USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 804 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 Single : A 96 A O2' : rot -14:sc= 0.373 USER MOD Single : A 96 A O5' : rot -23:sc= 0.00287 USER MOD Single : A 97 U O2' : rot 18:sc= 0.244 USER MOD Single : A 98 C O2' : rot 28:sc= 0.0942 USER MOD Single : A 99 A O2' : rot -31:sc= 1.17 USER MOD Single : A 100 A O2' : rot 180:sc=-0.00148 USER MOD Single : A 101 A O2' : rot 180:sc= 0 USER MOD Single : A 101 A O3' : rot 136:sc= 0.134 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 159:sc= 0.796 (180deg=0.538) USER MOD Single : B 16 ASN : amide:sc= -5.85! C(o=-5.9!,f=-4.9!) USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 180:sc= -0.0815 USER MOD Single : B 20 ASN : amide:sc= -0.0195 X(o=-0.02,f=-0.02) USER MOD Single : B 22 LYS NZ :NH3+ -163:sc= -0.0433 (180deg=-0.313) USER MOD Single : B 30 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00171) USER MOD Single : B 31 TYR OH : rot 160:sc= -0.756 USER MOD Single : B 40 MET CE :methyl -129:sc= -0.297 (180deg=-2.88!) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -170:sc= -0.109 USER MOD Single : B 46 ASN : amide:sc= -0.241 K(o=-0.24,f=-2.6!) USER MOD Single : B 47 LYS NZ :NH3+ -161:sc= 1.04 (180deg=0.823) USER MOD Single : B 48 SER OG : rot 120:sc= -0.0184 USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 58 SER OG : rot 180:sc= -0.0415 USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 MET CE :methyl -143:sc= -2.09 (180deg=-2.86!) USER MOD Single : B 70 ASN : amide:sc= 0.406 K(o=0.41,f=-3.6!) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 SER OG : rot 180:sc= -0.0477 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 141:sc= 0.897 (180deg=0.245) USER MOD Single : B 83 GLN : amide:sc= -0.65 K(o=-0.65,f=-2.2) USER MOD Single : B 85 THR OG1 : rot 180:sc= 0 USER MOD Single : B 86 LYS NZ :NH3+ -178:sc= 1.19 (180deg=1.18) USER MOD Single : B 88 SER OG : rot -26:sc= 0.163 USER MOD Single : B 91 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET B 1 -5.410 1.513 -1.355 1.00 0.00 N ATOM 2 CA MET B 1 -4.024 1.883 -1.699 1.00 0.00 C ATOM 3 C MET B 1 -3.410 0.867 -2.644 1.00 0.00 C ATOM 4 O MET B 1 -2.749 -0.081 -2.223 1.00 0.00 O ATOM 5 CB MET B 1 -3.181 2.057 -0.432 1.00 0.00 C ATOM 6 CG MET B 1 -1.767 2.516 -0.786 1.00 0.00 C ATOM 7 SD MET B 1 -1.717 4.058 -1.735 1.00 0.00 S ATOM 8 CE MET B 1 0.050 4.081 -2.123 1.00 0.00 C ATOM 0 H1 MET B 1 -5.808 2.223 -0.708 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.984 1.474 -2.221 1.00 0.00 H new ATOM 0 H3 MET B 1 -5.416 0.581 -0.893 1.00 0.00 H new ATOM 0 HA MET B 1 -4.042 2.841 -2.219 1.00 0.00 H new ATOM 0 HB2 MET B 1 -3.652 2.786 0.227 1.00 0.00 H new ATOM 0 HB3 MET B 1 -3.137 1.115 0.115 1.00 0.00 H new ATOM 0 HG2 MET B 1 -1.196 2.647 0.133 1.00 0.00 H new ATOM 0 HG3 MET B 1 -1.273 1.731 -1.359 1.00 0.00 H new ATOM 0 HE1 MET B 1 0.282 4.968 -2.712 1.00 0.00 H new ATOM 0 HE2 MET B 1 0.626 4.099 -1.198 1.00 0.00 H new ATOM 0 HE3 MET B 1 0.309 3.189 -2.694 1.00 0.00 H new ATOM 20 N VAL B 2 -3.642 1.082 -3.938 1.00 0.00 N ATOM 21 CA VAL B 2 -2.986 0.361 -5.006 1.00 0.00 C ATOM 22 C VAL B 2 -2.698 1.361 -6.119 1.00 0.00 C ATOM 23 O VAL B 2 -3.589 2.078 -6.570 1.00 0.00 O ATOM 24 CB VAL B 2 -3.846 -0.819 -5.471 1.00 0.00 C ATOM 25 CG1 VAL B 2 -5.262 -0.407 -5.885 1.00 0.00 C ATOM 26 CG2 VAL B 2 -3.152 -1.487 -6.653 1.00 0.00 C ATOM 0 H VAL B 2 -4.307 1.780 -4.271 1.00 0.00 H new ATOM 0 HA VAL B 2 -2.046 -0.077 -4.670 1.00 0.00 H new ATOM 0 HB VAL B 2 -3.950 -1.502 -4.628 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -5.819 -1.288 -6.204 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -5.769 0.056 -5.038 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -5.208 0.305 -6.708 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -3.751 -2.330 -6.997 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -3.039 -0.767 -7.463 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -2.169 -1.842 -6.344 1.00 0.00 H new ATOM 36 N GLU B 3 -1.442 1.408 -6.558 1.00 0.00 N ATOM 37 CA GLU B 3 -1.006 2.329 -7.591 1.00 0.00 C ATOM 38 C GLU B 3 -0.211 1.604 -8.676 1.00 0.00 C ATOM 39 O GLU B 3 0.775 0.927 -8.394 1.00 0.00 O ATOM 40 CB GLU B 3 -0.218 3.475 -6.951 1.00 0.00 C ATOM 41 CG GLU B 3 0.957 2.999 -6.089 1.00 0.00 C ATOM 42 CD GLU B 3 1.561 4.142 -5.273 1.00 0.00 C ATOM 43 OE1 GLU B 3 1.210 5.314 -5.543 1.00 0.00 O ATOM 44 OE2 GLU B 3 2.377 3.831 -4.379 1.00 0.00 O ATOM 0 H GLU B 3 -0.700 0.805 -6.203 1.00 0.00 H new ATOM 0 HA GLU B 3 -1.876 2.756 -8.089 1.00 0.00 H new ATOM 0 HB2 GLU B 3 0.159 4.130 -7.737 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -0.892 4.071 -6.336 1.00 0.00 H new ATOM 0 HG2 GLU B 3 0.619 2.211 -5.416 1.00 0.00 H new ATOM 0 HG3 GLU B 3 1.725 2.564 -6.729 1.00 0.00 H new ATOM 51 N ALA B 4 -0.658 1.762 -9.922 1.00 0.00 N ATOM 52 CA ALA B 4 -0.037 1.161 -11.085 1.00 0.00 C ATOM 53 C ALA B 4 0.561 2.280 -11.924 1.00 0.00 C ATOM 54 O ALA B 4 -0.158 3.017 -12.593 1.00 0.00 O ATOM 55 CB ALA B 4 -1.082 0.355 -11.859 1.00 0.00 C ATOM 0 H ALA B 4 -1.479 2.324 -10.147 1.00 0.00 H new ATOM 0 HA ALA B 4 0.758 0.471 -10.803 1.00 0.00 H new ATOM 0 HB1 ALA B 4 -0.617 -0.098 -12.734 1.00 0.00 H new ATOM 0 HB2 ALA B 4 -1.486 -0.428 -11.217 1.00 0.00 H new ATOM 0 HB3 ALA B 4 -1.888 1.016 -12.178 1.00 0.00 H new ATOM 61 N ASP B 5 1.887 2.403 -11.875 1.00 0.00 N ATOM 62 CA ASP B 5 2.576 3.522 -12.504 1.00 0.00 C ATOM 63 C ASP B 5 2.500 3.499 -14.032 1.00 0.00 C ATOM 64 O ASP B 5 2.403 4.558 -14.649 1.00 0.00 O ATOM 65 CB ASP B 5 4.028 3.512 -12.039 1.00 0.00 C ATOM 66 CG ASP B 5 4.791 4.700 -12.609 1.00 0.00 C ATOM 67 OD1 ASP B 5 4.443 5.838 -12.225 1.00 0.00 O ATOM 68 OD2 ASP B 5 5.711 4.461 -13.421 1.00 0.00 O ATOM 0 H ASP B 5 2.503 1.740 -11.405 1.00 0.00 H new ATOM 0 HA ASP B 5 2.076 4.441 -12.199 1.00 0.00 H new ATOM 0 HB2 ASP B 5 4.065 3.540 -10.950 1.00 0.00 H new ATOM 0 HB3 ASP B 5 4.507 2.584 -12.351 1.00 0.00 H new ATOM 73 N ARG B 6 2.544 2.316 -14.655 1.00 0.00 N ATOM 74 CA ARG B 6 2.483 2.219 -16.106 1.00 0.00 C ATOM 75 C ARG B 6 2.126 0.802 -16.551 1.00 0.00 C ATOM 76 O ARG B 6 2.701 -0.160 -16.037 1.00 0.00 O ATOM 77 CB ARG B 6 3.857 2.602 -16.670 1.00 0.00 C ATOM 78 CG ARG B 6 3.827 2.887 -18.179 1.00 0.00 C ATOM 79 CD ARG B 6 2.977 4.112 -18.512 1.00 0.00 C ATOM 80 NE ARG B 6 3.443 5.308 -17.796 1.00 0.00 N ATOM 81 CZ ARG B 6 3.234 6.562 -18.203 1.00 0.00 C ATOM 82 NH1 ARG B 6 2.557 6.811 -19.322 1.00 0.00 N ATOM 83 NH2 ARG B 6 3.704 7.577 -17.487 1.00 0.00 N ATOM 0 H ARG B 6 2.621 1.420 -14.174 1.00 0.00 H new ATOM 0 HA ARG B 6 1.709 2.891 -16.477 1.00 0.00 H new ATOM 0 HB2 ARG B 6 4.226 3.484 -16.146 1.00 0.00 H new ATOM 0 HB3 ARG B 6 4.563 1.795 -16.472 1.00 0.00 H new ATOM 0 HG2 ARG B 6 4.844 3.042 -18.539 1.00 0.00 H new ATOM 0 HG3 ARG B 6 3.432 2.018 -18.705 1.00 0.00 H new ATOM 0 HD2 ARG B 6 3.008 4.296 -19.586 1.00 0.00 H new ATOM 0 HD3 ARG B 6 1.937 3.915 -18.252 1.00 0.00 H new ATOM 0 HE ARG B 6 3.962 5.170 -16.929 1.00 0.00 H new ATOM 0 HH11 ARG B 6 2.191 6.039 -19.879 1.00 0.00 H new ATOM 0 HH12 ARG B 6 2.404 7.774 -19.622 1.00 0.00 H new ATOM 0 HH21 ARG B 6 4.224 7.398 -16.628 1.00 0.00 H new ATOM 0 HH22 ARG B 6 3.545 8.536 -17.796 1.00 0.00 H new ATOM 97 N PRO B 7 1.192 0.642 -17.501 1.00 0.00 N ATOM 98 CA PRO B 7 0.907 -0.637 -18.133 1.00 0.00 C ATOM 99 C PRO B 7 2.149 -1.230 -18.786 1.00 0.00 C ATOM 100 O PRO B 7 3.020 -0.495 -19.250 1.00 0.00 O ATOM 101 CB PRO B 7 -0.128 -0.330 -19.213 1.00 0.00 C ATOM 102 CG PRO B 7 -0.828 0.916 -18.700 1.00 0.00 C ATOM 103 CD PRO B 7 0.323 1.674 -18.037 1.00 0.00 C ATOM 0 HA PRO B 7 0.557 -1.361 -17.397 1.00 0.00 H new ATOM 0 HB2 PRO B 7 0.343 -0.155 -20.180 1.00 0.00 H new ATOM 0 HB3 PRO B 7 -0.827 -1.156 -19.344 1.00 0.00 H new ATOM 0 HG2 PRO B 7 -1.284 1.490 -19.507 1.00 0.00 H new ATOM 0 HG3 PRO B 7 -1.621 0.677 -17.992 1.00 0.00 H new ATOM 0 HD2 PRO B 7 0.850 2.300 -18.757 1.00 0.00 H new ATOM 0 HD3 PRO B 7 -0.041 2.333 -17.248 1.00 0.00 H new ATOM 111 N GLY B 8 2.242 -2.563 -18.830 1.00 0.00 N ATOM 112 CA GLY B 8 3.320 -3.239 -19.533 1.00 0.00 C ATOM 113 C GLY B 8 4.457 -3.557 -18.580 1.00 0.00 C ATOM 114 O GLY B 8 5.280 -4.416 -18.885 1.00 0.00 O ATOM 0 H GLY B 8 1.576 -3.192 -18.382 1.00 0.00 H new ATOM 0 HA2 GLY B 8 2.948 -4.159 -19.984 1.00 0.00 H new ATOM 0 HA3 GLY B 8 3.683 -2.610 -20.345 1.00 0.00 H new ATOM 118 N LYS B 9 4.508 -2.874 -17.433 1.00 0.00 N ATOM 119 CA LYS B 9 5.491 -3.189 -16.418 1.00 0.00 C ATOM 120 C LYS B 9 4.940 -4.300 -15.537 1.00 0.00 C ATOM 121 O LYS B 9 3.817 -4.207 -15.040 1.00 0.00 O ATOM 122 CB LYS B 9 5.870 -1.953 -15.605 1.00 0.00 C ATOM 123 CG LYS B 9 7.005 -2.355 -14.660 1.00 0.00 C ATOM 124 CD LYS B 9 7.390 -1.227 -13.702 1.00 0.00 C ATOM 125 CE LYS B 9 8.039 -0.067 -14.456 1.00 0.00 C ATOM 126 NZ LYS B 9 8.459 0.997 -13.530 1.00 0.00 N ATOM 0 H LYS B 9 3.880 -2.106 -17.194 1.00 0.00 H new ATOM 0 HA LYS B 9 6.410 -3.533 -16.893 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.187 -1.144 -16.263 1.00 0.00 H new ATOM 0 HB3 LYS B 9 5.012 -1.587 -15.040 1.00 0.00 H new ATOM 0 HG2 LYS B 9 6.703 -3.230 -14.085 1.00 0.00 H new ATOM 0 HG3 LYS B 9 7.877 -2.645 -15.246 1.00 0.00 H new ATOM 0 HD2 LYS B 9 6.503 -0.873 -13.176 1.00 0.00 H new ATOM 0 HD3 LYS B 9 8.079 -1.605 -12.947 1.00 0.00 H new ATOM 0 HE2 LYS B 9 8.902 -0.429 -15.014 1.00 0.00 H new ATOM 0 HE3 LYS B 9 7.335 0.337 -15.184 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 9.188 1.584 -13.983 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 7.639 1.589 -13.287 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 8.847 0.571 -12.664 1.00 0.00 H new ATOM 140 N LEU B 10 5.737 -5.348 -15.351 1.00 0.00 N ATOM 141 CA LEU B 10 5.352 -6.501 -14.561 1.00 0.00 C ATOM 142 C LEU B 10 6.262 -6.641 -13.351 1.00 0.00 C ATOM 143 O LEU B 10 7.396 -6.166 -13.364 1.00 0.00 O ATOM 144 CB LEU B 10 5.452 -7.746 -15.434 1.00 0.00 C ATOM 145 CG LEU B 10 4.439 -7.795 -16.577 1.00 0.00 C ATOM 146 CD1 LEU B 10 4.688 -9.102 -17.324 1.00 0.00 C ATOM 147 CD2 LEU B 10 2.998 -7.805 -16.075 1.00 0.00 C ATOM 0 H LEU B 10 6.674 -5.416 -15.749 1.00 0.00 H new ATOM 0 HA LEU B 10 4.329 -6.376 -14.207 1.00 0.00 H new ATOM 0 HB2 LEU B 10 6.457 -7.803 -15.852 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.318 -8.627 -14.807 1.00 0.00 H new ATOM 0 HG LEU B 10 4.565 -6.911 -17.202 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.987 -9.186 -18.154 1.00 0.00 H new ATOM 0 HD12 LEU B 10 5.708 -9.113 -17.708 1.00 0.00 H new ATOM 0 HD13 LEU B 10 4.547 -9.942 -16.644 1.00 0.00 H new ATOM 0 HD21 LEU B 10 2.317 -7.840 -16.925 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.838 -8.680 -15.445 1.00 0.00 H new ATOM 0 HD23 LEU B 10 2.808 -6.902 -15.495 1.00 0.00 H new ATOM 159 N PHE B 11 5.748 -7.297 -12.316 1.00 0.00 N ATOM 160 CA PHE B 11 6.492 -7.655 -11.130 1.00 0.00 C ATOM 161 C PHE B 11 6.707 -9.157 -11.150 1.00 0.00 C ATOM 162 O PHE B 11 5.754 -9.911 -11.340 1.00 0.00 O ATOM 163 CB PHE B 11 5.711 -7.238 -9.888 1.00 0.00 C ATOM 164 CG PHE B 11 6.311 -7.796 -8.621 1.00 0.00 C ATOM 165 CD1 PHE B 11 7.509 -7.264 -8.132 1.00 0.00 C ATOM 166 CD2 PHE B 11 5.679 -8.848 -7.941 1.00 0.00 C ATOM 167 CE1 PHE B 11 8.072 -7.773 -6.956 1.00 0.00 C ATOM 168 CE2 PHE B 11 6.252 -9.364 -6.771 1.00 0.00 C ATOM 169 CZ PHE B 11 7.446 -8.822 -6.281 1.00 0.00 C ATOM 0 H PHE B 11 4.774 -7.599 -12.286 1.00 0.00 H new ATOM 0 HA PHE B 11 7.455 -7.145 -11.109 1.00 0.00 H new ATOM 0 HB2 PHE B 11 5.684 -6.150 -9.826 1.00 0.00 H new ATOM 0 HB3 PHE B 11 4.679 -7.578 -9.979 1.00 0.00 H new ATOM 0 HD1 PHE B 11 7.999 -6.461 -8.662 1.00 0.00 H new ATOM 0 HD2 PHE B 11 4.754 -9.259 -8.318 1.00 0.00 H new ATOM 0 HE1 PHE B 11 8.990 -7.354 -6.571 1.00 0.00 H new ATOM 0 HE2 PHE B 11 