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 78 SER OG : rot -110:sc= 1.33 USER MOD Set 1.2: A 80 CYS SG : rot 92:sc= -0.011 USER MOD Set 2.1: A 16 GLN : amide:sc= 1.72 K(o=5,f=-1.1!) USER MOD Set 2.2: A 40 SER OG : rot 180:sc= 1.01 USER MOD Set 2.3: A 60 GLN : amide:sc= 1.6 K(o=5,f=2.4) USER MOD Set 2.4: A 62 SER OG : rot 154:sc= 0.665 USER MOD Set 3.1: A 43 HIS : no HE2:sc= 0.104 K(o=0.72,f=-0.72) USER MOD Set 3.2: A 45 THR OG1 : rot 103:sc= 0.615 USER MOD Set 4.1: A 5 MET CE :methyl -161:sc= 0 (180deg=-1.08) USER MOD Set 4.2: A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 148:sc= 0.00657 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 169:sc= 1.27 (180deg=1.2) USER MOD Single : A 8 CYS SG : rot -170:sc= -0.209 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 1.94 K(o=1.9,f=-0.27) USER MOD Single : A 12 SER OG : rot 55:sc= 1.84 USER MOD Single : A 13 CYS SG : rot -160:sc= 0.205 USER MOD Single : A 15 SER OG : rot 180:sc= 0.0097 USER MOD Single : A 17 MET CE :methyl 149:sc= -0.204 (180deg=-1.54) USER MOD Single : A 23 LYS NZ :NH3+ 175:sc= 1.25 (180deg=1.13) USER MOD Single : A 24 THR OG1 : rot 80:sc= 0.835 USER MOD Single : A 29 LYS NZ :NH3+ 174:sc= 0.799 (180deg=0.778) USER MOD Single : A 33 THR OG1 : rot -160:sc= 0 USER MOD Single : A 34 SER OG : rot -87:sc= 1.26 USER MOD Single : A 35 CYS SG : rot 59:sc= -0.0307 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0121 USER MOD Single : A 49 MET CE :methyl -179:sc= -0.0614 (180deg=-0.0691) USER MOD Single : A 50 MET CE :methyl 142:sc=-0.00249 (180deg=-0.172) USER MOD Single : A 58 SER OG : rot -68:sc= 1.27 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 2.55 K(o=2.6,f=0.053) USER MOD Single : A 69 ASN : amide:sc= 0.978 K(o=0.98,f=-0.054) USER MOD Single : A 82 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc=-0.00687 K(o=-0.0069,f=-0.76) USER MOD Single : A 92 THR OG1 : rot -20:sc= 0.148 USER MOD Single : A 93 GLN : amide:sc= -0.587! C(o=-0.59!,f=-5.7!) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 2.1 K(o=2.1,f=-0.045) USER MOD Single : A 108 SER OG : rot 180:sc= -0.0172 USER MOD Single : A 114 THR OG1 : rot 72:sc= 1.25 USER MOD Single : A 118 GLN : amide:sc= 0.344 X(o=0.34,f=-0.019) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= 0.55 K(o=0.55,f=-0.12) USER MOD Single : A 129 LYS NZ :NH3+ -168:sc= 1.22 (180deg=1.22) USER MOD Single : A 131 SER OG : rot 72:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.791 2.116 1.713 1.00 0.00 N ATOM 2 CA MET A 1 3.881 1.896 0.232 1.00 0.00 C ATOM 3 C MET A 1 4.835 0.730 -0.100 1.00 0.00 C ATOM 4 O MET A 1 5.869 0.584 0.549 1.00 0.00 O ATOM 5 CB MET A 1 4.285 3.206 -0.504 1.00 0.00 C ATOM 6 CG MET A 1 4.387 3.071 -2.035 1.00 0.00 C ATOM 7 SD MET A 1 4.657 4.630 -2.929 1.00 0.00 S ATOM 8 CE MET A 1 2.975 5.314 -2.912 1.00 0.00 C ATOM 0 H1 MET A 1 3.636 3.126 1.905 1.00 0.00 H new ATOM 0 H2 MET A 1 2.998 1.565 2.098 1.00 0.00 H new ATOM 0 H3 MET A 1 4.677 1.810 2.164 1.00 0.00 H new ATOM 0 HA MET A 1 2.892 1.615 -0.130 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.556 3.981 -0.268 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.246 3.544 -0.117 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.204 2.389 -2.271 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.471 2.611 -2.406 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.968 6.276 -3.424 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.298 4.627 -3.420 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.648 5.450 -1.881 1.00 0.00 H new ATOM 18 N LYS A 2 4.519 -0.086 -1.126 1.00 0.00 N ATOM 19 CA LYS A 2 5.372 -1.200 -1.591 1.00 0.00 C ATOM 20 C LYS A 2 6.634 -0.700 -2.284 1.00 0.00 C ATOM 21 O LYS A 2 6.569 0.247 -3.069 1.00 0.00 O ATOM 22 CB LYS A 2 4.609 -2.137 -2.545 1.00 0.00 C ATOM 23 CG LYS A 2 3.432 -2.891 -1.906 1.00 0.00 C ATOM 24 CD LYS A 2 2.560 -3.541 -2.998 1.00 0.00 C ATOM 25 CE LYS A 2 1.569 -2.563 -3.659 1.00 0.00 C ATOM 26 NZ LYS A 2 0.328 -2.358 -2.850 1.00 0.00 N ATOM 0 H LYS A 2 3.656 0.010 -1.661 1.00 0.00 H new ATOM 0 HA LYS A 2 5.659 -1.756 -0.698 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.234 -1.551 -3.384 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.310 -2.865 -2.953 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.807 -3.656 -1.226 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.830 -2.204 -1.311 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.208 -3.963 -3.766 1.00 0.00 H new ATOM 0 HD3 LYS A 2 2.003 -4.370 -2.561 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.061 -1.602 -3.811 1.00 0.00 H new ATOM 0 HE3 LYS A 2 1.296 -2.941 -4.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.301 -1.692 -3.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.160 -3.268 -2.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.581 -1.971 -1.918 1.00 0.00 H new ATOM 40 N LYS A 3 7.744 -1.405 -2.076 1.00 0.00 N ATOM 41 CA LYS A 3 9.008 -1.189 -2.795 1.00 0.00 C ATOM 42 C LYS A 3 9.314 -2.357 -3.733 1.00 0.00 C ATOM 43 O LYS A 3 9.332 -3.513 -3.311 1.00 0.00 O ATOM 44 CB LYS A 3 10.110 -0.917 -1.765 1.00 0.00 C ATOM 45 CG LYS A 3 11.364 -0.253 -2.352 1.00 0.00 C ATOM 46 CD LYS A 3 12.408 0.066 -1.269 1.00 0.00 C ATOM 47 CE LYS A 3 11.864 1.020 -0.190 1.00 0.00 C ATOM 48 NZ LYS A 3 12.907 1.376 0.811 1.00 0.00 N ATOM 0 H LYS A 3 7.796 -2.158 -1.390 1.00 0.00 H new ATOM 0 HA LYS A 3 8.937 -0.317 -3.446 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.708 -0.279 -0.978 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.396 -1.859 -1.297 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.807 -0.911 -3.099 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.081 0.666 -2.865 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.734 -0.862 -0.799 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.286 0.513 -1.735 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.490 1.928 -0.663 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.019 0.552 0.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.564 2.156 1.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.113 0.549 1.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.774 1.672 0.319 1.00 0.00 H new ATOM 62 N VAL A 4 9.548 -2.039 -5.003 1.00 0.00 N ATOM 63 CA VAL A 4 9.884 -2.983 -6.078 1.00 0.00 C ATOM 64 C VAL A 4 11.401 -3.040 -6.269 1.00 0.00 C ATOM 65 O VAL A 4 11.995 -2.033 -6.647 1.00 0.00 O ATOM 66 CB VAL A 4 9.201 -2.589 -7.404 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.455 -3.640 -8.491 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.682 -2.436 -7.259 1.00 0.00 C ATOM 0 H VAL A 4 9.508 -1.074 -5.331 1.00 0.00 H new ATOM 0 HA VAL A 4 9.518 -3.968 -5.789 1.00 0.00 H new ATOM 0 HB VAL A 4 9.637 -1.630 -7.684 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.962 -3.335 -9.414 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.527 -3.731 -8.666 1.00 0.00 H new ATOM 0 HG13 VAL A 4 9.057 -4.602 -8.167 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.251 -2.158 -8.221 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.251 -3.381 -6.928 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.463 -1.660 -6.525 1.00 0.00 H new ATOM 78 N MET A 5 12.029 -4.199 -6.061 1.00 0.00 N ATOM 79 CA MET A 5 13.437 -4.409 -6.436 1.00 0.00 C ATOM 80 C MET A 5 13.514 -5.118 -7.785 1.00 0.00 C ATOM 81 O MET A 5 13.064 -6.257 -7.902 1.00 0.00 O ATOM 82 CB MET A 5 14.205 -5.213 -5.375 1.00 0.00 C ATOM 83 CG MET A 5 15.701 -5.322 -5.710 1.00 0.00 C ATOM 84 SD MET A 5 16.641 -3.772 -5.624 1.00 0.00 S ATOM 85 CE MET A 5 17.314 -3.919 -3.946 1.00 0.00 C ATOM 0 H MET A 5 11.586 -5.012 -5.633 1.00 0.00 H new ATOM 0 HA MET A 5 13.908 -3.429 -6.507 1.00 0.00 H new ATOM 0 HB2 MET A 5 14.085 -4.737 -4.402 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.777 -6.212 -5.297 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.156 -6.040 -5.028 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.801 -5.731 -6.716 1.00 0.00 H new ATOM 0 HE1 MET A 5 17.629 -2.937 -3.593 1.00 0.00 H new ATOM 0 HE2 MET A 5 16.548 -4.315 -3.280 1.00 0.00 H new ATOM 0 HE3 MET A 5 18.171 -4.593 -3.955 1.00 0.00 H new ATOM 95 N PHE A 6 14.131 -4.490 -8.781 1.00 0.00 N ATOM 96 CA PHE A 6 14.463 -5.135 -10.049 1.00 0.00 C ATOM 97 C PHE A 6 15.861 -5.764 -9.979 1.00 0.00 C ATOM 98 O PHE A 6 16.832 -5.070 -9.680 1.00 0.00 O ATOM 99 CB PHE A 6 14.315 -4.127 -11.192 1.00 0.00 C ATOM 100 CG PHE A 6 12.872 -3.736 -11.452 1.00 0.00 C ATOM 101 CD1 PHE A 6 12.014 -4.649 -12.090 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.380 -2.479 -11.052 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.678 -4.301 -12.356 1.00 0.00 C ATOM 104 CE2 PHE A 6 11.046 -2.128 -11.334 1.00 0.00 C ATOM 105 CZ PHE A 6 10.201 -3.030 -12.008 1.00 0.00 C ATOM 0 H PHE A 6 14.417 -3.512 -8.732 1.00 0.00 H new ATOM 0 HA PHE A 6 13.768 -5.951 -10.247 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.892 -3.232 -10.958 1.00 0.00 H new ATOM 0 HB3 PHE A 6 14.741 -4.551 -12.101 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.383 -5.623 -12.377 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.024 -1.786 -10.531 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.019 -5.014 -12.829 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.669 -1.162 -11.032 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.190 -2.744 -12.256 1.00 0.00 H new ATOM 115 N VAL A 7 15.983 -7.067 -10.251 1.00 0.00 N ATOM 116 CA VAL A 7 17.234 -7.839 -10.083 1.00 0.00 C ATOM 117 C VAL A 7 17.689 -8.522 -11.376 1.00 0.00 C ATOM 118 O VAL A 7 16.876 -8.963 -12.184 1.00 0.00 O ATOM 119 CB VAL A 7 17.183 -8.815 -8.884 1.00 0.00 C ATOM 120 CG1 VAL A 7 16.851 -8.082 -7.582 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.169 -9.949 -9.039 1.00 0.00 C ATOM 0 H VAL A 7 15.208 -7.630 -10.600 1.00 0.00 H new ATOM 0 HA VAL A 7 18.003 -7.105 -9.841 1.00 0.00 H new ATOM 0 HB VAL A 7 18.182 -9.249 -8.854 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.823 -8.796 -6.759 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.614 -7.330 -7.383 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.879 -7.597 -7.675 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.198 -10.586 -8.155 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.169 -9.530 -9.152 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.416 -10.540 -9.921 1.00 0.00 H new ATOM 131 N CYS A 8 19.004 -8.598 -11.588 1.00 0.00 N ATOM 132 CA CYS A 8 19.641 -9.243 -12.746 1.00 0.00 C ATOM 133 C CYS A 8 20.987 -9.850 -12.319 1.00 0.00 C ATOM 134 O CYS A 8 21.490 -9.498 -11.257 1.00 0.00 O ATOM 135 CB CYS A 8 19.792 -8.184 -13.854 1.00 0.00 C ATOM 136 SG CYS A 8 20.346 -8.955 -15.402 1.00 0.00 S ATOM 0 H CYS A 8 19.681 -8.200 -10.938 1.00 0.00 H new ATOM 0 HA CYS A 8 19.035 -10.062 -13.133 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.840 -7.678 -14.014 1.00 0.00 H new ATOM 0 HB3 CYS A 8 20.509 -7.424 -13.543 1.00 0.00 H new ATOM 0 HG CYS A 8 20.667 -8.030 -16.257 1.00 0.00 H new ATOM 142 N LYS A 9 21.597 -10.748 -13.099 1.00 0.00 N ATOM 143 CA LYS A 9 22.859 -11.402 -12.696 1.00 0.00 C ATOM 144 C LYS A 9 24.080 -10.464 -12.771 1.00 0.00 C ATOM 145 O LYS A 9 24.778 -10.293 -11.774 1.00 0.00 O ATOM 146 CB LYS A 9 23.030 -12.706 -13.503 1.00 0.00 C ATOM 147 CG LYS A 9 24.182 -13.571 -12.965 1.00 0.00 C ATOM 148 CD LYS A 9 24.329 -14.876 -13.762 1.00 0.00 C ATOM 149 CE LYS A 9 25.516 -15.689 -13.224 1.00 0.00 C ATOM 150 NZ LYS A 9 25.722 -16.950 -13.997 1.00 0.00 N ATOM 0 H LYS A 9 21.244 -11.042 -14.010 1.00 0.00 H new ATOM 0 HA LYS A 9 22.798 -11.660 -11.639 1.00 0.00 H new ATOM 0 HB2 LYS A 9 22.102 -13.277 -13.470 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.217 -12.463 -14.549 1.00 0.00 H new ATOM 0 HG2 LYS A 9 25.114 -13.008 -13.013 1.00 0.00 H new ATOM 0 HG3 LYS A 9 24.004 -13.803 -11.915 1.00 0.00 H new ATOM 0 HD2 LYS A 9 23.413 -15.462 -13.688 1.00 0.00 H new ATOM 0 HD3 LYS A 9 24.480 -14.652 -14.818 1.00 0.00 H new ATOM 0 HE2 LYS A 9 26.421 -15.083 -13.269 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.345 -15.930 -12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 26.532 -17.470 -13.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.868 -17.540 -13.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.910 -16.720 -14.994 1.00 0.00 H new ATOM 164 N ARG A 10 24.315 -9.878 -13.951 1.00 0.00 N ATOM 165 CA ARG A 10 25.532 -9.118 -14.349 1.00 0.00 C ATOM 166 C ARG A 10 25.230 -7.953 -15.316 1.00 0.00 C ATOM 167 O ARG A 10 24.105 -7.785 -15.779 1.00 0.00 O ATOM 168 CB ARG A 10 26.489 -10.137 -15.033 1.00 0.00 C ATOM 169 CG ARG A 10 27.339 -10.991 -14.078 1.00 0.00 C ATOM 170 CD ARG A 10 28.611 -10.269 -13.616 1.00 0.00 C ATOM 171 NE ARG A 10 29.446 -11.168 -12.798 1.00 0.00 N ATOM 172 CZ ARG A 10 30.724 -11.030 -12.495 1.00 0.00 C ATOM 173 NH1 ARG A 10 31.459 -10.062 -12.968 1.00 0.00 N ATOM 174 NH2 ARG A 10 31.297 -11.876 -11.690 1.00 0.00 N ATOM 0 H ARG A 10 23.629 -9.917 -14.705 1.00 0.00 H new ATOM 0 HA ARG A 10 25.974 -8.662 -13.463 1.00 0.00 H new ATOM 0 HB2 ARG A 10 25.895 -10.804 -15.658 1.00 0.00 H new ATOM 0 HB3 ARG A 10 27.159 -9.591 -15.697 1.00 0.00 H new ATOM 0 HG2 ARG A 10 26.741 -11.260 -13.207 1.00 0.00 H new ATOM 0 HG3 ARG A 10 27.614 -11.921 -14.575 1.00 0.00 H new ATOM 0 HD2 ARG A 10 29.176 -9.926 -14.482 1.00 0.00 H new ATOM 0 HD3 ARG A 10 28.345 -9.384 -13.038 1.00 0.00 H new ATOM 0 HE ARG A 10 28.981 -11.994 -12.422 1.00 0.00 H new ATOM 0 HH11 ARG A 10 31.050 -9.373 -13.599 1.00 0.00 H new ATOM 0 HH12 ARG A 10 32.443 -9.994 -12.707 1.00 0.00 H new ATOM 0 HH21 ARG A 10 30.759 -12.646 -11.293 1.00 0.00 H new ATOM 0 HH22 ARG A 10 32.284 -11.769 -11.456 1.00 0.00 H new ATOM 188 N ASN A 11 26.282 -7.211 -15.674 1.00 0.00 N ATOM 189 CA ASN A 11 26.350 -6.186 -16.731 1.00 0.00 C ATOM 190 C ASN A 11 25.405 -4.976 -16.574 1.00 0.00 C ATOM 191 O ASN A 11 25.446 -4.299 -15.546 1.00 0.00 O ATOM 192 CB ASN A 11 26.341 -6.894 -18.110 1.00 0.00 C ATOM 193 CG ASN A 11 26.900 -6.026 -19.236 1.00 0.00 C ATOM 194 OD1 ASN A 11 27.979 -5.468 -19.129 1.00 0.00 O ATOM 195 ND2 ASN A 11 26.198 -5.874 -20.331 1.00 0.00 N ATOM 0 H ASN A 11 27.179 -7.316 -15.199 1.00 0.00 H new ATOM 0 HA ASN A 11 27.299 -5.660 -16.630 1.00 0.00 H new ATOM 0 HB2 ASN A 11 26.925 -7.812 -18.044 1.00 0.00 H new ATOM 0 HB3 ASN A 11 25.319 -7.183 -18.356 1.00 0.00 H new ATOM 0 HD21 ASN A 11 26.554 -5.291 -21.089 1.00 0.00 H new ATOM 0 HD22 ASN A 11 25.295 -6.338 -20.426 1.00 0.00 H new ATOM 202 N SER A 12 24.615 -4.643 -17.604 1.00 0.00 N ATOM 203 CA SER A 12 23.832 -3.402 -17.701 1.00 0.00 C ATOM 204 C SER A 12 22.427 -3.615 -18.291 1.00 0.00 C ATOM 205 O SER A 12 21.957 -4.746 -18.430 1.00 0.00 O ATOM 206 CB SER A 12 24.647 -2.386 -18.516 1.00 0.00 C ATOM 207 OG SER A 12 24.136 -1.089 -18.259 1.00 0.00 O ATOM 0 H SER A 12 24.499 -5.247 -18.417 1.00 0.00 H new ATOM 0 HA SER A 12 23.654 -3.021 -16.695 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.701 -2.439 -18.242 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.582 -2.615 -19.580 1.00 0.00 H new ATOM 0 HG SER A 12 24.144 -0.920 -17.294 1.00 0.00 H new ATOM 213 N CYS A 13 21.737 -2.505 -18.604 1.00 0.00 N ATOM 214 CA CYS A 13 20.331 -2.449 -19.019 1.00 0.00 C ATOM 215 C CYS A 13 19.447 -3.230 -18.021 1.00 0.00 C ATOM 216 