USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 803 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: I 7 MET CE :methyl -122:sc= -2.9 (180deg=-6.77!) USER MOD Set 1.2: I 8 MET CE :methyl 161:sc= -4.09! (180deg=-3.54!) USER MOD Set 2.1: C 60 MET CE :methyl 180:sc=-0.00198 (180deg=0) USER MOD Set 2.2: I 1 ARG N :NH3+ -140:sc= -0.243 (180deg=0) USER MOD Set 3.1: C 13 THR OG1 : rot 180:sc= -2.75! USER MOD Set 3.2: C 16 GLN : amide:sc= -1.3 K(o=-4.2,f=-5.7!) USER MOD Set 3.3: C 85 MET CE :methyl -150:sc= -0.152 (180deg=-0.846) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= -0.27 K(o=-0.27,f=-3.1!) USER MOD Single : C 17 LYS NZ :NH3+ 145:sc= 0 (180deg=-0.222) USER MOD Single : C 18 ASN : amide:sc= -1.02 K(o=-1,f=-2.8!) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 61:sc= 0.0514 USER MOD Single : C 37 SER OG : rot 180:sc= -0.365 USER MOD Single : C 38 THR OG1 : rot -81:sc= -0.0818 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ -144:sc= -0.11 (180deg=-0.777) USER MOD Single : C 45 MET CE :methyl -166:sc= -10.9! (180deg=-11.6!) USER MOD Single : C 47 MET CE :methyl 146:sc= -11.4! (180deg=-12.4!) USER MOD Single : C 50 GLN : amide:sc= -0.292 K(o=-0.29,f=-2.5!) USER MOD Single : C 51 ASN : amide:sc= -2.14! C(o=-2.1!,f=-6.1!) USER MOD Single : C 53 THR OG1 : rot -160:sc= -0.297 USER MOD Single : C 58 GLN : amide:sc= -0.577 K(o=-0.58,f=-2.8!) USER MOD Single : C 69 SER OG : rot -71:sc= -0.199! USER MOD Single : C 71 THR OG1 : rot 180:sc= 0 USER MOD Single : C 80 MET CE :methyl -160:sc=-0.00784 (180deg=-0.202) USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot -29:sc= 0.456 USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot 180:sc= -1.81! USER MOD Single : I 3 SER OG : rot 180:sc= 0 USER MOD Single : I 9 GLN : amide:sc= -0.154 K(o=-0.15,f=-0.87) USER MOD Single : I 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 55.088 -15.825 16.240 1.00 0.00 N ATOM 2 CA MET C 1 56.059 -14.968 16.978 1.00 0.00 C ATOM 3 C MET C 1 57.409 -14.955 16.255 1.00 0.00 C ATOM 4 O MET C 1 57.737 -14.025 15.546 1.00 0.00 O ATOM 5 CB MET C 1 56.192 -15.617 18.356 1.00 0.00 C ATOM 6 CG MET C 1 57.284 -14.903 19.155 1.00 0.00 C ATOM 7 SD MET C 1 56.522 -13.764 20.338 1.00 0.00 S ATOM 8 CE MET C 1 58.054 -13.073 21.008 1.00 0.00 C ATOM 0 H1 MET C 1 54.176 -15.826 16.740 1.00 0.00 H new ATOM 0 H2 MET C 1 54.955 -15.451 15.279 1.00 0.00 H new ATOM 0 H3 MET C 1 55.454 -16.797 16.186 1.00 0.00 H new ATOM 0 HA MET C 1 55.727 -13.932 17.047 1.00 0.00 H new ATOM 0 HB2 MET C 1 55.243 -15.562 18.888 1.00 0.00 H new ATOM 0 HB3 MET C 1 56.437 -16.674 18.250 1.00 0.00 H new ATOM 0 HG2 MET C 1 57.900 -15.632 19.681 1.00 0.00 H new ATOM 0 HG3 MET C 1 57.944 -14.356 18.481 1.00 0.00 H new ATOM 0 HE1 MET C 1 57.816 -12.332 21.771 1.00 0.00 H new ATOM 0 HE2 MET C 1 58.650 -13.871 21.450 1.00 0.00 H new ATOM 0 HE3 MET C 1 58.620 -12.599 20.206 1.00 0.00 H new ATOM 20 N ASP C 2 58.195 -15.984 16.429 1.00 0.00 N ATOM 21 CA ASP C 2 59.523 -16.034 15.752 1.00 0.00 C ATOM 22 C ASP C 2 59.396 -15.545 14.305 1.00 0.00 C ATOM 23 O ASP C 2 58.776 -16.183 13.477 1.00 0.00 O ATOM 24 CB ASP C 2 59.931 -17.510 15.795 1.00 0.00 C ATOM 25 CG ASP C 2 61.003 -17.786 14.739 1.00 0.00 C ATOM 26 OD1 ASP C 2 62.077 -17.218 14.851 1.00 0.00 O ATOM 27 OD2 ASP C 2 60.732 -18.560 13.836 1.00 0.00 O ATOM 0 H ASP C 2 57.974 -16.792 17.011 1.00 0.00 H new ATOM 0 HA ASP C 2 60.262 -15.395 16.235 1.00 0.00 H new ATOM 0 HB2 ASP C 2 60.310 -17.763 16.785 1.00 0.00 H new ATOM 0 HB3 ASP C 2 59.061 -18.142 15.616 1.00 0.00 H new ATOM 32 N ASP C 3 59.977 -14.417 13.997 1.00 0.00 N ATOM 33 CA ASP C 3 59.887 -13.890 12.606 1.00 0.00 C ATOM 34 C ASP C 3 58.421 -13.704 12.203 1.00 0.00 C ATOM 35 O ASP C 3 57.927 -14.359 11.307 1.00 0.00 O ATOM 36 CB ASP C 3 60.551 -14.956 11.733 1.00 0.00 C ATOM 37 CG ASP C 3 61.329 -14.277 10.604 1.00 0.00 C ATOM 38 OD1 ASP C 3 61.214 -13.068 10.477 1.00 0.00 O ATOM 39 OD2 ASP C 3 62.025 -14.975 9.887 1.00 0.00 O ATOM 0 H ASP C 3 60.509 -13.839 14.647 1.00 0.00 H new ATOM 0 HA ASP C 3 60.371 -12.919 12.502 1.00 0.00 H new ATOM 0 HB2 ASP C 3 61.222 -15.568 12.335 1.00 0.00 H new ATOM 0 HB3 ASP C 3 59.796 -15.624 11.319 1.00 0.00 H new ATOM 44 N ILE C 4 57.722 -12.817 12.856 1.00 0.00 N ATOM 45 CA ILE C 4 56.291 -12.592 12.507 1.00 0.00 C ATOM 46 C ILE C 4 56.181 -11.919 11.136 1.00 0.00 C ATOM 47 O ILE C 4 55.226 -12.115 10.412 1.00 0.00 O ATOM 48 CB ILE C 4 55.755 -11.672 13.604 1.00 0.00 C ATOM 49 CG1 ILE C 4 54.277 -11.374 13.341 1.00 0.00 C ATOM 50 CG2 ILE C 4 56.544 -10.363 13.604 1.00 0.00 C ATOM 51 CD1 ILE C 4 53.757 -10.401 14.399 1.00 0.00 C ATOM 0 H ILE C 4 58.080 -12.238 13.616 1.00 0.00 H new ATOM 0 HA ILE C 4 55.728 -13.524 12.448 1.00 0.00 H new ATOM 0 HB ILE C 4 55.863 -12.161 14.572 1.00 0.00 H new ATOM 0 HG12 ILE C 4 54.153 -10.947 12.346 1.00 0.00 H new ATOM 0 HG13 ILE C 4 53.699 -12.298 13.366 1.00 0.00 H new ATOM 0 HG21 ILE C 4 56.161 -9.708 14.386 1.00 0.00 H new ATOM 0 HG22 ILE C 4 57.597 -10.573 13.790 1.00 0.00 H new ATOM 0 HG23 ILE C 4 56.437 -9.874 12.636 1.00 0.00 H new ATOM 0 HD11 ILE C 4 52.704 -10.189 14.212 1.00 0.00 H new ATOM 0 HD12 ILE C 4 53.867 -10.846 15.388 1.00 0.00 H new ATOM 0 HD13 ILE C 4 54.328 -9.474 14.353 1.00 0.00 H new ATOM 63 N TYR C 5 57.155 -11.129 10.773 1.00 0.00 N ATOM 64 CA TYR C 5 57.107 -10.448 9.448 1.00 0.00 C ATOM 65 C TYR C 5 57.241 -11.477 8.323 1.00 0.00 C ATOM 66 O TYR C 5 56.438 -11.528 7.412 1.00 0.00 O ATOM 67 CB TYR C 5 58.302 -9.494 9.448 1.00 0.00 C ATOM 68 CG TYR C 5 58.192 -8.544 10.617 1.00 0.00 C ATOM 69 CD1 TYR C 5 57.137 -7.627 10.676 1.00 0.00 C ATOM 70 CD2 TYR C 5 59.145 -8.582 11.640 1.00 0.00 C ATOM 71 CE1 TYR C 5 57.035 -6.748 11.760 1.00 0.00 C ATOM 72 CE2 TYR C 5 59.043 -7.702 12.724 1.00 0.00 C ATOM 73 CZ TYR C 5 57.987 -6.784 12.784 1.00 0.00 C ATOM 74 OH TYR C 5 57.886 -5.917 13.852 1.00 0.00 O ATOM 0 H TYR C 5 57.981 -10.926 11.336 1.00 0.00 H new ATOM 0 HA TYR C 5 56.167 -9.921 9.287 1.00 0.00 H new ATOM 0 HB2 TYR C 5 59.232 -10.060 9.512 1.00 0.00 H new ATOM 0 HB3 TYR C 5 58.333 -8.934 8.513 1.00 0.00 H new ATOM 0 HD1 TYR C 5 56.402 -7.598 9.885 1.00 0.00 H new ATOM 0 HD2 TYR C 5 59.959 -9.290 11.594 1.00 0.00 H new ATOM 0 HE1 TYR C 5 56.220 -6.041 11.806 1.00 0.00 H new ATOM 0 HE2 TYR C 5 59.779 -7.731 13.514 1.00 0.00 H new ATOM 0 HH TYR C 5 58.627 -6.076 14.473 1.00 0.00 H new ATOM 84 N LYS C 6 58.253 -12.300 8.380 1.00 0.00 N ATOM 85 CA LYS C 6 58.441 -13.327 7.316 1.00 0.00 C ATOM 86 C LYS C 6 57.107 -14.008 6.996 1.00 0.00 C ATOM 87 O LYS C 6 56.884 -14.473 5.897 1.00 0.00 O ATOM 88 CB LYS C 6 59.427 -14.335 7.909 1.00 0.00 C ATOM 89 CG LYS C 6 60.802 -14.141 7.268 1.00 0.00 C ATOM 90 CD LYS C 6 60.778 -14.682 5.836 1.00 0.00 C ATOM 91 CE LYS C 6 61.511 -13.710 4.909 1.00 0.00 C ATOM 92 NZ LYS C 6 61.678 -14.456 3.629 1.00 0.00 N ATOM 0 H LYS C 6 58.958 -12.305 9.117 1.00 0.00 H new ATOM 0 HA LYS C 6 58.809 -12.895 6.385 1.00 0.00 H new ATOM 0 HB2 LYS C 6 59.495 -14.201 8.989 1.00 0.00 H new ATOM 0 HB3 LYS C 6 59.073 -15.351 7.735 1.00 0.00 H new ATOM 0 HG2 LYS C 6 61.068 -13.084 7.264 1.00 0.00 H new ATOM 0 HG3 LYS C 6 61.563 -14.659 7.851 1.00 0.00 H new ATOM 0 HD2 LYS C 6 61.252 -15.663 5.799 1.00 0.00 H new ATOM 0 HD3 LYS C 6 59.748 -14.812 5.503 1.00 0.00 H new ATOM 0 HE2 LYS C 6 60.937 -12.795 4.762 1.00 0.00 H new ATOM 0 HE3 LYS C 6 62.475 -13.418 5.325 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 62.174 -13.856 2.939 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 62.234 -15.318 3.800 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 60.743 -14.715 3.254 1.00 0.00 H new ATOM 106 N ALA C 7 56.218 -14.070 7.950 1.00 0.00 N ATOM 107 CA ALA C 7 54.900 -14.723 7.700 1.00 0.00 C ATOM 108 C ALA C 7 54.019 -13.819 6.833 1.00 0.00 C ATOM 109 O ALA C 7 53.677 -14.155 5.716 1.00 0.00 O ATOM 110 CB ALA C 7 54.280 -14.911 9.084 1.00 0.00 C ATOM 0 H ALA C 7 56.347 -13.697 8.891 1.00 0.00 H new ATOM 0 HA ALA C 7 55.002 -15.670 7.170 1.00 0.00 H new ATOM 0 HB1 ALA C 7 53.305 -15.387 8.984 1.00 0.00 H new ATOM 0 HB2 ALA C 7 54.931 -15.540 9.692 1.00 0.00 H new ATOM 0 HB3 ALA C 7 54.162 -13.940 9.565 1.00 0.00 H new ATOM 116 N ALA C 8 53.650 -12.673 7.338 1.00 0.00 N ATOM 117 CA ALA C 8 52.792 -11.749 6.542 1.00 0.00 C ATOM 118 C ALA C 8 53.326 -11.633 5.113 1.00 0.00 C ATOM 119 O ALA C 8 52.578 -11.458 4.171 1.00 0.00 O ATOM 120 CB ALA C 8 52.889 -10.402 7.261 1.00 0.00 C ATOM 0 H ALA C 8 53.905 -12.337 8.267 1.00 0.00 H new ATOM 0 HA ALA C 8 51.763 -12.100 6.469 1.00 0.00 H new ATOM 0 HB1 ALA C 8 52.283 -9.664 6.735 1.00 0.00 H new ATOM 0 HB2 ALA C 8 52.526 -10.508 8.283 1.00 0.00 H new ATOM 0 HB3 ALA C 8 53.928 -10.072 7.278 1.00 0.00 H new ATOM 126 N VAL C 9 54.617 -11.729 4.942 1.00 0.00 N ATOM 127 CA VAL C 9 55.197 -11.624 3.574 1.00 0.00 C ATOM 128 C VAL C 9 54.724 -12.794 2.708 1.00 0.00 C ATOM 129 O VAL C 9 54.183 -12.608 1.636 1.00 0.00 O ATOM 130 CB VAL C 9 56.710 -11.690 3.780 1.00 0.00 C ATOM 131 CG1 VAL C 9 57.420 -11.295 2.483 1.00 0.00 C ATOM 132 CG2 VAL C 9 57.115 -10.727 4.897 1.00 0.00 C ATOM 0 H VAL C 9 55.294 -11.876 5.691 1.00 0.00 H new ATOM 0 HA VAL C 9 54.893 -10.709 3.066 1.00 0.00 H new ATOM 0 HB VAL C 9 56.995 -12.706 4.055 1.00 0.00 H new ATOM 0 HG11 VAL C 9 58.499 -11.342 2.630 1.00 0.00 H new ATOM 0 HG12 VAL C 9 57.132 -11.982 1.687 1.00 0.00 H new ATOM 0 HG13 VAL C 9 57.135 -10.280 2.207 1.00 0.00 H new ATOM 0 HG21 VAL C 9 58.194 -10.774 5.044 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.830 -9.711 4.623 1.00 0.00 H new ATOM 0 HG23 VAL C 9 56.610 -11.009 5.821 1.00 0.00 H new ATOM 142 N GLU C 10 54.927 -14.000 3.165 1.00 0.00 N ATOM 143 CA GLU C 10 54.492 -15.184 2.370 1.00 0.00 C ATOM 144 C GLU C 10 52.965 -15.220 2.261 1.00 0.00 C ATOM 145 O GLU C 10 52.404 -16.004 1.520 1.00 0.00 O ATOM 146 CB GLU C 10 55.003 -16.395 3.152 1.00 0.00 C ATOM 147 CG GLU C 10 55.500 -17.462 2.176 1.00 0.00 C ATOM 148 CD GLU C 10 55.852 -18.735 2.949 1.00 0.00 C ATOM 149 OE1 GLU C 10 56.253 -18.616 4.095 1.00 0.00 O ATOM 150 OE2 GLU C 10 55.716 -19.806 2.381 1.00 0.00 O ATOM 0 H GLU C 10 55.376 -14.217 4.055 1.00 0.00 H new ATOM 0 HA GLU C 10 54.880 -15.162 1.352 1.00 0.00 H new ATOM 0 HB2 GLU C 10 55.810 -16.095 3.821 1.00 0.00 H new ATOM 0 HB3 GLU C 10 54.206 -16.801 3.776 1.00 0.00 H new ATOM 0 HG2 GLU C 10 54.732 -17.676 1.432 1.00 0.00 H new ATOM 0 HG3 GLU C 10 56.374 -17.098 1.636 1.00 0.00 H new ATOM 157 N GLN C 11 52.287 -14.377 2.992 1.00 0.00 N ATOM 158 CA GLN C 11 50.796 -14.364 2.929 1.00 0.00 C ATOM 159 C GLN C 11 50.309 -13.091 2.233 1.00 0.00 C ATOM 160 O GLN C 11 49.197 -12.646 2.439 1.00 0.00 O ATOM 161 CB GLN C 11 50.337 -14.384 4.387 1.00 0.00 C ATOM 162 CG GLN C 11 50.969 -15.578 5.104 1.00 0.00 C ATOM 163 CD GLN C 11 50.022 -16.079 6.197 1.00 0.00 C ATOM 164 OE1 GLN C 11 48.854 -15.747 6.203 1.00 0.00 O ATOM 165 NE2 GLN C 11 50.481 -16.869 7.128 1.00 0.00 N ATOM 0 H GLN C 11 52.700 -13.697 3.630 1.00 0.00 H new ATOM 0 HA GLN C 11 50.399 -15.208 2.365 1.00 0.00 H new ATOM 0 HB2 GLN C 11 50.623 -13.456 4.882 1.00 0.00 H new ATOM 0 HB3 GLN C 11 49.250 -14.450 4.436 1.00 0.00 H new ATOM 0 HG2 GLN C 11 51.173 -16.377 4.391 1.00 0.00 H new ATOM 0 HG3 GLN C 11 51.925 -15.289 5.541 1.00 0.00 H new ATOM 0 HE21 GLN C 11 51.462 -17.148 7.122 1.00 0.00 H new ATOM 0 HE22 GLN C 11 49.859 -17.208 7.862 1.00 0.00 H new ATOM 174 N LEU C 12 51.133 -12.497 1.415 1.00 0.00 N ATOM 175 CA LEU C 12 50.716 -11.251 0.712 1.00 0.00 C ATOM 176 C LEU C 12 49.789 -11.580 -0.459 