5.773 -10.179 -6.248 1.00 0.00 H new ATOM 0 HZ PHE B 11 7.885 -9.217 -5.377 1.00 0.00 H new ATOM 179 N ILE B 12 7.955 -9.587 -10.956 1.00 0.00 N ATOM 180 CA ILE B 12 8.330 -10.987 -11.053 1.00 0.00 C ATOM 181 C ILE B 12 8.942 -11.440 -9.729 1.00 0.00 C ATOM 182 O ILE B 12 10.162 -11.500 -9.604 1.00 0.00 O ATOM 183 CB ILE B 12 9.314 -11.185 -12.219 1.00 0.00 C ATOM 184 CG1 ILE B 12 9.043 -10.351 -13.483 1.00 0.00 C ATOM 185 CG2 ILE B 12 9.311 -12.664 -12.586 1.00 0.00 C ATOM 186 CD1 ILE B 12 7.679 -10.568 -14.138 1.00 0.00 C ATOM 0 H ILE B 12 8.732 -8.967 -10.727 1.00 0.00 H new ATOM 0 HA ILE B 12 7.447 -11.595 -11.251 1.00 0.00 H new ATOM 0 HB ILE B 12 10.280 -10.831 -11.859 1.00 0.00 H new ATOM 0 HG12 ILE B 12 9.140 -9.296 -13.228 1.00 0.00 H new ATOM 0 HG13 ILE B 12 9.818 -10.574 -14.217 1.00 0.00 H new ATOM 0 HG21 ILE B 12 10.001 -12.835 -13.412 1.00 0.00 H new ATOM 0 HG22 ILE B 12 9.623 -13.253 -11.724 1.00 0.00 H new ATOM 0 HG23 ILE B 12 8.306 -12.963 -12.885 1.00 0.00 H new ATOM 0 HD11 ILE B 12 7.593 -9.932 -15.019 1.00 0.00 H new ATOM 0 HD12 ILE B 12 7.579 -11.612 -14.433 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.891 -10.314 -13.429 1.00 0.00 H new ATOM 198 N GLY B 13 8.113 -11.758 -8.732 1.00 0.00 N ATOM 199 CA GLY B 13 8.620 -12.129 -7.414 1.00 0.00 C ATOM 200 C GLY B 13 8.728 -13.641 -7.249 1.00 0.00 C ATOM 201 O GLY B 13 7.897 -14.377 -7.770 1.00 0.00 O ATOM 0 H GLY B 13 7.096 -11.766 -8.813 1.00 0.00 H new ATOM 0 HA2 GLY B 13 9.600 -11.677 -7.262 1.00 0.00 H new ATOM 0 HA3 GLY B 13 7.960 -11.726 -6.645 1.00 0.00 H new ATOM 205 N GLY B 14 9.745 -14.110 -6.527 1.00 0.00 N ATOM 206 CA GLY B 14 9.884 -15.519 -6.177 1.00 0.00 C ATOM 207 C GLY B 14 10.921 -16.214 -7.053 1.00 0.00 C ATOM 208 O GLY B 14 11.067 -17.434 -6.993 1.00 0.00 O ATOM 0 H GLY B 14 10.496 -13.520 -6.169 1.00 0.00 H new ATOM 0 HA2 GLY B 14 10.173 -15.608 -5.130 1.00 0.00 H new ATOM 0 HA3 GLY B 14 8.921 -16.018 -6.286 1.00 0.00 H new ATOM 212 N LEU B 15 11.641 -15.441 -7.871 1.00 0.00 N ATOM 213 CA LEU B 15 12.633 -15.967 -8.793 1.00 0.00 C ATOM 214 C LEU B 15 13.789 -16.624 -8.043 1.00 0.00 C ATOM 215 O LEU B 15 13.963 -16.427 -6.839 1.00 0.00 O ATOM 216 CB LEU B 15 13.187 -14.827 -9.642 1.00 0.00 C ATOM 217 CG LEU B 15 12.157 -14.151 -10.538 1.00 0.00 C ATOM 218 CD1 LEU B 15 12.712 -12.811 -11.011 1.00 0.00 C ATOM 219 CD2 LEU B 15 11.945 -15.030 -11.764 1.00 0.00 C ATOM 0 H LEU B 15 11.546 -14.426 -7.907 1.00 0.00 H new ATOM 0 HA LEU B 15 12.150 -16.716 -9.421 1.00 0.00 H new ATOM 0 HB2 LEU B 15 13.624 -14.078 -8.982 1.00 0.00 H new ATOM 0 HB3 LEU B 15 13.994 -15.213 -10.264 1.00 0.00 H new ATOM 0 HG LEU B 15 11.225 -14.004 -9.993 1.00 0.00 H new ATOM 0 HD11 LEU B 15 11.981 -12.320 -11.653 1.00 0.00 H new ATOM 0 HD12 LEU B 15 12.920 -12.178 -10.148 1.00 0.00 H new ATOM 0 HD13 LEU B 15 13.633 -12.976 -11.570 1.00 0.00 H new ATOM 0 HD21 LEU B 15 11.210 -14.566 -12.422 1.00 0.00 H new ATOM 0 HD22 LEU B 15 12.889 -15.144 -12.297 1.00 0.00 H new ATOM 0 HD23 LEU B 15 11.584 -16.010 -11.451 1.00 0.00 H new ATOM 231 N ASN B 16 14.580 -17.404 -8.774 1.00 0.00 N ATOM 232 CA ASN B 16 15.761 -18.044 -8.245 1.00 0.00 C ATOM 233 C ASN B 16 16.866 -17.014 -8.007 1.00 0.00 C ATOM 234 O ASN B 16 16.847 -15.932 -8.594 1.00 0.00 O ATOM 235 CB ASN B 16 16.175 -19.103 -9.249 1.00 0.00 C ATOM 236 CG ASN B 16 17.190 -20.094 -8.733 1.00 0.00 C ATOM 237 OD1 ASN B 16 17.561 -20.104 -7.562 1.00 0.00 O ATOM 238 ND2 ASN B 16 17.633 -20.942 -9.646 1.00 0.00 N ATOM 0 H ASN B 16 14.410 -17.606 -9.759 1.00 0.00 H new ATOM 0 HA ASN B 16 15.564 -18.508 -7.278 1.00 0.00 H new ATOM 0 HB2 ASN B 16 15.287 -19.647 -9.571 1.00 0.00 H new ATOM 0 HB3 ASN B 16 16.584 -18.609 -10.131 1.00 0.00 H new ATOM 0 HD21 ASN B 16 18.319 -21.652 -9.392 1.00 0.00 H new ATOM 0 HD22 ASN B 16 17.288 -20.886 -10.604 1.00 0.00 H new ATOM 245 N THR B 17 17.833 -17.340 -7.147 1.00 0.00 N ATOM 246 CA THR B 17 18.960 -16.456 -6.876 1.00 0.00 C ATOM 247 C THR B 17 19.954 -16.494 -8.031 1.00 0.00 C ATOM 248 O THR B 17 20.934 -15.754 -8.040 1.00 0.00 O ATOM 249 CB THR B 17 19.661 -16.884 -5.586 1.00 0.00 C ATOM 250 OG1 THR B 17 20.165 -18.193 -5.725 1.00 0.00 O ATOM 251 CG2 THR B 17 18.684 -16.867 -4.415 1.00 0.00 C ATOM 0 H THR B 17 17.854 -18.216 -6.625 1.00 0.00 H new ATOM 0 HA THR B 17 18.584 -15.439 -6.764 1.00 0.00 H new ATOM 0 HB THR B 17 20.475 -16.184 -5.395 1.00 0.00 H new ATOM 0 HG1 THR B 17 20.614 -18.460 -4.896 1.00 0.00 H new ATOM 0 HG21 THR B 17 19.201 -17.174 -3.506 1.00 0.00 H new ATOM 0 HG22 THR B 17 18.289 -15.859 -4.285 1.00 0.00 H new ATOM 0 HG23 THR B 17 17.863 -17.555 -4.616 1.00 0.00 H new ATOM 259 N GLU B 18 19.687 -17.369 -9.004 1.00 0.00 N ATOM 260 CA GLU B 18 20.589 -17.667 -10.101 1.00 0.00 C ATOM 261 C GLU B 18 20.091 -17.046 -11.406 1.00 0.00 C ATOM 262 O GLU B 18 20.788 -17.078 -12.420 1.00 0.00 O ATOM 263 CB GLU B 18 20.711 -19.188 -10.235 1.00 0.00 C ATOM 264 CG GLU B 18 20.686 -19.915 -8.882 1.00 0.00 C ATOM 265 CD GLU B 18 21.925 -19.658 -8.014 1.00 0.00 C ATOM 266 OE1 GLU B 18 22.625 -18.646 -8.245 1.00 0.00 O ATOM 267 OE2 GLU B 18 22.164 -20.490 -7.113 1.00 0.00 O ATOM 0 H GLU B 18 18.816 -17.898 -9.045 1.00 0.00 H new ATOM 0 HA GLU B 18 21.568 -17.237 -9.892 1.00 0.00 H new ATOM 0 HB2 GLU B 18 19.895 -19.559 -10.855 1.00 0.00 H new ATOM 0 HB3 GLU B 18 21.640 -19.428 -10.753 1.00 0.00 H new ATOM 0 HG2 GLU B 18 19.798 -19.605 -8.331 1.00 0.00 H new ATOM 0 HG3 GLU B 18 20.594 -20.987 -9.058 1.00 0.00 H new ATOM 274 N THR B 19 18.878 -16.484 -11.378 1.00 0.00 N ATOM 275 CA THR B 19 18.253 -15.883 -12.548 1.00 0.00 C ATOM 276 C THR B 19 18.832 -14.496 -12.779 1.00 0.00 C ATOM 277 O THR B 19 19.144 -13.783 -11.826 1.00 0.00 O ATOM 278 CB THR B 19 16.740 -15.795 -12.337 1.00 0.00 C ATOM 279 OG1 THR B 19 16.216 -17.065 -12.032 1.00 0.00 O ATOM 280 CG2 THR B 19 16.025 -15.271 -13.582 1.00 0.00 C ATOM 0 