O CYS A 13 19.509 -2.943 -16.829 1.00 0.00 O ATOM 217 CB CYS A 13 20.262 -2.831 -20.512 1.00 0.00 C ATOM 218 SG CYS A 13 18.604 -2.485 -21.181 1.00 0.00 S ATOM 0 H CYS A 13 22.168 -1.581 -18.572 1.00 0.00 H new ATOM 0 HA CYS A 13 19.899 -1.449 -18.970 1.00 0.00 H new ATOM 0 HB2 CYS A 13 21.011 -2.271 -21.072 1.00 0.00 H new ATOM 0 HB3 CYS A 13 20.497 -3.888 -20.634 1.00 0.00 H new ATOM 0 HG CYS A 13 18.423 -3.173 -22.269 1.00 0.00 H new ATOM 224 N ARG A 14 18.598 -4.158 -18.480 1.00 0.00 N ATOM 225 CA ARG A 14 17.844 -5.145 -17.669 1.00 0.00 C ATOM 226 C ARG A 14 17.291 -4.600 -16.342 1.00 0.00 C ATOM 227 O ARG A 14 16.308 -3.872 -16.378 1.00 0.00 O ATOM 228 CB ARG A 14 18.654 -6.462 -17.583 1.00 0.00 C ATOM 229 CG ARG A 14 18.847 -7.087 -18.980 1.00 0.00 C ATOM 230 CD ARG A 14 19.559 -8.442 -18.956 1.00 0.00 C ATOM 231 NE ARG A 14 21.021 -8.304 -18.765 1.00 0.00 N ATOM 232 CZ ARG A 14 21.885 -9.296 -18.634 1.00 0.00 C ATOM 233 NH1 ARG A 14 21.513 -10.509 -18.340 1.00 0.00 N ATOM 234 NH2 ARG A 14 23.147 -9.083 -18.844 1.00 0.00 N ATOM 0 H ARG A 14 18.403 -4.253 -19.477 1.00 0.00 H new ATOM 0 HA ARG A 14 16.913 -5.380 -18.185 1.00 0.00 H new ATOM 0 HB2 ARG A 14 19.626 -6.266 -17.131 1.00 0.00 H new ATOM 0 HB3 ARG A 14 18.138 -7.169 -16.933 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.872 -7.207 -19.452 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.419 -6.397 -19.601 1.00 0.00 H new ATOM 0 HD2 ARG A 14 19.146 -9.053 -18.154 1.00 0.00 H new ATOM 0 HD3 ARG A 14 19.365 -8.969 -19.890 1.00 0.00 H new ATOM 0 HE ARG A 14 21.396 -7.356 -18.731 1.00 0.00 H new ATOM 0 HH11 ARG A 14 20.525 -10.720 -18.202 1.00 0.00 H new ATOM 0 HH12 ARG A 14 22.210 -11.248 -18.247 1.00 0.00 H new ATOM 0 HH21 ARG A 14 23.470 -8.153 -19.109 1.00 0.00 H new ATOM 0 HH22 ARG A 14 23.817 -9.846 -18.744 1.00 0.00 H new ATOM 248 N SER A 15 17.892 -4.886 -15.184 1.00 0.00 N ATOM 249 CA SER A 15 17.407 -4.419 -13.865 1.00 0.00 C ATOM 250 C SER A 15 17.447 -2.899 -13.720 1.00 0.00 C ATOM 251 O SER A 15 16.466 -2.290 -13.296 1.00 0.00 O ATOM 252 CB SER A 15 18.232 -5.058 -12.745 1.00 0.00 C ATOM 253 OG SER A 15 19.603 -4.950 -13.084 1.00 0.00 O ATOM 0 H SER A 15 18.738 -5.453 -15.126 1.00 0.00 H new ATOM 0 HA SER A 15 16.364 -4.726 -13.790 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.035 -4.559 -11.796 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.954 -6.104 -12.618 1.00 0.00 H new ATOM 0 HG SER A 15 20.148 -5.353 -12.376 1.00 0.00 H new ATOM 259 N GLN A 16 18.546 -2.274 -14.145 1.00 0.00 N ATOM 260 CA GLN A 16 18.699 -0.813 -14.161 1.00 0.00 C ATOM 261 C GLN A 16 17.686 -0.151 -15.103 1.00 0.00 C ATOM 262 O GLN A 16 17.127 0.895 -14.779 1.00 0.00 O ATOM 263 CB GLN A 16 20.138 -0.460 -14.592 1.00 0.00 C ATOM 264 CG GLN A 16 21.240 -0.969 -13.637 1.00 0.00 C ATOM 265 CD GLN A 16 21.300 -0.207 -12.313 1.00 0.00 C ATOM 266 OE1 GLN A 16 20.779 0.890 -12.175 1.00 0.00 O ATOM 267 NE2 GLN A 16 21.967 -0.733 -11.312 1.00 0.00 N ATOM 0 H GLN A 16 19.366 -2.771 -14.492 1.00 0.00 H new ATOM 0 HA GLN A 16 18.508 -0.433 -13.157 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.317 -0.873 -15.585 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.222 0.623 -14.677 1.00 0.00 H new ATOM 0 HG2 GLN A 16 21.071 -2.026 -13.431 1.00 0.00 H new ATOM 0 HG3 GLN A 16 22.206 -0.891 -14.136 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.406 -1.648 -11.416 1.00 0.00 H new ATOM 0 HE22 GLN A 16 22.046 -0.227 -10.430 1.00 0.00 H new ATOM 276 N MET A 17 17.395 -0.788 -16.243 1.00 0.00 N ATOM 277 CA MET A 17 16.422 -0.279 -17.222 1.00 0.00 C ATOM 278 C MET A 17 14.976 -0.463 -16.764 1.00 0.00 C ATOM 279 O MET A 17 14.153 0.423 -16.983 1.00 0.00 O ATOM 280 CB MET A 17 16.656 -0.949 -18.587 1.00 0.00 C ATOM 281 CG MET A 17 16.077 -0.116 -19.734 1.00 0.00 C ATOM 282 SD MET A 17 16.965 1.451 -19.902 1.00 0.00 S ATOM 283 CE MET A 17 15.700 2.663 -19.434 1.00 0.00 C ATOM 0 H MET A 17 17.826 -1.671 -16.515 1.00 0.00 H new ATOM 0 HA MET A 17 16.580 0.795 -17.315 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.725 -1.091 -18.744 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.199 -1.939 -18.590 1.00 0.00 H new ATOM 0 HG2 MET A 17 16.142 -0.678 -20.666 1.00 0.00 H new ATOM 0 HG3 MET A 17 15.020 0.078 -19.551 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.177 3.525 -18.968 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.158 2.985 -20.323 1.00 0.00 H new ATOM 0 HE3 MET A 17 15.004 2.209 -18.729 1.00 0.00 H new ATOM 293 N ALA A 18 14.681 -1.578 -16.093 1.00 0.00 N ATOM 294 CA ALA A 18 13.398 -1.824 -15.448 1.00 0.00 C ATOM 295 C ALA A 18 13.132 -0.748 -14.385 1.00 0.00 C ATOM 296 O ALA A 18 12.066 -0.142 -14.403 1.00 0.00 O ATOM 297 CB ALA A 18 13.400 -3.245 -14.885 1.00 0.00 C ATOM 0 H ALA A 18 15.342 -2.347 -15.983 1.00 0.00 H new ATOM 0 HA ALA A 18 12.578 -1.754 -16.163 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.445 -3.445 -14.398 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.550 -3.958 -15.696 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.206 -3.347 -14.158 1.00 0.00 H new ATOM 303 N GLU A 19 14.123 -0.391 -13.554 1.00 0.00 N ATOM 304 CA GLU A 19 13.992 0.777 -12.669 1.00 0.00 C ATOM 305 C GLU A 19 13.763 2.068 -13.462 1.00 0.00 C ATOM 306 O GLU A 19 12.868 2.823 -13.107 1.00 0.00 O ATOM 307 CB GLU A 19 15.194 0.939 -11.732 1.00 0.00 C ATOM 308 CG GLU A 19 14.904 1.970 -10.627 1.00 0.00 C ATOM 309 CD GLU A 19 16.180 2.455 -9.914 1.00 0.00 C ATOM 310 OE1 GLU A 19 17.008 1.603 -9.518 1.00 0.00 O ATOM 311 OE2 GLU A 19 16.324 3.688 -9.724 1.00 0.00 O ATOM 0 H GLU A 19 15.012 -0.886 -13.476 1.00 0.00 H new ATOM 0 HA GLU A 19 13.113 0.590 -12.052 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.439 -0.023 -11.281 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.066 1.253 -12.306 1.00 0.00 H new ATOM 0 HG2 GLU A 19 14.388 2.826 -11.062 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.228 1.530 -9.894 1.00 0.00 H new ATOM 318 N GLY A 20 14.491 2.307 -14.557 1.00 0.00 N ATOM 319 CA GLY A 20 14.343 3.511 -15.387 1.00 0.00 C ATOM 320 C GLY A 20 12.922 3.731 -15.909 1.00 0.00 C ATOM 321 O GLY A 20 12.327 4.782 -15.677 1.00 0.00 O ATOM 0 H GLY A 20 15.207 1.665 -14.897 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.645 4.382 -14.805 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.025 3.443 -16.235 1.00 0.00 H new ATOM 325 N PHE A 21 12.316 2.729 -16.555 1.00 0.00 N ATOM 326 CA PHE A 21 10.910 2.842 -16.975 1.00 0.00 C ATOM 327 C PHE A 21 9.963 2.860 -15.773 1.00 0.00 C ATOM 328 O PHE A 21 9.034 3.663 -15.741 1.00 0.00 O ATOM 329 CB PHE A 21 10.546 1.745 -17.991 1.00 0.00 C ATOM 330 CG PHE A 21 11.072 1.991 -19.383 1.00 0.00 C ATOM 331 CD1 PHE A 21 10.355 2.824 -20.260 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.253 1.368 -19.819 1.00 0.00 C ATOM 333 CE1 PHE A 21 10.826 3.050 -21.563 1.00 0.00 C ATOM 334 CE2 PHE A 21 12.725 1.594 -21.122 1.00 0.00 C ATOM 335 CZ PHE A 21 12.016 2.446 -21.988 1.00 0.00 C ATOM 0 H PHE A 21 12.764 1.845 -16.796 1.00 0.00 H new ATOM 0 HA PHE A 21 10.787 3.800 -17.481 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.932 0.791 -17.632 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.461 1.653 -18.036 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.439 3.291 -19.930 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.798 0.716 -19.153 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.272 3.688 -22.236 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.632 1.114 -21.459 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.390 2.635 -22.983 1.00 0.00 H new ATOM 345 N ALA A 22 10.213 2.061 -14.734 1.00 0.00 N ATOM 346 CA ALA A 22 9.346 2.000 -13.554 1.00 0.00 C ATOM 347 C ALA A 22 9.348 3.291 -12.718 1.00 0.00 C ATOM 348 O ALA A 22 8.302 3.671 -12.212 1.00 0.00 O ATOM 349 CB ALA A 22 9.730 0.773 -12.724 1.00 0.00 C ATOM 0 H ALA A 22 11.020 1.439 -14.686 1.00 0.00 H new ATOM 0 HA ALA A 22 8.316 1.903 -13.897 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.092 0.716 -11.842 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.601 -0.127 -13.324 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.772 0.855 -12.413 1.00 0.00 H new ATOM 355 N LYS A 23 10.457 4.034 -12.630 1.00 0.00 N ATOM 356 CA LYS A 23 10.512 5.341 -11.938 1.00 0.00 C ATOM 357 C LYS A 23 9.925 6.497 -12.761 1.00 0.00 C ATOM 358 O LYS A 23 9.585 7.536 -12.201 1.00 0.00 O ATOM 359 CB LYS A 23 11.936 5.614 -11.407 1.00 0.00 C ATOM 360 CG LYS A 23 12.969 6.045 -12.462 1.00 0.00 C ATOM 361 CD LYS A 23 14.419 5.973 -11.955 1.00 0.00 C ATOM 362 CE LYS A 23 14.656 6.713 -10.626 1.00 0.00 C ATOM 363 NZ LYS A 23 16.016 6.433 -10.082 1.00 0.00 N ATOM 0 H LYS A 23 11.349 3.751 -13.036 1.00 0.00 H new ATOM 0 HA LYS A 23 9.852 5.280 -11.072 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.877 6.390 -10.644 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.300 4.712 -10.916 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.867 5.410 -13.342 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.752 7.065 -12.778 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.698 4.927 -11.831 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.080 6.391 -12.714 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.538 7.786 -10.779 1.00 0.00 H new ATOM 0 HE3 LYS A 23 13.902 6.409 -9.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.176 7.011 -9.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.090 5.426 -9.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.732 6.667 -10.799 1.00 0.00 H new ATOM 377 N THR A 24 9.738 6.291 -14.070 1.00 0.00 N ATOM 378 CA THR A 24 9.057 7.245 -14.975 1.00 0.00 C ATOM 379 C THR A 24 7.540 6.994 -15.038 1.00 0.00 C ATOM 380 O THR A 24 6.757 7.935 -14.939 1.00 0.00 O ATOM 381 CB THR A 24 9.677 7.214 -16.382 1.00 0.00 C ATOM 382 OG1 THR A 24 11.090 7.294 -16.320 1.00 0.00 O ATOM 383 CG2 THR A 24 9.244 8.409 -17.233 1.00 0.00 C ATOM 0 H THR A 24 10.058 5.446 -14.544 1.00 0.00 H new ATOM 0 HA THR A 24 9.205 8.242 -14.560 1.00 0.00 H new ATOM 0 HB THR A 24 9.337 6.276 -16.822 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.458 6.414 -16.097 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.708 8.342 -18.217 1.00 0.00 H new ATOM 0 HG22 THR A 24 8.159 8.404 -17.342 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.556 9.334 -16.747 1.00 0.00 H new ATOM 391 N LEU A 25 7.112 5.728 -15.166 1.00 0.00 N ATOM 392 CA LEU A 25 5.698 5.332 -15.355 1.00 0.00 C ATOM 393 C LEU A 25 4.992 4.948 -14.045 1.00 0.00 C ATOM 394 O LEU A 25 3.785 5.127 -13.898 1.00 0.00 O ATOM 395 CB LEU A 25 5.639 4.166 -16.365 1.00 0.00 C ATOM 396 CG LEU A 25 6.357 4.430 -17.697 1.00 0.00 C ATOM 397 CD1 LEU A 25 6.275 3.188 -18.582 1.00 0.00 C ATOM 398 CD2 LEU A 25 5.768 5.609 -18.471 1.00 0.00 C ATOM 0 H LEU A 25 7.748 4.931 -15.141 1.00 0.00 H new ATOM 0 HA LEU A 25 5.160 6.199 -15.738 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.076 3.281 -15.902 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.594 3.935 -16.571 1.00 0.00 H new ATOM 0 HG LEU A 25 7.390 4.673 -17.448 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.785 3.379 -19.526 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.751 2.348 -18.076 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.230 2.949 -18.777 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.318 5.744 -19.402 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.720 5.410 -18.695 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.845 6.514 -17.869 1.00 0.00 H new ATOM 410 N GLY A 26 5.762 4.439 -13.081 1.00 0.00 N ATOM 411 CA GLY A 26 5.367 4.193 -11.689 1.00 0.00 C ATOM 412 C GLY A 26 5.512 5.408 -10.780 1.00 0.00 C ATOM 413 O GLY A 26 5.245 5.291 -9.584 1.00 0.00 O ATOM 0 H GLY A 26 6.730 4.172 -13.258 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.329 3.859 -11.670 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.971 3.379 -11.289 1.00 0.00 H new ATOM 417 N ALA A 27 5.926 6.564 -11.320 1.00 0.00 N ATOM 418 CA ALA A 27 6.076 7.811 -10.555 1.00 0.00 C ATOM 419 C ALA A 27 4.842 8.111 -9.668 1.00 0.00 C ATOM 420 O ALA A 27 3.736 8.330 -10.168 1.00 0.00 O ATOM 421 CB ALA A 27 6.345 8.957 -11.542 1.00 0.00 C ATOM 0 H ALA A 27 6.168 6.661 -12.306 1.00 0.00 H new ATOM 0 HA ALA A 27 6.917 7.704 -9.869 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.459 9.891 -10.992 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.258 8.750 -12.100 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.508 9.044 -12.235 1.00 0.00 H new ATOM 427 N GLY A 28 5.041 8.105 -8.343 1.00 0.00 N ATOM 428 CA GLY A 28 3.998 8.377 -7.338 1.00 0.00 C ATOM 429 C GLY A 28 3.030 7.222 -7.033 1.00 0.00 C ATOM 430 O GLY A 28 2.025 7.456 -6.357 1.00 0.00 O ATOM 0 H GLY A 28 5.951 7.907 -7.928 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.486 8.669 -6.408 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.414 9.234 -7.674 1.00 0.00 H new ATOM 434 N LYS A 29 3.295 5.990 -7.503 1.00 0.00 N ATOM 435 CA LYS A 29 2.391 4.824 -7.360 1.00 0.00 C ATOM 436 C LYS A 29 2.969 3.745 -6.446 1.00 0.00 C ATOM 437 O LYS A 29 2.260 3.138 -5.648 1.00 0.00 O ATOM 438 CB LYS A 29 2.113 4.217 -8.745 1.00 0.00 C ATOM 439 CG LYS A 29 1.431 5.206 -9.708 1.00 0.00 C ATOM 440 CD LYS A 29 1.262 4.611 -11.112 1.00 0.00 C ATOM 441 CE LYS A 29 0.738 5.685 -12.080 1.00 0.00 C ATOM 442 NZ LYS A 29 0.875 5.262 -13.505 1.00 0.00 N ATOM 0 H LYS A 29 4.157 5.768 -8.002 1.00 0.00 H new ATOM 0 HA LYS A 29 1.468 5.183 -6.904 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.052 3.880 -9.184 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.481 3.336 -8.630 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.455 5.484 -9.311 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.022 6.120 -9.769 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.216 4.223 -11.469 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.569 3.771 -11.079 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.310 5.891 -11.861 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.285 6.614 -11.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.420 5.965 -14.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.883 5.188 -13.