USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=18 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: C 69 SER OG : rot 88:sc= 1.18 USER MOD Set 1.2: C 71 THR OG1 : rot 180:sc= 1.03 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 X(o=0,f=0) USER MOD Single : C 13 THR OG1 : rot 180:sc= -0.151 USER MOD Single : C 16 GLN : amide:sc= -0.0255 K(o=-0.025,f=-0.95) USER MOD Single : C 17 LYS NZ :NH3+ 162:sc= 0.316 (180deg=0.0929) USER MOD Single : C 18 ASN : amide:sc= -0.0401 X(o=-0.04,f=-0.084) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 180:sc= 0.089 USER MOD Single : C 37 SER OG : rot 180:sc= -4.72! USER MOD Single : C 38 THR OG1 : rot -82:sc= 0.0128 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl 153:sc= -13.7! (180deg=-14.6!) USER MOD Single : C 47 MET CE :methyl 158:sc= -6.85! (180deg=-7.45!) USER MOD Single : C 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 51 ASN : amide:sc= -0.453 K(o=-0.45,f=-1.5) USER MOD Single : C 53 THR OG1 : rot 180:sc= -0.193 USER MOD Single : C 58 GLN : amide:sc= -5.14! C(o=-5.1!,f=-6.1!) USER MOD Single : C 60 MET CE :methyl 134:sc= -3.48! (180deg=-9.49!) USER MOD Single : C 80 MET CE :methyl -153:sc= -0.474 (180deg=-1.31) USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot -43:sc= -1.92! USER MOD Single : C 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : I 3 SER OG : rot 180:sc= 0 USER MOD Single : I 7 MET CE :methyl 163:sc= -17.9! (180deg=-19.7!) USER MOD Single : I 8 MET CE :methyl -140:sc= -10! (180deg=-12.9!) USER MOD Single : I 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : I 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 58.355 -8.318 21.123 1.00 0.00 N ATOM 2 CA MET C 1 57.807 -8.447 19.742 1.00 0.00 C ATOM 3 C MET C 1 57.918 -9.897 19.264 1.00 0.00 C ATOM 4 O MET C 1 59.000 -10.416 19.069 1.00 0.00 O ATOM 5 CB MET C 1 58.676 -7.529 18.882 1.00 0.00 C ATOM 6 CG MET C 1 57.861 -6.307 18.455 1.00 0.00 C ATOM 7 SD MET C 1 58.784 -5.368 17.214 1.00 0.00 S ATOM 8 CE MET C 1 58.738 -3.769 18.060 1.00 0.00 C ATOM 0 H1 MET C 1 58.275 -7.330 21.437 1.00 0.00 H new ATOM 0 H2 MET C 1 57.818 -8.932 21.768 1.00 0.00 H new ATOM 0 H3 MET C 1 59.355 -8.602 21.128 1.00 0.00 H new ATOM 0 HA MET C 1 56.753 -8.175 19.688 1.00 0.00 H new ATOM 0 HB2 MET C 1 59.556 -7.214 19.442 1.00 0.00 H new ATOM 0 HB3 MET C 1 59.033 -8.067 18.003 1.00 0.00 H new ATOM 0 HG2 MET C 1 56.900 -6.622 18.048 1.00 0.00 H new ATOM 0 HG3 MET C 1 57.650 -5.678 19.319 1.00 0.00 H new ATOM 0 HE1 MET C 1 59.260 -3.024 17.459 1.00 0.00 H new ATOM 0 HE2 MET C 1 57.702 -3.461 18.199 1.00 0.00 H new ATOM 0 HE3 MET C 1 59.224 -3.857 19.032 1.00 0.00 H new ATOM 20 N ASP C 2 56.808 -10.555 19.072 1.00 0.00 N ATOM 21 CA ASP C 2 56.849 -11.971 18.606 1.00 0.00 C ATOM 22 C ASP C 2 56.698 -12.029 17.083 1.00 0.00 C ATOM 23 O ASP C 2 57.172 -11.166 16.370 1.00 0.00 O ATOM 24 CB ASP C 2 55.660 -12.647 19.291 1.00 0.00 C ATOM 25 CG ASP C 2 55.991 -14.116 19.559 1.00 0.00 C ATOM 26 OD1 ASP C 2 56.375 -14.797 18.622 1.00 0.00 O ATOM 27 OD2 ASP C 2 55.852 -14.536 20.696 1.00 0.00 O ATOM 0 H ASP C 2 55.873 -10.173 19.218 1.00 0.00 H new ATOM 0 HA ASP C 2 57.791 -12.461 18.850 1.00 0.00 H new ATOM 0 HB2 ASP C 2 55.429 -12.139 20.227 1.00 0.00 H new ATOM 0 HB3 ASP C 2 54.774 -12.572 18.661 1.00 0.00 H new ATOM 32 N ASP C 3 56.043 -13.038 16.578 1.00 0.00 N ATOM 33 CA ASP C 3 55.866 -13.144 15.100 1.00 0.00 C ATOM 34 C ASP C 3 54.699 -12.265 14.642 1.00 0.00 C ATOM 35 O ASP C 3 53.557 -12.679 14.651 1.00 0.00 O ATOM 36 CB ASP C 3 55.559 -14.620 14.842 1.00 0.00 C ATOM 37 CG ASP C 3 56.466 -15.141 13.726 1.00 0.00 C ATOM 38 OD1 ASP C 3 56.087 -15.013 12.573 1.00 0.00 O ATOM 39 OD2 ASP C 3 57.523 -15.661 14.043 1.00 0.00 O ATOM 0 H ASP C 3 55.623 -13.792 17.122 1.00 0.00 H new ATOM 0 HA ASP C 3 56.748 -12.810 14.554 1.00 0.00 H new ATOM 0 HB2 ASP C 3 55.714 -15.199 15.752 1.00 0.00 H new ATOM 0 HB3 ASP C 3 54.513 -14.741 14.562 1.00 0.00 H new ATOM 44 N ILE C 4 54.978 -11.055 14.242 1.00 0.00 N ATOM 45 CA ILE C 4 53.885 -10.152 13.782 1.00 0.00 C ATOM 46 C ILE C 4 54.217 -9.579 12.402 1.00 0.00 C ATOM 47 O ILE C 4 53.342 -9.311 11.604 1.00 0.00 O ATOM 48 CB ILE C 4 53.825 -9.039 14.829 1.00 0.00 C ATOM 49 CG1 ILE C 4 53.305 -9.612 16.150 1.00 0.00 C ATOM 50 CG2 ILE C 4 52.884 -7.933 14.349 1.00 0.00 C ATOM 51 CD1 ILE C 4 53.870 -8.803 17.317 1.00 0.00 C ATOM 0 H ILE C 4 55.915 -10.653 14.214 1.00 0.00 H new ATOM 0 HA ILE C 4 52.932 -10.671 13.686 1.00 0.00 H new ATOM 0 HB ILE C 4 54.823 -8.626 14.977 1.00 0.00 H new ATOM 0 HG12 ILE C 4 52.216 -9.582 16.167 1.00 0.00 H new ATOM 0 HG13 ILE C 4 53.597 -10.658 16.244 1.00 0.00 H new ATOM 0 HG21 ILE C 4 52.843 -7.141 15.096 1.00 0.00 H new ATOM 0 HG22 ILE C 4 53.252 -7.525 13.408 1.00 0.00 H new ATOM 0 HG23 ILE C 4 51.885 -8.344 14.200 1.00 0.00 H new ATOM 0 HD11 ILE C 4 53.499 -9.212 18.257 1.00 0.00 H new ATOM 0 HD12 ILE C 4 54.959 -8.856 17.303 1.00 0.00 H new ATOM 0 HD13 ILE C 4 53.556 -7.763 17.225 1.00 0.00 H new ATOM 63 N TYR C 5 55.477 -9.391 12.115 1.00 0.00 N ATOM 64 CA TYR C 5 55.864 -8.837 10.785 1.00 0.00 C ATOM 65 C TYR C 5 56.105 -9.976 9.789 1.00 0.00 C ATOM 66 O TYR C 5 55.426 -10.092 8.788 1.00 0.00 O ATOM 67 CB TYR C 5 57.158 -8.063 11.038 1.00 0.00 C ATOM 68 CG TYR C 5 56.896 -6.943 12.015 1.00 0.00 C ATOM 69 CD1 TYR C 5 56.928 -7.193 13.392 1.00 0.00 C ATOM 70 CD2 TYR C 5 56.622 -5.653 11.544 1.00 0.00 C ATOM 71 CE1 TYR C 5 56.686 -6.153 14.298 1.00 0.00 C ATOM 72 CE2 TYR C 5 56.379 -4.613 12.450 1.00 0.00 C ATOM 73 CZ TYR C 5 56.411 -4.863 13.827 1.00 0.00 C ATOM 74 OH TYR C 5 56.172 -3.839 14.720 1.00 0.00 O ATOM 0 H TYR C 5 56.254 -9.597 12.743 1.00 0.00 H new ATOM 0 HA TYR C 5 55.087 -8.202 10.360 1.00 0.00 H new ATOM 0 HB2 TYR C 5 57.922 -8.732 11.433 1.00 0.00 H new ATOM 0 HB3 TYR C 5 57.541 -7.659 10.101 1.00 0.00 H new ATOM 0 HD1 TYR C 5 57.139 -8.188 13.756 1.00 0.00 H new ATOM 0 HD2 TYR C 5 56.598 -5.460 10.482 1.00 0.00 H new ATOM 0 HE1 TYR C 5 56.711 -6.346 15.360 1.00 0.00 H new ATOM 0 HE2 TYR C 5 56.167 -3.618 12.086 1.00 0.00 H new ATOM 0 HH TYR C 5 55.999 -3.009 14.228 1.00 0.00 H new ATOM 84 N LYS C 6 57.067 -10.817 10.054 1.00 0.00 N ATOM 85 CA LYS C 6 57.350 -11.947 9.122 1.00 0.00 C ATOM 86 C LYS C 6 56.042 -12.619 8.696 1.00 0.00 C ATOM 87 O LYS C 6 55.899 -13.069 7.576 1.00 0.00 O ATOM 88 CB LYS C 6 58.217 -12.918 9.925 1.00 0.00 C ATOM 89 CG LYS C 6 59.648 -12.381 10.001 1.00 0.00 C ATOM 90 CD LYS C 6 60.430 -13.162 11.059 1.00 0.00 C ATOM 91 CE LYS C 6 60.597 -12.299 12.311 1.00 0.00 C ATOM 92 NZ LYS C 6 61.827 -11.495 12.063 1.00 0.00 N ATOM 0 H LYS C 6 57.670 -10.771 10.876 1.00 0.00 H new ATOM 0 HA LYS C 6 57.849 -11.616 8.211 1.00 0.00 H new ATOM 0 HB2 LYS C 6 57.810 -13.041 10.928 1.00 0.00 H new ATOM 0 HB3 LYS C 6 58.211 -13.902 9.455 1.00 0.00 H new ATOM 0 HG2 LYS C 6 60.135 -12.475 9.030 1.00 0.00 H new ATOM 0 HG3 LYS C 6 59.637 -11.320 10.251 1.00 0.00 H new ATOM 0 HD2 LYS C 6 59.905 -14.084 11.308 1.00 0.00 H new ATOM 0 HD3 LYS C 6 61.407 -13.447 10.668 1.00 0.00 H new ATOM 0 HE2 LYS C 6 59.730 -11.657 12.466 1.00 0.00 H new ATOM 0 HE3 LYS C 6 60.701 -12.915 13.204 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 62.008 -10.877 12.879 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 62.637 -12.133 11.926 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 61.696 -10.914 11.211 1.00 0.00 H new ATOM 106 N ALA C 7 55.085 -12.689 9.581 1.00 0.00 N ATOM 107 CA ALA C 7 53.788 -13.330 9.225 1.00 0.00 C ATOM 108 C ALA C 7 53.078 -12.519 8.138 1.00 0.00 C ATOM 109 O ALA C 7 52.841 -13.001 7.047 1.00 0.00 O ATOM 110 CB ALA C 7 52.972 -13.321 10.520 1.00 0.00 C ATOM 0 H ALA C 7 55.145 -12.330 10.534 1.00 0.00 H new ATOM 0 HA ALA C 7 53.920 -14.339 8.834 1.00 0.00 H new ATOM 0 HB1 ALA C 7 51.999 -13.778 10.340 1.00 0.00 H new ATOM 0 HB2 ALA C 7 53.502 -13.885 11.288 1.00 0.00 H new ATOM 0 HB3 ALA C 7 52.833 -12.293 10.856 1.00 0.00 H new ATOM 116 N ALA C 8 52.738 -11.292 8.422 1.00 0.00 N ATOM 117 CA ALA C 8 52.045 -10.456 7.400 1.00 0.00 C ATOM 118 C ALA C 8 52.743 -10.597 6.044 1.00 0.00 C ATOM 119 O ALA C 8 52.132 -10.454 5.004 1.00 0.00 O ATOM 120 CB ALA C 8 52.160 -9.021 7.914 1.00 0.00 C ATOM 0 H ALA C 8 52.910 -10.832 9.316 1.00 0.00 H new ATOM 0 HA ALA C 8 51.006 -10.754 7.258 1.00 0.00 H new ATOM 0 HB1 ALA C 8 51.672 -8.343 7.214 1.00 0.00 H new ATOM 0 HB2 ALA C 8 51.678 -8.944 8.889 1.00 0.00 H new ATOM 0 HB3 ALA C 8 53.212 -8.751 8.007 1.00 0.00 H new ATOM 126 N VAL C 9 54.017 -10.876 6.049 1.00 0.00 N ATOM 127 CA VAL C 9 54.752 -11.026 4.761 1.00 0.00 C ATOM 128 C VAL C 9 54.380 -12.354 4.095 1.00 0.00 C ATOM 129 O VAL C 9 53.883 -12.385 2.986 1.00 0.00 O ATOM 130 CB VAL C 9 56.233 -11.015 5.142 1.00 0.00 C ATOM 131 CG1 VAL C 9 57.085 -10.959 3.874 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.529 -9.788 6.009 1.00 0.00 C ATOM 0 H VAL C 9 54.581 -11.007 6.889 1.00 0.00 H new ATOM 0 HA VAL C 9 54.509 -10.234 4.053 1.00 0.00 H new ATOM 0 HB VAL C 9 56.470 -11.920 5.701 1.00 0.00 H new ATOM 0 HG11 VAL C 9 58.141 -10.951 4.145 1.00 0.00 H new ATOM 0 HG12 VAL C 9 56.876 -11.832 3.256 1.00 0.00 H new ATOM 0 HG13 VAL C 9 56.847 -10.054 3.315 1.00 0.00 H new ATOM 0 HG21 VAL C 9 57.585 -9.780 6.280 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.291 -8.882 5.451 1.00 0.00 H new ATOM 0 HG23 VAL C 9 55.922 -9.827 6.914 1.00 0.00 H new ATOM 142 N GLU C 10 54.614 -13.449 4.763 1.00 0.00 N ATOM 143 CA GLU C 10 54.272 -14.772 4.168 1.00 0.00 C ATOM 144 C GLU C 10 52.810 -14.785 3.718 1.00 0.00 C ATOM 145 O GLU C 10 52.411 -15.578 2.889 1.00 0.00 O ATOM 146 CB GLU C 10 54.493 -15.781 5.295 1.00 0.00 C ATOM 147 CG GLU C 10 55.705 -16.655 4.969 1.00 0.00 C ATOM 148 CD GLU C 10 56.769 -16.475 6.053 1.00 0.00 C ATOM 149 OE1 GLU C 10 57.175 -15.346 6.276 1.00 0.00 O ATOM 150 OE2 GLU C 10 57.159 -17.469 6.643 1.00 0.00 O ATOM 0 H GLU C 10 55.027 -13.486 5.695 1.00 0.00 H new ATOM 0 HA GLU C 10 54.878 -15.000 3.291 1.00 0.00 H new ATOM 0 HB2 GLU C 10 54.651 -15.259 6.239 1.00 0.00 H new ATOM 0 HB3 GLU C 10 53.606 -16.403 5.420 1.00 0.00 H new ATOM 0 HG2 GLU C 10 55.406 -17.701 4.908 1.00 0.00 H new ATOM 0 HG3 GLU C 10 56.112 -16.382 3.995 1.00 0.00 H new ATOM 157 N GLN C 11 52.007 -13.908 4.258 1.00 0.00 N ATOM 158 CA GLN C 11 50.571 -13.870 3.860 1.00 0.00 C ATOM 159 C GLN C 11 50.414 -13.136 2.527 1.00 0.00 C ATOM 160 O GLN C 11 49.443 -13.315 1.818 1.00 0.00 O ATOM 161 CB GLN C 11 49.869 -13.103 4.982 1.00 0.00 C ATOM 162 CG GLN C 11 48.771 -13.979 5.587 1.00 0.00 C ATOM 163 CD GLN C 11 48.981 -14.092 7.097 1.00 0.00 C ATOM 164 OE1 GLN C 11 48.444 -13.311 7.857 1.00 0.00 O ATOM 165 NE2 GLN C 11 49.745 -15.039 7.569 1.00 0.00 N ATOM 0 H GLN C 11 52.283 -13.218 4.956 1.00 0.00 H new ATOM 0 HA GLN C 11 50.152 -14.867 3.725 1.00 0.00 H new ATOM 0 HB2 GLN C 11 50.589 -12.821 5.750 1.00 0.00 H new ATOM 0 HB3 GLN C 11 49.440 -12.180 4.593 1.00 0.00 H new ATOM 0 HG2 GLN C 11 47.792 -13.549 5.377 1.00 0.00 H new ATOM 0 HG3 GLN C 11 48.789 -14.969 5.132 1.00 0.00 H new ATOM 0 HE21 GLN C 11 50.196 -15.695 6.932 1.00 0.00 H new ATOM 0 HE22 GLN C 11 49.891 -15.123 8.575 1.00 0.00 H new ATOM 174 N LEU C 12 51.362 -12.310 2.181 1.00 0.00 N ATOM 175 CA LEU C 12 51.270 -11.565 0.894 1.00 0.00 C ATOM 176 C LEU C 12 50.829 -12.506 -0.231 1.00 0.00 C ATOM 177 O LEU C 12 50.767 -13.707 -0.061 1.00 0.00 O ATOM 178 CB LEU C 12 52.684 -11.043 0.638 1.00 0.00 C ATOM 179 CG LEU C 12 53.009 -9.937 1.643 1.00 0.00 C ATOM 180 CD1 LEU