H THR B 19 18.304 -16.436 -10.536 1.00 0.00 H new ATOM 0 HA THR B 19 18.451 -16.501 -13.424 1.00 0.00 H new ATOM 0 HB THR B 19 16.573 -15.103 -11.512 1.00 0.00 H new ATOM 0 HG1 THR B 19 15.248 -16.996 -11.897 1.00 0.00 H new ATOM 0 HG21 THR B 19 14.953 -15.223 -13.393 1.00 0.00 H new ATOM 0 HG22 THR B 19 16.396 -14.275 -13.822 1.00 0.00 H new ATOM 0 HG23 THR B 19 16.216 -15.941 -14.420 1.00 0.00 H new ATOM 288 N ASN B 20 18.974 -14.103 -14.047 1.00 0.00 N ATOM 289 CA ASN B 20 19.432 -12.769 -14.398 1.00 0.00 C ATOM 290 C ASN B 20 18.550 -12.187 -15.491 1.00 0.00 C ATOM 291 O ASN B 20 17.509 -12.739 -15.827 1.00 0.00 O ATOM 292 CB ASN B 20 20.887 -12.762 -14.867 1.00 0.00 C ATOM 293 CG ASN B 20 21.689 -13.924 -14.323 1.00 0.00 C ATOM 294 OD1 ASN B 20 22.290 -13.846 -13.255 1.00 0.00 O ATOM 295 ND2 ASN B 20 21.696 -15.016 -15.077 1.00 0.00 N ATOM 0 H ASN B 20 18.775 -14.700 -14.850 1.00 0.00 H new ATOM 0 HA ASN B 20 19.367 -12.159 -13.497 1.00 0.00 H new ATOM 0 HB2 ASN B 20 20.912 -12.789 -15.956 1.00 0.00 H new ATOM 0 HB3 ASN B 20 21.357 -11.828 -14.560 1.00 0.00 H new ATOM 0 HD21 ASN B 20 22.217 -15.840 -14.777 1.00 0.00 H new ATOM 0 HD22 ASN B 20 21.180 -15.031 -15.957 1.00 0.00 H new ATOM 302 N GLU B 21 18.996 -11.060 -16.039 1.00 0.00 N ATOM 303 CA GLU B 21 18.229 -10.308 -17.014 1.00 0.00 C ATOM 304 C GLU B 21 18.106 -11.083 -18.317 1.00 0.00 C ATOM 305 O GLU B 21 17.083 -10.998 -18.986 1.00 0.00 O ATOM 306 CB GLU B 21 18.926 -8.973 -17.256 1.00 0.00 C ATOM 307 CG GLU B 21 18.818 -8.114 -15.997 1.00 0.00 C ATOM 308 CD GLU B 21 19.715 -6.883 -16.088 1.00 0.00 C ATOM 309 OE1 GLU B 21 19.283 -5.896 -16.725 1.00 0.00 O ATOM 310 OE2 GLU B 21 20.828 -6.936 -15.518 1.00 0.00 O ATOM 0 H GLU B 21 19.901 -10.646 -15.816 1.00 0.00 H new ATOM 0 HA GLU B 21 17.222 -10.138 -16.632 1.00 0.00 H new ATOM 0 HB2 GLU B 21 19.973 -9.137 -17.510 1.00 0.00 H new ATOM 0 HB3 GLU B 21 18.469 -8.459 -18.102 1.00 0.00 H new ATOM 0 HG2 GLU B 21 17.783 -7.803 -15.854 1.00 0.00 H new ATOM 0 HG3 GLU B 21 19.096 -8.706 -15.125 1.00 0.00 H new ATOM 317 N LYS B 22 19.135 -11.845 -18.691 1.00 0.00 N ATOM 318 CA LYS B 22 19.111 -12.585 -19.943 1.00 0.00 C ATOM 319 C LYS B 22 18.047 -13.680 -19.909 1.00 0.00 C ATOM 320 O LYS B 22 17.481 -14.026 -20.940 1.00 0.00 O ATOM 321 CB LYS B 22 20.504 -13.174 -20.191 1.00 0.00 C ATOM 322 CG LYS B 22 20.566 -14.018 -21.467 1.00 0.00 C ATOM 323 CD LYS B 22 20.014 -13.256 -22.673 1.00 0.00 C ATOM 324 CE LYS B 22 20.165 -14.082 -23.951 1.00 0.00 C ATOM 325 NZ LYS B 22 21.585 -14.315 -24.283 1.00 0.00 N ATOM 0 H LYS B 22 19.989 -11.962 -18.145 1.00 0.00 H new ATOM 0 HA LYS B 22 18.852 -11.913 -20.761 1.00 0.00 H new ATOM 0 HB2 LYS B 22 21.230 -12.364 -20.260 1.00 0.00 H new ATOM 0 HB3 LYS B 22 20.792 -13.789 -19.338 1.00 0.00 H new ATOM 0 HG2 LYS B 22 21.598 -14.310 -21.661 1.00 0.00 H new ATOM 0 HG3 LYS B 22 19.997 -14.937 -21.324 1.00 0.00 H new ATOM 0 HD2 LYS B 22 18.963 -13.019 -22.509 1.00 0.00 H new ATOM 0 HD3 LYS B 22 20.541 -12.308 -22.783 1.00 0.00 H new ATOM 0 HE2 LYS B 22 19.658 -15.039 -23.829 1.00 0.00 H new ATOM 0 HE3 LYS B 22 19.677 -13.566 -24.778 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 21.665 -14.615 -25.276 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 22.123 -13.436 -24.143 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 21.969 -15.058 -23.665 1.00 0.00 H new ATOM 339 N ALA B 23 17.765 -14.230 -18.731 1.00 0.00 N ATOM 340 CA ALA B 23 16.806 -15.314 -18.613 1.00 0.00 C ATOM 341 C ALA B 23 15.409 -14.718 -18.511 1.00 0.00 C ATOM 342 O ALA B 23 14.413 -15.379 -18.789 1.00 0.00 O ATOM 343 CB ALA B 23 17.153 -16.145 -17.377 1.00 0.00 C ATOM 0 H ALA B 23 18.188 -13.941 -17.849 1.00 0.00 H new ATOM 0 HA ALA B 23 16.839 -15.967 -19.485 1.00 0.00 H new ATOM 0 HB1 ALA B 23 16.440 -16.963 -17.277 1.00 0.00 H new ATOM 0 HB2 ALA B 23 18.159 -16.551 -17.482 1.00 0.00 H new ATOM 0 HB3 ALA B 23 17.108 -15.514 -16.490 1.00 0.00 H new ATOM 349 N LEU B 24 15.354 -13.452 -18.107 1.00 0.00 N ATOM 350 CA LEU B 24 14.138 -12.721 -17.831 1.00 0.00 C ATOM 351 C LEU B 24 13.651 -12.030 -19.094 1.00 0.00 C ATOM 352 O LEU B 24 12.456 -11.808 -19.265 1.00 0.00 O ATOM 353 CB LEU B 24 14.523 -11.720 -16.737 1.00 0.00 C ATOM 354 CG LEU B 24 14.028 -12.206 -15.384 1.00 0.00 C ATOM 355 CD1 LEU B 24 14.761 -11.496 -14.256 1.00 0.00 C ATOM 356 CD2 LEU B 24 12.539 -11.922 -15.254 1.00 0.00 C ATOM 0 H LEU B 24 16.194 -12.892 -17.959 1.00 0.00 H new ATOM 0 HA LEU B 24 13.318 -13.361 -17.504 1.00 0.00 H new ATOM 0 HB2 LEU B 24 15.606 -11.595 -16.713 1.00 0.00 H new ATOM 0 HB3 LEU B 24 14.094 -10.743 -16.960 1.00 0.00 H new ATOM 0 HG LEU B 24 14.217 -13.277 -15.315 1.00 0.00 H new ATOM 0 HD11 LEU B 24 14.391 -11.859 -13.297 1.00 0.00 H new ATOM 0 HD12 LEU B 24 15.829 -11.697 -14.333 1.00 0.00 H new ATOM 0 HD13 LEU B 24 14.588 -10.422 -14.329 1.00 0.00 H new ATOM 0 HD21 LEU B 24 12.185 -12.271 -14.284 1.00 0.00 H new ATOM 0 HD22 LEU B 24 12.364 -10.850 -15.340 1.00 0.00 H new ATOM 0 HD23 LEU B 24 11.999 -12.442 -16.045 1.00 0.00 H new ATOM 368 N GLU B 25 14.577 -11.688 -19.988 1.00 0.00 N ATOM 369 CA GLU B 25 14.211 -11.165 -21.291 1.00 0.00 C ATOM 370 C GLU B 25 13.864 -12.304 -22.232 1.00 0.00 C ATOM 371 O GLU B 25 13.076 -12.145 -23.162 1.00 0.00 O ATOM 372 CB GLU B 25 15.384 -10.398 -21.903 1.00 0.00 C ATOM 373 CG GLU B 25 15.616 -9.118 -21.121 1.00 0.00 C ATOM 374 CD GLU B 25 16.688 -8.251 -21.779 1.00 0.00 C ATOM 375 OE1 GLU B 25 17.886 -8.545 -21.568 1.00 0.00 O ATOM 376 OE2 GLU B 25 16.299 -7.297 -22.491 1.00 0.00 O ATOM 0 H GLU B 25 15.582 -11.765 -19.829 1.00 0.00 H new ATOM 0 HA GLU B 25 13.354 -10.504 -21.159 1.00 0.00 H new ATOM 0 HB2 GLU B 25 16.283 -11.014 -21.887 1.00 0.00 H new ATOM 0 HB3 GLU B 25 15.175 -10.166 -22.947 1.00 0.00 H new ATOM 0 HG2 GLU B 25 14.684 -8.557 -21.052 1.00 0.00 H new ATOM 0 HG3 GLU B 25 15.917 -9.361 -20.102 1.00 0.00 H new ATOM 383 N ALA B 26 14.469 -13.462 -21.973 1.00 0.00 N ATOM 384 CA ALA B 26 14.324 -14.634 -22.817 1.00 0.00 C ATOM 385 C ALA B 26 13.030 -15.380 -22.509 1.00 0.00 C ATOM 386 O ALA B 26 12.525 -16.114 -23.356 1.00 0.00 O ATOM 387 CB ALA B 26 15.513 -15.544 -22.548 1.00 0.00 C ATOM 0 H ALA B 26 15.076 -13.608 -21.166 1.00 0.00 H new ATOM 0 HA ALA B 26 14.288 -14.329 -23.863 1.00 0.00 H new ATOM 0 HB1 ALA B 26 15.435 -16.437 -23.168 1.00 0.00 H new ATOM 0 HB2 ALA B 26 16.436 -15.016 -22.786 1.00 0.00 H new ATOM 0 HB3 ALA B 26 15.521 -15.832 -21.497 1.00 0.00 H new ATOM 393 N VAL B 27 12.496 -15.190 -21.300 1.00 0.00 N ATOM 394 CA VAL B 27 11.320 -15.914 -20.851 1.00 0.00 C ATOM 395 C VAL B 27 10.047 -15.086 -20.948 1.00 0.00 C ATOM 396 O VAL B 27 8.981 -15.604 -21.267 1.00 0.00 O ATOM 397 CB VAL B 27 11.584 -16.349 -19.422 1.00 0.00 C ATOM 398 CG1 VAL B 27 11.472 -15.197 -18.441 1.00 0.00 C ATOM 399 CG2 VAL B 27 10.615 -17.433 -18.987 1.00 0.00 C ATOM 0 H VAL B 27 12.869 -14.533 -20.614 1.00 0.00 H new ATOM 0 HA VAL B 27 11.152 -16.774 -21.499 1.00 0.00 H new ATOM 0 HB VAL B 27 12.605 -16.731 -19.412 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.669 -15.558 -17.432 1.00 0.00 H new ATOM 0 HG12 VAL B 27 12.199 -14.427 -18.700 1.00 0.00 H new ATOM 0 HG13 VAL B 27 10.467 -14.777 -18.486 1.00 0.00 H new ATOM 0 HG21 VAL B 27 10.831 -17.723 -17.959 1.00 0.00 H new ATOM 0 HG22 VAL B 27 9.594 -17.056 -19.051 1.00 0.00 H new ATOM 0 HG23 VAL B 27 10.723 -18.300 -19.638 1.00 0.00 H new ATOM 409 N PHE B 28 10.154 -13.786 -20.671 1.00 0.00 N ATOM 410 CA PHE B 28 9.016 -12.893 -20.814 1.00 0.00 C ATOM 411 C PHE B 28 8.975 -12.282 -22.208 1.00 0.00 C ATOM 412 O PHE B 28 7.982 -11.662 -22.582 1.00 0.00 O ATOM 413 CB PHE B 28 9.025 -11.828 -19.724 1.00 0.00 C ATOM 414 CG PHE B 28 8.749 -12.393 -18.350 1.00 0.00 C ATOM 415 CD1 PHE B 28 7.432 -12.646 -17.947 1.00 0.00 C ATOM 416 CD2 PHE B 28 9.810 -12.675 -17.481 1.00 0.00 C ATOM 417 CE1 PHE B 28 7.178 -13.186 -16.681 1.00 0.00 C ATOM 418 CE2 PHE B 28 9.562 -13.229 -16.218 1.00 0.00 C ATOM 419 CZ PHE B 28 8.244 -13.479 -15.819 1.00 0.00 C ATOM 0 H PHE B 28 11.011 -13.336 -20.350 1.00 0.00 H new ATOM 0 HA PHE B 28 8.103 -13.475 -20.692 1.00 0.00 H new ATOM 0 HB2 PHE B 28 9.994 -11.329 -19.718 1.00 0.00 H new ATOM 0 HB3 PHE B 28 8.277 -11.070 -19.957 1.00 0.00 H new ATOM 0 HD1 PHE B 28 6.612 -12.424 -18.614 1.00 0.00 H new ATOM 0 HD2 PHE B 28 10.825 -12.465 -17.786 1.00 0.00 H new ATOM 0 HE1 PHE B 28 6.162 -13.377 -16.369 1.00 0.00 H new ATOM 0 HE2 PHE B 28 10.383 -13.462 -15.556 1.00 0.00 H new ATOM 0 HZ PHE B 28 8.048 -13.899 -14.844 1.00 0.00 H new ATOM 429 N GLY B 29 10.046 -12.450 -22.985 1.00 0.00 N ATOM 430 CA GLY B 29 10.066 -11.982 -24.365 1.00 0.00 C ATOM 431 C GLY B 29 9.246 -12.914 -25.255 1.00 0.00 C ATOM 432 O GLY B 29 9.085 -12.667 -26.449 1.00 0.00 O ATOM 0 H GLY B 29 10.906 -12.905 -22.680 1.00 0.00 H new ATOM 0 HA2 GLY B 29 9.664 -10.970 -24.419 1.00 0.00 H new ATOM 0 HA3 GLY B 29 11.094 -11.936 -24.725 1.00 0.00 H new ATOM 436 N LYS B 30 8.729 -13.991 -24.658 1.00 0.00 N ATOM 437 CA LYS B 30 7.948 -15.013 -25.332 1.00 0.00 C ATOM 438 C LYS B 30 6.496 -14.583 -25.478 1.00 0.00 C ATOM 439 O LYS B 30 5.727 -15.209 -26.206 1.00 0.00 O ATOM 440 CB LYS B 30 8.041 -16.291 -24.498 1.00 0.00 C ATOM 441 CG LYS B 30 9.506 -16.684 -24.300 1.00 0.00 C ATOM 442 CD LYS B 30 9.680 -17.879 -23.359 1.00 0.00 C ATOM 443 CE LYS B 30 8.834 -19.087 -23.765 1.00 0.00 C ATOM 444 NZ LYS B 30 9.240 -19.618 -25.080 1.00 0.00 N ATOM 0 H LYS B 30 8.850 -14.175 -23.662 1.00 0.00 H new ATOM 0 HA LYS B 30 8.339 -15.178 -26.336 1.00 0.00 H new ATOM 0 HB2 LYS B 30 7.563 -16.138 -23.530 1.00 0.00 H new ATOM 0 HB3 LYS B 30 7.504 -17.099 -24.995 1.00 0.00 H new ATOM 0 HG2 LYS B 30 9.947 -16.923 -25.268 1.00 0.00 H new ATOM 0 HG3 LYS B 30 10.055 -15.831 -23.901 1.00 0.00 H new ATOM 0 HD2 LYS B 30 10.731 -18.168 -23.339 1.00 0.00 H new ATOM 0 HD3 LYS B 30 9.412 -17.579 -22.346 1.00 0.00 H new ATOM 0 HE2 LYS B 30 8.930 -19.869 -23.011 1.00 0.00 H new ATOM 0 HE3 LYS B 30 7.783 -18.801 -23.796 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 8.657 -20.446 -25.315 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 9.109 -18.885 -25.806 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 10.241 -19.898 -25.047 1.00 0.00 H new ATOM 458 N TYR B 31 6.135 -13.509 -24.778 1.00 0.00 N ATOM 459 CA TYR B 31 4.780 -12.988 -24.757 1.00 0.00 C ATOM 460 C TYR B 31 4.666 -11.626 -25.438 1.00 0.00 C ATOM 461 O TYR B 31 3.567 -11.232 -25.822 1.00 0.00 O ATOM 462 CB TYR B 31 4.350 -12.897 -23.301 1.00 0.00 C ATOM 463 CG TYR B 31 4.434 -14.225 -22.580 1.00 0.00 C ATOM 464 CD1 TYR B 31 3.463 -15.207 -22.812 1.00 0.00 C ATOM 465 CD2 TYR B 31 5.494 -14.472 -21.691 1.00 0.00 C ATOM 466 CE1 TYR B 31 3.565 -16.455 -22.184 1.00 0.00 C ATOM 467 CE2 TYR B 31 5.600 -15.717 -21.052 1.00 0.00 C ATOM 468 CZ TYR B 31 4.649 -16.726 -21.325 1.00 0.00 C ATOM 469 OH TYR B 31 4.764 -17.965 -20.773 1.00 0.00 O ATOM 0 H TYR B 31 6.787 -12.974 -24.205 1.00 0.00 H new ATOM 0 HA TYR B 31 4.129 -13.658 -25.319 1.00 0.00 H new ATOM 0 HB2 TYR B 31 4.978 -12.169 -22.787 1.00 0.00 H new ATOM 0 HB3 TYR B 31 3.326 -12.526 -23.252 1.00 0.00 H new ATOM 0 HD1 TYR B 31 2.636 -15.002 -23.475 1.00 0.00 H new ATOM 0 HD2 TYR B 31 6.228 -13.703 -21.499 1.00 0.00 H new ATOM 0 HE1 TYR B 31 2.813 -17.210 -22.358 1.00 0.00 H new ATOM 0 HE2 TYR B 31 6.404 -15.903 -20.355 1.00 0.00 H new ATOM 0 HH TYR B 31 5.688 -18.108 -20.479 1.00 0.00 H new ATOM 479 N GLY B 32 5.780 -10.905 -25.591 1.00 0.00 N ATOM 480 CA GLY B 32 5.768 -9.588 -26.209 1.00 0.00 C ATOM 481 C GLY B 32 7.159 -9.017 -26.363 1.00 0.00 C ATOM 482 O GLY B 32 8.116 -9.502 -25.760 1.00 0.00 O ATOM 0 H GLY B 32 6.703 -11.218 -25.292 1.00 0.00 H new ATOM 0 HA2 GLY B 32 5.293 -9.652 -27.188 1.00 0.00 H new ATOM 0 