USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 896 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: C 81 MET CE :methyl -108:sc= 0 (180deg=-0.116) USER MOD Set 1.2: I 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: C 69 SER OG : rot -55:sc= 1.66 USER MOD Set 2.2: C 71 THR OG1 : rot -21:sc= 0.316 USER MOD Set 3.1: C 37 SER OG : rot 180:sc= 0.0686 USER MOD Set 3.2: C 38 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ -161:sc= -0.761 (180deg=-1.37) USER MOD Single : C 5 TYR OH : rot -29:sc= -1.35 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= -0.232 X(o=-0.23,f=-0.33) USER MOD Single : C 13 THR OG1 : rot -150:sc= -0.497 USER MOD Single : C 16 GLN : amide:sc= -0.169 X(o=-0.17,f=-0.22) USER MOD Single : C 17 LYS NZ :NH3+ -179:sc= -2.47 (180deg=-2.55) USER MOD Single : C 18 ASN : amide:sc= -0.324 K(o=-0.32,f=-1.7) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 180:sc= 0 USER MOD Single : C 39 LYS NZ :NH3+ 150:sc= -0.036 (180deg=-0.316) USER MOD Single : C 43 LYS NZ :NH3+ 163:sc= -0.0253 (180deg=-0.369) USER MOD Single : C 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 47 MET CE :methyl -168:sc= -0.18 (180deg=-0.575) USER MOD Single : C 50 GLN :FLIP amide:sc= -0.995 F(o=-1.8!,f=-0.99) USER MOD Single : C 51 ASN : amide:sc= -1.16 K(o=-1.2,f=-5.7!) USER MOD Single : C 53 THR OG1 : rot 180:sc= -0.694 USER MOD Single : C 58 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : C 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot -48:sc= -1.45! USER MOD Single : C 85 MET CE :methyl 161:sc= -0.0477 (180deg=-0.539) USER MOD Single : C 86 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.577) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 149 SER OG : rot -67:sc= 1.25 USER MOD Single : I 153 MET CE :methyl 155:sc= -0.0254 (180deg=-0.865) USER MOD Single : I 155 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : I 162 HIS : no HD1:sc= -0.213 X(o=-0.21,f=0) USER MOD Single : I 163 LYS NZ :NH3+ -150:sc= -0.169 (180deg=-0.886) USER MOD Single : I 165 SER OG : rot 48:sc= 0.85 USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 18.290 4.032 -0.351 1.00 0.00 N ATOM 2 CA MET C 1 18.876 5.218 0.334 1.00 0.00 C ATOM 3 C MET C 1 18.658 5.083 1.838 1.00 0.00 C ATOM 4 O MET C 1 19.190 5.865 2.625 1.00 0.00 O ATOM 5 CB MET C 1 18.194 6.488 -0.183 1.00 0.00 C ATOM 6 CG MET C 1 18.659 7.694 0.639 1.00 0.00 C ATOM 7 SD MET C 1 17.531 7.961 2.028 1.00 0.00 S ATOM 8 CE MET C 1 18.236 9.532 2.587 1.00 0.00 C ATOM 0 H1 MET C 1 18.698 3.944 -1.303 1.00 0.00 H new ATOM 0 H2 MET C 1 18.503 3.174 0.197 1.00 0.00 H new ATOM 0 H3 MET C 1 17.259 4.148 -0.426 1.00 0.00 H new ATOM 0 HA MET C 1 19.945 5.278 0.129 1.00 0.00 H new ATOM 0 HB2 MET C 1 18.434 6.639 -1.236 1.00 0.00 H new ATOM 0 HB3 MET C 1 17.111 6.385 -0.115 1.00 0.00 H new ATOM 0 HG2 MET C 1 19.671 7.526 1.008 1.00 0.00 H new ATOM 0 HG3 MET C 1 18.693 8.583 0.010 1.00 0.00 H new ATOM 0 HE1 MET C 1 17.683 9.891 3.455 1.00 0.00 H new ATOM 0 HE2 MET C 1 19.282 9.386 2.858 1.00 0.00 H new ATOM 0 HE3 MET C 1 18.169 10.267 1.785 1.00 0.00 H new ATOM 20 N ASP C 2 17.870 4.083 2.228 1.00 0.00 N ATOM 21 CA ASP C 2 17.584 3.849 3.639 1.00 0.00 C ATOM 22 C ASP C 2 18.309 2.603 4.138 1.00 0.00 C ATOM 23 O ASP C 2 19.196 2.689 4.986 1.00 0.00 O ATOM 24 CB ASP C 2 16.077 3.680 3.845 1.00 0.00 C ATOM 25 CG ASP C 2 15.382 3.515 2.498 1.00 0.00 C ATOM 26 OD1 ASP C 2 15.701 2.565 1.801 1.00 0.00 O ATOM 27 OD2 ASP C 2 14.541 4.340 2.183 1.00 0.00 O1- ATOM 0 H ASP C 2 17.421 3.426 1.590 1.00 0.00 H new ATOM 0 HA ASP C 2 17.936 4.710 4.207 1.00 0.00 H new ATOM 0 HB2 ASP C 2 15.883 2.810 4.473 1.00 0.00 H new ATOM 0 HB3 ASP C 2 15.674 4.547 4.368 1.00 0.00 H new ATOM 32 N ASP C 3 17.923 1.445 3.610 1.00 0.00 N ATOM 33 CA ASP C 3 18.545 0.191 4.017 1.00 0.00 C ATOM 34 C ASP C 3 20.019 0.162 3.622 1.00 0.00 C ATOM 35 O ASP C 3 20.872 -0.250 4.407 1.00 0.00 O ATOM 36 CB ASP C 3 17.821 -0.986 3.360 1.00 0.00 C ATOM 37 CG ASP C 3 17.802 -0.805 1.847 1.00 0.00 C ATOM 38 OD1 ASP C 3 17.755 0.332 1.406 1.00 0.00 O ATOM 39 OD2 ASP C 3 17.839 -1.805 1.149 1.00 0.00 O1- ATOM 0 H ASP C 3 17.190 1.350 2.907 1.00 0.00 H new ATOM 0 HA ASP C 3 18.471 0.110 5.101 1.00 0.00 H new ATOM 0 HB2 ASP C 3 18.320 -1.920 3.617 1.00 0.00 H new ATOM 0 HB3 ASP C 3 16.801 -1.055 3.739 1.00 0.00 H new ATOM 44 N ILE C 4 20.312 0.603 2.403 1.00 0.00 N ATOM 45 CA ILE C 4 21.687 0.619 1.919 1.00 0.00 C ATOM 46 C ILE C 4 22.543 1.572 2.749 1.00 0.00 C ATOM 47 O ILE C 4 23.699 1.284 3.051 1.00 0.00 O ATOM 48 CB ILE C 4 21.711 1.056 0.450 1.00 0.00 C ATOM 49 CG1 ILE C 4 23.122 0.877 -0.116 1.00 0.00 C ATOM 50 CG2 ILE C 4 21.299 2.526 0.343 1.00 0.00 C ATOM 51 CD1 ILE C 4 23.092 1.056 -1.635 1.00 0.00 C ATOM 0 H ILE C 4 19.622 0.951 1.737 1.00 0.00 H new ATOM 0 HA ILE C 4 22.097 -0.387 2.011 1.00 0.00 H new ATOM 0 HB ILE C 4 21.012 0.443 -0.119 1.00 0.00 H new ATOM 0 HG12 ILE C 4 23.800 1.603 0.333 1.00 0.00 H new ATOM 0 HG13 ILE C 4 23.503 -0.113 0.136 1.00 0.00 H new ATOM 0 HG21 ILE C 4 21.317 2.834 -0.702 1.00 0.00 H new ATOM 0 HG22 ILE C 4 20.292 2.652 0.741 1.00 0.00 H new ATOM 0 HG23 ILE C 4 21.994 3.141 0.914 1.00 0.00 H new ATOM 0 HD11 ILE C 4 24.097 0.928 -2.036 1.00 0.00 H new ATOM 0 HD12 ILE C 4 22.428 0.312 -2.076 1.00 0.00 H new ATOM 0 HD13 ILE C 4 22.729 2.055 -1.877 1.00 0.00 H new ATOM 63 N TYR C 5 21.959 2.702 3.119 1.00 0.00 N ATOM 64 CA TYR C 5 22.654 3.701 3.919 1.00 0.00 C ATOM 65 C TYR C 5 23.017 3.134 5.285 1.00 0.00 C ATOM 66 O TYR C 5 24.141 3.290 5.759 1.00 0.00 O ATOM 67 CB TYR C 5 21.782 4.946 4.088 1.00 0.00 C ATOM 68 CG TYR C 5 22.533 5.974 4.895 1.00 0.00 C ATOM 69 CD1 TYR C 5 23.494 6.786 4.275 1.00 0.00 C ATOM 70 CD2 TYR C 5 22.279 6.115 6.264 1.00 0.00 C ATOM 71 CE1 TYR C 5 24.196 7.735 5.025 1.00 0.00 C ATOM 72 CE2 TYR C 5 22.981 7.065 7.013 1.00 0.00 C ATOM 73 CZ TYR C 5 23.941 7.875 6.393 1.00 0.00 C ATOM 74 OH TYR C 5 24.635 8.811 7.131 1.00 0.00 O ATOM 0 H TYR C 5 21.000 2.951 2.877 1.00 0.00 H new ATOM 0 HA TYR C 5 23.571 3.978 3.399 1.00 0.00 H new ATOM 0 HB2 TYR C 5 21.518 5.354 3.112 1.00 0.00 H new ATOM 0 HB3 TYR C 5 20.849 4.685 4.587 1.00 0.00 H new ATOM 0 HD1 TYR C 5 23.692 6.678 3.219 1.00 0.00 H new ATOM 0 HD2 TYR C 5 21.540 5.490 6.743 1.00 0.00 H new ATOM 0 HE1 TYR C 5 24.936 8.360 4.547 1.00 0.00 H new ATOM 0 HE2 TYR C 5 22.783 7.174 8.069 1.00 0.00 H new ATOM 0 HH TYR C 5 25.520 8.950 6.734 1.00 0.00 H new ATOM 84 N LYS C 6 22.046 2.483 5.916 1.00 0.00 N ATOM 85 CA LYS C 6 22.264 1.904 7.236 1.00 0.00 C ATOM 86 C LYS C 6 23.369 0.856 7.176 1.00 0.00 C ATOM 87 O LYS C 6 24.234 0.802 8.051 1.00 0.00 O ATOM 88 CB LYS C 6 20.964 1.255 7.718 1.00 0.00 C ATOM 89 CG LYS C 6 19.921 2.333 8.046 1.00 0.00 C ATOM 90 CD LYS C 6 20.136 2.875 9.464 1.00 0.00 C ATOM 91 CE LYS C 6 19.020 3.866 9.802 1.00 0.00 C ATOM 92 NZ LYS C 6 19.236 4.400 11.175 1.00 0.00 N1+ ATOM 0 H LYS C 6 21.109 2.344 5.539 1.00 0.00 H new ATOM 0 HA LYS C 6 22.565 2.690 7.929 1.00 0.00 H new ATOM 0 HB2 LYS C 6 20.577 0.586 6.949 1.00 0.00 H new ATOM 0 HB3 LYS C 6 21.159 0.647 8.601 1.00 0.00 H new ATOM 0 HG2 LYS C 6 19.992 3.147 7.325 1.00 0.00 H new ATOM 0 HG3 LYS C 6 18.918 1.915 7.958 1.00 0.00 H new ATOM 0 HD2 LYS C 6 20.140 2.055 10.182 1.00 0.00 H new ATOM 0 HD3 LYS C 6 21.107 3.365 9.535 1.00 0.00 H new ATOM 0 HE2 LYS C 6 19.011 4.682 9.079 1.00 0.00 H new ATOM 0 HE3 LYS C 6 18.049 3.374 9.739 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 18.479 5.074 11.408 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 19.224 3.616 11.858 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 20.156 4.883 11.219 1.00 0.00 H new ATOM 106 N ALA C 7 23.348 0.041 6.132 1.00 0.00 N ATOM 107 CA ALA C 7 24.365 -0.981 5.957 1.00 0.00 C ATOM 108 C ALA C 7 25.729 -0.341 5.755 1.00 0.00 C ATOM 109 O ALA C 7 26.735 -0.833 6.261 1.00 0.00 O ATOM 110 CB ALA C 7 24.028 -1.863 4.754 1.00 0.00 C ATOM 0 H ALA C 7 22.641 0.068 5.397 1.00 0.00 H new ATOM 0 HA ALA C 7 24.391 -1.597 6.856 1.00 0.00 H new ATOM 0 HB1 ALA C 7 24.798 -2.625 4.634 1.00 0.00 H new ATOM 0 HB2 ALA C 7 23.063 -2.344 4.915 1.00 0.00 H new ATOM 0 HB3 ALA C 7 23.982 -1.249 3.854 1.00 0.00 H new ATOM 116 N ALA C 8 25.758 0.757 5.009 1.00 0.00 N ATOM 117 CA ALA C 8 27.018 1.437 4.748 1.00 0.00 C ATOM 118 C ALA C 8 27.622 1.947 6.047 1.00 0.00 C ATOM 119 O ALA C 8 28.828 1.855 6.264 1.00 0.00 O ATOM 120 CB ALA C 8 26.799 2.597 3.777 1.00 0.00 C ATOM 0 H ALA C 8 24.939 1.188 4.581 1.00 0.00 H new ATOM 0 HA ALA C 8 27.711 0.727 4.297 1.00 0.00 H new ATOM 0 HB1 ALA C 8 27.748 3.098 3.589 1.00 0.00 H new ATOM 0 HB2 ALA C 8 26.398 2.215 2.838 1.00 0.00 H new ATOM 0 HB3 ALA C 8 26.094 3.306 4.210 1.00 0.00 H new ATOM 126 N VAL C 9 26.768 2.482 6.906 1.00 0.00 N ATOM 127 CA VAL C 9 27.207 3.005 8.190 1.00 0.00 C ATOM 128 C VAL C 9 27.715 1.889 9.095 1.00 0.00 C ATOM 129 O VAL C 9 28.714 2.052 9.788 1.00 0.00 O ATOM 130 CB VAL C 9 26.052 3.725 8.870 1.00 0.00 C ATOM 131 CG1 VAL C 9 26.449 4.080 10.306 1.00 0.00 C ATOM 132 CG2 VAL C 9 25.732 5.008 8.103 1.00 0.00 C ATOM 0 H VAL C 9 25.766 2.565 6.737 1.00 0.00 H new ATOM 0 HA VAL C 9 28.026 3.702 8.012 1.00 0.00 H new ATOM 0 HB VAL C 9 25.175 3.077 8.882 1.00 0.00 H new ATOM 0 HG11 VAL C 9 25.623 4.596 10.795 1.00 0.00 H new ATOM 0 HG12 VAL C 9 26.683 3.168 10.855 1.00 0.00 H new ATOM 0 HG13 VAL C 9 27.324 4.729 10.292 1.00 0.00 H new ATOM 0 HG21 VAL C 9 24.905 5.525 8.589 1.00 0.00 H new ATOM 0 HG22 VAL C 9 26.609 5.655 8.094 1.00 0.00 H new ATOM 0 HG23 VAL C 9 25.454 4.760 7.079 1.00 0.00 H new ATOM 142 N GLU C 10 27.009 0.763 9.103 1.00 0.00 N ATOM 143 CA GLU C 10 27.394 -0.364 9.943 1.00 0.00 C ATOM 144 C GLU C 10 28.638 -1.047 9.383 1.00 0.00 C ATOM 145 O GLU C 10 29.459 -1.580 10.132 1.00 0.00 O ATOM 146 CB GLU C 10 26.250 -1.373 10.021 1.00 0.00 C ATOM 147 CG GLU C 10 26.277 -2.063 11.385 1.00 0.00 C ATOM 148 CD GLU C 10 25.208 -3.147 11.439 1.00 0.00 C ATOM 149 OE1 GLU C 10 24.073 -2.819 11.739 1.00 0.00 O ATOM 150 OE2 GLU C 10 25.543 -4.291 11.180 1.00 0.00 O1- ATOM 0 H GLU C 10 26.172 0.607 8.541 1.00 0.00 H new ATOM 0 HA GLU C 10 27.615 0.011 10.942 1.00 0.00 H new ATOM 0 HB2 GLU C 10 25.295 -0.869 9.874 1.00 0.00 H new ATOM 0 HB3 GLU C 10 26.346 -2.111 9.225 1.00 0.00 H new ATOM 0 HG2 GLU C 10 27.260 -2.500 11.562 1.00 0.00 H new ATOM 0 HG3 GLU C 10 26.106 -1.332 12.175 1.00 0.00 H new ATOM 157 N GLN C 11 28.759 -1.040 8.059 1.00 0.00 N ATOM 158 CA GLN C 11 29.895 -1.679 7.396 1.00 0.00 C ATOM 159 C GLN C 11 31.210 -1.021 7.813 1.00 0.00 C ATOM 160 O GLN C 11 32.271 -1.641 7.728 1.00 0.00 O ATOM 161 CB GLN C 11 29.750 -1.582 5.872 1.00 0.00 C ATOM 162 CG GLN C 11 30.708 -2.570 5.197 1.00 0.00 C ATOM 163 CD GLN C 11 30.239 -4.000 5.450 1.00 0.00 C ATOM 164 OE1 GLN C 11 30.799 -4.698 6.295 1.00 0.00 O ATOM 165 NE2 GLN C 11 29.241 -4.477 4.759 1.00 0.00 N ATOM 0 H GLN C 11 28.090 -0.602 7.426 1.00 0.00 H new ATOM 0 HA GLN C 11 29.907 -2.727 7.697 1.00 0.00 H new ATOM 0 HB2 GLN C 11 28.723 -1.800 5.580 1.00 0.00 H new ATOM 0 HB3 GLN C 11 29.967 -0.567 5.540 1.00 0.00 H new ATOM 0 HG2 GLN C 11 30.750 -2.376 4.125 1.00 0.00 H new ATOM 0 HG3 GLN C 11 31.718 -2.435 5.585 1.00 0.00 H new ATOM 0 HE21 GLN C 11 28.780 -3.895 4.060 1.00 0.00 H new ATOM 0 HE22 GLN C 11 28.921 -5.432 4.918 1.00 0.00 H new ATOM 174 N LEU C 12 31.138 0.242 8.242 1.00 0.00 N ATOM 175 CA LEU C 12 32.330 0.983 8.652 1.00 0.00 C ATOM 176 C LEU C 12 33.359 0.064 9.296 1.00 0.00 C ATOM 177 O LEU C 12 33.008 -0.899 9.973 1.00 0.00 O ATOM 178 CB LEU C 12 31.951 2.069 9.663 1.00 0.00 C ATOM 179 CG LEU C 12 31.961 3.448 8.996 1.00 0.00 C ATOM 180 CD1 LEU C 12 33.386 3.814 8.571 1.00 0.00 C ATOM 181 CD2 LEU C 12 31.051 3.424 7.770 1.00 0.00 C ATOM 0 H LEU C 12 30.268 0.770 8.314 1.00 0.00 H new ATOM 0 HA LEU C 12 32.761 1.430 7.757 1.00 0.00 H new ATOM 0 HB2 LEU C 12 30.962 1.864 10.073 1.00 0.00 H new ATOM 0 HB3 LEU C 12 32.651 2.057 10.498 1.00 0.00 H new ATOM 0 HG LEU C 12 31.600 4.193 9.706 1.00 0.00 H new ATOM 0 HD11 LEU C 12 33.384 4.796 8.098 1.00 0.00 H new ATOM 0 HD12 LEU C 12 34.033 3.835 9.448 1.00 0.00 H new ATOM 0 HD13 LEU C 12 33.757 3.072 7.864 1.00 0.00 H new ATOM 0 HD21 LEU C 12 31.056 4.404 7.294 1.00 0.00 H new ATOM 0 HD22 LEU C 12 31.411 2.676 7.064 1.00 0.00 H new ATOM 0 HD23 LEU C 12 30.035 3.175 8.076 1.00 0.00 H new ATOM 193 N THR C 13 34.630 0.370 9.073 1.00 0.00 N ATOM 194 CA THR C 13 35.709 -0.427 9.630 1.00 0.00 C ATOM 195 C THR C 13 35.924 -0.102 11.100 1.00 0.00 C ATOM 196 O THR C 13 35.522 0.956 11.580 1.00 0.00 O ATOM 197 CB THR C 13 37.002 -0.172 8.858 1.00 0.00 C ATOM 198 OG1 THR C 13 37.367 1.195 8.985 1.00 0.00 O ATOM 199 CG2 THR C 13 36.789 -0.511 7.387 1.00 0.00 C ATOM 0 H THR C 13 34.937 1.164 8.511 1.00 0.00 H new ATOM 0 HA THR C 13 