1.00 0.00 C ATOM 177 O LEU C 12 49.944 -12.586 -1.124 1.00 0.00 O ATOM 178 CB LEU C 12 52.018 -10.630 0.205 1.00 0.00 C ATOM 179 CG LEU C 12 52.718 -9.906 1.356 1.00 0.00 C ATOM 180 CD1 LEU C 12 54.073 -9.380 0.880 1.00 0.00 C ATOM 181 CD2 LEU C 12 51.853 -8.734 1.820 1.00 0.00 C ATOM 0 H LEU C 12 52.077 -12.820 1.203 1.00 0.00 H new ATOM 0 HA LEU C 12 50.166 -10.575 1.367 1.00 0.00 H new ATOM 0 HB2 LEU C 12 52.669 -11.404 -0.201 1.00 0.00 H new ATOM 0 HB3 LEU C 12 51.809 -9.931 -0.605 1.00 0.00 H new ATOM 0 HG LEU C 12 52.868 -10.599 2.184 1.00 0.00 H new ATOM 0 HD11 LEU C 12 54.572 -8.864 1.701 1.00 0.00 H new ATOM 0 HD12 LEU C 12 54.691 -10.214 0.547 1.00 0.00 H new ATOM 0 HD13 LEU C 12 53.924 -8.686 0.053 1.00 0.00 H new ATOM 0 HD21 LEU C 12 52.351 -8.217 2.640 1.00 0.00 H new ATOM 0 HD22 LEU C 12 51.704 -8.041 0.992 1.00 0.00 H new ATOM 0 HD23 LEU C 12 50.887 -9.107 2.159 1.00 0.00 H new ATOM 193 N THR C 13 48.827 -10.738 -0.717 1.00 0.00 N ATOM 194 CA THR C 13 47.890 -11.000 -1.846 1.00 0.00 C ATOM 195 C THR C 13 48.600 -10.769 -3.182 1.00 0.00 C ATOM 196 O THR C 13 49.444 -9.904 -3.307 1.00 0.00 O ATOM 197 CB THR C 13 46.750 -9.997 -1.659 1.00 0.00 C ATOM 198 OG1 THR C 13 47.150 -8.987 -0.742 1.00 0.00 O ATOM 199 CG2 THR C 13 45.520 -10.722 -1.115 1.00 0.00 C ATOM 0 H THR C 13 48.649 -9.880 -0.195 1.00 0.00 H new ATOM 0 HA THR C 13 47.527 -12.028 -1.853 1.00 0.00 H new ATOM 0 HB THR C 13 46.508 -9.539 -2.618 1.00 0.00 H new ATOM 0 HG1 THR C 13 46.420 -8.344 -0.624 1.00 0.00 H new ATOM 0 HG21 THR C 13 44.707 -10.009 -0.981 1.00 0.00 H new ATOM 0 HG22 THR C 13 45.212 -11.495 -1.819 1.00 0.00 H new ATOM 0 HG23 THR C 13 45.762 -11.180 -0.156 1.00 0.00 H new ATOM 207 N GLU C 14 48.270 -11.543 -4.179 1.00 0.00 N ATOM 208 CA GLU C 14 48.928 -11.377 -5.506 1.00 0.00 C ATOM 209 C GLU C 14 49.050 -9.894 -5.868 1.00 0.00 C ATOM 210 O GLU C 14 50.115 -9.412 -6.200 1.00 0.00 O ATOM 211 CB GLU C 14 48.007 -12.093 -6.494 1.00 0.00 C ATOM 212 CG GLU C 14 48.826 -13.067 -7.344 1.00 0.00 C ATOM 213 CD GLU C 14 47.890 -14.072 -8.016 1.00 0.00 C ATOM 214 OE1 GLU C 14 47.520 -15.035 -7.365 1.00 0.00 O ATOM 215 OE2 GLU C 14 47.557 -13.862 -9.172 1.00 0.00 O ATOM 0 H GLU C 14 47.572 -12.285 -4.132 1.00 0.00 H new ATOM 0 HA GLU C 14 49.939 -11.784 -5.514 1.00 0.00 H new ATOM 0 HB2 GLU C 14 47.227 -12.631 -5.955 1.00 0.00 H new ATOM 0 HB3 GLU C 14 47.508 -11.366 -7.135 1.00 0.00 H new ATOM 0 HG2 GLU C 14 49.392 -12.520 -8.099 1.00 0.00 H new ATOM 0 HG3 GLU C 14 49.550 -13.590 -6.720 1.00 0.00 H new ATOM 222 N GLU C 15 47.968 -9.167 -5.816 1.00 0.00 N ATOM 223 CA GLU C 15 48.024 -7.717 -6.166 1.00 0.00 C ATOM 224 C GLU C 15 48.890 -6.950 -5.160 1.00 0.00 C ATOM 225 O GLU C 15 49.618 -6.046 -5.520 1.00 0.00 O ATOM 226 CB GLU C 15 46.575 -7.237 -6.102 1.00 0.00 C ATOM 227 CG GLU C 15 46.293 -6.303 -7.280 1.00 0.00 C ATOM 228 CD GLU C 15 44.879 -6.556 -7.807 1.00 0.00 C ATOM 229 OE1 GLU C 15 43.988 -6.732 -6.992 1.00 0.00 O ATOM 230 OE2 GLU C 15 44.712 -6.570 -9.015 1.00 0.00 O ATOM 0 H GLU C 15 47.047 -9.513 -5.547 1.00 0.00 H new ATOM 0 HA GLU C 15 48.467 -7.552 -7.148 1.00 0.00 H new ATOM 0 HB2 GLU C 15 45.897 -8.090 -6.130 1.00 0.00 H new ATOM 0 HB3 GLU C 15 46.394 -6.717 -5.161 1.00 0.00 H new ATOM 0 HG2 GLU C 15 46.395 -5.264 -6.966 1.00 0.00 H new ATOM 0 HG3 GLU C 15 47.023 -6.470 -8.072 1.00 0.00 H new ATOM 237 N GLN C 16 48.814 -7.298 -3.905 1.00 0.00 N ATOM 238 CA GLN C 16 49.632 -6.580 -2.885 1.00 0.00 C ATOM 239 C GLN C 16 51.124 -6.731 -3.193 1.00 0.00 C ATOM 240 O GLN C 16 51.806 -5.768 -3.483 1.00 0.00 O ATOM 241 CB GLN C 16 49.288 -7.247 -1.554 1.00 0.00 C ATOM 242 CG GLN C 16 49.837 -6.401 -0.403 1.00 0.00 C ATOM 243 CD GLN C 16 49.106 -6.760 0.892 1.00 0.00 C ATOM 244 OE1 GLN C 16 47.985 -7.229 0.861 1.00 0.00 O ATOM 245 NE2 GLN C 16 49.698 -6.557 2.037 1.00 0.00 N ATOM 0 H GLN C 16 48.223 -8.046 -3.542 1.00 0.00 H new ATOM 0 HA GLN C 16 49.421 -5.511 -2.870 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.208 -7.355 -1.457 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.713 -8.250 -1.517 1.00 0.00 H new ATOM 0 HG2 GLN C 16 50.907 -6.575 -0.289 1.00 0.00 H new ATOM 0 HG3 GLN C 16 49.708 -5.341 -0.623 1.00 0.00 H new ATOM 0 HE21 GLN C 16 50.639 -6.163 2.062 1.00 0.00 H new ATOM 0 HE22 GLN C 16 49.220 -6.792 2.907 1.00 0.00 H new ATOM 254 N LYS C 17 51.636 -7.930 -3.138 1.00 0.00 N ATOM 255 CA LYS C 17 53.082 -8.131 -3.433 1.00 0.00 C ATOM 256 C LYS C 17 53.401 -7.577 -4.827 1.00 0.00 C ATOM 257 O LYS C 17 54.519 -7.198 -5.116 1.00 0.00 O ATOM 258 CB LYS C 17 53.286 -9.652 -3.364 1.00 0.00 C ATOM 259 CG LYS C 17 54.370 -10.095 -4.352 1.00 0.00 C ATOM 260 CD LYS C 17 53.728 -10.365 -5.713 1.00 0.00 C ATOM 261 CE LYS C 17 53.809 -11.861 -6.028 1.00 0.00 C ATOM 262 NZ LYS C 17 52.616 -12.141 -6.875 1.00 0.00 N ATOM 0 H LYS C 17 51.117 -8.776 -2.902 1.00 0.00 H new ATOM 0 HA LYS C 17 53.741 -7.614 -2.736 1.00 0.00 H new ATOM 0 HB2 LYS C 17 53.569 -9.941 -2.352 1.00 0.00 H new ATOM 0 HB3 LYS C 17 52.349 -10.161 -3.591 1.00 0.00 H new ATOM 0 HG2 LYS C 17 55.134 -9.323 -4.443 1.00 0.00 H new ATOM 0 HG3 LYS C 17 54.867 -10.993 -3.986 1.00 0.00 H new ATOM 0 HD2 LYS C 17 52.688 -10.040 -5.707 1.00 0.00 H new ATOM 0 HD3 LYS C 17 54.237 -9.791 -6.487 1.00 0.00 H new ATOM 0 HE2 LYS C 17 54.732 -12.104 -6.554 1.00 0.00 H new ATOM 0 HE3 LYS C 17 53.795 -12.458 -5.116 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 52.855 -12.865 -7.583 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 51.838 -12.485 -6.276 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 52.321 -11.269 -7.358 1.00 0.00 H new ATOM 276 N ASN C 18 52.423 -7.523 -5.688 1.00 0.00 N ATOM 277 CA ASN C 18 52.664 -6.990 -7.057 1.00 0.00 C ATOM 278 C ASN C 18 52.771 -5.462 -7.014 1.00 0.00 C ATOM 279 O ASN C 18 53.360 -4.847 -7.881 1.00 0.00 O ATOM 280 CB ASN C 18 51.441 -7.422 -7.869 1.00 0.00 C ATOM 281 CG ASN C 18 51.730 -8.761 -8.549 1.00 0.00 C ATOM 282 OD1 ASN C 18 52.870 -9.091 -8.807 1.00 0.00 O ATOM 283 ND2 ASN C 18 50.737 -9.552 -8.852 1.00 0.00 N ATOM 0 H ASN C 18 51.467 -7.825 -5.502 1.00 0.00 H new ATOM 0 HA ASN C 18 53.592 -7.362 -7.491 1.00 0.00 H new ATOM 0 HB2 ASN C 18 50.572 -7.513 -7.218 1.00 0.00 H new ATOM 0 HB3 ASN C 18 51.202 -6.666 -8.617 1.00 0.00 H new ATOM 0 HD21 ASN C 18 50.918 -10.447 -9.306 1.00 0.00 H new ATOM 0 HD22 ASN C 18 49.780 -9.275 -8.635 1.00 0.00 H new ATOM 290 N GLU C 19 52.209 -4.848 -6.009 1.00 0.00 N ATOM 291 CA GLU C 19 52.280 -3.361 -5.908 1.00 0.00 C ATOM 292 C GLU C 19 53.650 -2.933 -5.373 1.00 0.00 C ATOM 293 O GLU C 19 54.244 -1.986 -5.847 1.00 0.00 O ATOM 294 CB GLU C 19 51.178 -2.976 -4.920 1.00 0.00 C ATOM 295 CG GLU C 19 49.838 -2.896 -5.654 1.00 0.00 C ATOM 296 CD GLU C 19 48.720 -2.612 -4.647 1.00 0.00 C ATOM 297 OE1 GLU C 19 48.855 -1.661 -3.895 1.00 0.00 O ATOM 298 OE2 GLU C 19 47.751 -3.352 -4.644 1.00 0.00 O ATOM 0 H GLU C 19 51.704 -5.311 -5.253 1.00 0.00 H new ATOM 0 HA GLU C 19 52.148 -2.876 -6.875 1.00 0.00 H new ATOM 0 HB2 GLU C 19 51.122 -3.711 -4.117 1.00 0.00 H new ATOM 0 HB3 GLU C 19 51.409 -2.016 -4.457 1.00 0.00 H new ATOM 0 HG2 GLU C 19 49.871 -2.110 -6.408 1.00 0.00 H new ATOM 0 HG3 GLU C 19 49.641 -3.832 -6.177 1.00 0.00 H new ATOM 305 N PHE C 20 54.153 -3.624 -4.387 1.00 0.00 N ATOM 306 CA PHE C 20 55.483 -3.257 -3.821 1.00 0.00 C ATOM 307 C PHE C 20 56.593 -3.592 -4.819 1.00 0.00 C ATOM 308 O PHE C 20 57.437 -2.770 -5.119 1.00 0.00 O ATOM 309 CB PHE C 20 55.624 -4.104 -2.556 1.00 0.00 C ATOM 310 CG PHE C 20 54.566 -3.695 -1.559 1.00 0.00 C ATOM 311 CD1 PHE C 20 54.576 -2.404 -1.019 1.00 0.00 C ATOM 312 CD2 PHE C 20 53.575 -4.607 -1.177 1.00 0.00 C ATOM 313 CE1 PHE C 20 53.594 -2.024 -0.096 1.00 0.00 C ATOM 314 CE2 PHE C 20 52.593 -4.226 -0.255 1.00 0.00 C ATOM 315 CZ PHE C 20 52.603 -2.935 0.286 1.00 0.00 C ATOM 0 H PHE C 20 53.701 -4.427 -3.949 1.00 0.00 H new ATOM 0 HA PHE C 20 55.560 -2.191 -3.607 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.521 -5.161 -2.800 1.00 0.00 H new ATOM 0 HB3 PHE C 20 56.616 -3.972 -2.125 1.00 0.00 H new ATOM 0 HD1 PHE C 20 55.341 -1.701 -1.314 1.00 0.00 H new ATOM 0 HD2 PHE C 20 53.568 -5.604 -1.593 1.00 0.00 H new ATOM 0 HE1 PHE C 20 53.601 -1.028 0.321 1.00 0.00 H new ATOM 0 HE2 PHE C 20 51.827 -4.928 0.039 1.00 0.00 H new ATOM 0 HZ PHE C 20 51.846 -2.642 0.998 1.00 0.00 H new ATOM 325 N LYS C 21 56.598 -4.789 -5.338 1.00 0.00 N ATOM 326 CA LYS C 21 57.657 -5.165 -6.319 1.00 0.00 C ATOM 327 C LYS C 21 57.861 -4.026 -7.318 1.00 0.00 C ATOM 328 O LYS C 21 58.933 -3.844 -7.859 1.00 0.00 O ATOM 329 CB LYS C 21 57.122 -6.414 -7.021 1.00 0.00 C ATOM 330 CG LYS C 21 55.953 -6.031 -7.928 1.00 0.00 C ATOM 331 CD LYS C 21 56.488 -5.544 -9.275 1.00 0.00 C ATOM 332 CE LYS C 21 56.118 -6.552 -10.367 1.00 0.00 C ATOM 333 NZ LYS C 21 56.914 -6.148 -11.560 1.00 0.00 N ATOM 0 H LYS C 21 55.919 -5.520 -5.127 1.00 0.00 H new ATOM 0 HA LYS C 21 58.621 -5.353 -5.846 1.00 0.00 H new ATOM 0 HB2 LYS C 21 57.913 -6.881 -7.608 1.00 0.00 H new ATOM 0 HB3 LYS C 21 56.798 -7.148 -6.283 1.00 0.00 H new ATOM 0 HG2 LYS C 21 55.297 -6.889 -8.074 1.00 0.00 H new ATOM 0 HG3 LYS C 21 55.356 -5.249 -7.458 1.00 0.00 H new ATOM 0 HD2 LYS C 21 56.070 -4.566 -9.512 1.00 0.00 H new ATOM 0 HD3 LYS C 21 57.570 -5.425 -9.227 1.00 0.00 H new ATOM 0 HE2 LYS C 21 56.358 -7.570 -10.060 1.00 0.00 H new ATOM 0 HE3 LYS C 21 55.049 -6.527 -10.580 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 56.711 -6.795 -12.348 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 56.660 -5.178 -11.835 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 57.928 -6.189 -11.331 1.00 0.00 H new ATOM 347 N ALA C 22 56.841 -3.247 -7.556 1.00 0.00 N ATOM 348 CA ALA C 22 56.978 -2.109 -8.507 1.00 0.00 C ATOM 349 C ALA C 22 57.793 -0.991 -7.854 1.00 0.00 C ATOM 350 O ALA C 22 58.864 -0.642 -8.309 1.00 0.00 O ATOM 351 CB ALA C 22 55.549 -1.645 -8.781 1.00 0.00 C ATOM 0 H ALA C 22 55.919 -3.350 -7.133 1.00 0.00 H new ATOM 0 HA ALA C 22 57.492 -2.390 -9.426 1.00 0.00 H new ATOM 0 HB1 ALA C 22 55.566 -0.806 -9.476 1.00 0.00 H new ATOM 0 HB2 ALA C 22 54.977 -2.465 -9.216 1.00 0.00 H new ATOM 0 HB3 ALA C 22 55.082 -1.333 -7.847 1.00 0.00 H new ATOM 357 N ALA C 23 57.298 -0.435 -6.782 1.00 0.00 N ATOM 358 CA ALA C 23 58.049 0.651 -6.092 1.00 0.00 C ATOM 359 C ALA C 23 59.482 0.192 -5.818 1.00 0.00 C ATOM 360 O ALA C 23 60.435 0.890 -6.101 1.00 0.00 O ATOM 361 CB ALA C 23 57.299 0.882 -4.781 1.00 0.00 C ATOM 0 H ALA C 23 56.406 -0.686 -6.355 1.00 0.00 H new ATOM 0 HA ALA C 23 58.109 1.562 -6.688 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.793 1.671 -4.213 1.00 0.00 H new ATOM 0 HB2 ALA C 23 56.272 1.178 -4.996 1.00 0.00 H new ATOM 0 HB3 ALA C 23 57.296 -0.038 -4.196 1.00 0.00 H new ATOM 367 N PHE C 24 59.638 -0.984 -5.272 1.00 0.00 N ATOM 368 CA PHE C 24 61.007 -1.498 -4.983 1.00 0.00 C ATOM 369 C PHE C 24 61.902 -1.316 -6.213 1.00 0.00 C ATOM 370 O PHE C 24 63.069 -1.001 -6.102 1.00 0.00 O ATOM 371 CB PHE C 24 60.811 -2.983 -4.671 1.00 0.00 C ATOM 372 CG PHE C 24 62.140 -3.696 -4.738 1.00 0.00 C ATOM 373 CD1 PHE C 24 63.045 -3.592 -3.675 1.00 0.00 C ATOM 374 CD2 PHE C 24 62.466 -4.465 -5.861 1.00 0.00 C ATOM 375 CE1 PHE C 24 64.276 -4.256 -3.736 1.00 0.00 C ATOM 376 CE2 PHE C 24 63.696 -5.129 -5.923 1.00 0.00 C ATOM 377 CZ PHE C 24 64.601 -5.025 -4.861 1.00 0.00 C ATOM 0 H PHE C 24 58.876 -1.611 -5.014 1.00 0.00 H new ATOM 0 HA PHE C 24 61.488 -0.971 -4.159 1.00 0.00 H new ATOM 0 HB2 PHE C 24 60.373 -3.102 -3.680 1.00 0.00 H new ATOM 0 HB3 PHE C 24 60.114 -3.425 -5.383 