HA3 GLY B 32 5.164 -8.911 -25.605 1.00 0.00 H new ATOM 486 N ARG B 33 7.270 -7.969 -27.181 1.00 0.00 N ATOM 487 CA ARG B 33 8.530 -7.293 -27.384 1.00 0.00 C ATOM 488 C ARG B 33 8.849 -6.486 -26.140 1.00 0.00 C ATOM 489 O ARG B 33 8.116 -5.573 -25.766 1.00 0.00 O ATOM 490 CB ARG B 33 8.423 -6.425 -28.635 1.00 0.00 C ATOM 491 CG ARG B 33 9.803 -6.294 -29.254 1.00 0.00 C ATOM 492 CD ARG B 33 9.716 -5.495 -30.554 1.00 0.00 C ATOM 493 NE ARG B 33 11.007 -5.468 -31.251 1.00 0.00 N ATOM 494 CZ ARG B 33 11.949 -4.533 -31.089 1.00 0.00 C ATOM 495 NH1 ARG B 33 11.770 -3.513 -30.254 1.00 0.00 N ATOM 496 NH2 ARG B 33 13.085 -4.624 -31.774 1.00 0.00 N ATOM 0 H ARG B 33 6.492 -7.577 -27.711 1.00 0.00 H new ATOM 0 HA ARG B 33 9.346 -7.998 -27.541 1.00 0.00 H new ATOM 0 HB2 ARG B 33 7.730 -6.872 -29.347 1.00 0.00 H new ATOM 0 HB3 ARG B 33 8.028 -5.442 -28.380 1.00 0.00 H new ATOM 0 HG2 ARG B 33 10.478 -5.798 -28.557 1.00 0.00 H new ATOM 0 HG3 ARG B 33 10.218 -7.282 -29.451 1.00 0.00 H new ATOM 0 HD2 ARG B 33 8.959 -5.934 -31.203 1.00 0.00 H new ATOM 0 HD3 ARG B 33 9.397 -4.476 -30.336 1.00 0.00 H new ATOM 0 HE ARG B 33 11.201 -6.221 -31.911 1.00 0.00 H new ATOM 0 HH11 ARG B 33 10.902 -3.434 -29.724 1.00 0.00 H new ATOM 0 HH12 ARG B 33 12.501 -2.810 -30.144 1.00 0.00 H new ATOM 0 HH21 ARG B 33 13.232 -5.402 -32.417 1.00 0.00 H new ATOM 0 HH22 ARG B 33 13.809 -3.915 -31.657 1.00 0.00 H new ATOM 510 N ILE B 34 9.957 -6.837 -25.503 1.00 0.00 N ATOM 511 CA ILE B 34 10.429 -6.151 -24.313 1.00 0.00 C ATOM 512 C ILE B 34 11.070 -4.816 -24.684 1.00 0.00 C ATOM 513 O ILE B 34 11.764 -4.712 -25.693 1.00 0.00 O ATOM 514 CB ILE B 34 11.395 -7.068 -23.559 1.00 0.00 C ATOM 515 CG1 ILE B 34 10.604 -8.285 -23.066 1.00 0.00 C ATOM 516 CG2 ILE B 34 12.047 -6.329 -22.393 1.00 0.00 C ATOM 517 CD1 ILE B 34 11.447 -9.219 -22.203 1.00 0.00 C ATOM 0 H ILE B 34 10.555 -7.609 -25.800 1.00 0.00 H new ATOM 0 HA ILE B 34 9.590 -5.923 -23.655 1.00 0.00 H new ATOM 0 HB ILE B 34 12.199 -7.391 -24.221 1.00 0.00 H new ATOM 0 HG12 ILE B 34 9.741 -7.946 -22.493 1.00 0.00 H new ATOM 0 HG13 ILE B 34 10.220 -8.836 -23.924 1.00 0.00 H new ATOM 0 HG21 ILE B 34 12.729 -7.001 -21.872 1.00 0.00 H new ATOM 0 HG22 ILE B 34 12.602 -5.470 -22.771 1.00 0.00 H new ATOM 0 HG23 ILE B 34 11.276 -5.988 -21.702 1.00 0.00 H new ATOM 0 HD11 ILE B 34 10.839 -10.064 -21.880 1.00 0.00 H new ATOM 0 HD12 ILE B 34 12.296 -9.583 -22.782 1.00 0.00 H new ATOM 0 HD13 ILE B 34 11.810 -8.678 -21.329 1.00 0.00 H new ATOM 529 N VAL B 35 10.831 -3.795 -23.854 1.00 0.00 N ATOM 530 CA VAL B 35 11.440 -2.479 -24.021 1.00 0.00 C ATOM 531 C VAL B 35 12.447 -2.221 -22.902 1.00 0.00 C ATOM 532 O VAL B 35 13.369 -1.426 -23.077 1.00 0.00 O ATOM 533 CB VAL B 35 10.377 -1.361 -24.044 1.00 0.00 C ATOM 534 CG1 VAL B 35 10.477 -0.604 -25.363 1.00 0.00 C ATOM 535 CG2 VAL B 35 8.942 -1.856 -23.879 1.00 0.00 C ATOM 0 H VAL B 35 10.209 -3.862 -23.048 1.00 0.00 H new ATOM 0 HA VAL B 35 11.956 -2.470 -24.981 1.00 0.00 H new ATOM 0 HB VAL B 35 10.591 -0.723 -23.186 1.00 0.00 H new ATOM 0 HG11 VAL B 35 9.728 0.188 -25.386 1.00 0.00 H new ATOM 0 HG12 VAL B 35 11.471 -0.166 -25.457 1.00 0.00 H new ATOM 0 HG13 VAL B 35 10.304 -1.291 -26.191 1.00 0.00 H new ATOM 0 HG21 VAL B 35 8.259 -1.007 -23.907 1.00 0.00 H new ATOM 0 HG22 VAL B 35 8.699 -2.544 -24.689 1.00 0.00 H new ATOM 0 HG23 VAL B 35 8.842 -2.371 -22.924 1.00 0.00 H new ATOM 545 N GLU B 36 12.272 -2.890 -21.759 1.00 0.00 N ATOM 546 CA GLU B 36 13.173 -2.770 -20.628 1.00 0.00 C ATOM 547 C GLU B 36 13.000 -3.973 -19.706 1.00 0.00 C ATOM 548 O GLU B 36 11.920 -4.554 -19.638 1.00 0.00 O ATOM 549 CB GLU B 36 12.863 -1.464 -19.883 1.00 0.00 C ATOM 550 CG GLU B 36 13.770 -1.277 -18.668 1.00 0.00 C ATOM 551 CD GLU B 36 13.580 0.108 -18.050 1.00 0.00 C ATOM 552 OE1 GLU B 36 14.219 1.058 -18.553 1.00 0.00 O ATOM 553 OE2 GLU B 36 12.798 0.207 -17.079 1.00 0.00 O ATOM 0 H GLU B 36 11.495 -3.531 -21.599 1.00 0.00 H new ATOM 0 HA GLU B 36 14.207 -2.747 -20.971 1.00 0.00 H new ATOM 0 HB2 GLU B 36 12.986 -0.620 -20.562 1.00 0.00 H new ATOM 0 HB3 GLU B 36 11.821 -1.467 -19.562 1.00 0.00 H new ATOM 0 HG2 GLU B 36 13.551 -2.044 -17.925 1.00 0.00 H new ATOM 0 HG3 GLU B 36 14.811 -1.408 -18.963 1.00 0.00 H new ATOM 560 N VAL B 37 14.060 -4.350 -18.990 1.00 0.00 N ATOM 561 CA VAL B 37 13.983 -5.381 -17.962 1.00 0.00 C ATOM 562 C VAL B 37 14.781 -4.950 -16.744 1.00 0.00 C ATOM 563 O VAL B 37 15.807 -4.278 -16.854 1.00 0.00 O ATOM 564 CB VAL B 37 14.433 -6.750 -18.490 1.00 0.00 C ATOM 565 CG1 VAL B 37 15.048 -7.639 -17.410 1.00 0.00 C ATOM 566 CG2 VAL B 37 13.208 -7.498 -19.016 1.00 0.00 C ATOM 0 H VAL B 37 14.991 -3.950 -19.108 1.00 0.00 H new ATOM 0 HA VAL B 37 12.941 -5.499 -17.666 1.00 0.00 H new ATOM 0 HB VAL B 37 15.183 -6.556 -19.256 1.00 0.00 H new ATOM 0 HG11 VAL B 37 15.345 -8.592 -17.849 1.00 0.00 H new ATOM 0 HG12 VAL B 37 15.923 -7.146 -16.987 1.00 0.00 H new ATOM 0 HG13 VAL B 37 14.315 -7.815 -16.623 1.00 0.00 H new ATOM 0 HG21 VAL B 37 13.512 -8.474 -19.395 1.00 0.00 H new ATOM 0 HG22 VAL B 37 12.488 -7.631 -18.208 1.00 0.00 H new ATOM 0 HG23 VAL B 37 12.749 -6.924 -19.820 1.00 0.00 H new ATOM 576 N LEU B 38 14.281 -5.356 -15.577 1.00 0.00 N ATOM 577 CA LEU B 38 14.930 -5.144 -14.292 1.00 0.00 C ATOM 578 C LEU B 38 15.215 -6.495 -13.682 1.00 0.00 C ATOM 579 O LEU B 38 14.534 -7.476 -13.968 1.00 0.00 O ATOM 580 CB LEU B 38 13.996 -4.359 -13.385 1.00 0.00 C ATOM 581 CG LEU B 38 14.322 -2.864 -13.334 1.00 0.00 C ATOM 582 CD1 LEU B 38 13.201 -2.135 -12.606 1.00 0.00 C ATOM 583 CD2 LEU B 38 15.620 -2.603 -12.577 1.00 0.00 C ATOM 0 H LEU B 38 13.393 -5.852 -15.502 1.00 0.00 H new ATOM 0 HA LEU B 38 15.858 -4.586 -14.417 1.00 0.00 H new ATOM 0 HB2 LEU B 38 12.970 -4.489 -13.730 1.00 0.00 H new ATOM 0 HB3 LEU B 38 14.048 -4.770 -12.377 1.00 0.00 H new ATOM 0 HG LEU B 38 14.429 -2.508 -14.359 1.00 0.00 H new ATOM 0 HD11 LEU