C 12 54.517 -9.676 1.651 1.00 0.00 C ATOM 181 CD2 LEU C 12 52.272 -8.655 1.246 1.00 0.00 C ATOM 0 H LEU C 12 52.197 -12.118 2.734 1.00 0.00 H new ATOM 0 HA LEU C 12 50.540 -10.757 0.934 1.00 0.00 H new ATOM 0 HB2 LEU C 12 53.405 -11.855 0.729 1.00 0.00 H new ATOM 0 HB3 LEU C 12 52.763 -10.659 -0.379 1.00 0.00 H new ATOM 0 HG LEU C 12 52.691 -10.248 2.638 1.00 0.00 H new ATOM 0 HD11 LEU C 12 54.746 -8.887 2.368 1.00 0.00 H new ATOM 0 HD12 LEU C 12 55.043 -10.588 1.934 1.00 0.00 H new ATOM 0 HD13 LEU C 12 54.838 -9.366 0.656 1.00 0.00 H new ATOM 0 HD21 LEU C 12 52.503 -7.866 1.962 1.00 0.00 H new ATOM 0 HD22 LEU C 12 52.590 -8.346 0.250 1.00 0.00 H new ATOM 0 HD23 LEU C 12 51.198 -8.839 1.243 1.00 0.00 H new ATOM 193 N THR C 13 50.519 -11.968 -1.379 1.00 0.00 N ATOM 194 CA THR C 13 50.078 -12.830 -2.513 1.00 0.00 C ATOM 195 C THR C 13 50.897 -12.516 -3.768 1.00 0.00 C ATOM 196 O THR C 13 51.598 -11.526 -3.832 1.00 0.00 O ATOM 197 CB THR C 13 48.605 -12.480 -2.736 1.00 0.00 C ATOM 198 OG1 THR C 13 48.268 -11.330 -1.971 1.00 0.00 O ATOM 199 CG2 THR C 13 47.727 -13.655 -2.304 1.00 0.00 C ATOM 0 H THR C 13 50.552 -10.969 -1.581 1.00 0.00 H new ATOM 0 HA THR C 13 50.216 -13.890 -2.298 1.00 0.00 H new ATOM 0 HB THR C 13 48.439 -12.274 -3.793 1.00 0.00 H new ATOM 0 HG1 THR C 13 47.325 -11.106 -2.116 1.00 0.00 H new ATOM 0 HG21 THR C 13 46.678 -13.404 -2.464 1.00 0.00 H new ATOM 0 HG22 THR C 13 47.983 -14.536 -2.893 1.00 0.00 H new ATOM 0 HG23 THR C 13 47.893 -13.864 -1.247 1.00 0.00 H new ATOM 207 N GLU C 14 50.811 -13.353 -4.766 1.00 0.00 N ATOM 208 CA GLU C 14 51.581 -13.102 -6.018 1.00 0.00 C ATOM 209 C GLU C 14 51.216 -11.732 -6.595 1.00 0.00 C ATOM 210 O GLU C 14 52.073 -10.916 -6.871 1.00 0.00 O ATOM 211 CB GLU C 14 51.155 -14.217 -6.973 1.00 0.00 C ATOM 212 CG GLU C 14 52.024 -14.172 -8.232 1.00 0.00 C ATOM 213 CD GLU C 14 53.239 -15.082 -8.045 1.00 0.00 C ATOM 214 OE1 GLU C 14 53.137 -16.025 -7.277 1.00 0.00 O ATOM 215 OE2 GLU C 14 54.252 -14.822 -8.673 1.00 0.00 O ATOM 0 H GLU C 14 50.241 -14.199 -4.769 1.00 0.00 H new ATOM 0 HA GLU C 14 52.658 -13.099 -5.849 1.00 0.00 H new ATOM 0 HB2 GLU C 14 51.254 -15.186 -6.484 1.00 0.00 H new ATOM 0 HB3 GLU C 14 50.104 -14.100 -7.239 1.00 0.00 H new ATOM 0 HG2 GLU C 14 51.445 -14.493 -9.098 1.00 0.00 H new ATOM 0 HG3 GLU C 14 52.348 -13.150 -8.427 1.00 0.00 H new ATOM 222 N GLU C 15 49.950 -11.474 -6.778 1.00 0.00 N ATOM 223 CA GLU C 15 49.532 -10.157 -7.335 1.00 0.00 C ATOM 224 C GLU C 15 49.936 -9.030 -6.382 1.00 0.00 C ATOM 225 O GLU C 15 50.497 -8.032 -6.789 1.00 0.00 O ATOM 226 CB GLU C 15 48.010 -10.242 -7.456 1.00 0.00 C ATOM 227 CG GLU C 15 47.556 -9.500 -8.715 1.00 0.00 C ATOM 228 CD GLU C 15 46.028 -9.408 -8.730 1.00 0.00 C ATOM 229 OE1 GLU C 15 45.417 -9.875 -7.782 1.00 0.00 O ATOM 230 OE2 GLU C 15 45.496 -8.874 -9.688 1.00 0.00 O ATOM 0 H GLU C 15 49.188 -12.118 -6.566 1.00 0.00 H new ATOM 0 HA GLU C 15 50.003 -9.945 -8.295 1.00 0.00 H new ATOM 0 HB2 GLU C 15 47.696 -11.285 -7.502 1.00 0.00 H new ATOM 0 HB3 GLU C 15 47.540 -9.806 -6.575 1.00 0.00 H new ATOM 0 HG2 GLU C 15 47.991 -8.501 -8.738 1.00 0.00 H new ATOM 0 HG3 GLU C 15 47.908 -10.022 -9.605 1.00 0.00 H new ATOM 237 N GLN C 16 49.658 -9.183 -5.117 1.00 0.00 N ATOM 238 CA GLN C 16 50.033 -8.120 -4.140 1.00 0.00 C ATOM 239 C GLN C 16 51.536 -7.841 -4.224 1.00 0.00 C ATOM 240 O GLN C 16 51.966 -6.705 -4.246 1.00 0.00 O ATOM 241 CB GLN C 16 49.666 -8.690 -2.770 1.00 0.00 C ATOM 242 CG GLN C 16 50.363 -7.879 -1.676 1.00 0.00 C ATOM 243 CD GLN C 16 49.847 -6.439 -1.704 1.00 0.00 C ATOM 244 OE1 GLN C 16 48.692 -6.201 -1.997 1.00 0.00 O ATOM 245 NE2 GLN C 16 50.660 -5.460 -1.410 1.00 0.00 N ATOM 0 H GLN C 16 49.189 -9.996 -4.717 1.00 0.00 H new ATOM 0 HA GLN C 16 49.521 -7.177 -4.335 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.586 -8.658 -2.629 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.965 -9.736 -2.708 1.00 0.00 H new ATOM 0 HG2 GLN C 16 50.173 -8.326 -0.700 1.00 0.00 H new ATOM 0 HG3 GLN C 16 51.442 -7.893 -1.829 1.00 0.00 H new ATOM 0 HE21 GLN C 16 51.630 -5.659 -1.164 1.00 0.00 H new ATOM 0 HE22 GLN C 16 50.325 -4.497 -1.426 1.00 0.00 H new ATOM 254 N LYS C 17 52.337 -8.870 -4.279 1.00 0.00 N ATOM 255 CA LYS C 17 53.809 -8.662 -4.369 1.00 0.00 C ATOM 256 C LYS C 17 54.132 -7.861 -5.635 1.00 0.00 C ATOM 257 O LYS C 17 54.971 -6.982 -5.630 1.00 0.00 O ATOM 258 CB LYS C 17 54.400 -10.078 -4.425 1.00 0.00 C ATOM 259 CG LYS C 17 55.692 -10.089 -5.249 1.00 0.00 C ATOM 260 CD LYS C 17 55.341 -10.201 -6.733 1.00 0.00 C ATOM 261 CE LYS C 17 55.961 -11.475 -7.313 1.00 0.00 C ATOM 262 NZ LYS C 17 54.997 -12.558 -6.976 1.00 0.00 N ATOM 0 H LYS C 17 52.036 -9.844 -4.265 1.00 0.00 H new ATOM 0 HA LYS C 17 54.219 -8.099 -3.531 1.00 0.00 H new ATOM 0 HB2 LYS C 17 54.603 -10.434 -3.415 1.00 0.00 H new ATOM 0 HB3 LYS C 17 53.676 -10.764 -4.865 1.00 0.00 H new ATOM 0 HG2 LYS C 17 56.262 -9.178 -5.066 1.00 0.00 H new ATOM 0 HG3 LYS C 17 56.322 -10.926 -4.948 1.00 0.00 H new ATOM 0 HD2 LYS C 17 54.259 -10.221 -6.861 1.00 0.00 H new ATOM 0 HD3 LYS C 17 55.710 -9.328 -7.271 1.00 0.00 H new ATOM 0 HE2 LYS C 17 56.100 -11.391 -8.391 1.00 0.00 H new ATOM 0 HE3 LYS C 17 56.942 -11.670 -6.879 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 55.178 -13.385 -7.580 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 55.112 -12.827 -5.978 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 54.026 -12.220 -7.134 1.00 0.00 H new ATOM 276 N ASN C 18 53.462 -8.151 -6.717 1.00 0.00 N ATOM 277 CA ASN C 18 53.721 -7.398 -7.977 1.00 0.00 C ATOM 278 C ASN C 18 53.347 -5.928 -7.785 1.00 0.00 C ATOM 279 O ASN C 18 53.825 -5.056 -8.483 1.00 0.00 O ATOM 280 CB ASN C 18 52.815 -8.049 -9.022 1.00 0.00 C ATOM 281 CG ASN C 18 53.581 -9.157 -9.747 1.00 0.00 C ATOM 282 OD1 ASN C 18 54.178 -8.924 -10.780 1.00 0.00 O ATOM 283 ND2 ASN C 18 53.590 -10.361 -9.246 1.00 0.00 N ATOM 0 H ASN C 18 52.747 -8.876 -6.783 1.00 0.00 H new ATOM 0 HA ASN C 18 54.769 -7.430 -8.275 1.00 0.00 H new ATOM 0 HB2 ASN C 18 51.927 -8.461 -8.542 1.00 0.00 H new ATOM 0 HB3 ASN C 18 52.473 -7.301 -9.738 1.00 0.00 H new ATOM 0 HD21 ASN C 18 54.098 -11.107 -9.721 1.00 0.00 H new ATOM 0 HD22 ASN C 18 53.089 -10.556 -8.379 1.00 0.00 H new ATOM 290 N GLU C 19 52.495 -5.648 -6.836 1.00 0.00 N ATOM 291 CA GLU C 19 52.087 -4.235 -6.588 1.00 0.00 C ATOM 292 C GLU C 19 53.246 -3.460 -5.961 1.00 0.00 C ATOM 293 O GLU C 19 53.703 -2.468 -6.494 1.00 0.00 O ATOM 294 CB GLU C 19 50.914 -4.331 -5.611 1.00 0.00 C ATOM 295 CG GLU C 19 49.753 -3.476 -6.120 1.00 0.00 C ATOM 296 CD GLU C 19 48.965 -2.926 -4.929 1.00 0.00 C ATOM 297 OE1 GLU C 19 49.541 -2.178 -4.158 1.00 0.00 O ATOM 298 OE2 GLU C 19 47.799 -3.266 -4.809 1.00 0.00 O ATOM 0 H GLU C 19 52.063 -6.338 -6.221 1.00 0.00 H new ATOM 0 HA GLU C 19 51.812 -3.713 -7.504 1.00 0.00 H new ATOM 0 HB2 GLU C 19 50.597 -5.369 -5.508 1.00 0.00 H new ATOM 0 HB3 GLU C 19 51.222 -3.992 -4.622 1.00 0.00 H new ATOM 0 HG2 GLU C 19 50.131 -2.655 -6.730 1.00 0.00 H new ATOM 0 HG3 GLU C 19 49.100 -4.072 -6.758 1.00 0.00 H new ATOM 305 N PHE C 20 53.727 -3.905 -4.833 1.00 0.00 N ATOM 306 CA PHE C 20 54.857 -3.194 -4.176 1.00 0.00 C ATOM 307 C PHE C 20 56.102 -3.257 -5.074 1.00 0.00 C ATOM 308 O PHE C 20 56.910 -2.350 -5.093 1.00 0.00 O ATOM 309 CB PHE C 20 55.050 -3.926 -2.832 1.00 0.00 C ATOM 310 CG PHE C 20 56.340 -4.717 -2.807 1.00 0.00 C ATOM 311 CD1 PHE C 20 57.566 -4.052 -2.677 1.00 0.00 C ATOM 312 CD2 PHE C 20 56.308 -6.113 -2.905 1.00 0.00 C ATOM 313 CE1 PHE C 20 58.759 -4.784 -2.646 1.00 0.00 C ATOM 314 CE2 PHE C 20 57.502 -6.844 -2.872 1.00 0.00 C ATOM 315 CZ PHE C 20 58.727 -6.180 -2.743 1.00 0.00 C ATOM 0 H PHE C 20 53.386 -4.730 -4.339 1.00 0.00 H new ATOM 0 HA PHE C 20 54.669 -2.133 -4.011 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.052 -3.200 -2.019 1.00 0.00 H new ATOM 0 HB3 PHE C 20 54.208 -4.596 -2.658 1.00 0.00 H new ATOM 0 HD1 PHE C 20 57.591 -2.975 -2.601 1.00 0.00 H new ATOM 0 HD2 PHE C 20 55.363 -6.626 -3.006 1.00 0.00 H new ATOM 0 HE1 PHE C 20 59.704 -4.271 -2.547 1.00 0.00 H new ATOM 0 HE2 PHE C 20 57.477 -7.921 -2.946 1.00 0.00 H new ATOM 0 HZ PHE C 20 59.647 -6.744 -2.718 1.00 0.00 H new ATOM 325 N LYS C 21 56.254 -4.316 -5.824 1.00 0.00 N ATOM 326 CA LYS C 21 57.435 -4.425 -6.725 1.00 0.00 C ATOM 327 C LYS C 21 57.629 -3.116 -7.493 1.00 0.00 C ATOM 328 O LYS C 21 58.739 -2.686 -7.740 1.00 0.00 O ATOM 329 CB LYS C 21 57.092 -5.560 -7.688 1.00 0.00 C ATOM 330 CG LYS C 21 58.056 -6.725 -7.466 1.00 0.00 C ATOM 331 CD LYS C 21 58.939 -6.902 -8.701 1.00 0.00 C ATOM 332 CE LYS C 21 58.132 -7.563 -9.820 1.00 0.00 C ATOM 333 NZ LYS C 21 59.141 -7.933 -10.852 1.00 0.00 N ATOM 0 H LYS C 21 55.612 -5.108 -5.851 1.00 0.00 H new ATOM 0 HA LYS C 21 58.358 -4.617 -6.178 1.00 0.00 H new ATOM 0 HB2 LYS C 21 56.065 -5.888 -7.529 1.00 0.00 H new ATOM 0 HB3 LYS C 21 57.159 -5.210 -8.718 1.00 0.00 H new ATOM 0 HG2 LYS C 21 58.674 -6.536 -6.588 1.00 0.00 H new ATOM 0 HG3 LYS C 21 57.497 -7.641 -7.272 1.00 0.00 H new ATOM 0 HD2 LYS C 21 59.315 -5.934 -9.033 1.00 0.00 H new ATOM 0 HD3 LYS C 21 59.807 -7.514 -8.455 1.00 0.00 H new ATOM 0 HE2 LYS C 21 57.598 -8.441 -9.457 1.00 0.00 H new ATOM 0 HE3 LYS C 21 57.385 -6.880 -10.225 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 58.665 -8.393 -11.654 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 59.629 -7.076 -11.184 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 59.835 -8.589 -10.440 1.00 0.00 H new ATOM 347 N ALA C 22 56.555 -2.479 -7.871 1.00 0.00 N ATOM 348 CA ALA C 22 56.674 -1.196 -8.623 1.00 0.00 C ATOM 349 C ALA C 22 57.584 -0.227 -7.866 1.00 0.00 C ATOM 350 O ALA C 22 58.653 0.122 -8.325 1.00 0.00 O ATOM 351 CB ALA C 22 55.248 -0.649 -8.698 1.00 0.00 C ATOM 0 H ALA C 22 55.600 -2.790 -7.692 1.00 0.00 H new ATOM 0 HA ALA C 22 57.109 -1.333 -9.613 1.00 0.00 H new ATOM 0 HB1 ALA C 22 55.249 0.298 -9.238 1.00 0.00 H new ATOM 0 HB2 ALA C 22 54.611 -1.364 -9.219 1.00 0.00 H new ATOM 0 HB3 ALA C 22 54.866 -0.491 -7.690 1.00 0.00 H new ATOM 357 N ALA C 23 57.172 0.207 -6.706 1.00 0.00 N ATOM 358 CA ALA C 23 58.022 1.148 -5.922 1.00 0.00 C ATOM 359 C ALA C 23 59.413 0.544 -5.717 1.00 0.00 C ATOM 360 O ALA C 23 60.418 1.215 -5.850 1.00 0.00 O ATOM 361 CB ALA C 23 57.302 1.314 -4.583 1.00 0.00 C ATOM 0 H ALA C 23 56.287 -0.048 -6.268 1.00 0.00 H new ATOM 0 HA ALA C 23 58.160 2.104 -6.426 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.868 1.995 -3.948 1.00 0.00 H new ATOM 0 HB2 ALA C 23 56.305 1.721 -4.754 1.00 0.00 H new ATOM 0 HB3 ALA C 23 57.219 0.344 -4.092 1.00 0.00 H new ATOM 367 N PHE C 24 59.478 -0.720 -5.401 1.00 0.00 N ATOM 368 CA PHE C 24 60.804 -1.370 -5.197 1.00 0.00 C ATOM 369 C PHE C 24 61.754 -0.982 -6.336 1.00 0.00 C ATOM 370 O PHE C 24 62.913 -0.687 -6.119 1.00 0.00 O ATOM 371 CB PHE C 24 60.508 -2.875 -5.209 1.00 0.00 C ATOM 372 CG PHE C 24 61.748 -3.647 -5.599 1.00 0.00 C ATOM 373 CD1 PHE C 24 62.980 -3.333 -5.014 1.00 0.00 C ATOM 374 CD2 PHE C 24 61.665 -4.673 -6.548 1.00 0.00 C ATOM 375 CE1 PHE C 24 64.130 -4.045 -5.378 1.00 0.00 C ATOM 376 CE2 PHE C 24 62.814 -5.385 -6.912 1.00 0.00 C ATOM 377 CZ PHE C 24 64.047 -5.070 -6.327 1.00 0.00 C ATOM 0 H PHE C 24 58.671 -1.331 -5.275 1.00 0.00 H new ATOM 0 HA PHE C 24 61.288 -1.065 -4.269 1.00 0.00 H new ATOM 0 HB2 PHE C 24 60.167 -3.194 -4.224 1.00 0.00 H new ATOM 0 HB3 PHE C 24 59.702 -3.089 -5.910 1.00 0.00 H new ATOM 0 HD1 PHE C 24 63.044 -2.542 -4.282 1.00 0.00 H new ATOM 0 HD2 PHE C 24 60.714 -4.915 -6.999 1.00 