1.00 0.00 H new ATOM 0 HD1 PHE C 24 62.794 -2.999 -2.808 1.00 0.00 H new ATOM 0 HD2 PHE C 24 61.767 -4.546 -6.681 1.00 0.00 H new ATOM 0 HE1 PHE C 24 64.975 -4.175 -2.916 1.00 0.00 H new ATOM 0 HE2 PHE C 24 63.947 -5.722 -6.790 1.00 0.00 H new ATOM 0 HZ PHE C 24 65.550 -5.538 -4.909 1.00 0.00 H new ATOM 387 N ASP C 25 61.359 -1.507 -7.384 1.00 0.00 N ATOM 388 CA ASP C 25 62.178 -1.338 -8.619 1.00 0.00 C ATOM 389 C ASP C 25 62.475 0.146 -8.843 1.00 0.00 C ATOM 390 O ASP C 25 63.563 0.520 -9.237 1.00 0.00 O ATOM 391 CB ASP C 25 61.313 -1.891 -9.751 1.00 0.00 C ATOM 392 CG ASP C 25 62.034 -1.694 -11.086 1.00 0.00 C ATOM 393 OD1 ASP C 25 63.031 -2.364 -11.302 1.00 0.00 O ATOM 394 OD2 ASP C 25 61.579 -0.876 -11.868 1.00 0.00 O ATOM 0 H ASP C 25 60.386 -1.772 -7.540 1.00 0.00 H new ATOM 0 HA ASP C 25 63.137 -1.853 -8.557 1.00 0.00 H new ATOM 0 HB2 ASP C 25 61.113 -2.950 -9.586 1.00 0.00 H new ATOM 0 HB3 ASP C 25 60.349 -1.383 -9.768 1.00 0.00 H new ATOM 399 N ILE C 26 61.518 0.995 -8.588 1.00 0.00 N ATOM 400 CA ILE C 26 61.747 2.456 -8.777 1.00 0.00 C ATOM 401 C ILE C 26 62.738 2.965 -7.728 1.00 0.00 C ATOM 402 O ILE C 26 63.496 3.885 -7.966 1.00 0.00 O ATOM 403 CB ILE C 26 60.377 3.103 -8.571 1.00 0.00 C ATOM 404 CG1 ILE C 26 59.510 2.868 -9.810 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.547 4.607 -8.347 1.00 0.00 C ATOM 406 CD1 ILE C 26 58.633 1.636 -9.587 1.00 0.00 C ATOM 0 H ILE C 26 60.587 0.741 -8.257 1.00 0.00 H new ATOM 0 HA ILE C 26 62.163 2.688 -9.757 1.00 0.00 H new ATOM 0 HB ILE C 26 59.896 2.659 -7.699 1.00 0.00 H new ATOM 0 HG12 ILE C 26 58.887 3.742 -10.003 1.00 0.00 H new ATOM 0 HG13 ILE C 26 60.141 2.726 -10.688 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.569 5.066 -8.200 1.00 0.00 H new ATOM 0 HG22 ILE C 26 61.163 4.776 -7.464 1.00 0.00 H new ATOM 0 HG23 ILE C 26 61.030 5.052 -9.217 1.00 0.00 H new ATOM 0 HD11 ILE C 26 58.014 1.466 -10.468 1.00 0.00 H new ATOM 0 HD12 ILE C 26 59.266 0.765 -9.414 1.00 0.00 H new ATOM 0 HD13 ILE C 26 57.993 1.797 -8.719 1.00 0.00 H new ATOM 418 N PHE C 27 62.734 2.372 -6.565 1.00 0.00 N ATOM 419 CA PHE C 27 63.668 2.814 -5.491 1.00 0.00 C ATOM 420 C PHE C 27 65.119 2.572 -5.914 1.00 0.00 C ATOM 421 O PHE C 27 65.917 3.485 -5.981 1.00 0.00 O ATOM 422 CB PHE C 27 63.313 1.949 -4.282 1.00 0.00 C ATOM 423 CG PHE C 27 62.376 2.706 -3.370 1.00 0.00 C ATOM 424 CD1 PHE C 27 61.217 3.296 -3.887 1.00 0.00 C ATOM 425 CD2 PHE C 27 62.666 2.814 -2.004 1.00 0.00 C ATOM 426 CE1 PHE C 27 60.348 3.994 -3.040 1.00 0.00 C ATOM 427 CE2 PHE C 27 61.797 3.511 -1.157 1.00 0.00 C ATOM 428 CZ PHE C 27 60.638 4.101 -1.675 1.00 0.00 C ATOM 0 H PHE C 27 62.121 1.597 -6.312 1.00 0.00 H new ATOM 0 HA PHE C 27 63.575 3.879 -5.276 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.844 1.022 -4.612 1.00 0.00 H new ATOM 0 HB3 PHE C 27 64.219 1.674 -3.741 1.00 0.00 H new ATOM 0 HD1 PHE C 27 60.993 3.213 -4.940 1.00 0.00 H new ATOM 0 HD2 PHE C 27 63.560 2.359 -1.604 1.00 0.00 H new ATOM 0 HE1 PHE C 27 59.454 4.450 -3.440 1.00 0.00 H new ATOM 0 HE2 PHE C 27 62.021 3.594 -0.104 1.00 0.00 H new ATOM 0 HZ PHE C 27 59.967 4.639 -1.021 1.00 0.00 H new ATOM 438 N VAL C 28 65.468 1.346 -6.194 1.00 0.00 N ATOM 439 CA VAL C 28 66.871 1.042 -6.604 1.00 0.00 C ATOM 440 C VAL C 28 67.087 1.387 -8.080 1.00 0.00 C ATOM 441 O VAL C 28 68.142 1.148 -8.631 1.00 0.00 O ATOM 442 CB VAL C 28 67.026 -0.462 -6.384 1.00 0.00 C ATOM 443 CG1 VAL C 28 66.573 -0.820 -4.968 1.00 0.00 C ATOM 444 CG2 VAL C 28 66.163 -1.214 -7.400 1.00 0.00 C ATOM 0 H VAL C 28 64.843 0.541 -6.157 1.00 0.00 H new ATOM 0 HA VAL C 28 67.598 1.621 -6.035 1.00 0.00 H new ATOM 0 HB VAL C 28 68.071 -0.743 -6.512 1.00 0.00 H new ATOM 0 HG11 VAL C 28 66.684 -1.893 -4.811 1.00 0.00 H new ATOM 0 HG12 VAL C 28 67.185 -0.282 -4.243 1.00 0.00 H new ATOM 0 HG13 VAL C 28 65.527 -0.540 -4.839 1.00 0.00 H new ATOM 0 HG21 VAL C 28 66.271 -2.288 -7.246 1.00 0.00 H new ATOM 0 HG22 VAL C 28 65.118 -0.932 -7.269 1.00 0.00 H new ATOM 0 HG23 VAL C 28 66.484 -0.958 -8.410 1.00 0.00 H new ATOM 454 N LEU C 29 66.102 1.943 -8.729 1.00 0.00 N ATOM 455 CA LEU C 29 66.270 2.292 -10.169 1.00 0.00 C ATOM 456 C LEU C 29 67.618 2.988 -10.384 1.00 0.00 C ATOM 457 O LEU C 29 67.773 4.161 -10.110 1.00 0.00 O ATOM 458 CB LEU C 29 65.116 3.241 -10.492 1.00 0.00 C ATOM 459 CG LEU C 29 64.751 3.107 -11.971 1.00 0.00 C ATOM 460 CD1 LEU C 29 63.344 3.659 -12.204 1.00 0.00 C ATOM 461 CD2 LEU C 29 65.753 3.898 -12.815 1.00 0.00 C ATOM 0 H LEU C 29 65.192 2.170 -8.328 1.00 0.00 H new ATOM 0 HA LEU C 29 66.257 1.412 -10.812 1.00 0.00 H new ATOM 0 HB2 LEU C 29 64.252 3.007 -9.870 1.00 0.00 H new ATOM 0 HB3 LEU C 29 65.401 4.269 -10.268 1.00 0.00 H new ATOM 0 HG LEU C 29 64.780 2.056 -12.258 1.00 0.00 H new ATOM 0 HD11 LEU C 29 63.085 3.563 -13.259 1.00 0.00 H new ATOM 0 HD12 LEU C 29 62.629 3.098 -11.602 1.00 0.00 H new ATOM 0 HD13 LEU C 29 63.313 4.710 -11.917 1.00 0.00 H new ATOM 0 HD21 LEU C 29 65.495 3.804 -13.870 1.00 0.00 H new ATOM 0 HD22 LEU C 29 65.722 4.949 -12.526 1.00 0.00 H new ATOM 0 HD23 LEU C 29 66.757 3.506 -12.651 1.00 0.00 H new ATOM 473 N GLY C 30 68.593 2.271 -10.872 1.00 0.00 N ATOM 474 CA GLY C 30 69.931 2.888 -11.103 1.00 0.00 C ATOM 475 C GLY C 30 70.940 2.303 -10.114 1.00 0.00 C ATOM 476 O GLY C 30 72.136 2.419 -10.290 1.00 0.00 O ATOM 0 H GLY C 30 68.521 1.284 -11.121 1.00 0.00 H new ATOM 0 HA2 GLY C 30 70.258 2.701 -12.126 1.00 0.00 H new ATOM 0 HA3 GLY C 30 69.871 3.969 -10.980 1.00 0.00 H new ATOM 480 N ALA C 31 70.466 1.674 -9.072 1.00 0.00 N ATOM 481 CA ALA C 31 71.396 1.080 -8.069 1.00 0.00 C ATOM 482 C ALA C 31 72.308 0.045 -8.735 1.00 0.00 C ATOM 483 O ALA C 31 72.647 0.158 -9.896 1.00 0.00 O ATOM 484 CB ALA C 31 70.487 0.407 -7.039 1.00 0.00 C ATOM 0 H ALA C 31 69.474 1.546 -8.872 1.00 0.00 H new ATOM 0 HA ALA C 31 72.046 1.829 -7.616 1.00 0.00 H new ATOM 0 HB1 ALA C 31 71.097 -0.056 -6.263 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.832 1.153 -6.589 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.883 -0.356 -7.530 1.00 0.00 H new ATOM 490 N GLU C 32 72.707 -0.964 -8.008 1.00 0.00 N ATOM 491 CA GLU C 32 73.596 -2.003 -8.601 1.00 0.00 C ATOM 492 C GLU C 32 73.202 -3.393 -8.095 1.00 0.00 C ATOM 493 O GLU C 32 72.844 -4.264 -8.862 1.00 0.00 O ATOM 494 CB GLU C 32 75.004 -1.640 -8.124 1.00 0.00 C ATOM 495 CG GLU C 32 76.023 -2.563 -8.795 1.00 0.00 C ATOM 496 CD GLU C 32 76.917 -3.198 -7.729 1.00 0.00 C ATOM 497 OE1 GLU C 32 76.385 -3.866 -6.857 1.00 0.00 O ATOM 498 OE2 GLU C 32 78.120 -3.007 -7.802 1.00 0.00 O ATOM 0 H GLU C 32 72.456 -1.113 -7.031 1.00 0.00 H new ATOM 0 HA GLU C 32 73.527 -2.030 -9.688 1.00 0.00 H new ATOM 0 HB2 GLU C 32 75.225 -0.600 -8.366 1.00 0.00 H new ATOM 0 HB3 GLU C 32 75.069 -1.736 -7.040 1.00 0.00 H new ATOM 0 HG2 GLU C 32 75.509 -3.339 -9.362 1.00 0.00 H new ATOM 0 HG3 GLU C 32 76.629 -1.999 -9.504 1.00 0.00 H new ATOM 505 N ASP C 33 73.270 -3.609 -6.810 1.00 0.00 N ATOM 506 CA ASP C 33 72.901 -4.946 -6.258 1.00 0.00 C ATOM 507 C ASP C 33 71.436 -4.955 -5.816 1.00 0.00 C ATOM 508 O ASP C 33 71.042 -5.723 -4.961 1.00 0.00 O ATOM 509 CB ASP C 33 73.824 -5.146 -5.056 1.00 0.00 C ATOM 510 CG ASP C 33 73.737 -6.597 -4.581 1.00 0.00 C ATOM 511 OD1 ASP C 33 73.601 -7.468 -5.425 1.00 0.00 O ATOM 512 OD2 ASP C 33 73.807 -6.813 -3.383 1.00 0.00 O ATOM 0 H ASP C 33 73.564 -2.920 -6.118 1.00 0.00 H new ATOM 0 HA ASP C 33 73.012 -5.740 -6.996 1.00 0.00 H new ATOM 0 HB2 ASP C 33 74.851 -4.902 -5.328 1.00 0.00 H new ATOM 0 HB3 ASP C 33 73.539 -4.471 -4.249 1.00 0.00 H new ATOM 517 N GLY C 34 70.626 -4.110 -6.392 1.00 0.00 N ATOM 518 CA GLY C 34 69.188 -4.075 -6.003 1.00 0.00 C ATOM 519 C GLY C 34 69.064 -3.688 -4.529 1.00 0.00 C ATOM 520 O GLY C 34 68.221 -4.192 -3.813 1.00 0.00 O ATOM 0 H GLY C 34 70.897 -3.443 -7.114 1.00 0.00 H new ATOM 0 HA2 GLY C 34 68.650 -3.358 -6.624 1.00 0.00 H new ATOM 0 HA3 GLY C 34 68.731 -5.050 -6.173 1.00 0.00 H new ATOM 524 N CYS C 35 69.894 -2.793 -4.067 1.00 0.00 N ATOM 525 CA CYS C 35 69.818 -2.372 -2.639 1.00 0.00 C ATOM 526 C CYS C 35 69.427 -0.895 -2.549 1.00 0.00 C ATOM 527 O CYS C 35 69.498 -0.166 -3.519 1.00 0.00 O ATOM 528 CB CYS C 35 71.225 -2.590 -2.082 1.00 0.00 C ATOM 529 SG CYS C 35 71.465 -4.347 -1.719 1.00 0.00 S ATOM 0 H CYS C 35 70.621 -2.335 -4.616 1.00 0.00 H new ATOM 0 HA CYS C 35 69.071 -2.936 -2.081 1.00 0.00 H new ATOM 0 HB2 CYS C 35 71.969 -2.252 -2.803 1.00 0.00 H new ATOM 0 HB3 CYS C 35 71.365 -1.998 -1.177 1.00 0.00 H new ATOM 0 HG CYS C 35 71.343 -5.037 -2.814 1.00 0.00 H new ATOM 535 N ILE C 36 69.012 -0.448 -1.397 1.00 0.00 N ATOM 536 CA ILE C 36 68.615 0.982 -1.254 1.00 0.00 C ATOM 537 C ILE C 36 69.503 1.682 -0.223 1.00 0.00 C ATOM 538 O ILE C 36 70.027 1.067 0.684 1.00 0.00 O ATOM 539 CB ILE C 36 67.167 0.947 -0.769 1.00 0.00 C ATOM 540 CG1 ILE C 36 66.254 0.483 -1.908 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.746 2.347 -0.321 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.985 -0.141 -1.322 1.00 0.00 C ATOM 0 H ILE C 36 68.930 -1.009 -0.549 1.00 0.00 H new ATOM 0 HA ILE C 36 68.721 1.530 -2.190 1.00 0.00 H new ATOM 0 HB ILE C 36 67.084 0.254 0.068 1.00 0.00 H new ATOM 0 HG12 ILE C 36 65.995 1.327 -2.548 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.774 -0.243 -2.533 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.713 2.323 0.025 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.393 2.679 0.491 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.832 3.038 -1.159 1.00 0.00 H new ATOM 0 HD11 ILE C 36 64.335 -0.471 -2.132 1.00 0.00 H new ATOM 0 HD12 ILE C 36 65.253 -0.995 -0.700 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.462 0.599 -0.716 1.00 0.00 H new ATOM 554 N SER C 37 69.672 2.967 -0.359 1.00 0.00 N ATOM 555 CA SER C 37 70.520 3.725 0.604 1.00 0.00 C ATOM 556 C SER C 37 70.144 5.200 0.561 1.00 0.00 C ATOM 557 O SER C 37 70.988 6.071 0.545 1.00 0.00 O ATOM 558 CB SER C 37 71.938 3.538 0.100 1.00 0.00 C ATOM 559 OG SER C 37 72.677 2.764 1.034 1.00 0.00 O ATOM 0 H SER C 37 69.256 3.529 -1.101 1.00 0.00 H new ATOM 0 HA SER C 37 70.398 3.381 1.631 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.927 3.042 -0.871 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.415 4.508 -0.042 1.00 0.00 H new ATOM 0 HG SER C 37 73.593 2.643 0.706 1.00 0.00 H new ATOM 565 N THR C 38 68.876 5.470 0.513 1.00 0.00 N ATOM 566 CA THR C 38 68.383 6.882 0.436 1.00 0.00 C ATOM 567 C THR C 38 68.681 7.438 -0.957 1.00 0.00 C ATOM 568 O THR C 38 67.797 7.880 -1.660 1.00 0.00 O ATOM 569 CB THR C 38 69.127 7.685 1.518 1.00 0.00 C ATOM 570 OG1 THR C 38 70.330 8.214 0.979 1.00 0.00 O ATOM 571 CG2 THR C 38 69.446 6.795 2.725 1.00 0.00 C ATOM 0 H THR C 38 68.140 4.764 0.524 1.00 0.00 H new ATOM 0 HA THR C 38 67.308 6.943 0.603 1.00 0.00 H new ATOM 0 HB THR C 38 68.487 8.503 1.849 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.022 7.520 0.980 1.00 0.00 H new ATOM 0 HG21 THR C 38 69.972 7.380 3.479 1.00 0.00 H new ATOM 0 HG22 THR C 38 68.518 6.408 3.147 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.075 5.963 2.408 1.00 0.00 H new ATOM 579 N LYS C 39 69.918 7.399 -1.377 1.00 0.00 N ATOM 580 CA LYS C 39 70.246 7.904 -2.740 1.00 0.00 C ATOM 581 C LYS C 39 69.274 7.280 -3.743 1.00 0.00 C ATOM 582 O LYS C 39 68.825 7.918 -4.675 1.00 0.00 O ATOM 583 CB LYS C 39 71.678 7.436 -3.007 1.00 0.00 C ATOM 584 CG LYS C 39 72.637 8.175 -2.070 1.00 0.00 C ATOM 585 CD LYS C 39 74.039 7.578 -2.198 1.00 0.00 C ATOM 586 CE LYS C 39 75.079 8.622 -1.785 1.00 0.00 C ATOM 587 NZ LYS C 39 75.395 8.311 -0.364 1.00 