35.432 -1.478 9.542 1.00 0.00 H new ATOM 0 HB THR C 13 37.798 -0.797 9.262 1.00 0.00 H new ATOM 0 HG1 THR C 13 37.853 1.480 8.183 1.00 0.00 H new ATOM 0 HG21 THR C 13 37.711 -0.330 6.835 1.00 0.00 H new ATOM 0 HG22 THR C 13 36.510 -1.560 7.292 1.00 0.00 H new ATOM 0 HG23 THR C 13 35.994 0.114 6.981 1.00 0.00 H new ATOM 207 N GLU C 14 36.569 -1.019 11.804 1.00 0.00 N ATOM 208 CA GLU C 14 36.839 -0.829 13.211 1.00 0.00 C ATOM 209 C GLU C 14 37.794 0.335 13.419 1.00 0.00 C ATOM 210 O GLU C 14 37.649 1.119 14.355 1.00 0.00 O ATOM 211 CB GLU C 14 37.424 -2.109 13.811 1.00 0.00 C ATOM 212 CG GLU C 14 37.638 -1.909 15.307 1.00 0.00 C ATOM 213 CD GLU C 14 38.090 -3.213 15.956 1.00 0.00 C ATOM 214 OE1 GLU C 14 38.192 -4.200 15.249 1.00 0.00 O ATOM 215 OE2 GLU C 14 38.327 -3.203 17.153 1.00 0.00 O1- ATOM 0 H GLU C 14 36.913 -1.899 11.420 1.00 0.00 H new ATOM 0 HA GLU C 14 35.901 -0.599 13.717 1.00 0.00 H new ATOM 0 HB2 GLU C 14 36.750 -2.948 13.637 1.00 0.00 H new ATOM 0 HB3 GLU C 14 38.369 -2.354 13.326 1.00 0.00 H new ATOM 0 HG2 GLU C 14 38.386 -1.134 15.474 1.00 0.00 H new ATOM 0 HG3 GLU C 14 36.713 -1.565 15.771 1.00 0.00 H new ATOM 222 N GLU C 15 38.777 0.429 12.541 1.00 0.00 N ATOM 223 CA GLU C 15 39.767 1.495 12.639 1.00 0.00 C ATOM 224 C GLU C 15 39.112 2.859 12.473 1.00 0.00 C ATOM 225 O GLU C 15 39.406 3.787 13.229 1.00 0.00 O ATOM 226 CB GLU C 15 40.839 1.311 11.559 1.00 0.00 C ATOM 227 CG GLU C 15 41.705 0.084 11.870 1.00 0.00 C ATOM 228 CD GLU C 15 42.470 0.285 13.175 1.00 0.00 C ATOM 229 OE1 GLU C 15 43.080 1.330 13.327 1.00 0.00 O ATOM 230 OE2 GLU C 15 42.441 -0.613 14.002 1.00 0.00 O1- ATOM 0 H GLU C 15 38.913 -0.211 11.759 1.00 0.00 H new ATOM 0 HA GLU C 15 40.226 1.445 13.626 1.00 0.00 H new ATOM 0 HB2 GLU C 15 40.366 1.193 10.584 1.00 0.00 H new ATOM 0 HB3 GLU C 15 41.465 2.201 11.503 1.00 0.00 H new ATOM 0 HG2 GLU C 15 41.076 -0.803 11.944 1.00 0.00 H new ATOM 0 HG3 GLU C 15 42.406 -0.090 11.054 1.00 0.00 H new ATOM 237 N GLN C 16 38.213 2.972 11.501 1.00 0.00 N ATOM 238 CA GLN C 16 37.511 4.225 11.265 1.00 0.00 C ATOM 239 C GLN C 16 36.618 4.563 12.455 1.00 0.00 C ATOM 240 O GLN C 16 36.503 5.721 12.854 1.00 0.00 O ATOM 241 CB GLN C 16 36.673 4.118 9.990 1.00 0.00 C ATOM 242 CG GLN C 16 37.596 4.105 8.769 1.00 0.00 C ATOM 243 CD GLN C 16 38.228 5.482 8.581 1.00 0.00 C ATOM 244 OE1 GLN C 16 37.518 6.479 8.461 1.00 0.00 O ATOM 245 NE2 GLN C 16 39.529 5.599 8.547 1.00 0.00 N ATOM 0 H GLN C 16 37.955 2.215 10.868 1.00 0.00 H new ATOM 0 HA GLN C 16 38.243 5.023 11.143 1.00 0.00 H new ATOM 0 HB2 GLN C 16 36.071 3.209 10.013 1.00 0.00 H new ATOM 0 HB3 GLN C 16 35.981 4.957 9.926 1.00 0.00 H new ATOM 0 HG2 GLN C 16 38.374 3.353 8.898 1.00 0.00 H new ATOM 0 HG3 GLN C 16 37.031 3.830 7.878 1.00 0.00 H new ATOM 0 HE21 GLN C 16 40.118 4.772 8.647 1.00 0.00 H new ATOM 0 HE22 GLN C 16 39.955 6.517 8.421 1.00 0.00 H new ATOM 254 N LYS C 17 35.983 3.543 13.015 1.00 0.00 N ATOM 255 CA LYS C 17 35.107 3.738 14.161 1.00 0.00 C ATOM 256 C LYS C 17 35.912 4.131 15.385 1.00 0.00 C ATOM 257 O LYS C 17 35.477 4.964 16.181 1.00 0.00 O ATOM 258 CB LYS C 17 34.319 2.456 14.437 1.00 0.00 C ATOM 259 CG LYS C 17 33.345 2.214 13.277 1.00 0.00 C ATOM 260 CD LYS C 17 31.960 2.786 13.599 1.00 0.00 C ATOM 261 CE LYS C 17 31.106 1.714 14.283 1.00 0.00 C ATOM 262 NZ LYS C 17 31.958 0.908 15.202 1.00 0.00 N1+ ATOM 0 H LYS C 17 36.057 2.577 12.696 1.00 0.00 H new ATOM 0 HA LYS C 17 34.409 4.544 13.935 1.00 0.00 H new ATOM 0 HB2 LYS C 17 34.999 1.610 14.541 1.00 0.00 H new ATOM 0 HB3 LYS C 17 33.773 2.544 15.376 1.00 0.00 H new ATOM 0 HG2 LYS C 17 33.732 2.677 12.369 1.00 0.00 H new ATOM 0 HG3 LYS C 17 33.265 1.145 13.081 1.00 0.00 H new ATOM 0 HD2 LYS C 17 32.057 3.656 14.248 1.00 0.00 H new ATOM 0 HD3 LYS C 17 31.473 3.123 12.684 1.00 0.00 H new ATOM 0 HE2 LYS C 17 30.294 2.182 14.840 1.00 0.00 H new ATOM 0 HE3 LYS C 17 30.648 1.067 13.535 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 31.381 0.170 15.653 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 32.728 0.464 14.662 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 32.361 1.527 15.934 1.00 0.00 H new ATOM 276 N ASN C 18 37.077 3.523 15.541 1.00 0.00 N ATOM 277 CA ASN C 18 37.908 3.819 16.691 1.00 0.00 C ATOM 278 C ASN C 18 38.367 5.276 16.691 1.00 0.00 C ATOM 279 O ASN C 18 38.247 5.976 17.702 1.00 0.00 O ATOM 280 CB ASN C 18 39.124 2.895 16.694 1.00 0.00 C ATOM 281 CG ASN C 18 39.950 3.106 17.957 1.00 0.00 C ATOM 282 OD1 ASN C 18 40.598 4.142 18.113 1.00 0.00 O ATOM 283 ND2 ASN C 18 39.968 2.177 18.873 1.00 0.00 N ATOM 0 H ASN C 18 37.462 2.833 14.896 1.00 0.00 H new ATOM 0 HA ASN C 18 37.314 3.655 17.590 1.00 0.00 H new ATOM 0 HB2 ASN C 18 38.799 1.856 16.634 1.00 0.00 H new ATOM 0 HB3 ASN C 18 39.738 3.089 15.814 1.00 0.00 H new ATOM 0 HD21 ASN C 18 40.520 2.308 19.721 1.00 0.00 H new ATOM 0 HD22 ASN C 18 39.430 1.320 18.741 1.00 0.00 H new ATOM 290 N GLU C 19 38.894 5.731 15.557 1.00 0.00 N ATOM 291 CA GLU C 19 39.370 7.106 15.451 1.00 0.00 C ATOM 292 C GLU C 19 38.208 8.084 15.550 1.00 0.00 C ATOM 293 O GLU C 19 38.326 9.149 16.155 1.00 0.00 O ATOM 294 CB GLU C 19 40.101 7.294 14.123 1.00 0.00 C ATOM 295 CG GLU C 19 39.150 6.976 12.978 1.00 0.00 C ATOM 296 CD GLU C 19 39.906 6.966 11.654 1.00 0.00 C ATOM 297 OE1 GLU C 19 40.714 6.072 11.464 1.00 0.00 O ATOM 298 OE2 GLU C 19 39.665 7.850 10.849 1.00 0.00 O1- ATOM 0 H GLU C 19 39.001 5.175 14.709 1.00 0.00 H new ATOM 0 HA GLU C 19 40.057 7.305 16.274 1.00 0.00 H new ATOM 0 HB2 GLU C 19 40.464 8.318 14.036 1.00 0.00 H new ATOM 0 HB3 GLU C 19 40.973 6.642 14.079 1.00 0.00 H new ATOM 0 HG2 GLU C 19 38.680 6.007 13.144 1.00 0.00 H new ATOM 0 HG3 GLU C 19 38.351 7.716 12.943 1.00 0.00 H new ATOM 305 N PHE C 20 37.083 7.705 14.964 1.00 0.00 N ATOM 306 CA PHE C 20 35.892 8.547 15.001 1.00 0.00 C ATOM 307 C PHE C 20 35.463 8.812 16.441 1.00 0.00 C ATOM 308 O PHE C 20 35.272 9.961 16.839 1.00 0.00 O ATOM 309 CB PHE C 20 34.754 7.867 14.245 1.00 0.00 C ATOM 310 CG PHE C 20 33.457 8.122 14.969 1.00 0.00 C ATOM 311 CD1 PHE C 20 32.982 9.429 15.134 1.00 0.00 C ATOM 312 CD2 PHE C 20 32.736 7.043 15.492 1.00 0.00 C ATOM 313 CE1 PHE C 20 31.783 9.653 15.822 1.00 0.00 C ATOM 314 CE2 PHE C 20 31.542 7.268 16.175 1.00 0.00 C ATOM 315 CZ PHE C 20 31.064 8.572 16.342 1.00 0.00 C ATOM 0 H PHE C 20 36.967 6.826 14.460 1.00 0.00 H new ATOM 0 HA PHE C 20 36.128 9.499 14.526 1.00 0.00 H new ATOM 0 HB2 PHE C 20 34.697 8.251 13.226 1.00 0.00 H new ATOM 0 HB3 PHE C 20 34.939 6.795 14.172 1.00 0.00 H new ATOM 0 HD1 PHE C 20 33.539 10.262 14.732 1.00 0.00 H new ATOM 0 HD2 PHE C 20 33.105 6.036 15.366 1.00 0.00 H new ATOM 0 HE1 PHE C 20 31.414 10.660 15.951 1.00 0.00 H new ATOM 0 HE2 PHE C 20 30.985 6.434 16.576 1.00 0.00 H new ATOM 0 HZ PHE C 20 30.139 8.744 16.873 1.00 0.00 H new ATOM 325 N LYS C 21 35.318 7.748 17.220 1.00 0.00 N ATOM 326 CA LYS C 21 34.919 7.894 18.613 1.00 0.00 C ATOM 327 C LYS C 21 35.866 8.845 19.337 1.00 0.00 C ATOM 328 O LYS C 21 35.434 9.698 20.111 1.00 0.00 O ATOM 329 CB LYS C 21 34.944 6.527 19.301 1.00 0.00 C ATOM 330 CG LYS C 21 33.572 5.867 19.178 1.00 0.00 C ATOM 331 CD LYS C 21 33.596 4.495 19.856 1.00 0.00 C ATOM 332 CE LYS C 21 33.233 3.412 18.836 1.00 0.00 C ATOM 333 NZ LYS C 21 33.263 2.077 19.498 1.00 0.00 N1+ ATOM 0 H LYS C 21 35.469 6.786 16.916 1.00 0.00 H new ATOM 0 HA LYS C 21 33.910 8.304 18.649 1.00 0.00 H new ATOM 0 HB2 LYS C 21 35.706 5.894 18.846 1.00 0.00 H new ATOM 0 HB3 LYS C 21 35.211 6.642 20.352 1.00 0.00 H new ATOM 0 HG2 LYS C 21 32.812 6.498 19.639 1.00 0.00 H new ATOM 0 HG3 LYS C 21 33.303 5.759 18.127 1.00 0.00 H new ATOM 0 HD2 LYS C 21 34.585 4.301 20.272 1.00 0.00 H new ATOM 0 HD3 LYS C 21 32.891 4.477 20.688 1.00 0.00 H new ATOM 0 HE2 LYS C 21 32.242 3.603 18.423 1.00 0.00 H new ATOM 0 HE3 LYS C 21 33.935 3.432 18.002 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 33.017 1.341 18.806 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 34.217 1.896 19.871 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 32.577 2.061 20.279 1.00 0.00 H new ATOM 347 N ALA C 22 37.160 8.701 19.075 1.00 0.00 N ATOM 348 CA ALA C 22 38.152 9.569 19.708 1.00 0.00 C ATOM 349 C ALA C 22 37.919 11.029 19.317 1.00 0.00 C ATOM 350 O ALA C 22 38.009 11.936 20.151 1.00 0.00 O ATOM 351 CB ALA C 22 39.560 9.145 19.284 1.00 0.00 C ATOM 0 H ALA C 22 37.545 8.003 18.439 1.00 0.00 H new ATOM 0 HA ALA C 22 38.052 9.475 20.789 1.00 0.00 H new ATOM 0 HB1 ALA C 22 40.294 9.796 19.759 1.00 0.00 H new ATOM 0 HB2 ALA C 22 39.737 8.114 19.590 1.00 0.00 H new ATOM 0 HB3 ALA C 22 39.653 9.223 18.201 1.00 0.00 H new ATOM 357 N ALA C 23 37.610 11.246 18.043 1.00 0.00 N ATOM 358 CA ALA C 23 37.357 12.593 17.548 1.00 0.00 C ATOM 359 C ALA C 23 36.165 13.201 18.273 1.00 0.00 C ATOM 360 O ALA C 23 36.161 14.388 18.596 1.00 0.00 O ATOM 361 CB ALA C 23 37.080 12.557 16.043 1.00 0.00 C ATOM 0 H ALA C 23 37.529 10.512 17.339 1.00 0.00 H new ATOM 0 HA ALA C 23 38.239 13.205 17.735 1.00 0.00 H new ATOM 0 HB1 ALA C 23 36.892 13.569 15.683 1.00 0.00 H new ATOM 0 HB2 ALA C 23 37.944 12.142 15.524 1.00 0.00 H new ATOM 0 HB3 ALA C 23 36.206 11.935 15.849 1.00 0.00 H new ATOM 367 N PHE C 24 35.152 12.381 18.521 1.00 0.00 N ATOM 368 CA PHE C 24 33.957 12.854 19.203 1.00 0.00 C ATOM 369 C PHE C 24 34.311 13.339 20.606 1.00 0.00 C ATOM 370 O PHE C 24 33.793 14.352 21.067 1.00 0.00 O ATOM 371 CB PHE C 24 32.919 11.735 19.288 1.00 0.00 C ATOM 372 CG PHE C 24 31.567 12.329 19.602 1.00 0.00 C ATOM 373 CD1 PHE C 24 30.844 12.968 18.586 1.00 0.00 C ATOM 374 CD2 PHE C 24 31.031 12.243 20.893 1.00 0.00 C ATOM 375 CE1 PHE C 24 29.587 13.516 18.858 1.00 0.00 C ATOM 376 CE2 PHE C 24 29.770 12.795 21.165 1.00 0.00 C ATOM 377 CZ PHE C 24 29.049 13.430 20.146 1.00 0.00 C ATOM 0 H PHE C 24 35.134 11.394 18.263 1.00 0.00 H new ATOM 0 HA PHE C 24 33.537 13.684 18.635 1.00 0.00 H new ATOM 0 HB2 PHE C 24 32.879 11.189 18.346 1.00 0.00 H new ATOM 0 HB3 PHE C 24 33.202 11.019 20.060 1.00 0.00 H new ATOM 0 HD1 PHE C 24 31.258 13.037 17.591 1.00 0.00 H new ATOM 0 HD2 PHE C 24 31.587 11.753 21.678 1.00 0.00 H new ATOM 0 HE1 PHE C 24 29.031 14.006 18.073 1.00 0.00 H new ATOM 0 HE2 PHE C 24 29.355 12.730 22.160 1.00 0.00 H new ATOM 0 HZ PHE C 24 28.078 13.853 20.355 1.00 0.00 H new ATOM 387 N ASP C 25 35.205 12.607 21.273 1.00 0.00 N ATOM 388 CA ASP C 25 35.632 12.964 22.627 1.00 0.00 C ATOM 389 C ASP C 25 36.293 14.341 22.635 1.00 0.00 C ATOM 390 O ASP C 25 36.103 15.130 23.562 1.00 0.00 O ATOM 391 CB ASP C 25 36.613 11.916 23.166 1.00 0.00 C ATOM 392 CG ASP C 25 36.907 12.185 24.639 1.00 0.00 C ATOM 393 OD1 ASP C 25 35.987 12.087 25.433 1.00 0.00 O ATOM 394 OD2 ASP C 25 38.049 12.481 24.952 1.00 0.00 O1- ATOM 0 H ASP C 25 35.646 11.767 20.899 1.00 0.00 H new ATOM 0 HA ASP C 25 34.751 12.993 23.268 1.00 0.00 H new ATOM 0 HB2 ASP C 25 36.193 10.917 23.047 1.00 0.00 H new ATOM 0 HB3 ASP C 25 37.539 11.943 22.591 1.00 0.00 H new ATOM 399 N ILE C 26 37.080 14.627 21.606 1.00 0.00 N ATOM 400 CA ILE C 26 37.749 15.916 21.511 1.00 0.00 C ATOM 401 C ILE C 26 36.763 16.994 21.049 1.00 0.00 C ATOM 402 O ILE C 26 36.805 18.130 21.515 1.00 0.00 O ATOM 403 CB ILE C 26 38.920 15.814 20.528 1.00 0.00 C ATOM 404 CG1 ILE C 26 40.168 15.237 21.221 1.00 0.00 C ATOM 405 CG2 ILE C 26 39.241 17.197 19.973 1.00 0.00 C ATOM 406 CD1 ILE C 26 40.074 13.711 21.272 1.00 0.00 C ATOM 0 H ILE C 26 37.269 13.990 20.832 1.00 0.00 H new ATOM 0 HA ILE C 26 38.129 16.195 22.494 1.00 0.00 H new ATOM 0 HB ILE C 26 38.633 15.146 19.716 1.00 0.00 H new ATOM 0 HG12 ILE C 26 41.066 15.537 20.681 1.00 0.00 H new ATOM 0 HG13 ILE C 26 40.253 15.639 22.231 1.00 0.00 H new ATOM 0 HG21 ILE C 26 40.074 17.124 19.274 1.00 0.00 H new ATOM 0 HG22 ILE C 26 38.367 17.593 19.456 1.00 0.00 H new ATOM 0 HG23 ILE C 26 39.512 17.864 20.792 1.00 0.00 H new ATOM 0 HD11 ILE C 26 40.960 13.308 21.763 1.00 0.00 H new ATOM 0 HD12 ILE C 26 39.185 13.420 21.831 1.00 0.00 H new ATOM 0 HD13 ILE C 26 40.011 13.316 20.258 1.00 0.00 H new ATOM 418 N PHE C 27 35.877 16.630 20.131 1.00 0.00 N ATOM 419 CA PHE C 27 34.895 17.578 19.626 1.00 0.00 C ATOM 420 C PHE C 27 34.043 18.131 20.762 1.00 0.00 C ATOM 421 O PHE C 27 33.663 19.302 20.754 1.00 0.00 O ATOM 422 CB PHE C 27 33.993 16.897 18.601 1.00 0.00 C ATOM 423 CG PHE C 27 34.119 17.599 17.272 1.00 0.00 C ATOM 424 CD1 PHE C 27 35.326 17.552 16.565 1.00 0.00 C ATOM 425 CD2 PHE C 27 33.025 18.296 16.745 1.00 0.00 C ATOM 426 CE1 PHE C 27 35.440 18.204 15.331 1.00 0.00 C ATOM 427 CE2 PHE C 27 33.138 18.948 15.513 1.00 0.00 C ATOM 428 CZ PHE C 27 34.345 18.901 14.806 1.00 0.00 C ATOM 0 H PHE C 27 35.818 15.696 19.725 1.00 0.00 H new ATOM 0 HA PHE C 27 35.429 18.403 19.154 1.00 0.00 H new ATOM 0 HB2 PHE C 27 34.270 15.848 18.497 1.00 0.00 H new ATOM 0 