0.00 H new ATOM 0 HE1 PHE C 24 65.081 -3.803 -4.926 1.00 0.00 H new ATOM 0 HE2 PHE C 24 62.750 -6.177 -7.644 1.00 0.00 H new ATOM 0 HZ PHE C 24 64.934 -5.618 -6.608 1.00 0.00 H new ATOM 387 N ASP C 25 61.269 -0.979 -7.547 1.00 0.00 N ATOM 388 CA ASP C 25 62.142 -0.609 -8.698 1.00 0.00 C ATOM 389 C ASP C 25 62.466 0.886 -8.657 1.00 0.00 C ATOM 390 O ASP C 25 63.613 1.282 -8.604 1.00 0.00 O ATOM 391 CB ASP C 25 61.317 -0.943 -9.942 1.00 0.00 C ATOM 392 CG ASP C 25 62.181 -0.758 -11.191 1.00 0.00 C ATOM 393 OD1 ASP C 25 62.954 0.187 -11.218 1.00 0.00 O ATOM 394 OD2 ASP C 25 62.055 -1.562 -12.099 1.00 0.00 O ATOM 0 H ASP C 25 60.307 -1.216 -7.790 1.00 0.00 H new ATOM 0 HA ASP C 25 63.093 -1.141 -8.683 1.00 0.00 H new ATOM 0 HB2 ASP C 25 60.954 -1.969 -9.886 1.00 0.00 H new ATOM 0 HB3 ASP C 25 60.440 -0.298 -9.994 1.00 0.00 H new ATOM 399 N ILE C 26 61.461 1.718 -8.677 1.00 0.00 N ATOM 400 CA ILE C 26 61.706 3.188 -8.638 1.00 0.00 C ATOM 401 C ILE C 26 62.565 3.550 -7.423 1.00 0.00 C ATOM 402 O ILE C 26 63.232 4.565 -7.403 1.00 0.00 O ATOM 403 CB ILE C 26 60.316 3.813 -8.514 1.00 0.00 C ATOM 404 CG1 ILE C 26 59.610 3.753 -9.870 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.448 5.272 -8.072 1.00 0.00 C ATOM 406 CD1 ILE C 26 58.791 2.464 -9.963 1.00 0.00 C ATOM 0 H ILE C 26 60.480 1.443 -8.719 1.00 0.00 H new ATOM 0 HA ILE C 26 62.239 3.543 -9.520 1.00 0.00 H new ATOM 0 HB ILE C 26 59.734 3.262 -7.775 1.00 0.00 H new ATOM 0 HG12 ILE C 26 58.960 4.619 -9.992 1.00 0.00 H new ATOM 0 HG13 ILE C 26 60.343 3.789 -10.676 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.457 5.717 -7.984 1.00 0.00 H new ATOM 0 HG22 ILE C 26 60.952 5.316 -7.107 1.00 0.00 H new ATOM 0 HG23 ILE C 26 61.029 5.825 -8.810 1.00 0.00 H new ATOM 0 HD11 ILE C 26 58.288 2.421 -10.929 1.00 0.00 H new ATOM 0 HD12 ILE C 26 59.453 1.604 -9.860 1.00 0.00 H new ATOM 0 HD13 ILE C 26 58.048 2.447 -9.166 1.00 0.00 H new ATOM 418 N PHE C 27 62.551 2.731 -6.409 1.00 0.00 N ATOM 419 CA PHE C 27 63.363 3.035 -5.196 1.00 0.00 C ATOM 420 C PHE C 27 64.842 2.743 -5.456 1.00 0.00 C ATOM 421 O PHE C 27 65.715 3.320 -4.839 1.00 0.00 O ATOM 422 CB PHE C 27 62.812 2.111 -4.111 1.00 0.00 C ATOM 423 CG PHE C 27 62.075 2.931 -3.080 1.00 0.00 C ATOM 424 CD1 PHE C 27 61.018 3.762 -3.472 1.00 0.00 C ATOM 425 CD2 PHE C 27 62.451 2.864 -1.734 1.00 0.00 C ATOM 426 CE1 PHE C 27 60.336 4.524 -2.516 1.00 0.00 C ATOM 427 CE2 PHE C 27 61.770 3.627 -0.778 1.00 0.00 C ATOM 428 CZ PHE C 27 60.712 4.457 -1.169 1.00 0.00 C ATOM 0 H PHE C 27 62.014 1.865 -6.367 1.00 0.00 H new ATOM 0 HA PHE C 27 63.298 4.085 -4.909 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.141 1.374 -4.552 1.00 0.00 H new ATOM 0 HB3 PHE C 27 63.626 1.560 -3.639 1.00 0.00 H new ATOM 0 HD1 PHE C 27 60.729 3.815 -4.511 1.00 0.00 H new ATOM 0 HD2 PHE C 27 63.267 2.224 -1.432 1.00 0.00 H new ATOM 0 HE1 PHE C 27 59.520 5.164 -2.818 1.00 0.00 H new ATOM 0 HE2 PHE C 27 62.061 3.576 0.261 1.00 0.00 H new ATOM 0 HZ PHE C 27 60.186 5.045 -0.432 1.00 0.00 H new ATOM 438 N VAL C 28 65.134 1.850 -6.362 1.00 0.00 N ATOM 439 CA VAL C 28 66.558 1.522 -6.655 1.00 0.00 C ATOM 440 C VAL C 28 66.895 1.860 -8.110 1.00 0.00 C ATOM 441 O VAL C 28 67.967 1.555 -8.595 1.00 0.00 O ATOM 442 CB VAL C 28 66.665 0.018 -6.420 1.00 0.00 C ATOM 443 CG1 VAL C 28 66.184 -0.315 -5.006 1.00 0.00 C ATOM 444 CG2 VAL C 28 65.793 -0.717 -7.441 1.00 0.00 C ATOM 0 H VAL C 28 64.448 1.333 -6.912 1.00 0.00 H new ATOM 0 HA VAL C 28 67.250 2.088 -6.032 1.00 0.00 H new ATOM 0 HB VAL C 28 67.703 -0.295 -6.532 1.00 0.00 H new ATOM 0 HG11 VAL C 28 66.261 -1.389 -4.839 1.00 0.00 H new ATOM 0 HG12 VAL C 28 66.802 0.210 -4.278 1.00 0.00 H new ATOM 0 HG13 VAL C 28 65.146 -0.003 -4.892 1.00 0.00 H new ATOM 0 HG21 VAL C 28 65.867 -1.792 -7.276 1.00 0.00 H new ATOM 0 HG22 VAL C 28 64.756 -0.403 -7.326 1.00 0.00 H new ATOM 0 HG23 VAL C 28 66.135 -0.480 -8.449 1.00 0.00 H new ATOM 454 N LEU C 29 65.988 2.482 -8.812 1.00 0.00 N ATOM 455 CA LEU C 29 66.256 2.830 -10.239 1.00 0.00 C ATOM 456 C LEU C 29 67.644 3.463 -10.387 1.00 0.00 C ATOM 457 O LEU C 29 68.272 3.363 -11.422 1.00 0.00 O ATOM 458 CB LEU C 29 65.168 3.838 -10.612 1.00 0.00 C ATOM 459 CG LEU C 29 64.267 3.237 -11.694 1.00 0.00 C ATOM 460 CD1 LEU C 29 63.234 4.276 -12.135 1.00 0.00 C ATOM 461 CD2 LEU C 29 65.121 2.826 -12.896 1.00 0.00 C ATOM 0 H LEU C 29 65.073 2.765 -8.461 1.00 0.00 H new ATOM 0 HA LEU C 29 66.241 1.951 -10.884 1.00 0.00 H new ATOM 0 HB2 LEU C 29 64.577 4.094 -9.732 1.00 0.00 H new ATOM 0 HB3 LEU C 29 65.621 4.762 -10.972 1.00 0.00 H new ATOM 0 HG LEU C 29 63.754 2.362 -11.295 1.00 0.00 H new ATOM 0 HD11 LEU C 29 62.593 3.847 -12.905 1.00 0.00 H new ATOM 0 HD12 LEU C 29 62.626 4.571 -11.280 1.00 0.00 H new ATOM 0 HD13 LEU C 29 63.746 5.151 -12.535 1.00 0.00 H new ATOM 0 HD21 LEU C 29 64.481 2.398 -13.668 1.00 0.00 H new ATOM 0 HD22 LEU C 29 65.634 3.701 -13.294 1.00 0.00 H new ATOM 0 HD23 LEU C 29 65.857 2.086 -12.583 1.00 0.00 H new ATOM 473 N GLY C 30 68.127 4.115 -9.365 1.00 0.00 N ATOM 474 CA GLY C 30 69.472 4.752 -9.457 1.00 0.00 C ATOM 475 C GLY C 30 70.511 3.871 -8.758 1.00 0.00 C ATOM 476 O GLY C 30 71.695 4.133 -8.810 1.00 0.00 O ATOM 0 H GLY C 30 67.650 4.234 -8.472 1.00 0.00 H new ATOM 0 HA2 GLY C 30 69.746 4.895 -10.502 1.00 0.00 H new ATOM 0 HA3 GLY C 30 69.449 5.739 -8.996 1.00 0.00 H new ATOM 480 N ALA C 31 70.077 2.828 -8.106 1.00 0.00 N ATOM 481 CA ALA C 31 71.044 1.932 -7.406 1.00 0.00 C ATOM 482 C ALA C 31 71.850 1.126 -8.427 1.00 0.00 C ATOM 483 O ALA C 31 71.303 0.523 -9.329 1.00 0.00 O ATOM 484 CB ALA C 31 70.177 1.006 -6.553 1.00 0.00 C ATOM 0 H ALA C 31 69.097 2.557 -8.027 1.00 0.00 H new ATOM 0 HA ALA C 31 71.762 2.487 -6.803 1.00 0.00 H new ATOM 0 HB1 ALA C 31 70.815 0.313 -6.004 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.595 1.600 -5.848 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.502 0.444 -7.198 1.00 0.00 H new ATOM 490 N GLU C 32 73.149 1.108 -8.293 1.00 0.00 N ATOM 491 CA GLU C 32 73.987 0.339 -9.258 1.00 0.00 C ATOM 492 C GLU C 32 74.097 -1.122 -8.815 1.00 0.00 C ATOM 493 O GLU C 32 74.777 -1.918 -9.433 1.00 0.00 O ATOM 494 CB GLU C 32 75.359 1.016 -9.222 1.00 0.00 C ATOM 495 CG GLU C 32 75.940 0.923 -7.809 1.00 0.00 C ATOM 496 CD GLU C 32 77.262 0.152 -7.846 1.00 0.00 C ATOM 497 OE1 GLU C 32 77.783 -0.040 -8.932 1.00 0.00 O ATOM 498 OE2 GLU C 32 77.731 -0.231 -6.788 1.00 0.00 O ATOM 0 H GLU C 32 73.665 1.592 -7.558 1.00 0.00 H new ATOM 0 HA GLU C 32 73.562 0.335 -10.262 1.00 0.00 H new ATOM 0 HB2 GLU C 32 76.031 0.537 -9.935 1.00 0.00 H new ATOM 0 HB3 GLU C 32 75.269 2.060 -9.521 1.00 0.00 H new ATOM 0 HG2 GLU C 32 76.102 1.922 -7.405 1.00 0.00 H new ATOM 0 HG3 GLU C 32 75.234 0.422 -7.147 1.00 0.00 H new ATOM 505 N ASP C 33 73.434 -1.482 -7.751 1.00 0.00 N ATOM 506 CA ASP C 33 73.502 -2.893 -7.272 1.00 0.00 C ATOM 507 C ASP C 33 72.102 -3.511 -7.245 1.00 0.00 C ATOM 508 O ASP C 33 71.946 -4.714 -7.166 1.00 0.00 O ATOM 509 CB ASP C 33 74.078 -2.805 -5.858 1.00 0.00 C ATOM 510 CG ASP C 33 75.530 -3.288 -5.868 1.00 0.00 C ATOM 511 OD1 ASP C 33 76.323 -2.706 -6.589 1.00 0.00 O ATOM 512 OD2 ASP C 33 75.823 -4.233 -5.155 1.00 0.00 O ATOM 0 H ASP C 33 72.848 -0.861 -7.192 1.00 0.00 H new ATOM 0 HA ASP C 33 74.112 -3.520 -7.922 1.00 0.00 H new ATOM 0 HB2 ASP C 33 74.028 -1.778 -5.497 1.00 0.00 H new ATOM 0 HB3 ASP C 33 73.486 -3.413 -5.174 1.00 0.00 H new ATOM 517 N GLY C 34 71.083 -2.699 -7.311 1.00 0.00 N ATOM 518 CA GLY C 34 69.695 -3.242 -7.291 1.00 0.00 C ATOM 519 C GLY C 34 69.112 -3.108 -5.884 1.00 0.00 C ATOM 520 O GLY C 34 68.048 -3.619 -5.590 1.00 0.00 O ATOM 0 H GLY C 34 71.151 -1.683 -7.378 1.00 0.00 H new ATOM 0 HA2 GLY C 34 69.073 -2.704 -8.006 1.00 0.00 H new ATOM 0 HA3 GLY C 34 69.699 -4.288 -7.596 1.00 0.00 H new ATOM 524 N CYS C 35 69.798 -2.422 -5.009 1.00 0.00 N ATOM 525 CA CYS C 35 69.280 -2.253 -3.621 1.00 0.00 C ATOM 526 C CYS C 35 68.972 -0.777 -3.353 1.00 0.00 C ATOM 527 O CYS C 35 69.237 0.079 -4.172 1.00 0.00 O ATOM 528 CB CYS C 35 70.412 -2.737 -2.714 1.00 0.00 C ATOM 529 SG CYS C 35 71.885 -1.724 -2.993 1.00 0.00 S ATOM 0 H CYS C 35 70.694 -1.972 -5.196 1.00 0.00 H new ATOM 0 HA CYS C 35 68.358 -2.809 -3.452 1.00 0.00 H new ATOM 0 HB2 CYS C 35 70.107 -2.674 -1.669 1.00 0.00 H new ATOM 0 HB3 CYS C 35 70.634 -3.784 -2.919 1.00 0.00 H new ATOM 0 HG CYS C 35 72.846 -2.134 -2.220 1.00 0.00 H new ATOM 535 N ILE C 36 68.415 -0.472 -2.213 1.00 0.00 N ATOM 536 CA ILE C 36 68.093 0.951 -1.899 1.00 0.00 C ATOM 537 C ILE C 36 69.161 1.543 -0.976 1.00 0.00 C ATOM 538 O ILE C 36 69.871 0.834 -0.291 1.00 0.00 O ATOM 539 CB ILE C 36 66.738 0.907 -1.192 1.00 0.00 C ATOM 540 CG1 ILE C 36 65.755 0.076 -2.019 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.191 2.329 -1.038 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.537 -0.272 -1.161 1.00 0.00 C ATOM 0 H ILE C 36 68.169 -1.144 -1.486 1.00 0.00 H new ATOM 0 HA ILE C 36 68.064 1.574 -2.793 1.00 0.00 H new ATOM 0 HB ILE C 36 66.862 0.455 -0.208 1.00 0.00 H new ATOM 0 HG12 ILE C 36 65.444 0.633 -2.903 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.238 -0.835 -2.371 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.225 2.295 -0.534 1.00 0.00 H new ATOM 0 HG22 ILE C 36 66.887 2.925 -0.448 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.070 2.781 -2.022 1.00 0.00 H new ATOM 0 HD11 ILE C 36 63.835 -0.864 -1.748 1.00 0.00 H new ATOM 0 HD12 ILE C 36 64.857 -0.846 -0.291 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.050 0.646 -0.831 1.00 0.00 H new ATOM 554 N SER C 37 69.280 2.841 -0.961 1.00 0.00 N ATOM 555 CA SER C 37 70.298 3.495 -0.093 1.00 0.00 C ATOM 556 C SER C 37 69.892 4.942 0.166 1.00 0.00 C ATOM 557 O SER C 37 70.719 5.822 0.278 1.00 0.00 O ATOM 558 CB SER C 37 71.580 3.452 -0.907 1.00 0.00 C ATOM 559 OG SER C 37 72.240 2.213 -0.687 1.00 0.00 O ATOM 0 H SER C 37 68.712 3.481 -1.516 1.00 0.00 H new ATOM 0 HA SER C 37 70.406 3.004 0.874 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.355 3.573 -1.967 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.231 4.279 -0.623 1.00 0.00 H new ATOM 0 HG SER C 37 73.066 2.184 -1.213 1.00 0.00 H new ATOM 565 N THR C 38 68.616 5.186 0.230 1.00 0.00 N ATOM 566 CA THR C 38 68.103 6.576 0.451 1.00 0.00 C ATOM 567 C THR C 38 68.362 7.407 -0.806 1.00 0.00 C ATOM 568 O THR C 38 67.451 7.948 -1.401 1.00 0.00 O ATOM 569 CB THR C 38 68.867 7.153 1.655 1.00 0.00 C ATOM 570 OG1 THR C 38 70.047 7.802 1.205 1.00 0.00 O ATOM 571 CG2 THR C 38 69.235 6.039 2.641 1.00 0.00 C ATOM 0 H THR C 38 67.891 4.475 0.138 1.00 0.00 H new ATOM 0 HA THR C 38 67.031 6.586 0.650 1.00 0.00 H new ATOM 0 HB THR C 38 68.226 7.873 2.164 1.00 0.00 H new ATOM 0 HG1 THR C 38 70.751 7.136 1.059 1.00 0.00 H new ATOM 0 HG21 THR C 38 69.775 6.465 3.487 1.00 0.00 H new ATOM 0 HG22 THR C 38 68.326 5.554 2.998 1.00 0.00 H new ATOM 0 HG23 THR C 38 69.866 5.304 2.141 1.00 0.00 H new ATOM 579 N LYS C 39 69.592 7.495 -1.231 1.00 0.00 N ATOM 580 CA LYS C 39 69.890 8.270 -2.465 1.00 0.00 C ATOM 581 C LYS C 39 68.886 7.882 -3.551 1.00 0.00 C ATOM 582 O LYS C 39 68.457 8.700 -4.340 1.00 0.00 O ATOM 583 CB LYS C 39 71.308 7.857 -2.857 1.00 0.00 C ATOM 584 CG LYS C 39 72.239 8.050 -1.660 1.00 0.00 C ATOM 585 CD LYS C 39 73.662 8.313 -2.154 1.00 0.00 C ATOM 586 CE LYS C 39 73.783 9.768 -2.618 1.00 0.00 C ATOM 587 NZ LYS C 39 74.966 9.791 -3.525 1.00 0.00 N ATOM 0 H LYS C 39 70.399 7.066 -0.779 1.00 0.00 H new ATOM 0 HA LYS C 39 69.817 9.348 -2.324 1.00 0.00 H new ATOM 0 HB2 LYS C 39 