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 0.418 4.338 -13.638 1.00 0.00 H new ATOM 456 N ILE A 30 4.275 3.522 -6.594 1.00 0.00 N ATOM 457 CA ILE A 30 5.103 2.557 -5.867 1.00 0.00 C ATOM 458 C ILE A 30 6.532 3.103 -5.722 1.00 0.00 C ATOM 459 O ILE A 30 6.942 3.991 -6.470 1.00 0.00 O ATOM 460 CB ILE A 30 5.108 1.156 -6.545 1.00 0.00 C ATOM 461 CG1 ILE A 30 4.707 1.080 -8.035 1.00 0.00 C ATOM 462 CG2 ILE A 30 4.202 0.202 -5.749 1.00 0.00 C ATOM 463 CD1 ILE A 30 5.720 1.748 -8.971 1.00 0.00 C ATOM 0 H ILE A 30 4.823 4.049 -7.274 1.00 0.00 H new ATOM 0 HA ILE A 30 4.668 2.422 -4.877 1.00 0.00 H new ATOM 0 HB ILE A 30 6.160 0.871 -6.531 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.594 0.034 -8.321 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.734 1.553 -8.167 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.203 -0.780 -6.222 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.574 0.114 -4.728 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.185 0.595 -5.732 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.377 1.658 -10.002 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.816 2.802 -8.711 1.00 0.00 H new ATOM 0 HD13 ILE A 30 6.689 1.259 -8.867 1.00 0.00 H new ATOM 475 N ALA A 31 7.300 2.544 -4.784 1.00 0.00 N ATOM 476 CA ALA A 31 8.740 2.811 -4.671 1.00 0.00 C ATOM 477 C ALA A 31 9.507 1.800 -5.533 1.00 0.00 C ATOM 478 O ALA A 31 9.087 0.649 -5.640 1.00 0.00 O ATOM 479 CB ALA A 31 9.151 2.795 -3.189 1.00 0.00 C ATOM 0 H ALA A 31 6.945 1.895 -4.082 1.00 0.00 H new ATOM 0 HA ALA A 31 8.988 3.803 -5.049 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.220 2.993 -3.106 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.596 3.563 -2.649 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.929 1.818 -2.760 1.00 0.00 H new ATOM 485 N VAL A 32 10.614 2.194 -6.167 1.00 0.00 N ATOM 486 CA VAL A 32 11.363 1.322 -7.097 1.00 0.00 C ATOM 487 C VAL A 32 12.882 1.446 -6.926 1.00 0.00 C ATOM 488 O VAL A 32 13.410 2.536 -6.695 1.00 0.00 O ATOM 489 CB VAL A 32 10.952 1.537 -8.568 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.440 1.382 -8.779 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.323 2.913 -9.118 1.00 0.00 C ATOM 0 H VAL A 32 11.022 3.122 -6.056 1.00 0.00 H new ATOM 0 HA VAL A 32 11.089 0.302 -6.828 1.00 0.00 H new ATOM 0 HB VAL A 32 11.508 0.766 -9.101 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.201 1.543 -9.830 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.133 0.378 -8.486 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.911 2.115 -8.170 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.002 2.988 -10.157 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.829 3.686 -8.529 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.403 3.048 -9.062 1.00 0.00 H new ATOM 501 N THR A 33 13.582 0.319 -7.061 1.00 0.00 N ATOM 502 CA THR A 33 15.039 0.179 -6.874 1.00 0.00 C ATOM 503 C THR A 33 15.569 -0.924 -7.800 1.00 0.00 C ATOM 504 O THR A 33 14.798 -1.779 -8.246 1.00 0.00 O ATOM 505 CB THR A 33 15.351 -0.187 -5.407 1.00 0.00 C ATOM 506 OG1 THR A 33 14.621 0.620 -4.503 1.00 0.00 O ATOM 507 CG2 THR A 33 16.822 -0.047 -5.013 1.00 0.00 C ATOM 0 H THR A 33 13.136 -0.563 -7.314 1.00 0.00 H new ATOM 0 HA THR A 33 15.523 1.125 -7.116 1.00 0.00 H new ATOM 0 HB THR A 33 15.066 -1.237 -5.344 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.053 0.599 -3.623 1.00 0.00 H new ATOM 0 HG21 THR A 33 16.946 -0.325 -3.966 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.430 -0.702 -5.637 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.140 0.986 -5.154 1.00 0.00 H new ATOM 515 N SER A 34 16.870 -0.949 -8.088 1.00 0.00 N ATOM 516 CA SER A 34 17.517 -2.023 -8.853 1.00 0.00 C ATOM 517 C SER A 34 18.857 -2.473 -8.271 1.00 0.00 C ATOM 518 O SER A 34 19.543 -1.729 -7.566 1.00 0.00 O ATOM 519 CB SER A 34 17.662 -1.650 -10.331 1.00 0.00 C ATOM 520 OG SER A 34 18.350 -0.431 -10.516 1.00 0.00 O ATOM 0 H SER A 34 17.516 -0.216 -7.794 1.00 0.00 H new ATOM 0 HA SER A 34 16.848 -2.880 -8.773 1.00 0.00 H new ATOM 0 HB2 SER A 34 18.193 -2.446 -10.853 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.673 -1.577 -10.783 1.00 0.00 H new ATOM 0 HG SER A 34 17.714 0.314 -10.470 1.00 0.00 H new ATOM 526 N CYS A 35 19.204 -3.732 -8.549 1.00 0.00 N ATOM 527 CA CYS A 35 20.362 -4.431 -7.994 1.00 0.00 C ATOM 528 C CYS A 35 20.859 -5.517 -8.969 1.00 0.00 C ATOM 529 O CYS A 35 20.085 -6.045 -9.771 1.00 0.00 O ATOM 530 CB CYS A 35 19.908 -5.008 -6.633 1.00 0.00 C ATOM 531 SG CYS A 35 21.060 -6.246 -5.971 1.00 0.00 S ATOM 0 H CYS A 35 18.665 -4.313 -9.191 1.00 0.00 H new ATOM 0 HA CYS A 35 21.211 -3.764 -7.847 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.805 -4.194 -5.915 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.923 -5.460 -6.746 1.00 0.00 H new ATOM 0 HG CYS A 35 22.233 -5.708 -5.815 1.00 0.00 H new ATOM 537 N GLY A 36 22.150 -5.851 -8.913 1.00 0.00 N ATOM 538 CA GLY A 36 22.730 -7.007 -9.604 1.00 0.00 C ATOM 539 C GLY A 36 23.176 -8.072 -8.597 1.00 0.00 C ATOM 540 O GLY A 36 23.745 -7.729 -7.564 1.00 0.00 O ATOM 0 H GLY A 36 22.834 -5.317 -8.377 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.997 -7.432 -10.290 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.582 -6.688 -10.205 1.00 0.00 H new ATOM 544 N LEU A 37 22.988 -9.366 -8.880 1.00 0.00 N ATOM 545 CA LEU A 37 23.426 -10.442 -7.968 1.00 0.00 C ATOM 546 C LEU A 37 24.954 -10.414 -7.774 1.00 0.00 C ATOM 547 O LEU A 37 25.437 -10.580 -6.657 1.00 0.00 O ATOM 548 CB LEU A 37 22.953 -11.826 -8.457 1.00 0.00 C ATOM 549 CG LEU A 37 21.486 -12.176 -8.134 1.00 0.00 C ATOM 550 CD1 LEU A 37 20.456 -11.460 -9.008 1.00 0.00 C ATOM 551 CD2 LEU A 37 21.266 -13.675 -8.319 1.00 0.00 C ATOM 0 H LEU A 37 22.536 -9.699 -9.732 1.00 0.00 H new ATOM 0 HA LEU A 37 22.960 -10.261 -6.999 1.00 0.00 H new ATOM 0 HB2 LEU A 37 23.092 -11.878 -9.537 1.00 0.00 H new ATOM 0 HB3 LEU A 37 23.596 -12.588 -8.016 1.00 0.00 H new ATOM 0 HG LEU A 37 21.334 -11.849 -7.105 1.00 0.00 H new ATOM 0 HD11 LEU A 37 19.452 -11.765 -8.712 1.00 0.00 H new ATOM 0 HD12 LEU A 37 20.559 -10.382 -8.883 1.00 0.00 H new ATOM 0 HD13 LEU A 37 20.621 -11.722 -10.053 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.229 -13.921 -8.091 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.486 -13.950 -9.351 1.00 0.00 H new ATOM 0 HD23 LEU A 37 21.926 -14.225 -7.648 1.00 0.00 H new ATOM 563 N GLU A 38 25.694 -10.108 -8.844 1.00 0.00 N ATOM 564 CA GLU A 38 27.137 -9.819 -8.839 1.00 0.00 C ATOM 565 C GLU A 38 27.407 -8.325 -9.151 1.00 0.00 C ATOM 566 O GLU A 38 28.410 -7.974 -9.775 1.00 0.00 O ATOM 567 CB GLU A 38 27.855 -10.775 -9.809 1.00 0.00 C ATOM 568 CG GLU A 38 27.670 -12.261 -9.460 1.00 0.00 C ATOM 569 CD GLU A 38 28.529 -13.119 -10.405 1.00 0.00 C ATOM 570 OE1 GLU A 38 28.119 -13.366 -11.563 1.00 0.00 O ATOM 571 OE2 GLU A 38 29.681 -13.463 -10.051 1.00 0.00 O ATOM 0 H GLU A 38 25.289 -10.052 -9.779 1.00 0.00 H new ATOM 0 HA GLU A 38 27.543 -9.994 -7.843 1.00 0.00 H new ATOM 0 HB2 GLU A 38 27.485 -10.599 -10.819 1.00 0.00 H new ATOM 0 HB3 GLU A 38 28.920 -10.542 -9.814 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.958 -12.441 -8.424 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.620 -12.539 -9.552 1.00 0.00 H new ATOM 578 N SER A 39 26.500 -7.441 -8.702 1.00 0.00 N ATOM 579 CA SER A 39 26.416 -6.008 -9.047 1.00 0.00 C ATOM 580 C SER A 39 26.118 -5.724 -10.537 1.00 0.00 C ATOM 581 O SER A 39 26.099 -6.622 -11.381 1.00 0.00 O ATOM 582 CB SER A 39 27.644 -5.246 -8.531 1.00 0.00 C ATOM 583 OG SER A 39 27.316 -3.874 -8.400 1.00 0.00 O ATOM 0 H SER A 39 25.765 -7.720 -8.053 1.00 0.00 H new ATOM 0 HA SER A 39 25.538 -5.624 -8.527 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.961 -5.650 -7.570 1.00 0.00 H new ATOM 0 HB3 SER A 39 28.480 -5.369 -9.220 1.00 0.00 H new ATOM 0 HG SER A 39 28.096 -3.381 -8.069 1.00 0.00 H new ATOM 589 N SER A 40 25.805 -4.464 -10.857 1.00 0.00 N ATOM 590 CA SER A 40 25.466 -3.976 -12.209 1.00 0.00 C ATOM 591 C SER A 40 25.859 -2.501 -12.420 1.00 0.00 C ATOM 592 O SER A 40 26.202 -1.789 -11.475 1.00 0.00 O ATOM 593 CB SER A 40 23.976 -4.216 -12.506 1.00 0.00 C ATOM 594 OG SER A 40 23.135 -3.532 -11.587 1.00 0.00 O ATOM 0 H SER A 40 25.778 -3.722 -10.157 1.00 0.00 H new ATOM 0 HA SER A 40 26.056 -4.550 -12.923 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.750 -3.885 -13.520 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.765 -5.285 -12.465 1.00 0.00 H new ATOM 0 HG SER A 40 22.197 -3.708 -11.809 1.00 0.00 H new ATOM 600 N ARG A 41 25.839 -2.033 -13.673 1.00 0.00 N ATOM 601 CA ARG A 41 26.218 -0.656 -14.074 1.00 0.00 C ATOM 602 C ARG A 41 25.261 -0.076 -15.095 1.00 0.00 C ATOM 603 O ARG A 41 24.425 -0.794 -15.632 1.00 0.00 O ATOM 604 CB ARG A 41 27.695 -0.643 -14.537 1.00 0.00 C ATOM 605 CG ARG A 41 27.971 -1.531 -15.769 1.00 0.00 C ATOM 606 CD ARG A 41 29.423 -1.414 -16.252 1.00 0.00 C ATOM 607 NE ARG A 41 30.392 -1.944 -15.266 1.00 0.00 N ATOM 608 CZ ARG A 41 31.711 -1.860 -15.332 1.00 0.00 C ATOM 609 NH1 ARG A 41 32.320 -1.289 -16.334 1.00 0.00 N ATOM 610 NH2 ARG A 41 32.455 -2.356 -14.384 1.00 0.00 N ATOM 0 H ARG A 41 25.552 -2.610 -14.464 1.00 0.00 H new ATOM 0 HA ARG A 41 26.136 0.004 -13.210 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.984 0.382 -14.768 1.00 0.00 H new ATOM 0 HB3 ARG A 41 28.327 -0.975 -13.713 1.00 0.00 H new ATOM 0 HG2 ARG A 41 27.754 -2.570 -15.522 1.00 0.00 H new ATOM 0 HG3 ARG A 41 27.297 -1.248 -16.577 1.00 0.00 H new ATOM 0 HD2 ARG A 41 29.534 -1.954 -17.193 1.00 0.00 H new ATOM 0 HD3 ARG A 41 29.652 -0.368 -16.456 1.00 0.00 H new ATOM 0 HE ARG A 41 30.003 -2.422 -14.453 1.00 0.00 H new ATOM 0 HH11 ARG A 41 31.778 -0.889 -17.100 1.00 0.00 H new ATOM 0 HH12 ARG A 41 33.339 -1.242 -16.352 1.00 0.00 H new ATOM 0 HH21 ARG A 41 32.021 -2.814 -13.582 1.00 0.00 H new ATOM 0 HH22 ARG A 41 33.471 -2.286 -14.444 1.00 0.00 H new ATOM 624 N VAL A 42 25.392 1.213 -15.390 1.00 0.00 N ATOM 625 CA VAL A 42 24.605 1.898 -16.427 1.00 0.00 C ATOM 626 C VAL A 42 25.485 2.249 -17.635 1.00 0.00 C ATOM 627 O VAL A 42 26.417 3.046 -17.552 1.00 0.00 O ATOM 628 CB VAL A 42 23.800 3.081 -15.855 1.00 0.00 C ATOM 629 CG1 VAL A 42 22.786 2.565 -14.828 1.00 0.00 C ATOM 630 CG2 VAL A 42 24.610 4.205 -15.205 1.00 0.00 C ATOM 0 H VAL A 42 26.054 1.825 -14.914 1.00 0.00 H new ATOM 0 HA VAL A 42 23.846 1.211 -16.802 1.00 0.00 H new ATOM 0 HB VAL A 42 23.328 3.528 -16.730 1.00 0.00 H new ATOM 0 HG11 VAL A 42 22.218 3.403 -14.425 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.105 1.863 -15.310 1.00 0.00 H new ATOM 0 HG13 VAL A 42 23.313 2.061 -14.018 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.933 4.978 -14.841 1.00 0.00 H new ATOM 0 HG22 VAL A 42 25.184 3.804 -14.370 1.00 0.00 H new ATOM 0 HG23 VAL A 42 25.290 4.635 -15.940 1.00 0.00 H new ATOM 640 N HIS A 43 25.203 1.594 -18.764 1.00 0.00 N ATOM 641 CA HIS A 43 25.947 1.725 -20.021 1.00 0.00 C ATOM 642 C HIS A 43 25.536 3.014 -20.761 1.00 0.00 C ATOM 643 O HIS A 43 24.334 3.250 -20.881 1.00 0.00 O ATOM 644 CB HIS A 43 25.679 0.457 -20.852 1.00 0.00 C ATOM 645 CG HIS A 43 26.339 0.464 -22.206 1.00 0.00 C ATOM 646 ND1 HIS A 43 27.714 0.547 -22.433 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.686 0.444 -23.402 1.00 0.00 C ATOM 648 CE1 HIS A 43 27.862 0.576 -23.768 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.664 0.523 -24.374 1.00 0.00 N ATOM 0 H HIS A 43 24.426 0.937 -18.831 1.00 0.00 H new ATOM 0 HA HIS A 43 27.018 1.812 -19.837 1.00 0.00 H new ATOM 0 HB2 HIS A 43 26.027 -0.412 -20.293 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.603 0.341 -20.984 1.00 0.00 H new ATOM 0 HD1 HIS A 43 28.453 0.579 -21.731 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.619 0.379 -23.558 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.810 0.634 -24.282 1.00 0.00 H new ATOM 657 N PRO A 44 26.455 3.841 -21.305 1.00 0.00 N ATOM 658 CA PRO A 44 26.104 5.119 -21.944 1.00 0.00 C ATOM 659 C PRO A 44 25.058 5.022 -23.060 1.00 0.00 C ATOM 660 O PRO A 44 24.150 5.849 -23.128 1.00 0.00 O ATOM 661 CB PRO A 44 27.428 5.693 -22.457 1.00 0.00 C ATOM 662 CG PRO A 44 28.435 5.162 -21.444 1.00 0.00 C ATOM 663 CD PRO A 44 27.905 3.758 -21.161 1.00 0.00 C ATOM 0 HA PRO A 44 25.616 5.765 -21.214 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.652 5.353 -23.468 1.00 0.00 H new ATOM 0 HB3 PRO A 44 27.415 6.783 -22.482 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.447 5.140 -21.850 1.00 0.00 H new ATOM 0 HG3 PRO A 44 28.466 5.774 -20.543 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.326 3.034 -21.858 1.00 0.00 H new ATOM 0 HD3 PRO A 44 28.180 3.432 -20.158 1.00 0.00 H new ATOM 671 N THR A 45 25.086 3.965 -23.879 1.00 0.00 N ATOM 672 CA THR A 45 24.049 3.744 -24.911 1.00 0.00 C ATOM 673 C THR A 45 22.680 3.465 -24.284 1.00 0.00 C ATOM 674 O THR A 45 21.673 3.933 -24.796 1.00 0.00 O ATOM 675 CB THR A 45 24.458 2.615 -25.877 1.00 0.00 C ATOM 676 OG1 THR A 45 25.813 2.747 -26.264 1.00 0.00 O ATOM 677 CG2 THR A 45 23.626 2.530 -27.152 1.00 0.00 C ATOM 0 H THR A 45 25.810 3.247 -23.853 1.00 0.00 H new ATOM 0 HA THR A 45 23.962 4.664 -25.488 1.00 0.00 H new ATOM 0 HB THR A 45 24.285 1.703 -25.305 1.00 0.00 H new ATOM 0 HG1 THR A 45 26.359 2.100 -25.770 1.00 0.00 H new ATOM 0 HG21 THR A 45 23.988 1.707 -27.768 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.581 2.358 -26.894 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.714 3.464 -27.707 1.00 0.00 H new ATOM 685 N ALA A 46 22.612 2.822 -23.112 1.00 0.00 N ATOM 686 CA ALA A 46 21.359 2.661 -22.364 1.00 0.00 C ATOM 687 C ALA A 46 20.880 3.946 -21.664 1.00 0.00 C ATOM 688 O ALA A 46 19.799 3.961 -21.091 1.00 0.00 O ATOM 689 CB ALA A 46 21.475 1.457 -21.415 1.00 0.00 C ATOM 0 H ALA A 46 23.421 2.400 -22.657 1.00 0.00 H new ATOM 0 HA ALA A 46 20.568 2.455 -23.084 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.544 1.339 -20.861 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.669 0.554 -21.994 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.295 1.622 -20.716 1.00 0.00 H new ATOM 695 N ILE A 47 21.662 5.027 -21.686 1.00 0.00 N ATOM 696 CA ILE A 47 21.192 6.360 -21.282 1.00 0.00 C ATOM 697 C ILE A 47 20.574 6.996 -22.543 1.00 0.00 C ATOM 698 O ILE A 47 19.382 7.303 -22.589 1.00 0.00 O ATOM 699 CB ILE A 47 22.339 7.202 -20.670 1.00 0.00 C ATOM 700 CG1 ILE A 47 23.021 6.459 -19.494 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.782 8.562 -20.203 1.00 0.00 C ATOM 702 CD1 ILE A 47 24.255 7.171 -18.926 1.00 0.00 C ATOM 0 H ILE A 47 22.638 5.007 -21.983 1.00 0.00 H new ATOM 0 HA ILE A 47 20.444 6.304 -20.491 1.00 0.00 H new ATOM 0 HB ILE A 47 23.098 7.364 -21.435 1.00 0.00 H new ATOM 0 HG12 ILE A 47 22.293 6.325 -18.694 1.00 0.00 H new ATOM 0 HG13 ILE A 47 23.313 5.464 -19.829 1.00 0.00 H new ATOM 0 HG21 ILE A 47 22.588 9.156 -19.772 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.355 9.092 -21.054 1.00 0.00 H new ATOM 0 HG23 ILE A 47 21.009 8.400 -19.452 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.670 6.583 -18.107 1.00 0.00 H new ATOM 0 HD12 ILE A 47 25.004 7.281 -19.710 1.00 0.00 H new ATOM 0 HD13 ILE A 47 23.969 8.156 -18.557 1.00 0.00 H new ATOM 714 N ALA A 48 21.358 7.076 -23.625 1.00 0.00 N ATOM 715 CA ALA A 48 20.993 7.818 -24.835 1.00 0.00 C ATOM 716 C ALA A 48 19.824 7.193 -25.623 1.00 0.00 C ATOM 717 O ALA A 48 18.961 7.918 -26.122 1.00 0.00 O ATOM 718 CB ALA A 48 22.248 7.948 -25.709 1.00 0.00 C ATOM 0 H ALA A 48 22.270 6.624 -23.684 1.00 0.00 H new ATOM 0 HA ALA A 48 20.627 8.799 -24.533 1.00 0.00 H new ATOM 0 HB1 ALA A 48 22.003 8.498 -26.618 1.00 0.00 H new ATOM 0 HB2 ALA A 48 23.021 8.484 -25.158 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.612 6.955 -25.972 1.00 0.00 H new ATOM 724 N MET A 49 19.736 5.856 -25.672 1.00 0.00 N ATOM 725 CA MET A 49 18.644 5.131 -26.343 1.00 0.00 C ATOM 726 C MET A 49 17.308 5.176 -25.591 1.00 0.00 C ATOM 727 O MET A 49 16.316 4.637 -26.072 1.00 0.00 O ATOM 728 CB MET A 49 19.049 3.680 -26.652 1.00 0.00 C ATOM 729 CG MET A 49 20.241 3.558 -27.607 1.00 0.00 C ATOM 730 SD MET A 49 20.168 4.479 -29.171 1.00 0.00 S ATOM 731 CE MET A 49 18.613 3.855 -29.855 1.00 0.00 C ATOM 0 H MET A 49 20.427 5.240 -25.243 1.00 0.00 H new ATOM 0 HA MET A 49 18.476 5.662 -27.280 1.00 0.00 H new ATOM 0 HB2 MET A 49 19.291 3.174 -25.718 1.00 0.00 H new ATOM 