 1.00 0.00 O ATOM 1858 CB VAL A 123 14.137 6.412 -11.055 1.00 0.00 C ATOM 1859 CG1 VAL A 123 12.654 6.557 -10.719 1.00 0.00 C ATOM 1860 CG2 VAL A 123 14.931 7.263 -10.051 1.00 0.00 C ATOM 0 H VAL A 123 16.358 5.698 -11.762 1.00 0.00 H new ATOM 0 HA VAL A 123 14.514 4.594 -9.995 1.00 0.00 H new ATOM 0 HB VAL A 123 14.340 6.767 -12.065 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.377 7.611 -10.743 1.00 0.00 H new ATOM 0 HG12 VAL A 123 12.060 6.009 -11.450 1.00 0.00 H new ATOM 0 HG13 VAL A 123 12.465 6.155 -9.724 1.00 0.00 H new ATOM 0 HG21 VAL A 123 14.596 8.299 -10.106 1.00 0.00 H new ATOM 0 HG22 VAL A 123 14.768 6.882 -9.043 1.00 0.00 H new ATOM 0 HG23 VAL A 123 15.993 7.212 -10.291 1.00 0.00 H new ATOM 1870 N GLU A 124 13.679 4.093 -13.184 1.00 0.00 N ATOM 1871 CA GLU A 124 12.787 3.303 -14.026 1.00 0.00 C ATOM 1872 C GLU A 124 12.987 1.809 -13.775 1.00 0.00 C ATOM 1873 O GLU A 124 12.015 1.062 -13.666 1.00 0.00 O ATOM 1874 CB GLU A 124 12.991 3.630 -15.517 1.00 0.00 C ATOM 1875 CG GLU A 124 12.438 5.004 -15.916 1.00 0.00 C ATOM 1876 CD GLU A 124 12.573 5.272 -17.425 1.00 0.00 C ATOM 1877 OE1 GLU A 124 11.887 4.603 -18.233 1.00 0.00 O ATOM 1878 OE2 GLU A 124 13.338 6.183 -17.816 1.00 0.00 O ATOM 0 H GLU A 124 14.341 4.672 -13.701 1.00 0.00 H new ATOM 0 HA GLU A 124 11.763 3.565 -13.760 1.00 0.00 H new ATOM 0 HB2 GLU A 124 14.056 3.593 -15.748 1.00 0.00 H new ATOM 0 HB3 GLU A 124 12.507 2.862 -16.120 1.00 0.00 H new ATOM 0 HG2 GLU A 124 11.388 5.067 -15.631 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.966 5.780 -15.363 1.00 0.00 H new ATOM 1885 N ASN A 125 14.241 1.380 -13.624 1.00 0.00 N ATOM 1886 CA ASN A 125 14.575 0.005 -13.285 1.00 0.00 C ATOM 1887 C ASN A 125 14.001 -0.356 -11.926 1.00 0.00 C ATOM 1888 O ASN A 125 13.401 -1.417 -11.783 1.00 0.00 O ATOM 1889 CB ASN A 125 16.091 -0.247 -13.286 1.00 0.00 C ATOM 1890 CG ASN A 125 16.597 -0.651 -14.663 1.00 0.00 C ATOM 1891 OD1 ASN A 125 16.755 -1.832 -14.959 1.00 0.00 O ATOM 1892 ND2 ASN A 125 16.845 0.308 -15.535 1.00 0.00 N ATOM 0 H ASN A 125 15.055 1.984 -13.735 1.00 0.00 H new ATOM 0 HA ASN A 125 14.134 -0.628 -14.055 1.00 0.00 H new ATOM 0 HB2 ASN A 125 16.609 0.654 -12.959 1.00 0.00 H new ATOM 0 HB3 ASN A 125 16.329 -1.031 -12.567 1.00 0.00 H new ATOM 0 HD21 ASN A 125 17.173 0.073 -16.472 1.00 0.00 H new ATOM 0 HD22 ASN A 125 16.708 1.284 -15.272 1.00 0.00 H new ATOM 1899 N LEU A 126 14.171 0.510 -10.927 1.00 0.00 N ATOM 1900 CA LEU A 126 13.715 0.244 -9.572 1.00 0.00 C ATOM 1901 C LEU A 126 12.201 0.088 -9.559 1.00 0.00 C ATOM 1902 O LEU A 126 11.726 -0.902 -9.022 1.00 0.00 O ATOM 1903 CB LEU A 126 14.325 1.218 -8.539 1.00 0.00 C ATOM 1904 CG LEU A 126 13.359 2.265 -7.963 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.521 1.705 -6.807 1.00 0.00 C ATOM 1906 CD2 LEU A 126 14.097 3.489 -7.438 