0.00 N ATOM 0 H LYS C 39 70.708 7.042 -0.840 1.00 0.00 H new ATOM 0 HA LYS C 39 70.163 8.987 -2.827 1.00 0.00 H new ATOM 0 HB2 LYS C 39 71.756 6.360 -2.850 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.947 7.627 -4.046 1.00 0.00 H new ATOM 0 HG2 LYS C 39 72.658 9.236 -2.318 1.00 0.00 H new ATOM 0 HG3 LYS C 39 72.289 8.095 -1.040 1.00 0.00 H new ATOM 0 HD2 LYS C 39 74.127 6.693 -1.569 1.00 0.00 H new ATOM 0 HD3 LYS C 39 74.217 7.258 -3.225 1.00 0.00 H new ATOM 0 HE2 LYS C 39 75.970 8.560 -2.410 1.00 0.00 H new ATOM 0 HE3 LYS C 39 74.686 9.633 -1.890 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 76.103 8.986 -0.010 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 74.530 8.385 0.208 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 75.774 7.345 -0.296 1.00 0.00 H new ATOM 601 N GLU C 40 68.927 6.038 -3.535 1.00 0.00 N ATOM 602 CA GLU C 40 67.960 5.361 -4.445 1.00 0.00 C ATOM 603 C GLU C 40 66.551 5.534 -3.882 1.00 0.00 C ATOM 604 O GLU C 40 65.577 5.607 -4.603 1.00 0.00 O ATOM 605 CB GLU C 40 68.346 3.879 -4.431 1.00 0.00 C ATOM 606 CG GLU C 40 69.865 3.728 -4.525 1.00 0.00 C ATOM 607 CD GLU C 40 70.453 3.576 -3.120 1.00 0.00 C ATOM 608 OE1 GLU C 40 70.521 4.572 -2.418 1.00 0.00 O ATOM 609 OE2 GLU C 40 70.824 2.468 -2.770 1.00 0.00 O ATOM 0 H GLU C 40 69.274 5.461 -2.769 1.00 0.00 H new ATOM 0 HA GLU C 40 67.982 5.770 -5.455 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.982 3.410 -3.517 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.870 3.364 -5.265 1.00 0.00 H new ATOM 0 HG2 GLU C 40 70.117 2.859 -5.132 1.00 0.00 H new ATOM 0 HG3 GLU C 40 70.297 4.598 -5.019 1.00 0.00 H new ATOM 616 N LEU C 41 66.448 5.595 -2.583 1.00 0.00 N ATOM 617 CA LEU C 41 65.120 5.756 -1.930 1.00 0.00 C ATOM 618 C LEU C 41 64.669 7.223 -2.006 1.00 0.00 C ATOM 619 O LEU C 41 63.658 7.538 -2.603 1.00 0.00 O ATOM 620 CB LEU C 41 65.366 5.303 -0.480 1.00 0.00 C ATOM 621 CG LEU C 41 64.528 6.126 0.503 1.00 0.00 C ATOM 622 CD1 LEU C 41 63.078 6.170 0.027 1.00 0.00 C ATOM 623 CD2 LEU C 41 64.587 5.478 1.888 1.00 0.00 C ATOM 0 H LEU C 41 67.237 5.539 -1.939 1.00 0.00 H new ATOM 0 HA LEU C 41 64.327 5.179 -2.405 1.00 0.00 H new ATOM 0 HB2 LEU C 41 65.118 4.246 -0.379 1.00 0.00 H new ATOM 0 HB3 LEU C 41 66.424 5.407 -0.237 1.00 0.00 H new ATOM 0 HG LEU C 41 64.924 7.140 0.556 1.00 0.00 H new ATOM 0 HD11 LEU C 41 62.483 6.756 0.727 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.033 6.629 -0.960 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.682 5.156 -0.026 1.00 0.00 H new ATOM 0 HD21 LEU C 41 63.991 6.063 2.589 1.00 0.00 H new ATOM 0 HD22 LEU C 41 64.191 4.464 1.832 1.00 0.00 H new ATOM 0 HD23 LEU C 41 65.621 5.445 2.231 1.00 0.00 H new ATOM 635 N GLY C 42 65.405 8.113 -1.401 1.00 0.00 N ATOM 636 CA GLY C 42 65.018 9.552 -1.431 1.00 0.00 C ATOM 637 C GLY C 42 64.538 9.935 -2.833 1.00 0.00 C ATOM 638 O GLY C 42 63.737 10.833 -3.001 1.00 0.00 O ATOM 0 H GLY C 42 66.260 7.906 -0.885 1.00 0.00 H new ATOM 0 HA2 GLY C 42 64.229 9.740 -0.703 1.00 0.00 H new ATOM 0 HA3 GLY C 42 65.868 10.172 -1.147 1.00 0.00 H new ATOM 642 N LYS C 43 65.019 9.262 -3.842 1.00 0.00 N ATOM 643 CA LYS C 43 64.585 9.596 -5.231 1.00 0.00 C ATOM 644 C LYS C 43 63.060 9.528 -5.338 1.00 0.00 C ATOM 645 O LYS C 43 62.455 10.207 -6.145 1.00 0.00 O ATOM 646 CB LYS C 43 65.232 8.530 -6.117 1.00 0.00 C ATOM 647 CG LYS C 43 66.534 9.077 -6.706 1.00 0.00 C ATOM 648 CD LYS C 43 66.517 8.913 -8.225 1.00 0.00 C ATOM 649 CE LYS C 43 67.613 7.931 -8.646 1.00 0.00 C ATOM 650 NZ LYS C 43 68.891 8.618 -8.313 1.00 0.00 N ATOM 0 H LYS C 43 65.691 8.498 -3.767 1.00 0.00 H new ATOM 0 HA LYS C 43 64.880 10.603 -5.525 1.00 0.00 H new ATOM 0 HB2 LYS C 43 65.433 7.631 -5.534 1.00 0.00 H new ATOM 0 HB3 LYS C 43 64.550 8.245 -6.918 1.00 0.00 H new ATOM 0 HG2 LYS C 43 66.650 10.129 -6.445 1.00 0.00 H new ATOM 0 HG3 LYS C 43 67.387 8.548 -6.282 1.00 0.00 H new ATOM 0 HD2 LYS C 43 65.543 8.548 -8.551 1.00 0.00 H new ATOM 0 HD3 LYS C 43 66.674 9.878 -8.707 1.00 0.00 H new ATOM 0 HE2 LYS C 43 67.522 6.985 -8.112 1.00 0.00 H new ATOM 0 HE3 LYS C 43 67.552 7.704 -9.710 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 69.605 8.391 -9.034 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 68.737 9.646 -8.291 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 69.225 8.298 -7.382 1.00 0.00 H new ATOM 664 N VAL C 44 62.433 8.715 -4.534 1.00 0.00 N ATOM 665 CA VAL C 44 60.947 8.606 -4.592 1.00 0.00 C ATOM 666 C VAL C 44 60.302 9.680 -3.713 1.00 0.00 C ATOM 667 O VAL C 44 59.296 10.262 -4.066 1.00 0.00 O ATOM 668 CB VAL C 44 60.631 7.209 -4.057 1.00 0.00 C ATOM 669 CG1 VAL C 44 59.144 7.122 -3.707 1.00 0.00 C ATOM 670 CG2 VAL C 44 60.965 6.168 -5.128 1.00 0.00 C ATOM 0 H VAL C 44 62.885 8.121 -3.839 1.00 0.00 H new ATOM 0 HA VAL C 44 60.561 8.751 -5.601 1.00 0.00 H new ATOM 0 HB VAL C 44 61.226 7.017 -3.164 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.918 6.126 -3.325 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.905 7.865 -2.946 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.548 7.313 -4.600 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.741 5.171 -4.749 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.369 6.360 -6.020 1.00 0.00 H new ATOM 0 HG23 VAL C 44 62.024 6.231 -5.379 1.00 0.00 H new ATOM 680 N MET C 45 60.872 9.949 -2.570 1.00 0.00 N ATOM 681 CA MET C 45 60.288 10.986 -1.672 1.00 0.00 C ATOM 682 C MET C 45 60.079 12.290 -2.446 1.00 0.00 C ATOM 683 O MET C 45 59.187 13.061 -2.152 1.00 0.00 O ATOM 684 CB MET C 45 61.321 11.178 -0.562 1.00 0.00 C ATOM 685 CG MET C 45 60.930 10.331 0.651 1.00 0.00 C ATOM 686 SD MET C 45 60.822 8.592 0.162 1.00 0.00 S ATOM 687 CE MET C 45 59.054 8.568 -0.225 1.00 0.00 C ATOM 0 H MET C 45 61.716 9.496 -2.219 1.00 0.00 H new ATOM 0 HA MET C 45 59.317 10.692 -1.274 1.00 0.00 H new ATOM 0 HB2 MET C 45 62.310 10.889 -0.917 1.00 0.00 H new ATOM 0 HB3 MET C 45 61.378 12.230 -0.281 1.00 0.00 H new ATOM 0 HG2 MET C 45 61.667 10.452 1.445 1.00 0.00 H new ATOM 0 HG3 MET C 45 59.973 10.668 1.050 1.00 0.00 H new ATOM 0 HE1 MET C 45 58.714 7.536 -0.312 1.00 0.00 H new ATOM 0 HE2 MET C 45 58.501 9.067 0.571 1.00 0.00 H new ATOM 0 HE3 MET C 45 58.881 9.087 -1.168 1.00 0.00 H new ATOM 697 N ARG C 46 60.892 12.539 -3.435 1.00 0.00 N ATOM 698 CA ARG C 46 60.737 13.789 -4.231 1.00 0.00 C ATOM 699 C ARG C 46 59.562 13.648 -5.200 1.00 0.00 C ATOM 700 O ARG C 46 58.939 14.617 -5.584 1.00 0.00 O ATOM 701 CB ARG C 46 62.050 13.938 -5.000 1.00 0.00 C ATOM 702 CG ARG C 46 63.002 14.840 -4.216 1.00 0.00 C ATOM 703 CD ARG C 46 64.448 14.443 -4.518 1.00 0.00 C ATOM 704 NE ARG C 46 64.978 15.542 -5.373 1.00 0.00 N ATOM 705 CZ ARG C 46 66.233 15.542 -5.730 1.00 0.00 C ATOM 706 NH1 ARG C 46 67.152 15.162 -4.884 1.00 0.00 N ATOM 707 NH2 ARG C 46 66.570 15.923 -6.932 1.00 0.00 N ATOM 0 H ARG C 46 61.657 11.931 -3.727 1.00 0.00 H new ATOM 0 HA ARG C 46 60.534 14.657 -3.604 1.00 0.00 H new ATOM 0 HB2 ARG C 46 62.505 12.960 -5.156 1.00 0.00 H new ATOM 0 HB3 ARG C 46 61.860 14.362 -5.986 1.00 0.00 H new ATOM 0 HG2 ARG C 46 62.836 15.883 -4.486 1.00 0.00 H new ATOM 0 HG3 ARG C 46 62.805 14.752 -3.147 1.00 0.00 H new ATOM 0 HD2 ARG C 46 65.029 14.341 -3.601 1.00 0.00 H new ATOM 0 HD3 ARG C 46 64.495 13.484 -5.034 1.00 0.00 H new ATOM 0 HE ARG C 46 64.360 16.294 -5.679 1.00 0.00 H new ATOM 0 HH11 ARG C 46 66.889 14.865 -3.944 1.00 0.00 H new ATOM 0 HH12 ARG C 46 68.133 15.162 -5.163 1.00 0.00 H new ATOM 0 HH21 ARG C 46 65.852 16.221 -7.593 1.00 0.00 H new ATOM 0 HH22 ARG C 46 67.551 15.923 -7.211 1.00 0.00 H new ATOM 721 N MET C 47 59.256 12.443 -5.596 1.00 0.00 N ATOM 722 CA MET C 47 58.122 12.230 -6.538 1.00 0.00 C ATOM 723 C MET C 47 56.803 12.166 -5.766 1.00 0.00 C ATOM 724 O MET C 47 55.746 12.446 -6.297 1.00 0.00 O ATOM 725 CB MET C 47 58.422 10.894 -7.216 1.00 0.00 C ATOM 726 CG MET C 47 59.582 11.072 -8.199 1.00 0.00 C ATOM 727 SD MET C 47 60.590 9.571 -8.221 1.00 0.00 S ATOM 728 CE MET C 47 59.320 8.463 -8.876 1.00 0.00 C ATOM 0 H MET C 47 59.744 11.595 -5.307 1.00 0.00 H new ATOM 0 HA MET C 47 58.022 13.038 -7.263 1.00 0.00 H new ATOM 0 HB2 MET C 47 58.677 10.143 -6.468 1.00 0.00 H new ATOM 0 HB3 MET C 47 57.538 10.534 -7.741 1.00 0.00 H new ATOM 0 HG2 MET C 47 59.198 11.279 -9.198 1.00 0.00 H new ATOM 0 HG3 MET C 47 60.191 11.928 -7.908 1.00 0.00 H new ATOM 0 HE1 MET C 47 59.786 7.713 -9.516 1.00 0.00 H new ATOM 0 HE2 MET C 47 58.808 7.968 -8.051 1.00 0.00 H new ATOM 0 HE3 MET C 47 58.599 9.039 -9.457 1.00 0.00 H new ATOM 738 N LEU C 48 56.856 11.802 -4.513 1.00 0.00 N ATOM 739 CA LEU C 48 55.603 11.728 -3.706 1.00 0.00 C ATOM 740 C LEU C 48 55.107 13.137 -3.377 1.00 0.00 C ATOM 741 O LEU C 48 54.046 13.317 -2.814 1.00 0.00 O ATOM 742 CB LEU C 48 55.993 10.983 -2.427 1.00 0.00 C ATOM 743 CG LEU C 48 56.393 9.543 -2.764 1.00 0.00 C ATOM 744 CD1 LEU C 48 56.403 8.705 -1.485 1.00 0.00 C ATOM 745 CD2 LEU C 48 55.386 8.945 -3.751 1.00 0.00 C ATOM 0 H LEU C 48 57.710 11.553 -4.014 1.00 0.00 H new ATOM 0 HA LEU C 48 54.798 11.222 -4.239 1.00 0.00 H new ATOM 0 HB2 LEU C 48 56.821 11.494 -1.936 1.00 0.00 H new ATOM 0 HB3 LEU C 48 55.158 10.983 -1.727 1.00 0.00 H new ATOM 0 HG LEU C 48 57.386 9.541 -3.213 1.00 0.00 H new ATOM 0 HD11 LEU C 48 56.687 7.680 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.120 9.126 -0.780 1.00 0.00 H new ATOM 0 HD13 LEU C 48 55.409 8.711 -1.038 1.00 0.00 H new ATOM 0 HD21 LEU C 48 55.674 7.921 -3.988 1.00 0.00 H new ATOM 0 HD22 LEU C 48 54.392 8.948 -3.304 1.00 0.00 H new ATOM 0 HD23 LEU C 48 55.375 9.540 -4.664 1.00 0.00 H new ATOM 757 N GLY C 49 55.869 14.139 -3.722 1.00 0.00 N ATOM 758 CA GLY C 49 55.443 15.536 -3.430 1.00 0.00 C ATOM 759 C GLY C 49 56.039 15.981 -2.093 1.00 0.00 C ATOM 760 O GLY C 49 55.506 16.842 -1.421 1.00 0.00 O ATOM 0 H GLY C 49 56.769 14.050 -4.194 1.00 0.00 H new ATOM 0 HA2 GLY C 49 55.773 16.202 -4.227 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.355 15.596 -3.394 1.00 0.00 H new ATOM 764 N GLN C 50 57.142 15.403 -1.701 1.00 0.00 N ATOM 765 CA GLN C 50 57.768 15.795 -0.406 1.00 0.00 C ATOM 766 C GLN C 50 59.294 15.711 -0.503 1.00 0.00 C ATOM 767 O GLN C 50 59.854 15.619 -1.578 1.00 0.00 O ATOM 768 CB GLN C 50 57.241 14.783 0.611 1.00 0.00 C ATOM 769 CG GLN C 50 55.917 15.283 1.189 1.00 0.00 C ATOM 770 CD GLN C 50 55.020 14.087 1.514 1.00 0.00 C ATOM 771 OE1 GLN C 50 55.126 13.048 0.894 1.00 0.00 O ATOM 772 NE2 GLN C 50 54.134 14.192 2.467 1.00 0.00 N ATOM 0 H GLN C 50 57.636 14.677 -2.221 1.00 0.00 H new ATOM 0 HA GLN C 50 57.525 16.820 -0.127 1.00 0.00 H new ATOM 0 HB2 GLN C 50 57.099 13.813 0.135 1.00 0.00 H new ATOM 0 HB3 GLN C 50 57.969 14.642 1.410 1.00 0.00 H new ATOM 0 HG2 GLN C 50 56.099 15.870 2.089 1.00 0.00 H new ATOM 0 HG3 GLN C 50 55.421 15.940 0.475 1.00 0.00 H new ATOM 0 HE21 GLN C 50 54.046 15.065 2.987 1.00 0.00 H new ATOM 0 HE22 GLN C 50 53.530 13.401 2.691 1.00 0.00 H new ATOM 781 N ASN C 51 59.967 15.742 0.614 1.00 0.00 N ATOM 782 CA ASN C 51 61.455 15.664 0.597 1.00 0.00 C ATOM 783 C ASN C 51 62.000 15.752 2.026 1.00 0.00 C ATOM 784 O ASN C 51 62.198 16.829 2.550 1.00 0.00 O ATOM 785 CB ASN C 51 61.907 16.872 -0.224 1.00 0.00 C ATOM 786 CG ASN C 51 63.155 16.505 -1.028 1.00 0.00 C ATOM 787 OD1 ASN C 51 63.443 15.341 -1.229 1.00 0.00 O ATOM 788 ND2 ASN C 51 63.914 17.456 -1.502 1.00 0.00 N ATOM 0 H ASN C 51 59.549 15.818 1.541 1.00 0.00 H new ATOM 0 HA ASN C 51 61.816 14.727 0.173 1.00 0.00 H new ATOM 0 HB2 ASN C 51 61.109 17.188 -0.896 1.00 0.00 H new ATOM 0 HB3 ASN C 51 62.121 17.714 0.435 1.00 0.00 H