HB3 PHE C 27 32.957 16.921 18.940 1.00 0.00 H new ATOM 0 HD1 PHE C 27 36.169 17.013 16.971 1.00 0.00 H new ATOM 0 HD2 PHE C 27 32.093 18.330 17.290 1.00 0.00 H new ATOM 0 HE1 PHE C 27 36.371 18.169 14.785 1.00 0.00 H new ATOM 0 HE2 PHE C 27 32.295 19.487 15.107 1.00 0.00 H new ATOM 0 HZ PHE C 27 34.432 19.403 13.854 1.00 0.00 H new ATOM 438 N VAL C 28 33.737 17.280 21.736 1.00 0.00 N ATOM 439 CA VAL C 28 32.917 17.697 22.867 1.00 0.00 C ATOM 440 C VAL C 28 33.770 18.381 23.934 1.00 0.00 C ATOM 441 O VAL C 28 33.393 18.426 25.105 1.00 0.00 O ATOM 442 CB VAL C 28 32.191 16.492 23.473 1.00 0.00 C ATOM 443 CG1 VAL C 28 31.336 15.813 22.403 1.00 0.00 C ATOM 444 CG2 VAL C 28 33.208 15.489 24.006 1.00 0.00 C ATOM 0 H VAL C 28 34.041 16.307 21.765 1.00 0.00 H new ATOM 0 HA VAL C 28 32.178 18.411 22.503 1.00 0.00 H new ATOM 0 HB VAL C 28 31.555 16.837 24.288 1.00 0.00 H new ATOM 0 HG11 VAL C 28 30.821 14.956 22.838 1.00 0.00 H new ATOM 0 HG12 VAL C 28 30.602 16.522 22.020 1.00 0.00 H new ATOM 0 HG13 VAL C 28 31.975 15.476 21.587 1.00 0.00 H new ATOM 0 HG21 VAL C 28 32.685 14.634 24.436 1.00 0.00 H new ATOM 0 HG22 VAL C 28 33.847 15.151 23.191 1.00 0.00 H new ATOM 0 HG23 VAL C 28 33.819 15.964 24.773 1.00 0.00 H new ATOM 454 N LEU C 29 34.916 18.907 23.520 1.00 0.00 N ATOM 455 CA LEU C 29 35.814 19.588 24.444 1.00 0.00 C ATOM 456 C LEU C 29 35.043 20.518 25.377 1.00 0.00 C ATOM 457 O LEU C 29 35.319 20.573 26.576 1.00 0.00 O ATOM 458 CB LEU C 29 36.856 20.396 23.665 1.00 0.00 C ATOM 459 CG LEU C 29 36.155 21.381 22.728 1.00 0.00 C ATOM 460 CD1 LEU C 29 36.209 22.780 23.335 1.00 0.00 C ATOM 461 CD2 LEU C 29 36.865 21.382 21.376 1.00 0.00 C ATOM 0 H LEU C 29 35.245 18.876 22.555 1.00 0.00 H new ATOM 0 HA LEU C 29 36.314 18.829 25.046 1.00 0.00 H new ATOM 0 HB2 LEU C 29 37.502 20.936 24.357 1.00 0.00 H new ATOM 0 HB3 LEU C 29 37.494 19.725 23.090 1.00 0.00 H new ATOM 0 HG LEU C 29 35.115 21.084 22.592 1.00 0.00 H new ATOM 0 HD11 LEU C 29 35.710 23.485 22.670 1.00 0.00 H new ATOM 0 HD12 LEU C 29 35.707 22.777 24.302 1.00 0.00 H new ATOM 0 HD13 LEU C 29 37.249 23.079 23.467 1.00 0.00 H new ATOM 0 HD21 LEU C 29 36.369 22.083 20.705 1.00 0.00 H new ATOM 0 HD22 LEU C 29 37.904 21.683 21.511 1.00 0.00 H new ATOM 0 HD23 LEU C 29 36.830 20.381 20.946 1.00 0.00 H new ATOM 473 N GLY C 30 34.088 21.257 24.819 1.00 0.00 N ATOM 474 CA GLY C 30 33.301 22.191 25.614 1.00 0.00 C ATOM 475 C GLY C 30 31.940 21.608 25.983 1.00 0.00 C ATOM 476 O GLY C 30 31.354 21.985 26.997 1.00 0.00 O ATOM 0 H GLY C 30 33.843 21.227 23.829 1.00 0.00 H new ATOM 0 HA2 GLY C 30 33.847 22.446 26.523 1.00 0.00 H new ATOM 0 HA3 GLY C 30 33.161 23.117 25.056 1.00 0.00 H new ATOM 480 N ALA C 31 31.436 20.694 25.160 1.00 0.00 N ATOM 481 CA ALA C 31 30.138 20.086 25.423 1.00 0.00 C ATOM 482 C ALA C 31 30.265 18.977 26.455 1.00 0.00 C ATOM 483 O ALA C 31 30.660 17.858 26.137 1.00 0.00 O ATOM 484 CB ALA C 31 29.558 19.521 24.131 1.00 0.00 C ATOM 0 H ALA C 31 31.901 20.361 24.315 1.00 0.00 H new ATOM 0 HA ALA C 31 29.471 20.853 25.815 1.00 0.00 H new ATOM 0 HB1 ALA C 31 28.588 19.068 24.335 1.00 0.00 H new ATOM 0 HB2 ALA C 31 29.438 20.324 23.404 1.00 0.00 H new ATOM 0 HB3 ALA C 31 30.233 18.766 23.729 1.00 0.00 H new ATOM 490 N GLU C 32 29.927 19.295 27.692 1.00 0.00 N ATOM 491 CA GLU C 32 30.008 18.318 28.764 1.00 0.00 C ATOM 492 C GLU C 32 29.002 17.199 28.534 1.00 0.00 C ATOM 493 O GLU C 32 29.252 16.039 28.863 1.00 0.00 O ATOM 494 CB GLU C 32 29.749 18.990 30.110 1.00 0.00 C ATOM 495 CG GLU C 32 30.229 18.072 31.235 1.00 0.00 C ATOM 496 CD GLU C 32 29.893 18.687 32.589 1.00 0.00 C ATOM 497 OE1 GLU C 32 28.792 18.457 33.062 1.00 0.00 O ATOM 498 OE2 GLU C 32 30.738 19.379 33.131 1.00 0.00 O1- ATOM 0 H GLU C 32 29.596 20.216 27.978 1.00 0.00 H new ATOM 0 HA GLU C 32 31.011 17.891 28.772 1.00 0.00 H new ATOM 0 HB2 GLU C 32 30.270 19.946 30.158 1.00 0.00 H new ATOM 0 HB3 GLU C 32 28.686 19.200 30.226 1.00 0.00 H new ATOM 0 HG2 GLU C 32 29.757 17.094 31.144 1.00 0.00 H new ATOM 0 HG3 GLU C 32 31.305 17.916 31.154 1.00 0.00 H new ATOM 505 N ASP C 33 27.858 17.566 27.972 1.00 0.00 N ATOM 506 CA ASP C 33 26.800 16.597 27.700 1.00 0.00 C ATOM 507 C ASP C 33 27.185 15.685 26.540 1.00 0.00 C ATOM 508 O ASP C 33 26.547 14.658 26.314 1.00 0.00 O ATOM 509 CB ASP C 33 25.492 17.318 27.364 1.00 0.00 C ATOM 510 CG ASP C 33 25.658 18.137 26.089 1.00 0.00 C ATOM 511 OD1 ASP C 33 26.757 18.154 25.558 1.00 0.00 O ATOM 512 OD2 ASP C 33 24.684 18.731 25.660 1.00 0.00 O1- ATOM 0 H ASP C 33 27.638 18.523 27.696 1.00 0.00 H new ATOM 0 HA ASP C 33 26.662 15.992 28.596 1.00 0.00 H new ATOM 0 HB2 ASP C 33 24.689 16.591 27.237 1.00 0.00 H new ATOM 0 HB3 ASP C 33 25.204 17.970 28.189 1.00 0.00 H new ATOM 517 N GLY C 34 28.232 16.058 25.807 1.00 0.00 N ATOM 518 CA GLY C 34 28.674 15.246 24.682 1.00 0.00 C ATOM 519 C GLY C 34 27.903 15.588 23.410 1.00 0.00 C ATOM 520 O GLY C 34 27.857 14.794 22.474 1.00 0.00 O ATOM 0 H GLY C 34 28.780 16.903 25.970 1.00 0.00 H new ATOM 0 HA2 GLY C 34 29.740 15.402 24.516 1.00 0.00 H new ATOM 0 HA3 GLY C 34 28.539 14.190 24.918 1.00 0.00 H new ATOM 524 N CYS C 35 27.302 16.775 23.388 1.00 0.00 N ATOM 525 CA CYS C 35 26.536 17.216 22.221 1.00 0.00 C ATOM 526 C CYS C 35 27.253 18.364 21.510 1.00 0.00 C ATOM 527 O CYS C 35 27.812 19.246 22.152 1.00 0.00 O ATOM 528 CB CYS C 35 25.140 17.672 22.653 1.00 0.00 C ATOM 529 SG CYS C 35 24.268 16.290 23.436 1.00 0.00 S ATOM 0 H CYS C 35 27.329 17.445 24.157 1.00 0.00 H new ATOM 0 HA CYS C 35 26.446 16.377 21.531 1.00 0.00 H new ATOM 0 HB2 CYS C 35 25.218 18.508 23.349 1.00 0.00 H new ATOM 0 HB3 CYS C 35 24.578 18.028 21.789 1.00 0.00 H new ATOM 0 HG CYS C 35 23.083 16.678 23.805 1.00 0.00 H new ATOM 535 N ILE C 36 27.236 18.341 20.182 1.00 0.00 N ATOM 536 CA ILE C 36 27.900 19.381 19.398 1.00 0.00 C ATOM 537 C ILE C 36 26.902 20.464 19.008 1.00 0.00 C ATOM 538 O ILE C 36 25.795 20.169 18.552 1.00 0.00 O ATOM 539 CB ILE C 36 28.497 18.768 18.133 1.00 0.00 C ATOM 540 CG1 ILE C 36 29.169 17.434 18.473 1.00 0.00 C ATOM 541 CG2 ILE C 36 29.530 19.723 17.530 1.00 0.00 C ATOM 542 CD1 ILE C 36 30.153 17.618 19.626 1.00 0.00 C ATOM 0 H ILE C 36 26.774 17.620 19.627 1.00 0.00 H new ATOM 0 HA ILE C 36 28.692 19.824 20.002 1.00 0.00 H new ATOM 0 HB ILE C 36 27.700 18.598 17.409 1.00 0.00 H new ATOM 0 HG12 ILE C 36 28.413 16.697 18.744 1.00 0.00 H new ATOM 0 HG13 ILE C 36 29.691 17.048 17.598 1.00 0.00 H new ATOM 0 HG21 ILE C 36 29.952 19.280 16.628 1.00 0.00 H new ATOM 0 HG22 ILE C 36 29.049 20.668 17.279 1.00 0.00 H new ATOM 0 HG23 ILE C 36 30.326 19.902 18.253 1.00 0.00 H new ATOM 0 HD11 ILE C 36 30.624 16.663 19.858 1.00 0.00 H new ATOM 0 HD12 ILE C 36 30.918 18.340 19.340 1.00 0.00 H new ATOM 0 HD13 ILE C 36 29.620 17.983 20.504 1.00 0.00 H new ATOM 554 N SER C 37 27.302 21.711 19.200 1.00 0.00 N ATOM 555 CA SER C 37 26.443 22.839 18.874 1.00 0.00 C ATOM 556 C SER C 37 27.226 23.901 18.115 1.00 0.00 C ATOM 557 O SER C 37 28.389 23.697 17.762 1.00 0.00 O ATOM 558 CB SER C 37 25.871 23.438 20.158 1.00 0.00 C ATOM 559 OG SER C 37 24.915 24.433 19.826 1.00 0.00 O ATOM 0 H SER C 37 28.214 21.968 19.579 1.00 0.00 H new ATOM 0 HA SER C 37 25.627 22.488 18.242 1.00 0.00 H new ATOM 0 HB2 SER C 37 25.407 22.658 20.761 1.00 0.00 H new ATOM 0 HB3 SER C 37 26.671 23.872 20.758 1.00 0.00 H new ATOM 0 HG SER C 37 24.545 24.818 20.648 1.00 0.00 H new ATOM 565 N THR C 38 26.584 25.033 17.866 1.00 0.00 N ATOM 566 CA THR C 38 27.230 26.115 17.148 1.00 0.00 C ATOM 567 C THR C 38 28.397 26.663 17.961 1.00 0.00 C ATOM 568 O THR C 38 29.345 27.218 17.406 1.00 0.00 O ATOM 569 CB THR C 38 26.218 27.227 16.871 1.00 0.00 C ATOM 570 OG1 THR C 38 25.686 27.695 18.103 1.00 0.00 O ATOM 571 CG2 THR C 38 25.083 26.690 15.991 1.00 0.00 C ATOM 0 H THR C 38 25.623 25.223 18.149 1.00 0.00 H new ATOM 0 HA THR C 38 27.612 25.734 16.201 1.00 0.00 H new ATOM 0 HB THR C 38 26.714 28.047 16.351 1.00 0.00 H new ATOM 0 HG1 THR C 38 25.038 28.409 17.929 1.00 0.00 H new ATOM 0 HG21 THR C 38 24.365 27.487 15.797 1.00 0.00 H new ATOM 0 HG22 THR C 38 25.493 26.333 15.046 1.00 0.00 H new ATOM 0 HG23 THR C 38 24.583 25.868 16.503 1.00 0.00 H new ATOM 579 N LYS C 39 28.326 26.501 19.279 1.00 0.00 N ATOM 580 CA LYS C 39 29.393 26.988 20.142 1.00 0.00 C ATOM 581 C LYS C 39 30.712 26.298 19.803 1.00 0.00 C ATOM 582 O LYS C 39 31.727 26.962 19.585 1.00 0.00 O ATOM 583 CB LYS C 39 29.039 26.711 21.605 1.00 0.00 C ATOM 584 CG LYS C 39 30.041 27.414 22.526 1.00 0.00 C ATOM 585 CD LYS C 39 30.551 26.424 23.576 1.00 0.00 C ATOM 586 CE LYS C 39 29.381 25.924 24.425 1.00 0.00 C ATOM 587 NZ LYS C 39 29.207 24.458 24.215 1.00 0.00 N1+ ATOM 0 H LYS C 39 27.554 26.044 19.765 1.00 0.00 H new ATOM 0 HA LYS C 39 29.504 28.061 19.985 1.00 0.00 H new ATOM 0 HB2 LYS C 39 28.029 27.062 21.817 1.00 0.00 H new ATOM 0 HB3 LYS C 39 29.049 25.638 21.794 1.00 0.00 H new ATOM 0 HG2 LYS C 39 30.875 27.804 21.943 1.00 0.00 H new ATOM 0 HG3 LYS C 39 29.567 28.266 23.014 1.00 0.00 H new ATOM 0 HD2 LYS C 39 31.044 25.583 23.088 1.00 0.00 H new ATOM 0 HD3 LYS C 39 31.295 26.904 24.212 1.00 0.00 H new ATOM 0 HE2 LYS C 39 29.567 26.132 25.479 1.00 0.00 H new ATOM 0 HE3 LYS C 39 28.468 26.452 24.152 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 28.820 24.027 25.079 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 28.551 24.296 23.424 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 30.128 24.027 23.995 1.00 0.00 H new ATOM 601 N GLU C 40 30.698 24.965 19.739 1.00 0.00 N ATOM 602 CA GLU C 40 31.904 24.220 19.404 1.00 0.00 C ATOM 603 C GLU C 40 32.258 24.385 17.930 1.00 0.00 C ATOM 604 O GLU C 40 33.433 24.450 17.553 1.00 0.00 O ATOM 605 CB GLU C 40 31.721 22.742 19.738 1.00 0.00 C ATOM 606 CG GLU C 40 31.687 22.572 21.258 1.00 0.00 C ATOM 607 CD GLU C 40 31.356 21.127 21.614 1.00 0.00 C ATOM 608 OE1 GLU C 40 30.813 20.440 20.767 1.00 0.00 O ATOM 609 OE2 GLU C 40 31.656 20.729 22.727 1.00 0.00 O1- ATOM 0 H GLU C 40 29.874 24.389 19.913 1.00 0.00 H new ATOM 0 HA GLU C 40 32.725 24.620 19.998 1.00 0.00 H new ATOM 0 HB2 GLU C 40 30.797 22.369 19.297 1.00 0.00 H new ATOM 0 HB3 GLU C 40 32.536 22.157 19.312 1.00 0.00 H new ATOM 0 HG2 GLU C 40 32.651 22.849 21.685 1.00 0.00 H new ATOM 0 HG3 GLU C 40 30.943 23.241 21.690 1.00 0.00 H new ATOM 616 N LEU C 41 31.223 24.432 17.099 1.00 0.00 N ATOM 617 CA LEU C 41 31.409 24.567 15.666 1.00 0.00 C ATOM 618 C LEU C 41 32.218 25.819 15.356 1.00 0.00 C ATOM 619 O LEU C 41 32.911 25.885 14.341 1.00 0.00 O ATOM 620 CB LEU C 41 30.047 24.643 14.975 1.00 0.00 C ATOM 621 CG LEU C 41 30.187 24.144 13.533 1.00 0.00 C ATOM 622 CD1 LEU C 41 30.411 22.625 13.510 1.00 0.00 C ATOM 623 CD2 LEU C 41 28.920 24.482 12.745 1.00 0.00 C ATOM 0 H LEU C 41 30.249 24.378 17.396 1.00 0.00 H new ATOM 0 HA LEU C 41 31.953 23.698 15.296 1.00 0.00 H new ATOM 0 HB2 LEU C 41 29.318 24.037 15.513 1.00 0.00 H new ATOM 0 HB3 LEU C 41 29.678 25.669 14.984 1.00 0.00 H new ATOM 0 HG LEU C 41 31.046 24.636 13.077 1.00 0.00 H new ATOM 0 HD11 LEU C 41 30.508 22.287 12.478 1.00 0.00 H new ATOM 0 HD12 LEU C 41 31.321 22.383 14.058 1.00 0.00 H new ATOM 0 HD13 LEU C 41 29.562 22.125 13.977 1.00 0.00 H new ATOM 0 HD21 LEU C 41 29.023 24.126 11.720 1.00 0.00 H new ATOM 0 HD22 LEU C 41 28.061 24.000 13.212 1.00 0.00 H new ATOM 0 HD23 LEU C 41 28.772 25.562 12.741 1.00 0.00 H new ATOM 635 N GLY C 42 32.123 26.811 16.231 1.00 0.00 N ATOM 636 CA GLY C 42 32.854 28.053 16.029 1.00 0.00 C ATOM 637 C GLY C 42 34.357 27.796 15.977 1.00 0.00 C ATOM 638 O GLY C 42 35.064 28.373 15.152 1.00 0.00 O ATOM 0 H GLY C 42 31.554 26.781 17.077 1.00 0.00 H new ATOM 0 HA2 GLY C 42 32.529 28.525 15.102 1.00 0.00 H new ATOM 0 HA3 GLY C 42 32.627 28.749 16.837 1.00 0.00 H new ATOM 642 N LYS C 43 34.845 26.917 16.848 1.00 0.00 N ATOM 643 CA LYS C 43 36.255 26.591 16.876 1.00 0.00 C ATOM 644 C LYS C 43 36.632 25.827 15.617 1.00 0.00 C ATOM 645 O LYS C 43 37.708 26.021 15.051 1.00 0.00 O ATOM 646 CB LYS C 43 36.574 25.769 18.120 1.00 0.00 C ATOM 647 CG LYS C 43 38.070 25.490 18.169 1.00 0.00 C ATOM 648 CD LYS C 43 38.403 24.732 19.451 1.00 0.00 C ATOM 649 CE LYS C 43 39.894 24.384 19.471 1.00 0.00 C ATOM 650 NZ LYS C 43 40.703 25.637 19.499 1.00 0.00 N1+ ATOM 0 H LYS C 43 34.281 26.422 17.539 1.00 0.00 H new ATOM 0 HA LYS C 43 36.838 27.511 16.912 1.00 0.00 H new ATOM 0 HB2 LYS C 43 36.263 26.308 19.015 1.00 0.00 H new ATOM 0 HB3 LYS C 43 36.018 24.832 18.103 1.00 0.00 H new ATOM 0 HG2 LYS C 43 38.371 24.906 17.299 1.00 0.00 H new ATOM 0 HG3 LYS C 43 38.627 26.426 18.132 1.00 0.00 H new ATOM 0 HD2 LYS C 43 38.149 25.339 20.320 1.00 0.00 H new ATOM 0 HD3 LYS C 43 37.806 23.822 19.513 1.00 0.00 H new ATOM 0 HE2 LYS C 43 40.123 23.773 20.344 1.00 0.00 H new ATOM 0 HE3 LYS C 43 40.151 23.793 18.592 