71.320 6.815 -3.178 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.653 8.454 -3.701 1.00 0.00 H new ATOM 0 HG2 LYS C 39 71.895 8.885 -1.050 1.00 0.00 H new ATOM 0 HG3 LYS C 39 72.221 7.163 -1.026 1.00 0.00 H new ATOM 0 HD2 LYS C 39 74.378 8.114 -1.356 1.00 0.00 H new ATOM 0 HD3 LYS C 39 73.904 7.637 -2.975 1.00 0.00 H new ATOM 0 HE2 LYS C 39 72.882 10.092 -3.138 1.00 0.00 H new ATOM 0 HE3 LYS C 39 73.922 10.441 -1.772 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 75.111 10.757 -3.882 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 75.811 9.485 -3.001 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 74.803 9.147 -4.325 1.00 0.00 H new ATOM 601 N GLU C 40 68.492 6.636 -3.578 1.00 0.00 N ATOM 602 CA GLU C 40 67.496 6.185 -4.590 1.00 0.00 C ATOM 603 C GLU C 40 66.098 6.265 -3.983 1.00 0.00 C ATOM 604 O GLU C 40 65.130 6.588 -4.644 1.00 0.00 O ATOM 605 CB GLU C 40 67.860 4.732 -4.897 1.00 0.00 C ATOM 606 CG GLU C 40 69.374 4.604 -5.062 1.00 0.00 C ATOM 607 CD GLU C 40 69.840 5.498 -6.212 1.00 0.00 C ATOM 608 OE1 GLU C 40 68.991 5.970 -6.950 1.00 0.00 O ATOM 609 OE2 GLU C 40 71.037 5.698 -6.336 1.00 0.00 O ATOM 0 H GLU C 40 68.819 5.910 -2.940 1.00 0.00 H new ATOM 0 HA GLU C 40 67.506 6.797 -5.492 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.516 4.083 -4.092 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.356 4.405 -5.807 1.00 0.00 H new ATOM 0 HG2 GLU C 40 69.877 4.890 -4.138 1.00 0.00 H new ATOM 0 HG3 GLU C 40 69.642 3.567 -5.262 1.00 0.00 H new ATOM 616 N LEU C 41 65.994 5.972 -2.716 1.00 0.00 N ATOM 617 CA LEU C 41 64.674 6.023 -2.031 1.00 0.00 C ATOM 618 C LEU C 41 64.235 7.486 -1.860 1.00 0.00 C ATOM 619 O LEU C 41 63.178 7.882 -2.310 1.00 0.00 O ATOM 620 CB LEU C 41 64.929 5.325 -0.681 1.00 0.00 C ATOM 621 CG LEU C 41 64.255 6.077 0.473 1.00 0.00 C ATOM 622 CD1 LEU C 41 62.767 6.252 0.171 1.00 0.00 C ATOM 623 CD2 LEU C 41 64.419 5.275 1.766 1.00 0.00 C ATOM 0 H LEU C 41 66.776 5.697 -2.121 1.00 0.00 H new ATOM 0 HA LEU C 41 63.870 5.536 -2.583 1.00 0.00 H new ATOM 0 HB2 LEU C 41 64.552 4.303 -0.721 1.00 0.00 H new ATOM 0 HB3 LEU C 41 66.002 5.262 -0.499 1.00 0.00 H new ATOM 0 HG LEU C 41 64.720 7.056 0.588 1.00 0.00 H new ATOM 0 HD11 LEU C 41 62.289 6.787 0.992 1.00 0.00 H new ATOM 0 HD12 LEU C 41 62.647 6.821 -0.751 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.301 5.273 0.056 1.00 0.00 H new ATOM 0 HD21 LEU C 41 63.941 5.808 2.588 1.00 0.00 H new ATOM 0 HD22 LEU C 41 63.954 4.296 1.649 1.00 0.00 H new ATOM 0 HD23 LEU C 41 65.480 5.149 1.984 1.00 0.00 H new ATOM 635 N GLY C 42 65.037 8.285 -1.215 1.00 0.00 N ATOM 636 CA GLY C 42 64.663 9.715 -1.016 1.00 0.00 C ATOM 637 C GLY C 42 64.192 10.317 -2.342 1.00 0.00 C ATOM 638 O GLY C 42 63.231 11.059 -2.390 1.00 0.00 O ATOM 0 H GLY C 42 65.935 8.011 -0.817 1.00 0.00 H new ATOM 0 HA2 GLY C 42 63.873 9.793 -0.269 1.00 0.00 H new ATOM 0 HA3 GLY C 42 65.518 10.274 -0.635 1.00 0.00 H new ATOM 642 N LYS C 43 64.864 10.010 -3.418 1.00 0.00 N ATOM 643 CA LYS C 43 64.456 10.572 -4.739 1.00 0.00 C ATOM 644 C LYS C 43 62.945 10.438 -4.939 1.00 0.00 C ATOM 645 O LYS C 43 62.331 11.226 -5.629 1.00 0.00 O ATOM 646 CB LYS C 43 65.212 9.738 -5.774 1.00 0.00 C ATOM 647 CG LYS C 43 66.339 10.579 -6.380 1.00 0.00 C ATOM 648 CD LYS C 43 66.165 10.651 -7.896 1.00 0.00 C ATOM 649 CE LYS C 43 66.863 9.457 -8.549 1.00 0.00 C ATOM 650 NZ LYS C 43 65.841 8.862 -9.455 1.00 0.00 N ATOM 0 H LYS C 43 65.677 9.395 -3.440 1.00 0.00 H new ATOM 0 HA LYS C 43 64.687 11.634 -4.821 1.00 0.00 H new ATOM 0 HB2 LYS C 43 65.622 8.843 -5.306 1.00 0.00 H new ATOM 0 HB3 LYS C 43 64.531 9.405 -6.557 1.00 0.00 H new ATOM 0 HG2 LYS C 43 66.327 11.582 -5.954 1.00 0.00 H new ATOM 0 HG3 LYS C 43 67.306 10.140 -6.135 1.00 0.00 H new ATOM 0 HD2 LYS C 43 65.105 10.650 -8.151 1.00 0.00 H new ATOM 0 HD3 LYS C 43 66.584 11.583 -8.277 1.00 0.00 H new ATOM 0 HE2 LYS C 43 67.747 9.771 -9.104 1.00 0.00 H new ATOM 0 HE3 LYS C 43 67.195 8.737 -7.801 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 66.246 8.036 -9.940 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 65.014 8.566 -8.898 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 65.549 9.568 -10.160 1.00 0.00 H new ATOM 664 N VAL C 44 62.337 9.448 -4.344 1.00 0.00 N ATOM 665 CA VAL C 44 60.866 9.276 -4.509 1.00 0.00 C ATOM 666 C VAL C 44 60.111 10.204 -3.553 1.00 0.00 C ATOM 667 O VAL C 44 58.979 10.573 -3.797 1.00 0.00 O ATOM 668 CB VAL C 44 60.593 7.814 -4.159 1.00 0.00 C ATOM 669 CG1 VAL C 44 59.089 7.606 -3.991 1.00 0.00 C ATOM 670 CG2 VAL C 44 61.107 6.911 -5.283 1.00 0.00 C ATOM 0 H VAL C 44 62.793 8.753 -3.753 1.00 0.00 H new ATOM 0 HA VAL C 44 60.536 9.522 -5.518 1.00 0.00 H new ATOM 0 HB VAL C 44 61.105 7.563 -3.230 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.892 6.564 -3.741 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.720 8.247 -3.190 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.581 7.859 -4.921 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.911 5.869 -5.031 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.597 7.161 -6.213 1.00 0.00 H new ATOM 0 HG23 VAL C 44 62.180 7.059 -5.407 1.00 0.00 H new ATOM 680 N MET C 45 60.726 10.582 -2.466 1.00 0.00 N ATOM 681 CA MET C 45 60.037 11.483 -1.496 1.00 0.00 C ATOM 682 C MET C 45 59.668 12.806 -2.170 1.00 0.00 C ATOM 683 O MET C 45 58.574 13.312 -2.008 1.00 0.00 O ATOM 684 CB MET C 45 61.054 11.712 -0.379 1.00 0.00 C ATOM 685 CG MET C 45 61.464 10.366 0.219 1.00 0.00 C ATOM 686 SD MET C 45 59.984 9.432 0.677 1.00 0.00 S ATOM 687 CE MET C 45 59.783 8.550 -0.891 1.00 0.00 C ATOM 0 H MET C 45 61.674 10.307 -2.207 1.00 0.00 H new ATOM 0 HA MET C 45 59.109 11.053 -1.120 1.00 0.00 H new ATOM 0 HB2 MET C 45 61.929 12.230 -0.770 1.00 0.00 H new ATOM 0 HB3 MET C 45 60.625 12.350 0.394 1.00 0.00 H new ATOM 0 HG2 MET C 45 62.055 9.801 -0.502 1.00 0.00 H new ATOM 0 HG3 MET C 45 62.094 10.522 1.095 1.00 0.00 H new ATOM 0 HE1 MET C 45 59.269 7.605 -0.714 1.00 0.00 H new ATOM 0 HE2 MET C 45 59.196 9.159 -1.579 1.00 0.00 H new ATOM 0 HE3 MET C 45 60.763 8.353 -1.326 1.00 0.00 H new ATOM 697 N ARG C 46 60.568 13.374 -2.925 1.00 0.00 N ATOM 698 CA ARG C 46 60.262 14.663 -3.607 1.00 0.00 C ATOM 699 C ARG C 46 59.106 14.478 -4.593 1.00 0.00 C ATOM 700 O ARG C 46 58.467 15.428 -5.002 1.00 0.00 O ATOM 701 CB ARG C 46 61.546 15.034 -4.350 1.00 0.00 C ATOM 702 CG ARG C 46 61.854 13.964 -5.400 1.00 0.00 C ATOM 703 CD ARG C 46 62.244 14.639 -6.716 1.00 0.00 C ATOM 704 NE ARG C 46 63.723 14.484 -6.804 1.00 0.00 N ATOM 705 CZ ARG C 46 64.245 13.722 -7.726 1.00 0.00 C ATOM 706 NH1 ARG C 46 63.587 12.685 -8.167 1.00 0.00 N ATOM 707 NH2 ARG C 46 65.428 13.996 -8.206 1.00 0.00 N ATOM 0 H ARG C 46 61.501 13.001 -3.099 1.00 0.00 H new ATOM 0 HA ARG C 46 59.959 15.440 -2.905 1.00 0.00 H new ATOM 0 HB2 ARG C 46 61.434 16.007 -4.829 1.00 0.00 H new ATOM 0 HB3 ARG C 46 62.375 15.118 -3.647 1.00 0.00 H new ATOM 0 HG2 ARG C 46 62.664 13.322 -5.054 1.00 0.00 H new ATOM 0 HG3 ARG C 46 60.984 13.325 -5.550 1.00 0.00 H new ATOM 0 HD2 ARG C 46 61.746 14.168 -7.564 1.00 0.00 H new ATOM 0 HD3 ARG C 46 61.956 15.690 -6.721 1.00 0.00 H new ATOM 0 HE ARG C 46 64.327 14.973 -6.144 1.00 0.00 H new ATOM 0 HH11 ARG C 46 62.664 12.469 -7.791 1.00 0.00 H new ATOM 0 HH12 ARG C 46 63.996 12.090 -8.888 1.00 0.00 H new ATOM 0 HH21 ARG C 46 65.944 14.805 -7.860 1.00 0.00 H new ATOM 0 HH22 ARG C 46 65.836 13.401 -8.927 1.00 0.00 H new ATOM 721 N MET C 47 58.833 13.262 -4.982 1.00 0.00 N ATOM 722 CA MET C 47 57.719 13.017 -5.945 1.00 0.00 C ATOM 723 C MET C 47 56.379 12.929 -5.207 1.00 0.00 C ATOM 724 O MET C 47 55.348 13.302 -5.730 1.00 0.00 O ATOM 725 CB MET C 47 58.054 11.681 -6.607 1.00 0.00 C ATOM 726 CG MET C 47 58.704 11.933 -7.970 1.00 0.00 C ATOM 727 SD MET C 47 59.997 10.700 -8.260 1.00 0.00 S ATOM 728 CE MET C 47 58.915 9.254 -8.360 1.00 0.00 C ATOM 0 H MET C 47 59.333 12.427 -4.675 1.00 0.00 H new ATOM 0 HA MET C 47 57.624 13.823 -6.673 1.00 0.00 H new ATOM 0 HB2 MET C 47 58.729 11.108 -5.971 1.00 0.00 H new ATOM 0 HB3 MET C 47 57.148 11.087 -6.729 1.00 0.00 H new ATOM 0 HG2 MET C 47 57.953 11.880 -8.758 1.00 0.00 H new ATOM 0 HG3 MET C 47 59.129 12.936 -8.002 1.00 0.00 H new ATOM 0 HE1 MET C 47 59.421 8.458 -8.907 1.00 0.00 H new ATOM 0 HE2 MET C 47 58.676 8.908 -7.354 1.00 0.00 H new ATOM 0 HE3 MET C 47 57.995 9.523 -8.879 1.00 0.00 H new ATOM 738 N LEU C 48 56.383 12.433 -4.000 1.00 0.00 N ATOM 739 CA LEU C 48 55.104 12.317 -3.239 1.00 0.00 C ATOM 740 C LEU C 48 54.727 13.666 -2.618 1.00 0.00 C ATOM 741 O LEU C 48 53.778 13.769 -1.867 1.00 0.00 O ATOM 742 CB LEU C 48 55.383 11.285 -2.147 1.00 0.00 C ATOM 743 CG LEU C 48 55.746 9.947 -2.791 1.00 0.00 C ATOM 744 CD1 LEU C 48 56.994 9.378 -2.115 1.00 0.00 C ATOM 745 CD2 LEU C 48 54.584 8.966 -2.619 1.00 0.00 C ATOM 0 H LEU C 48 57.213 12.104 -3.508 1.00 0.00 H new ATOM 0 HA LEU C 48 54.273 12.021 -3.878 1.00 0.00 H new ATOM 0 HB2 LEU C 48 56.198 11.626 -1.509 1.00 0.00 H new ATOM 0 HB3 LEU C 48 54.506 11.168 -1.510 1.00 0.00 H new ATOM 0 HG LEU C 48 55.942 10.097 -3.853 1.00 0.00 H new ATOM 0 HD11 LEU C 48 57.253 8.424 -2.574 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.823 10.076 -2.235 1.00 0.00 H new ATOM 0 HD13 LEU C 48 56.797 9.228 -1.054 1.00 0.00 H new ATOM 0 HD21 LEU C 48 54.842 8.012 -3.078 1.00 0.00 H new ATOM 0 HD22 LEU C 48 54.388 8.817 -1.557 1.00 0.00 H new ATOM 0 HD23 LEU C 48 53.693 9.370 -3.099 1.00 0.00 H new ATOM 757 N GLY C 49 55.460 14.700 -2.926 1.00 0.00 N ATOM 758 CA GLY C 49 55.137 16.037 -2.351 1.00 0.00 C ATOM 759 C GLY C 49 55.834 16.193 -0.999 1.00 0.00 C ATOM 760 O GLY C 49 55.487 17.044 -0.205 1.00 0.00 O ATOM 0 H GLY C 49 56.267 14.678 -3.549 1.00 0.00 H new ATOM 0 HA2 GLY C 49 55.460 16.825 -3.032 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.059 16.142 -2.230 1.00 0.00 H new ATOM 764 N GLN C 50 56.816 15.377 -0.732 1.00 0.00 N ATOM 765 CA GLN C 50 57.537 15.476 0.568 1.00 0.00 C ATOM 766 C GLN C 50 59.048 15.362 0.341 1.00 0.00 C ATOM 767 O GLN C 50 59.508 15.246 -0.778 1.00 0.00 O ATOM 768 CB GLN C 50 57.024 14.297 1.396 1.00 0.00 C ATOM 769 CG GLN C 50 55.648 14.639 1.970 1.00 0.00 C ATOM 770 CD GLN C 50 55.410 13.826 3.245 1.00 0.00 C ATOM 771 OE1 GLN C 50 54.600 12.921 3.260 1.00 0.00 O ATOM 772 NE2 GLN C 50 56.086 14.113 4.324 1.00 0.00 N ATOM 0 H GLN C 50 57.151 14.645 -1.359 1.00 0.00 H new ATOM 0 HA GLN C 50 57.363 16.428 1.069 1.00 0.00 H new ATOM 0 HB2 GLN C 50 56.959 13.403 0.775 1.00 0.00 H new ATOM 0 HB3 GLN C 50 57.722 14.074 2.203 1.00 0.00 H new ATOM 0 HG2 GLN C 50 55.588 15.705 2.189 1.00 0.00 H new ATOM 0 HG3 GLN C 50 54.872 14.421 1.237 1.00 0.00 H new ATOM 0 HE21 GLN C 50 56.766 14.873 4.313 1.00 0.00 H new ATOM 0 HE22 GLN C 50 55.934 13.577 5.179 1.00 0.00 H new ATOM 781 N ASN C 51 59.823 15.398 1.390 1.00 0.00 N ATOM 782 CA ASN C 51 61.301 15.295 1.223 1.00 0.00 C ATOM 783 C ASN C 51 61.987 15.193 2.590 1.00 0.00 C ATOM 784 O ASN C 51 62.289 16.193 3.209 1.00 0.00 O ATOM 785 CB ASN C 51 61.709 16.588 0.516 1.00 0.00 C ATOM 786 CG ASN C 51 62.823 16.291 -0.489 1.00 0.00 C ATOM 787 OD1 ASN C 51 62.680 15.435 -1.338 1.00 0.00 O ATOM 788 ND2 ASN C 51 63.936 16.969 -0.427 1.00 0.00 N ATOM 0 H ASN C 51 59.499 15.494 2.352 1.00 0.00 H new ATOM 0 HA ASN C 51 61.590 14.409 0.658 1.00 0.00 H new ATOM 0 HB2 ASN C 51 60.850 17.022 0.005 1.00 0.00 H new ATOM 0 HB3 ASN C 51 62.050 17.322 1.246 1.00 0.00 H new ATOM 0 HD21 ASN C 51 64.686 16.780 -1.092 1.00 0.00 H new ATOM 0 HD22 ASN C 51 64.056 