new ATOM 0 HD21 ASN C 51 64.748 17.222 -2.041 1.00 0.00 H new ATOM 0 HD22 ASN C 51 63.673 18.433 -1.334 1.00 0.00 H new ATOM 795 N PRO C 52 62.218 14.604 2.608 1.00 0.00 N ATOM 796 CA PRO C 52 62.740 14.539 3.996 1.00 0.00 C ATOM 797 C PRO C 52 64.219 14.937 4.035 1.00 0.00 C ATOM 798 O PRO C 52 64.843 15.150 3.014 1.00 0.00 O ATOM 799 CB PRO C 52 62.564 13.072 4.374 1.00 0.00 C ATOM 800 CG PRO C 52 62.561 12.334 3.073 1.00 0.00 C ATOM 801 CD PRO C 52 62.002 13.272 2.035 1.00 0.00 C ATOM 0 HA PRO C 52 62.227 15.217 4.678 1.00 0.00 H new ATOM 0 HB2 PRO C 52 63.374 12.731 5.019 1.00 0.00 H new ATOM 0 HB3 PRO C 52 61.634 12.914 4.919 1.00 0.00 H new ATOM 0 HG2 PRO C 52 63.570 12.020 2.806 1.00 0.00 H new ATOM 0 HG3 PRO C 52 61.954 11.431 3.143 1.00 0.00 H new ATOM 0 HD2 PRO C 52 62.514 13.161 1.079 1.00 0.00 H new ATOM 0 HD3 PRO C 52 60.944 13.082 1.854 1.00 0.00 H new ATOM 809 N THR C 53 64.782 15.036 5.207 1.00 0.00 N ATOM 810 CA THR C 53 66.219 15.418 5.317 1.00 0.00 C ATOM 811 C THR C 53 67.107 14.188 5.110 1.00 0.00 C ATOM 812 O THR C 53 66.638 13.068 5.156 1.00 0.00 O ATOM 813 CB THR C 53 66.378 15.955 6.740 1.00 0.00 C ATOM 814 OG1 THR C 53 65.542 15.210 7.619 1.00 0.00 O ATOM 815 CG2 THR C 53 65.984 17.434 6.776 1.00 0.00 C ATOM 0 H THR C 53 64.309 14.869 6.095 1.00 0.00 H new ATOM 0 HA THR C 53 66.510 16.154 4.567 1.00 0.00 H new ATOM 0 HB THR C 53 67.416 15.855 7.057 1.00 0.00 H new ATOM 0 HG1 THR C 53 65.389 15.724 8.439 1.00 0.00 H new ATOM 0 HG21 THR C 53 66.098 17.816 7.790 1.00 0.00 H new ATOM 0 HG22 THR C 53 66.628 17.999 6.101 1.00 0.00 H new ATOM 0 HG23 THR C 53 64.946 17.542 6.462 1.00 0.00 H new ATOM 823 N PRO C 54 68.368 14.442 4.891 1.00 0.00 N ATOM 824 CA PRO C 54 69.340 13.342 4.680 1.00 0.00 C ATOM 825 C PRO C 54 69.614 12.618 6.000 1.00 0.00 C ATOM 826 O PRO C 54 70.025 11.476 6.021 1.00 0.00 O ATOM 827 CB PRO C 54 70.589 14.059 4.178 1.00 0.00 C ATOM 828 CG PRO C 54 70.474 15.454 4.706 1.00 0.00 C ATOM 829 CD PRO C 54 69.003 15.762 4.823 1.00 0.00 C ATOM 0 HA PRO C 54 68.987 12.581 3.984 1.00 0.00 H new ATOM 0 HB2 PRO C 54 71.495 13.573 4.540 1.00 0.00 H new ATOM 0 HB3 PRO C 54 70.637 14.052 3.089 1.00 0.00 H new ATOM 0 HG2 PRO C 54 70.964 15.541 5.676 1.00 0.00 H new ATOM 0 HG3 PRO C 54 70.964 16.161 4.037 1.00 0.00 H new ATOM 0 HD2 PRO C 54 68.789 16.354 5.713 1.00 0.00 H new ATOM 0 HD3 PRO C 54 68.645 16.333 3.966 1.00 0.00 H new ATOM 837 N GLU C 55 69.382 13.275 7.105 1.00 0.00 N ATOM 838 CA GLU C 55 69.622 12.623 8.425 1.00 0.00 C ATOM 839 C GLU C 55 68.437 11.724 8.785 1.00 0.00 C ATOM 840 O GLU C 55 68.586 10.719 9.451 1.00 0.00 O ATOM 841 CB GLU C 55 69.743 13.776 9.421 1.00 0.00 C ATOM 842 CG GLU C 55 70.170 13.228 10.785 1.00 0.00 C ATOM 843 CD GLU C 55 71.663 13.480 10.991 1.00 0.00 C ATOM 844 OE1 GLU C 55 72.372 13.567 10.001 1.00 0.00 O ATOM 845 OE2 GLU C 55 72.075 13.582 12.135 1.00 0.00 O ATOM 0 H GLU C 55 69.037 14.234 7.151 1.00 0.00 H new ATOM 0 HA GLU C 55 70.513 11.995 8.423 1.00 0.00 H new ATOM 0 HB2 GLU C 55 70.472 14.504 9.065 1.00 0.00 H new ATOM 0 HB3 GLU C 55 68.790 14.297 9.508 1.00 0.00 H new ATOM 0 HG2 GLU C 55 69.597 13.709 11.578 1.00 0.00 H new ATOM 0 HG3 GLU C 55 69.959 12.160 10.842 1.00 0.00 H new ATOM 852 N GLU C 56 67.262 12.081 8.347 1.00 0.00 N ATOM 853 CA GLU C 56 66.064 11.250 8.658 1.00 0.00 C ATOM 854 C GLU C 56 65.946 10.103 7.653 1.00 0.00 C ATOM 855 O GLU C 56 65.320 9.095 7.916 1.00 0.00 O ATOM 856 CB GLU C 56 64.877 12.204 8.528 1.00 0.00 C ATOM 857 CG GLU C 56 64.677 12.954 9.846 1.00 0.00 C ATOM 858 CD GLU C 56 63.208 12.870 10.263 1.00 0.00 C ATOM 859 OE1 GLU C 56 62.531 11.970 9.795 1.00 0.00 O ATOM 860 OE2 GLU C 56 62.786 13.706 11.044 1.00 0.00 O ATOM 0 H GLU C 56 67.079 12.913 7.786 1.00 0.00 H new ATOM 0 HA GLU C 56 66.116 10.800 9.649 1.00 0.00 H new ATOM 0 HB2 GLU C 56 65.053 12.912 7.718 1.00 0.00 H new ATOM 0 HB3 GLU C 56 63.975 11.647 8.274 1.00 0.00 H new ATOM 0 HG2 GLU C 56 65.311 12.524 10.621 1.00 0.00 H new ATOM 0 HG3 GLU C 56 64.975 13.996 9.732 1.00 0.00 H new ATOM 867 N LEU C 57 66.545 10.248 6.502 1.00 0.00 N ATOM 868 CA LEU C 57 66.470 9.164 5.482 1.00 0.00 C ATOM 869 C LEU C 57 67.072 7.874 6.045 1.00 0.00 C ATOM 870 O LEU C 57 66.469 6.821 5.991 1.00 0.00 O ATOM 871 CB LEU C 57 67.293 9.677 4.299 1.00 0.00 C ATOM 872 CG LEU C 57 66.359 9.980 3.127 1.00 0.00 C ATOM 873 CD1 LEU C 57 67.170 10.547 1.959 1.00 0.00 C ATOM 874 CD2 LEU C 57 65.664 8.690 2.684 1.00 0.00 C ATOM 0 H LEU C 57 67.082 11.069 6.224 1.00 0.00 H new ATOM 0 HA LEU C 57 65.445 8.934 5.191 1.00 0.00 H new ATOM 0 HB2 LEU C 57 67.840 10.575 4.584 1.00 0.00 H new ATOM 0 HB3 LEU C 57 68.033 8.932 4.006 1.00 0.00 H new ATOM 0 HG LEU C 57 65.612 10.710 3.438 1.00 0.00 H new ATOM 0 HD11 LEU C 57 66.503 10.763 1.124 1.00 0.00 H new ATOM 0 HD12 LEU C 57 67.667 11.465 2.273 1.00 0.00 H new ATOM 0 HD13 LEU C 57 67.918 9.818 1.647 1.00 0.00 H new ATOM 0 HD21 LEU C 57 64.998 8.904 1.848 1.00 0.00 H new ATOM 0 HD22 LEU C 57 66.413 7.961 2.373 1.00 0.00 H new ATOM 0 HD23 LEU C 57 65.086 8.285 3.514 1.00 0.00 H new ATOM 886 N GLN C 58 68.255 7.949 6.592 1.00 0.00 N ATOM 887 CA GLN C 58 68.887 6.728 7.166 1.00 0.00 C ATOM 888 C GLN C 58 67.954 6.105 8.207 1.00 0.00 C ATOM 889 O GLN C 58 68.047 4.935 8.520 1.00 0.00 O ATOM 890 CB GLN C 58 70.176 7.220 7.824 1.00 0.00 C ATOM 891 CG GLN C 58 71.274 6.169 7.652 1.00 0.00 C ATOM 892 CD GLN C 58 70.965 4.958 8.533 1.00 0.00 C ATOM 893 OE1 GLN C 58 70.535 5.105 9.659 1.00 0.00 O ATOM 894 NE2 GLN C 58 71.168 3.756 8.064 1.00 0.00 N ATOM 0 H GLN C 58 68.810 8.802 6.666 1.00 0.00 H new ATOM 0 HA GLN C 58 69.085 5.965 6.413 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.488 8.163 7.375 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.005 7.412 8.883 1.00 0.00 H new ATOM 0 HG2 GLN C 58 71.340 5.865 6.607 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.242 6.591 7.923 1.00 0.00 H new ATOM 0 HE21 GLN C 58 71.529 3.632 7.118 1.00 0.00 H new ATOM 0 HE22 GLN C 58 70.965 2.941 8.644 1.00 0.00 H new ATOM 903 N GLU C 59 67.052 6.882 8.742 1.00 0.00 N ATOM 904 CA GLU C 59 66.108 6.341 9.762 1.00 0.00 C ATOM 905 C GLU C 59 65.121 5.375 9.100 1.00 0.00 C ATOM 906 O GLU C 59 64.744 4.371 9.670 1.00 0.00 O ATOM 907 CB GLU C 59 65.376 7.565 10.313 1.00 0.00 C ATOM 908 CG GLU C 59 65.067 7.350 11.797 1.00 0.00 C ATOM 909 CD GLU C 59 66.112 8.075 12.647 1.00 0.00 C ATOM 910 OE1 GLU C 59 66.732 8.992 12.133 1.00 0.00 O ATOM 911 OE2 GLU C 59 66.274 7.702 13.796 1.00 0.00 O ATOM 0 H GLU C 59 66.928 7.869 8.517 1.00 0.00 H new ATOM 0 HA GLU C 59 66.619 5.786 10.549 1.00 0.00 H new ATOM 0 HB2 GLU C 59 65.989 8.457 10.184 1.00 0.00 H new ATOM 0 HB3 GLU C 59 64.452 7.730 9.758 1.00 0.00 H new ATOM 0 HG2 GLU C 59 64.070 7.725 12.030 1.00 0.00 H new ATOM 0 HG3 GLU C 59 65.069 6.285 12.029 1.00 0.00 H new ATOM 918 N MET C 60 64.704 5.668 7.898 1.00 0.00 N ATOM 919 CA MET C 60 63.746 4.765 7.201 1.00 0.00 C ATOM 920 C MET C 60 64.432 3.439 6.859 1.00 0.00 C ATOM 921 O MET C 60 63.787 2.432 6.640 1.00 0.00 O ATOM 922 CB MET C 60 63.353 5.510 5.925 1.00 0.00 C ATOM 923 CG MET C 60 61.839 5.736 5.912 1.00 0.00 C ATOM 924 SD MET C 60 61.329 6.318 4.275 1.00 0.00 S ATOM 925 CE MET C 60 61.262 8.081 4.673 1.00 0.00 C ATOM 0 H MET C 60 64.986 6.494 7.369 1.00 0.00 H new ATOM 0 HA MET C 60 62.877 4.528 7.815 1.00 0.00 H new ATOM 0 HB2 MET C 60 63.875 6.466 5.874 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.653 4.936 5.049 1.00 0.00 H new ATOM 0 HG2 MET C 60 61.320 4.810 6.158 1.00 0.00 H new ATOM 0 HG3 MET C 60 61.563 6.467 6.672 1.00 0.00 H new ATOM 0 HE1 MET C 60 60.962 8.643 3.788 1.00 0.00 H new ATOM 0 HE2 MET C 60 60.538 8.247 5.471 1.00 0.00 H new ATOM 0 HE3 MET C 60 62.246 8.418 5.000 1.00 0.00 H new ATOM 935 N ILE C 61 65.736 3.432 6.814 1.00 0.00 N ATOM 936 CA ILE C 61 66.467 2.174 6.488 1.00 0.00 C ATOM 937 C ILE C 61 66.815 1.414 7.772 1.00 0.00 C ATOM 938 O ILE C 61 66.861 0.200 7.792 1.00 0.00 O ATOM 939 CB ILE C 61 67.739 2.631 5.776 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.385 3.139 4.378 1.00 0.00 C ATOM 941 CG2 ILE C 61 68.710 1.455 5.660 1.00 0.00 C ATOM 942 CD1 ILE C 61 67.017 4.621 4.451 1.00 0.00 C ATOM 0 H ILE C 61 66.328 4.244 6.989 1.00 0.00 H new ATOM 0 HA ILE C 61 65.873 1.499 5.872 1.00 0.00 H new ATOM 0 HB ILE C 61 68.207 3.433 6.347 1.00 0.00 H new ATOM 0 HG12 ILE C 61 68.229 2.996 3.703 1.00 0.00 H new ATOM 0 HG13 ILE C 61 66.551 2.566 3.972 1.00 0.00 H new ATOM 0 HG21 ILE C 61 69.618 1.781 5.152 1.00 0.00 H new ATOM 0 HG22 ILE C 61 68.962 1.092 6.656 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.243 0.653 5.089 1.00 0.00 H new ATOM 0 HD11 ILE C 61 66.765 4.983 3.454 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.160 4.751 5.112 1.00 0.00 H new ATOM 0 HD13 ILE C 61 67.864 5.187 4.839 1.00 0.00 H new ATOM 954 N ASP C 62 67.062 2.121 8.840 1.00 0.00 N ATOM 955 CA ASP C 62 67.410 1.442 10.121 1.00 0.00 C ATOM 956 C ASP C 62 66.159 0.832 10.759 1.00 0.00 C ATOM 957 O ASP C 62 66.231 0.158 11.767 1.00 0.00 O ATOM 958 CB ASP C 62 67.981 2.546 11.011 1.00 0.00 C ATOM 959 CG ASP C 62 69.506 2.426 11.062 1.00 0.00 C ATOM 960 OD1 ASP C 62 70.032 1.541 10.407 1.00 0.00 O ATOM 961 OD2 ASP C 62 70.119 3.220 11.755 1.00 0.00 O ATOM 0 H ASP C 62 67.038 3.140 8.882 1.00 0.00 H new ATOM 0 HA ASP C 62 68.118 0.627 9.975 1.00 0.00 H new ATOM 0 HB2 ASP C 62 67.696 3.524 10.623 1.00 0.00 H new ATOM 0 HB3 ASP C 62 67.566 2.468 12.016 1.00 0.00 H new ATOM 966 N GLU C 63 65.011 1.061 10.181 1.00 0.00 N ATOM 967 CA GLU C 63 63.759 0.491 10.758 1.00 0.00 C ATOM 968 C GLU C 63 63.638 -0.992 10.398 1.00 0.00 C ATOM 969 O GLU C 63 63.035 -1.767 11.112 1.00 0.00 O ATOM 970 CB GLU C 63 62.626 1.292 10.116 1.00 0.00 C ATOM 971 CG GLU C 63 61.948 2.159 11.179 1.00 0.00 C ATOM 972 CD GLU C 63 61.234 1.261 12.191 1.00 0.00 C ATOM 973 OE1 GLU C 63 60.109 0.874 11.920 1.00 0.00 O ATOM 974 OE2 GLU C 63 61.824 0.975 13.220 1.00 0.00 O ATOM 0 H GLU C 63 64.886 1.617 9.335 1.00 0.00 H new ATOM 0 HA GLU C 63 63.739 0.556 11.846 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.018 1.919 9.316 1.00 0.00 H new ATOM 0 HB3 GLU C 63 61.899 0.617 9.665 1.00 0.00 H new ATOM 0 HG2 GLU C 63 62.689 2.778 11.685 1.00 0.00 H new ATOM 0 HG3 GLU C 63 61.234 2.836 10.710 1.00 0.00 H new ATOM 981 N VAL C 64 64.206 -1.390 9.293 1.00 0.00 N ATOM 982 CA VAL C 64 64.123 -2.821 8.886 1.00 0.00 C ATOM 983 C VAL C 64 65.524 -3.438 8.829 1.00 0.00 C ATOM 984 O VAL C 64 65.683 -4.620 8.597 1.00 0.00 O ATOM 985 CB VAL C 64 63.493 -2.796 7.495 1.00 0.00 C ATOM 986 CG1 VAL C 64 62.018 -2.409 7.608 1.00 0.00 C ATOM 987 CG2 VAL C 64 64.223 -1.770 6.626 1.00 0.00 C ATOM 0 H VAL C 64 64.724 -0.786 8.654 1.00 0.00 H new ATOM 0 HA VAL C 64 63.542 -3.419 9.589 1.00 0.00 H new ATOM 0 HB VAL C 64 63.575 -3.784 7.041 1.00 0.00 H new ATOM 0 HG11 VAL C 64 61.569 -2.391 6.615 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.497 -3.138 8.229 1.00 0.00 H new ATOM 0 HG13 VAL C 64 61.935 -1.421 8.061 1.00 0.00 H new ATOM 0 HG21 VAL C 64 63.775 -1.750 5.632 1.00 0.00 H new ATOM 0 HG22 VAL C 64 64.140 -0.783 7.081 1.00 0.00 H new ATOM 0 HG23 VAL C 64 65.275 -2.045 6.544 1.00 0.00 H new ATOM 997 N ASP C 65 66.540 -2.646 9.037 1.00 0.00 N ATOM 998 CA ASP C 65 67.929 -3.187 8.993 1.00 0.00 C ATOM 999 C ASP C 65 68.180 -4.104 10.193 1.00 0.00 C ATOM 1000 O ASP C 65 68.604 -3.665 11.243 1.00 0.00 O ATOM 1001 CB ASP C 65 68.835 -1.957 9.057 1.00 0.00 C ATOM 1002 CG ASP C 65 69.848 -2.010 7.912 1.00 0.00 C ATOM 1003 OD1 ASP C 65 70.732 -2.849 7.968 1.00 0.00 O ATOM 1004 OD2 ASP C 65 69.723 -1.212 6.998 1.00 0.00 O ATOM 0 H ASP C 65 66.469 -1.648 9.235 1.00 0.00 H new ATOM 0 HA ASP C 65 68.112 -3.782 8.098 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.238 -1.048 8.987 1.00 0.00 H new ATOM 0 HB3 ASP C 65 69.354 -1.924 10.015 1.00 0.00 H new ATOM 1009 N GLU C 66 67.920 -5.374 10.044 1.00 0.00 N ATOM 1010 CA GLU C 66 68.144 -6.319 11.177 1.00 0.00 C ATOM 1011 C GLU C 66 69.618 -6.726 11.244 1.00 0.00 C ATOM 1012 O GLU C 66 69.998 -7.604 11.995 1.00 0.00 O ATOM 1013 CB GLU C 66 67.269 -7.532 10.862 1.00 0.00 C ATOM 1014 CG GLU C 66 66.604 -8.026 12.148 1.00 0.00 C ATOM 1015 CD GLU C 66 65.819 -9.307 11.859 1.00 0.00 C ATOM 1016 OE1 GLU C 66 66.338 -10.146 11.141 1.00 0.00 O ATOM 1017 OE2 GLU C 66 64.713 -9.427 12.360 1.00 0.00 O ATOM 0 H GLU C 66 67.563 -5.799 9.188 1.00 0.00 H new ATOM 0 HA GLU C 66 67.893 -5.874 12.140 1.00 0.00 H new ATOM 0 HB2 GLU C 66 66.510 -7.266 10.126 1.00 0.00 H new ATOM 0 HB3 GLU C 66 67.873 -8.326 10.424 1.00 0.00 H new ATOM 0 HG2 GLU C 66 67.359 -8.214 12.911 1.00 0.00 H new ATOM 0 HG3 GLU C 66 65.937 -7.259 12.542 1.00 0.00 H new ATOM 1024 N ASP C 67 70.452 -6.091 10.468 1.00 0.00 N ATOM 1025 CA ASP C 67 71.902 -6.436 10.487 1.00 0.00 C ATOM 1026 C ASP C 67 72.738 -5.159 10.579 1.00 0.00 C ATOM 1027 O ASP C 67 73.940 -5.177 10.405 1.00 0.00 O ATOM 1028 CB ASP C 67 72.161 -7.153 9.161 1.00 0.00 C ATOM 1029 CG ASP C 67 71.479 -6.392 8.023 1.00 0.00 C ATOM 1030 OD1 ASP C 67 71.232 -5.209 8.191 1.00 0.00 O ATOM 1031 OD2 ASP C 67 71.213 -7.007 7.003 1.00 0.00 O ATOM 0 H ASP C 67 70.192 -5.347 9.821 1.00 0.00 H new ATOM 0 HA ASP C 67 72.169 -7.059 11.341 1.00 0.00 H new ATOM 0 HB2 ASP C 67 73.233 -7.220 8.976 1.00 0.00 H new ATOM 0 HB3 ASP C 67 71.781 -8.174 9.208 1.00 0.00 H new ATOM 1036 N GLY C 68 72.107 -4.049 10.849 1.00 0.00 N ATOM 1037 CA GLY C 68 72.861 -2.769 10.950 1.00 0.00 C ATOM 1038 C GLY C 68 73.808 -2.644 9.756 1.00 0.00 C ATOM 1039 O GLY C 68 74.892 -2.105 9.864 1.00 0.00 O ATOM 0 H GLY C 68 71.102 -3.974 11.004 1.00 0.00 H new ATOM 0 HA2 GLY C 68 72.169 -1.927 10.970 1.00 0.00 H new ATOM 0 HA3 GLY C 68 73.426 -2.739 11.882 1.00 0.00 H new ATOM 1043 N SER C 69 73.409 -3.141 8.617 1.00 0.00 N ATOM 1044 CA SER C 69 74.288 -3.052 7.415 1.00 0.00 C ATOM 1045 C SER C 69 74.317 -1.614 6.889 1.00 0.00 C ATOM 1046 O SER C 69 75.359 -0.993 6.813 1.00 0.00 O ATOM 1047 CB SER C 69 73.652 -3.989 6.389 1.00 0.00 C ATOM 1048 OG SER C 69 72.245 -3.787 6.378 1.00 0.00 O ATOM 0 H SER C 69 72.513 -3.605 8.466 1.00 0.00 H new ATOM 0 HA SER C 69 75.319 -3.330 7.634 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.066 -3.798 5.399 1.00 0.00 H new ATOM 0 HB3 SER C 69 73.880 -5.026 6.636 1.00 0.00 H new ATOM 0 HG SER C 69 71.856 -4.148 7.202 1.00 0.00 H new ATOM 1054 N GLY C 70 73.182 -1.081 6.526 1.00 0.00 N ATOM 1055 CA GLY C 70 73.148 0.316 6.006 1.00 0.00 C ATOM 1056 C GLY C 70 72.368 0.359 4.691 1.00 0.00 C ATOM 1057 O GLY C 70 72.208 1.401 4.088 1.00 0.00 O ATOM 0 H GLY C 70 72.278 -1.552 6.567 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.682 0.975 6.738 1.00 0.00 H new ATOM 0 HA3 GLY C 70 74.163 0.681 5.850 1.00 0.00 H new ATOM 1061 N THR C 71 71.880 -0.764 4.240 1.00 0.00 N ATOM 1062 CA THR C 71 71.111 -0.782 2.962 1.00 0.00 C ATOM 1063 C THR C 71 69.873 -1.671 3.103 1.00 0.00 C ATOM 1064 O THR C 71 69.718 -2.385 4.074 1.00 0.00 O ATOM 1065 CB THR C 71 72.076 -1.364 1.929 1.00 0.00 C ATOM 1066 OG1 THR C 71 72.981 -2.248 2.576 1.00 0.00 O ATOM 1067 CG2 THR C 71 72.857 -0.230 1.263 1.00 0.00 C ATOM 0 H THR C 71 71.980 -1.669 4.700 1.00 0.00 H new ATOM 0 HA THR C 71 70.758 0.209 2.677 1.00 0.00 H new ATOM 0 HB THR C 71 71.513 -1.909 1.171 1.00 0.00 H new ATOM 0 HG1 THR C 71 73.600 -2.624 1.915 1.00 0.00 H new ATOM 0 HG21 THR C 71 73.545 -0.645 0.527 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.162 0.449 0.768 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.421 0.316 2.019 1.00 0.00 H new ATOM 1075 N VAL C 72 68.990 -1.635 2.142 1.00 0.00 N ATOM 1076 CA VAL C 72 67.765 -2.479 2.228 1.00 0.00 C ATOM 1077 C VAL C 72 67.566 -3.267 0.932 1.00 0.00 C ATOM 1078 O VAL C 72 67.862 -2.794 -0.148 1.00 0.00 O ATOM 1079 CB VAL C 72 66.617 -1.493 2.436 1.00 0.00 C ATOM 1080 CG1 VAL C 72 65.282 -2.220 2.267 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.704 -0.908 3.845 1.00 0.00 C ATOM 0 H VAL C 72 69.064 -1.059 1.303 1.00 0.00 H new ATOM 0 HA VAL C 72 67.827 -3.210 3.034 1.00 0.00 H new ATOM 0 HB VAL C 72 66.687 -0.691 1.702 1.00 0.00 H new ATOM 0 HG11 VAL C 72 64.463 -1.516 2.416 1.00 0.00 H new ATOM 0 HG12 VAL C 72 65.221 -2.641 1.263 1.00 0.00 H new ATOM 0 HG13 VAL C 72 65.209 -3.022 3.002 1.00 0.00 H new ATOM 0 HG21 VAL C 72 65.886 -0.204 3.998 1.00 0.00 H new ATOM 0 HG22 VAL C 72 66.632 -1.712 4.578 1.00 0.00 H new ATOM 0 HG23 VAL C 72 67.656 -0.391 3.966 1.00 0.00 H new ATOM 1091 N ASP C 73 67.061 -4.465 1.034 1.00 0.00 N ATOM 1092 CA ASP C 73 66.835 -5.290 -0.188 1.00 0.00 C ATOM 1093 C ASP C 73 65.366 -5.708 -0.268 1.00 0.00 C ATOM 1094 O ASP C 73 64.564 -5.348 0.570 1.00 0.00 O ATOM 1095 CB ASP C 73 67.733 -6.513 -0.010 1.00 0.00 C ATOM 1096 CG ASP C 73 67.393 -7.207 1.310 1.00 0.00 C ATOM 1097 OD1 ASP C 73 66.317 -6.956 1.828 1.00 0.00 O ATOM 1098 OD2 ASP C 73 68.215 -7.976 1.781 1.00 0.00 O ATOM 0 H ASP C 73 66.794 -4.910 1.912 1.00 0.00 H new ATOM 0 HA ASP C 73 67.065 -4.749 -1.106 1.00 0.00 H new ATOM 0 HB2 ASP C 73 67.595 -7.203 -0.842 1.00 0.00 H new ATOM 0 HB3 ASP C 73 68.781 -6.212 -0.016 1.00 0.00 H new ATOM 1103 N PHE C 74 65.005 -6.470 -1.263 1.00 0.00 N ATOM 1104 CA PHE C 74 63.586 -6.907 -1.380 1.00 0.00 C ATOM 1105 C PHE C 74 63.132 -7.548 -0.067 1.00 0.00 C ATOM 1106 O PHE C 74 61.954 -7.655 0.209 1.00 0.00 O ATOM 1107 CB PHE C 74 63.569 -7.933 -2.514 1.00 0.00 C ATOM 1108 CG PHE C 74 62.330 -7.737 -3.356 1.00 0.00 C ATOM 1109 CD1 PHE C 74 61.195 -7.127 -2.805 1.00 0.00 C ATOM 1110 CD2 PHE C 74 62.314 -8.165 -4.689 1.00 0.00 C ATOM 1111 CE1 PHE C 74 60.048 -6.945 -3.587 1.00 0.00 C ATOM 1112 CE2 PHE C 74 61.166 -7.984 -5.470 1.00 0.00 C ATOM 1113 CZ PHE C 74 60.033 -7.374 -4.919 1.00 0.00 C ATOM 0 H PHE C 74 65.628 -6.808 -1.997 1.00 0.00 H new ATOM 0 HA PHE C 74 62.912 -6.075 -1.584 1.00 0.00 H new ATOM 0 HB2 PHE C 74 64.461 -7.823 -3.131 1.00 0.00 H new ATOM 0 HB3 PHE C 74 63.587 -8.943 -2.105 1.00 0.00 H new ATOM 0 HD1 PHE C 74 61.205 -6.797 -1.777 1.00 0.00 H new ATOM 0 HD2 PHE C 74 63.188 -8.635 -5.115 1.00 0.00 H new ATOM 0 HE1 PHE C 74 59.174 -6.473 -3.162 1.00 0.00 H new ATOM 0 HE2 PHE C 74 61.155 -8.315 -6.498 1.00 0.00 H new ATOM 0 HZ PHE C 74 59.148 -7.234 -5.522 1.00 0.00 H new ATOM 1123 N ASP C 75 64.061 -7.972 0.746 1.00 0.00 N ATOM 1124 CA ASP C 75 63.686 -8.601 2.045 1.00 0.00 C ATOM 1125 C ASP C 75 63.339 -7.519 3.070 1.00 0.00 C ATOM 1126 O ASP C 75 62.202 -7.371 3.470 1.00 0.00 O ATOM 1127 CB ASP C 75 64.928 -9.377 2.483 1.00 0.00 C ATOM 1128 CG ASP C 75 65.490 -10.159 1.295 1.00 0.00 C ATOM 1129 OD1 ASP C 75 64.882 -11.151 0.923 1.00 0.00 O ATOM 1130 OD2 ASP C 75 66.518 -9.756 0.776 1.00 0.00 O ATOM 0 H ASP C 75 65.063 -7.910 0.567 1.00 0.00 H new ATOM 0 HA ASP C 75 62.814 -9.248 1.956 1.00 0.00 H new ATOM 0 HB2 ASP C 75 65.681 -8.690 2.868 1.00 0.00 H new ATOM 0 HB3 ASP C 75 64.675 -10.060 3.294 1.00 0.00 H new ATOM 1135 N GLU C 76 64.311 -6.759 3.495 1.00 0.00 N ATOM 1136 CA GLU C 76 64.034 -5.685 4.490 1.00 0.00 C ATOM 1137 C GLU C 76 63.038 -4.677 3.911 1.00 0.00 C ATOM 1138 O GLU C 76 62.341 -3.993 4.633 1.00 0.00 O ATOM 1139 CB GLU C 76 65.387 -5.020 4.742 1.00 0.00 C ATOM 1140 CG GLU C 76 66.328 -6.016 5.422 1.00 0.00 C ATOM 1141 CD GLU C 76 67.753 -5.459 5.420 1.00 0.00 C ATOM 1142 OE1 GLU C 76 67.918 -4.313 5.036 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.654 -6.186 5.804 1.00 0.00 O ATOM 0 H GLU C 76 65.283 -6.835 3.197 1.00 0.00 H new ATOM 0 HA GLU C 76 63.595 -6.074 5.409 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.818 -4.681 3.800 1.00 0.00 H new ATOM 0 HB3 GLU C 76 65.259 -4.138 5.370 1.00 0.00 H new ATOM 0 HG2 GLU C 76 66.000 -6.201 6.445 1.00 0.00 H new ATOM 0 HG3 GLU C 76 66.300 -6.973 4.900 1.00 0.00 H new ATOM 1150 N PHE C 77 62.964 -4.585 2.612 1.00 0.00 N ATOM 1151 CA PHE C 77 62.010 -3.625 1.986 1.00 0.00 C ATOM 1152 C PHE C 77 60.573 -4.108 2.191 1.00 0.00 C ATOM 1153 O PHE C 77 59.777 -3.458 2.840 1.00 0.00 O ATOM 1154 CB PHE C 77 62.367 -3.622 0.499 1.00 0.00 C ATOM 1155 CG PHE C 77 61.366 -2.781 -0.257 1.00 0.00 C ATOM 1156 CD1 PHE C 77 61.508 -1.389 -0.296 1.00 0.00 C ATOM 1157 CD2 PHE C 77 60.293 -3.395 -0.917 1.00 0.00 C ATOM 1158 CE1 PHE C 77 60.577 -0.610 -0.994 1.00 0.00 C ATOM 1159 CE2 PHE C 77 59.364 -2.615 -1.615 1.00 0.00 C ATOM 1160 CZ PHE C 77 59.506 -1.223 -1.655 1.00 0.00 C ATOM 0 H PHE C 77 63.522 -5.132 1.957 1.00 0.00 H new ATOM 0 HA PHE C 77 62.079 -2.628 2.422 1.00 0.00 H new ATOM 0 HB2 PHE C 77 63.372 -3.226 0.356 1.00 0.00 H new ATOM 0 HB3 PHE C 77 62.368 -4.641 0.112 1.00 0.00 H new ATOM 0 HD1 PHE C 77 62.335 -0.916 0.212 1.00 0.00 H new ATOM 0 HD2 PHE C 77 60.183 -4.469 -0.887 1.00 0.00 H new ATOM 0 HE1 PHE C 77 60.685 0.464 -1.022 1.00 0.00 H new ATOM 0 HE2 PHE C 77 58.537 -3.088 -2.123 1.00 0.00 H new ATOM 0 HZ PHE C 77 58.790 -0.622 -2.196 1.00 0.00 H new ATOM 1170 N LEU C 78 60.235 -5.245 1.648 1.00 0.00 N ATOM 1171 CA LEU C 78 58.850 -5.767 1.817 1.00 0.00 C ATOM 1172 C LEU C 78 58.464 -5.758 3.297 1.00 0.00 C ATOM 1173 O LEU C 78 57.319 -5.554 3.650 1.00 0.00 O ATOM 1174 CB LEU C 78 58.897 -7.199 1.282 1.00 0.00 C ATOM 1175 CG LEU C 78 58.433 -7.216 -0.175 1.00 0.00 C ATOM 1176 CD1 LEU C 78 58.874 -8.523 -0.836 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.907 -7.110 -0.226 1.00 0.00 C ATOM 0 H LEU C 78 60.857 -5.834 1.095 1.00 0.00 H new ATOM 0 HA LEU C 78 58.111 -5.162 1.291 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.911 -7.593 1.356 1.00 0.00 H new ATOM 0 HB3 LEU C 78 58.259 -7.845 1.885 1.00 0.00 H new ATOM 0 HG LEU C 78 58.875 -6.373 -0.706 1.00 0.00 H new ATOM 0 HD11 LEU C 78 58.543 -8.535 -1.875 1.00 0.00 H new ATOM 0 HD12 LEU C 78 59.961 -8.600 -0.800 1.00 0.00 H new ATOM 0 HD13 LEU C 78 58.433 -9.366 -0.305 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.576 -7.122 -1.264 1.00 0.00 H new ATOM 0 HD22 LEU C 78 56.466 -7.953 0.305 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.591 -6.179 0.245 1.00 0.00 H new ATOM 1189 N VAL C 79 59.412 -5.972 4.167 1.00 0.00 N ATOM 1190 CA VAL C 79 59.102 -5.969 5.625 1.00 0.00 C ATOM 1191 C VAL C 79 58.801 -4.544 6.092 1.00 0.00 C ATOM 1192 O VAL C 79 57.940 -4.318 6.919 1.00 0.00 O ATOM 1193 CB VAL C 79 60.366 -6.502 6.298 1.00 0.00 C ATOM 1194 CG1 VAL C 79 60.190 -6.465 7.817 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.614 -7.943 5.847 1.00 0.00 C ATOM 0 H VAL C 79 60.389 -6.149 3.932 1.00 0.00 H new ATOM 0 HA VAL C 79 58.228 -6.574 5.867 1.00 0.00 H new ATOM 0 HB VAL C 79 61.217 -5.882 6.017 1.00 0.00 H new ATOM 0 HG11 VAL C 79 61.092 -6.845 8.297 1.00 0.00 H new ATOM 0 HG12 VAL C 79 60.013 -5.438 8.138 1.00 0.00 H new ATOM 0 HG13 VAL C 79 59.339 -7.085 8.100 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.516 -8.324 6.327 1.00 0.00 H new ATOM 0 HG22 VAL C 79 59.763 -8.564 6.128 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.740 -7.969 4.765 1.00 0.00 H new ATOM 1205 N MET C 80 59.505 -3.579 5.563 1.00 0.00 N ATOM 1206 CA MET C 80 59.261 -2.166 5.970 1.00 0.00 C ATOM 1207 C MET C 80 57.821 -1.768 5.635 1.00 0.00 C ATOM 1208 O MET C 80 57.265 -0.860 