0 HB3 MET A 49 18.195 3.159 -27.084 1.00 0.00 H new ATOM 0 HG2 MET A 49 21.134 3.878 -27.071 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.373 2.503 -27.845 1.00 0.00 H new ATOM 0 HE1 MET A 49 18.434 4.313 -30.828 1.00 0.00 H new ATOM 0 HE2 MET A 49 18.674 2.773 -29.969 1.00 0.00 H new ATOM 0 HE3 MET A 49 17.793 4.103 -29.181 1.00 0.00 H new ATOM 741 N MET A 50 17.276 5.817 -24.420 1.00 0.00 N ATOM 742 CA MET A 50 16.121 5.845 -23.516 1.00 0.00 C ATOM 743 C MET A 50 15.652 7.285 -23.258 1.00 0.00 C ATOM 744 O MET A 50 14.455 7.520 -23.115 1.00 0.00 O ATOM 745 CB MET A 50 16.474 5.097 -22.224 1.00 0.00 C ATOM 746 CG MET A 50 17.234 3.790 -22.466 1.00 0.00 C ATOM 747 SD MET A 50 16.357 2.519 -23.398 1.00 0.00 S ATOM 748 CE MET A 50 17.701 1.324 -23.644 1.00 0.00 C ATOM 0 H MET A 50 18.073 6.345 -24.064 1.00 0.00 H new ATOM 0 HA MET A 50 15.278 5.335 -23.982 1.00 0.00 H new ATOM 0 HB2 MET A 50 17.077 5.747 -21.590 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.557 4.879 -21.677 1.00 0.00 H new ATOM 0 HG2 MET A 50 18.159 4.024 -22.993 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.515 3.373 -21.499 1.00 0.00 H new ATOM 0 HE1 MET A 50 17.308 0.311 -23.558 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.134 1.462 -24.635 1.00 0.00 H new ATOM 0 HE3 MET A 50 18.470 1.480 -22.887 1.00 0.00 H new ATOM 758 N GLU A 51 16.561 8.266 -23.317 1.00 0.00 N ATOM 759 CA GLU A 51 16.209 9.698 -23.312 1.00 0.00 C ATOM 760 C GLU A 51 15.283 10.069 -24.491 1.00 0.00 C ATOM 761 O GLU A 51 14.447 10.966 -24.366 1.00 0.00 O ATOM 762 CB GLU A 51 17.486 10.556 -23.396 1.00 0.00 C ATOM 763 CG GLU A 51 18.270 10.617 -22.082 1.00 0.00 C ATOM 764 CD GLU A 51 19.500 11.535 -22.232 1.00 0.00 C ATOM 765 OE1 GLU A 51 20.501 11.122 -22.867 1.00 0.00 O ATOM 766 OE2 GLU A 51 19.472 12.685 -21.727 1.00 0.00 O ATOM 0 H GLU A 51 17.565 8.092 -23.370 1.00 0.00 H new ATOM 0 HA GLU A 51 15.678 9.895 -22.381 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.132 10.155 -24.177 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.215 11.568 -23.695 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.627 10.988 -21.284 1.00 0.00 H new ATOM 0 HG3 GLU A 51 18.589 9.615 -21.795 1.00 0.00 H new ATOM 773 N GLU A 52 15.358 9.332 -25.609 1.00 0.00 N ATOM 774 CA GLU A 52 14.471 9.492 -26.781 1.00 0.00 C ATOM 775 C GLU A 52 13.000 9.114 -26.509 1.00 0.00 C ATOM 776 O GLU A 52 12.112 9.497 -27.273 1.00 0.00 O ATOM 777 CB GLU A 52 15.029 8.702 -27.979 1.00 0.00 C ATOM 778 CG GLU A 52 15.179 7.197 -27.701 1.00 0.00 C ATOM 779 CD GLU A 52 15.605 6.406 -28.948 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.537 6.828 -29.672 1.00 0.00 O ATOM 781 OE2 GLU A 52 14.991 5.348 -29.229 1.00 0.00 O ATOM 0 H GLU A 52 16.049 8.592 -25.731 1.00 0.00 H new ATOM 0 HA GLU A 52 14.460 10.556 -27.016 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.370 8.842 -28.836 1.00 0.00 H new ATOM 0 HB3 GLU A 52 16.001 9.112 -28.254 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.916 7.049 -26.912 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.232 6.803 -27.331 1.00 0.00 H new ATOM 788 N VAL A 53 12.736 8.396 -25.408 1.00 0.00 N ATOM 789 CA VAL A 53 11.397 8.097 -24.863 1.00 0.00 C ATOM 790 C VAL A 53 11.246 8.650 -23.425 1.00 0.00 C ATOM 791 O VAL A 53 10.421 8.203 -22.631 1.00 0.00 O ATOM 792 CB VAL A 53 11.034 6.613 -25.122 1.00 0.00 C ATOM 793 CG1 VAL A 53 11.955 5.605 -24.425 1.00 0.00 C ATOM 794 CG2 VAL A 53 9.577 6.251 -24.812 1.00 0.00 C ATOM 0 H VAL A 53 13.482 7.988 -24.845 1.00 0.00 H new ATOM 0 HA VAL A 53 10.615 8.638 -25.397 1.00 0.00 H new ATOM 0 HB VAL A 53 11.185 6.529 -26.198 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.629 4.592 -24.660 1.00 0.00 H new ATOM 0 HG12 VAL A 53 12.979 5.747 -24.772 1.00 0.00 H new ATOM 0 HG13 VAL A 53 11.913 5.759 -23.347 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.412 5.194 -25.022 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.369 6.449 -23.761 1.00 0.00 H new ATOM 0 HG23 VAL A 53 8.913 6.852 -25.433 1.00 0.00 H new ATOM 804 N GLY A 54 12.038 9.683 -23.097 1.00 0.00 N ATOM 805 CA GLY A 54 11.928 10.495 -21.877 1.00 0.00 C ATOM 806 C GLY A 54 12.489 9.866 -20.593 1.00 0.00 C ATOM 807 O GLY A 54 12.214 10.379 -19.506 1.00 0.00 O ATOM 0 H GLY A 54 12.803 9.987 -23.699 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.441 11.442 -22.048 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.876 10.728 -21.714 1.00 0.00 H new ATOM 811 N ILE A 55 13.249 8.770 -20.690 1.00 0.00 N ATOM 812 CA ILE A 55 13.783 8.027 -19.536 1.00 0.00 C ATOM 813 C ILE A 55 15.190 8.506 -19.163 1.00 0.00 C ATOM 814 O ILE A 55 15.971 8.925 -20.017 1.00 0.00 O ATOM 815 CB ILE A 55 13.793 6.501 -19.787 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.570 5.976 -20.560 1.00 0.00 C ATOM 817 CG2 ILE A 55 13.944 5.700 -18.483 1.00 0.00 C ATOM 818 CD1 ILE A 55 11.214 6.190 -19.876 1.00 0.00 C ATOM 0 H ILE A 55 13.517 8.365 -21.587 1.00 0.00 H new ATOM 0 HA ILE A 55 13.114 8.229 -18.700 1.00 0.00 H new ATOM 0 HB ILE A 55 14.667 6.346 -20.419 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.545 6.459 -21.537 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.704 4.909 -20.736 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.946 4.634 -18.709 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.882 5.969 -17.997 1.00 0.00 H new ATOM 0 HG23 ILE A 55 13.112 5.928 -17.817 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.421 5.784 -20.504 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.209 5.682 -18.912 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.047 7.256 -19.725 1.00 0.00 H new ATOM 830 N ASP A 56 15.536 8.363 -17.887 1.00 0.00 N ATOM 831 CA ASP A 56 16.890 8.553 -17.356 1.00 0.00 C ATOM 832 C ASP A 56 17.271 7.411 -16.398 1.00 0.00 C ATOM 833 O ASP A 56 16.480 7.020 -15.539 1.00 0.00 O ATOM 834 CB ASP A 56 16.982 9.922 -16.666 1.00 0.00 C ATOM 835 CG ASP A 56 18.354 10.143 -16.001 1.00 0.00 C ATOM 836 OD1 ASP A 56 19.387 9.740 -16.591 1.00 0.00 O ATOM 837 OD2 ASP A 56 18.405 10.683 -14.871 1.00 0.00 O ATOM 0 H ASP A 56 14.862 8.103 -17.167 1.00 0.00 H new ATOM 0 HA ASP A 56 17.604 8.530 -18.179 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.803 10.710 -17.398 1.00 0.00 H new ATOM 0 HB3 ASP A 56 16.197 10.002 -15.914 1.00 0.00 H new ATOM 842 N ILE A 57 18.503 6.906 -16.536 1.00 0.00 N ATOM 843 CA ILE A 57 19.153 5.963 -15.605 1.00 0.00 C ATOM 844 C ILE A 57 20.540 6.451 -15.145 1.00 0.00 C ATOM 845 O ILE A 57 21.200 5.763 -14.374 1.00 0.00 O ATOM 846 CB ILE A 57 19.216 4.528 -16.192 1.00 0.00 C ATOM 847 CG1 ILE A 57 20.118 4.426 -17.443 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.804 4.001 -16.495 1.00 0.00 C ATOM 849 CD1 ILE A 57 20.319 2.990 -17.944 1.00 0.00 C ATOM 0 H ILE A 57 19.100 7.149 -17.327 1.00 0.00 H new ATOM 0 HA ILE A 57 18.526 5.924 -14.714 1.00 0.00 H new ATOM 0 HB ILE A 57 19.673 3.900 -15.427 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.682 5.023 -18.244 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.091 4.861 -17.215 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.872 2.994 -16.906 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.219 3.979 -15.576 1.00 0.00 H new ATOM 0 HG23 ILE A 57 17.319 4.656 -17.219 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.962 2.998 -18.824 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.784 2.393 -17.160 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.353 2.557 -18.205 1.00 0.00 H new ATOM 861 N SER A 58 21.003 7.626 -15.590 1.00 0.00 N ATOM 862 CA SER A 58 22.386 8.104 -15.400 1.00 0.00 C ATOM 863 C SER A 58 22.793 8.298 -13.929 1.00 0.00 C ATOM 864 O SER A 58 23.967 8.142 -13.589 1.00 0.00 O ATOM 865 CB SER A 58 22.595 9.414 -16.174 1.00 0.00 C ATOM 866 OG SER A 58 21.737 10.442 -15.717 1.00 0.00 O ATOM 0 H SER A 58 20.419 8.287 -16.102 1.00 0.00 H new ATOM 0 HA SER A 58 23.031 7.316 -15.789 1.00 0.00 H new ATOM 0 HB2 SER A 58 23.632 9.735 -16.071 1.00 0.00 H new ATOM 0 HB3 SER A 58 22.419 9.240 -17.236 1.00 0.00 H new ATOM 0 HG SER A 58 20.811 10.224 -15.952 1.00 0.00 H new ATOM 872 N GLY A 59 21.828 8.594 -13.049 1.00 0.00 N ATOM 873 CA GLY A 59 22.033 8.734 -11.601 1.00 0.00 C ATOM 874 C GLY A 59 22.008 7.418 -10.807 1.00 0.00 C ATOM 875 O GLY A 59 22.228 7.442 -9.595 1.00 0.00 O ATOM 0 H GLY A 59 20.860 8.747 -13.331 1.00 0.00 H new ATOM 0 HA2 GLY A 59 22.992 9.224 -11.432 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.263 9.395 -11.203 1.00 0.00 H new ATOM 879 N GLN A 60 21.718 6.275 -11.447 1.00 0.00 N ATOM 880 CA GLN A 60 21.573 4.982 -10.760 1.00 0.00 C ATOM 881 C GLN A 60 22.918 4.286 -10.475 1.00 0.00 C ATOM 882 O GLN A 60 23.911 4.480 -11.178 1.00 0.00 O ATOM 883 CB GLN A 60 20.634 4.053 -11.543 1.00 0.00 C ATOM 884 CG GLN A 60 19.179 4.548 -11.560 1.00 0.00 C ATOM 885 CD GLN A 60 18.252 3.746 -12.477 1.00 0.00 C ATOM 886 OE1 GLN A 60 17.269 4.266 -12.979 1.00 0.00 O ATOM 887 NE2 GLN A 60 18.495 2.483 -12.749 1.00 0.00 N ATOM 0 H GLN A 60 21.577 6.221 -12.456 1.00 0.00 H new ATOM 0 HA GLN A 60 21.131 5.200 -9.788 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.993 3.962 -12.568 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.668 3.056 -11.103 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.784 4.515 -10.545 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.166 5.592 -11.873 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.309 2.022 -12.344 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.869 1.964 -13.365 1.00 0.00 H new ATOM 896 N THR A 61 22.918 3.437 -9.443 1.00 0.00 N ATOM 897 CA THR A 61 24.064 2.658 -8.933 1.00 0.00 C ATOM 898 C THR A 61 23.659 1.195 -8.674 1.00 0.00 C ATOM 899 O THR A 61 22.509 0.810 -8.903 1.00 0.00 O ATOM 900 CB THR A 61 24.619 3.297 -7.641 1.00 0.00 C ATOM 901 OG1 THR A 61 23.607 3.369 -6.654 1.00 0.00 O ATOM 902 CG2 THR A 61 25.160 4.711 -7.867 1.00 0.00 C ATOM 0 H THR A 61 22.070 3.260 -8.905 1.00 0.00 H new ATOM 0 HA THR A 61 24.846 2.668 -9.692 1.00 0.00 H new ATOM 0 HB THR A 61 25.440 2.658 -7.314 1.00 0.00 H new ATOM 0 HG1 THR A 61 23.972 3.774 -5.840 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.537 5.111 -6.926 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.969 4.679 -8.597 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.360 5.351 -8.239 1.00 0.00 H new ATOM 910 N SER A 62 24.597 0.350 -8.229 1.00 0.00 N ATOM 911 CA SER A 62 24.324 -1.036 -7.812 1.00 0.00 C ATOM 912 C SER A 62 25.341 -1.544 -6.783 1.00 0.00 C ATOM 913 O SER A 62 26.435 -0.993 -6.637 1.00 0.00 O ATOM 914 CB SER A 62 24.375 -1.971 -9.013 1.00 0.00 C ATOM 915 OG SER A 62 23.598 -3.136 -8.782 1.00 0.00 O ATOM 0 H SER A 62 25.580 0.610 -8.146 1.00 0.00 H new ATOM 0 HA SER A 62 23.332 -1.031 -7.361 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.006 -1.453 -9.898 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.408 -2.253 -9.216 1.00 0.00 H new ATOM 0 HG SER A 62 23.303 -3.508 -9.639 1.00 0.00 H new ATOM 921 N ASP A 63 24.974 -2.626 -6.101 1.00 0.00 N ATOM 922 CA ASP A 63 25.828 -3.430 -5.222 1.00 0.00 C ATOM 923 C ASP A 63 25.344 -4.894 -5.250 1.00 0.00 C ATOM 924 O ASP A 63 24.172 -5.130 -5.575 1.00 0.00 O ATOM 925 CB ASP A 63 25.792 -2.885 -3.783 1.00 0.00 C ATOM 926 CG ASP A 63 26.658 -1.629 -3.597 1.00 0.00 C ATOM 927 OD1 ASP A 63 27.908 -1.752 -3.604 1.00 0.00 O ATOM 928 OD2 ASP A 63 26.101 -0.528 -3.371 1.00 0.00 O ATOM 0 H ASP A 63 24.021 -2.987 -6.147 1.00 0.00 H new ATOM 0 HA ASP A 63 26.857 -3.378 -5.577 1.00 0.00 H new ATOM 0 HB2 ASP A 63 24.762 -2.653 -3.514 1.00 0.00 H new ATOM 0 HB3 ASP A 63 26.134 -3.661 -3.098 1.00 0.00 H new ATOM 933 N PRO A 64 26.195 -5.882 -4.898 1.00 0.00 N ATOM 934 CA PRO A 64 25.799 -7.288 -4.807 1.00 0.00 C ATOM 935 C PRO A 64 24.601 -7.491 -3.875 1.00 0.00 C ATOM 936 O PRO A 64 24.563 -6.936 -2.776 1.00 0.00 O ATOM 937 CB PRO A 64 27.037 -8.045 -4.308 1.00 0.00 C ATOM 938 CG PRO A 64 28.196 -7.144 -4.726 1.00 0.00 C ATOM 939 CD PRO A 64 27.610 -5.742 -4.578 1.00 0.00 C ATOM 0 HA PRO A 64 25.471 -7.661 -5.777 1.00 0.00 H new ATOM 0 HB2 PRO A 64 27.011 -8.190 -3.228 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.113 -9.033 -4.761 1.00 0.00 H new ATOM 0 HG2 PRO A 64 29.068 -7.286 -4.088 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.513 -7.343 -5.750 1.00 0.00 H new ATOM 0 HD2 PRO A 64 27.749 -5.362 -3.566 1.00 0.00 H new ATOM 0 HD3 PRO A 64 28.098 -5.038 -5.252 1.00 0.00 H new ATOM 947 N ILE A 65 23.633 -8.315 -4.281 1.00 0.00 N ATOM 948 CA ILE A 65 22.332 -8.430 -3.592 1.00 0.00 C ATOM 949 C ILE A 65 22.415 -8.797 -2.099 1.00 0.00 C ATOM 950 O ILE A 65 21.594 -8.342 -1.307 1.00 0.00 O ATOM 951 CB ILE A 65 21.411 -9.387 -4.387 1.00 0.00 C ATOM 952 CG1 ILE A 65 19.940 -9.147 -3.992 1.00 0.00 C ATOM 953 CG2 ILE A 65 21.824 -10.866 -4.221 1.00 0.00 C ATOM 954 CD1 ILE A 65 18.945 -9.942 -4.839 1.00 0.00 C ATOM 0 H ILE A 65 23.722 -8.923 -5.095 1.00 0.00 H new ATOM 0 HA ILE A 65 21.896 -7.431 -3.579 1.00 0.00 H new ATOM 0 HB ILE A 65 21.522 -9.165 -5.448 1.00 0.00 H new ATOM 0 HG12 ILE A 65 19.806 -9.412 -2.943 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.716 -8.084 -4.084 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.149 -11.499 -4.797 1.00 0.00 H new ATOM 0 HG22 ILE A 65 22.844 -11.002 -4.581 1.00 0.00 H new ATOM 0 HG23 ILE A 65 21.771 -11.143 -3.168 1.00 0.00 H new ATOM 0 HD11 ILE A 65 17.930 -9.725 -4.507 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.052 -9.660 -5.886 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.143 -11.008 -4.728 1.00 0.00 H new ATOM 966 N GLU A 66 23.444 -9.545 -1.685 1.00 0.00 N ATOM 967 CA GLU A 66 23.644 -9.946 -0.282 1.00 0.00 C ATOM 968 C GLU A 66 23.949 -8.765 0.662 1.00 0.00 C ATOM 969 O GLU A 66 23.827 -8.912 1.880 1.00 0.00 O ATOM 970 CB GLU A 66 24.756 -11.004 -0.197 1.00 0.00 C ATOM 971 CG GLU A 66 24.386 -12.316 -0.907 1.00 0.00 C ATOM 972 CD GLU A 66 25.491 -13.373 -0.708 1.00 0.00 C ATOM 973 OE1 GLU A 66 25.430 -14.144 0.280 1.00 0.00 O ATOM 974 OE2 GLU A 66 26.431 -13.444 -1.541 1.00 0.00 O ATOM 0 H GLU A 66 24.167 -9.893 -2.315 1.00 0.00 H new ATOM 0 HA GLU A 66 22.699 -10.367 0.061 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.668 -10.602 -0.638 1.00 0.00 H new ATOM 0 HB3 GLU A 66 24.974 -11.212 0.851 1.00 0.00 H new ATOM 0 HG2 GLU A 66 23.441 -12.693 -0.516 1.00 0.00 H new ATOM 0 HG3 GLU A 66 24.240 -12.131 -1.971 1.00 0.00 H new ATOM 981 N ASN A 67 24.301 -7.582 0.131 1.00 0.00 N ATOM 982 CA ASN A 67 24.461 -6.359 0.931 1.00 0.00 C ATOM 983 C ASN A 67 23.108 -5.730 1.362 1.00 0.00 C ATOM 984 O ASN A 67 23.079 -4.942 2.311 1.00 0.00 O ATOM 985 CB ASN A 67 25.375 -5.358 0.184 1.00 0.00 C ATOM 986 CG ASN A 67 24.606 -4.223 -0.479 1.00 0.00 C ATOM 987 OD1 ASN A 67 24.557 -3.103 0.007 1.00 0.00 O ATOM 988 ND2 ASN A 67 23.947 -4.489 -1.575 1.00 0.00 N ATOM 0 H ASN A 67 24.482 -7.448 -0.864 1.00 0.00 H new ATOM 0 HA ASN A 67 24.947 -6.634 1.867 1.00 0.00 H new ATOM 0 HB2 ASN A 67 26.095 -4.939 0.887 1.00 0.00 H new ATOM 0 HB3 ASN A 67 25.946 -5.893 -0.575 1.00 0.00 H new ATOM 0 HD21 ASN A 67 23.391 -3.762 -2.025 1.00 0.00 H new ATOM 0 HD22 ASN A 67 23.988 -5.424 -1.981 1.00 0.00 H new ATOM 995 N PHE A 68 22.006 -6.063 0.680 1.00 0.00 N ATOM 996 CA PHE A 68 20.665 -5.500 0.908 1.00 