17.688 0.286 1.00 0.00 H new ATOM 795 N PRO C 52 62.212 13.977 3.011 1.00 0.00 N ATOM 796 CA PRO C 52 62.873 13.734 4.317 1.00 0.00 C ATOM 797 C PRO C 52 64.367 14.063 4.232 1.00 0.00 C ATOM 798 O PRO C 52 64.907 14.267 3.164 1.00 0.00 O ATOM 799 CB PRO C 52 62.656 12.242 4.553 1.00 0.00 C ATOM 800 CG PRO C 52 62.475 11.655 3.189 1.00 0.00 C ATOM 801 CD PRO C 52 61.873 12.729 2.320 1.00 0.00 C ATOM 0 HA PRO C 52 62.474 14.351 5.122 1.00 0.00 H new ATOM 0 HB2 PRO C 52 63.509 11.796 5.065 1.00 0.00 H new ATOM 0 HB3 PRO C 52 61.781 12.065 5.178 1.00 0.00 H new ATOM 0 HG2 PRO C 52 63.430 11.322 2.783 1.00 0.00 H new ATOM 0 HG3 PRO C 52 61.824 10.782 3.229 1.00 0.00 H new ATOM 0 HD2 PRO C 52 62.287 12.706 1.312 1.00 0.00 H new ATOM 0 HD3 PRO C 52 60.794 12.606 2.224 1.00 0.00 H new ATOM 809 N THR C 53 65.039 14.115 5.351 1.00 0.00 N ATOM 810 CA THR C 53 66.497 14.430 5.333 1.00 0.00 C ATOM 811 C THR C 53 67.314 13.148 5.151 1.00 0.00 C ATOM 812 O THR C 53 66.810 12.059 5.335 1.00 0.00 O ATOM 813 CB THR C 53 66.787 15.055 6.700 1.00 0.00 C ATOM 814 OG1 THR C 53 66.762 14.043 7.697 1.00 0.00 O ATOM 815 CG2 THR C 53 65.728 16.112 7.017 1.00 0.00 C ATOM 0 H THR C 53 64.642 13.953 6.276 1.00 0.00 H new ATOM 0 HA THR C 53 66.762 15.098 4.513 1.00 0.00 H new ATOM 0 HB THR C 53 67.771 15.525 6.683 1.00 0.00 H new ATOM 0 HG1 THR C 53 66.949 14.442 8.572 1.00 0.00 H new ATOM 0 HG21 THR C 53 65.937 16.555 7.991 1.00 0.00 H new ATOM 0 HG22 THR C 53 65.749 16.889 6.253 1.00 0.00 H new ATOM 0 HG23 THR C 53 64.743 15.646 7.034 1.00 0.00 H new ATOM 823 N PRO C 54 68.557 13.326 4.795 1.00 0.00 N ATOM 824 CA PRO C 54 69.464 12.171 4.585 1.00 0.00 C ATOM 825 C PRO C 54 69.827 11.533 5.929 1.00 0.00 C ATOM 826 O PRO C 54 69.979 10.332 6.036 1.00 0.00 O ATOM 827 CB PRO C 54 70.692 12.795 3.929 1.00 0.00 C ATOM 828 CG PRO C 54 70.674 14.226 4.361 1.00 0.00 C ATOM 829 CD PRO C 54 69.229 14.608 4.555 1.00 0.00 C ATOM 0 HA PRO C 54 69.022 11.379 3.980 1.00 0.00 H new ATOM 0 HB2 PRO C 54 71.607 12.297 4.250 1.00 0.00 H new ATOM 0 HB3 PRO C 54 70.646 12.710 2.843 1.00 0.00 H new ATOM 0 HG2 PRO C 54 71.235 14.357 5.286 1.00 0.00 H new ATOM 0 HG3 PRO C 54 71.144 14.862 3.610 1.00 0.00 H new ATOM 0 HD2 PRO C 54 69.105 15.289 5.397 1.00 0.00 H new ATOM 0 HD3 PRO C 54 68.827 15.112 3.676 1.00 0.00 H new ATOM 837 N GLU C 55 69.963 12.326 6.956 1.00 0.00 N ATOM 838 CA GLU C 55 70.312 11.763 8.291 1.00 0.00 C ATOM 839 C GLU C 55 69.234 10.770 8.738 1.00 0.00 C ATOM 840 O GLU C 55 69.529 9.717 9.269 1.00 0.00 O ATOM 841 CB GLU C 55 70.358 12.967 9.230 1.00 0.00 C ATOM 842 CG GLU C 55 71.520 12.805 10.213 1.00 0.00 C ATOM 843 CD GLU C 55 72.704 13.655 9.748 1.00 0.00 C ATOM 844 OE1 GLU C 55 72.470 14.762 9.294 1.00 0.00 O ATOM 845 OE2 GLU C 55 73.823 13.182 9.853 1.00 0.00 O ATOM 0 H GLU C 55 69.848 13.339 6.929 1.00 0.00 H new ATOM 0 HA GLU C 55 71.259 11.223 8.280 1.00 0.00 H new ATOM 0 HB2 GLU C 55 70.479 13.885 8.655 1.00 0.00 H new ATOM 0 HB3 GLU C 55 69.417 13.053 9.774 1.00 0.00 H new ATOM 0 HG2 GLU C 55 71.210 13.110 11.212 1.00 0.00 H new ATOM 0 HG3 GLU C 55 71.813 11.757 10.276 1.00 0.00 H new ATOM 852 N GLU C 56 67.988 11.097 8.526 1.00 0.00 N ATOM 853 CA GLU C 56 66.894 10.170 8.937 1.00 0.00 C ATOM 854 C GLU C 56 66.646 9.134 7.839 1.00 0.00 C ATOM 855 O GLU C 56 66.226 8.023 8.102 1.00 0.00 O ATOM 856 CB GLU C 56 65.665 11.061 9.126 1.00 0.00 C ATOM 857 CG GLU C 56 65.325 11.154 10.614 1.00 0.00 C ATOM 858 CD GLU C 56 64.606 12.475 10.893 1.00 0.00 C ATOM 859 OE1 GLU C 56 63.734 12.828 10.115 1.00 0.00 O ATOM 860 OE2 GLU C 56 64.938 13.112 11.879 1.00 0.00 O ATOM 0 H GLU C 56 67.680 11.965 8.087 1.00 0.00 H new ATOM 0 HA GLU C 56 67.137 9.620 9.846 1.00 0.00 H new ATOM 0 HB2 GLU C 56 65.858 12.055 8.724 1.00 0.00 H new ATOM 0 HB3 GLU C 56 64.819 10.653 8.574 1.00 0.00 H new ATOM 0 HG2 GLU C 56 64.693 10.315 10.906 1.00 0.00 H new ATOM 0 HG3 GLU C 56 66.235 11.090 11.210 1.00 0.00 H new ATOM 867 N LEU C 57 66.906 9.485 6.607 1.00 0.00 N ATOM 868 CA LEU C 57 66.690 8.515 5.496 1.00 0.00 C ATOM 869 C LEU C 57 67.282 7.155 5.872 1.00 0.00 C ATOM 870 O LEU C 57 66.584 6.165 5.956 1.00 0.00 O ATOM 871 CB LEU C 57 67.429 9.112 4.299 1.00 0.00 C ATOM 872 CG LEU C 57 66.437 9.402 3.172 1.00 0.00 C ATOM 873 CD1 LEU C 57 67.185 9.984 1.972 1.00 0.00 C ATOM 874 CD2 LEU C 57 65.741 8.102 2.757 1.00 0.00 C ATOM 0 H LEU C 57 67.258 10.400 6.324 1.00 0.00 H new ATOM 0 HA LEU C 57 65.634 8.356 5.280 1.00 0.00 H new ATOM 0 HB2 LEU C 57 67.937 10.030 4.594 1.00 0.00 H new ATOM 0 HB3 LEU C 57 68.197 8.420 3.952 1.00 0.00 H new ATOM 0 HG LEU C 57 65.692 10.118 3.519 1.00 0.00 H new ATOM 0 HD11 LEU C 57 66.478 10.191 1.168 1.00 0.00 H new ATOM 0 HD12 LEU C 57 67.681 10.909 2.266 1.00 0.00 H new ATOM 0 HD13 LEU C 57 67.930 9.268 1.625 1.00 0.00 H new ATOM 0 HD21 LEU C 57 65.034 8.308 1.954 1.00 0.00 H new ATOM 0 HD22 LEU C 57 66.485 7.385 2.410 1.00 0.00 H new ATOM 0 HD23 LEU C 57 65.208 7.686 3.612 1.00 0.00 H new ATOM 886 N GLN C 58 68.565 7.101 6.105 1.00 0.00 N ATOM 887 CA GLN C 58 69.197 5.806 6.486 1.00 0.00 C ATOM 888 C GLN C 58 68.454 5.201 7.679 1.00 0.00 C ATOM 889 O GLN C 58 68.440 4.002 7.874 1.00 0.00 O ATOM 890 CB GLN C 58 70.634 6.162 6.871 1.00 0.00 C ATOM 891 CG GLN C 58 71.558 4.989 6.537 1.00 0.00 C ATOM 892 CD GLN C 58 71.031 3.717 7.202 1.00 0.00 C ATOM 893 OE1 GLN C 58 71.133 3.557 8.402 1.00 0.00 O ATOM 894 NE2 GLN C 58 70.464 2.798 6.469 1.00 0.00 N ATOM 0 H GLN C 58 69.202 7.896 6.048 1.00 0.00 H new ATOM 0 HA GLN C 58 69.166 5.073 5.680 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.955 7.055 6.335 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.690 6.391 7.935 1.00 0.00 H new ATOM 0 HG2 GLN C 58 71.612 4.851 5.457 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.570 5.200 6.883 1.00 0.00 H new ATOM 0 HE21 GLN C 58 70.378 2.931 5.461 1.00 0.00 H new ATOM 0 HE22 GLN C 58 70.107 1.947 6.904 1.00 0.00 H new ATOM 903 N GLU C 59 67.831 6.026 8.477 1.00 0.00 N ATOM 904 CA GLU C 59 67.083 5.507 9.657 1.00 0.00 C ATOM 905 C GLU C 59 65.954 4.581 9.198 1.00 0.00 C ATOM 906 O GLU C 59 65.514 3.713 9.926 1.00 0.00 O ATOM 907 CB GLU C 59 66.516 6.748 10.346 1.00 0.00 C ATOM 908 CG GLU C 59 66.683 6.613 11.861 1.00 0.00 C ATOM 909 CD GLU C 59 68.087 7.071 12.261 1.00 0.00 C ATOM 910 OE1 GLU C 59 68.321 8.269 12.258 1.00 0.00 O ATOM 911 OE2 GLU C 59 68.903 6.217 12.561 1.00 0.00 O ATOM 0 H GLU C 59 67.808 7.039 8.362 1.00 0.00 H new ATOM 0 HA GLU C 59 67.717 4.927 10.327 1.00 0.00 H new ATOM 0 HB2 GLU C 59 67.031 7.641 9.991 1.00 0.00 H new ATOM 0 HB3 GLU C 59 65.462 6.867 10.095 1.00 0.00 H new ATOM 0 HG2 GLU C 59 65.933 7.213 12.375 1.00 0.00 H new ATOM 0 HG3 GLU C 59 66.526 5.578 12.164 1.00 0.00 H new ATOM 918 N MET C 60 65.484 4.755 7.992 1.00 0.00 N ATOM 919 CA MET C 60 64.393 3.884 7.487 1.00 0.00 C ATOM 920 C MET C 60 64.982 2.541 7.041 1.00 0.00 C ATOM 921 O MET C 60 64.372 1.501 7.195 1.00 0.00 O ATOM 922 CB MET C 60 63.795 4.667 6.308 1.00 0.00 C ATOM 923 CG MET C 60 63.238 3.707 5.258 1.00 0.00 C ATOM 924 SD MET C 60 61.651 4.328 4.647 1.00 0.00 S ATOM 925 CE MET C 60 62.176 6.032 4.336 1.00 0.00 C ATOM 0 H MET C 60 65.811 5.465 7.337 1.00 0.00 H new ATOM 0 HA MET C 60 63.633 3.655 8.234 1.00 0.00 H new ATOM 0 HB2 MET C 60 63.003 5.325 6.665 1.00 0.00 H new ATOM 0 HB3 MET C 60 64.559 5.302 5.860 1.00 0.00 H new ATOM 0 HG2 MET C 60 63.943 3.607 4.432 1.00 0.00 H new ATOM 0 HG3 MET C 60 63.109 2.715 5.690 1.00 0.00 H new ATOM 0 HE1 MET C 60 61.817 6.350 3.357 1.00 0.00 H new ATOM 0 HE2 MET C 60 61.763 6.686 5.104 1.00 0.00 H new ATOM 0 HE3 MET C 60 63.264 6.087 4.359 1.00 0.00 H new ATOM 935 N ILE C 61 66.169 2.557 6.499 1.00 0.00 N ATOM 936 CA ILE C 61 66.803 1.283 6.053 1.00 0.00 C ATOM 937 C ILE C 61 67.332 0.516 7.269 1.00 0.00 C ATOM 938 O ILE C 61 67.347 -0.698 7.292 1.00 0.00 O ATOM 939 CB ILE C 61 67.951 1.711 5.139 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.391 2.113 3.772 1.00 0.00 C ATOM 941 CG2 ILE C 61 68.930 0.549 4.965 1.00 0.00 C ATOM 942 CD1 ILE C 61 66.943 3.575 3.815 1.00 0.00 C ATOM 0 H ILE C 61 66.727 3.397 6.346 1.00 0.00 H new ATOM 0 HA ILE C 61 66.104 0.624 5.538 1.00 0.00 H new ATOM 0 HB ILE C 61 68.471 2.559 5.585 1.00 0.00 H new ATOM 0 HG12 ILE C 61 68.150 1.976 3.002 1.00 0.00 H new ATOM 0 HG13 ILE C 61 66.550 1.471 3.508 1.00 0.00 H new ATOM 0 HG21 ILE C 61 69.748 0.857 4.313 1.00 0.00 H new ATOM 0 HG22 ILE C 61 69.330 0.261 5.937 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.411 -0.300 4.520 1.00 0.00 H new ATOM 0 HD11 ILE C 61 66.544 3.862 2.842 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.170 3.697 4.574 1.00 0.00 H new ATOM 0 HD13 ILE C 61 67.795 4.210 4.059 1.00 0.00 H new ATOM 954 N ASP C 62 67.764 1.220 8.280 1.00 0.00 N ATOM 955 CA ASP C 62 68.288 0.537 9.498 1.00 0.00 C ATOM 956 C ASP C 62 67.142 -0.143 10.251 1.00 0.00 C ATOM 957 O ASP C 62 67.344 -1.082 10.995 1.00 0.00 O ATOM 958 CB ASP C 62 68.902 1.651 10.346 1.00 0.00 C ATOM 959 CG ASP C 62 69.676 1.038 11.513 1.00 0.00 C ATOM 960 OD1 ASP C 62 69.380 -0.092 11.867 1.00 0.00 O ATOM 961 OD2 ASP C 62 70.552 1.708 12.036 1.00 0.00 O ATOM 0 H ASP C 62 67.777 2.239 8.315 1.00 0.00 H new ATOM 0 HA ASP C 62 69.017 -0.237 9.258 1.00 0.00 H new ATOM 0 HB2 ASP C 62 69.567 2.262 9.736 1.00 0.00 H new ATOM 0 HB3 ASP C 62 68.119 2.310 10.722 1.00 0.00 H new ATOM 966 N GLU C 63 65.939 0.328 10.063 1.00 0.00 N ATOM 967 CA GLU C 63 64.777 -0.288 10.766 1.00 0.00 C ATOM 968 C GLU C 63 64.434 -1.638 10.130 1.00 0.00 C ATOM 969 O GLU C 63 63.873 -2.509 10.764 1.00 0.00 O ATOM 970 CB GLU C 63 63.630 0.705 10.576 1.00 0.00 C ATOM 971 CG GLU C 63 62.956 0.974 11.923 1.00 0.00 C ATOM 972 CD GLU C 63 63.166 2.438 12.317 1.00 0.00 C ATOM 973 OE1 GLU C 63 64.276 2.777 12.693 1.00 0.00 O ATOM 974 OE2 GLU C 63 62.212 3.195 12.235 1.00 0.00 O ATOM 0 H GLU C 63 65.710 1.113 9.453 1.00 0.00 H new ATOM 0 HA GLU C 63 64.980 -0.477 11.820 1.00 0.00 H new ATOM 0 HB2 GLU C 63 64.008 1.636 10.155 1.00 0.00 H new ATOM 0 HB3 GLU C 63 62.904 0.306 9.868 1.00 0.00 H new ATOM 0 HG2 GLU C 63 61.891 0.753 11.859 1.00 0.00 H new ATOM 0 HG3 GLU C 63 63.372 0.318 12.687 1.00 0.00 H new ATOM 981 N VAL C 64 64.769 -1.818 8.881 1.00 0.00 N ATOM 982 CA VAL C 64 64.464 -3.113 8.207 1.00 0.00 C ATOM 983 C VAL C 64 65.691 -3.608 7.438 1.00 0.00 C ATOM 984 O VAL C 64 65.621 -3.900 6.261 1.00 0.00 O ATOM 985 CB VAL C 64 63.320 -2.800 7.244 1.00 0.00 C ATOM 986 CG1 VAL C 64 62.074 -2.409 8.040 1.00 0.00 C ATOM 987 CG2 VAL C 64 63.726 -1.639 6.331 1.00 0.00 C ATOM 0 H VAL C 64 65.240 -1.126 8.299 1.00 0.00 H new ATOM 0 HA VAL C 64 64.195 -3.895 8.917 1.00 0.00 H new ATOM 0 HB VAL C 64 63.103 -3.681 6.640 1.00 0.00 H new ATOM 0 HG11 VAL C 64 61.258 -2.186 7.352 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.784 -3.234 8.691 1.00 0.00 H new ATOM 0 HG13 VAL C 64 62.290 -1.528 8.645 1.00 0.00 H new ATOM 0 HG21 VAL C 64 62.911 -1.415 5.643 1.00 0.00 H new ATOM 0 HG22 VAL C 64 63.943 -0.759 6.936 1.00 0.00 H new ATOM 0 HG23 VAL C 64 64.614 -1.916 5.763 1.00 0.00 H new ATOM 997 N ASP C 65 66.814 -3.704 8.093 1.00 0.00 N ATOM 998 CA ASP C 65 68.044 -4.180 7.399 1.00 0.00 C ATOM 999 C ASP C 65 68.888 -5.036 8.348 1.00 0.00 C ATOM 1000 O ASP C 65 69.731 -4.536 9.064 1.00 0.00 O ATOM 1001 CB ASP C 65 68.797 -2.907 7.010 1.00 0.00 C ATOM 1002 CG ASP C 65 70.214 -3.269 6.562 1.00 0.00 C ATOM 1003 OD1 ASP C 65 70.390 -4.363 6.050 1.00 0.00 O ATOM 1004 OD2 ASP C 65 71.098 -2.447 6.740 1.00 0.00 