1.00 0.00 C ATOM 0 H LEU A 126 14.629 1.414 -11.039 1.00 0.00 H new ATOM 0 HA LEU A 126 14.102 -0.715 -9.228 1.00 0.00 H new ATOM 0 HB2 LEU A 126 14.734 0.635 -7.714 1.00 0.00 H new ATOM 0 HB3 LEU A 126 15.160 1.739 -9.007 1.00 0.00 H new ATOM 0 HG LEU A 126 12.709 2.543 -8.793 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.853 2.481 -6.432 1.00 0.00 H new ATOM 0 HD12 LEU A 126 11.932 0.859 -7.161 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.182 1.376 -6.005 1.00 0.00 H new ATOM 0 HD21 LEU A 126 13.378 4.205 -7.040 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.785 3.188 -6.648 1.00 0.00 H new ATOM 0 HD23 LEU A 126 14.658 3.952 -8.250 1.00 0.00 H new ATOM 1918 N ILE A 127 11.455 0.978 -10.215 1.00 0.00 N ATOM 1919 CA ILE A 127 10.017 0.853 -10.394 1.00 0.00 C ATOM 1920 C ILE A 127 9.699 -0.476 -11.088 1.00 0.00 C ATOM 1921 O ILE A 127 8.731 -1.127 -10.704 1.00 0.00 O ATOM 1922 CB ILE A 127 9.499 2.081 -11.183 1.00 0.00 C ATOM 1923 CG1 ILE A 127 9.522 3.364 -10.317 1.00 0.00 C ATOM 1924 CG2 ILE A 127 8.070 1.828 -11.680 1.00 0.00 C ATOM 1925 CD1 ILE A 127 9.292 4.673 -11.095 1.00 0.00 C ATOM 0 H ILE A 127 11.845 1.818 -10.642 1.00 0.00 H new ATOM 0 HA ILE A 127 9.505 0.840 -9.432 1.00 0.00 H new ATOM 0 HB ILE A 127 10.164 2.228 -12.034 1.00 0.00 H new ATOM 0 HG12 ILE A 127 8.758 3.278 -9.545 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.484 3.425 -9.808 1.00 0.00 H new ATOM 0 HG21 ILE A 127 7.718 2.699 -12.233 1.00 0.00 H new ATOM 0 HG22 ILE A 127 8.061 0.955 -12.333 1.00 0.00 H new ATOM 0 HG23 ILE A 127 7.414 1.650 -10.828 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.325 5.517 -10.406 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.070 4.790 -11.849 1.00 0.00 H new ATOM 0 HD13 ILE A 127 8.317 4.641 -11.582 1.00 0.00 H new ATOM 1937 N ALA A 128 10.473 -0.915 -12.080 1.00 0.00 N ATOM 1938 CA ALA A 128 10.152 -2.122 -12.840 1.00 0.00 C ATOM 1939 C ALA A 128 10.199 -3.375 -11.956 1.00 0.00 C ATOM 1940 O ALA A 128 9.437 -4.318 -12.176 1.00 0.00 O ATOM 1941 CB ALA A 128 11.081 -2.266 -14.051 1.00 0.00 C ATOM 0 H ALA A 128 11.331 -0.450 -12.377 1.00 0.00 H new ATOM 0 HA ALA A 128 9.130 -2.020 -13.205 1.00 0.00 H new ATOM 0 HB1 ALA A 128 10.824 -3.171 -14.601 1.00 0.00 H new ATOM 0 HB2 ALA A 128 10.966 -1.400 -14.703 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.115 -2.330 -13.711 1.00 0.00 H new ATOM 1947 N LYS A 129 11.066 -3.379 -10.939 1.00 0.00 N ATOM 1948 CA LYS A 129 11.173 -4.452 -9.953 1.00 0.00 C ATOM 1949 C LYS A 129 9.894 -4.588 -9.117 1.00 0.00 C ATOM 1950 O LYS A 129 9.518 -5.704 -8.760 1.00 0.00 O ATOM 1951 CB LYS A 129 12.344 -4.161 -9.010 1.00 0.00 C ATOM 1952 CG LYS A 129 13.716 -4.139 -9.700 1.00 0.00 C ATOM 1953 CD LYS A 129 14.777 -3.653 -8.707 1.00 0.00 C ATOM 1954 CE LYS A 129 16.050 -3.169 -9.420 