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 41.674 25.417 19.799 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 40.721 26.060 18.549 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 40.278 26.310 20.169 1.00 0.00 H new ATOM 664 N VAL C 44 35.736 24.949 15.194 1.00 0.00 N ATOM 665 CA VAL C 44 35.982 24.151 14.001 1.00 0.00 C ATOM 666 C VAL C 44 36.178 25.059 12.797 1.00 0.00 C ATOM 667 O VAL C 44 37.084 24.851 11.992 1.00 0.00 O ATOM 668 CB VAL C 44 34.790 23.238 13.744 1.00 0.00 C ATOM 669 CG1 VAL C 44 34.946 22.555 12.382 1.00 0.00 C ATOM 670 CG2 VAL C 44 34.716 22.173 14.839 1.00 0.00 C ATOM 0 H VAL C 44 34.842 24.771 15.652 1.00 0.00 H new ATOM 0 HA VAL C 44 36.881 23.554 14.155 1.00 0.00 H new ATOM 0 HB VAL C 44 33.876 23.832 13.749 1.00 0.00 H new ATOM 0 HG11 VAL C 44 34.091 21.903 12.202 1.00 0.00 H new ATOM 0 HG12 VAL C 44 34.996 23.312 11.599 1.00 0.00 H new ATOM 0 HG13 VAL C 44 35.862 21.964 12.374 1.00 0.00 H new ATOM 0 HG21 VAL C 44 33.863 21.520 14.655 1.00 0.00 H new ATOM 0 HG22 VAL C 44 35.632 21.583 14.835 1.00 0.00 H new ATOM 0 HG23 VAL C 44 34.600 22.656 15.809 1.00 0.00 H new ATOM 680 N MET C 45 35.324 26.066 12.678 1.00 0.00 N ATOM 681 CA MET C 45 35.420 26.993 11.565 1.00 0.00 C ATOM 682 C MET C 45 36.754 27.734 11.596 1.00 0.00 C ATOM 683 O MET C 45 37.364 27.979 10.555 1.00 0.00 O ATOM 684 CB MET C 45 34.274 28.002 11.607 1.00 0.00 C ATOM 685 CG MET C 45 32.958 27.304 11.260 1.00 0.00 C ATOM 686 SD MET C 45 32.960 26.845 9.508 1.00 0.00 S ATOM 687 CE MET C 45 31.344 26.032 9.487 1.00 0.00 C ATOM 0 H MET C 45 34.565 26.259 13.332 1.00 0.00 H new ATOM 0 HA MET C 45 35.355 26.418 10.642 1.00 0.00 H new ATOM 0 HB2 MET C 45 34.208 28.451 12.598 1.00 0.00 H new ATOM 0 HB3 MET C 45 34.464 28.812 10.902 1.00 0.00 H new ATOM 0 HG2 MET C 45 32.831 26.416 11.879 1.00 0.00 H new ATOM 0 HG3 MET C 45 32.117 27.964 11.473 1.00 0.00 H new ATOM 0 HE1 MET C 45 31.135 25.664 8.483 1.00 0.00 H new ATOM 0 HE2 MET C 45 31.348 25.196 10.186 1.00 0.00 H new ATOM 0 HE3 MET C 45 30.574 26.746 9.779 1.00 0.00 H new ATOM 697 N ARG C 46 37.196 28.096 12.798 1.00 0.00 N ATOM 698 CA ARG C 46 38.455 28.819 12.954 1.00 0.00 C ATOM 699 C ARG C 46 39.614 27.994 12.408 1.00 0.00 C ATOM 700 O ARG C 46 40.493 28.515 11.721 1.00 0.00 O ATOM 701 CB ARG C 46 38.697 29.113 14.437 1.00 0.00 C ATOM 702 CG ARG C 46 37.797 30.265 14.891 1.00 0.00 C ATOM 703 CD ARG C 46 38.600 31.565 14.900 1.00 0.00 C ATOM 704 NE ARG C 46 39.101 31.853 13.561 1.00 0.00 N ATOM 705 CZ ARG C 46 40.213 32.558 13.375 1.00 0.00 C ATOM 706 NH1 ARG C 46 40.882 33.010 14.401 1.00 0.00 N ATOM 707 NH2 ARG C 46 40.638 32.798 12.165 1.00 0.00 N1+ ATOM 0 H ARG C 46 36.706 27.903 13.671 1.00 0.00 H new ATOM 0 HA ARG C 46 38.393 29.754 12.397 1.00 0.00 H new ATOM 0 HB2 ARG C 46 38.492 28.223 15.032 1.00 0.00 H new ATOM 0 HB3 ARG C 46 39.743 29.371 14.600 1.00 0.00 H new ATOM 0 HG2 ARG C 46 36.942 30.358 14.222 1.00 0.00 H new ATOM 0 HG3 ARG C 46 37.402 30.062 15.887 1.00 0.00 H new ATOM 0 HD2 ARG C 46 37.973 32.387 15.247 1.00 0.00 H new ATOM 0 HD3 ARG C 46 39.433 31.483 15.599 1.00 0.00 H new ATOM 0 HE ARG C 46 38.588 31.506 12.750 1.00 0.00 H new ATOM 0 HH11 ARG C 46 40.552 32.823 15.348 1.00 0.00 H new ATOM 0 HH12 ARG C 46 41.735 33.551 14.256 1.00 0.00 H new ATOM 0 HH21 ARG C 46 40.117 32.445 11.362 1.00 0.00 H new ATOM 0 HH22 ARG C 46 41.491 33.339 12.022 1.00 0.00 H new ATOM 721 N MET C 47 39.605 26.701 12.698 1.00 0.00 N ATOM 722 CA MET C 47 40.655 25.817 12.211 1.00 0.00 C ATOM 723 C MET C 47 40.607 25.722 10.692 1.00 0.00 C ATOM 724 O MET C 47 41.638 25.638 10.026 1.00 0.00 O ATOM 725 CB MET C 47 40.521 24.424 12.834 1.00 0.00 C ATOM 726 CG MET C 47 40.886 24.492 14.322 1.00 0.00 C ATOM 727 SD MET C 47 41.001 22.815 15.001 1.00 0.00 S ATOM 728 CE MET C 47 39.229 22.454 15.065 1.00 0.00 C ATOM 0 H MET C 47 38.889 26.243 13.263 1.00 0.00 H new ATOM 0 HA MET C 47 41.618 26.235 12.505 1.00 0.00 H new ATOM 0 HB2 MET C 47 39.501 24.057 12.715 1.00 0.00 H new ATOM 0 HB3 MET C 47 41.175 23.720 12.320 1.00 0.00 H new ATOM 0 HG2 MET C 47 41.835 25.012 14.450 1.00 0.00 H new ATOM 0 HG3 MET C 47 40.133 25.064 14.865 1.00 0.00 H new ATOM 0 HE1 MET C 47 39.063 21.550 15.651 1.00 0.00 H new ATOM 0 HE2 MET C 47 38.704 23.289 15.529 1.00 0.00 H new ATOM 0 HE3 MET C 47 38.851 22.305 14.053 1.00 0.00 H new ATOM 738 N LEU C 48 39.396 25.734 10.156 1.00 0.00 N ATOM 739 CA LEU C 48 39.201 25.650 8.713 1.00 0.00 C ATOM 740 C LEU C 48 39.608 26.957 8.041 1.00 0.00 C ATOM 741 O LEU C 48 39.623 27.054 6.814 1.00 0.00 O ATOM 742 CB LEU C 48 37.734 25.340 8.399 1.00 0.00 C ATOM 743 CG LEU C 48 37.384 23.931 8.900 1.00 0.00 C ATOM 744 CD1 LEU C 48 35.880 23.684 8.751 1.00 0.00 C ATOM 745 CD2 LEU C 48 38.152 22.872 8.095 1.00 0.00 C ATOM 0 H LEU C 48 38.533 25.801 10.696 1.00 0.00 H new ATOM 0 HA LEU C 48 39.829 24.847 8.326 1.00 0.00 H new ATOM 0 HB2 LEU C 48 37.087 26.077 8.875 1.00 0.00 H new ATOM 0 HB3 LEU C 48 37.560 25.408 7.325 1.00 0.00 H new ATOM 0 HG LEU C 48 37.666 23.857 9.950 1.00 0.00 H new ATOM 0 HD11 LEU C 48 35.639 22.683 9.108 1.00 0.00 H new ATOM 0 HD12 LEU C 48 35.330 24.421 9.337 1.00 0.00 H new ATOM 0 HD13 LEU C 48 35.599 23.772 7.702 1.00 0.00 H new ATOM 0 HD21 LEU C 48 37.894 21.878 8.461 1.00 0.00 H new ATOM 0 HD22 LEU C 48 37.884 22.951 7.041 1.00 0.00 H new ATOM 0 HD23 LEU C 48 39.224 23.034 8.210 1.00 0.00 H new ATOM 757 N GLY C 49 39.938 27.960 8.849 1.00 0.00 N ATOM 758 CA GLY C 49 40.346 29.251 8.313 1.00 0.00 C ATOM 759 C GLY C 49 39.140 30.056 7.844 1.00 0.00 C ATOM 760 O GLY C 49 39.262 30.934 6.990 1.00 0.00 O ATOM 0 H GLY C 49 39.931 27.904 9.867 1.00 0.00 H new ATOM 0 HA2 GLY C 49 40.886 29.811 9.076 1.00 0.00 H new ATOM 0 HA3 GLY C 49 41.034 29.102 7.481 1.00 0.00 H new ATOM 764 N GLN C 50 37.974 29.745 8.407 1.00 0.00 N ATOM 765 CA GLN C 50 36.744 30.441 8.043 1.00 0.00 C ATOM 766 C GLN C 50 36.119 31.098 9.268 1.00 0.00 C ATOM 767 O GLN C 50 36.112 30.527 10.358 1.00 0.00 O ATOM 768 CB GLN C 50 35.751 29.452 7.433 1.00 0.00 C ATOM 769 CG GLN C 50 36.374 28.804 6.195 1.00 0.00 C ATOM 770 CD GLN C 50 35.472 27.689 5.681 1.00 0.00 C ATOM 771 OE1 GLN C 50 34.392 27.377 6.345 1.00 0.00 O flip ATOM 772 NE2 GLN C 50 35.759 27.083 4.648 1.00 0.00 N flip ATOM 0 H GLN C 50 37.856 29.019 9.114 1.00 0.00 H new ATOM 0 HA GLN C 50 36.986 31.214 7.313 1.00 0.00 H new ATOM 0 HB2 GLN C 50 35.487 28.687 8.164 1.00 0.00 H new ATOM 0 HB3 GLN C 50 34.829 29.966 7.163 1.00 0.00 H new ATOM 0 HG2 GLN C 50 36.520 29.553 5.417 1.00 0.00 H new ATOM 0 HG3 GLN C 50 37.358 28.403 6.440 1.00 0.00 H new ATOM 0 HE21 GLN C 50 36.603 27.328 4.131 1.00 0.00 H new ATOM 0 HE22 GLN C 50 35.153 26.336 4.310 1.00 0.00 H new ATOM 781 N ASN C 51 35.590 32.303 9.077 1.00 0.00 N ATOM 782 CA ASN C 51 34.958 33.036 10.169 1.00 0.00 C ATOM 783 C ASN C 51 33.641 33.649 9.714 1.00 0.00 C ATOM 784 O ASN C 51 33.516 34.867 9.591 1.00 0.00 O ATOM 785 CB ASN C 51 35.891 34.143 10.663 1.00 0.00 C ATOM 786 CG ASN C 51 35.293 34.827 11.888 1.00 0.00 C ATOM 787 OD1 ASN C 51 34.102 34.682 12.161 1.00 0.00 O ATOM 788 ND2 ASN C 51 36.051 35.577 12.640 1.00 0.00 N ATOM 0 H ASN C 51 35.586 32.791 8.181 1.00 0.00 H new ATOM 0 HA ASN C 51 34.759 32.337 10.981 1.00 0.00 H new ATOM 0 HB2 ASN C 51 36.866 33.723 10.911 1.00 0.00 H new ATOM 0 HB3 ASN C 51 36.051 34.874 9.871 1.00 0.00 H new ATOM 0 HD21 ASN C 51 35.657 36.045 13.456 1.00 0.00 H new ATOM 0 HD22 ASN C 51 37.038 35.696 12.412 1.00 0.00 H new ATOM 795 N PRO C 52 32.662 32.823 9.471 1.00 0.00 N ATOM 796 CA PRO C 52 31.313 33.271 9.030 1.00 0.00 C ATOM 797 C PRO C 52 30.483 33.807 10.182 1.00 0.00 C ATOM 798 O PRO C 52 30.999 34.051 11.275 1.00 0.00 O ATOM 799 CB PRO C 52 30.688 32.010 8.450 1.00 0.00 C ATOM 800 CG PRO C 52 31.342 30.883 9.172 1.00 0.00 C ATOM 801 CD PRO C 52 32.732 31.358 9.591 1.00 0.00 C ATOM 0 HA PRO C 52 31.367 34.093 8.316 1.00 0.00 H new ATOM 0 HB2 PRO C 52 29.608 32.000 8.600 1.00 0.00 H new ATOM 0 HB3 PRO C 52 30.861 31.943 7.376 1.00 0.00 H new ATOM 0 HG2 PRO C 52 30.756 30.593 10.044 1.00 0.00 H new ATOM 0 HG3 PRO C 52 31.413 30.005 8.530 1.00 0.00 H new ATOM 0 HD2 PRO C 52 32.967 31.052 10.610 1.00 0.00 H new ATOM 0 HD3 PRO C 52 33.506 30.942 8.947 1.00 0.00 H new ATOM 809 N THR C 53 29.195 33.996 9.935 1.00 0.00 N ATOM 810 CA THR C 53 28.305 34.511 10.964 1.00 0.00 C ATOM 811 C THR C 53 27.521 33.381 11.642 1.00 0.00 C ATOM 812 O THR C 53 27.268 32.340 11.030 1.00 0.00 O ATOM 813 CB THR C 53 27.330 35.521 10.358 1.00 0.00 C ATOM 814 OG1 THR C 53 26.891 35.057 9.088 1.00 0.00 O ATOM 815 CG2 THR C 53 28.024 36.874 10.213 1.00 0.00 C ATOM 0 H THR C 53 28.746 33.802 9.040 1.00 0.00 H new ATOM 0 HA THR C 53 28.918 35.002 11.719 1.00 0.00 H new ATOM 0 HB THR C 53 26.465 35.633 11.012 1.00 0.00 H new ATOM 0 HG1 THR C 53 26.265 35.705 8.702 1.00 0.00 H new ATOM 0 HG21 THR C 53 27.330 37.595 9.781 1.00 0.00 H new ATOM 0 HG22 THR C 53 28.347 37.224 11.193 1.00 0.00 H new ATOM 0 HG23 THR C 53 28.891 36.770 9.561 1.00 0.00 H new ATOM 823 N PRO C 54 27.118 33.561 12.887 1.00 0.00 N ATOM 824 CA PRO C 54 26.338 32.522 13.632 1.00 0.00 C ATOM 825 C PRO C 54 25.158 31.986 12.822 1.00 0.00 C ATOM 826 O PRO C 54 24.824 30.804 12.905 1.00 0.00 O ATOM 827 CB PRO C 54 25.825 33.270 14.864 1.00 0.00 C ATOM 828 CG PRO C 54 26.804 34.366 15.101 1.00 0.00 C ATOM 829 CD PRO C 54 27.359 34.758 13.730 1.00 0.00 C ATOM 0 HA PRO C 54 26.952 31.652 13.864 1.00 0.00 H new ATOM 0 HB2 PRO C 54 24.825 33.668 14.693 1.00 0.00 H new ATOM 0 HB3 PRO C 54 25.761 32.607 15.727 1.00 0.00 H new ATOM 0 HG2 PRO C 54 26.324 35.218 15.583 1.00 0.00 H new ATOM 0 HG3 PRO C 54 27.604 34.035 15.763 1.00 0.00 H new ATOM 0 HD2 PRO C 54 26.851 35.636 13.330 1.00 0.00 H new ATOM 0 HD3 PRO C 54 28.420 35.001 13.784 1.00 0.00 H new ATOM 837 N GLU C 55 24.523 32.863 12.049 1.00 0.00 N ATOM 838 CA GLU C 55 23.375 32.460 11.244 1.00 0.00 C ATOM 839 C GLU C 55 23.752 31.340 10.287 1.00 0.00 C ATOM 840 O GLU C 55 22.956 30.445 10.009 1.00 0.00 O ATOM 841 CB GLU C 55 22.873 33.656 10.440 1.00 0.00 C ATOM 842 CG GLU C 55 23.954 34.101 9.460 1.00 0.00 C ATOM 843 CD GLU C 55 23.581 35.447 8.848 1.00 0.00 C ATOM 844 OE1 GLU C 55 23.625 36.435 9.564 1.00 0.00 O ATOM 845 OE2 GLU C 55 23.256 35.473 7.673 1.00 0.00 O1- ATOM 0 H GLU C 55 24.780 33.846 11.963 1.00 0.00 H new ATOM 0 HA GLU C 55 22.593 32.102 11.914 1.00 0.00 H new ATOM 0 HB2 GLU C 55 21.965 33.389 9.899 1.00 0.00 H new ATOM 0 HB3 GLU C 55 22.615 34.476 11.110 1.00 0.00 H new ATOM 0 HG2 GLU C 55 24.912 34.179 9.974 1.00 0.00 H new ATOM 0 HG3 GLU C 55 24.073 33.355 8.674 1.00 0.00 H new ATOM 852 N GLU C 56 24.976 31.401 9.793 1.00 0.00 N ATOM 853 CA GLU C 56 25.473 30.390 8.866 1.00 0.00 C ATOM 854 C GLU C 56 25.688 29.078 9.595 1.00 0.00 C ATOM 855 O GLU C 56 25.398 28.005 9.067 1.00 0.00 O ATOM 856 CB GLU C 56 26.796 30.837 8.243 1.00 0.00 C ATOM 857 CG GLU C 56 26.563 32.123 7.460 1.00 0.00 C ATOM 858 CD GLU C 56 27.824 32.522 6.701 1.00 0.00 C ATOM 859 OE1 GLU C 56 28.687 31.675 6.534 1.00 0.00 O ATOM 860 OE2 GLU C 56 27.908 33.668 6.292 1.00 0.00 O1- ATOM 0 H GLU C 56 25.646 32.137 10.016 1.00 0.00 H new ATOM 0 HA GLU C 56 24.732 30.257 8.078 1.00 0.00 H new ATOM 0 HB2 GLU C 56 27.543 30.999 9.020 1.00 0.00 H new ATOM 0 HB3 GLU C 56 27.184 30.060 7.585 1.00 0.00 H new ATOM 0 HG2 GLU C 56 25.739 31.985 6.760 1.00 0.00 H new ATOM 0 HG3 GLU C 56 26.273 32.923 8.141 1.00 0.00 H new ATOM 867 N LEU C 57 26.204 29.177 10.814 1.00 0.00 N ATOM 868 CA LEU C 57 26.457 27.980 11.609 1.00 0.00 C ATOM 869 C LEU C 57 25.169 27.207 11.838 1.00 0.00 C ATOM 870 O LEU C 57 25.140 25.979 11.723 1.00 0.00 O ATOM 871 CB LEU C 57 27.066 28.345 12.970 1.00 0.00 C ATOM 872 CG LEU C 57 28.578 28.532 12.835 1.00 0.00 C ATOM 873 CD1 LEU C 57 28.874 29.673 11.868 1.00 0.00 C ATOM 874 CD2 LEU C 57 29.176 28.861 14.205 1.00 0.00 C ATOM 0 H LEU C 57 26.452 30.056 11.268 1.00 0.00 H new ATOM 0 HA LEU C 57 27.161 27.360 11.054 1.00 0.00 H new ATOM 0 HB2 LEU C 57 26.611 29.261 13.347 1.00 0.00 H new ATOM 0 HB3 LEU C 57 26.852 27.560 13.695 1.00 0.00 H new ATOM 0 HG LEU C 57 29.020 27.612 12.453 1.00 0.00 H new ATOM 0 HD11 LEU C 57 29.952 29.801 11.776 1.00 0.00 H new ATOM 0 HD12 LEU C 57 28.452 29.440 10.891 1.00 0.00 H new ATOM 0 HD13 LEU C 57 28.430 30.594 12.245 1.00 0.00 H new ATOM 0 HD21 LEU C 57 30.254 28.994 14.109 1.00 0.00 H new ATOM 0 HD22 LEU C 57 28.729 29.779 14.586 1.00 0.00 H new ATOM 0 HD23 LEU C 57 28.972 28.044 14.897 1.00 0.00 H new ATOM 886 N GLN C 58 24.105 27.930 12.157 1.00 0.00 N ATOM 887 CA GLN C 58 22.816 27.287 12.397 1.00 0.00 C ATOM 888 C GLN C 58 22.302 26.619 11.131 1.00 0.00 C ATOM 889 O GLN C 58 21.812 25.489 11.163 1.00 0.00 O ATOM 890 CB GLN C 58 21.799 28.311 12.902 1.00 0.00 C ATOM 