6.220 1.00 0.00 O ATOM 1209 CB MET C 80 60.251 -1.342 5.147 1.00 0.00 C ATOM 1210 CG MET C 80 60.893 -0.277 6.037 1.00 0.00 C ATOM 1211 SD MET C 80 60.544 1.365 5.359 1.00 0.00 S ATOM 1212 CE MET C 80 61.577 1.224 3.880 1.00 0.00 C ATOM 0 H MET C 80 60.239 -3.709 4.866 1.00 0.00 H new ATOM 0 HA MET C 80 59.395 -2.011 7.041 1.00 0.00 H new ATOM 0 HB2 MET C 80 61.019 -1.991 4.727 1.00 0.00 H new ATOM 0 HB3 MET C 80 59.739 -0.870 4.309 1.00 0.00 H new ATOM 0 HG2 MET C 80 60.504 -0.353 7.052 1.00 0.00 H new ATOM 0 HG3 MET C 80 61.970 -0.437 6.095 1.00 0.00 H new ATOM 0 HE1 MET C 80 61.800 2.219 3.496 1.00 0.00 H new ATOM 0 HE2 MET C 80 62.507 0.715 4.133 1.00 0.00 H new ATOM 0 HE3 MET C 80 61.046 0.652 3.119 1.00 0.00 H new ATOM 1222 N MET C 81 57.215 -2.445 4.700 1.00 0.00 N ATOM 1223 CA MET C 81 55.811 -2.112 4.325 1.00 0.00 C ATOM 1224 C MET C 81 54.836 -2.829 5.261 1.00 0.00 C ATOM 1225 O MET C 81 53.654 -2.550 5.276 1.00 0.00 O ATOM 1226 CB MET C 81 55.654 -2.624 2.893 1.00 0.00 C ATOM 1227 CG MET C 81 56.473 -1.746 1.946 1.00 0.00 C ATOM 1228 SD MET C 81 55.726 -0.100 1.852 1.00 0.00 S ATOM 1229 CE MET C 81 56.887 0.606 0.658 1.00 0.00 C ATOM 0 H MET C 81 57.632 -3.216 4.178 1.00 0.00 H new ATOM 0 HA MET C 81 55.601 -1.045 4.401 1.00 0.00 H new ATOM 0 HB2 MET C 81 55.988 -3.659 2.827 1.00 0.00 H new ATOM 0 HB3 MET C 81 54.603 -2.609 2.603 1.00 0.00 H new ATOM 0 HG2 MET C 81 57.501 -1.671 2.300 1.00 0.00 H new ATOM 0 HG3 MET C 81 56.510 -2.198 0.955 1.00 0.00 H new ATOM 0 HE1 MET C 81 56.611 1.639 0.449 1.00 0.00 H new ATOM 0 HE2 MET C 81 57.896 0.576 1.070 1.00 0.00 H new ATOM 0 HE3 MET C 81 56.855 0.028 -0.266 1.00 0.00 H new ATOM 1239 N VAL C 82 55.325 -3.753 6.042 1.00 0.00 N ATOM 1240 CA VAL C 82 54.430 -4.493 6.978 1.00 0.00 C ATOM 1241 C VAL C 82 54.431 -3.820 8.354 1.00 0.00 C ATOM 1242 O VAL C 82 53.438 -3.819 9.054 1.00 0.00 O ATOM 1243 CB VAL C 82 55.025 -5.898 7.068 1.00 0.00 C ATOM 1244 CG1 VAL C 82 53.997 -6.850 7.684 1.00 0.00 C ATOM 1245 CG2 VAL C 82 55.398 -6.388 5.667 1.00 0.00 C ATOM 0 H VAL C 82 56.307 -4.028 6.073 1.00 0.00 H new ATOM 0 HA VAL C 82 53.396 -4.510 6.634 1.00 0.00 H new ATOM 0 HB VAL C 82 55.918 -5.873 7.693 1.00 0.00 H new ATOM 0 HG11 VAL C 82 54.422 -7.852 7.748 1.00 0.00 H new ATOM 0 HG12 VAL C 82 53.733 -6.503 8.683 1.00 0.00 H new ATOM 0 HG13 VAL C 82 53.103 -6.874 7.060 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.822 -7.390 5.733 1.00 0.00 H new ATOM 0 HG22 VAL C 82 54.506 -6.412 5.041 1.00 0.00 H new ATOM 0 HG23 VAL C 82 56.132 -5.712 5.228 1.00 0.00 H new ATOM 1255 N ARG C 83 55.538 -3.251 8.745 1.00 0.00 N ATOM 1256 CA ARG C 83 55.603 -2.581 10.078 1.00 0.00 C ATOM 1257 C ARG C 83 54.643 -1.388 10.121 1.00 0.00 C ATOM 1258 O ARG C 83 54.308 -0.888 11.176 1.00 0.00 O ATOM 1259 CB ARG C 83 57.049 -2.105 10.210 1.00 0.00 C ATOM 1260 CG ARG C 83 57.867 -3.154 10.967 1.00 0.00 C ATOM 1261 CD ARG C 83 59.142 -2.508 11.515 1.00 0.00 C ATOM 1262 NE ARG C 83 58.718 -1.827 12.771 1.00 0.00 N ATOM 1263 CZ ARG C 83 59.589 -1.596 13.713 1.00 0.00 C ATOM 1264 NH1 ARG C 83 60.472 -2.504 14.023 1.00 0.00 N ATOM 1265 NH2 ARG C 83 59.578 -0.455 14.347 1.00 0.00 N ATOM 0 H ARG C 83 56.400 -3.220 8.201 1.00 0.00 H new ATOM 0 HA ARG C 83 55.315 -3.250 10.889 1.00 0.00 H new ATOM 0 HB2 ARG C 83 57.479 -1.937 9.223 1.00 0.00 H new ATOM 0 HB3 ARG C 83 57.082 -1.152 10.738 1.00 0.00 H new ATOM 0 HG2 ARG C 83 57.278 -3.571 11.784 1.00 0.00 H new ATOM 0 HG3 ARG C 83 58.121 -3.981 10.304 1.00 0.00 H new ATOM 0 HD2 ARG C 83 59.911 -3.256 11.711 1.00 0.00 H new ATOM 0 HD3 ARG C 83 59.562 -1.798 10.803 1.00 0.00 H new ATOM 0 HE ARG C 83 57.746 -1.542 12.894 1.00 0.00 H new ATOM 0 HH11 ARG C 83 60.482 -3.396 13.528 1.00 0.00 H new ATOM 0 HH12 ARG C 83 61.153 -2.322 14.760 1.00 0.00 H new ATOM 0 HH21 ARG C 83 58.888 0.256 14.105 1.00 0.00 H new ATOM 0 HH22 ARG C 83 60.260 -0.275 15.084 1.00 0.00 H new ATOM 1279 N CYS C 84 54.200 -0.926 8.984 1.00 0.00 N ATOM 1280 CA CYS C 84 53.264 0.236 8.966 1.00 0.00 C ATOM 1281 C CYS C 84 51.891 -0.196 8.447 1.00 0.00 C ATOM 1282 O CYS C 84 50.929 0.543 8.521 1.00 0.00 O ATOM 1283 CB CYS C 84 53.903 1.245 8.012 1.00 0.00 C ATOM 1284 SG CYS C 84 52.863 2.723 7.917 1.00 0.00 S ATOM 0 H CYS C 84 54.445 -1.301 8.068 1.00 0.00 H new ATOM 0 HA CYS C 84 53.109 0.655 9.960 1.00 0.00 H new ATOM 0 HB2 CYS C 84 54.901 1.511 8.361 1.00 0.00 H new ATOM 0 HB3 CYS C 84 54.018 0.804 7.022 1.00 0.00 H new ATOM 0 HG CYS C 84 51.623 2.396 8.133 1.00 0.00 H new ATOM 1290 N MET C 85 51.792 -1.385 7.920 1.00 0.00 N ATOM 1291 CA MET C 85 50.479 -1.860 7.395 1.00 0.00 C ATOM 1292 C MET C 85 49.380 -1.638 8.437 1.00 0.00 C ATOM 1293 O MET C 85 49.404 -2.205 9.512 1.00 0.00 O ATOM 1294 CB MET C 85 50.676 -3.352 7.129 1.00 0.00 C ATOM 1295 CG MET C 85 50.855 -3.582 5.627 1.00 0.00 C ATOM 1296 SD MET C 85 49.231 -3.715 4.840 1.00 0.00 S ATOM 1297 CE MET C 85 48.820 -5.369 5.446 1.00 0.00 C ATOM 0 H MET C 85 52.562 -2.048 7.830 1.00 0.00 H new ATOM 0 HA MET C 85 50.174 -1.323 6.496 1.00 0.00 H new ATOM 0 HB2 MET C 85 51.549 -3.717 7.670 1.00 0.00 H new ATOM 0 HB3 MET C 85 49.817 -3.914 7.494 1.00 0.00 H new ATOM 0 HG2 MET C 85 51.418 -2.759 5.187 1.00 0.00 H new ATOM 0 HG3 MET C 85 51.431 -4.491 5.453 1.00 0.00 H new ATOM 0 HE1 MET C 85 48.177 -5.872 4.724 1.00 0.00 H new ATOM 0 HE2 MET C 85 49.735 -5.945 5.580 1.00 0.00 H new ATOM 0 HE3 MET C 85 48.300 -5.288 6.400 1.00 0.00 H new ATOM 1307 N LYS C 86 48.412 -0.816 8.128 1.00 0.00 N ATOM 1308 CA LYS C 86 47.313 -0.560 9.102 1.00 0.00 C ATOM 1309 C LYS C 86 45.964 -0.525 8.378 1.00 0.00 C ATOM 1310 O LYS C 86 45.866 -0.846 7.210 1.00 0.00 O ATOM 1311 CB LYS C 86 47.630 0.807 9.709 1.00 0.00 C ATOM 1312 CG LYS C 86 47.554 0.719 11.234 1.00 0.00 C ATOM 1313 CD LYS C 86 48.611 1.635 11.854 1.00 0.00 C ATOM 1314 CE LYS C 86 48.165 2.053 13.258 1.00 0.00 C ATOM 1315 NZ LYS C 86 49.049 3.196 13.625 1.00 0.00 N ATOM 0 H LYS C 86 48.336 -0.312 7.244 1.00 0.00 H new ATOM 0 HA LYS C 86 47.247 -1.338 9.863 1.00 0.00 H new ATOM 0 HB2 LYS C 86 48.624 1.131 9.402 1.00 0.00 H new ATOM 0 HB3 LYS C 86 46.924 1.552 9.342 1.00 0.00 H new ATOM 0 HG2 LYS C 86 46.561 1.009 11.576 1.00 0.00 H new ATOM 0 HG3 LYS C 86 47.714 -0.309 11.558 1.00 0.00 H new ATOM 0 HD2 LYS C 86 49.570 1.119 11.904 1.00 0.00 H new ATOM 0 HD3 LYS C 86 48.755 2.516 11.229 1.00 0.00 H new ATOM 0 HE2 LYS C 86 47.116 2.348 13.266 1.00 0.00 H new ATOM 0 HE3 LYS C 86 48.270 1.231 13.966 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 48.801 3.535 14.576 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 50.041 2.884 13.616 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 48.922 3.967 12.939 1.00 0.00 H new ATOM 1329 N ASP C 87 44.922 -0.138 9.063 1.00 0.00 N ATOM 1330 CA ASP C 87 43.580 -0.082 8.415 1.00 0.00 C ATOM 1331 C ASP C 87 43.303 -1.384 7.658 1.00 0.00 C ATOM 1332 O ASP C 87 43.398 -1.443 6.449 1.00 0.00 O ATOM 1333 CB ASP C 87 43.657 1.096 7.443 1.00 0.00 C ATOM 1334 CG ASP C 87 42.252 1.439 6.942 1.00 0.00 C ATOM 1335 OD1 ASP C 87 41.571 0.536 6.486 1.00 0.00 O ATOM 1336 OD2 ASP C 87 41.882 2.599 7.022 1.00 0.00 O ATOM 0 H ASP C 87 44.942 0.142 10.044 1.00 0.00 H new ATOM 0 HA ASP C 87 42.777 0.041 9.141 1.00 0.00 H new ATOM 0 HB2 ASP C 87 44.099 1.961 7.938 1.00 0.00 H new ATOM 0 HB3 ASP C 87 44.303 0.845 6.602 1.00 0.00 H new ATOM 1341 N ASP C 88 42.959 -2.428 8.363 1.00 0.00 N ATOM 1342 CA ASP C 88 42.674 -3.724 7.683 1.00 0.00 C ATOM 1343 C ASP C 88 41.293 -4.240 8.093 1.00 0.00 C ATOM 1344 O ASP C 88 41.167 -5.274 8.719 1.00 0.00 O ATOM 1345 CB ASP C 88 43.770 -4.676 8.164 1.00 0.00 C ATOM 1346 CG ASP C 88 43.772 -4.720 9.693 1.00 0.00 C ATOM 1347 OD1 ASP C 88 43.031 -3.956 10.289 1.00 0.00 O ATOM 1348 OD2 ASP C 88 44.516 -5.516 10.242 1.00 0.00 O ATOM 0 H ASP C 88 42.863 -2.440 9.378 1.00 0.00 H new ATOM 0 HA ASP C 88 42.668 -3.629 6.597 1.00 0.00 H new ATOM 0 HB2 ASP C 88 43.602 -5.675 7.761 1.00 0.00 H new ATOM 0 HB3 ASP C 88 44.741 -4.344 7.798 1.00 0.00 H new ATOM 1353 N SER C 89 40.257 -3.526 7.749 1.00 0.00 N ATOM 1354 CA SER C 89 38.885 -3.973 8.121 1.00 0.00 C ATOM 1355 C SER C 89 37.843 -3.271 7.244 1.00 0.00 C ATOM 1356 O SER C 89 36.727 -3.100 7.706 1.00 0.00 O ATOM 1357 CB SER C 89 38.719 -3.564 9.583 1.00 0.00 C ATOM 1358 OG SER C 89 39.988 -3.590 10.224 1.00 0.00 O ATOM 1359 OXT SER C 89 38.181 -2.917 6.126 1.00 0.00 O ATOM 0 H SER C 89 40.301 -2.651 7.226 1.00 0.00 H new ATOM 0 HA SER C 89 38.747 -5.045 7.980 1.00 0.00 H new ATOM 0 HB2 SER C 89 38.287 -2.565 9.647 1.00 0.00 H new ATOM 0 HB3 SER C 89 38.030 -4.242 10.087 1.00 0.00 H new ATOM 0 HG SER C 89 39.886 -3.327 11.162 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 59.479 10.878 5.259 1.00 0.00 N ATOM 1367 CA ARG I 1 58.117 10.353 5.563 1.00 0.00 C ATOM 1368 C ARG I 1 57.537 9.644 4.335 1.00 0.00 C ATOM 1369 O ARG I 1 57.147 10.271 3.370 1.00 0.00 O ATOM 1370 CB ARG I 1 57.285 11.588 5.914 1.00 0.00 C ATOM 1371 CG ARG I 1 56.893 11.534 7.392 1.00 0.00 C ATOM 1372 CD ARG I 1 55.414 11.156 7.516 1.00 0.00 C ATOM 1373 NE ARG I 1 54.671 12.337 6.995 1.00 0.00 N ATOM 1374 CZ ARG I 1 53.367 12.318 6.951 1.00 0.00 C ATOM 1375 NH1 ARG I 1 52.751 11.444 6.204 1.00 0.00 N ATOM 1376 NH2 ARG I 1 52.678 13.175 7.654 1.00 0.00 N ATOM 0 H1 ARG I 1 60.100 10.730 6.080 1.00 0.00 H new ATOM 0 H2 ARG I 1 59.869 10.376 4.436 1.00 0.00 H new ATOM 0 H3 ARG I 1 59.420 11.895 5.049 1.00 0.00 H new ATOM 0 HA ARG I 1 58.126 9.625 6.374 1.00 0.00 H new ATOM 0 HB2 ARG I 1 57.856 12.494 5.711 1.00 0.00 H new ATOM 0 HB3 ARG I 1 56.392 11.627 5.291 1.00 0.00 H new ATOM 0 HG2 ARG I 1 57.511 10.805 7.916 1.00 0.00 H new ATOM 0 HG3 ARG I 1 57.073 12.501 7.862 1.00 0.00 H new ATOM 0 HD2 ARG I 1 55.186 10.260 6.939 1.00 0.00 H new ATOM 0 HD3 ARG I 1 55.146 10.946 8.551 1.00 0.00 H new ATOM 0 HE ARG I 1 55.181 13.160 6.673 1.00 0.00 H new ATOM 0 HH11 ARG I 1 53.289 10.774 5.653 1.00 0.00 H new ATOM 0 HH12 ARG I 1 51.732 11.430 6.170 1.00 0.00 H new ATOM 0 HH21 ARG I 1 53.159 13.859 8.238 1.00 0.00 H new ATOM 0 HH22 ARG I 1 51.659 13.160 7.620 1.00 0.00 H new ATOM 1392 N ILE I 2 57.481 8.340 4.364 1.00 0.00 N ATOM 1393 CA ILE I 2 56.928 7.590 3.199 1.00 0.00 C ATOM 1394 C ILE I 2 55.523 7.072 3.518 1.00 0.00 C ATOM 1395 O ILE I 2 55.219 6.727 4.643 1.00 0.00 O ATOM 1396 CB ILE I 2 57.894 6.424 2.987 1.00 0.00 C ATOM 1397 CG1 ILE I 2 57.553 5.711 1.676 1.00 0.00 C ATOM 1398 CG2 ILE I 2 57.770 5.438 4.150 1.00 0.00 C ATOM 1399 CD1 ILE I 2 58.827 5.121 1.070 1.00 0.00 C ATOM 0 H ILE I 2 57.794 7.761 5.144 1.00 0.00 H new ATOM 0 HA ILE I 2 56.839 8.215 2.310 1.00 0.00 H new ATOM 0 HB ILE I 2 58.915 6.803 2.941 1.00 0.00 H new ATOM 0 HG12 ILE I 2 56.825 4.921 1.858 1.00 0.00 H new ATOM 0 HG13 ILE I 2 57.096 6.411 0.977 1.00 0.00 H new ATOM 0 HG21 ILE I 2 58.459 4.607 3.998 1.00 0.00 H new ATOM 0 HG22 ILE I 2 58.013 5.945 5.084 1.00 0.00 H new ATOM 0 HG23 ILE I 2 56.749 5.059 4.198 1.00 0.00 H new ATOM 0 HD11 ILE I 2 58.585 4.613 0.136 1.00 0.00 H new ATOM 0 HD12 ILE I 2 59.541 5.921 0.873 1.00 0.00 H new ATOM 0 HD13 ILE I 2 59.265 4.408 1.768 1.00 0.00 H new ATOM 1411 N SER I 3 54.666 7.013 2.535 1.00 0.00 N ATOM 1412 CA SER I 3 53.282 6.516 2.782 1.00 0.00 C ATOM 1413 C SER I 3 53.006 5.276 1.926 1.00 0.00 C ATOM 1414 O SER I 3 53.907 4.682 1.369 1.00 0.00 O ATOM 1415 CB SER I 3 52.369 7.669 2.367 1.00 0.00 C ATOM 1416 OG SER I 3 52.233 8.573 3.455 1.00 0.00 O ATOM 0 H SER I 3 54.864 7.287 1.573 1.00 0.00 H new ATOM 0 HA SER I 3 53.125 6.226 3.821 1.00 0.00 H new ATOM 0 HB2 SER I 3 52.785 