1.00 0.00 C ATOM 1955 NZ LYS A 129 17.135 -2.873 -8.451 1.00 0.00 N ATOM 0 H LYS A 129 11.726 -2.619 -10.777 1.00 0.00 H new ATOM 0 HA LYS A 129 11.332 -5.384 -10.495 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.177 -3.198 -8.527 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.358 -4.914 -8.222 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.970 -5.136 -10.061 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.688 -3.482 -10.569 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.367 -2.842 -8.106 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.030 -4.462 -8.021 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.386 -3.930 -10.124 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.825 -2.275 -10.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 18.038 -2.781 -8.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 16.924 -1.984 -7.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 17.204 -3.647 -7.760 1.00 0.00 H new ATOM 1969 N ILE A 130 9.242 -3.466 -8.800 1.00 0.00 N ATOM 1970 CA ILE A 130 8.151 -3.366 -7.838 1.00 0.00 C ATOM 1971 C ILE A 130 6.751 -3.227 -8.443 1.00 0.00 C ATOM 1972 O ILE A 130 5.770 -3.580 -7.786 1.00 0.00 O ATOM 1973 CB ILE A 130 8.437 -2.207 -6.857 1.00 0.00 C ATOM 1974 CG1 ILE A 130 8.799 -0.855 -7.495 1.00 0.00 C ATOM 1975 CG2 ILE A 130 9.474 -2.690 -5.820 1.00 0.00 C ATOM 1976 CD1 ILE A 130 9.366 0.191 -6.527 1.00 0.00 C ATOM 0 H ILE A 130 9.472 -2.568 -9.226 1.00 0.00 H new ATOM 0 HA ILE A 130 8.127 -4.323 -7.317 1.00 0.00 H new ATOM 0 HB ILE A 130 7.495 -1.967 -6.364 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.528 -1.028 -8.286 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.907 -0.444 -7.968 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.689 -1.884 -5.118 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.074 -3.547 -5.278 1.00 0.00 H new ATOM 0 HG23 ILE A 130 10.392 -2.980 -6.331 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.589 1.108 -7.072 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.633 0.401 -5.748 1.00 0.00 H new ATOM 0 HD13 ILE A 130 10.279 -0.192 -6.072 1.00 0.00 H new ATOM 1988 N SER A 131 6.666 -2.704 -9.663 1.00 0.00 N ATOM 1989 CA SER A 131 5.434 -2.496 -10.419 1.00 0.00 C ATOM 1990 C SER A 131 4.538 -3.739 -10.369 1.00 0.00 C ATOM 1991 O SER A 131 3.339 -3.598 -10.053 1.00 0.00 O ATOM 1992 CB SER A 131 5.764 -2.132 -11.866 1.00 0.00 C ATOM 1993 OG SER A 131 6.378 -0.861 -11.889 1.00 0.00 O ATOM 1994 OXT SER A 131 5.024 -4.852 -10.669 1.00 0.00 O ATOM 0 H SER A 131 7.493 -2.399 -10.176 1.00 0.00 H new ATOM 0 HA SER A 131 4.886 -1.672 -9.962 1.00 0.00 H new ATOM 0 HB2 SER A 131 6.428 -2.879 -12.301 1.00 0.00 H new ATOM 0 HB3 SER A 131 4.856 -2.123 -12.469 1.00 0.00 H new ATOM 0 HG SER A 131 7.312 -0.944 -11.604 1.00 0.00 H new TER 2000 SER A 131