891 CG GLN C 58 20.458 27.616 13.146 1.00 0.00 C ATOM 892 CD GLN C 58 19.649 28.393 14.176 1.00 0.00 C ATOM 893 OE1 GLN C 58 19.681 29.623 14.199 1.00 0.00 O ATOM 894 NE2 GLN C 58 18.932 27.738 15.049 1.00 0.00 N ATOM 0 H GLN C 58 24.104 28.945 12.255 1.00 0.00 H new ATOM 0 HA GLN C 58 22.954 26.520 13.159 1.00 0.00 H new ATOM 0 HB2 GLN C 58 22.156 28.771 13.824 1.00 0.00 H new ATOM 0 HB3 GLN C 58 21.679 29.112 12.172 1.00 0.00 H new ATOM 0 HG2 GLN C 58 19.901 27.545 12.212 1.00 0.00 H new ATOM 0 HG3 GLN C 58 20.625 26.597 13.496 1.00 0.00 H new ATOM 0 HE21 GLN C 58 18.908 26.719 15.027 1.00 0.00 H new ATOM 0 HE22 GLN C 58 18.396 28.246 15.753 1.00 0.00 H new ATOM 903 N GLU C 59 22.424 27.321 10.015 1.00 0.00 N ATOM 904 CA GLU C 59 21.978 26.787 8.738 1.00 0.00 C ATOM 905 C GLU C 59 22.793 25.558 8.353 1.00 0.00 C ATOM 906 O GLU C 59 22.257 24.597 7.810 1.00 0.00 O ATOM 907 CB GLU C 59 22.110 27.850 7.650 1.00 0.00 C ATOM 908 CG GLU C 59 21.061 28.943 7.873 1.00 0.00 C ATOM 909 CD GLU C 59 21.310 30.106 6.919 1.00 0.00 C ATOM 910 OE1 GLU C 59 22.365 30.127 6.306 1.00 0.00 O ATOM 911 OE2 GLU C 59 20.444 30.959 6.817 1.00 0.00 O1- ATOM 0 H GLU C 59 22.826 28.257 9.968 1.00 0.00 H new ATOM 0 HA GLU C 59 20.932 26.497 8.836 1.00 0.00 H new ATOM 0 HB2 GLU C 59 23.110 28.282 7.669 1.00 0.00 H new ATOM 0 HB3 GLU C 59 21.976 27.398 6.667 1.00 0.00 H new ATOM 0 HG2 GLU C 59 20.062 28.538 7.713 1.00 0.00 H new ATOM 0 HG3 GLU C 59 21.102 29.293 8.905 1.00 0.00 H new ATOM 918 N MET C 60 24.092 25.601 8.625 1.00 0.00 N ATOM 919 CA MET C 60 24.965 24.489 8.282 1.00 0.00 C ATOM 920 C MET C 60 24.476 23.208 8.950 1.00 0.00 C ATOM 921 O MET C 60 24.416 22.154 8.317 1.00 0.00 O ATOM 922 CB MET C 60 26.386 24.798 8.751 1.00 0.00 C ATOM 923 CG MET C 60 27.395 24.066 7.868 1.00 0.00 C ATOM 924 SD MET C 60 27.124 22.281 7.978 1.00 0.00 S ATOM 925 CE MET C 60 28.600 21.773 7.061 1.00 0.00 C ATOM 0 H MET C 60 24.559 26.387 9.078 1.00 0.00 H new ATOM 0 HA MET C 60 24.955 24.349 7.201 1.00 0.00 H new ATOM 0 HB2 MET C 60 26.566 25.872 8.711 1.00 0.00 H new ATOM 0 HB3 MET C 60 26.510 24.493 9.790 1.00 0.00 H new ATOM 0 HG2 MET C 60 27.293 24.395 6.834 1.00 0.00 H new ATOM 0 HG3 MET C 60 28.410 24.309 8.182 1.00 0.00 H new ATOM 0 HE1 MET C 60 28.637 20.685 7.005 1.00 0.00 H new ATOM 0 HE2 MET C 60 28.563 22.187 6.054 1.00 0.00 H new ATOM 0 HE3 MET C 60 29.490 22.140 7.572 1.00 0.00 H new ATOM 935 N ILE C 61 24.120 23.309 10.225 1.00 0.00 N ATOM 936 CA ILE C 61 23.628 22.153 10.960 1.00 0.00 C ATOM 937 C ILE C 61 22.254 21.731 10.451 1.00 0.00 C ATOM 938 O ILE C 61 21.974 20.544 10.309 1.00 0.00 O ATOM 939 CB ILE C 61 23.548 22.465 12.447 1.00 0.00 C ATOM 940 CG1 ILE C 61 24.962 22.715 12.970 1.00 0.00 C ATOM 941 CG2 ILE C 61 22.933 21.267 13.176 1.00 0.00 C ATOM 942 CD1 ILE C 61 24.890 23.258 14.391 1.00 0.00 C ATOM 0 H ILE C 61 24.163 24.172 10.767 1.00 0.00 H new ATOM 0 HA ILE C 61 24.328 21.332 10.803 1.00 0.00 H new ATOM 0 HB ILE C 61 22.931 23.347 12.617 1.00 0.00 H new ATOM 0 HG12 ILE C 61 25.537 21.789 12.952 1.00 0.00 H new ATOM 0 HG13 ILE C 61 25.480 23.424 12.324 1.00 0.00 H new ATOM 0 HG21 ILE C 61 22.872 21.482 14.243 1.00 0.00 H new ATOM 0 HG22 ILE C 61 21.933 21.078 12.786 1.00 0.00 H new ATOM 0 HG23 ILE C 61 23.556 20.386 13.019 1.00 0.00 H new ATOM 0 HD11 ILE C 61 25.899 23.436 14.764 1.00 0.00 H new ATOM 0 HD12 ILE C 61 24.331 24.194 14.395 1.00 0.00 H new ATOM 0 HD13 ILE C 61 24.389 22.533 15.033 1.00 0.00 H new ATOM 954 N ASP C 62 21.394 22.719 10.199 1.00 0.00 N ATOM 955 CA ASP C 62 20.035 22.448 9.728 1.00 0.00 C ATOM 956 C ASP C 62 20.053 21.591 8.464 1.00 0.00 C ATOM 957 O ASP C 62 19.123 20.823 8.216 1.00 0.00 O ATOM 958 CB ASP C 62 19.308 23.764 9.439 1.00 0.00 C ATOM 959 CG ASP C 62 19.058 23.902 7.942 1.00 0.00 C ATOM 960 OD1 ASP C 62 19.991 24.239 7.234 1.00 0.00 O ATOM 961 OD2 ASP C 62 17.935 23.663 7.527 1.00 0.00 O1- ATOM 0 H ASP C 62 21.613 23.709 10.312 1.00 0.00 H new ATOM 0 HA ASP C 62 19.510 21.902 10.512 1.00 0.00 H new ATOM 0 HB2 ASP C 62 18.361 23.792 9.979 1.00 0.00 H new ATOM 0 HB3 ASP C 62 19.904 24.604 9.796 1.00 0.00 H new ATOM 966 N GLU C 63 21.109 21.727 7.671 1.00 0.00 N ATOM 967 CA GLU C 63 21.228 20.960 6.435 1.00 0.00 C ATOM 968 C GLU C 63 21.284 19.461 6.725 1.00 0.00 C ATOM 969 O GLU C 63 20.669 18.660 6.018 1.00 0.00 O ATOM 970 CB GLU C 63 22.497 21.380 5.690 1.00 0.00 C ATOM 971 CG GLU C 63 22.307 22.779 5.104 1.00 0.00 C ATOM 972 CD GLU C 63 23.643 23.323 4.613 1.00 0.00 C ATOM 973 OE1 GLU C 63 24.662 22.771 4.997 1.00 0.00 O ATOM 974 OE2 GLU C 63 23.630 24.285 3.864 1.00 0.00 O1- ATOM 0 H GLU C 63 21.890 22.356 7.859 1.00 0.00 H new ATOM 0 HA GLU C 63 20.351 21.163 5.820 1.00 0.00 H new ATOM 0 HB2 GLU C 63 23.349 21.372 6.369 1.00 0.00 H new ATOM 0 HB3 GLU C 63 22.717 20.668 4.894 1.00 0.00 H new ATOM 0 HG2 GLU C 63 21.594 22.744 4.280 1.00 0.00 H new ATOM 0 HG3 GLU C 63 21.889 23.445 5.859 1.00 0.00 H new ATOM 981 N VAL C 64 22.027 19.086 7.760 1.00 0.00 N ATOM 982 CA VAL C 64 22.159 17.678 8.123 1.00 0.00 C ATOM 983 C VAL C 64 21.170 17.284 9.215 1.00 0.00 C ATOM 984 O VAL C 64 20.722 16.139 9.278 1.00 0.00 O ATOM 985 CB VAL C 64 23.584 17.402 8.603 1.00 0.00 C ATOM 986 CG1 VAL C 64 23.907 18.312 9.788 1.00 0.00 C ATOM 987 CG2 VAL C 64 23.701 15.939 9.039 1.00 0.00 C ATOM 0 H VAL C 64 22.544 19.730 8.359 1.00 0.00 H new ATOM 0 HA VAL C 64 21.940 17.082 7.237 1.00 0.00 H new ATOM 0 HB VAL C 64 24.285 17.597 7.791 1.00 0.00 H new ATOM 0 HG11 VAL C 64 24.923 18.116 10.131 1.00 0.00 H new ATOM 0 HG12 VAL C 64 23.823 19.354 9.480 1.00 0.00 H new ATOM 0 HG13 VAL C 64 23.206 18.116 10.599 1.00 0.00 H new ATOM 0 HG21 VAL C 64 24.717 15.741 9.381 1.00 0.00 H new ATOM 0 HG22 VAL C 64 23.000 15.744 9.851 1.00 0.00 H new ATOM 0 HG23 VAL C 64 23.469 15.288 8.196 1.00 0.00 H new ATOM 997 N ASP C 65 20.843 18.231 10.084 1.00 0.00 N ATOM 998 CA ASP C 65 19.924 17.957 11.181 1.00 0.00 C ATOM 999 C ASP C 65 18.518 17.729 10.655 1.00 0.00 C ATOM 1000 O ASP C 65 17.898 18.630 10.088 1.00 0.00 O ATOM 1001 CB ASP C 65 19.916 19.130 12.154 1.00 0.00 C ATOM 1002 CG ASP C 65 19.135 18.771 13.414 1.00 0.00 C ATOM 1003 OD1 ASP C 65 18.453 17.760 13.400 1.00 0.00 O ATOM 1004 OD2 ASP C 65 19.226 19.518 14.375 1.00 0.00 O1- ATOM 0 H ASP C 65 21.196 19.187 10.052 1.00 0.00 H new ATOM 0 HA ASP C 65 20.259 17.056 11.695 1.00 0.00 H new ATOM 0 HB2 ASP C 65 20.939 19.399 12.417 1.00 0.00 H new ATOM 0 HB3 ASP C 65 19.469 20.003 11.678 1.00 0.00 H new ATOM 1009 N GLU C 66 18.023 16.515 10.847 1.00 0.00 N ATOM 1010 CA GLU C 66 16.686 16.160 10.395 1.00 0.00 C ATOM 1011 C GLU C 66 15.634 16.635 11.391 1.00 0.00 C ATOM 1012 O GLU C 66 14.449 16.702 11.066 1.00 0.00 O ATOM 1013 CB GLU C 66 16.583 14.643 10.217 1.00 0.00 C ATOM 1014 CG GLU C 66 16.770 13.950 11.569 1.00 0.00 C ATOM 1015 CD GLU C 66 16.846 12.440 11.373 1.00 0.00 C ATOM 1016 OE1 GLU C 66 15.897 11.883 10.847 1.00 0.00 O ATOM 1017 OE2 GLU C 66 17.853 11.864 11.751 1.00 0.00 O1- ATOM 0 H GLU C 66 18.527 15.760 11.312 1.00 0.00 H new ATOM 0 HA GLU C 66 16.504 16.651 9.439 1.00 0.00 H new ATOM 0 HB2 GLU C 66 15.612 14.382 9.795 1.00 0.00 H new ATOM 0 HB3 GLU C 66 17.340 14.298 9.513 1.00 0.00 H new ATOM 0 HG2 GLU C 66 17.680 14.309 12.049 1.00 0.00 H new ATOM 0 HG3 GLU C 66 15.941 14.198 12.232 1.00 0.00 H new ATOM 1024 N ASP C 67 16.070 16.953 12.607 1.00 0.00 N ATOM 1025 CA ASP C 67 15.137 17.405 13.635 1.00 0.00 C ATOM 1026 C ASP C 67 15.083 18.926 13.678 1.00 0.00 C ATOM 1027 O ASP C 67 14.184 19.506 14.288 1.00 0.00 O ATOM 1028 CB ASP C 67 15.583 16.876 14.999 1.00 0.00 C ATOM 1029 CG ASP C 67 16.140 15.464 14.856 1.00 0.00 C ATOM 1030 OD1 ASP C 67 15.364 14.527 14.956 1.00 0.00 O1- ATOM 1031 OD2 ASP C 67 17.337 15.341 14.647 1.00 0.00 O ATOM 0 H ASP C 67 17.046 16.908 12.902 1.00 0.00 H new ATOM 0 HA ASP C 67 14.144 17.024 13.396 1.00 0.00 H new ATOM 0 HB2 ASP C 67 16.342 17.534 15.422 1.00 0.00 H new ATOM 0 HB3 ASP C 67 14.741 16.875 15.691 1.00 0.00 H new ATOM 1036 N GLY C 68 16.041 19.566 13.021 1.00 0.00 N ATOM 1037 CA GLY C 68 16.082 21.022 12.985 1.00 0.00 C ATOM 1038 C GLY C 68 16.428 21.586 14.358 1.00 0.00 C ATOM 1039 O GLY C 68 16.263 22.780 14.609 1.00 0.00 O ATOM 0 H GLY C 68 16.794 19.105 12.510 1.00 0.00 H new ATOM 0 HA2 GLY C 68 16.821 21.352 12.254 1.00 0.00 H new ATOM 0 HA3 GLY C 68 15.117 21.410 12.660 1.00 0.00 H new ATOM 1043 N SER C 69 16.901 20.718 15.246 1.00 0.00 N ATOM 1044 CA SER C 69 17.257 21.140 16.595 1.00 0.00 C ATOM 1045 C SER C 69 18.417 22.129 16.565 1.00 0.00 C ATOM 1046 O SER C 69 18.629 22.879 17.518 1.00 0.00 O ATOM 1047 CB SER C 69 17.640 19.926 17.442 1.00 0.00 C ATOM 1048 OG SER C 69 18.834 19.350 16.927 1.00 0.00 O ATOM 0 H SER C 69 17.046 19.726 15.058 1.00 0.00 H new ATOM 0 HA SER C 69 16.390 21.631 17.037 1.00 0.00 H new ATOM 0 HB2 SER C 69 17.785 20.224 18.480 1.00 0.00 H new ATOM 0 HB3 SER C 69 16.834 19.192 17.431 1.00 0.00 H new ATOM 0 HG SER C 69 18.714 19.142 15.977 1.00 0.00 H new ATOM 1054 N GLY C 70 19.167 22.127 15.466 1.00 0.00 N ATOM 1055 CA GLY C 70 20.303 23.030 15.330 1.00 0.00 C ATOM 1056 C GLY C 70 21.535 22.458 16.025 1.00 0.00 C ATOM 1057 O GLY C 70 22.564 23.126 16.134 1.00 0.00 O ATOM 0 H GLY C 70 19.010 21.516 14.665 1.00 0.00 H new ATOM 0 HA2 GLY C 70 20.519 23.194 14.274 1.00 0.00 H new ATOM 0 HA3 GLY C 70 20.055 24.001 15.759 1.00 0.00 H new ATOM 1061 N THR C 71 21.418 21.218 16.493 1.00 0.00 N ATOM 1062 CA THR C 71 22.523 20.558 17.180 1.00 0.00 C ATOM 1063 C THR C 71 22.770 19.172 16.591 1.00 0.00 C ATOM 1064 O THR C 71 21.894 18.594 15.942 1.00 0.00 O ATOM 1065 CB THR C 71 22.209 20.428 18.672 1.00 0.00 C ATOM 1066 OG1 THR C 71 21.062 19.607 18.841 1.00 0.00 O ATOM 1067 CG2 THR C 71 21.937 21.812 19.261 1.00 0.00 C ATOM 0 H THR C 71 20.573 20.653 16.409 1.00 0.00 H new ATOM 0 HA THR C 71 23.420 21.164 17.048 1.00 0.00 H new ATOM 0 HB THR C 71 23.059 19.978 19.185 1.00 0.00 H new ATOM 0 HG1 THR C 71 20.546 19.591 18.008 1.00 0.00 H new ATOM 0 HG21 THR C 71 21.714 21.718 20.324 1.00 0.00 H new ATOM 0 HG22 THR C 71 22.816 22.443 19.130 1.00 0.00 H new ATOM 0 HG23 THR C 71 21.087 22.264 18.750 1.00 0.00 H new ATOM 1075 N VAL C 72 23.967 18.646 16.833 1.00 0.00 N ATOM 1076 CA VAL C 72 24.339 17.324 16.336 1.00 0.00 C ATOM 1077 C VAL C 72 24.736 16.406 17.491 1.00 0.00 C ATOM 1078 O VAL C 72 25.641 16.717 18.267 1.00 0.00 O ATOM 1079 CB VAL C 72 25.499 17.455 15.344 1.00 0.00 C ATOM 1080 CG1 VAL C 72 26.042 16.073 14.995 1.00 0.00 C ATOM 1081 CG2 VAL C 72 25.000 18.132 14.066 1.00 0.00 C ATOM 0 H VAL C 72 24.697 19.115 17.370 1.00 0.00 H new ATOM 0 HA VAL C 72 23.479 16.884 15.830 1.00 0.00 H new ATOM 0 HB VAL C 72 26.290 18.052 15.797 1.00 0.00 H new ATOM 0 HG11 VAL C 72 26.867 16.174 14.289 1.00 0.00 H new ATOM 0 HG12 VAL C 72 26.398 15.582 15.901 1.00 0.00 H new ATOM 0 HG13 VAL C 72 25.250 15.474 14.545 1.00 0.00 H new ATOM 0 HG21 VAL C 72 25.824 18.226 13.359 1.00 0.00 H new ATOM 0 HG22 VAL C 72 24.207 17.531 13.621 1.00 0.00 H new ATOM 0 HG23 VAL C 72 24.613 19.122 14.306 1.00 0.00 H new ATOM 1091 N ASP C 73 24.045 15.270 17.595 1.00 0.00 N ATOM 1092 CA ASP C 73 24.318 14.301 18.653 1.00 0.00 C ATOM 1093 C ASP C 73 25.362 13.284 18.197 1.00 0.00 C ATOM 1094 O ASP C 73 25.971 13.443 17.142 1.00 0.00 O ATOM 1095 CB ASP C 73 23.024 13.584 19.063 1.00 0.00 C ATOM 1096 CG ASP C 73 22.515 12.693 17.934 1.00 0.00 C ATOM 1097 OD1 ASP C 73 23.241 12.504 16.980 1.00 0.00 O ATOM 1098 OD2 ASP C 73 21.399 12.213 18.042 1.00 0.00 O1- ATOM 0 H ASP C 73 23.294 15.000 16.960 1.00 0.00 H new ATOM 0 HA ASP C 73 24.713 14.837 19.516 1.00 0.00 H new ATOM 0 HB2 ASP C 73 23.203 12.982 19.954 1.00 0.00 H new ATOM 0 HB3 ASP C 73 22.263 14.319 19.323 1.00 0.00 H new ATOM 1103 N PHE C 74 25.565 12.245 19.000 1.00 0.00 N ATOM 1104 CA PHE C 74 26.547 11.217 18.668 1.00 0.00 C ATOM 1105 C PHE C 74 26.212 10.545 17.332 1.00 0.00 C ATOM 1106 O PHE C 74 27.076 10.400 16.469 1.00 0.00 O ATOM 1107 CB PHE C 74 26.559 10.157 19.772 1.00 0.00 C ATOM 1108 CG PHE C 74 27.683 9.182 19.520 1.00 0.00 C ATOM 1109 CD1 PHE C 74 28.952 9.451 20.039 1.00 0.00 C ATOM 1110 CD2 PHE C 74 27.463 8.022 18.769 1.00 0.00 C ATOM 1111 CE1 PHE C 74 30.005 8.561 19.810 1.00 0.00 C ATOM 1112 CE2 PHE C 74 28.517 7.129 18.540 1.00 0.00 C ATOM 1113 CZ PHE C 74 29.789 7.399 19.062 1.00 0.00 C ATOM 0 H PHE C 74 25.068 12.092 19.878 1.00 0.00 H new ATOM 0 HA PHE C 74 27.525 11.690 18.583 1.00 0.00 H new ATOM 0 HB2 PHE C 74 26.686 10.631 20.745 1.00 0.00 H new ATOM 0 HB3 PHE C 74 25.605 9.630 19.796 1.00 0.00 H new ATOM 0 HD1 PHE C 74 29.119 10.347 20.618 1.00 0.00 H new ATOM 0 HD2 PHE C 74 26.482 7.816 18.367 1.00 0.00 H new ATOM 0 HE1 PHE C 74 30.986 8.771 20.211 1.00 0.00 H new ATOM 0 HE2 PHE C 74 28.350 6.233 