0.00 C ATOM 997 C PHE A 68 19.780 -6.399 1.802 1.00 0.00 C ATOM 998 O PHE A 68 20.120 -7.547 2.096 1.00 0.00 O ATOM 999 CB PHE A 68 19.993 -5.215 -0.452 1.00 0.00 C ATOM 1000 CG PHE A 68 20.710 -4.227 -1.360 1.00 0.00 C ATOM 1001 CD1 PHE A 68 21.083 -2.954 -0.884 1.00 0.00 C ATOM 1002 CD2 PHE A 68 20.988 -4.574 -2.696 1.00 0.00 C ATOM 1003 CE1 PHE A 68 21.735 -2.043 -1.733 1.00 0.00 C ATOM 1004 CE2 PHE A 68 21.651 -3.664 -3.540 1.00 0.00 C ATOM 1005 CZ PHE A 68 22.020 -2.398 -3.061 1.00 0.00 C ATOM 0 H PHE A 68 22.021 -6.754 -0.070 1.00 0.00 H new ATOM 0 HA PHE A 68 20.781 -4.566 1.457 1.00 0.00 H new ATOM 0 HB2 PHE A 68 19.888 -6.159 -0.987 1.00 0.00 H new ATOM 0 HB3 PHE A 68 18.986 -4.841 -0.265 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.867 -2.677 0.137 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.692 -5.541 -3.074 1.00 0.00 H new ATOM 0 HE1 PHE A 68 22.017 -1.068 -1.363 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.876 -3.941 -4.559 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.522 -1.698 -3.712 1.00 0.00 H new ATOM 1015 N ASN A 69 18.621 -5.868 2.220 1.00 0.00 N ATOM 1016 CA ASN A 69 17.634 -6.535 3.082 1.00 0.00 C ATOM 1017 C ASN A 69 16.278 -6.687 2.366 1.00 0.00 C ATOM 1018 O ASN A 69 15.547 -5.712 2.199 1.00 0.00 O ATOM 1019 CB ASN A 69 17.535 -5.771 4.426 1.00 0.00 C ATOM 1020 CG ASN A 69 17.571 -4.244 4.335 1.00 0.00 C ATOM 1021 OD1 ASN A 69 18.418 -3.588 4.922 1.00 0.00 O ATOM 1022 ND2 ASN A 69 16.675 -3.623 3.598 1.00 0.00 N ATOM 0 H ASN A 69 18.335 -4.925 1.956 1.00 0.00 H new ATOM 0 HA ASN A 69 17.961 -7.551 3.302 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.608 -6.064 4.920 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.354 -6.096 5.067 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.693 -2.606 3.522 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.962 -4.159 3.103 1.00 0.00 H new ATOM 1029 N ALA A 70 15.901 -7.903 1.971 1.00 0.00 N ATOM 1030 CA ALA A 70 14.745 -8.158 1.106 1.00 0.00 C ATOM 1031 C ALA A 70 13.377 -7.846 1.738 1.00 0.00 C ATOM 1032 O ALA A 70 12.385 -7.677 1.031 1.00 0.00 O ATOM 1033 CB ALA A 70 14.806 -9.626 0.710 1.00 0.00 C ATOM 0 H ALA A 70 16.396 -8.752 2.246 1.00 0.00 H new ATOM 0 HA ALA A 70 14.814 -7.481 0.254 1.00 0.00 H new ATOM 0 HB1 ALA A 70 13.962 -9.864 0.063 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.737 -9.821 0.178 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.763 -10.246 1.605 1.00 0.00 H new ATOM 1039 N ASP A 71 13.319 -7.754 3.068 1.00 0.00 N ATOM 1040 CA ASP A 71 12.082 -7.506 3.826 1.00 0.00 C ATOM 1041 C ASP A 71 11.482 -6.118 3.537 1.00 0.00 C ATOM 1042 O ASP A 71 10.273 -5.902 3.647 1.00 0.00 O ATOM 1043 CB ASP A 71 12.424 -7.589 5.317 1.00 0.00 C ATOM 1044 CG ASP A 71 11.169 -7.545 6.204 1.00 0.00 C ATOM 1045 OD1 ASP A 71 10.346 -8.489 6.134 1.00 0.00 O ATOM 1046 OD2 ASP A 71 11.017 -6.586 6.999 1.00 0.00 O ATOM 0 H ASP A 71 14.142 -7.851 3.663 1.00 0.00 H new ATOM 0 HA ASP A 71 11.343 -8.250 3.529 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.972 -8.511 5.512 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.084 -6.763 5.583 1.00 0.00 H new ATOM 1051 N ASP A 72 12.346 -5.183 3.139 1.00 0.00 N ATOM 1052 CA ASP A 72 12.024 -3.798 2.812 1.00 0.00 C ATOM 1053 C ASP A 72 11.630 -3.635 1.331 1.00 0.00 C ATOM 1054 O ASP A 72 11.266 -2.540 0.905 1.00 0.00 O ATOM 1055 CB ASP A 72 13.239 -2.950 3.204 1.00 0.00 C ATOM 1056 CG ASP A 72 12.949 -1.440 3.185 1.00 0.00 C ATOM 1057 OD1 ASP A 72 12.042 -0.979 3.922 1.00 0.00 O ATOM 1058 OD2 ASP A 72 13.660 -0.696 2.467 1.00 0.00 O ATOM 0 H ASP A 72 13.340 -5.384 3.031 1.00 0.00 H new ATOM 0 HA ASP A 72 11.148 -3.463 3.368 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.570 -3.238 4.202 1.00 0.00 H new ATOM 0 HB3 ASP A 72 14.061 -3.165 2.521 1.00 0.00 H new ATOM 1063 N TYR A 73 11.670 -4.736 0.564 1.00 0.00 N ATOM 1064 CA TYR A 73 11.254 -4.854 -0.830 1.00 0.00 C ATOM 1065 C TYR A 73 10.109 -5.858 -0.914 1.00 0.00 C ATOM 1066 O TYR A 73 10.303 -7.038 -1.198 1.00 0.00 O ATOM 1067 CB TYR A 73 12.443 -5.229 -1.721 1.00 0.00 C ATOM 1068 CG TYR A 73 13.592 -4.257 -1.597 1.00 0.00 C ATOM 1069 CD1 TYR A 73 13.669 -3.128 -2.430 1.00 0.00 C ATOM 1070 CD2 TYR A 73 14.556 -4.459 -0.597 1.00 0.00 C ATOM 1071 CE1 TYR A 73 14.723 -2.211 -2.265 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.599 -3.538 -0.412 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.683 -2.399 -1.246 1.00 0.00 C ATOM 1074 OH TYR A 73 16.684 -1.489 -1.087 1.00 0.00 O ATOM 0 H TYR A 73 12.018 -5.622 0.931 1.00 0.00 H new ATOM 0 HA TYR A 73 10.892 -3.895 -1.202 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.788 -6.229 -1.458 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.116 -5.268 -2.760 1.00 0.00 H new ATOM 0 HD1 TYR A 73 12.923 -2.965 -3.193 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.495 -5.332 0.036 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.799 -1.357 -2.922 1.00 0.00 H new ATOM 0 HE2 TYR A 73 16.334 -3.698 0.363 1.00 0.00 H new ATOM 0 HH TYR A 73 17.260 -1.763 -0.343 1.00 0.00 H new ATOM 1084 N ASP A 74 8.904 -5.376 -0.621 1.00 0.00 N ATOM 1085 CA ASP A 74 7.643 -6.130 -0.636 1.00 0.00 C ATOM 1086 C ASP A 74 7.404 -6.879 -1.959 1.00 0.00 C ATOM 1087 O ASP A 74 6.714 -7.896 -1.985 1.00 0.00 O ATOM 1088 CB ASP A 74 6.469 -5.154 -0.428 1.00 0.00 C ATOM 1089 CG ASP A 74 6.745 -4.091 0.646 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.458 -3.114 0.310 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.250 -4.228 1.789 1.00 0.00 O ATOM 0 H ASP A 74 8.768 -4.401 -0.353 1.00 0.00 H new ATOM 0 HA ASP A 74 7.709 -6.868 0.163 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.247 -4.657 -1.372 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.580 -5.720 -0.149 1.00 0.00 H new ATOM 1096 N VAL A 75 7.971 -6.371 -3.057 1.00 0.00 N ATOM 1097 CA VAL A 75 7.827 -6.895 -4.415 1.00 0.00 C ATOM 1098 C VAL A 75 9.222 -7.011 -5.049 1.00 0.00 C ATOM 1099 O VAL A 75 10.007 -6.065 -5.002 1.00 0.00 O ATOM 1100 CB VAL A 75 6.852 -5.985 -5.197 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.752 -6.394 -6.673 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.443 -6.038 -4.586 1.00 0.00 C ATOM 0 H VAL A 75 8.570 -5.546 -3.020 1.00 0.00 H new ATOM 0 HA VAL A 75 7.396 -7.896 -4.427 1.00 0.00 H new ATOM 0 HB VAL A 75 7.252 -4.973 -5.131 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.057 -5.731 -7.188 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.735 -6.322 -7.138 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.392 -7.421 -6.743 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.776 -5.390 -5.154 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.070 -7.062 -4.620 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.483 -5.700 -3.550 1.00 0.00 H new ATOM 1112 N VAL A 76 9.559 -8.158 -5.646 1.00 0.00 N ATOM 1113 CA VAL A 76 10.900 -8.412 -6.223 1.00 0.00 C ATOM 1114 C VAL A 76 10.758 -9.029 -7.611 1.00 0.00 C ATOM 1115 O VAL A 76 10.073 -10.030 -7.774 1.00 0.00 O ATOM 1116 CB VAL A 76 11.762 -9.302 -5.302 1.00 0.00 C ATOM 1117 CG1 VAL A 76 13.102 -9.680 -5.957 1.00 0.00 C ATOM 1118 CG2 VAL A 76 12.101 -8.594 -3.980 1.00 0.00 C ATOM 0 H VAL A 76 8.915 -8.943 -5.747 1.00 0.00 H new ATOM 0 HA VAL A 76 11.418 -7.457 -6.313 1.00 0.00 H new ATOM 0 HB VAL A 76 11.162 -10.193 -5.119 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.677 -10.306 -5.275 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.914 -10.227 -6.881 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.666 -8.774 -6.180 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.708 -9.253 -3.360 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.656 -7.679 -4.189 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.179 -8.347 -3.453 1.00 0.00 H new ATOM 1128 N ILE A 77 11.398 -8.429 -8.612 1.00 0.00 N ATOM 1129 CA ILE A 77 11.225 -8.762 -10.030 1.00 0.00 C ATOM 1130 C ILE A 77 12.589 -9.051 -10.662 1.00 0.00 C ATOM 1131 O ILE A 77 13.413 -8.154 -10.820 1.00 0.00 O ATOM 1132 CB ILE A 77 10.483 -7.605 -10.743 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.104 -7.251 -10.124 1.00 0.00 C ATOM 1134 CG2 ILE A 77 10.355 -7.911 -12.244 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.087 -8.385 -10.055 1.00 0.00 C ATOM 0 H ILE A 77 12.070 -7.677 -8.459 1.00 0.00 H new ATOM 0 HA ILE A 77 10.618 -9.661 -10.137 1.00 0.00 H new ATOM 0 HB ILE A 77 11.094 -6.714 -10.598 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.268 -6.876 -9.114 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.669 -6.435 -10.701 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.832 -7.093 -12.739 1.00 0.00 H new ATOM 0 HG22 ILE A 77 11.348 -8.022 -12.679 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.794 -8.835 -12.380 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.164 -8.019 -9.605 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.880 -8.750 -11.061 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.489 -9.198 -9.450 1.00 0.00 H new ATOM 1147 N SER A 78 12.838 -10.304 -11.025 1.00 0.00 N ATOM 1148 CA SER A 78 14.057 -10.743 -11.709 1.00 0.00 C ATOM 1149 C SER A 78 13.942 -10.617 -13.233 1.00 0.00 C ATOM 1150 O SER A 78 12.841 -10.578 -13.782 1.00 0.00 O ATOM 1151 CB SER A 78 14.419 -12.153 -11.233 1.00 0.00 C ATOM 1152 OG SER A 78 15.563 -12.641 -11.907 1.00 0.00 O ATOM 0 H SER A 78 12.183 -11.066 -10.849 1.00 0.00 H new ATOM 0 HA SER A 78 14.881 -10.081 -11.443 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.604 -12.141 -10.159 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.578 -12.825 -11.404 1.00 0.00 H new ATOM 0 HG SER A 78 15.300 -13.359 -12.520 1.00 0.00 H new ATOM 1158 N LEU A 79 15.084 -10.523 -13.920 1.00 0.00 N ATOM 1159 CA LEU A 79 15.200 -10.457 -15.383 1.00 0.00 C ATOM 1160 C LEU A 79 16.239 -11.469 -15.920 1.00 0.00 C ATOM 1161 O LEU A 79 17.052 -11.147 -16.789 1.00 0.00 O ATOM 1162 CB LEU A 79 15.476 -9.006 -15.837 1.00 0.00 C ATOM 1163 CG LEU A 79 14.384 -7.978 -15.470 1.00 0.00 C ATOM 1164 CD1 LEU A 79 14.692 -7.236 -14.166 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.286 -6.920 -16.571 1.00 0.00 C ATOM 0 H LEU A 79 15.991 -10.489 -13.455 1.00 0.00 H new ATOM 0 HA LEU A 79 14.247 -10.753 -15.821 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.420 -8.680 -15.400 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.607 -9.001 -16.919 1.00 0.00 H new ATOM 0 HG LEU A 79 13.456 -8.538 -15.354 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.893 -6.525 -13.954 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.766 -7.953 -13.348 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.636 -6.701 -14.266 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.515 -6.195 -16.311 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.244 -6.410 -16.672 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.029 -7.400 -17.515 1.00 0.00 H new ATOM 1177 N CYS A 80 16.238 -12.683 -15.364 1.00 0.00 N ATOM 1178 CA CYS A 80 17.172 -13.765 -15.710 1.00 0.00 C ATOM 1179 C CYS A 80 16.501 -14.877 -16.543 1.00 0.00 C ATOM 1180 O CYS A 80 17.163 -15.517 -17.364 1.00 0.00 O ATOM 1181 CB CYS A 80 17.778 -14.328 -14.419 1.00 0.00 C ATOM 1182 SG CYS A 80 18.558 -13.003 -13.443 1.00 0.00 S ATOM 0 H CYS A 80 15.571 -12.951 -14.641 1.00 0.00 H new ATOM 0 HA CYS A 80 17.961 -13.353 -16.339 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.001 -14.813 -13.828 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.517 -15.092 -14.661 1.00 0.00 H new ATOM 0 HG CYS A 80 17.694 -12.517 -12.602 1.00 0.00 H new ATOM 1188 N GLY A 81 15.187 -15.066 -16.378 1.00 0.00 N ATOM 1189 CA GLY A 81 14.333 -15.913 -17.212 1.00 0.00 C ATOM 1190 C GLY A 81 14.153 -17.334 -16.676 1.00 0.00 C ATOM 1191 O GLY A 81 14.885 -18.246 -17.064 1.00 0.00 O ATOM 0 H GLY A 81 14.669 -14.612 -15.626 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.353 -15.444 -17.305 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.758 -15.965 -18.214 1.00 0.00 H new ATOM 1195 N CYS A 82 13.139 -17.521 -15.820 1.00 0.00 N ATOM 1196 CA CYS A 82 12.775 -18.796 -15.180 1.00 0.00 C ATOM 1197 C CYS A 82 13.977 -19.575 -14.583 1.00 0.00 C ATOM 1198 O CYS A 82 14.110 -20.793 -14.745 1.00 0.00 O ATOM 1199 CB CYS A 82 11.887 -19.600 -16.143 1.00 0.00 C ATOM 1200 SG CYS A 82 10.846 -20.764 -15.211 1.00 0.00 S ATOM 0 H CYS A 82 12.523 -16.757 -15.542 1.00 0.00 H new ATOM 0 HA CYS A 82 12.188 -18.586 -14.286 1.00 0.00 H new ATOM 0 HB2 CYS A 82 11.259 -18.923 -16.722 1.00 0.00 H new ATOM 0 HB3 CYS A 82 12.508 -20.145 -16.854 1.00 0.00 H new ATOM 0 HG CYS A 82 10.099 -21.435 -16.037 1.00 0.00 H new ATOM 1206 N GLY A 83 14.881 -18.860 -13.908 1.00 0.00 N ATOM 1207 CA GLY A 83 16.081 -19.403 -13.274 1.00 0.00 C ATOM 1208 C GLY A 83 17.040 -18.297 -12.822 1.00 0.00 C ATOM 1209 O GLY A 83 17.712 -17.673 -13.645 1.00 0.00 O ATOM 0 H GLY A 83 14.792 -17.851 -13.785 1.00 0.00 H new ATOM 0 HA2 GLY A 83 15.795 -20.009 -12.414 1.00 0.00 H new ATOM 0 HA3 GLY A 83 16.593 -20.064 -13.973 1.00 0.00 H new ATOM 1213 N VAL A 84 17.116 -18.068 -11.506 1.00 0.00 N ATOM 1214 CA VAL A 84 17.999 -17.073 -10.866 1.00 0.00 C ATOM 1215 C VAL A 84 18.506 -17.564 -9.499 1.00 0.00 C ATOM 1216 O VAL A 84 17.765 -18.195 -8.745 1.00 0.00 O ATOM 1217 CB VAL A 84 17.285 -15.702 -10.792 1.00 0.00 C ATOM 1218 CG1 VAL A 84 16.024 -15.694 -9.919 1.00 0.00 C ATOM 1219 CG2 VAL A 84 18.241 -14.593 -10.340 1.00 0.00 C ATOM 0 H VAL A 84 16.549 -18.583 -10.832 1.00 0.00 H new ATOM 0 HA VAL A 84 18.890 -16.942 -11.480 1.00 0.00 H new ATOM 0 HB VAL A 84 16.956 -15.506 -11.813 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.586 -14.696 -9.922 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.302 -16.408 -10.316 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.286 -15.972 -8.898 1.00 0.00 H new ATOM 0 HG21 VAL A 84 17.705 -13.645 -10.300 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.633 -14.831 -9.351 1.00 0.00 H new ATOM 0 HG23 VAL A 84 19.066 -14.513 -11.047 1.00 0.00 H new ATOM 1229 N ASN A 85 19.767 -17.268 -9.151 1.00 0.00 N ATOM 1230 CA ASN A 85 20.438 -17.777 -7.943 1.00 0.00 C ATOM 1231 C ASN A 85 20.214 -16.866 -6.713 1.00 0.00 C ATOM 1232 O ASN A 85 21.160 -16.395 -6.079 1.00 0.00 O ATOM 1233 CB ASN A 85 21.921 -18.041 -8.279 1.00 0.00 C ATOM 1234 CG ASN A 85 22.659 -18.833 -7.204 1.00 0.00 C ATOM 1235 OD1 ASN A 85 22.078 -19.459 -6.326 1.00 0.00 O ATOM 1236 ND2 ASN A 85 23.972 -18.869 -7.261 1.00 0.00 N ATOM 0 H ASN A 85 20.361 -16.657 -9.711 1.00 0.00 H new ATOM 0 HA ASN A 85 19.991 -18.724 -7.642 1.00 0.00 H new ATOM 0 HB2 ASN A 85 21.980 -18.583 -9.223 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.427 -17.087 -8.427 1.00 0.00 H new ATOM 0 HD21 ASN A 85 24.497 -19.415 -6.578 1.00 0.00 H new ATOM 0 HD22 ASN A 85 24.465 -18.351 -7.988 1.00 0.00 H new ATOM 1243 N LEU A 86 18.949 -16.548 -6.419 1.00 0.00 N ATOM 1244 CA LEU A 86 18.566 -15.642 -5.328 1.00 0.00 C ATOM 1245 C LEU A 86 18.623 -16.304 -3.934 1.00 0.00 C ATOM 1246 O LEU A 86 18.217 -17.464 -3.800 1.00 0.00 O ATOM 1247 CB LEU A 86 17.130 -15.130 -5.559 1.00 0.00 C ATOM 1248 CG LEU A 86 16.968 -14.056 -6.641 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.488 -13.735 -6.823 1.00 0.00 C ATOM 1250 CD2 LEU A 86 17.685 -12.757 -6.289 1.00 0.00 C ATOM 0 H LEU A 86 18.152 -16.916 -6.938 1.00 0.00 H new ATOM 0 HA LEU A 86 19.290 -14.827 -5.340 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.500 -15.980 -5.821 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.752 -14.730 -4.618 1.00 0.00 H new ATOM 0 HG LEU A 86 17.408 -14.460 -7.553 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.373 -12.971 -7.592 1.00 0.00 H new ATOM 0 HD12 LEU A 86 14.955 -14.637 -7.124 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.077 -13.367 -5.883 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.537 -12.032 -7.089 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.280 -12.358 -5.359 1.00 0.00 H new ATOM 0 HD23 LEU A 86 18.751 -12.951 -6.167 1.00 0.00 H new ATOM 1262 N PRO A 87 19.048 -15.566 -2.883 1.00 0.00 N ATOM 1263 CA PRO A 87 18.907 -16.021 -1.498 1.00 0.00 C ATOM 1264 C PRO A 87 17.411 -16.134 -1.130 1.00 0.00 C ATOM 1265 O PRO A 87 16.591 -15.405 -1.698 1.00 0.00 O ATOM 1266 CB PRO A 87 19.653 -14.992 -0.631 1.00 0.00 C ATOM 1267 CG PRO A 87 20.592 -14.286 -1.611 1.00 0.00 C ATOM 1268 CD PRO A 87 19.836 -14.343 -2.938 1.00 0.00 C ATOM 0 HA PRO A 87 19.331 -17.013 -1.341 1.00 0.00 H new ATOM 0 HB2 PRO A 87 18.963 -14.289 -0.164 1.00 0.00 H new ATOM 0 HB3 PRO A 87 20.207 -15.476 0.173 1.00 0.00 H new ATOM 0 HG2 PRO A 87 20.790 -13.258 -1.306 1.00 0.00 H new ATOM 0 HG3 PRO A 87 21.556 -14.791 -1.677 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.197 -13.469 -3.064 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.525 -14.358 -3.782 1.00 0.00 H new ATOM 1276 N PRO A 88 17.021 -16.984 -0.161 1.00 0.00 N ATOM 1277 CA PRO A 88 15.611 -17.309 0.097 1.00 0.00 C ATOM 1278 C PRO A 88 14.740 -16.116 0.522 1.00 0.00 C ATOM 1279 O PRO A 88 13.540 -16.101 0.254 1.00 0.00 O ATOM 1280 CB PRO A 88 15.637 -18.418 1.155 1.00 0.00 C ATOM 1281 CG PRO A 88 16.989 -18.238 1.848 1.00 0.00 C ATOM 1282 CD PRO A 88 17.891 -17.765 0.711 1.00 0.00 C ATOM 0 HA PRO A 88 15.132 -17.629 -0.828 1.00 0.00 H new ATOM 0 HB2 PRO A 88 14.811 -18.317 1.859 1.00 0.00 H new ATOM 0 HB3 PRO A 88 15.550 -19.405 0.701 1.00 0.00 H new ATOM 0 HG2 PRO A 88 16.936 -17.506 2.654 1.00 0.00 H new ATOM 0 HG3 PRO A 88 17.346 -19.170 2.287 1.00 0.00 H new ATOM 0 HD2 PRO A 88 18.717 -17.162 1.087 1.00 0.00 H new ATOM 0 HD3 PRO A 88 18.330 -18.609 0.178 1.00 0.00 H new ATOM 1290 N GLU A 89 15.326 -15.069 1.110 1.00 0.00 N ATOM 1291 CA GLU A 89 14.583 -13.852 1.473 1.00 0.00 C ATOM 1292 C GLU A 89 14.126 -13.001 0.265 1.00 0.00 C ATOM 1293 O GLU A 89 13.220 -12.186 0.416 1.00 0.00 O ATOM 1294 CB GLU A 89 15.362 -13.033 2.515 1.00 0.00 C ATOM 1295 CG GLU A 89 16.715 -12.493 2.029 1.00 0.00 C ATOM 1296 CD GLU A 89 17.346 -11.564 3.087 1.00 0.00 C ATOM 1297 OE1 GLU A 89 18.048 -12.075 3.996 1.00 0.00 O ATOM 1298 OE2 GLU A 89 17.142 -10.325 3.025 1.00 0.00 O ATOM 0 H GLU A 89 16.318 -15.037 1.347 1.00 0.00 H new ATOM 0 HA GLU A 89 13.650 -14.185 1.929 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.744 -12.193 2.832 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.530 -13.655 3.394 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.389 -13.324 1.819 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.580 -11.948 1.094 1.00 0.00 H new ATOM 1305 N TRP A 90 14.685 -13.209 -0.934 1.00 0.00 N ATOM 1306 CA TRP A 90 14.346 -12.455 -2.162 1.00 0.00 C ATOM 1307 C TRP A 90 13.255 -13.105 -3.039 1.00 0.00 C ATOM 1308 O TRP A 90 12.887 -12.549 -4.073 1.00 0.00 O ATOM 1309 CB TRP A 90 15.627 -12.179 -2.960 1.00 0.00 C ATOM 1310 CG TRP A 90 16.569 -11.233 -2.290 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.631 -11.574 -1.525 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.490 -9.778 -2.233 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.207 -10.436 -0.994 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.516 -9.305 -1.366 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.618 -8.814 -2.782 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.625 -7.958 -1.008 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.725 -7.453 -2.438 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.714 -7.028 -1.537 1.00 0.00 C ATOM 0 H TRP A 90 15.401 -13.919 -1.088 1.00 0.00 H new ATOM 0 HA TRP A 90 13.899 -11.515 -1.838 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.142 -13.123 -3.138 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.355 -11.775 -3.935 1.00 0.00 H new ATOM 0 HD1 TRP A 90 17.976 -12.583 -1.355 1.00 0.00 H new ATOM 0 HE1 TRP A 90 19.038 -10.434 -0.402 1.00 0.00 H new ATOM 0 HE3 TRP A 90 14.854 -9.126 -3.479 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.402 -7.635 -0.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.044 -6.734 -2.869 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.775 -5.988 -1.251 1.00 0.00 H new ATOM 1329 N VAL A 91 12.755 -14.286 -2.650 1.00 0.00 N ATOM 1330 CA VAL A 91 11.746 -15.079 -3.396 1.00 0.00 C ATOM 1331 C VAL A 91 10.454 -15.351 -2.603 1.00 0.00 C ATOM 1332 O VAL A 91 9.544 -16.016 -3.101 1.00 0.00 O ATOM 1333 CB VAL A 91 12.359 -16.408 -3.885 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.460 -16.171 -4.922 1.00 0.00 C ATOM 1335 CG2 VAL A 91 12.944 -17.223 -2.724 1.00 0.00 C ATOM 0 H VAL A 91 13.045 -14.737 -1.782 1.00 0.00 H new ATOM 0 HA VAL A 91 11.456 -14.466 -4.249 1.00 0.00 H new ATOM 0 HB VAL A 91 11.545 -16.969 -4.344 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.869 -17.129 -5.244 1.00 0.00 H new ATOM 0 HG12 VAL A 91 13.043 -15.647 -5.782 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.253 -15.568 -4.479 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.366 -18.152 -3.108 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.726 -16.645 -2.231 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.156 -17.452 -2.007 1.00 0.00 H new ATOM 1345 N THR A 92 10.365 -14.846 -1.370 1.00 0.00 N ATOM 1346 CA THR A 92 9.292 -15.118 -0.386 1.00 0.00 C ATOM 1347 C THR A 92 8.272 -13.961 -0.260 1.00 0.00 C ATOM 1348 O THR A 92 7.278 -14.042 0.463 1.00 0.00 O ATOM 1349 CB THR A 92 9.943 -15.542 0.950 1.00 0.00 C ATOM 1350 OG1 THR A 92 8.989 -15.972 1.903 1.00 0.00 O ATOM 1351 CG2 THR A 92 10.806 -14.436 1.551 1.00 0.00 C ATOM 0 H THR A 92 11.069 -14.204 -1.005 1.00 0.00 H new ATOM 0 HA THR A 92 8.679 -15.946 -0.741 1.00 0.00 H new ATOM 0 HB THR A 92 10.587 -16.387 0.704 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.105 -15.625 1.661 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.241 -14.783 2.488 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.604 -14.178 0.854 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.191 -13.556 1.740 1.00 0.00 H new ATOM 1359 N GLN A 93 8.499 -12.884 -1.018 1.00 0.00 N ATOM 1360 CA GLN A 93 7.654 -11.697 -1.185 1.00 0.00 C ATOM 1361 C GLN A 93 6.211 -12.002 -1.626 1.00 0.00 C ATOM 1362 O GLN A 93 5.920 -13.062 -2.186 1.00 0.00 O ATOM 1363 CB GLN A 93 8.319 -10.792 -2.239 1.00 0.00 C ATOM 1364 CG GLN A 93 9.426 -9.898 -1.667 1.00 0.00 C ATOM 1365 CD GLN A 93 10.715 -10.622 -1.274 1.00 0.00 C ATOM 1366 OE1 GLN A 93 10.960 -11.762 -1.642 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.590 -10.016 -0.505 1.00 0.00 N ATOM 0 H GLN A 93 9.349 -12.814 -1.577 1.00 0.00 H new ATOM 0 HA GLN A 93 7.574 -11.219 -0.209 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.738 -11.415 -3.029 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.557 -10.163 -2.699 1.00 0.00 H new ATOM 0 HG2 GLN A 93 9.669 -9.133 -2.404 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.036 -9.383 -0.789 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.413 -9.065 -0.182 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.447 -10.497 -0.230 1.00 0.00 H new ATOM 1376 N GLU A 94 5.307 -11.031 -1.428 1.00 0.00 N ATOM 1377 CA GLU A 94 3.904 -11.161 -1.846 1.00 0.00 C ATOM 1378 C GLU A 94 3.736 -11.281 -3.372 1.00 0.00 C ATOM 1379 O GLU A 94 2.861 -12.018 -3.833 1.00 0.00 O ATOM 1380 CB GLU A 94 3.040 -10.021 -1.277 1.00 0.00 C ATOM 1381 CG GLU A 94 3.478 -8.588 -1.605 1.00 0.00 C ATOM 1382 CD GLU A 94 2.405 -7.583 -1.142 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.416 -7.182 0.050 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.538 -7.191 -1.958 1.00 0.00 O ATOM 0 H GLU A 94 5.525 -10.142 -0.978 1.00 0.00 H new ATOM 0 HA GLU A 94 3.548 -12.101 -1.424 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.020 -10.155 -1.638 1.00 0.00 H new ATOM 0 HB3 GLU A 94 3.010 -10.127 -0.193 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.427 -8.369 -1.115 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.642 -8.487 -2.678 1.00 0.00 H new ATOM 1391 N ILE A 95 4.583 -10.591 -4.154 1.00 0.00 N ATOM 1392 CA ILE A 95 4.586 -10.641 -5.629 1.00 0.00 C ATOM 1393 C ILE A 95 6.019 -10.807 -6.158 1.00 0.00 C ATOM 1394 O ILE A 95 6.929 -10.073 -5.759 1.00 0.00 O ATOM 1395 CB ILE A 95 3.863 -9.406 -6.225 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.392 -9.369 -5.731 1.00 0.00 C ATOM 1397 CG2 ILE A 95 3.918 -9.401 -7.767 1.00 0.00 C ATOM 1398 CD1 ILE A 95 1.586 -8.143 -6.150 1.00 0.00 C ATOM 0 H ILE A 95 5.298 -9.971 -3.774 1.00 0.00 H new ATOM 0 HA ILE A 95 4.024 -11.516 -5.957 1.00 0.00 H new ATOM 0 HB ILE A 95 4.381 -8.511 -5.880 1.00 0.00 H new ATOM 0 HG12 ILE A 95 1.882 -10.260 -6.098 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.392 -9.427 -4.643 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.401 -8.520 -8.147 1.00 0.00 H new ATOM 0 HG22 ILE A 95 4.958 -9.380 -8.094 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.435 -10.299 -8.151 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.574 -8.219 -5.752 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.062 -7.244 -5.760 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.545 -8.089 -7.238 1.00 0.00 H new ATOM 1410 N PHE A 96 6.199 -11.761 -7.079 1.00 0.00 N ATOM 1411 CA PHE A 96 7.477 -12.097 -7.716 1.00 0.00 C ATOM 1412 C PHE A 96 7.316 -12.432 -9.213 1.00 0.00 C ATOM 1413 O PHE A 96 6.290 -12.968 -9.632 1.00 0.00 O ATOM 1414 CB PHE A 96 8.132 -13.257 -6.949 1.00 0.00 C ATOM 1415 CG PHE A 96 9.534 -13.615 -7.416 1.00 0.00 C ATOM 1416 CD1 PHE A 96 9.728 -14.562 -8.442 1.00 0.00 C ATOM 1417 CD2 PHE A 96 10.651 -12.990 -6.833 1.00 0.00 C ATOM 1418 CE1 PHE A 96 11.026 -14.867 -8.888 1.00 0.00 C ATOM 1419 CE2 PHE A 96 11.950 -13.290 -7.285 1.00 0.00 C ATOM 1420 CZ PHE A 96 12.138 -14.225 -8.317 1.00 0.00 C ATOM 0 H PHE A 96 5.430 -12.341 -7.413 1.00 0.00 H new ATOM 0 HA PHE A 96 8.125 -11.221 -7.672 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.171 -12.999 -5.891 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.497 -14.139 -7.039 1.00 0.00 H new ATOM 0 HD1 PHE A 96 8.876 -15.055 -8.887 1.00 0.00 H new ATOM 0 HD2 PHE A 96 10.511 -12.276 -6.035 1.00 0.00 H new ATOM 0 HE1 PHE A 96 11.169 -15.597 -9.671 1.00 0.00 H new ATOM 0 HE2 PHE A 96 12.803 -12.801 -6.838 1.00 0.00 H new ATOM 0 HZ PHE A 96 13.134 -14.449 -8.670 1.00 0.00 H new ATOM 1430 N GLU A 97 8.348 -12.141 -10.011 1.00 0.00 N ATOM 1431 CA GLU A 97 8.473 -12.503 -11.436 1.00 0.00 C ATOM 1432 C GLU A 97 9.947 -12.790 -11.788 1.00 0.00 C ATOM 1433 O GLU A 97 10.844 -12.287 -11.113 1.00 0.00 O ATOM 1434 CB GLU A 97 8.012 -11.350 -12.350 1.00 0.00 C ATOM 1435 CG GLU A 97 6.585 -10.812 -12.189 1.00 0.00 C ATOM 1436 CD GLU A 97 5.468 -11.793 -12.596 1.00 0.00 C ATOM 1437 OE1 GLU A 97 5.734 -12.861 -13.200 1.00 0.00 O ATOM 1438 OE2 GLU A 97 4.284 -11.446 -12.360 1.00 0.00 O ATOM 0 H GLU A 97 9.158 -11.623 -9.671 1.00 0.00 H new ATOM 0 HA GLU A 97 7.849 -13.383 -11.594 1.00 0.00 H new ATOM 0 HB2 GLU A 97 8.699 -10.516 -12.203 1.00 0.00 H new ATOM 0 HB3 GLU A 97 8.127 -11.680 -13.383 1.00 0.00 H new ATOM 0 HG2 GLU A 97 6.436 -10.527 -11.147 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.486 -9.905 -12.785 1.00 0.00 H new ATOM 1445 N ASP A 98 10.209 -13.526 -12.876 1.00 0.00 N ATOM 1446 CA ASP A 98 11.558 -13.682 -13.443 1.00 0.00 C ATOM 1447 C ASP A 98 11.532 -13.624 -14.984 1.00 0.00 C ATOM 1448 O ASP A 98 11.397 -14.645 -15.663 1.00 0.00 O ATOM 1449 CB ASP A 98 12.242 -14.949 -12.908 1.00 0.00 C ATOM 1450 CG ASP A 98 13.704 -15.057 -13.370 1.00 0.00 C ATOM 1451 OD1 ASP A 98 14.307 -14.028 -13.760 1.00 0.00 O ATOM 1452 OD2 ASP A 98 14.251 -16.177 -13.337 1.00 0.00 O ATOM 0 H ASP A 98 9.489 -14.033 -13.391 1.00 0.00 H new ATOM 0 HA ASP A 98 12.163 -12.837 -13.114 1.00 0.00 H new ATOM 0 HB2 ASP A 98 12.206 -14.947 -11.819 1.00 0.00 H new ATOM 0 HB3 ASP A 98 11.691 -15.827 -13.244 1.00 0.00 H new ATOM 1457 N TRP A 99 11.607 -12.405 -15.529 1.00 0.00 N ATOM 1458 CA TRP A 99 11.406 -12.085 -16.947 1.00 0.00 C ATOM 1459 C TRP A 99 12.503 -12.644 -17.866 1.00 0.00 C ATOM 1460 O TRP A 99 13.681 -12.692 -17.518 1.00 0.00 O ATOM 1461 CB TRP A 99 11.238 -10.557 -17.110 1.00 0.00 C ATOM 1462 CG TRP A 99 10.060 -9.933 -16.408 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.918 -10.584 -16.076 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.855 -8.541 -15.982 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.038 -9.712 -15.476 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.564 -8.448 -15.386 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.591 -7.331 -16.062 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.037 -7.254 -14.894 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.074 -6.118 -15.558 1.00 0.00 C ATOM 1470 CH2 TRP A 99 8.797 -6.077 -14.974 1.00 0.00 C ATOM 0 H TRP A 99 11.819 -11.579 -14.970 1.00 0.00 H new ATOM 0 HA TRP A 99 10.493 -12.585 -17.270 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.146 -10.073 -16.749 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.159 -10.334 -18.174 1.00 0.00 H new ATOM 0 HD1 TRP A 99 8.727 -11.632 -16.256 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.111 -9.973 -15.140 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.569 -7.338 -16.519 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.051 -7.235 -14.454 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.664 -5.216 -15.622 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.403 -5.148 -14.590 1.00 0.00 H new ATOM 1481 N GLN A 100 12.111 -13.014 -19.089 1.00 0.00 N ATOM 1482 CA GLN A 100 12.937 -13.691 -20.110 1.00 0.00 C ATOM 1483 C GLN A 100 13.430 -12.622 -21.095 1.00 0.00 C ATOM 1484 O GLN A 100 13.100 -12.607 -22.281 1.00 0.00 O ATOM 1485 CB GLN A 100 12.110 -14.819 -20.764 1.00 0.00 C ATOM 1486 CG GLN A 100 11.735 -15.930 -19.766 1.00 0.00 C ATOM 1487 CD GLN A 100 10.724 -16.928 -20.335 1.00 0.00 C ATOM 1488 OE1 GLN A 100 10.825 -17.402 -21.461 1.00 0.00 O ATOM 1489 NE2 GLN A 100 9.714 -17.299 -19.574 1.00 0.00 N ATOM 0 H GLN A 100 11.160 -12.843 -19.417 1.00 0.00 H new ATOM 0 HA GLN A 100 13.817 -14.173 -19.684 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.200 -14.397 -21.192 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.679 -15.251 -21.587 1.00 0.00 H new ATOM 0 HG2 GLN A 100 12.638 -16.464 -19.470 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.322 -15.477 -18.865 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.615 -16.914 -18.635 1.00 0.00 H new ATOM 0 HE22 GLN A 100 9.031 -17.971 -19.924 1.00 0.00 H new ATOM 1498 N LEU A 101 14.176 -11.671 -20.532 1.00 0.00 N ATOM 1499 CA LEU A 101 14.571 -10.408 -21.150 1.00 0.00 C ATOM 1500 C LEU