8.184 1.501 1.00 0.00 H new ATOM 0 HB3 SER I 3 51.392 7.287 2.072 1.00 0.00 H new ATOM 0 HG SER I 3 51.649 9.315 3.193 1.00 0.00 H new ATOM 1422 N ALA I 4 51.767 4.881 1.821 1.00 0.00 N ATOM 1423 CA ALA I 4 51.434 3.678 1.003 1.00 0.00 C ATOM 1424 C ALA I 4 50.369 4.024 -0.041 1.00 0.00 C ATOM 1425 O ALA I 4 50.410 3.556 -1.162 1.00 0.00 O ATOM 1426 CB ALA I 4 50.892 2.658 2.005 1.00 0.00 C ATOM 0 H ALA I 4 50.971 5.338 2.265 1.00 0.00 H new ATOM 0 HA ALA I 4 52.298 3.297 0.458 1.00 0.00 H new ATOM 0 HB1 ALA I 4 50.623 1.741 1.481 1.00 0.00 H new ATOM 0 HB2 ALA I 4 51.656 2.439 2.751 1.00 0.00 H new ATOM 0 HB3 ALA I 4 50.010 3.066 2.499 1.00 0.00 H new ATOM 1432 N ASP I 5 49.414 4.838 0.317 1.00 0.00 N ATOM 1433 CA ASP I 5 48.345 5.212 -0.655 1.00 0.00 C ATOM 1434 C ASP I 5 48.827 6.347 -1.564 1.00 0.00 C ATOM 1435 O ASP I 5 48.730 6.270 -2.773 1.00 0.00 O ATOM 1436 CB ASP I 5 47.173 5.679 0.209 1.00 0.00 C ATOM 1437 CG ASP I 5 45.924 4.865 -0.139 1.00 0.00 C ATOM 1438 OD1 ASP I 5 45.769 3.789 0.415 1.00 0.00 O ATOM 1439 OD2 ASP I 5 45.146 5.331 -0.953 1.00 0.00 O ATOM 0 H ASP I 5 49.327 5.261 1.241 1.00 0.00 H new ATOM 0 HA ASP I 5 48.069 4.382 -1.305 1.00 0.00 H new ATOM 0 HB2 ASP I 5 47.416 5.559 1.265 1.00 0.00 H new ATOM 0 HB3 ASP I 5 46.986 6.740 0.044 1.00 0.00 H new ATOM 1444 N ALA I 6 49.340 7.402 -0.992 1.00 0.00 N ATOM 1445 CA ALA I 6 49.824 8.542 -1.825 1.00 0.00 C ATOM 1446 C ALA I 6 51.110 8.161 -2.563 1.00 0.00 C ATOM 1447 O ALA I 6 51.495 8.794 -3.524 1.00 0.00 O ATOM 1448 CB ALA I 6 50.093 9.672 -0.830 1.00 0.00 C ATOM 0 H ALA I 6 49.445 7.525 0.015 1.00 0.00 H new ATOM 0 HA ALA I 6 49.099 8.829 -2.587 1.00 0.00 H new ATOM 0 HB1 ALA I 6 50.454 10.550 -1.366 1.00 0.00 H new ATOM 0 HB2 ALA I 6 49.171 9.921 -0.304 1.00 0.00 H new ATOM 0 HB3 ALA I 6 50.846 9.351 -0.110 1.00 0.00 H new ATOM 1454 N MET I 7 51.779 7.132 -2.118 1.00 0.00 N ATOM 1455 CA MET I 7 53.041 6.716 -2.797 1.00 0.00 C ATOM 1456 C MET I 7 52.734 6.085 -4.158 1.00 0.00 C ATOM 1457 O MET I 7 53.402 6.345 -5.139 1.00 0.00 O ATOM 1458 CB MET I 7 53.675 5.688 -1.860 1.00 0.00 C ATOM 1459 CG MET I 7 55.186 5.645 -2.095 1.00 0.00 C ATOM 1460 SD MET I 7 55.734 3.923 -2.194 1.00 0.00 S ATOM 1461 CE MET I 7 56.626 4.058 -3.762 1.00 0.00 C ATOM 0 H MET I 7 51.508 6.563 -1.316 1.00 0.00 H new ATOM 0 HA MET I 7 53.703 7.561 -2.985 1.00 0.00 H new ATOM 0 HB2 MET I 7 53.465 5.948 -0.823 1.00 0.00 H new ATOM 0 HB3 MET I 7 53.241 4.704 -2.036 1.00 0.00 H new ATOM 0 HG2 MET I 7 55.436 6.171 -3.016 1.00 0.00 H new ATOM 0 HG3 MET I 7 55.705 6.157 -1.285 1.00 0.00 H new ATOM 0 HE1 MET I 7 56.210 3.351 -4.480 1.00 0.00 H new ATOM 0 HE2 MET I 7 56.526 5.071 -4.151 1.00 0.00 H new ATOM 0 HE3 MET I 7 57.680 3.833 -3.601 1.00 0.00 H new ATOM 1471 N MET I 8 51.728 5.256 -4.224 1.00 0.00 N ATOM 1472 CA MET I 8 51.382 4.607 -5.522 1.00 0.00 C ATOM 1473 C MET I 8 50.745 5.621 -6.476 1.00 0.00 C ATOM 1474 O MET I 8 50.823 5.487 -7.681 1.00 0.00 O ATOM 1475 CB MET I 8 50.378 3.512 -5.158 1.00 0.00 C ATOM 1476 CG MET I 8 51.051 2.484 -4.247 1.00 0.00 C ATOM 1477 SD MET I 8 52.421 1.700 -5.131 1.00 0.00 S ATOM 1478 CE MET I 8 53.762 2.409 -4.146 1.00 0.00 C ATOM 0 H MET I 8 51.131 5.000 -3.437 1.00 0.00 H new ATOM 0 HA MET I 8 52.261 4.208 -6.029 1.00 0.00 H new ATOM 0 HB2 MET I 8 49.514 3.948 -4.656 1.00 0.00 H new ATOM 0 HB3 MET I 8 50.010 3.027 -6.062 1.00 0.00 H new ATOM 0 HG2 MET I 8 51.418 2.969 -3.342 1.00 0.00 H new ATOM 0 HG3 MET I 8 50.328 1.731 -3.934 1.00 0.00 H new ATOM 0 HE1 MET I 8 54.667 1.818 -4.285 1.00 0.00 H new ATOM 0 HE2 MET I 8 53.946 3.435 -4.466 1.00 0.00 H new ATOM 0 HE3 MET I 8 53.482 2.402 -3.092 1.00 0.00 H new ATOM 1488 N GLN I 9 50.110 6.631 -5.949 1.00 0.00 N ATOM 1489 CA GLN I 9 49.462 7.648 -6.827 1.00 0.00 C ATOM 1490 C GLN I 9 50.468 8.724 -7.250 1.00 0.00 C ATOM 1491 O GLN I 9 50.219 9.496 -8.153 1.00 0.00 O ATOM 1492 CB GLN I 9 48.355 8.260 -5.970 1.00 0.00 C ATOM 1493 CG GLN I 9 47.113 7.371 -6.029 1.00 0.00 C ATOM 1494 CD GLN I 9 45.900 8.214 -6.428 1.00 0.00 C ATOM 1495 OE1 GLN I 9 45.796 9.364 -6.051 1.00 0.00 O ATOM 1496 NE2 GLN I 9 44.973 7.687 -7.179 1.00 0.00 N ATOM 0 H GLN I 9 50.011 6.797 -4.947 1.00 0.00 H new ATOM 0 HA GLN I 9 49.077 7.205 -7.746 1.00 0.00 H new ATOM 0 HB2 GLN I 9 48.693 8.362 -4.939 1.00 0.00 H new ATOM 0 HB3 GLN I 9 48.116 9.261 -6.327 1.00 0.00 H new ATOM 0 HG2 GLN I 9 47.263 6.566 -6.749 1.00 0.00 H new ATOM 0 HG3 GLN I 9 46.941 6.903 -5.060 1.00 0.00 H new ATOM 0 HE21 GLN I 9 45.061 6.721 -7.495 1.00 0.00 H new ATOM 0 HE22 GLN I 9 44.160 8.241 -7.450 1.00 0.00 H new ATOM 1505 N ALA I 10 51.600 8.787 -6.602 1.00 0.00 N ATOM 1506 CA ALA I 10 52.608 9.823 -6.972 1.00 0.00 C ATOM 1507 C ALA I 10 53.485 9.337 -8.128 1.00 0.00 C ATOM 1508 O ALA I 10 53.602 9.988 -9.147 1.00 0.00 O ATOM 1509 CB ALA I 10 53.450 10.022 -5.712 1.00 0.00 C ATOM 0 H ALA I 10 51.870 8.170 -5.836 1.00 0.00 H new ATOM 0 HA ALA I 10 52.137 10.748 -7.305 1.00 0.00 H new ATOM 0 HB1 ALA I 10 54.218 10.772 -5.902 1.00 0.00 H new ATOM 0 HB2 ALA I 10 52.810 10.357 -4.896 1.00 0.00 H new ATOM 0 HB3 ALA I 10 53.924 9.079 -5.438 1.00 0.00 H new ATOM 1515 N LEU I 11 54.110 8.201 -7.979 1.00 0.00 N ATOM 1516 CA LEU I 11 54.984 7.684 -9.071 1.00 0.00 C ATOM 1517 C LEU I 11 54.721 6.196 -9.309 1.00 0.00 C ATOM 1518 O LEU I 11 55.633 5.395 -9.359 1.00 0.00 O ATOM 1519 CB LEU I 11 56.412 7.901 -8.565 1.00 0.00 C ATOM 1520 CG LEU I 11 56.583 7.208 -7.211 1.00 0.00 C ATOM 1521 CD1 LEU I 11 57.601 6.074 -7.342 1.00 0.00 C ATOM 1522 CD2 LEU I 11 57.080 8.222 -6.178 1.00 0.00 C ATOM 0 H LEU I 11 54.054 7.609 -7.150 1.00 0.00 H new ATOM 0 HA LEU I 11 54.801 8.190 -10.019 1.00 0.00 H new ATOM 0 HB2 LEU I 11 57.128 7.502 -9.283 1.00 0.00 H new ATOM 0 HB3 LEU I 11 56.617 8.967 -8.469 1.00 0.00 H new ATOM 0 HG LEU I 11 55.625 6.800 -6.889 1.00 0.00 H new ATOM 0 HD11 LEU I 11 57.722 5.581 -6.378 1.00 0.00 H new ATOM 0 HD12 LEU I 11 57.248 5.351 -8.077 1.00 0.00 H new ATOM 0 HD13 LEU I 11 58.559 6.481 -7.665 1.00 0.00 H new ATOM 0 HD21 LEU I 11 57.202 7.729 -5.214 1.00 0.00 H new ATOM 0 HD22 LEU I 11 58.038 8.630 -6.500 1.00 0.00 H new ATOM 0 HD23 LEU I 11 56.355 9.030 -6.083 1.00 0.00 H new ATOM 1534 N LEU I 12 53.481 5.816 -9.460 1.00 0.00 N ATOM 1535 CA LEU I 12 53.168 4.378 -9.695 1.00 0.00 C ATOM 1536 C LEU I 12 51.711 4.216 -10.139 1.00 0.00 C ATOM 1537 O LEU I 12 50.914 3.591 -9.468 1.00 0.00 O ATOM 1538 CB LEU I 12 53.396 3.698 -8.344 1.00 0.00 C ATOM 1539 CG LEU I 12 54.822 3.147 -8.281 1.00 0.00 C ATOM 1540 CD1 LEU I 12 55.629 3.933 -7.247 1.00 0.00 C ATOM 1541 CD2 LEU I 12 54.780 1.672 -7.875 1.00 0.00 C ATOM 0 H LEU I 12 52.673 6.438 -9.431 1.00 0.00 H new ATOM 0 HA LEU I 12 53.787 3.945 -10.480 1.00 0.00 H new ATOM 0 HB2 LEU I 12 53.235 4.410 -7.535 1.00 0.00 H new ATOM 0 HB3 LEU I 12 52.677 2.891 -8.206 1.00 0.00 H new ATOM 0 HG LEU I 12 55.291 3.244 -9.260 1.00 0.00 H new ATOM 0 HD11 LEU I 12 56.645 3.540 -7.203 1.00 0.00 H new ATOM 0 HD12 LEU I 12 55.659 4.985 -7.532 1.00 0.00 H new ATOM 0 HD13 LEU I 12 55.159 3.836 -6.268 1.00 0.00 H new ATOM 0 HD21 LEU I 12 55.795 1.278 -7.830 1.00 0.00 H new ATOM 0 HD22 LEU I 12 54.310 1.577 -6.896 1.00 0.00 H new ATOM 0 HD23 LEU I 12 54.205 1.109 -8.610 1.00 0.00 H new ATOM 1553 N GLY I 13 51.357 4.776 -11.264 1.00 0.00 N ATOM 1554 CA GLY I 13 49.952 4.651 -11.747 1.00 0.00 C ATOM 1555 C GLY I 13 49.759 5.515 -12.995 1.00 0.00 C ATOM 1556 O GLY I 13 50.263 6.617 -13.084 1.00 0.00 O ATOM 0 H GLY I 13 51.978 5.314 -11.868 1.00 0.00 H new ATOM 0 HA2 GLY I 13 49.727 3.609 -11.975 1.00 0.00 H new ATOM 0 HA3 GLY I 13 49.259 4.963 -10.966 1.00 0.00 H new ATOM 1560 N ALA I 14 49.028 5.024 -13.959 1.00 0.00 N ATOM 1561 CA ALA I 14 48.799 5.816 -15.202 1.00 0.00 C ATOM 1562 C ALA I 14 47.566 6.712 -15.037 1.00 0.00 C ATOM 1563 O ALA I 14 46.605 6.346 -14.390 1.00 0.00 O ATOM 1564 CB ALA I 14 48.561 4.774 -16.296 1.00 0.00 C ATOM 0 H ALA I 14 48.579 4.108 -13.940 1.00 0.00 H new ATOM 0 HA ALA I 14 49.639 6.470 -15.437 1.00 0.00 H new ATOM 0 HB1 ALA I 14 48.384 5.278 -17.246 1.00 0.00 H new ATOM 0 HB2 ALA I 14 49.437 4.132 -16.384 1.00 0.00 H new ATOM 0 HB3 ALA I 14 47.692 4.168 -16.039 1.00 0.00 H new ATOM 1570 N ARG I 15 47.584 7.882 -15.616 1.00 0.00 N ATOM 1571 CA ARG I 15 46.411 8.794 -15.488 1.00 0.00 C ATOM 1572 C ARG I 15 45.768 9.029 -16.859 1.00 0.00 C ATOM 1573 O ARG I 15 44.561 9.033 -16.995 1.00 0.00 O ATOM 1574 CB ARG I 15 46.978 10.100 -14.927 1.00 0.00 C ATOM 1575 CG ARG I 15 45.841 10.944 -14.344 1.00 0.00 C ATOM 1576 CD ARG I 15 46.088 11.178 -12.851 1.00 0.00 C ATOM 1577 NE ARG I 15 46.015 12.656 -12.675 1.00 0.00 N ATOM 1578 CZ ARG I 15 45.498 13.160 -11.586 1.00 0.00 C ATOM 1579 NH1 ARG I 15 46.079 12.960 -10.434 1.00 0.00 N ATOM 1580 NH2 ARG I 15 44.404 13.868 -11.651 1.00 0.00 N ATOM 0 H ARG I 15 48.359 8.245 -16.171 1.00 0.00 H new ATOM 0 HA ARG I 15 45.636 8.379 -14.843 1.00 0.00 H new ATOM 0 HB2 ARG I 15 47.718 9.886 -14.156 1.00 0.00 H new ATOM 0 HB3 ARG I 15 47.489 10.654 -15.714 1.00 0.00 H new ATOM 0 HG2 ARG I 15 45.778 11.899 -14.866 1.00 0.00 H new ATOM 0 HG3 ARG I 15 44.887 10.438 -14.490 1.00 0.00 H new ATOM 0 HD2 ARG I 15 45.339 10.671 -12.243 1.00 0.00 H new ATOM 0 HD3 ARG I 15 47.061 10.792 -12.547 1.00 0.00 H new ATOM 0 HE ARG I 15 46.369 13.274 -13.405 1.00 0.00 H new ATOM 0 HH11 ARG I 15 46.937 12.410 -10.384 1.00 0.00 H new ATOM 0 HH12 ARG I 15 45.675 13.354 -9.584 1.00 0.00 H new ATOM 0 HH21 ARG I 15 43.953 14.028 -12.552 1.00 0.00 H new ATOM 0 HH22 ARG I 15 44.000 14.262 -10.801 1.00 0.00 H new ATOM 1594 N ALA I 16 46.563 9.225 -17.877 1.00 0.00 N ATOM 1595 CA ALA I 16 45.989 9.458 -19.233 1.00 0.00 C ATOM 1596 C ALA I 16 47.103 9.536 -20.281 1.00 0.00 C ATOM 1597 O ALA I 16 46.990 10.234 -21.270 1.00 0.00 O ATOM 1598 CB ALA I 16 45.258 10.796 -19.128 1.00 0.00 C ATOM 0 H ALA I 16 47.582 9.234 -17.828 1.00 0.00 H new ATOM 0 HA ALA I 16 45.324 8.651 -19.541 1.00 0.00 H new ATOM 0 HB1 ALA I 16 44.806 11.040 -20.089 1.00 0.00 H new ATOM 0 HB2 ALA I 16 44.480 10.727 -18.368 1.00 0.00 H new ATOM 0 HB3 ALA I 16 45.966 11.577 -18.851 1.00 0.00 H new ATOM 1604 N LYS I 17 48.178 8.824 -20.077 1.00 0.00 N ATOM 1605 CA LYS I 17 49.294 8.860 -21.066 1.00 0.00 C ATOM 1606 C LYS I 17 50.457 7.989 -20.584 1.00 0.00 C ATOM 1607 O LYS I 17 51.581 8.276 -20.961 1.00 0.00 O ATOM 1608 CB LYS I 17 49.716 10.328 -21.137 1.00 0.00 C ATOM 1609 CG LYS I 17 50.052 10.694 -22.585 1.00 0.00 C ATOM 1610 CD LYS I 17 48.857 11.401 -23.224 1.00 0.00 C ATOM 1611 CE LYS I 17 49.348 12.595 -24.045 1.00 0.00 C ATOM 1612 NZ LYS I 17 48.143 13.446 -24.246 1.00 0.00 N ATOM 1613 OXT LYS I 17 50.204 7.051 -19.846 1.00 0.00 O ATOM 0 H LYS I 17 48.332 8.220 -19.270 1.00 0.00 H new ATOM 0 HA LYS I 17 48.993 8.476 -22.041 1.00 0.00 H new ATOM 0 HB2 LYS I 17 48.914 10.966 -20.766 1.00 0.00 H new ATOM 0 HB3 LYS I 17 50.582 10.500 -20.497 1.00 0.00 H new ATOM 0 HG2 LYS I 17 50.929 11.341 -22.613 1.00 0.00 H new ATOM 0 HG3 LYS I 17 50.301 9.796 -23.150 1.00 0.00 H new ATOM 0 HD2 LYS I 17 48.310 10.708 -23.863 1.00 0.00 H new ATOM 0 HD3 LYS I 17 48.165 11.737 -22.452 1.00 0.00 H new ATOM 0 HE2 LYS I 17 50.132 13.139 -23.519 1.00 0.00 H new ATOM 0 HE3 LYS I 17 49.767 12.273 -24.998 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 48.400 14.286 -24.802 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 47.416 12.904 -24.755 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 47.770 13.743 -23.322 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 69.546 -3.909 6.395 1.00 0.00 CA