17.961 1.00 0.00 H new ATOM 0 HZ PHE C 74 30.602 6.710 18.887 1.00 0.00 H new ATOM 1123 N ASP C 75 24.957 10.129 17.171 1.00 0.00 N ATOM 1124 CA ASP C 75 24.533 9.466 15.937 1.00 0.00 C ATOM 1125 C ASP C 75 24.592 10.414 14.743 1.00 0.00 C ATOM 1126 O ASP C 75 25.268 10.131 13.756 1.00 0.00 O ATOM 1127 CB ASP C 75 23.099 8.953 16.094 1.00 0.00 C ATOM 1128 CG ASP C 75 23.080 7.649 16.886 1.00 0.00 C ATOM 1129 OD1 ASP C 75 24.019 6.881 16.754 1.00 0.00 O ATOM 1130 OD2 ASP C 75 22.128 7.440 17.619 1.00 0.00 O1- ATOM 0 H ASP C 75 24.222 10.237 17.870 1.00 0.00 H new ATOM 0 HA ASP C 75 25.216 8.636 15.754 1.00 0.00 H new ATOM 0 HB2 ASP C 75 22.492 9.703 16.602 1.00 0.00 H new ATOM 0 HB3 ASP C 75 22.654 8.795 15.112 1.00 0.00 H new ATOM 1135 N GLU C 76 23.897 11.545 14.851 1.00 0.00 N ATOM 1136 CA GLU C 76 23.877 12.527 13.773 1.00 0.00 C ATOM 1137 C GLU C 76 25.301 12.872 13.363 1.00 0.00 C ATOM 1138 O GLU C 76 25.567 13.204 12.210 1.00 0.00 O ATOM 1139 CB GLU C 76 23.140 13.797 14.225 1.00 0.00 C ATOM 1140 CG GLU C 76 21.626 13.571 14.213 1.00 0.00 C ATOM 1141 CD GLU C 76 20.912 14.858 14.629 1.00 0.00 C ATOM 1142 OE1 GLU C 76 21.462 15.920 14.392 1.00 0.00 O ATOM 1143 OE2 GLU C 76 19.829 14.759 15.184 1.00 0.00 O1- ATOM 0 H GLU C 76 23.344 11.801 15.669 1.00 0.00 H new ATOM 0 HA GLU C 76 23.351 12.102 12.918 1.00 0.00 H new ATOM 0 HB2 GLU C 76 23.464 14.075 15.228 1.00 0.00 H new ATOM 0 HB3 GLU C 76 23.395 14.627 13.566 1.00 0.00 H new ATOM 0 HG2 GLU C 76 21.301 13.268 13.217 1.00 0.00 H new ATOM 0 HG3 GLU C 76 21.364 12.761 14.894 1.00 0.00 H new ATOM 1150 N PHE C 77 26.230 12.786 14.295 1.00 0.00 N ATOM 1151 CA PHE C 77 27.612 13.071 13.964 1.00 0.00 C ATOM 1152 C PHE C 77 28.169 11.962 13.067 1.00 0.00 C ATOM 1153 O PHE C 77 28.871 12.226 12.086 1.00 0.00 O ATOM 1154 CB PHE C 77 28.445 13.160 15.238 1.00 0.00 C ATOM 1155 CG PHE C 77 29.798 13.741 14.918 1.00 0.00 C ATOM 1156 CD1 PHE C 77 30.798 12.931 14.375 1.00 0.00 C ATOM 1157 CD2 PHE C 77 30.050 15.095 15.171 1.00 0.00 C ATOM 1158 CE1 PHE C 77 32.052 13.473 14.081 1.00 0.00 C ATOM 1159 CE2 PHE C 77 31.305 15.638 14.879 1.00 0.00 C ATOM 1160 CZ PHE C 77 32.308 14.826 14.337 1.00 0.00 C ATOM 0 H PHE C 77 26.059 12.527 15.267 1.00 0.00 H new ATOM 0 HA PHE C 77 27.660 14.023 13.436 1.00 0.00 H new ATOM 0 HB2 PHE C 77 27.936 13.782 15.975 1.00 0.00 H new ATOM 0 HB3 PHE C 77 28.558 12.170 15.680 1.00 0.00 H new ATOM 0 HD1 PHE C 77 30.602 11.886 14.182 1.00 0.00 H new ATOM 0 HD2 PHE C 77 29.276 15.719 15.591 1.00 0.00 H new ATOM 0 HE1 PHE C 77 32.824 12.848 13.656 1.00 0.00 H new ATOM 0 HE2 PHE C 77 31.500 16.683 15.071 1.00 0.00 H new ATOM 0 HZ PHE C 77 33.280 15.243 14.116 1.00 0.00 H new ATOM 1170 N LEU C 78 27.861 10.714 13.427 1.00 0.00 N ATOM 1171 CA LEU C 78 28.352 9.565 12.666 1.00 0.00 C ATOM 1172 C LEU C 78 27.770 9.548 11.255 1.00 0.00 C ATOM 1173 O LEU C 78 28.485 9.300 10.282 1.00 0.00 O ATOM 1174 CB LEU C 78 27.969 8.261 13.377 1.00 0.00 C ATOM 1175 CG LEU C 78 28.642 7.065 12.683 1.00 0.00 C ATOM 1176 CD1 LEU C 78 30.168 7.144 12.850 1.00 0.00 C ATOM 1177 CD2 LEU C 78 28.126 5.766 13.306 1.00 0.00 C ATOM 0 H LEU C 78 27.281 10.475 14.231 1.00 0.00 H new ATOM 0 HA LEU C 78 29.437 9.650 12.599 1.00 0.00 H new ATOM 0 HB2 LEU C 78 28.274 8.304 14.422 1.00 0.00 H new ATOM 0 HB3 LEU C 78 26.886 8.136 13.366 1.00 0.00 H new ATOM 0 HG LEU C 78 28.402 7.087 11.620 1.00 0.00 H new ATOM 0 HD11 LEU C 78 30.633 6.292 12.354 1.00 0.00 H new ATOM 0 HD12 LEU C 78 30.535 8.068 12.404 1.00 0.00 H new ATOM 0 HD13 LEU C 78 30.419 7.128 13.911 1.00 0.00 H new ATOM 0 HD21 LEU C 78 28.600 4.915 12.817 1.00 0.00 H new ATOM 0 HD22 LEU C 78 28.364 5.753 14.370 1.00 0.00 H new ATOM 0 HD23 LEU C 78 27.046 5.704 13.175 1.00 0.00 H new ATOM 1189 N VAL C 79 26.464 9.787 11.152 1.00 0.00 N ATOM 1190 CA VAL C 79 25.802 9.770 9.865 1.00 0.00 C ATOM 1191 C VAL C 79 26.296 10.922 9.003 1.00 0.00 C ATOM 1192 O VAL C 79 26.297 10.837 7.778 1.00 0.00 O ATOM 1193 CB VAL C 79 24.282 9.881 10.056 1.00 0.00 C ATOM 1194 CG1 VAL C 79 23.837 9.146 11.324 1.00 0.00 C ATOM 1195 CG2 VAL C 79 23.878 11.347 10.147 1.00 0.00 C ATOM 0 H VAL C 79 25.854 9.993 11.943 1.00 0.00 H new ATOM 0 HA VAL C 79 26.034 8.829 9.365 1.00 0.00 H new ATOM 0 HB VAL C 79 23.794 9.420 9.198 1.00 0.00 H new ATOM 0 HG11 VAL C 79 22.757 9.239 11.438 1.00 0.00 H new ATOM 0 HG12 VAL C 79 24.105 8.092 11.247 1.00 0.00 H new ATOM 0 HG13 VAL C 79 24.332 9.583 12.191 1.00 0.00 H new ATOM 0 HG21 VAL C 79 22.799 11.419 10.282 1.00 0.00 H new ATOM 0 HG22 VAL C 79 24.382 11.811 10.995 1.00 0.00 H new ATOM 0 HG23 VAL C 79 24.164 11.861 9.229 1.00 0.00 H new ATOM 1205 N MET C 80 26.728 11.997 9.649 1.00 0.00 N ATOM 1206 CA MET C 80 27.226 13.156 8.927 1.00 0.00 C ATOM 1207 C MET C 80 28.522 12.799 8.227 1.00 0.00 C ATOM 1208 O MET C 80 28.756 13.188 7.082 1.00 0.00 O ATOM 1209 CB MET C 80 27.465 14.317 9.897 1.00 0.00 C ATOM 1210 CG MET C 80 27.757 15.604 9.118 1.00 0.00 C ATOM 1211 SD MET C 80 28.851 16.667 10.092 1.00 0.00 S ATOM 1212 CE MET C 80 30.410 15.924 9.552 1.00 0.00 C ATOM 0 H MET C 80 26.743 12.089 10.665 1.00 0.00 H new ATOM 0 HA MET C 80 26.486 13.460 8.187 1.00 0.00 H new ATOM 0 HB2 MET C 80 26.589 14.457 10.531 1.00 0.00 H new ATOM 0 HB3 MET C 80 28.301 14.084 10.556 1.00 0.00 H new ATOM 0 HG2 MET C 80 28.222 15.365 8.162 1.00 0.00 H new ATOM 0 HG3 MET C 80 26.826 16.127 8.898 1.00 0.00 H new ATOM 0 HE1 MET C 80 31.243 16.433 10.037 1.00 0.00 H new ATOM 0 HE2 MET C 80 30.423 14.868 9.822 1.00 0.00 H new ATOM 0 HE3 MET C 80 30.505 16.023 8.471 1.00 0.00 H new ATOM 1222 N MET C 81 29.360 12.051 8.928 1.00 0.00 N ATOM 1223 CA MET C 81 30.640 11.641 8.365 1.00 0.00 C ATOM 1224 C MET C 81 30.439 10.754 7.145 1.00 0.00 C ATOM 1225 O MET C 81 31.113 10.923 6.129 1.00 0.00 O ATOM 1226 CB MET C 81 31.446 10.886 9.419 1.00 0.00 C ATOM 1227 CG MET C 81 31.948 11.865 10.485 1.00 0.00 C ATOM 1228 SD MET C 81 33.244 12.930 9.790 1.00 0.00 S ATOM 1229 CE MET C 81 34.635 11.774 9.929 1.00 0.00 C ATOM 0 H MET C 81 29.182 11.718 9.876 1.00 0.00 H new ATOM 0 HA MET C 81 31.182 12.535 8.056 1.00 0.00 H new ATOM 0 HB2 MET C 81 30.828 10.116 9.881 1.00 0.00 H new ATOM 0 HB3 MET C 81 32.290 10.379 8.951 1.00 0.00 H new ATOM 0 HG2 MET C 81 31.121 12.475 10.849 1.00 0.00 H new ATOM 0 HG3 MET C 81 32.338 11.315 11.341 1.00 0.00 H new ATOM 0 HE1 MET C 81 35.304 12.104 10.724 1.00 0.00 H new ATOM 0 HE2 MET C 81 34.258 10.778 10.161 1.00 0.00 H new ATOM 0 HE3 MET C 81 35.180 11.745 8.985 1.00 0.00 H new ATOM 1239 N VAL C 82 29.511 9.811 7.247 1.00 0.00 N ATOM 1240 CA VAL C 82 29.241 8.905 6.140 1.00 0.00 C ATOM 1241 C VAL C 82 28.634 9.666 4.966 1.00 0.00 C ATOM 1242 O VAL C 82 28.987 9.426 3.810 1.00 0.00 O ATOM 1243 CB VAL C 82 28.295 7.797 6.590 1.00 0.00 C ATOM 1244 CG1 VAL C 82 27.935 6.914 5.392 1.00 0.00 C ATOM 1245 CG2 VAL C 82 28.981 6.954 7.668 1.00 0.00 C ATOM 0 H VAL C 82 28.938 9.655 8.076 1.00 0.00 H new ATOM 0 HA VAL C 82 30.182 8.459 5.817 1.00 0.00 H new ATOM 0 HB VAL C 82 27.384 8.235 6.998 1.00 0.00 H new ATOM 0 HG11 VAL C 82 27.259 6.122 5.714 1.00 0.00 H new ATOM 0 HG12 VAL C 82 27.447 7.519 4.628 1.00 0.00 H new ATOM 0 HG13 VAL C 82 28.842 6.471 4.981 1.00 0.00 H new ATOM 0 HG21 VAL C 82 28.308 6.161 7.993 1.00 0.00 H new ATOM 0 HG22 VAL C 82 29.891 6.514 7.261 1.00 0.00 H new ATOM 0 HG23 VAL C 82 29.233 7.587 8.519 1.00 0.00 H new ATOM 1255 N ARG C 83 27.717 10.584 5.268 1.00 0.00 N ATOM 1256 CA ARG C 83 27.071 11.368 4.222 1.00 0.00 C ATOM 1257 C ARG C 83 28.084 12.184 3.429 1.00 0.00 C ATOM 1258 O ARG C 83 28.002 12.259 2.203 1.00 0.00 O ATOM 1259 CB ARG C 83 26.037 12.317 4.828 1.00 0.00 C ATOM 1260 CG ARG C 83 24.762 11.548 5.172 1.00 0.00 C ATOM 1261 CD ARG C 83 23.759 12.498 5.824 1.00 0.00 C ATOM 1262 NE ARG C 83 23.425 13.582 4.904 1.00 0.00 N ATOM 1263 CZ ARG C 83 22.660 14.598 5.285 1.00 0.00 C ATOM 1264 NH1 ARG C 83 22.172 14.628 6.494 1.00 0.00 N ATOM 1265 NH2 ARG C 83 22.394 15.565 4.450 1.00 0.00 N1+ ATOM 0 H ARG C 83 27.409 10.800 6.216 1.00 0.00 H new ATOM 0 HA ARG C 83 26.581 10.665 3.548 1.00 0.00 H new ATOM 0 HB2 ARG C 83 26.442 12.785 5.725 1.00 0.00 H new ATOM 0 HB3 ARG C 83 25.810 13.118 4.125 1.00 0.00 H new ATOM 0 HG2 ARG C 83 24.333 11.111 4.270 1.00 0.00 H new ATOM 0 HG3 ARG C 83 24.992 10.724 5.848 1.00 0.00 H new ATOM 0 HD2 ARG C 83 22.856 11.953 6.100 1.00 0.00 H new ATOM 0 HD3 ARG C 83 24.178 12.907 6.744 1.00 0.00 H new ATOM 0 HE ARG C 83 23.786 13.558 3.950 1.00 0.00 H new ATOM 0 HH11 ARG C 83 22.378 13.871 7.146 1.00 0.00 H new ATOM 0 HH12 ARG C 83 21.584 15.408 6.787 1.00 0.00 H new ATOM 0 HH21 ARG C 83 22.774 15.541 3.504 1.00 0.00 H new ATOM 0 HH22 ARG C 83 21.806 16.345 4.744 1.00 0.00 H new ATOM 1279 N CYS C 84 29.031 12.805 4.123 1.00 0.00 N ATOM 1280 CA CYS C 84 30.032 13.620 3.444 1.00 0.00 C ATOM 1281 C CYS C 84 30.940 12.746 2.586 1.00 0.00 C ATOM 1282 O CYS C 84 31.314 13.126 1.475 1.00 0.00 O ATOM 1283 CB CYS C 84 30.871 14.377 4.476 1.00 0.00 C ATOM 1284 SG CYS C 84 32.099 13.255 5.188 1.00 0.00 S ATOM 0 H CYS C 84 29.127 12.762 5.138 1.00 0.00 H new ATOM 0 HA CYS C 84 29.520 14.333 2.798 1.00 0.00 H new ATOM 0 HB2 CYS C 84 31.367 15.226 4.006 1.00 0.00 H new ATOM 0 HB3 CYS C 84 30.229 14.777 5.261 1.00 0.00 H new ATOM 0 HG CYS C 84 31.519 12.148 5.547 1.00 0.00 H new ATOM 1290 N MET C 85 31.281 11.568 3.099 1.00 0.00 N ATOM 1291 CA MET C 85 32.135 10.649 2.359 1.00 0.00 C ATOM 1292 C MET C 85 31.431 10.154 1.099 1.00 0.00 C ATOM 1293 O MET C 85 32.046 10.043 0.038 1.00 0.00 O ATOM 1294 CB MET C 85 32.513 9.455 3.240 1.00 0.00 C ATOM 1295 CG MET C 85 33.474 9.919 4.337 1.00 0.00 C ATOM 1296 SD MET C 85 33.745 8.577 5.524 1.00 0.00 S ATOM 1297 CE MET C 85 34.729 7.498 4.455 1.00 0.00 C ATOM 0 H MET C 85 30.982 11.231 4.014 1.00 0.00 H new ATOM 0 HA MET C 85 33.039 11.183 2.068 1.00 0.00 H new ATOM 0 HB2 MET C 85 31.618 9.019 3.685 1.00 0.00 H new ATOM 0 HB3 MET C 85 32.980 8.677 2.637 1.00 0.00 H new ATOM 0 HG2 MET C 85 34.423 10.224 3.896 1.00 0.00 H new ATOM 0 HG3 MET C 85 33.064 10.791 4.847 1.00 0.00 H new ATOM 0 HE1 MET C 85 35.281 6.784 5.067 1.00 0.00 H new ATOM 0 HE2 MET C 85 34.069 6.959 3.775 1.00 0.00 H new ATOM 0 HE3 MET C 85 35.431 8.100 3.878 1.00 0.00 H new ATOM 1307 N LYS C 86 30.142 9.851 1.224 1.00 0.00 N ATOM 1308 CA LYS C 86 29.377 9.362 0.083 1.00 0.00 C ATOM 1309 C LYS C 86 29.046 10.487 -0.892 1.00 0.00 C ATOM 1310 O LYS C 86 29.275 10.364 -2.096 1.00 0.00 O ATOM 1311 CB LYS C 86 28.075 8.725 0.560 1.00 0.00 C ATOM 1312 CG LYS C 86 28.381 7.397 1.256 1.00 0.00 C ATOM 1313 CD LYS C 86 27.094 6.780 1.820 1.00 0.00 C ATOM 1314 CE LYS C 86 26.199 6.277 0.679 1.00 0.00 C ATOM 1315 NZ LYS C 86 25.106 5.429 1.240 1.00 0.00 N1+ ATOM 0 H LYS C 86 29.612 9.934 2.091 1.00 0.00 H new ATOM 0 HA LYS C 86 29.992 8.623 -0.431 1.00 0.00 H new ATOM 0 HB2 LYS C 86 27.559 9.397 1.246 1.00 0.00 H new ATOM 0 HB3 LYS C 86 27.408 8.559 -0.286 1.00 0.00 H new ATOM 0 HG2 LYS C 86 28.844 6.707 0.550 1.00 0.00 H new ATOM 0 HG3 LYS C 86 29.098 7.558 2.061 1.00 0.00 H new ATOM 0 HD2 LYS C 86 27.341 5.955 2.488 1.00 0.00 H new ATOM 0 HD3 LYS C 86 26.557 7.521 2.413 1.00 0.00 H new ATOM 0 HE2 LYS C 86 25.776 7.122 0.135 1.00 0.00 H new ATOM 0 HE3 LYS C 86 26.790 5.702 -0.034 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 24.865 4.679 0.561 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 25.423 4.999 2.132 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 24.267 6.017 1.418 1.00 0.00 H new ATOM 1329 N ASP C 87 28.502 11.581 -0.367 1.00 0.00 N ATOM 1330 CA ASP C 87 28.140 12.712 -1.207 1.00 0.00 C ATOM 1331 C ASP C 87 29.388 13.434 -1.690 1.00 0.00 C ATOM 1332 O ASP C 87 30.317 13.665 -0.917 1.00 0.00 O ATOM 1333 CB ASP C 87 27.246 13.680 -0.428 1.00 0.00 C ATOM 1334 CG ASP C 87 25.860 13.073 -0.231 1.00 0.00 C ATOM 1335 OD1 ASP C 87 25.573 12.076 -0.874 1.00 0.00 O ATOM 1336 OD2 ASP C 87 25.106 13.614 0.561 1.00 0.00 O1- ATOM 0 H ASP C 87 28.305 11.706 0.626 1.00 0.00 H new ATOM 0 HA ASP C 87 27.593 12.340 -2.073 1.00 0.00 H new ATOM 0 HB2 ASP C 87 27.695 13.902 0.540 1.00 0.00 H new ATOM 0 HB3 ASP C 87 27.164 14.625 -0.966 1.00 0.00 H new ATOM 1341 N ASP C 88 29.401 13.793 -2.970 1.00 0.00 N ATOM 1342 CA ASP C 88 30.538 14.497 -3.549 1.00 0.00 C ATOM 1343 C ASP C 88 30.079 15.783 -4.226 1.00 0.00 C ATOM 1344 O ASP C 88 30.039 15.868 -5.453 1.00 0.00 O ATOM 1345 CB ASP C 88 31.242 13.602 -4.570 1.00 0.00 C ATOM 1346 CG ASP C 88 32.502 14.288 -5.081 1.00 0.00 C ATOM 1347 OD1 ASP C 88 32.670 15.464 -4.798 1.00 0.00 O ATOM 1348 OD2 ASP C 88 33.284 13.629 -5.747 1.00 0.00 O1- ATOM 0 H ASP C 88 28.640 13.608 -3.623 1.00 0.00 H new ATOM 0 HA ASP C 88 31.234 14.749 -2.749 1.00 0.00 H new ATOM 0 HB2 ASP C 88 31.498 12.646 -4.113 1.00 0.00 H new