A 101 16.094 -10.318 -21.379 1.00 0.00 C ATOM 1501 O LEU A 101 16.886 -10.540 -20.465 1.00 0.00 O ATOM 1502 CB LEU A 101 13.970 -9.364 -20.188 1.00 0.00 C ATOM 1503 CG LEU A 101 13.851 -7.903 -20.607 1.00 0.00 C ATOM 1504 CD1 LEU A 101 15.184 -7.170 -20.490 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.282 -7.714 -22.006 1.00 0.00 C ATOM 0 H LEU A 101 14.539 -11.767 -19.584 1.00 0.00 H new ATOM 0 HA LEU A 101 14.202 -10.262 -22.165 1.00 0.00 H new ATOM 0 HB2 LEU A 101 12.969 -9.706 -19.927 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.564 -9.389 -19.274 1.00 0.00 H new ATOM 0 HG LEU A 101 13.138 -7.467 -19.907 1.00 0.00 H new ATOM 0 HD11 LEU A 101 15.057 -6.132 -20.798 1.00 0.00 H new ATOM 0 HD12 LEU A 101 15.528 -7.202 -19.456 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.921 -7.651 -21.133 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.226 -6.650 -22.235 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.928 -8.208 -22.731 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.283 -8.148 -22.054 1.00 0.00 H new ATOM 1517 N GLU A 102 16.499 -10.007 -22.615 1.00 0.00 N ATOM 1518 CA GLU A 102 17.895 -10.011 -23.070 1.00 0.00 C ATOM 1519 C GLU A 102 18.642 -8.691 -22.807 1.00 0.00 C ATOM 1520 O GLU A 102 18.055 -7.667 -22.461 1.00 0.00 O ATOM 1521 CB GLU A 102 17.944 -10.415 -24.558 1.00 0.00 C ATOM 1522 CG GLU A 102 17.419 -9.343 -25.519 1.00 0.00 C ATOM 1523 CD GLU A 102 17.425 -9.867 -26.968 1.00 0.00 C ATOM 1524 OE1 GLU A 102 18.526 -9.997 -27.559 1.00 0.00 O ATOM 1525 OE2 GLU A 102 16.334 -10.152 -27.518 1.00 0.00 O ATOM 0 H GLU A 102 15.845 -9.737 -23.350 1.00 0.00 H new ATOM 0 HA GLU A 102 18.430 -10.749 -22.473 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.974 -10.652 -24.824 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.361 -11.326 -24.695 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.407 -9.055 -25.234 1.00 0.00 H new ATOM 0 HG3 GLU A 102 18.037 -8.448 -25.447 1.00 0.00 H new ATOM 1532 N ASP A 103 19.957 -8.709 -23.008 1.00 0.00 N ATOM 1533 CA ASP A 103 20.825 -7.529 -22.898 1.00 0.00 C ATOM 1534 C ASP A 103 21.162 -6.959 -24.292 1.00 0.00 C ATOM 1535 O ASP A 103 21.754 -7.670 -25.111 1.00 0.00 O ATOM 1536 CB ASP A 103 22.095 -7.916 -22.118 1.00 0.00 C ATOM 1537 CG ASP A 103 22.856 -6.718 -21.533 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.712 -5.595 -22.063 1.00 0.00 O ATOM 1539 OD2 ASP A 103 23.579 -6.926 -20.525 1.00 0.00 O ATOM 0 H ASP A 103 20.464 -9.559 -23.257 1.00 0.00 H new ATOM 0 HA ASP A 103 20.304 -6.740 -22.355 1.00 0.00 H new ATOM 0 HB2 ASP A 103 21.820 -8.590 -21.307 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.761 -8.469 -22.780 1.00 0.00 H new ATOM 1544 N PRO A 104 20.804 -5.697 -24.601 1.00 0.00 N ATOM 1545 CA PRO A 104 21.156 -5.067 -25.870 1.00 0.00 C ATOM 1546 C PRO A 104 22.629 -4.617 -25.946 1.00 0.00 C ATOM 1547 O PRO A 104 23.096 -4.288 -27.035 1.00 0.00 O ATOM 1548 CB PRO A 104 20.185 -3.896 -26.004 1.00 0.00 C ATOM 1549 CG PRO A 104 19.946 -3.470 -24.560 1.00 0.00 C ATOM 1550 CD PRO A 104 19.970 -4.803 -23.809 1.00 0.00 C ATOM 0 HA PRO A 104 21.068 -5.774 -26.695 1.00 0.00 H new ATOM 0 HB2 PRO A 104 20.611 -3.086 -26.597 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.258 -4.196 -26.493 1.00 0.00 H new ATOM 0 HG2 PRO A 104 20.721 -2.791 -24.204 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.992 -2.956 -24.442 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.376 -4.678 -22.805 1.00 0.00 H new ATOM 0 HD3 PRO A 104 18.963 -5.206 -23.697 1.00 0.00 H new ATOM 1558 N ASP A 105 23.389 -4.616 -24.843 1.00 0.00 N ATOM 1559 CA ASP A 105 24.832 -4.345 -24.875 1.00 0.00 C ATOM 1560 C ASP A 105 25.577 -5.342 -25.790 1.00 0.00 C ATOM 1561 O ASP A 105 25.419 -6.562 -25.669 1.00 0.00 O ATOM 1562 CB ASP A 105 25.394 -4.370 -23.447 1.00 0.00 C ATOM 1563 CG ASP A 105 26.911 -4.121 -23.394 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.434 -3.309 -24.193 1.00 0.00 O ATOM 1565 OD2 ASP A 105 27.581 -4.747 -22.540 1.00 0.00 O ATOM 0 H ASP A 105 23.024 -4.802 -23.909 1.00 0.00 H new ATOM 0 HA ASP A 105 24.989 -3.352 -25.297 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.886 -3.613 -22.849 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.174 -5.336 -22.993 1.00 0.00 H new ATOM 1570 N GLY A 106 26.372 -4.815 -26.728 1.00 0.00 N ATOM 1571 CA GLY A 106 27.030 -5.594 -27.785 1.00 0.00 C ATOM 1572 C GLY A 106 26.127 -5.970 -28.975 1.00 0.00 C ATOM 1573 O GLY A 106 26.591 -6.649 -29.895 1.00 0.00 O ATOM 0 H GLY A 106 26.580 -3.818 -26.775 1.00 0.00 H new ATOM 0 HA2 GLY A 106 27.880 -5.024 -28.160 1.00 0.00 H new ATOM 0 HA3 GLY A 106 27.428 -6.509 -27.347 1.00 0.00 H new ATOM 1577 N GLN A 107 24.863 -5.525 -28.982 1.00 0.00 N ATOM 1578 CA GLN A 107 23.900 -5.687 -30.083 1.00 0.00 C ATOM 1579 C GLN A 107 23.566 -4.333 -30.761 1.00 0.00 C ATOM 1580 O GLN A 107 24.118 -3.289 -30.403 1.00 0.00 O ATOM 1581 CB GLN A 107 22.646 -6.430 -29.574 1.00 0.00 C ATOM 1582 CG GLN A 107 22.945 -7.760 -28.858 1.00 0.00 C ATOM 1583 CD GLN A 107 21.699 -8.643 -28.783 1.00 0.00 C ATOM 1584 OE1 GLN A 107 21.275 -9.239 -29.766 1.00 0.00 O ATOM 1585 NE2 GLN A 107 21.049 -8.739 -27.647 1.00 0.00 N ATOM 0 H GLN A 107 24.466 -5.021 -28.189 1.00 0.00 H new ATOM 0 HA GLN A 107 24.354 -6.298 -30.863 1.00 0.00 H new ATOM 0 HB2 GLN A 107 22.103 -5.777 -28.891 1.00 0.00 H new ATOM 0 HB3 GLN A 107 21.986 -6.626 -30.419 1.00 0.00 H new ATOM 0 HG2 GLN A 107 23.737 -8.290 -29.387 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.312 -7.559 -27.852 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.391 -8.248 -26.821 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.202 -9.305 -27.590 1.00 0.00 H new ATOM 1594 N SER A 108 22.689 -4.351 -31.776 1.00 0.00 N ATOM 1595 CA SER A 108 22.344 -3.163 -32.582 1.00 0.00 C ATOM 1596 C SER A 108 21.445 -2.178 -31.824 1.00 0.00 C ATOM 1597 O SER A 108 20.730 -2.551 -30.894 1.00 0.00 O ATOM 1598 CB SER A 108 21.707 -3.606 -33.910 1.00 0.00 C ATOM 1599 OG SER A 108 21.384 -2.483 -34.716 1.00 0.00 O ATOM 0 H SER A 108 22.194 -5.195 -32.065 1.00 0.00 H new ATOM 0 HA SER A 108 23.266 -2.621 -32.794 1.00 0.00 H new ATOM 0 HB2 SER A 108 22.394 -4.259 -34.448 1.00 0.00 H new ATOM 0 HB3 SER A 108 20.806 -4.186 -33.710 1.00 0.00 H new ATOM 0 HG SER A 108 20.982 -2.788 -35.556 1.00 0.00 H new ATOM 1605 N LEU A 109 21.409 -0.916 -32.262 1.00 0.00 N ATOM 1606 CA LEU A 109 20.529 0.124 -31.712 1.00 0.00 C ATOM 1607 C LEU A 109 19.042 -0.216 -31.916 1.00 0.00 C ATOM 1608 O LEU A 109 18.207 0.151 -31.094 1.00 0.00 O ATOM 1609 CB LEU A 109 20.907 1.503 -32.297 1.00 0.00 C ATOM 1610 CG LEU A 109 22.324 2.043 -31.988 1.00 0.00 C ATOM 1611 CD1 LEU A 109 22.737 1.848 -30.526 1.00 0.00 C ATOM 1612 CD2 LEU A 109 23.418 1.439 -32.874 1.00 0.00 C ATOM 0 H LEU A 109 22.001 -0.581 -33.022 1.00 0.00 H new ATOM 0 HA LEU A 109 20.678 0.168 -30.633 1.00 0.00 H new ATOM 0 HB2 LEU A 109 20.795 1.452 -33.380 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.182 2.232 -31.936 1.00 0.00 H new ATOM 0 HG LEU A 109 22.241 3.108 -32.204 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.740 2.247 -30.375 1.00 0.00 H new ATOM 0 HD12 LEU A 109 22.036 2.372 -29.877 1.00 0.00 H new ATOM 0 HD13 LEU A 109 22.730 0.785 -30.285 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.384 1.864 -32.601 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.444 0.358 -32.734 1.00 0.00 H new ATOM 0 HD23 LEU A 109 23.205 1.664 -33.919 1.00 0.00 H new ATOM 1624 N GLU A 110 18.716 -1.020 -32.931 1.00 0.00 N ATOM 1625 CA GLU A 110 17.376 -1.600 -33.108 1.00 0.00 C ATOM 1626 C GLU A 110 17.040 -2.605 -31.986 1.00 0.00 C ATOM 1627 O GLU A 110 15.895 -2.677 -31.543 1.00 0.00 O ATOM 1628 CB GLU A 110 17.305 -2.253 -34.498 1.00 0.00 C ATOM 1629 CG GLU A 110 15.898 -2.741 -34.866 1.00 0.00 C ATOM 1630 CD GLU A 110 15.862 -3.273 -36.314 1.00 0.00 C ATOM 1631 OE1 GLU A 110 16.183 -4.466 -36.543 1.00 0.00 O ATOM 1632 OE2 GLU A 110 15.506 -2.502 -37.240 1.00 0.00 O ATOM 0 H GLU A 110 19.376 -1.291 -33.660 1.00 0.00 H new ATOM 0 HA GLU A 110 16.627 -0.811 -33.042 1.00 0.00 H new ATOM 0 HB2 GLU A 110 17.641 -1.536 -35.247 1.00 0.00 H new ATOM 0 HB3 GLU A 110 17.995 -3.096 -34.532 1.00 0.00 H new ATOM 0 HG2 GLU A 110 15.590 -3.528 -34.177 1.00 0.00 H new ATOM 0 HG3 GLU A 110 15.185 -1.924 -34.756 1.00 0.00 H new ATOM 1639 N VAL A 111 18.035 -3.321 -31.446 1.00 0.00 N ATOM 1640 CA VAL A 111 17.857 -4.205 -30.282 1.00 0.00 C ATOM 1641 C VAL A 111 17.684 -3.377 -29.010 1.00 0.00 C ATOM 1642 O VAL A 111 16.799 -3.691 -28.222 1.00 0.00 O ATOM 1643 CB VAL A 111 18.965 -5.271 -30.159 1.00 0.00 C ATOM 1644 CG1 VAL A 111 18.632 -6.274 -29.048 1.00 0.00 C ATOM 1645 CG2 VAL A 111 19.103 -6.074 -31.458 1.00 0.00 C ATOM 0 H VAL A 111 18.990 -3.305 -31.804 1.00 0.00 H new ATOM 0 HA VAL A 111 16.941 -4.775 -30.436 1.00 0.00 H new ATOM 0 HB VAL A 111 19.890 -4.739 -29.938 1.00 0.00 H new ATOM 0 HG11 VAL A 111 19.427 -7.017 -28.978 1.00 0.00 H new ATOM 0 HG12 VAL A 111 18.543 -5.748 -28.098 1.00 0.00 H new ATOM 0 HG13 VAL A 111 17.689 -6.771 -29.277 1.00 0.00 H new ATOM 0 HG21 VAL A 111 19.891 -6.818 -31.344 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.160 -6.575 -31.678 1.00 0.00 H new ATOM 0 HG23 VAL A 111 19.356 -5.401 -32.277 1.00 0.00 H new ATOM 1655 N PHE A 112 18.404 -2.260 -28.832 1.00 0.00 N ATOM 1656 CA PHE A 112 18.117 -1.307 -27.737 1.00 0.00 C ATOM 1657 C PHE A 112 16.672 -0.786 -27.828 1.00 0.00 C ATOM 1658 O PHE A 112 15.931 -0.861 -26.851 1.00 0.00 O ATOM 1659 CB PHE A 112 19.119 -0.133 -27.737 1.00 0.00 C ATOM 1660 CG PHE A 112 20.483 -0.422 -27.131 1.00 0.00 C ATOM 1661 CD1 PHE A 112 20.701 -0.212 -25.755 1.00 0.00 C ATOM 1662 CD2 PHE A 112 21.543 -0.881 -27.933 1.00 0.00 C ATOM 1663 CE1 PHE A 112 21.962 -0.465 -25.189 1.00 0.00 C ATOM 1664 CE2 PHE A 112 22.806 -1.129 -27.369 1.00 0.00 C ATOM 1665 CZ PHE A 112 23.016 -0.928 -25.997 1.00 0.00 C ATOM 0 H PHE A 112 19.187 -1.990 -29.427 1.00 0.00 H new ATOM 0 HA PHE A 112 18.230 -1.844 -26.795 1.00 0.00 H new ATOM 0 HB2 PHE A 112 19.263 0.196 -28.766 1.00 0.00 H new ATOM 0 HB3 PHE A 112 18.672 0.701 -27.195 1.00 0.00 H new ATOM 0 HD1 PHE A 112 19.895 0.145 -25.132 1.00 0.00 H new ATOM 0 HD2 PHE A 112 21.385 -1.044 -28.989 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.122 -0.304 -24.133 1.00 0.00 H new ATOM 0 HE2 PHE A 112 23.617 -1.475 -27.993 1.00 0.00 H new ATOM 0 HZ PHE A 112 23.984 -1.128 -25.562 1.00 0.00 H new ATOM 1675 N ARG A 113 16.225 -0.340 -29.013 1.00 0.00 N ATOM 1676 CA ARG A 113 14.849 0.163 -29.237 1.00 0.00 C ATOM 1677 C ARG A 113 13.768 -0.916 -29.103 1.00 0.00 C ATOM 1678 O ARG A 113 12.649 -0.610 -28.702 1.00 0.00 O ATOM 1679 CB ARG A 113 14.751 0.855 -30.611 1.00 0.00 C ATOM 1680 CG ARG A 113 15.457 2.214 -30.586 1.00 0.00 C ATOM 1681 CD ARG A 113 15.321 2.964 -31.915 1.00 0.00 C ATOM 1682 NE ARG A 113 15.801 4.354 -31.768 1.00 0.00 N ATOM 1683 CZ ARG A 113 16.298 5.144 -32.701 1.00 0.00 C ATOM 1684 NH1 ARG A 113 16.386 4.792 -33.952 1.00 0.00 N ATOM 1685 NH2 ARG A 113 16.724 6.325 -32.367 1.00 0.00 N ATOM 0 H ARG A 113 16.807 -0.316 -29.851 1.00 0.00 H new ATOM 0 HA ARG A 113 14.655 0.885 -28.444 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.200 0.221 -31.376 1.00 0.00 H new ATOM 0 HB3 ARG A 113 13.704 0.989 -30.882 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.040 2.823 -29.783 1.00 0.00 H new ATOM 0 HG3 ARG A 113 16.513 2.068 -30.360 1.00 0.00 H new ATOM 0 HD2 ARG A 113 15.894 2.454 -32.689 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.279 2.963 -32.236 1.00 0.00 H new ATOM 0 HE ARG A 113 15.741 4.751 -30.831 1.00 0.00 H new ATOM 0 HH11 ARG A 113 16.063 3.870 -34.246 1.00 0.00 H new ATOM 0 HH12 ARG A 113 16.778 5.438 -34.637 1.00 0.00 H new ATOM 0 HH21 ARG A 113 16.672 6.630 -31.395 1.00 0.00 H new ATOM 0 HH22 ARG A 113 17.111 6.947 -33.077 1.00 0.00 H new ATOM 1699 N THR A 114 14.112 -2.177 -29.349 1.00 0.00 N ATOM 1700 CA THR A 114 13.236 -3.323 -29.084 1.00 0.00 C ATOM 1701 C THR A 114 13.151 -3.623 -27.590 1.00 0.00 C ATOM 1702 O THR A 114 12.060 -3.641 -27.022 1.00 0.00 O ATOM 1703 CB THR A 114 13.692 -4.572 -29.857 1.00 0.00 C ATOM 1704 OG1 THR A 114 13.711 -4.324 -31.246 1.00 0.00 O ATOM 1705 CG2 THR A 114 12.717 -5.725 -29.629 1.00 0.00 C ATOM 0 H THR A 114 15.016 -2.439 -29.742 1.00 0.00 H new ATOM 0 HA THR A 114 12.240 -3.053 -29.435 1.00 0.00 H new ATOM 0 HB THR A 114 14.690 -4.824 -29.497 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.464 -3.735 -31.463 1.00 0.00 H new ATOM 0 HG21 THR A 114 13.054 -6.601 -30.183 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.675 -5.962 -28.566 1.00 0.00 H new ATOM 0 HG23 THR A 114 11.725 -5.436 -29.975 1.00 0.00 H new ATOM 1713 N VAL A 115 14.295 -3.836 -26.928 1.00 0.00 N ATOM 1714 CA VAL A 115 14.359 -4.270 -25.520 1.00 0.00 C ATOM 1715 C VAL A 115 13.806 -3.195 -24.595 1.00 0.00 C ATOM 1716 O VAL A 115 13.088 -3.540 -23.662 1.00 0.00 O ATOM 1717 CB VAL A 115 15.781 -4.735 -25.124 1.00 0.00 C ATOM 1718 CG1 VAL A 115 15.850 -5.092 -23.633 1.00 0.00 C ATOM 1719 CG2 VAL A 115 16.183 -5.987 -25.911 1.00 0.00 C ATOM 0 H VAL A 115 15.213 -3.712 -27.355 1.00 0.00 H new ATOM 0 HA VAL A 115 13.719 -5.145 -25.406 1.00 0.00 H new ATOM 0 HB VAL A 115 16.456 -3.908 -25.347 1.00 0.00 H new ATOM 0 HG11 VAL A 115 16.860 -5.415 -23.383 1.00 0.00 H new ATOM 0 HG12 VAL A 115 15.591 -4.217 -23.037 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.148 -5.898 -23.419 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.186 -6.296 -25.616 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.479 -6.792 -25.699 1.00 0.00 H new ATOM 0 HG23 VAL A 115 16.171 -5.766 -26.978 1.00 0.00 H new ATOM 1729 N ARG A 116 13.988 -1.906 -24.902 1.00 0.00 N ATOM 1730 CA ARG A 116 13.389 -0.813 -24.112 1.00 0.00 C ATOM 1731 C ARG A 116 11.860 -0.903 -24.042 1.00 0.00 C ATOM 1732 O ARG A 116 11.285 -0.819 -22.965 1.00 0.00 O ATOM 1733 CB ARG A 116 13.945 0.543 -24.605 1.00 0.00 C ATOM 1734 CG ARG A 116 13.308 1.183 -25.848 1.00 0.00 C ATOM 1735 CD ARG A 116 13.933 2.580 -26.044 1.00 0.00 C ATOM 1736 NE ARG A 116 13.616 3.284 -27.312 1.00 0.00 N ATOM 1737 CZ ARG A 116 12.463 3.565 -27.899 1.00 0.00 C ATOM 1738 NH1 ARG A 116 11.308 3.139 -27.476 1.00 0.00 N ATOM 1739 NH2 ARG A 116 12.470 4.322 -28.952 1.00 0.00 N ATOM 0 H ARG A 116 14.547 -1.588 -25.694 1.00 0.00 H new ATOM 0 HA ARG A 116 13.688 -0.913 -23.069 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.860 1.255 -23.784 1.00 0.00 H new ATOM 0 HB3 ARG A 116 15.008 0.413 -24.806 1.00 0.00 H new ATOM 0 HG2 ARG A 116 13.482 0.562 -26.727 1.00 0.00 H new ATOM 0 HG3 ARG A 116 12.228 1.264 -25.723 1.00 0.00 H new ATOM 0 HD2 ARG A 116 13.616 3.213 -25.216 1.00 0.00 H new ATOM 0 HD3 ARG A 116 15.016 2.481 -25.972 1.00 0.00 H new ATOM 0 HE ARG A 116 14.435 3.611 -27.824 1.00 0.00 H new ATOM 0 HH11 ARG A 116 11.255 2.551 -26.644 1.00 0.00 H new ATOM 0 HH12 ARG A 116 10.456 3.393 -27.976 1.00 0.00 H new ATOM 0 HH21 ARG A 116 13.352 4.688 -29.311 1.00 0.00 H new ATOM 0 HH22 ARG A 116 11.594 4.552 -29.421 1.00 0.00 H new ATOM 1753 N GLY A 117 11.220 -1.222 -25.168 1.00 0.00 N ATOM 1754 CA GLY A 117 9.773 -1.469 -25.234 1.00 0.00 C ATOM 1755 C GLY A 117 9.361 -2.763 -24.527 1.00 0.00 C ATOM 1756 O