O ATOM 0 H ASP C 65 66.934 -3.473 9.079 1.00 0.00 H new ATOM 0 HA ASP C 65 67.816 -4.799 6.531 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.271 -2.392 6.207 1.00 0.00 H new ATOM 0 HB3 ASP C 65 68.836 -2.222 7.857 1.00 0.00 H new ATOM 1009 N GLU C 66 68.666 -6.322 8.358 1.00 0.00 N ATOM 1010 CA GLU C 66 69.456 -7.207 9.261 1.00 0.00 C ATOM 1011 C GLU C 66 70.742 -7.657 8.564 1.00 0.00 C ATOM 1012 O GLU C 66 71.195 -8.771 8.735 1.00 0.00 O ATOM 1013 CB GLU C 66 68.547 -8.404 9.535 1.00 0.00 C ATOM 1014 CG GLU C 66 68.402 -8.598 11.046 1.00 0.00 C ATOM 1015 CD GLU C 66 67.659 -9.904 11.327 1.00 0.00 C ATOM 1016 OE1 GLU C 66 68.196 -10.951 11.001 1.00 0.00 O ATOM 1017 OE2 GLU C 66 66.565 -9.836 11.862 1.00 0.00 O ATOM 0 H GLU C 66 67.973 -6.798 7.781 1.00 0.00 H new ATOM 0 HA GLU C 66 69.753 -6.702 10.180 1.00 0.00 H new ATOM 0 HB2 GLU C 66 67.569 -8.242 9.083 1.00 0.00 H new ATOM 0 HB3 GLU C 66 68.964 -9.303 9.080 1.00 0.00 H new ATOM 0 HG2 GLU C 66 69.385 -8.619 11.516 1.00 0.00 H new ATOM 0 HG3 GLU C 66 67.859 -7.758 11.480 1.00 0.00 H new ATOM 1024 N ASP C 67 71.334 -6.798 7.779 1.00 0.00 N ATOM 1025 CA ASP C 67 72.590 -7.178 7.071 1.00 0.00 C ATOM 1026 C ASP C 67 73.705 -6.184 7.406 1.00 0.00 C ATOM 1027 O ASP C 67 74.870 -6.524 7.421 1.00 0.00 O ATOM 1028 CB ASP C 67 72.243 -7.110 5.584 1.00 0.00 C ATOM 1029 CG ASP C 67 71.000 -7.960 5.309 1.00 0.00 C ATOM 1030 OD1 ASP C 67 70.856 -8.987 5.952 1.00 0.00 O ATOM 1031 OD2 ASP C 67 70.216 -7.568 4.461 1.00 0.00 O ATOM 0 H ASP C 67 71.003 -5.851 7.597 1.00 0.00 H new ATOM 0 HA ASP C 67 72.945 -8.167 7.362 1.00 0.00 H new ATOM 0 HB2 ASP C 67 72.062 -6.076 5.289 1.00 0.00 H new ATOM 0 HB3 ASP C 67 73.081 -7.470 4.987 1.00 0.00 H new ATOM 1036 N GLY C 68 73.354 -4.956 7.673 1.00 0.00 N ATOM 1037 CA GLY C 68 74.391 -3.940 8.005 1.00 0.00 C ATOM 1038 C GLY C 68 74.867 -3.254 6.722 1.00 0.00 C ATOM 1039 O GLY C 68 75.784 -2.458 6.737 1.00 0.00 O ATOM 0 H GLY C 68 72.394 -4.613 7.675 1.00 0.00 H new ATOM 0 HA2 GLY C 68 73.983 -3.201 8.695 1.00 0.00 H new ATOM 0 HA3 GLY C 68 75.232 -4.416 8.509 1.00 0.00 H new ATOM 1043 N SER C 69 74.250 -3.554 5.611 1.00 0.00 N ATOM 1044 CA SER C 69 74.671 -2.916 4.330 1.00 0.00 C ATOM 1045 C SER C 69 74.017 -1.539 4.188 1.00 0.00 C ATOM 1046 O SER C 69 74.292 -0.805 3.259 1.00 0.00 O ATOM 1047 CB SER C 69 74.178 -3.861 3.235 1.00 0.00 C ATOM 1048 OG SER C 69 72.769 -4.018 3.349 1.00 0.00 O ATOM 0 H SER C 69 73.474 -4.212 5.535 1.00 0.00 H new ATOM 0 HA SER C 69 75.749 -2.763 4.278 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.433 -3.463 2.253 1.00 0.00 H new ATOM 0 HB3 SER C 69 74.672 -4.829 3.324 1.00 0.00 H new ATOM 0 HG SER C 69 72.319 -3.316 2.834 1.00 0.00 H new ATOM 1054 N GLY C 70 73.154 -1.183 5.101 1.00 0.00 N ATOM 1055 CA GLY C 70 72.486 0.147 5.018 1.00 0.00 C ATOM 1056 C GLY C 70 71.687 0.241 3.716 1.00 0.00 C ATOM 1057 O GLY C 70 71.596 1.289 3.110 1.00 0.00 O ATOM 0 H GLY C 70 72.883 -1.756 5.900 1.00 0.00 H new ATOM 0 HA2 GLY C 70 71.825 0.287 5.873 1.00 0.00 H new ATOM 0 HA3 GLY C 70 73.231 0.942 5.058 1.00 0.00 H new ATOM 1061 N THR C 71 71.106 -0.845 3.283 1.00 0.00 N ATOM 1062 CA THR C 71 70.314 -0.809 2.021 1.00 0.00 C ATOM 1063 C THR C 71 69.141 -1.788 2.102 1.00 0.00 C ATOM 1064 O THR C 71 69.133 -2.696 2.909 1.00 0.00 O ATOM 1065 CB THR C 71 71.294 -1.232 0.926 1.00 0.00 C ATOM 1066 OG1 THR C 71 72.007 -2.386 1.349 1.00 0.00 O ATOM 1067 CG2 THR C 71 72.277 -0.093 0.652 1.00 0.00 C ATOM 0 H THR C 71 71.145 -1.753 3.747 1.00 0.00 H new ATOM 0 HA THR C 71 69.889 0.176 1.829 1.00 0.00 H new ATOM 0 HB THR C 71 70.743 -1.461 0.014 1.00 0.00 H new ATOM 0 HG1 THR C 71 72.635 -2.658 0.647 1.00 0.00 H new ATOM 0 HG21 THR C 71 72.975 -0.395 -0.129 1.00 0.00 H new ATOM 0 HG22 THR C 71 71.728 0.791 0.326 1.00 0.00 H new ATOM 0 HG23 THR C 71 72.829 0.138 1.563 1.00 0.00 H new ATOM 1075 N VAL C 72 68.153 -1.612 1.270 1.00 0.00 N ATOM 1076 CA VAL C 72 66.980 -2.532 1.298 1.00 0.00 C ATOM 1077 C VAL C 72 66.821 -3.227 -0.057 1.00 0.00 C ATOM 1078 O VAL C 72 67.073 -2.648 -1.094 1.00 0.00 O ATOM 1079 CB VAL C 72 65.777 -1.635 1.584 1.00 0.00 C ATOM 1080 CG1 VAL C 72 64.487 -2.409 1.304 1.00 0.00 C ATOM 1081 CG2 VAL C 72 65.801 -1.202 3.051 1.00 0.00 C ATOM 0 H VAL C 72 68.106 -0.871 0.571 1.00 0.00 H new ATOM 0 HA VAL C 72 67.089 -3.316 2.047 1.00 0.00 H new ATOM 0 HB VAL C 72 65.820 -0.754 0.944 1.00 0.00 H new ATOM 0 HG11 VAL C 72 63.628 -1.770 1.508 1.00 0.00 H new ATOM 0 HG12 VAL C 72 64.469 -2.720 0.259 1.00 0.00 H new ATOM 0 HG13 VAL C 72 64.444 -3.289 1.945 1.00 0.00 H new ATOM 0 HG21 VAL C 72 64.943 -0.562 3.256 1.00 0.00 H new ATOM 0 HG22 VAL C 72 65.757 -2.083 3.691 1.00 0.00 H new ATOM 0 HG23 VAL C 72 66.720 -0.652 3.253 1.00 0.00 H new ATOM 1091 N ASP C 73 66.404 -4.463 -0.053 1.00 0.00 N ATOM 1092 CA ASP C 73 66.227 -5.193 -1.340 1.00 0.00 C ATOM 1093 C ASP C 73 64.756 -5.563 -1.543 1.00 0.00 C ATOM 1094 O ASP C 73 63.913 -5.270 -0.719 1.00 0.00 O ATOM 1095 CB ASP C 73 67.086 -6.452 -1.203 1.00 0.00 C ATOM 1096 CG ASP C 73 66.859 -7.081 0.173 1.00 0.00 C ATOM 1097 OD1 ASP C 73 65.859 -6.756 0.794 1.00 0.00 O ATOM 1098 OD2 ASP C 73 67.687 -7.877 0.583 1.00 0.00 O ATOM 0 H ASP C 73 66.178 -4.999 0.785 1.00 0.00 H new ATOM 0 HA ASP C 73 66.521 -4.591 -2.200 1.00 0.00 H new ATOM 0 HB2 ASP C 73 66.831 -7.165 -1.987 1.00 0.00 H new ATOM 0 HB3 ASP C 73 68.139 -6.202 -1.330 1.00 0.00 H new ATOM 1103 N PHE C 74 64.444 -6.205 -2.636 1.00 0.00 N ATOM 1104 CA PHE C 74 63.029 -6.596 -2.893 1.00 0.00 C ATOM 1105 C PHE C 74 62.476 -7.395 -1.710 1.00 0.00 C ATOM 1106 O PHE C 74 61.280 -7.547 -1.557 1.00 0.00 O ATOM 1107 CB PHE C 74 63.083 -7.468 -4.149 1.00 0.00 C ATOM 1108 CG PHE C 74 61.770 -8.197 -4.312 1.00 0.00 C ATOM 1109 CD1 PHE C 74 60.622 -7.494 -4.693 1.00 0.00 C ATOM 1110 CD2 PHE C 74 61.702 -9.576 -4.080 1.00 0.00 C ATOM 1111 CE1 PHE C 74 59.404 -8.169 -4.843 1.00 0.00 C ATOM 1112 CE2 PHE C 74 60.484 -10.251 -4.230 1.00 0.00 C ATOM 1113 CZ PHE C 74 59.336 -9.547 -4.611 1.00 0.00 C ATOM 0 H PHE C 74 65.108 -6.475 -3.362 1.00 0.00 H new ATOM 0 HA PHE C 74 62.379 -5.731 -3.023 1.00 0.00 H new ATOM 0 HB2 PHE C 74 63.280 -6.850 -5.025 1.00 0.00 H new ATOM 0 HB3 PHE C 74 63.902 -8.184 -4.073 1.00 0.00 H new ATOM 0 HD1 PHE C 74 60.675 -6.430 -4.872 1.00 0.00 H new ATOM 0 HD2 PHE C 74 62.588 -10.119 -3.786 1.00 0.00 H new ATOM 0 HE1 PHE C 74 58.518 -7.626 -5.138 1.00 0.00 H new ATOM 0 HE2 PHE C 74 60.431 -11.315 -4.052 1.00 0.00 H new ATOM 0 HZ PHE C 74 58.397 -10.068 -4.726 1.00 0.00 H new ATOM 1123 N ASP C 75 63.335 -7.910 -0.873 1.00 0.00 N ATOM 1124 CA ASP C 75 62.855 -8.702 0.295 1.00 0.00 C ATOM 1125 C ASP C 75 62.645 -7.791 1.509 1.00 0.00 C ATOM 1126 O ASP C 75 61.555 -7.685 2.036 1.00 0.00 O ATOM 1127 CB ASP C 75 63.968 -9.713 0.572 1.00 0.00 C ATOM 1128 CG ASP C 75 63.386 -10.929 1.294 1.00 0.00 C ATOM 1129 OD1 ASP C 75 62.586 -10.733 2.195 1.00 0.00 O ATOM 1130 OD2 ASP C 75 63.750 -12.037 0.935 1.00 0.00 O ATOM 0 H ASP C 75 64.348 -7.817 -0.947 1.00 0.00 H new ATOM 0 HA ASP C 75 61.900 -9.188 0.096 1.00 0.00 H new ATOM 0 HB2 ASP C 75 64.435 -10.021 -0.364 1.00 0.00 H new ATOM 0 HB3 ASP C 75 64.747 -9.254 1.181 1.00 0.00 H new ATOM 1135 N GLU C 76 63.681 -7.137 1.960 1.00 0.00 N ATOM 1136 CA GLU C 76 63.541 -6.238 3.142 1.00 0.00 C ATOM 1137 C GLU C 76 62.484 -5.161 2.876 1.00 0.00 C ATOM 1138 O GLU C 76 61.971 -4.545 3.789 1.00 0.00 O ATOM 1139 CB GLU C 76 64.919 -5.599 3.319 1.00 0.00 C ATOM 1140 CG GLU C 76 65.915 -6.657 3.797 1.00 0.00 C ATOM 1141 CD GLU C 76 67.298 -6.021 3.957 1.00 0.00 C ATOM 1142 OE1 GLU C 76 67.551 -5.027 3.297 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.080 -6.539 4.738 1.00 0.00 O ATOM 0 H GLU C 76 64.619 -7.186 1.561 1.00 0.00 H new ATOM 0 HA GLU C 76 63.222 -6.780 4.032 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.255 -5.168 2.376 1.00 0.00 H new ATOM 0 HB3 GLU C 76 64.864 -4.784 4.041 1.00 0.00 H new ATOM 0 HG2 GLU C 76 65.585 -7.080 4.746 1.00 0.00 H new ATOM 0 HG3 GLU C 76 65.961 -7.478 3.081 1.00 0.00 H new ATOM 1150 N PHE C 77 62.156 -4.928 1.635 1.00 0.00 N ATOM 1151 CA PHE C 77 61.134 -3.886 1.317 1.00 0.00 C ATOM 1152 C PHE C 77 59.761 -4.301 1.855 1.00 0.00 C ATOM 1153 O PHE C 77 59.022 -3.495 2.385 1.00 0.00 O ATOM 1154 CB PHE C 77 61.111 -3.809 -0.209 1.00 0.00 C ATOM 1155 CG PHE C 77 60.605 -2.452 -0.637 1.00 0.00 C ATOM 1156 CD1 PHE C 77 59.238 -2.157 -0.555 1.00 0.00 C ATOM 1157 CD2 PHE C 77 61.501 -1.489 -1.114 1.00 0.00 C ATOM 1158 CE1 PHE C 77 58.769 -0.898 -0.949 1.00 0.00 C ATOM 1159 CE2 PHE C 77 61.031 -0.230 -1.510 1.00 0.00 C ATOM 1160 CZ PHE C 77 59.666 0.065 -1.427 1.00 0.00 C ATOM 0 H PHE C 77 62.549 -5.412 0.828 1.00 0.00 H new ATOM 0 HA PHE C 77 61.372 -2.925 1.772 1.00 0.00 H new ATOM 0 HB2 PHE C 77 62.111 -3.978 -0.607 1.00 0.00 H new ATOM 0 HB3 PHE C 77 60.470 -4.592 -0.614 1.00 0.00 H new ATOM 0 HD1 PHE C 77 58.546 -2.901 -0.188 1.00 0.00 H new ATOM 0 HD2 PHE C 77 62.555 -1.716 -1.177 1.00 0.00 H new ATOM 0 HE1 PHE C 77 57.715 -0.670 -0.884 1.00 0.00 H new ATOM 0 HE2 PHE C 77 61.722 0.513 -1.879 1.00 0.00 H new ATOM 0 HZ PHE C 77 59.304 1.036 -1.732 1.00 0.00 H new ATOM 1170 N LEU C 78 59.412 -5.551 1.722 1.00 0.00 N ATOM 1171 CA LEU C 78 58.086 -6.014 2.224 1.00 0.00 C ATOM 1172 C LEU C 78 57.948 -5.714 3.720 1.00 0.00 C ATOM 1173 O LEU C 78 56.901 -5.316 4.188 1.00 0.00 O ATOM 1174 CB LEU C 78 58.074 -7.524 1.980 1.00 0.00 C ATOM 1175 CG LEU C 78 57.897 -7.800 0.487 1.00 0.00 C ATOM 1176 CD1 LEU C 78 57.802 -9.308 0.254 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.613 -7.127 -0.006 1.00 0.00 C ATOM 0 H LEU C 78 59.987 -6.272 1.287 1.00 0.00 H new ATOM 0 HA LEU C 78 57.259 -5.511 1.722 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.005 -7.967 2.334 1.00 0.00 H new ATOM 0 HB3 LEU C 78 57.265 -7.987 2.544 1.00 0.00 H new ATOM 0 HG LEU C 78 58.751 -7.401 -0.060 1.00 0.00 H new ATOM 0 HD11 LEU C 78 57.676 -9.504 -0.811 1.00 0.00 H new ATOM 0 HD12 LEU C 78 58.715 -9.789 0.606 1.00 0.00 H new ATOM 0 HD13 LEU C 78 56.948 -9.707 0.800 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.485 -7.323 -1.071 1.00 0.00 H new ATOM 0 HD22 LEU C 78 55.759 -7.527 0.541 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.679 -6.052 0.160 1.00 0.00 H new ATOM 1189 N VAL C 79 58.997 -5.907 4.472 1.00 0.00 N ATOM 1190 CA VAL C 79 58.927 -5.642 5.939 1.00 0.00 C ATOM 1191 C VAL C 79 58.654 -4.158 6.209 1.00 0.00 C ATOM 1192 O VAL C 79 57.729 -3.805 6.913 1.00 0.00 O ATOM 1193 CB VAL C 79 60.302 -6.035 6.475 1.00 0.00 C ATOM 1194 CG1 VAL C 79 60.376 -5.721 7.971 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.522 -7.534 6.258 1.00 0.00 C ATOM 0 H VAL C 79 59.901 -6.237 4.134 1.00 0.00 H new ATOM 0 HA VAL C 79 58.122 -6.200 6.416 1.00 0.00 H new ATOM 0 HB VAL C 79 61.073 -5.473 5.948 1.00 0.00 H new ATOM 0 HG11 VAL C 79 61.357 -6.002 8.354 1.00 0.00 H new ATOM 0 HG12 VAL C 79 60.217 -4.654 8.127 1.00 0.00 H new ATOM 0 HG13 VAL C 79 59.606 -6.284 8.499 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.503 -7.817 6.640 1.00 0.00 H new ATOM 0 HG22 VAL C 79 59.751 -8.095 6.786 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.469 -7.759 5.193 1.00 0.00 H new ATOM 1205 N MET C 80 59.460 -3.291 5.663 1.00 0.00 N ATOM 1206 CA MET C 80 59.259 -1.831 5.895 1.00 0.00 C ATOM 1207 C MET C 80 57.783 -1.448 5.737 1.00 0.00 C ATOM 1208 O MET C 80 57.243 -0.696 6.523 1.00 0.00 O ATOM 1209 CB MET C 80 60.107 -1.141 4.826 1.00 0.00 C ATOM 1210 CG MET C 80 60.811 