ATOM 0 HB3 ASP C 88 30.571 13.388 -5.402 1.00 0.00 H new ATOM 1353 N SER C 89 29.735 16.778 -3.416 1.00 0.00 N ATOM 1354 CA SER C 89 29.279 18.063 -3.940 1.00 0.00 C ATOM 1355 C SER C 89 30.189 19.189 -3.459 1.00 0.00 C ATOM 1356 O SER C 89 31.306 18.895 -3.068 1.00 0.00 O ATOM 1357 CB SER C 89 27.844 18.338 -3.484 1.00 0.00 C ATOM 1358 OG SER C 89 27.857 18.786 -2.135 1.00 0.00 O ATOM 1359 OXT SER C 89 29.755 20.329 -3.489 1.00 0.00 O ATOM 0 H SER C 89 29.762 16.722 -2.398 1.00 0.00 H new ATOM 0 HA SER C 89 29.311 18.020 -5.029 1.00 0.00 H new ATOM 0 HB2 SER C 89 27.385 19.091 -4.125 1.00 0.00 H new ATOM 0 HB3 SER C 89 27.242 17.433 -3.573 1.00 0.00 H new ATOM 0 HG SER C 89 26.939 18.965 -1.841 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 144 41.584 29.785 0.108 1.00 0.00 N ATOM 1367 CA ARG I 144 40.296 29.940 -0.627 1.00 0.00 C ATOM 1368 C ARG I 144 40.309 29.057 -1.870 1.00 0.00 C ATOM 1369 O ARG I 144 39.309 28.420 -2.201 1.00 0.00 O ATOM 1370 CB ARG I 144 40.115 31.404 -1.037 1.00 0.00 C ATOM 1371 CG ARG I 144 39.606 32.213 0.157 1.00 0.00 C ATOM 1372 CD ARG I 144 39.390 33.668 -0.268 1.00 0.00 C ATOM 1373 NE ARG I 144 40.669 34.318 -0.525 1.00 0.00 N ATOM 1374 CZ ARG I 144 40.726 35.556 -1.003 1.00 0.00 C ATOM 1375 NH1 ARG I 144 39.625 36.213 -1.245 1.00 0.00 N ATOM 1376 NH2 ARG I 144 41.883 36.116 -1.231 1.00 0.00 N1+ ATOM 0 HA ARG I 144 39.470 29.641 0.019 1.00 0.00 H new ATOM 0 HB2 ARG I 144 41.062 31.813 -1.389 1.00 0.00 H new ATOM 0 HB3 ARG I 144 39.409 31.476 -1.865 1.00 0.00 H new ATOM 0 HG2 ARG I 144 38.673 31.788 0.526 1.00 0.00 H new ATOM 0 HG3 ARG I 144 40.324 32.165 0.976 1.00 0.00 H new ATOM 0 HD2 ARG I 144 38.770 33.704 -1.164 1.00 0.00 H new ATOM 0 HD3 ARG I 144 38.852 34.206 0.513 1.00 0.00 H new ATOM 0 HE ARG I 144 41.535 33.814 -0.335 1.00 0.00 H new ATOM 0 HH11 ARG I 144 38.721 35.776 -1.067 1.00 0.00 H new ATOM 0 HH12 ARG I 144 39.669 37.164 -1.612 1.00 0.00 H new ATOM 0 HH21 ARG I 144 42.744 35.603 -1.042 1.00 0.00 H new ATOM 0 HH22 ARG I 144 41.926 37.067 -1.598 1.00 0.00 H new ATOM 1392 N ARG I 145 41.444 29.032 -2.558 1.00 0.00 N ATOM 1393 CA ARG I 145 41.573 28.232 -3.770 1.00 0.00 C ATOM 1394 C ARG I 145 41.363 26.754 -3.450 1.00 0.00 C ATOM 1395 O ARG I 145 40.740 26.025 -4.220 1.00 0.00 O ATOM 1396 CB ARG I 145 42.958 28.437 -4.387 1.00 0.00 C ATOM 1397 CG ARG I 145 42.971 27.875 -5.811 1.00 0.00 C ATOM 1398 CD ARG I 145 44.352 28.096 -6.433 1.00 0.00 C ATOM 1399 NE ARG I 145 44.327 27.756 -7.851 1.00 0.00 N ATOM 1400 CZ ARG I 145 43.966 28.652 -8.768 1.00 0.00 C ATOM 1401 NH1 ARG I 145 43.630 29.860 -8.405 1.00 0.00 N ATOM 1402 NH2 ARG I 145 43.948 28.325 -10.031 1.00 0.00 N1+ ATOM 0 H ARG I 145 42.283 29.552 -2.300 1.00 0.00 H new ATOM 0 HA ARG I 145 40.813 28.551 -4.483 1.00 0.00 H new ATOM 0 HB2 ARG I 145 43.208 29.498 -4.401 1.00 0.00 H new ATOM 0 HB3 ARG I 145 43.715 27.939 -3.781 1.00 0.00 H new ATOM 0 HG2 ARG I 145 42.733 26.811 -5.796 1.00 0.00 H new ATOM 0 HG3 ARG I 145 42.206 28.364 -6.414 1.00 0.00 H new ATOM 0 HD2 ARG I 145 44.654 29.136 -6.306 1.00 0.00 H new ATOM 0 HD3 ARG I 145 45.093 27.484 -5.918 1.00 0.00 H new ATOM 0 HE ARG I 145 44.591 26.816 -8.146 1.00 0.00 H new ATOM 0 HH11 ARG I 145 43.644 30.118 -7.418 1.00 0.00 H new ATOM 0 HH12 ARG I 145 43.354 30.545 -9.108 1.00 0.00 H new ATOM 0 HH21 ARG I 145 44.211 27.382 -10.317 1.00 0.00 H new ATOM 0 HH22 ARG I 145 43.671 29.012 -10.732 1.00 0.00 H new ATOM 1416 N VAL I 146 41.889 26.322 -2.306 1.00 0.00 N ATOM 1417 CA VAL I 146 41.755 24.928 -1.892 1.00 0.00 C ATOM 1418 C VAL I 146 40.372 24.677 -1.295 1.00 0.00 C ATOM 1419 O VAL I 146 39.949 25.368 -0.368 1.00 0.00 O ATOM 1420 CB VAL I 146 42.826 24.587 -0.853 1.00 0.00 C ATOM 1421 CG1 VAL I 146 42.634 23.148 -0.373 1.00 0.00 C ATOM 1422 CG2 VAL I 146 44.212 24.734 -1.483 1.00 0.00 C ATOM 0 H VAL I 146 42.407 26.911 -1.655 1.00 0.00 H new ATOM 0 HA VAL I 146 41.882 24.294 -2.770 1.00 0.00 H new ATOM 0 HB VAL I 146 42.738 25.266 -0.005 1.00 0.00 H new ATOM 0 HG11 VAL I 146 43.397 22.906 0.367 1.00 0.00 H new ATOM 0 HG12 VAL I 146 41.647 23.043 0.077 1.00 0.00 H new ATOM 0 HG13 VAL I 146 42.721 22.467 -1.220 1.00 0.00 H new ATOM 0 HG21 VAL I 146 44.975 24.491 -0.744 1.00 0.00 H new ATOM 0 HG22 VAL I 146 44.300 24.055 -2.331 1.00 0.00 H new ATOM 0 HG23 VAL I 146 44.350 25.760 -1.823 1.00 0.00 H new ATOM 1432 N ARG I 147 39.675 23.681 -1.835 1.00 0.00 N ATOM 1433 CA ARG I 147 38.341 23.339 -1.352 1.00 0.00 C ATOM 1434 C ARG I 147 38.425 22.610 -0.019 1.00 0.00 C ATOM 1435 O ARG I 147 39.416 21.939 0.272 1.00 0.00 O ATOM 1436 CB ARG I 147 37.622 22.460 -2.373 1.00 0.00 C ATOM 1437 CG ARG I 147 37.301 23.288 -3.618 1.00 0.00 C ATOM 1438 CD ARG I 147 36.651 22.392 -4.672 1.00 0.00 C ATOM 1439 NE ARG I 147 36.301 23.173 -5.851 1.00 0.00 N ATOM 1440 CZ ARG I 147 37.210 23.464 -6.777 1.00 0.00 C ATOM 1441 NH1 ARG I 147 38.440 23.049 -6.637 1.00 0.00 N ATOM 1442 NH2 ARG I 147 36.872 24.164 -7.825 1.00 0.00 N1+ ATOM 0 H ARG I 147 40.010 23.099 -2.603 1.00 0.00 H new ATOM 0 HA ARG I 147 37.780 24.263 -1.213 1.00 0.00 H new ATOM 0 HB2 ARG I 147 38.247 21.608 -2.640 1.00 0.00 H new ATOM 0 HB3 ARG I 147 36.704 22.059 -1.942 1.00 0.00 H new ATOM 0 HG2 ARG I 147 36.631 24.108 -3.360 1.00 0.00 H new ATOM 0 HG3 ARG I 147 38.212 23.734 -4.016 1.00 0.00 H new ATOM 0 HD2 ARG I 147 37.334 21.589 -4.949 1.00 0.00 H new ATOM 0 HD3 ARG I 147 35.758 21.922 -4.260 1.00 0.00 H new ATOM 0 HE ARG I 147 35.343 23.502 -5.968 1.00 0.00 H new ATOM 0 HH11 ARG I 147 38.703 22.502 -5.818 1.00 0.00 H new ATOM 0 HH12 ARG I 147 39.137 23.272 -7.347 1.00 0.00 H new ATOM 0 HH21 ARG I 147 35.911 24.488 -7.934 1.00 0.00 H new ATOM 0 HH22 ARG I 147 37.569 24.387 -8.535 1.00 0.00 H new ATOM 1456 N ILE I 148 37.385 22.750 0.795 1.00 0.00 N ATOM 1457 CA ILE I 148 37.370 22.103 2.103 1.00 0.00 C ATOM 1458 C ILE I 148 37.560 20.600 1.961 1.00 0.00 C ATOM 1459 O ILE I 148 38.622 20.072 2.275 1.00 0.00 O ATOM 1460 CB ILE I 148 36.034 22.380 2.802 1.00 0.00 C ATOM 1461 CG1 ILE I 148 36.010 23.814 3.354 1.00 0.00 C ATOM 1462 CG2 ILE I 148 35.820 21.380 3.940 1.00 0.00 C ATOM 1463 CD1 ILE I 148 36.813 23.930 4.662 1.00 0.00 C ATOM 0 H ILE I 148 36.552 23.297 0.578 1.00 0.00 H new ATOM 0 HA ILE I 148 38.189 22.508 2.697 1.00 0.00 H new ATOM 0 HB ILE I 148 35.230 22.269 2.075 1.00 0.00 H new ATOM 0 HG12 ILE I 148 36.422 24.497 2.611 1.00 0.00 H new ATOM 0 HG13 ILE I 148 34.979 24.119 3.531 1.00 0.00 H new ATOM 0 HG21 ILE I 148 34.868 21.585 4.430 1.00 0.00 H new ATOM 0 HG22 ILE I 148 35.810 20.367 3.537 1.00 0.00 H new ATOM 0 HG23 ILE I 148 36.629 21.474 4.664 1.00 0.00 H new ATOM 0 HD11 ILE I 148 36.774 24.958 5.023 1.00 0.00 H new ATOM 0 HD12 ILE I 148 36.385 23.265 5.412 1.00 0.00 H new ATOM 0 HD13 ILE I 148 37.850 23.649 4.478 1.00 0.00 H new ATOM 1475 N SER I 149 36.538 19.915 1.479 1.00 0.00 N ATOM 1476 CA SER I 149 36.629 18.473 1.303 1.00 0.00 C ATOM 1477 C SER I 149 36.833 17.768 2.644 1.00 0.00 C ATOM 1478 O SER I 149 37.462 18.306 3.563 1.00 0.00 O ATOM 1479 CB SER I 149 37.796 18.141 0.373 1.00 0.00 C ATOM 1480 OG SER I 149 38.965 17.917 1.151 1.00 0.00 O ATOM 0 H SER I 149 35.645 20.326 1.205 1.00 0.00 H new ATOM 0 HA SER I 149 35.694 18.123 0.866 1.00 0.00 H new ATOM 0 HB2 SER I 149 37.564 17.256 -0.220 1.00 0.00 H new ATOM 0 HB3 SER I 149 37.962 18.959 -0.328 1.00 0.00 H new ATOM 0 HG SER I 149 39.244 18.757 1.572 1.00 0.00 H new ATOM 1486 N ALA I 150 36.304 16.556 2.739 1.00 0.00 N ATOM 1487 CA ALA I 150 36.428 15.763 3.955 1.00 0.00 C ATOM 1488 C ALA I 150 37.895 15.462 4.255 1.00 0.00 C ATOM 1489 O ALA I 150 38.300 15.415 5.416 1.00 0.00 O ATOM 1490 CB ALA I 150 35.651 14.451 3.817 1.00 0.00 C ATOM 0 H ALA I 150 35.785 16.100 1.989 1.00 0.00 H new ATOM 0 HA ALA I 150 36.011 16.341 4.780 1.00 0.00 H new ATOM 0 HB1 ALA I 150 35.753 13.870 4.733 1.00 0.00 H new ATOM 0 HB2 ALA I 150 34.598 14.669 3.641 1.00 0.00 H new ATOM 0 HB3 ALA I 150 36.048 13.879 2.978 1.00 0.00 H new ATOM 1496 N ASP I 151 38.679 15.239 3.205 1.00 0.00 N ATOM 1497 CA ASP I 151 40.094 14.921 3.379 1.00 0.00 C ATOM 1498 C ASP I 151 40.799 16.003 4.187 1.00 0.00 C ATOM 1499 O ASP I 151 41.543 15.702 5.120 1.00 0.00 O ATOM 1500 CB ASP I 151 40.766 14.808 2.010 1.00 0.00 C ATOM 1501 CG ASP I 151 40.476 13.448 1.387 1.00 0.00 C ATOM 1502 OD1 ASP I 151 41.248 12.534 1.626 1.00 0.00 O1- ATOM 1503 OD2 ASP I 151 39.491 13.340 0.675 1.00 0.00 O ATOM 0 H ASP I 151 38.365 15.272 2.235 1.00 0.00 H new ATOM 0 HA ASP I 151 40.168 13.975 3.915 1.00 0.00 H new ATOM 0 HB2 ASP I 151 40.405 15.600 1.354 1.00 0.00 H new ATOM 0 HB3 ASP I 151 41.842 14.946 2.114 1.00 0.00 H new ATOM 1508 N ALA I 152 40.559 17.260 3.841 1.00 0.00 N ATOM 1509 CA ALA I 152 41.181 18.361 4.563 1.00 0.00 C ATOM 1510 C ALA I 152 40.718 18.374 6.014 1.00 0.00 C ATOM 1511 O ALA I 152 41.506 18.634 6.927 1.00 0.00 O ATOM 1512 CB ALA I 152 40.833 19.692 3.906 1.00 0.00 C ATOM 0 H ALA I 152 39.946 17.541 3.075 1.00 0.00 H new ATOM 0 HA ALA I 152 42.261 18.220 4.534 1.00 0.00 H new ATOM 0 HB1 ALA I 152 41.306 20.505 4.458 1.00 0.00 H new ATOM 0 HB2 ALA I 152 41.192 19.695 2.877 1.00 0.00 H new ATOM 0 HB3 ALA I 152 39.752 19.829 3.913 1.00 0.00 H new ATOM 1518 N MET I 153 39.432 18.099 6.222 1.00 0.00 N ATOM 1519 CA MET I 153 38.885 18.091 7.576 1.00 0.00 C ATOM 1520 C MET I 153 39.599 17.057 8.440 1.00 0.00 C ATOM 1521 O MET I 153 39.909 17.315 9.604 1.00 0.00 O ATOM 1522 CB MET I 153 37.383 17.771 7.541 1.00 0.00 C ATOM 1523 CG MET I 153 36.555 19.063 7.544 1.00 0.00 C ATOM 1524 SD MET I 153 34.802 18.649 7.729 1.00 0.00 S ATOM 1525 CE MET I 153 34.326 18.876 6.000 1.00 0.00 C ATOM 0 H MET I 153 38.760 17.883 5.485 1.00 0.00 H new ATOM 0 HA MET I 153 39.037 19.081 8.007 1.00 0.00 H new ATOM 0 HB2 MET I 153 37.151 17.186 6.651 1.00 0.00 H new ATOM 0 HB3 MET I 153 37.116 17.159 8.403 1.00 0.00 H new ATOM 0 HG2 MET I 153 36.875 19.712 8.359 1.00 0.00 H new ATOM 0 HG3 MET I 153 36.715 19.613 6.617 1.00 0.00 H new ATOM 0 HE1 MET I 153 33.443 18.275 5.784 1.00 0.00 H new ATOM 0 HE2 MET I 153 34.102 19.927 5.819 1.00 0.00 H new ATOM 0 HE3 MET I 153 35.145 18.563 5.353 1.00 0.00 H new ATOM 1535 N MET I 154 39.864 15.890 7.866 1.00 0.00 N ATOM 1536 CA MET I 154 40.548 14.832 8.599 1.00 0.00 C ATOM 1537 C MET I 154 41.977 15.247 8.931 1.00 0.00 C ATOM 1538 O MET I 154 42.490 14.930 10.004 1.00 0.00 O ATOM 1539 CB MET I 154 40.564 13.546 7.775 1.00 0.00 C ATOM 1540 CG MET I 154 39.138 13.006 7.657 1.00 0.00 C ATOM 1541 SD MET I 154 39.157 11.458 6.720 1.00 0.00 S ATOM 1542 CE MET I 154 37.396 11.076 6.890 1.00 0.00 C ATOM 0 H MET I 154 39.619 15.653 6.905 1.00 0.00 H new ATOM 0 HA MET I 154 40.008 14.656 9.529 1.00 0.00 H new ATOM 0 HB2 MET I 154 40.975 13.740 6.784 1.00 0.00 H new ATOM 0 HB3 MET I 154 41.208 12.805 8.248 1.00 0.00 H new ATOM 0 HG2 MET I 154 38.718 12.839 8.649 1.00 0.00 H new ATOM 0 HG3 MET I 154 38.500 13.737 7.160 1.00 0.00 H new ATOM 0 HE1 MET I 154 37.175 10.140 6.376 1.00 0.00 H new ATOM 0 HE2 MET I 154 37.145 10.978 7.946 1.00 0.00 H new ATOM 0 HE3 MET I 154 36.805 11.879 6.450 1.00 0.00 H new ATOM 1552 N GLN I 155 42.618 15.945 7.995 1.00 0.00 N ATOM 1553 CA GLN I 155 43.995 16.384 8.196 1.00 0.00 C ATOM 1554 C GLN I 155 44.100 17.304 9.407 1.00 0.00 C ATOM 1555 O GLN I 155 45.017 17.171 10.220 1.00 0.00 O ATOM 1556 CB GLN I 155 44.490 17.130 6.953 1.00 0.00 C ATOM 1557 CG GLN I 155 44.692 16.144 5.801 1.00 0.00 C ATOM 1558 CD GLN I 155 44.964 16.904 4.506 1.00 0.00 C ATOM 1559 OE1 GLN I 155 45.179 18.116 4.530 1.00 0.00 O ATOM 1560 NE2 GLN I 155 44.967 16.259 3.372 1.00 0.00 N ATOM 0 H GLN I 155 42.210 16.216 7.100 1.00 0.00 H new ATOM 0 HA GLN I 155 44.611 15.502 8.369 1.00 0.00 H new ATOM 0 HB2 GLN I 155 43.769 17.895 6.666 1.00 0.00 H new ATOM 0 HB3 GLN I 155 45.427 17.642 7.174 1.00 0.00 H new ATOM 0 HG2 GLN I 155 45.526 15.478 6.023 1.00 0.00 H new ATOM 0 HG3 GLN I 155 43.806 15.519 5.687 1.00 0.00 H new ATOM 0 HE21 GLN I 155 44.788 15.255 3.356 1.00 0.00 H new ATOM 0 HE22 GLN I 155 45.148 16.759 2.501 1.00 0.00 H new ATOM 1569 N ALA I 156 43.161 18.233 9.528 1.00 0.00 N ATOM 1570 CA ALA I 156 43.167 19.161 10.653 1.00 0.00 C ATOM 1571 C ALA I 156 42.979 18.412 11.970 1.00 0.00 C ATOM 1572 O ALA I 156 43.626 18.721 12.970 1.00 0.00 O ATOM 1573 CB ALA I 156 42.053 20.195 10.486 1.00 0.00 C ATOM 0 H ALA I 156 42.393 18.364 8.870 1.00 0.00 H new ATOM 0 HA ALA I 156 44.131 19.669 10.673 1.00 0.00 H new ATOM 0 HB1 ALA I 156 42.066 20.883 11.331 1.00 0.00 H new ATOM 0 HB2 ALA I 156 42.209 20.752 9.562 1.00 0.00 H new ATOM 0 HB3 ALA I 156 41.089 19.688 10.446 1.00 0.00 H new ATOM 1579 N LEU I 157 42.083 17.427 11.960 1.00 0.00 N ATOM 1580 CA LEU I 157 41.811 16.643 13.161 1.00 0.00 C ATOM 1581 C LEU I 157 43.041 15.860 