GLY A 117 8.333 -2.790 -23.855 1.00 0.00 O ATOM 0 H GLY A 117 11.691 -1.318 -26.067 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.244 -0.629 -24.783 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.464 -1.516 -26.278 1.00 0.00 H new ATOM 1760 N GLN A 118 10.203 -3.806 -24.566 1.00 0.00 N ATOM 1761 CA GLN A 118 9.918 -5.076 -23.877 1.00 0.00 C ATOM 1762 C GLN A 118 9.980 -4.911 -22.359 1.00 0.00 C ATOM 1763 O GLN A 118 9.118 -5.431 -21.655 1.00 0.00 O ATOM 1764 CB GLN A 118 10.860 -6.214 -24.344 1.00 0.00 C ATOM 1765 CG GLN A 118 10.917 -6.533 -25.848 1.00 0.00 C ATOM 1766 CD GLN A 118 9.604 -6.320 -26.603 1.00 0.00 C ATOM 1767 OE1 GLN A 118 8.675 -7.110 -26.524 1.00 0.00 O ATOM 1768 NE2 GLN A 118 9.484 -5.244 -27.356 1.00 0.00 N ATOM 0 H GLN A 118 11.090 -3.796 -25.069 1.00 0.00 H new ATOM 0 HA GLN A 118 8.901 -5.361 -24.148 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.870 -5.967 -24.017 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.569 -7.125 -23.820 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.687 -5.913 -26.307 1.00 0.00 H new ATOM 0 HG3 GLN A 118 11.226 -7.571 -25.973 1.00 0.00 H new ATOM 0 HE21 GLN A 118 10.256 -4.581 -27.425 1.00 0.00 H new ATOM 0 HE22 GLN A 118 8.619 -5.074 -27.869 1.00 0.00 H new ATOM 1777 N VAL A 119 10.946 -4.135 -21.860 1.00 0.00 N ATOM 1778 CA VAL A 119 11.021 -3.712 -20.448 1.00 0.00 C ATOM 1779 C VAL A 119 9.811 -2.862 -20.080 1.00 0.00 C ATOM 1780 O VAL A 119 9.130 -3.197 -19.120 1.00 0.00 O ATOM 1781 CB VAL A 119 12.340 -2.963 -20.171 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.410 -2.392 -18.753 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.544 -3.895 -20.320 1.00 0.00 C ATOM 0 H VAL A 119 11.712 -3.775 -22.429 1.00 0.00 H new ATOM 0 HA VAL A 119 11.009 -4.602 -19.818 1.00 0.00 H new ATOM 0 HB VAL A 119 12.365 -2.153 -20.900 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.360 -1.876 -18.615 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.590 -1.689 -18.603 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.330 -3.203 -18.030 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.461 -3.340 -20.119 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.456 -4.719 -19.612 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.575 -4.291 -21.335 1.00 0.00 H new ATOM 1793 N LYS A 120 9.486 -1.814 -20.849 1.00 0.00 N ATOM 1794 CA LYS A 120 8.335 -0.915 -20.606 1.00 0.00 C ATOM 1795 C LYS A 120 7.017 -1.671 -20.491 1.00 0.00 C ATOM 1796 O LYS A 120 6.320 -1.461 -19.514 1.00 0.00 O ATOM 1797 CB LYS A 120 8.326 0.158 -21.719 1.00 0.00 C ATOM 1798 CG LYS A 120 7.220 1.218 -21.574 1.00 0.00 C ATOM 1799 CD LYS A 120 6.004 0.962 -22.480 1.00 0.00 C ATOM 1800 CE LYS A 120 4.960 2.079 -22.299 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.808 1.924 -23.238 1.00 0.00 N ATOM 0 H LYS A 120 10.024 -1.557 -21.677 1.00 0.00 H new ATOM 0 HA LYS A 120 8.447 -0.425 -19.639 1.00 0.00 H new ATOM 0 HB2 LYS A 120 9.294 0.660 -21.730 1.00 0.00 H new ATOM 0 HB3 LYS A 120 8.213 -0.338 -22.683 1.00 0.00 H new ATOM 0 HG2 LYS A 120 6.890 1.248 -20.536 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.635 2.199 -21.805 1.00 0.00 H new ATOM 0 HD2 LYS A 120 6.321 0.916 -23.522 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.559 -0.004 -22.239 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.595 2.071 -21.272 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.433 3.047 -22.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 3.128 2.696 -23.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 4.153 1.957 -24.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 3.340 1.011 -23.066 1.00 0.00 H new ATOM 1815 N GLU A 121 6.686 -2.599 -21.387 1.00 0.00 N ATOM 1816 CA GLU A 121 5.413 -3.351 -21.268 1.00 0.00 C ATOM 1817 C GLU A 121 5.394 -4.306 -20.062 1.00 0.00 C ATOM 1818 O GLU A 121 4.342 -4.560 -19.470 1.00 0.00 O ATOM 1819 CB GLU A 121 5.070 -4.069 -22.586 1.00 0.00 C ATOM 1820 CG GLU A 121 5.990 -5.245 -22.937 1.00 0.00 C ATOM 1821 CD GLU A 121 5.599 -5.987 -24.235 1.00 0.00 C ATOM 1822 OE1 GLU A 121 4.945 -5.400 -25.132 1.00 0.00 O ATOM 1823 OE2 GLU A 121 5.975 -7.179 -24.359 1.00 0.00 O ATOM 0 H GLU A 121 7.260 -2.853 -22.191 1.00 0.00 H new ATOM 0 HA GLU A 121 4.628 -2.620 -21.076 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.044 -4.433 -22.529 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.106 -3.343 -23.398 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.011 -4.877 -23.035 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.986 -5.955 -22.110 1.00 0.00 H new ATOM 1830 N ARG A 122 6.573 -4.791 -19.643 1.00 0.00 N ATOM 1831 CA ARG A 122 6.746 -5.624 -18.439 1.00 0.00 C ATOM 1832 C ARG A 122 6.586 -4.802 -17.161 1.00 0.00 C ATOM 1833 O ARG A 122 5.755 -5.146 -16.327 1.00 0.00 O ATOM 1834 CB ARG A 122 8.064 -6.415 -18.547 1.00 0.00 C ATOM 1835 CG ARG A 122 7.866 -7.590 -19.518 1.00 0.00 C ATOM 1836 CD ARG A 122 9.177 -8.189 -20.055 1.00 0.00 C ATOM 1837 NE ARG A 122 8.897 -9.229 -21.073 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.339 -9.063 -22.264 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.078 -7.886 -22.743 1.00 0.00 N ATOM 1840 NH2 ARG A 122 8.012 -10.078 -23.004 1.00 0.00 N ATOM 0 H ARG A 122 7.447 -4.614 -20.138 1.00 0.00 H new ATOM 0 HA ARG A 122 5.950 -6.366 -18.376 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.865 -5.765 -18.901 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.363 -6.784 -17.566 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.301 -8.374 -19.013 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.261 -7.254 -20.360 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.791 -7.401 -20.491 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.749 -8.621 -19.234 1.00 0.00 H new ATOM 0 HE ARG A 122 9.165 -10.183 -20.829 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.303 -7.053 -22.199 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.648 -7.794 -23.663 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.183 -11.027 -22.672 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.584 -9.926 -23.917 1.00 0.00 H new ATOM 1854 N VAL A 123 7.269 -3.659 -17.043 1.00 0.00 N ATOM 1855 CA VAL A 123 7.056 -2.727 -15.920 1.00 0.00 C ATOM 1856 C VAL A 123 5.644 -2.145 -15.879 1.00 0.00 C ATOM 1857 O VAL A 123 5.072 -2.086 -14.800 1.00 0.00 O ATOM 1858 CB VAL A 123 8.129 -1.629 -15.838 1.00 0.00 C ATOM 1859 CG1 VAL A 123 9.512 -2.241 -15.593 1.00 0.00 C ATOM 1860 CG2 VAL A 123 8.237 -0.688 -17.019 1.00 0.00 C ATOM 0 H VAL A 123 7.977 -3.352 -17.711 1.00 0.00 H new ATOM 0 HA VAL A 123 7.164 -3.337 -15.023 1.00 0.00 H new ATOM 0 HB VAL A 123 7.786 -1.019 -15.002 1.00 0.00 H new ATOM 0 HG11 VAL A 123 10.257 -1.447 -15.538 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.503 -2.796 -14.655 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.761 -2.916 -16.411 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.030 0.037 -16.835 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.468 -1.258 -17.919 1.00 0.00 H new ATOM 0 HG23 VAL A 123 7.291 -0.164 -17.155 1.00 0.00 H new ATOM 1870 N GLU A 124 5.025 -1.771 -17.002 1.00 0.00 N ATOM 1871 CA GLU A 124 3.689 -1.171 -16.981 1.00 0.00 C ATOM 1872 C GLU A 124 2.636 -2.152 -16.456 1.00 0.00 C ATOM 1873 O GLU A 124 1.886 -1.805 -15.544 1.00 0.00 O ATOM 1874 CB GLU A 124 3.326 -0.642 -18.379 1.00 0.00 C ATOM 1875 CG GLU A 124 2.617 0.706 -18.322 1.00 0.00 C ATOM 1876 CD GLU A 124 1.202 0.636 -17.712 1.00 0.00 C ATOM 1877 OE1 GLU A 124 0.339 -0.093 -18.256 1.00 0.00 O ATOM 1878 OE2 GLU A 124 0.935 1.354 -16.718 1.00 0.00 O ATOM 0 H GLU A 124 5.426 -1.873 -17.934 1.00 0.00 H new ATOM 0 HA GLU A 124 3.702 -0.329 -16.289 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.233 -0.548 -18.976 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.686 -1.366 -18.884 1.00 0.00 H new ATOM 0 HG2 GLU A 124 3.221 1.400 -17.738 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.549 1.114 -19.331 1.00 0.00 H new ATOM 1885 N ASN A 125 2.630 -3.404 -16.938 1.00 0.00 N ATOM 1886 CA ASN A 125 1.656 -4.391 -16.449 1.00 0.00 C ATOM 1887 C ASN A 125 1.938 -4.832 -14.998 1.00 0.00 C ATOM 1888 O ASN A 125 0.995 -5.027 -14.230 1.00 0.00 O ATOM 1889 CB ASN A 125 1.474 -5.546 -17.453 1.00 0.00 C ATOM 1890 CG ASN A 125 2.370 -6.748 -17.201 1.00 0.00 C ATOM 1891 OD1 ASN A 125 2.097 -7.594 -16.362 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.462 -6.862 -17.914 1.00 0.00 N ATOM 0 H ASN A 125 3.273 -3.752 -17.650 1.00 0.00 H new ATOM 0 HA ASN A 125 0.683 -3.904 -16.391 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.434 -5.872 -17.427 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.666 -5.170 -18.458 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.085 -7.657 -17.769 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.690 -6.156 -18.614 1.00 0.00 H new ATOM 1899 N LEU A 126 3.214 -4.892 -14.588 1.00 0.00 N ATOM 1900 CA LEU A 126 3.623 -5.081 -13.188 1.00 0.00 C ATOM 1901 C LEU A 126 3.074 -3.965 -12.299 1.00 0.00 C ATOM 1902 O LEU A 126 2.518 -4.233 -11.242 1.00 0.00 O ATOM 1903 CB LEU A 126 5.162 -5.175 -13.132 1.00 0.00 C ATOM 1904 CG LEU A 126 5.851 -5.373 -11.766 1.00 0.00 C ATOM 1905 CD1 LEU A 126 6.016 -4.082 -10.960 1.00 0.00 C ATOM 1906 CD2 LEU A 126 5.164 -6.416 -10.884 1.00 0.00 C ATOM 0 H LEU A 126 4.003 -4.809 -15.230 1.00 0.00 H new ATOM 0 HA LEU A 126 3.204 -6.009 -12.799 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.465 -6.001 -13.776 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.563 -4.263 -13.574 1.00 0.00 H new ATOM 0 HG LEU A 126 6.841 -5.737 -12.040 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.508 -4.305 -10.013 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.622 -3.374 -11.526 1.00 0.00 H new ATOM 0 HD13 LEU A 126 5.036 -3.647 -10.766 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.701 -6.504 -9.939 1.00 0.00 H new ATOM 0 HD22 LEU A 126 4.136 -6.109 -10.690 1.00 0.00 H new ATOM 0 HD23 LEU A 126 5.164 -7.380 -11.393 1.00 0.00 H new ATOM 1918 N ILE A 127 3.199 -2.709 -12.716 1.00 0.00 N ATOM 1919 CA ILE A 127 2.789 -1.570 -11.892 1.00 0.00 C ATOM 1920 C ILE A 127 1.263 -1.463 -11.844 1.00 0.00 C ATOM 1921 O ILE A 127 0.699 -1.299 -10.764 1.00 0.00 O ATOM 1922 CB ILE A 127 3.474 -0.293 -12.420 1.00 0.00 C ATOM 1923 CG1 ILE A 127 4.999 -0.393 -12.177 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.920 0.992 -11.776 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.820 0.584 -13.023 1.00 0.00 C ATOM 0 H ILE A 127 3.583 -2.450 -13.625 1.00 0.00 H new ATOM 0 HA ILE A 127 3.111 -1.712 -10.860 1.00 0.00 H new ATOM 0 HB ILE A 127 3.263 -0.225 -13.487 1.00 0.00 H new ATOM 0 HG12 ILE A 127 5.203 -0.208 -11.122 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.327 -1.410 -12.391 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.440 1.858 -12.186 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.854 1.075 -11.988 1.00 0.00 H new ATOM 0 HG23 ILE A 127 3.074 0.954 -10.698 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.879 0.457 -12.800 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.646 0.385 -14.080 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.520 1.606 -12.792 1.00 0.00 H new ATOM 1937 N ALA A 128 0.584 -1.630 -12.981 1.00 0.00 N ATOM 1938 CA ALA A 128 -0.870 -1.527 -13.087 1.00 0.00 C ATOM 1939 C ALA A 128 -1.626 -2.577 -12.249 1.00 0.00 C ATOM 1940 O ALA A 128 -2.743 -2.312 -11.798 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.247 -1.614 -14.571 1.00 0.00 C ATOM 0 H ALA A 128 1.039 -1.844 -13.868 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.177 -0.568 -12.670 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.329 -1.539 -14.676 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.772 -0.798 -15.115 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.908 -2.567 -14.977 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.014 -3.748 -12.001 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.586 -4.805 -11.144 1.00 0.00 C ATOM 1949 C LYS A 129 -1.291 -4.648 -9.643 1.00 0.00 C ATOM 1950 O LYS A 129 -1.940 -5.327 -8.847 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.235 -6.203 -11.691 1.00 0.00 C ATOM 1952 CG LYS A 129 0.196 -6.678 -11.406 1.00 0.00 C ATOM 1953 CD LYS A 129 0.443 -8.021 -12.097 1.00 0.00 C ATOM 1954 CE LYS A 129 1.862 -8.543 -11.838 1.00 0.00 C ATOM 1955 NZ LYS A 129 2.035 -9.885 -12.468 1.00 0.00 N ATOM 0 H LYS A 129 -0.103 -3.991 -12.391 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.668 -4.686 -11.199 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -1.932 -6.926 -11.267 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.392 -6.203 -12.770 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.913 -5.938 -11.762 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.349 -6.778 -10.331 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.284 -8.752 -11.741 1.00 0.00 H new ATOM 0 HD3 LYS A 129 0.286 -7.912 -13.170 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.595 -7.845 -12.243 1.00 0.00 H new ATOM 0 HE3 LYS A 129 2.044 -8.609 -10.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.915 -10.320 -12.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.228 -10.492 -12.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 2.083 -9.780 -13.502 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.360 -3.765 -9.245 1.00 0.00 N ATOM 1970 CA ILE A 130 0.007 -3.557 -7.821 1.00 0.00 C ATOM 1971 C ILE A 130 -0.329 -2.164 -7.255 1.00 0.00 C ATOM 1972 O ILE A 130 -0.382 -2.007 -6.033 1.00 0.00 O ATOM 1973 CB ILE A 130 1.478 -3.944 -7.540 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.493 -2.910 -8.070 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.764 -5.358 -8.071 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.954 -3.273 -7.772 1.00 0.00 C ATOM 0 H ILE A 130 0.161 -3.174 -9.893 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.641 -4.242 -7.275 1.00 0.00 H new ATOM 0 HB ILE A 130 1.611 -3.945 -6.458 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.366 -2.808 -9.148 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.272 -1.938 -7.629 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.802 -5.620 -7.868 1.00 0.00 H new ATOM 0 HG22 ILE A 130 1.106 -6.072 -7.576 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.587 -5.386 -9.146 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.610 -2.501 -8.174 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.098 -3.346 -6.694 1.00 0.00 H new ATOM 0 HD13 ILE A 130 4.193 -4.230 -8.236 1.00 0.00 H new ATOM 1988 N SER A 131 -0.550 -1.163 -8.116 1.00 0.00 N ATOM 1989 CA SER A 131 -0.874 0.226 -7.726 1.00 0.00 C ATOM 1990 C SER A 131 -2.248 0.358 -7.054 1.00 0.00 C ATOM 1991 O SER A 131 -3.242 -0.202 -7.578 1.00 0.00 O ATOM 1992 CB SER A 131 -0.811 1.162 -8.927 1.00 0.00 C ATOM 1993 OG SER A 131 0.486 1.116 -9.488 1.00 0.00 O ATOM 1994 OXT SER A 131 -2.335 1.040 -6.008 1.00 0.00 O ATOM 0 H SER A 131 -0.509 -1.293 -9.127 1.00 0.00 H new ATOM 0 HA SER A 131 -0.118 0.511 -6.994 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.552 0.868 -9.671 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.052 2.180 -8.622 1.00 0.00 H new ATOM 0 HG SER A 131 0.615 0.258 -9.943 1.00 0.00 H new TER 2000 SER A 131