0.072 5.436 1.00 0.00 C ATOM 1211 SD MET C 80 59.915 1.578 4.987 1.00 0.00 S ATOM 1212 CE MET C 80 60.292 1.548 3.218 1.00 0.00 C ATOM 0 H MET C 80 60.251 -3.530 5.065 1.00 0.00 H new ATOM 0 HA MET C 80 59.547 -1.538 6.905 1.00 0.00 H new ATOM 0 HB2 MET C 80 60.843 -1.838 4.425 1.00 0.00 H new ATOM 0 HB3 MET C 80 59.477 -0.828 3.993 1.00 0.00 H new ATOM 0 HG2 MET C 80 60.856 -0.028 6.521 1.00 0.00 H new ATOM 0 HG3 MET C 80 61.839 0.127 5.078 1.00 0.00 H new ATOM 0 HE1 MET C 80 60.271 2.564 2.824 1.00 0.00 H new ATOM 0 HE2 MET C 80 61.282 1.119 3.064 1.00 0.00 H new ATOM 0 HE3 MET C 80 59.550 0.942 2.698 1.00 0.00 H new ATOM 1222 N MET C 81 57.128 -1.949 4.725 1.00 0.00 N ATOM 1223 CA MET C 81 55.691 -1.598 4.520 1.00 0.00 C ATOM 1224 C MET C 81 54.816 -2.213 5.618 1.00 0.00 C ATOM 1225 O MET C 81 53.842 -1.627 6.046 1.00 0.00 O ATOM 1226 CB MET C 81 55.329 -2.185 3.155 1.00 0.00 C ATOM 1227 CG MET C 81 55.224 -1.056 2.128 1.00 0.00 C ATOM 1228 SD MET C 81 56.886 -0.554 1.614 1.00 0.00 S ATOM 1229 CE MET C 81 56.430 1.041 0.891 1.00 0.00 C ATOM 0 H MET C 81 57.523 -2.585 4.032 1.00 0.00 H new ATOM 0 HA MET C 81 55.528 -0.521 4.561 1.00 0.00 H new ATOM 0 HB2 MET C 81 56.086 -2.905 2.844 1.00 0.00 H new ATOM 0 HB3 MET C 81 54.383 -2.724 3.218 1.00 0.00 H new ATOM 0 HG2 MET C 81 54.649 -1.388 1.264 1.00 0.00 H new ATOM 0 HG3 MET C 81 54.692 -0.207 2.558 1.00 0.00 H new ATOM 0 HE1 MET C 81 57.322 1.533 0.504 1.00 0.00 H new ATOM 0 HE2 MET C 81 55.721 0.883 0.078 1.00 0.00 H new ATOM 0 HE3 MET C 81 55.972 1.669 1.655 1.00 0.00 H new ATOM 1239 N VAL C 82 55.150 -3.388 6.078 1.00 0.00 N ATOM 1240 CA VAL C 82 54.327 -4.029 7.146 1.00 0.00 C ATOM 1241 C VAL C 82 54.288 -3.140 8.393 1.00 0.00 C ATOM 1242 O VAL C 82 53.277 -3.027 9.057 1.00 0.00 O ATOM 1243 CB VAL C 82 55.034 -5.348 7.456 1.00 0.00 C ATOM 1244 CG1 VAL C 82 54.152 -6.203 8.367 1.00 0.00 C ATOM 1245 CG2 VAL C 82 55.299 -6.101 6.152 1.00 0.00 C ATOM 0 H VAL C 82 55.954 -3.931 5.763 1.00 0.00 H new ATOM 0 HA VAL C 82 53.295 -4.182 6.831 1.00 0.00 H new ATOM 0 HB VAL C 82 55.979 -5.142 7.958 1.00 0.00 H new ATOM 0 HG11 VAL C 82 54.659 -7.143 8.586 1.00 0.00 H new ATOM 0 HG12 VAL C 82 53.963 -5.667 9.297 1.00 0.00 H new ATOM 0 HG13 VAL C 82 53.205 -6.409 7.868 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.803 -7.042 6.371 1.00 0.00 H new ATOM 0 HG22 VAL C 82 54.353 -6.305 5.651 1.00 0.00 H new ATOM 0 HG23 VAL C 82 55.930 -5.494 5.503 1.00 0.00 H new ATOM 1255 N ARG C 83 55.385 -2.517 8.717 1.00 0.00 N ATOM 1256 CA ARG C 83 55.424 -1.642 9.925 1.00 0.00 C ATOM 1257 C ARG C 83 54.231 -0.678 9.946 1.00 0.00 C ATOM 1258 O ARG C 83 53.380 -0.752 10.811 1.00 0.00 O ATOM 1259 CB ARG C 83 56.738 -0.870 9.808 1.00 0.00 C ATOM 1260 CG ARG C 83 57.909 -1.854 9.832 1.00 0.00 C ATOM 1261 CD ARG C 83 59.100 -1.218 10.551 1.00 0.00 C ATOM 1262 NE ARG C 83 59.225 0.139 9.954 1.00 0.00 N ATOM 1263 CZ ARG C 83 59.197 1.193 10.721 1.00 0.00 C ATOM 1264 NH1 ARG C 83 58.465 1.195 11.803 1.00 0.00 N ATOM 1265 NH2 ARG C 83 59.898 2.248 10.408 1.00 0.00 N ATOM 0 H ARG C 83 56.260 -2.575 8.197 1.00 0.00 H new ATOM 0 HA ARG C 83 55.365 -2.220 10.847 1.00 0.00 H new ATOM 0 HB2 ARG C 83 56.752 -0.293 8.883 1.00 0.00 H new ATOM 0 HB3 ARG C 83 56.829 -0.159 10.629 1.00 0.00 H new ATOM 0 HG2 ARG C 83 57.614 -2.773 10.338 1.00 0.00 H new ATOM 0 HG3 ARG C 83 58.189 -2.126 8.814 1.00 0.00 H new ATOM 0 HD2 ARG C 83 58.929 -1.163 11.626 1.00 0.00 H new ATOM 0 HD3 ARG C 83 60.009 -1.801 10.402 1.00 0.00 H new ATOM 0 HE ARG C 83 59.333 0.245 8.945 1.00 0.00 H new ATOM 0 HH11 ARG C 83 57.915 0.372 12.048 1.00 0.00 H new ATOM 0 HH12 ARG C 83 58.443 2.020 12.403 1.00 0.00 H new ATOM 0 HH21 ARG C 83 60.469 2.249 9.563 1.00 0.00 H new ATOM 0 HH22 ARG C 83 59.875 3.072 11.009 1.00 0.00 H new ATOM 1279 N CYS C 84 54.163 0.233 9.012 1.00 0.00 N ATOM 1280 CA CYS C 84 53.025 1.203 9.000 1.00 0.00 C ATOM 1281 C CYS C 84 51.683 0.465 9.035 1.00 0.00 C ATOM 1282 O CYS C 84 50.703 0.969 9.544 1.00 0.00 O ATOM 1283 CB CYS C 84 53.175 1.986 7.695 1.00 0.00 C ATOM 1284 SG CYS C 84 52.824 0.902 6.289 1.00 0.00 S ATOM 0 H CYS C 84 54.842 0.349 8.260 1.00 0.00 H new ATOM 0 HA CYS C 84 53.043 1.858 9.871 1.00 0.00 H new ATOM 0 HB2 CYS C 84 52.493 2.837 7.690 1.00 0.00 H new ATOM 0 HB3 CYS C 84 54.185 2.387 7.614 1.00 0.00 H new ATOM 0 HG CYS C 84 53.391 -0.252 6.479 1.00 0.00 H new ATOM 1290 N MET C 85 51.628 -0.723 8.498 1.00 0.00 N ATOM 1291 CA MET C 85 50.343 -1.483 8.506 1.00 0.00 C ATOM 1292 C MET C 85 50.080 -2.061 9.901 1.00 0.00 C ATOM 1293 O MET C 85 50.835 -2.873 10.397 1.00 0.00 O ATOM 1294 CB MET C 85 50.534 -2.608 7.488 1.00 0.00 C ATOM 1295 CG MET C 85 50.760 -2.011 6.099 1.00 0.00 C ATOM 1296 SD MET C 85 51.703 -3.181 5.090 1.00 0.00 S ATOM 1297 CE MET C 85 51.543 -2.306 3.514 1.00 0.00 C ATOM 0 H MET C 85 52.413 -1.200 8.055 1.00 0.00 H new ATOM 0 HA MET C 85 49.491 -0.851 8.256 1.00 0.00 H new ATOM 0 HB2 MET C 85 51.385 -3.228 7.771 1.00 0.00 H new ATOM 0 HB3 MET C 85 49.657 -3.256 7.478 1.00 0.00 H new ATOM 0 HG2 MET C 85 49.803 -1.793 5.624 1.00 0.00 H new ATOM 0 HG3 MET C 85 51.298 -1.067 6.180 1.00 0.00 H new ATOM 0 HE1 MET C 85 52.062 -2.863 2.734 1.00 0.00 H new ATOM 0 HE2 MET C 85 50.488 -2.215 3.254 1.00 0.00 H new ATOM 0 HE3 MET C 85 51.982 -1.312 3.603 1.00 0.00 H new ATOM 1307 N LYS C 86 49.016 -1.649 10.536 1.00 0.00 N ATOM 1308 CA LYS C 86 48.712 -2.176 11.897 1.00 0.00 C ATOM 1309 C LYS C 86 47.241 -2.602 11.987 1.00 0.00 C ATOM 1310 O LYS C 86 46.734 -3.290 11.123 1.00 0.00 O ATOM 1311 CB LYS C 86 49.002 -1.010 12.843 1.00 0.00 C ATOM 1312 CG LYS C 86 49.382 -1.555 14.222 1.00 0.00 C ATOM 1313 CD LYS C 86 49.808 -0.399 15.128 1.00 0.00 C ATOM 1314 CE LYS C 86 48.640 -0.007 16.036 1.00 0.00 C ATOM 1315 NZ LYS C 86 49.048 1.287 16.650 1.00 0.00 N ATOM 0 H LYS C 86 48.346 -0.972 10.172 1.00 0.00 H new ATOM 0 HA LYS C 86 49.306 -3.056 12.144 1.00 0.00 H new ATOM 0 HB2 LYS C 86 49.812 -0.398 12.446 1.00 0.00 H new ATOM 0 HB3 LYS C 86 48.126 -0.366 12.923 1.00 0.00 H new ATOM 0 HG2 LYS C 86 48.536 -2.083 14.662 1.00 0.00 H new ATOM 0 HG3 LYS C 86 50.194 -2.276 14.129 1.00 0.00 H new ATOM 0 HD2 LYS C 86 50.668 -0.692 15.730 1.00 0.00 H new ATOM 0 HD3 LYS C 86 50.117 0.455 14.525 1.00 0.00 H new ATOM 0 HE2 LYS C 86 47.716 0.100 15.467 1.00 0.00 H new ATOM 0 HE3 LYS C 86 48.460 -0.766 16.797 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 48.297 1.621 17.287 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 49.926 1.153 17.190 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 49.206 1.992 15.902 1.00 0.00 H new ATOM 1329 N ASP C 87 46.550 -2.208 13.025 1.00 0.00 N ATOM 1330 CA ASP C 87 45.117 -2.603 13.159 1.00 0.00 C ATOM 1331 C ASP C 87 44.201 -1.439 12.774 1.00 0.00 C ATOM 1332 O ASP C 87 44.287 -0.359 13.324 1.00 0.00 O ATOM 1333 CB ASP C 87 44.941 -2.954 14.637 1.00 0.00 C ATOM 1334 CG ASP C 87 43.579 -3.617 14.844 1.00 0.00 C ATOM 1335 OD1 ASP C 87 43.169 -4.369 13.975 1.00 0.00 O ATOM 1336 OD2 ASP C 87 42.967 -3.362 15.869 1.00 0.00 O ATOM 0 H ASP C 87 46.915 -1.632 13.783 1.00 0.00 H new ATOM 0 HA ASP C 87 44.859 -3.436 12.505 1.00 0.00 H new ATOM 0 HB2 ASP C 87 45.737 -3.625 14.960 1.00 0.00 H new ATOM 0 HB3 ASP C 87 45.016 -2.054 15.247 1.00 0.00 H new ATOM 1341 N ASP C 88 43.321 -1.652 11.834 1.00 0.00 N ATOM 1342 CA ASP C 88 42.394 -0.561 11.418 1.00 0.00 C ATOM 1343 C ASP C 88 40.957 -0.913 11.810 1.00 0.00 C ATOM 1344 O ASP C 88 40.610 -2.067 11.959 1.00 0.00 O ATOM 1345 CB ASP C 88 42.533 -0.481 9.896 1.00 0.00 C ATOM 1346 CG ASP C 88 41.832 -1.679 9.255 1.00 0.00 C ATOM 1347 OD1 ASP C 88 41.869 -2.747 9.842 1.00 0.00 O ATOM 1348 OD2 ASP C 88 41.269 -1.508 8.186 1.00 0.00 O ATOM 0 H ASP C 88 43.204 -2.534 11.336 1.00 0.00 H new ATOM 0 HA ASP C 88 42.630 0.389 11.898 1.00 0.00 H new ATOM 0 HB2 ASP C 88 42.097 0.448 9.529 1.00 0.00 H new ATOM 0 HB3 ASP C 88 43.587 -0.471 9.617 1.00 0.00 H new ATOM 1353 N SER C 89 40.118 0.073 11.982 1.00 0.00 N ATOM 1354 CA SER C 89 38.705 -0.210 12.366 1.00 0.00 C ATOM 1355 C SER C 89 38.037 -1.099 11.315 1.00 0.00 C ATOM 1356 O SER C 89 38.049 -2.306 11.495 1.00 0.00 O ATOM 1357 CB SER C 89 38.028 1.158 12.419 1.00 0.00 C ATOM 1358 OG SER C 89 38.403 1.820 13.620 1.00 0.00 O ATOM 1359 OXT SER C 89 37.524 -0.559 10.350 1.00 0.00 O ATOM 0 H SER C 89 40.349 1.060 11.873 1.00 0.00 H new ATOM 0 HA SER C 89 38.634 -0.738 13.317 1.00 0.00 H new ATOM 0 HB2 SER C 89 38.319 1.755 11.555 1.00 0.00 H new ATOM 0 HB3 SER C 89 36.945 1.043 12.376 1.00 0.00 H new ATOM 0 HG SER C 89 37.972 2.699 13.657 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 56.320 5.173 8.985 1.00 0.00 N ATOM 1367 CA ARG I 1 55.131 6.053 8.800 1.00 0.00 C ATOM 1368 C ARG I 1 55.026 6.498 7.340 1.00 0.00 C ATOM 1369 O ARG I 1 54.870 7.668 7.048 1.00 0.00 O ATOM 1370 CB ARG I 1 55.383 7.257 9.709 1.00 0.00 C ATOM 1371 CG ARG I 1 54.580 7.098 11.001 1.00 0.00 C ATOM 1372 CD ARG I 1 54.858 8.285 11.925 1.00 0.00 C ATOM 1373 NE ARG I 1 54.596 7.773 13.298 1.00 0.00 N ATOM 1374 CZ ARG I 1 53.505 8.116 13.925 1.00 0.00 C ATOM 1375 NH1 ARG I 1 52.365 7.570 13.599 1.00 0.00 N ATOM 1376 NH2 ARG I 1 53.553 9.007 14.877 1.00 0.00 N ATOM 0 H1 ARG I 1 56.381 4.877 9.980 1.00 0.00 H new ATOM 0 H2 ARG I 1 56.228 4.333 8.379 1.00 0.00 H new ATOM 0 H3 ARG I 1 57.182 5.694 8.725 1.00 0.00 H new ATOM 0 HA ARG I 1 54.199 5.544 9.046 1.00 0.00 H new ATOM 0 HB2 ARG I 1 56.446 7.338 9.937 1.00 0.00 H new ATOM 0 HB3 ARG I 1 55.095 8.177 9.200 1.00 0.00 H new ATOM 0 HG2 ARG I 1 53.515 7.041 10.775 1.00 0.00 H new ATOM 0 HG3 ARG I 1 54.851 6.166 11.497 1.00 0.00 H new ATOM 0 HD2 ARG I 1 55.886 8.633 11.823 1.00 0.00 H new ATOM 0 HD3 ARG I 1 54.211 9.130 11.688 1.00 0.00 H new ATOM 0 HE ARG I 1 55.270 7.154 13.749 1.00 0.00 H new ATOM 0 HH11 ARG I 1 52.327 6.875 12.854 1.00 0.00 H new ATOM 0 HH12 ARG I 1 51.512 7.839 14.090 1.00 0.00 H new ATOM 0 HH21 ARG I 1 54.443 9.435 15.131 1.00 0.00 H new ATOM 0 HH22 ARG I 1 52.700 9.276 15.368 1.00 0.00 H new ATOM 1392 N ILE I 2 55.108 5.576 6.422 1.00 0.00 N ATOM 1393 CA ILE I 2 55.011 5.948 4.981 1.00 0.00 C ATOM 1394 C ILE I 2 53.812 5.250 4.335 1.00 0.00 C ATOM 1395 O ILE I 2 53.826 4.058 4.101 1.00 0.00 O ATOM 1396 CB ILE I 2 56.319 5.460 4.358 1.00 0.00 C ATOM 1397 CG1 ILE I 2 57.471 6.350 4.830 1.00 0.00 C ATOM 1398 CG2 ILE I 2 56.214 5.532 2.833 1.00 0.00 C ATOM 1399 CD1 ILE I 2 58.796 5.788 4.314 1.00 0.00 C ATOM 0 H ILE I 2 55.238 4.581 6.606 1.00 0.00 H new ATOM 0 HA ILE I 2 54.868 7.019 4.838 1.00 0.00 H new ATOM 0 HB ILE I 2 56.505 4.430 4.663 1.00 0.00 H new ATOM 0 HG12 ILE I 2 57.330 7.368 4.467 1.00 0.00 H new ATOM 0 HG13 ILE I 2 57.484 6.399 5.919 1.00 0.00 H new ATOM 0 HG21 ILE I 2 57.146 5.184 2.387 1.00 0.00 H new ATOM 0 HG22 ILE I 2 55.392 4.901 2.495 1.00 0.00 H new ATOM 0 HG23 ILE I 2 56.029 6.562 2.529 1.00 0.00 H new ATOM 0 HD11 ILE I 2 59.616 6.422 4.651 1.00 0.00 H new ATOM 0 HD12 ILE I 2 58.937 4.778 4.699 1.00 0.00 H new ATOM 0 HD13 ILE I 2 58.781 5.762 3.224 1.00 0.00 H new ATOM 1411 N SER I 3 52.772 5.984 4.047 1.00 0.00 N ATOM 1412 CA SER I 3 51.573 5.364 3.416 1.00 0.00 C ATOM 1413 C SER I 3 51.941 4.763 2.058 1.00 0.00 C ATOM 1414 O SER I 3 52.910 5.152 1.437 1.00 0.00 O ATOM 1415 CB SER I 3 50.581 6.512 3.242 1.00 0.00 C ATOM 1416 OG SER I 3 50.129 6.940 4.520 1.00 0.00 O ATOM 0 H SER I 3 52.701 6.986 4.222 1.00 0.00 H new ATOM 0 HA SER I 3 51.160 4.555 4.019 1.00 0.00 H new ATOM 0 HB2 SER I 3 51.054 7.340 2.715 1.00 0.00 H new ATOM 0 HB3 SER