13.603 1.00 0.00 C ATOM 1582 O LEU I 157 43.423 15.902 14.774 1.00 0.00 O ATOM 1583 CB LEU I 157 40.661 15.669 12.889 1.00 0.00 C ATOM 1584 CG LEU I 157 39.323 16.332 13.238 1.00 0.00 C ATOM 1585 CD1 LEU I 157 38.206 15.678 12.425 1.00 0.00 C ATOM 1586 CD2 LEU I 157 39.024 16.145 14.732 1.00 0.00 C ATOM 0 H LEU I 157 41.538 17.155 11.142 1.00 0.00 H new ATOM 0 HA LEU I 157 41.538 17.332 13.960 1.00 0.00 H new ATOM 0 HB2 LEU I 157 40.666 15.370 11.841 1.00 0.00 H new ATOM 0 HB3 LEU I 157 40.793 14.763 13.480 1.00 0.00 H new ATOM 0 HG LEU I 157 39.380 17.396 13.006 1.00 0.00 H new ATOM 0 HD11 LEU I 157 37.254 16.148 12.671 1.00 0.00 H new ATOM 0 HD12 LEU I 157 38.408 15.804 11.361 1.00 0.00 H new ATOM 0 HD13 LEU I 157 38.158 14.615 12.662 1.00 0.00 H new ATOM 0 HD21 LEU I 157 38.072 16.618 14.975 1.00 0.00 H new ATOM 0 HD22 LEU I 157 38.969 15.081 14.962 1.00 0.00 H new ATOM 0 HD23 LEU I 157 39.818 16.603 15.322 1.00 0.00 H new ATOM 1598 N LEU I 158 43.654 15.146 12.664 1.00 0.00 N ATOM 1599 CA LEU I 158 44.840 14.354 12.970 1.00 0.00 C ATOM 1600 C LEU I 158 46.065 14.931 12.277 1.00 0.00 C ATOM 1601 O LEU I 158 47.043 15.299 12.928 1.00 0.00 O ATOM 1602 CB LEU I 158 44.632 12.904 12.520 1.00 0.00 C ATOM 1603 CG LEU I 158 44.582 11.986 13.746 1.00 0.00 C ATOM 1604 CD1 LEU I 158 43.391 12.364 14.633 1.00 0.00 C ATOM 1605 CD2 LEU I 158 44.436 10.535 13.287 1.00 0.00 C ATOM 0 H LEU I 158 43.352 15.099 11.691 1.00 0.00 H new ATOM 0 HA LEU I 158 45.001 14.381 14.048 1.00 0.00 H new ATOM 0 HB2 LEU I 158 43.706 12.819 11.951 1.00 0.00 H new ATOM 0 HB3 LEU I 158 45.442 12.599 11.858 1.00 0.00 H new ATOM 0 HG LEU I 158 45.503 12.099 14.318 1.00 0.00 H new ATOM 0 HD11 LEU I 158 43.362 11.707 15.502 1.00 0.00 H new ATOM 0 HD12 LEU I 158 43.496 13.398 14.962 1.00 0.00 H new ATOM 0 HD13 LEU I 158 42.466 12.256 14.066 1.00 0.00 H new ATOM 0 HD21 LEU I 158 44.400 9.880 14.157 1.00 0.00 H new ATOM 0 HD22 LEU I 158 43.516 10.426 12.713 1.00 0.00 H new ATOM 0 HD23 LEU I 158 45.288 10.263 12.663 1.00 0.00 H new ATOM 1617 N GLY I 159 46.009 15.003 10.952 1.00 0.00 N ATOM 1618 CA GLY I 159 47.125 15.535 10.182 1.00 0.00 C ATOM 1619 C GLY I 159 48.212 14.479 10.010 1.00 0.00 C ATOM 1620 O GLY I 159 48.042 13.329 10.416 1.00 0.00 O ATOM 0 H GLY I 159 45.210 14.703 10.393 1.00 0.00 H new ATOM 0 HA2 GLY I 159 46.774 15.866 9.204 1.00 0.00 H new ATOM 0 HA3 GLY I 159 47.537 16.410 10.686 1.00 0.00 H new ATOM 1624 N ALA I 160 49.328 14.876 9.410 1.00 0.00 N ATOM 1625 CA ALA I 160 50.435 13.953 9.192 1.00 0.00 C ATOM 1626 C ALA I 160 49.993 12.779 8.321 1.00 0.00 C ATOM 1627 O ALA I 160 48.912 12.804 7.734 1.00 0.00 O ATOM 1628 CB ALA I 160 50.946 13.428 10.535 1.00 0.00 C ATOM 0 H ALA I 160 49.490 15.823 9.068 1.00 0.00 H new ATOM 0 HA ALA I 160 51.235 14.489 8.681 1.00 0.00 H new ATOM 0 HB1 ALA I 160 51.773 12.739 10.365 1.00 0.00 H new ATOM 0 HB2 ALA I 160 51.289 14.263 11.145 1.00 0.00 H new ATOM 0 HB3 ALA I 160 50.140 12.907 11.053 1.00 0.00 H new ATOM 1634 N ARG I 161 50.835 11.752 8.248 1.00 0.00 N ATOM 1635 CA ARG I 161 50.519 10.571 7.450 1.00 0.00 C ATOM 1636 C ARG I 161 49.878 10.979 6.123 1.00 0.00 C ATOM 1637 O ARG I 161 50.519 11.620 5.288 1.00 0.00 O ATOM 1638 CB ARG I 161 49.568 9.660 8.233 1.00 0.00 C ATOM 1639 CG ARG I 161 50.346 8.894 9.308 1.00 0.00 C ATOM 1640 CD ARG I 161 49.413 7.891 9.990 1.00 0.00 C ATOM 1641 NE ARG I 161 48.507 8.585 10.900 1.00 0.00 N ATOM 1642 CZ ARG I 161 48.844 8.813 12.169 1.00 0.00 C ATOM 1643 NH1 ARG I 161 49.999 8.405 12.623 1.00 0.00 N ATOM 1644 NH2 ARG I 161 48.022 9.443 12.962 1.00 0.00 N1+ ATOM 0 H ARG I 161 51.734 11.713 8.728 1.00 0.00 H new ATOM 0 HA ARG I 161 51.442 10.032 7.237 1.00 0.00 H new ATOM 0 HB2 ARG I 161 48.780 10.254 8.696 1.00 0.00 H new ATOM 0 HB3 ARG I 161 49.082 8.959 7.555 1.00 0.00 H new ATOM 0 HG2 ARG I 161 51.192 8.374 8.859 1.00 0.00 H new ATOM 0 HG3 ARG I 161 50.752 9.588 10.043 1.00 0.00 H new ATOM 0 HD2 ARG I 161 48.840 7.347 9.239 1.00 0.00 H new ATOM 0 HD3 ARG I 161 49.998 7.154 10.540 1.00 0.00 H new ATOM 0 HE ARG I 161 47.599 8.901 10.558 1.00 0.00 H new ATOM 0 HH11 ARG I 161 50.644 7.911 12.006 1.00 0.00 H new ATOM 0 HH12 ARG I 161 50.256 8.580 13.594 1.00 0.00 H new ATOM 0 HH21 ARG I 161 47.119 9.762 12.611 1.00 0.00 H new ATOM 0 HH22 ARG I 161 48.282 9.616 13.933 1.00 0.00 H new ATOM 1658 N HIS I 162 48.611 10.609 5.931 1.00 0.00 N ATOM 1659 CA HIS I 162 47.907 10.952 4.701 1.00 0.00 C ATOM 1660 C HIS I 162 48.792 10.708 3.483 1.00 0.00 C ATOM 1661 O HIS I 162 49.362 11.643 2.922 1.00 0.00 O ATOM 1662 CB HIS I 162 47.469 12.416 4.739 1.00 0.00 C ATOM 1663 CG HIS I 162 46.153 12.525 5.459 1.00 0.00 C ATOM 1664 ND1 HIS I 162 44.966 12.770 4.787 1.00 0.00 N ATOM 1665 CD2 HIS I 162 45.817 12.417 6.787 1.00 0.00 C ATOM 1666 CE1 HIS I 162 43.981 12.802 5.702 1.00 0.00 C ATOM 1667 NE2 HIS I 162 44.444 12.592 6.937 1.00 0.00 N ATOM 0 H HIS I 162 48.059 10.078 6.605 1.00 0.00 H new ATOM 0 HA HIS I 162 47.027 10.314 4.622 1.00 0.00 H new ATOM 0 HB2 HIS I 162 48.223 13.020 5.244 1.00 0.00 H new ATOM 0 HB3 HIS I 162 47.375 12.805 3.725 1.00 0.00 H new ATOM 0 HD2 HIS I 162 46.512 12.226 7.591 1.00 0.00 H new ATOM 0 HE1 HIS I 162 42.941 12.976 5.467 1.00 0.00 H new ATOM 0 HE2 HIS I 162 43.907 12.566 7.804 1.00 0.00 H new ATOM 1676 N LYS I 163 48.914 9.445 3.085 1.00 0.00 N ATOM 1677 CA LYS I 163 49.747 9.100 1.939 1.00 0.00 C ATOM 1678 C LYS I 163 49.344 9.917 0.714 1.00 0.00 C ATOM 1679 O LYS I 163 50.145 10.685 0.181 1.00 0.00 O ATOM 1680 CB LYS I 163 49.590 7.611 1.620 1.00 0.00 C ATOM 1681 CG LYS I 163 50.401 6.782 2.614 1.00 0.00 C ATOM 1682 CD LYS I 163 49.848 5.356 2.662 1.00 0.00 C ATOM 1683 CE LYS I 163 49.965 4.707 1.279 1.00 0.00 C ATOM 1684 NZ LYS I 163 48.660 4.814 0.566 1.00 0.00 N1+ ATOM 0 H LYS I 163 48.453 8.653 3.533 1.00 0.00 H new ATOM 0 HA LYS I 163 50.785 9.322 2.188 1.00 0.00 H new ATOM 0 HB2 LYS I 163 48.539 7.328 1.669 1.00 0.00 H new ATOM 0 HB3 LYS I 163 49.928 7.410 0.603 1.00 0.00 H new ATOM 0 HG2 LYS I 163 51.450 6.767 2.320 1.00 0.00 H new ATOM 0 HG3 LYS I 163 50.354 7.235 3.604 1.00 0.00 H new ATOM 0 HD2 LYS I 163 50.397 4.768 3.397 1.00 0.00 H new ATOM 0 HD3 LYS I 163 48.805 5.371 2.980 1.00 0.00 H new ATOM 0 HE2 LYS I 163 50.748 5.197 0.701 1.00 0.00 H new ATOM 0 HE3 LYS I 163 50.251 3.660 1.380 1.00 0.00 H new ATOM 0 HZ1 LYS I 163 48.550 4.006 -0.079 1.00 0.00 H new ATOM 0 HZ2 LYS I 163 47.885 4.812 1.259 1.00 0.00 H new ATOM 0 HZ3 LYS I 163 48.634 5.699 0.020 1.00 0.00 H new ATOM 1698 N GLU I 164 48.097 9.756 0.283 1.00 0.00 N ATOM 1699 CA GLU I 164 47.594 10.490 -0.874 1.00 0.00 C ATOM 1700 C GLU I 164 46.189 11.017 -0.609 1.00 0.00 C ATOM 1701 O GLU I 164 45.976 12.227 -0.524 1.00 0.00 O ATOM 1702 CB GLU I 164 47.576 9.584 -2.110 1.00 0.00 C ATOM 1703 CG GLU I 164 49.009 9.217 -2.504 1.00 0.00 C ATOM 1704 CD GLU I 164 49.726 10.450 -3.044 1.00 0.00 C ATOM 1705 OE1 GLU I 164 49.046 11.407 -3.379 1.00 0.00 O ATOM 1706 OE2 GLU I 164 50.943 10.422 -3.114 1.00 0.00 O1- ATOM 0 H GLU I 164 47.419 9.128 0.714 1.00 0.00 H new ATOM 0 HA GLU I 164 48.259 11.335 -1.055 1.00 0.00 H new ATOM 0 HB2 GLU I 164 47.003 8.680 -1.902 1.00 0.00 H new ATOM 0 HB3 GLU I 164 47.080 10.092 -2.937 1.00 0.00 H new ATOM 0 HG2 GLU I 164 49.544 8.823 -1.640 1.00 0.00 H new ATOM 0 HG3 GLU I 164 48.999 8.431 -3.259 1.00 0.00 H new ATOM 1713 N SER I 165 45.234 10.103 -0.477 1.00 0.00 N ATOM 1714 CA SER I 165 43.853 10.489 -0.220 1.00 0.00 C ATOM 1715 C SER I 165 43.036 9.286 0.241 1.00 0.00 C ATOM 1716 O SER I 165 42.636 8.449 -0.566 1.00 0.00 O ATOM 1717 CB SER I 165 43.231 11.076 -1.488 1.00 0.00 C ATOM 1718 OG SER I 165 43.326 10.125 -2.540 1.00 0.00 O ATOM 0 H SER I 165 45.390 9.097 -0.543 1.00 0.00 H new ATOM 0 HA SER I 165 43.847 11.241 0.569 1.00 0.00 H new ATOM 0 HB2 SER I 165 42.187 11.335 -1.309 1.00 0.00 H new ATOM 0 HB3 SER I 165 43.744 11.996 -1.767 1.00 0.00 H new ATOM 0 HG SER I 165 43.026 9.249 -2.218 1.00 0.00 H new ATOM 1724 N LEU I 166 42.790 9.213 1.543 1.00 0.00 N ATOM 1725 CA LEU I 166 42.014 8.115 2.106 1.00 0.00 C ATOM 1726 C LEU I 166 42.654 6.773 1.758 1.00 0.00 C ATOM 1727 O LEU I 166 42.007 5.730 1.816 1.00 0.00 O ATOM 1728 CB LEU I 166 40.585 8.160 1.563 1.00 0.00 C ATOM 1729 CG LEU I 166 40.046 9.589 1.664 1.00 0.00 C ATOM 1730 CD1 LEU I 166 38.609 9.634 1.146 1.00 0.00 C ATOM 1731 CD2 LEU I 166 40.081 10.053 3.122 1.00 0.00 C ATOM 0 H LEU I 166 43.115 9.897 2.226 1.00 0.00 H new ATOM 0 HA LEU I 166 41.995 8.223 3.191 1.00 0.00 H new ATOM 0 HB2 LEU I 166 40.568 7.826 0.526 1.00 0.00 H new ATOM 0 HB3 LEU I 166 39.948 7.479 2.128 1.00 0.00 H new ATOM 0 HG LEU I 166 40.668 10.250 1.061 1.00 0.00 H new ATOM 0 HD11 LEU I 166 38.228 10.652 1.219 1.00 0.00 H new ATOM 0 HD12 LEU I 166 38.587 9.312 0.105 1.00 0.00 H new ATOM 0 HD13 LEU I 166 37.986 8.969 1.744 1.00 0.00 H new ATOM 0 HD21 LEU I 166 39.696 11.071 3.189 1.00 0.00 H new ATOM 0 HD22 LEU I 166 39.464 9.391 3.729 1.00 0.00 H new ATOM 0 HD23 LEU I 166 41.108 10.028 3.487 1.00 0.00 H new ATOM 1743 N ASP I 167 43.931 6.808 1.392 1.00 0.00 N ATOM 1744 CA ASP I 167 44.645 5.587 1.037 1.00 0.00 C ATOM 1745 C ASP I 167 43.876 4.810 -0.026 1.00 0.00 C ATOM 1746 O ASP I 167 43.956 3.583 -0.092 1.00 0.00 O ATOM 1747 CB ASP I 167 44.818 4.709 2.277 1.00 0.00 C ATOM 1748 CG ASP I 167 45.349 5.542 3.438 1.00 0.00 C ATOM 1749 OD1 ASP I 167 44.561 6.256 4.035 1.00 0.00 O ATOM 1750 OD2 ASP I 167 46.534 5.451 3.715 1.00 0.00 O1- ATOM 0 H ASP I 167 44.489 7.660 1.334 1.00 0.00 H new ATOM 0 HA ASP I 167 45.623 5.861 0.640 1.00 0.00 H new ATOM 0 HB2 ASP I 167 43.864 4.258 2.549 1.00 0.00 H new ATOM 0 HB3 ASP I 167 45.506 3.892 2.061 1.00 0.00 H new ATOM 1755 N LEU I 168 43.132 5.532 -0.856 1.00 0.00 N ATOM 1756 CA LEU I 168 42.348 4.901 -1.912 1.00 0.00 C ATOM 1757 C LEU I 168 41.588 3.693 -1.370 1.00 0.00 C ATOM 1758 O LEU I 168 41.132 2.841 -2.133 1.00 0.00 O ATOM 1759 CB LEU I 168 43.274 4.465 -3.054 1.00 0.00 C ATOM 1760 CG LEU I 168 43.094 5.393 -4.262 1.00 0.00 C ATOM 1761 CD1 LEU I 168 41.685 5.229 -4.840 1.00 0.00 C ATOM 1762 CD2 LEU I 168 43.307 6.846 -3.827 1.00 0.00 C ATOM 0 H LEU I 168 43.055 6.548 -0.819 1.00 0.00 H new ATOM 0 HA LEU I 168 41.624 5.624 -2.288 1.00 0.00 H new ATOM 0 HB2 LEU I 168 44.311 4.487 -2.720 1.00 0.00 H new ATOM 0 HB3 LEU I 168 43.053 3.437 -3.339 1.00 0.00 H new ATOM 0 HG LEU I 168 43.825 5.132 -5.027 1.00 0.00 H new ATOM 0 HD11 LEU I 168 41.564 5.891 -5.697 1.00 0.00 H new ATOM 0 HD12 LEU I 168 41.539 4.196 -5.156 1.00 0.00 H new ATOM 0 HD13 LEU I 168 40.948 5.483 -4.079 1.00 0.00 H new ATOM 0 HD21 LEU I 168 43.179 7.505 -4.686 1.00 0.00 H new ATOM 0 HD22 LEU I 168 42.579 7.106 -3.058 1.00 0.00 H new ATOM 0 HD23 LEU I 168 44.314 6.962 -3.427 1.00 0.00 H new ATOM 1774 N ARG I 169 41.452 3.629 -0.051 1.00 0.00 N ATOM 1775 CA ARG I 169 40.743 2.526 0.577 1.00 0.00 C ATOM 1776 C ARG I 169 40.239 2.930 1.957 1.00 0.00 C ATOM 1777 O ARG I 169 39.061 2.763 2.272 1.00 0.00 O ATOM 1778 CB ARG I 169 41.665 1.313 0.692 1.00 0.00 C ATOM 1779 CG ARG I 169 40.925 0.170 1.389 1.00 0.00 C ATOM 1780 CD ARG I 169 41.742 -1.114 1.258 1.00 0.00 C ATOM 1781 NE ARG I 169 43.053 -0.946 1.871 1.00 0.00 N ATOM 1782 CZ ARG I 169 44.019 -1.837 1.676 1.00 0.00 C ATOM 1783 NH1 ARG I 169 43.797 -2.888 0.935 1.00 0.00 N ATOM 1784 NH2 ARG I 169 45.191 -1.659 2.222 1.00 0.00 N1+ ATOM 0 H ARG I 169 41.821 4.323 0.599 1.00 0.00 H new ATOM 0 HA ARG I 169 39.885 2.266 -0.043 1.00 0.00 H new ATOM 0 HB2 ARG I 169 41.992 0.997 -0.299 1.00 0.00 H new ATOM 0 HB3 ARG I 169 42.561 1.576 1.255 1.00 0.00 H new ATOM 0 HG2 ARG I 169 40.769 0.410 2.441 1.00 0.00 H new ATOM 0 HG3 ARG I 169 39.939 0.035 0.944 1.00 0.00 H new ATOM 0 HD2 ARG I 169 41.213 -1.939 1.735 1.00 0.00 H new ATOM 0 HD3 ARG I 169 41.856 -1.374 0.206 1.00 0.00 H new ATOM 0 HE ARG I 169 43.232 -0.132 2.459 1.00 0.00 H new ATOM 0 HH11 ARG I 169 42.882 -3.025 0.506 1.00 0.00 H new ATOM 0 HH12 ARG I 169 44.538 -3.572 0.785 1.00 0.00 H new ATOM 0 HH21 ARG I 169 45.365 -0.836 2.798 1.00 0.00 H new ATOM 0 HH22 ARG I 169 45.933 -2.343 2.072 1.00 0.00 H new ATOM 1798 N ALA I 170 41.139 3.467 2.775 1.00 0.00 N ATOM 1799 CA ALA I 170 40.773 3.896 4.118 1.00 0.00 C ATOM 1800 C ALA I 170 40.196 2.727 4.912 1.00 0.00 C ATOM 1801 O ALA I 170 39.093 2.312 4.599 1.00 0.00 O ATOM 1802 CB ALA I 170 39.744 5.025 4.047 1.00 0.00 C ATOM 1803 OXT ALA I 170 40.866 2.265 5.821 1.00 0.00 O ATOM 0 H ALA I 170 42.119 3.614 2.533 1.00 0.00 H new ATOM 0 HA ALA I 170 41.670 4.257 4.621 1.00 0.00 H new ATOM 0 HB1 ALA I 170 39.477 5.338 5.056 1.00 0.00 H new ATOM 0 HB2 ALA I 170 40.168 5.870 3.505 1.00 0.00 H new ATOM 0 HB3 ALA I 170 38.852 4.672 3.529 1.00 0.00 H new TER 1809 ALA I 170 HETATM 1810 CA CA C 101 19.490 17.155 15.300 1.00 0.00 CA