I 3 49.736 6.189 2.634 1.00 0.00 H new ATOM 0 HG SER I 3 49.493 7.678 4.412 1.00 0.00 H new ATOM 1422 N ALA I 4 51.174 3.816 1.589 1.00 0.00 N ATOM 1423 CA ALA I 4 51.481 3.193 0.270 1.00 0.00 C ATOM 1424 C ALA I 4 50.597 3.804 -0.819 1.00 0.00 C ATOM 1425 O ALA I 4 51.027 4.020 -1.934 1.00 0.00 O ATOM 1426 CB ALA I 4 51.164 1.709 0.448 1.00 0.00 C ATOM 0 H ALA I 4 50.349 3.447 2.062 1.00 0.00 H new ATOM 0 HA ALA I 4 52.516 3.354 -0.032 1.00 0.00 H new ATOM 0 HB1 ALA I 4 51.365 1.180 -0.483 1.00 0.00 H new ATOM 0 HB2 ALA I 4 51.787 1.296 1.242 1.00 0.00 H new ATOM 0 HB3 ALA I 4 50.113 1.591 0.713 1.00 0.00 H new ATOM 1432 N ASP I 5 49.362 4.086 -0.502 1.00 0.00 N ATOM 1433 CA ASP I 5 48.450 4.686 -1.519 1.00 0.00 C ATOM 1434 C ASP I 5 49.067 5.965 -2.091 1.00 0.00 C ATOM 1435 O ASP I 5 48.753 6.381 -3.188 1.00 0.00 O ATOM 1436 CB ASP I 5 47.164 5.004 -0.758 1.00 0.00 C ATOM 1437 CG ASP I 5 46.394 3.710 -0.489 1.00 0.00 C ATOM 1438 OD1 ASP I 5 46.746 3.020 0.453 1.00 0.00 O ATOM 1439 OD2 ASP I 5 45.466 3.431 -1.230 1.00 0.00 O ATOM 0 H ASP I 5 48.945 3.927 0.415 1.00 0.00 H new ATOM 0 HA ASP I 5 48.270 4.017 -2.360 1.00 0.00 H new ATOM 0 HB2 ASP I 5 47.400 5.501 0.183 1.00 0.00 H new ATOM 0 HB3 ASP I 5 46.548 5.692 -1.337 1.00 0.00 H new ATOM 1444 N ALA I 6 49.944 6.592 -1.355 1.00 0.00 N ATOM 1445 CA ALA I 6 50.581 7.843 -1.857 1.00 0.00 C ATOM 1446 C ALA I 6 51.564 7.520 -2.986 1.00 0.00 C ATOM 1447 O ALA I 6 51.485 8.069 -4.067 1.00 0.00 O ATOM 1448 CB ALA I 6 51.320 8.423 -0.652 1.00 0.00 C ATOM 0 H ALA I 6 50.247 6.292 -0.428 1.00 0.00 H new ATOM 0 HA ALA I 6 49.851 8.544 -2.263 1.00 0.00 H new ATOM 0 HB1 ALA I 6 51.817 9.349 -0.941 1.00 0.00 H new ATOM 0 HB2 ALA I 6 50.608 8.628 0.148 1.00 0.00 H new ATOM 0 HB3 ALA I 6 52.063 7.707 -0.302 1.00 0.00 H new ATOM 1454 N MET I 7 52.489 6.633 -2.742 1.00 0.00 N ATOM 1455 CA MET I 7 53.476 6.276 -3.801 1.00 0.00 C ATOM 1456 C MET I 7 52.754 5.964 -5.115 1.00 0.00 C ATOM 1457 O MET I 7 53.320 6.070 -6.185 1.00 0.00 O ATOM 1458 CB MET I 7 54.191 5.031 -3.272 1.00 0.00 C ATOM 1459 CG MET I 7 55.666 5.355 -3.024 1.00 0.00 C ATOM 1460 SD MET I 7 56.598 3.816 -2.832 1.00 0.00 S ATOM 1461 CE MET I 7 57.776 4.092 -4.178 1.00 0.00 C ATOM 0 H MET I 7 52.604 6.140 -1.856 1.00 0.00 H new ATOM 0 HA MET I 7 54.172 7.089 -4.008 1.00 0.00 H new ATOM 0 HB2 MET I 7 53.721 4.694 -2.348 1.00 0.00 H new ATOM 0 HB3 MET I 7 54.103 4.216 -3.990 1.00 0.00 H new ATOM 0 HG2 MET I 7 56.067 5.934 -3.856 1.00 0.00 H new ATOM 0 HG3 MET I 7 55.769 5.969 -2.129 1.00 0.00 H new ATOM 0 HE1 MET I 7 58.628 3.423 -4.059 1.00 0.00 H new ATOM 0 HE2 MET I 7 57.290 3.894 -5.133 1.00 0.00 H new ATOM 0 HE3 MET I 7 58.121 5.126 -4.154 1.00 0.00 H new ATOM 1471 N MET I 8 51.509 5.581 -5.043 1.00 0.00 N ATOM 1472 CA MET I 8 50.752 5.263 -6.288 1.00 0.00 C ATOM 1473 C MET I 8 50.156 6.540 -6.885 1.00 0.00 C ATOM 1474 O MET I 8 50.097 6.708 -8.087 1.00 0.00 O ATOM 1475 CB MET I 8 49.639 4.313 -5.844 1.00 0.00 C ATOM 1476 CG MET I 8 50.159 2.874 -5.851 1.00 0.00 C ATOM 1477 SD MET I 8 50.434 2.325 -4.149 1.00 0.00 S ATOM 1478 CE MET I 8 52.152 2.876 -4.011 1.00 0.00 C ATOM 0 H MET I 8 50.982 5.474 -4.176 1.00 0.00 H new ATOM 0 HA MET I 8 51.387 4.819 -7.054 1.00 0.00 H new ATOM 0 HB2 MET I 8 49.295 4.581 -4.845 1.00 0.00 H new ATOM 0 HB3 MET I 8 48.782 4.404 -6.511 1.00 0.00 H new ATOM 0 HG2 MET I 8 49.441 2.219 -6.344 1.00 0.00 H new ATOM 0 HG3 MET I 8 51.088 2.814 -6.418 1.00 0.00 H new ATOM 0 HE1 MET I 8 52.731 2.130 -3.467 1.00 0.00 H new ATOM 0 HE2 MET I 8 52.573 3.007 -5.008 1.00 0.00 H new ATOM 0 HE3 MET I 8 52.188 3.824 -3.475 1.00 0.00 H new ATOM 1488 N GLN I 9 49.711 7.441 -6.053 1.00 0.00 N ATOM 1489 CA GLN I 9 49.114 8.705 -6.570 1.00 0.00 C ATOM 1490 C GLN I 9 50.215 9.656 -7.048 1.00 0.00 C ATOM 1491 O GLN I 9 50.037 10.399 -7.994 1.00 0.00 O ATOM 1492 CB GLN I 9 48.369 9.306 -5.378 1.00 0.00 C ATOM 1493 CG GLN I 9 46.919 9.590 -5.774 1.00 0.00 C ATOM 1494 CD GLN I 9 45.986 9.134 -4.651 1.00 0.00 C ATOM 1495 OE1 GLN I 9 45.577 9.926 -3.826 1.00 0.00 O ATOM 1496 NE2 GLN I 9 45.630 7.881 -4.586 1.00 0.00 N ATOM 0 H GLN I 9 49.735 7.357 -5.037 1.00 0.00 H new ATOM 0 HA GLN I 9 48.454 8.532 -7.420 1.00 0.00 H new ATOM 0 HB2 GLN I 9 48.398 8.618 -4.533 1.00 0.00 H new ATOM 0 HB3 GLN I 9 48.857 10.227 -5.057 1.00 0.00 H new ATOM 0 HG2 GLN I 9 46.784 10.655 -5.964 1.00 0.00 H new ATOM 0 HG3 GLN I 9 46.674 9.068 -6.699 1.00 0.00 H new ATOM 0 HE21 GLN I 9 45.974 7.216 -5.279 1.00 0.00 H new ATOM 0 HE22 GLN I 9 45.008 7.566 -3.842 1.00 0.00 H new ATOM 1505 N ALA I 10 51.349 9.640 -6.405 1.00 0.00 N ATOM 1506 CA ALA I 10 52.459 10.545 -6.826 1.00 0.00 C ATOM 1507 C ALA I 10 53.230 9.926 -7.995 1.00 0.00 C ATOM 1508 O ALA I 10 53.482 10.567 -8.995 1.00 0.00 O ATOM 1509 CB ALA I 10 53.356 10.670 -5.596 1.00 0.00 C ATOM 0 H ALA I 10 51.557 9.040 -5.606 1.00 0.00 H new ATOM 0 HA ALA I 10 52.096 11.516 -7.164 1.00 0.00 H new ATOM 0 HB1 ALA I 10 54.199 11.322 -5.825 1.00 0.00 H new ATOM 0 HB2 ALA I 10 52.784 11.093 -4.770 1.00 0.00 H new ATOM 0 HB3 ALA I 10 53.726 9.684 -5.314 1.00 0.00 H new ATOM 1515 N LEU I 11 53.607 8.683 -7.875 1.00 0.00 N ATOM 1516 CA LEU I 11 54.363 8.024 -8.979 1.00 0.00 C ATOM 1517 C LEU I 11 53.943 6.558 -9.101 1.00 0.00 C ATOM 1518 O LEU I 11 52.922 6.148 -8.586 1.00 0.00 O ATOM 1519 CB LEU I 11 55.833 8.128 -8.570 1.00 0.00 C ATOM 1520 CG LEU I 11 56.009 7.592 -7.146 1.00 0.00 C ATOM 1521 CD1 LEU I 11 57.261 6.714 -7.078 1.00 0.00 C ATOM 1522 CD2 LEU I 11 56.158 8.766 -6.176 1.00 0.00 C ATOM 0 H LEU I 11 53.425 8.095 -7.062 1.00 0.00 H new ATOM 0 HA LEU I 11 54.176 8.491 -9.946 1.00 0.00 H new ATOM 0 HB2 LEU I 11 56.455 7.560 -9.262 1.00 0.00 H new ATOM 0 HB3 LEU I 11 56.163 9.166 -8.622 1.00 0.00 H new ATOM 0 HG LEU I 11 55.136 6.999 -6.872 1.00 0.00 H new ATOM 0 HD11 LEU I 11 57.384 6.334 -6.064 1.00 0.00 H new ATOM 0 HD12 LEU I 11 57.157 5.877 -7.769 1.00 0.00 H new ATOM 0 HD13 LEU I 11 58.135 7.305 -7.353 1.00 0.00 H new ATOM 0 HD21 LEU I 11 56.283 8.386 -5.162 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.031 9.358 -6.452 1.00 0.00 H new ATOM 0 HD23 LEU I 11 55.266 9.391 -6.222 1.00 0.00 H new ATOM 1534 N LEU I 12 54.729 5.764 -9.775 1.00 0.00 N ATOM 1535 CA LEU I 12 54.384 4.321 -9.927 1.00 0.00 C ATOM 1536 C LEU I 12 53.083 4.158 -10.720 1.00 0.00 C ATOM 1537 O LEU I 12 52.067 3.755 -10.189 1.00 0.00 O ATOM 1538 CB LEU I 12 54.212 3.800 -8.497 1.00 0.00 C ATOM 1539 CG LEU I 12 55.358 4.316 -7.622 1.00 0.00 C ATOM 1540 CD1 LEU I 12 55.056 4.016 -6.153 1.00 0.00 C ATOM 1541 CD2 LEU I 12 56.659 3.621 -8.028 1.00 0.00 C ATOM 0 H LEU I 12 55.596 6.052 -10.228 1.00 0.00 H new ATOM 0 HA LEU I 12 55.152 3.773 -10.472 1.00 0.00 H new ATOM 0 HB2 LEU I 12 53.255 4.129 -8.092 1.00 0.00 H new ATOM 0 HB3 LEU I 12 54.201 2.710 -8.495 1.00 0.00 H new ATOM 0 HG LEU I 12 55.462 5.393 -7.757 1.00 0.00 H new ATOM 0 HD11 LEU I 12 55.872 4.384 -5.531 1.00 0.00 H new ATOM 0 HD12 LEU I 12 54.129 4.510 -5.864 1.00 0.00 H new ATOM 0 HD13 LEU I 12 54.952 2.940 -6.015 1.00 0.00 H new ATOM 0 HD21 LEU I 12 57.476 3.987 -7.406 1.00 0.00 H new ATOM 0 HD22 LEU I 12 56.554 2.545 -7.893 1.00 0.00 H new ATOM 0 HD23 LEU I 12 56.875 3.836 -9.075 1.00 0.00 H new ATOM 1553 N GLY I 13 53.108 4.464 -11.989 1.00 0.00 N ATOM 1554 CA GLY I 13 51.877 4.320 -12.818 1.00 0.00 C ATOM 1555 C GLY I 13 50.819 5.327 -12.362 1.00 0.00 C ATOM 1556 O GLY I 13 50.550 5.471 -11.186 1.00 0.00 O ATOM 0 H GLY I 13 53.929 4.808 -12.488 1.00 0.00 H new ATOM 0 HA2 GLY I 13 52.116 4.481 -13.869 1.00 0.00 H new ATOM 0 HA3 GLY I 13 51.487 3.306 -12.732 1.00 0.00 H new ATOM 1560 N ALA I 14 50.216 6.023 -13.287 1.00 0.00 N ATOM 1561 CA ALA I 14 49.171 7.020 -12.912 1.00 0.00 C ATOM 1562 C ALA I 14 48.087 7.076 -13.991 1.00 0.00 C ATOM 1563 O ALA I 14 47.264 7.971 -14.015 1.00 0.00 O ATOM 1564 CB ALA I 14 49.909 8.356 -12.824 1.00 0.00 C ATOM 0 H ALA I 14 50.401 5.945 -14.287 1.00 0.00 H new ATOM 0 HA ALA I 14 48.676 6.767 -11.974 1.00 0.00 H new ATOM 0 HB1 ALA I 14 49.206 9.143 -12.552 1.00 0.00 H new ATOM 0 HB2 ALA I 14 50.691 8.291 -12.068 1.00 0.00 H new ATOM 0 HB3 ALA I 14 50.357 8.588 -13.790 1.00 0.00 H new ATOM 1570 N ARG I 15 48.078 6.126 -14.886 1.00 0.00 N ATOM 1571 CA ARG I 15 47.048 6.121 -15.965 1.00 0.00 C ATOM 1572 C ARG I 15 46.972 4.735 -16.613 1.00 0.00 C ATOM 1573 O ARG I 15 47.475 3.764 -16.084 1.00 0.00 O ATOM 1574 CB ARG I 15 47.530 7.160 -16.978 1.00 0.00 C ATOM 1575 CG ARG I 15 49.012 6.929 -17.281 1.00 0.00 C ATOM 1576 CD ARG I 15 49.851 7.993 -16.570 1.00 0.00 C ATOM 1577 NE ARG I 15 49.588 9.255 -17.317 1.00 0.00 N ATOM 1578 CZ ARG I 15 50.574 9.893 -17.888 1.00 0.00 C ATOM 1579 NH1 ARG I 15 50.970 9.547 -19.082 1.00 0.00 N ATOM 1580 NH2 ARG I 15 51.162 10.879 -17.266 1.00 0.00 N ATOM 0 H ARG I 15 48.741 5.351 -14.917 1.00 0.00 H new ATOM 0 HA ARG I 15 46.052 6.352 -15.588 1.00 0.00 H new ATOM 0 HB2 ARG I 15 46.945 7.088 -17.895 1.00 0.00 H new ATOM 0 HB3 ARG I 15 47.381 8.165 -16.583 1.00 0.00 H new ATOM 0 HG2 ARG I 15 49.311 5.934 -16.950 1.00 0.00 H new ATOM 0 HG3 ARG I 15 49.185 6.973 -18.356 1.00 0.00 H new ATOM 0 HD2 ARG I 15 49.564 8.087 -15.523 1.00 0.00 H new ATOM 0 HD3 ARG I 15 50.910 7.737 -16.588 1.00 0.00 H new ATOM 0 HE ARG I 15 48.638 9.621 -17.382 1.00 0.00 H new ATOM 0 HH11 ARG I 15 50.509 8.778 -19.569 1.00 0.00 H new ATOM 0 HH12 ARG I 15 51.740 10.045 -19.528 1.00 0.00 H new ATOM 0 HH21 ARG I 15 50.851 11.151 -16.333 1.00 0.00 H new ATOM 0 HH22 ARG I 15 51.932 11.377 -17.713 1.00 0.00 H new ATOM 1594 N ALA I 16 46.349 4.636 -17.755 1.00 0.00 N ATOM 1595 CA ALA I 16 46.244 3.313 -18.435 1.00 0.00 C ATOM 1596 C ALA I 16 45.818 2.234 -17.436 1.00 0.00 C ATOM 1597 O ALA I 16 46.629 1.684 -16.718 1.00 0.00 O ATOM 1598 CB ALA I 16 47.649 3.029 -18.965 1.00 0.00 C ATOM 0 H ALA I 16 45.908 5.413 -18.247 1.00 0.00 H new ATOM 0 HA ALA I 16 45.500 3.317 -19.232 1.00 0.00 H new ATOM 0 HB1 ALA I 16 47.656 2.069 -19.481 1.00 0.00 H new ATOM 0 HB2 ALA I 16 47.942 3.816 -19.660 1.00 0.00 H new ATOM 0 HB3 ALA I 16 48.353 2.999 -18.133 1.00 0.00 H new ATOM 1604 N LYS I 17 44.551 1.929 -17.383 1.00 0.00 N ATOM 1605 CA LYS I 17 44.075 0.886 -16.431 1.00 0.00 C ATOM 1606 C LYS I 17 44.891 -0.398 -16.602 1.00 0.00 C ATOM 1607 O LYS I 17 45.085 -0.806 -17.735 1.00 0.00 O ATOM 1608 CB LYS I 17 42.611 0.647 -16.804 1.00 0.00 C ATOM 1609 CG LYS I 17 41.704 1.376 -15.810 1.00 0.00 C ATOM 1610 CD LYS I 17 40.239 1.099 -16.155 1.00 0.00 C ATOM 1611 CE LYS I 17 39.606 0.248 -15.052 1.00 0.00 C ATOM 1612 NZ LYS I 17 38.256 -0.108 -15.569 1.00 0.00 N ATOM 1613 OXT LYS I 17 45.305 -0.952 -15.597 1.00 0.00 O ATOM 0 H LYS I 17 43.825 2.357 -17.957 1.00 0.00 H new ATOM 0 HA LYS I 17 44.184 1.194 -15.391 1.00 0.00 H new ATOM 0 HB2 LYS I 17 42.420 1.004 -17.816 1.00 0.00 H new ATOM 0 HB3 LYS I 17 42.393 -0.421 -16.796 1.00 0.00 H new ATOM 0 HG2 LYS I 17 41.918 1.043 -14.794 1.00 0.00 H new ATOM 0 HG3 LYS I 17 41.899 2.448 -15.842 1.00 0.00 H new ATOM 0 HD2 LYS I 17 39.696 2.038 -16.261 1.00 0.00 H new ATOM 0 HD3 LYS I 17 40.171 0.582 -17.112 1.00 0.00 H new ATOM 0 HE2 LYS I 17 40.200 -0.644 -14.851 1.00 0.00 H new ATOM 0 HE3 LYS I 17 39.537 0.802 -14.116 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 37.759 -0.693 -14.867 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 37.711 0.760 -15.745 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 38.354 -0.641 -16.457 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 70.221 -4.879 4.102 1.00 0.00 CA