B 38 13.426 -1.069 -12.566 1.00 0.00 H new ATOM 0 HD12 LEU B 38 12.262 -2.288 -13.138 1.00 0.00 H new ATOM 0 HD13 LEU B 38 13.111 -2.525 -11.592 1.00 0.00 H new ATOM 0 HD21 LEU B 38 15.822 -1.532 -12.560 1.00 0.00 H new ATOM 0 HD22 LEU B 38 15.526 -2.971 -11.555 1.00 0.00 H new ATOM 0 HD23 LEU B 38 16.441 -3.119 -13.074 1.00 0.00 H new ATOM 595 N LEU B 39 16.231 -6.537 -12.829 1.00 0.00 N ATOM 596 CA LEU B 39 16.523 -7.715 -12.058 1.00 0.00 C ATOM 597 C LEU B 39 17.233 -7.228 -10.807 1.00 0.00 C ATOM 598 O LEU B 39 18.288 -6.600 -10.898 1.00 0.00 O ATOM 599 CB LEU B 39 17.382 -8.639 -12.922 1.00 0.00 C ATOM 600 CG LEU B 39 17.865 -9.936 -12.275 1.00 0.00 C ATOM 601 CD1 LEU B 39 19.132 -9.720 -11.459 1.00 0.00 C ATOM 602 CD2 LEU B 39 16.807 -10.606 -11.405 1.00 0.00 C ATOM 0 H LEU B 39 16.865 -5.756 -12.661 1.00 0.00 H new ATOM 0 HA LEU B 39 15.643 -8.286 -11.762 1.00 0.00 H new ATOM 0 HB2 LEU B 39 16.812 -8.897 -13.814 1.00 0.00 H new ATOM 0 HB3 LEU B 39 18.256 -8.079 -13.253 1.00 0.00 H new ATOM 0 HG LEU B 39 18.081 -10.607 -13.106 1.00 0.00 H new ATOM 0 HD11 LEU B 39 19.444 -10.665 -11.015 1.00 0.00 H new ATOM 0 HD12 LEU B 39 19.923 -9.345 -12.108 1.00 0.00 H new ATOM 0 HD13 LEU B 39 18.937 -8.995 -10.669 1.00 0.00 H new ATOM 0 HD21 LEU B 39 17.215 -11.521 -10.976 1.00 0.00 H new ATOM 0 HD22 LEU B 39 16.513 -9.929 -10.603 1.00 0.00 H new ATOM 0 HD23 LEU B 39 15.935 -10.848 -12.013 1.00 0.00 H new ATOM 614 N MET B 40 16.659 -7.509 -9.638 1.00 0.00 N ATOM 615 CA MET B 40 17.184 -6.944 -8.411 1.00 0.00 C ATOM 616 C MET B 40 18.187 -7.902 -7.796 1.00 0.00 C ATOM 617 O MET B 40 17.964 -9.111 -7.810 1.00 0.00 O ATOM 618 CB MET B 40 16.056 -6.615 -7.430 1.00 0.00 C ATOM 619 CG MET B 40 14.852 -5.897 -8.054 1.00 0.00 C ATOM 620 SD MET B 40 15.138 -4.923 -9.558 1.00 0.00 S ATOM 621 CE MET B 40 16.322 -3.685 -8.978 1.00 0.00 C ATOM 0 H MET B 40 15.846 -8.114 -9.522 1.00 0.00 H new ATOM 0 HA MET B 40 17.692 -6.008 -8.643 1.00 0.00 H new ATOM 0 HB2 MET B 40 15.711 -7.541 -6.970 1.00 0.00 H new ATOM 0 HB3 MET B 40 16.458 -5.993 -6.630 1.00 0.00 H new ATOM 0 HG2 MET B 40 14.094 -6.647 -8.279 1.00 0.00 H new ATOM 0 HG3 MET B 40 14.429 -5.233 -7.300 1.00 0.00 H new ATOM 0 HE1 MET B 40 15.972 -2.690 -9.254 1.00 0.00 H new ATOM 0 HE2 MET B 40 16.414 -3.750 -7.894 1.00 0.00 H new ATOM 0 HE3 MET B 40 17.294 -3.868 -9.437 1.00 0.00 H new ATOM 631 N LYS B 41 19.289 -7.375 -7.255 1.00 0.00 N ATOM 632 CA LYS B 41 20.283 -8.195 -6.581 1.00 0.00 C ATOM 633 C LYS B 41 20.934 -7.469 -5.410 1.00 0.00 C ATOM 634 O LYS B 41 20.977 -6.241 -5.365 1.00 0.00 O ATOM 635 CB LYS B 41 21.336 -8.744 -7.554 1.00 0.00 C ATOM 636 CG LYS B 41 21.419 -7.973 -8.871 1.00 0.00 C ATOM 637 CD LYS B 41 22.632 -8.448 -9.670 1.00 0.00 C ATOM 638 CE LYS B 41 22.676 -7.721 -11.013 1.00 0.00 C ATOM 639 NZ LYS B 41 23.858 -8.132 -11.797 1.00 0.00 N ATOM 0 H LYS B 41 19.510 -6.379 -7.274 1.00 0.00 H new ATOM 0 HA LYS B 41 19.745 -9.049 -6.170 1.00 0.00 H new ATOM 0 HB2 LYS B 41 22.312 -8.723 -7.069 1.00 0.00 H new ATOM 0 HB3 LYS B 41 21.110 -9.788 -7.769 1.00 0.00 H new ATOM 0 HG2 LYS B 41 20.508 -8.124 -9.450 1.00 0.00 H new ATOM 0 HG3 LYS B 41 21.497 -6.904 -8.673 1.00 0.00 H new ATOM 0 HD2 LYS B 41 23.547 -8.255 -9.110 1.00 0.00 H new ATOM 0 HD3 LYS B 41 22.577 -9.525 -9.829 1.00 0.00 H new ATOM 0 HE2 LYS B 41 21.768 -7.936 -11.577 1.00 0.00 H new ATOM 0 HE3 LYS B 41 22.701 -6.644 -10.847 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 23.866 -7.625 -12.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 24.723 -7.905 -11.266 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 23.819 -9.156 -11.973 1.00 0.00 H new ATOM 653 N ASP B 42 21.441 -8.260 -4.465 1.00 0.00 N ATOM 654 CA ASP B 42 22.109 -7.796 -3.264 1.00 0.00 C ATOM 655 C ASP B 42 23.429 -7.094 -3.585 1.00 0.00 C ATOM 656 O ASP B 42 23.984 -7.268 -4.669 1.00 0.00 O ATOM 657 CB ASP B 42 22.327 -9.000 -2.351 1.00 0.00 C ATOM 658 CG ASP B 42 22.596 -8.566 -0.915 1.00 0.00 C ATOM 659 OD1 ASP B 42 21.604 -8.345 -0.187 1.00 0.00 O ATOM 660 OD2 ASP B 42 23.789 -8.460 -0.562 1.00 0.00 O ATOM 0 H ASP B 42 21.393 -9.277 -4.523 1.00 0.00 H new ATOM 0 HA ASP B 42 21.487 -7.055 -2.762 1.00 0.00 H new ATOM 0 HB2 ASP B 42 21.448 -9.644 -2.380 1.00 0.00 H new ATOM 0 HB3 ASP B 42 23.167 -9.590 -2.718 1.00 0.00 H new ATOM 665 N ARG B 43 23.937 -6.298 -2.638 1.00 0.00 N ATOM 666 CA ARG B 43 25.160 -5.522 -2.822 1.00 0.00 C ATOM 667 C ARG B 43 26.353 -6.141 -2.096 1.00 0.00 C ATOM 668 O ARG B 43 27.470 -5.643 -2.216 1.00 0.00 O ATOM 669 CB ARG B 43 24.918 -4.078 -2.382 1.00 0.00 C ATOM 670 CG ARG B 43 24.633 -3.985 -0.879 1.00 0.00 C ATOM 671 CD ARG B 43 24.371 -2.533 -0.481 1.00 0.00 C ATOM 672 NE ARG B 43 24.093 -2.417 0.958 1.00 0.00 N ATOM 673 CZ ARG B 43 25.032 -2.358 1.907 1.00 0.00 C ATOM 674 NH1 ARG B 43 26.326 -2.401 1.598 1.00 0.00 N ATOM 675 NH2 ARG B 43 24.678 -2.250 3.185 1.00 0.00 N ATOM 0 H ARG B 43 23.507 -6.176 -1.721 1.00 0.00 H new ATOM 0 HA ARG B 43 25.416 -5.531 -3.881 1.00 0.00 H new ATOM 0 HB2 ARG B 43 25.791 -3.472 -2.625 1.00 0.00 H new ATOM 0 HB3 ARG B 43 24.077 -3.664 -2.938 1.00 0.00 H new ATOM 0 HG2 ARG B 43 23.770 -4.601 -0.626 1.00 0.00 H new ATOM 0 HG3 ARG B 43 25.480 -4.377 -0.316 1.00 0.00 H new ATOM 0 HD2 ARG B 43 25.236 -1.921 -0.737 1.00 0.00 H new ATOM 0 HD3 ARG B 43 23.526 -2.144 -1.050 1.00 0.00 H new ATOM 0 HE ARG B 43 23.117 -2.379 1.252 1.00 0.00 H new ATOM 0 HH11 ARG B 43 26.615 -2.480 0.623 1.00 0.00 H new ATOM 0 HH12 ARG B 43 27.028 -2.355 2.336 1.00 0.00 H new ATOM 0 HH21 ARG B 43 23.691 -2.212 3.439 1.00 0.00 H new ATOM 0 HH22 ARG B 43 25.394 -2.205 3.910 1.00 0.00 H new ATOM 689 N GLU B 44 26.122 -7.223 -1.346 1.00 0.00 N ATOM 690 CA GLU B 44 27.177 -7.927 -0.628 1.00 0.00 C ATOM 691 C GLU B 44 27.374 -9.344 -1.163 1.00 0.00 C ATOM 692 O GLU B 44 28.383 -9.981 -0.855 1.00 0.00 O ATOM 693 CB GLU B 44 26.849 -7.981 0.865 1.00 0.00 C ATOM 694 CG GLU B 44 26.727 -6.581 1.468 1.00 0.00 C ATOM 695 CD GLU B 44 26.502 -6.652 2.977 1.00 0.00 C ATOM 696 OE1 GLU B 44 27.517 -6.743 3.707 1.00 0.00 O ATOM 697 OE2 GLU B 44 25.323 -6.613 3.392 1.00 0.00 O ATOM 0 H GLU B 44 25.196 -7.632 -1.223 1.00 0.00 H new ATOM 0 HA GLU B 44 28.105 -7.376 -0.781 1.00 0.00 H new ATOM 0 HB2 GLU B 44 25.915 -8.524 1.013 1.00 0.00 H new ATOM 0 HB3 GLU B 44 27.627 -8.536 1.389 1.00 0.00 H new ATOM 0 HG2 GLU B 44 27.632 -6.011 1.258 1.00 0.00 H new ATOM 0 HG3 GLU B 44 25.899 -6.050 0.998 1.00 0.00 H new ATOM 704 N THR B 45 26.424 -9.845 -1.962 1.00 0.00 N ATOM 705 CA THR B 45 26.532 -11.165 -2.580 1.00 0.00 C ATOM 706 C THR B 45 26.299 -11.093 -4.077 1.00 0.00 C ATOM 707 O THR B 45 26.617 -12.045 -4.788 1.00 0.00 O ATOM 708 CB THR B 45 25.516 -12.133 -1.984 1.00 0.00 C ATOM 709 OG1 THR B 45 24.216 -11.752 -2.369 1.00 0.00 O ATOM 710 CG2 THR B 45 25.597 -12.110 -0.471 1.00 0.00 C ATOM 0 H THR B 45 25.565 -9.347 -2.195 1.00 0.00 H new ATOM 0 HA THR B 45 27.543 -11.522 -2.384 1.00 0.00 H new ATOM 0 HB THR B 45 25.737 -13.136 -2.348 1.00 0.00 H new ATOM 0 HG1 THR B 45 23.559 -12.274 -1.863 1.00 0.00 H new ATOM 0 HG21 THR B 45 24.867 -12.805 -0.057 1.00 0.00 H new ATOM 0 HG22 THR B 45 26.598 -12.405 -0.156 1.00 0.00 H new ATOM 0 HG23 THR B 45 25.385 -11.103 -0.111 1.00 0.00 H new ATOM 718 N ASN B 46 25.746 -9.977 -4.561 1.00 0.00 N ATOM 719 CA ASN B 46 25.471 -9.804 -5.976 1.00 0.00 C ATOM 720 C ASN B 46 24.446 -10.826 -6.481 1.00 0.00 C ATOM 721 O ASN B 46 24.221 -10.941 -7.687 1.00 0.00 O ATOM 722 CB ASN B 46 26.805 -9.851 -6.724 1.00 0.00 C ATOM 723 CG ASN B 46 26.812 -9.016 -7.998 1.00 0.00 C ATOM 724 OD1 ASN B 46 25.861 -8.302 -8.300 1.00 0.00 O ATOM 725 ND2 ASN B 46 27.899 -9.098 -8.757 1.00 0.00 N ATOM 0 H ASN B 46 25.481 -9.179 -3.983 1.00 0.00 H new ATOM 0 HA ASN B 46 25.006 -8.836 -6.161 1.00 0.00 H new ATOM 0 HB2 ASN B 46 27.597 -9.499 -6.063 1.00 0.00 H new ATOM 0 HB3 ASN B 46 27.036 -10.886 -6.975 1.00 0.00 H new ATOM 0 HD21 ASN B 46 27.960 -8.558 -9.620 1.00 0.00 H new ATOM 0 HD22 ASN B 46 28.672 -9.701 -8.477 1.00 0.00 H new ATOM 732 N LYS B 47 23.821 -11.567 -5.558 1.00 0.00 N ATOM 733 CA LYS B 47 22.789 -12.543 -5.869 1.00 0.00 C ATOM 734 C LYS B 47 21.446 -11.856 -5.994 1.00 0.00 C ATOM 735 O LYS B 47 21.186 -10.855 -5.331 1.00 0.00 O ATOM 736 CB LYS B 47 22.703 -13.602 -4.770 1.00 0.00 C ATOM 737 CG LYS B 47 23.886 -14.562 -4.842 1.00 0.00 C ATOM 738 CD LYS B 47 23.746 -15.537 -6.011 1.00 0.00 C ATOM 739 CE LYS B 47 24.906 -16.527 -5.948 1.00 0.00 C ATOM 740 NZ LYS B 47 24.876 -17.446 -7.102 1.00 0.00 N ATOM 0 H LYS B 47 24.027 -11.499 -4.561 1.00 0.00 H new ATOM 0 HA LYS B 47 23.048 -13.023 -6.813 1.00 0.00 H new ATOM 0 HB2 LYS B 47 22.682 -13.117 -3.794 1.00 0.00 H new ATOM 0 HB3 LYS B 47 21.771 -14.159 -4.869 1.00 0.00 H new ATOM 0 HG2 LYS B 47 24.810 -13.994 -4.949 1.00 0.00 H new ATOM 0 HG3 LYS B 47 23.961 -15.120 -3.909 1.00 0.00 H new ATOM 0 HD2 LYS B 47 22.793 -16.064 -5.955 1.00 0.00 H new ATOM 0 HD3 LYS B 47 23.757 -14.998 -6.959 1.00 0.00 H new ATOM 0 HE2 LYS B 47 25.852 -15.985 -5.934 1.00 0.00 H new ATOM 0 HE3 LYS B 47 24.852 -17.098 -5.021 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 25.448 -18.288 -6.890 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 23.895 -17.733 -7.292 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 25.264 -16.966 -7.939 1.00 0.00 H new ATOM 754 N SER B 48 20.594 -12.407 -6.846 1.00 0.00 N ATOM 755 CA SER B 48 19.272 -11.858 -7.077 1.00 0.00 C ATOM 756 C SER B 48 18.486 -11.790 -5.772 1.00 0.00 C ATOM 757 O SER B 48 18.547 -12.706 -4.953 1.00 0.00 O ATOM 758 CB SER B 48 18.544 -12.684 -8.134 1.00 0.00 C ATOM 759 OG SER B 48 19.349 -12.728 -9.289 1.00 0.00 O ATOM 0 H SER B 48 20.801 -13.243 -7.393 1.00 0.00 H new ATOM 0 HA SER B 48 19.366 -10.839 -7.453 1.00 0.00 H new ATOM 0 HB2 SER B 48 18.354 -13.692 -7.765 1.00 0.00 H new ATOM 0 HB3 SER B 48 17.575 -12.240 -8.363 1.00 0.00 H new ATOM 0 HG SER B 48 19.574 -13.659 -9.496 1.00 0.00 H new ATOM 765 N ARG B 49 17.744 -10.695 -5.581 1.00 0.00 N ATOM 766 CA ARG B 49 16.945 -10.458 -4.383 1.00 0.00 C ATOM 767 C ARG B 49 15.715 -11.363 -4.384 1.00 0.00 C ATOM 768 O ARG B 49 14.932 -11.353 -3.435 1.00 0.00 O ATOM 769 CB ARG B 49 16.518 -8.987 -4.344 1.00 0.00 C ATOM 770 CG ARG B 49 17.708 -8.027 -4.390 1.00 0.00 C ATOM 771 CD ARG B 49 17.939 -7.274 -3.085 1.00 0.00 C ATOM 772 NE ARG B 49 16.865 -6.317 -2.808 1.00 0.00 N ATOM 773 CZ ARG B 49 16.861 -5.065 -3.270 1.00 0.00 C ATOM 774 NH1 ARG B 49 17.837 -4.620 -4.052 1.00 0.00 N ATOM 775 NH2 ARG B 49 15.872 -4.237 -2.955 1.00 0.00 N ATOM 0 H ARG B 49 17.683 -9.941 -6.265 1.00 0.00 H new ATOM 0 HA ARG B 49 17.541 -10.686 -3.499 1.00 0.00 H new ATOM 0 HB2 ARG B 49 15.858 -8.782 -5.187 1.00 0.00 H new ATOM 0 HB3 ARG B 49 15.943 -8.804 -3.436 1.00 0.00 H new ATOM 0 HG2 ARG B 49 18.608 -8.590 -4.639 1.00 0.00 H new ATOM 0 HG3 ARG B 49 17.551 -7.306 -5.192 1.00 0.00 H new ATOM 0 HD2 ARG B 49 18.011 -7.986 -2.263 1.00 0.00 H new ATOM 0 HD3 ARG B 49 18.891 -6.746 -3.134 1.00 0.00 H new ATOM 0 HE ARG B 49 16.080 -6.623 -2.233 1.00 0.00 H new ATOM 0 HH11 ARG B 49 18.607 -5.238 -4.309 1.00 0.00 H new ATOM 0 HH12 ARG B 49 17.817 -3.660 -4.396 1.00 0.00 H new ATOM 0 HH21 ARG B 49 15.110 -4.557 -2.357 1.00 0.00 H new ATOM 0 HH22 ARG B 49 15.874 -3.281 -3.311 1.00 0.00 H new ATOM 789 N GLY B 50 15.553 -12.140 -5.456 1.00 0.00 N ATOM 790 CA GLY B 50 14.437 -13.056 -5.618 1.00 0.00 C ATOM 791 C GLY B 50 13.241 -12.398 -6.298 1.00 0.00 C ATOM 792 O GLY B 50 12.207 -13.041 -6.452 1.00 0.00 O ATOM 0 H GLY B 50 16.204 -12.147 -6.242 1.00 0.00 H new ATOM 0 HA2 GLY B 50 14.758 -13.916 -6.206 1.00 0.00 H new ATOM 0 HA3 GLY B 50 14.134 -13.433 -4.641 1.00 0.00 H new ATOM 796 N PHE B 51 13.355 -11.130 -6.709 1.00 0.00 N ATOM 797 CA PHE B 51 12.284 -10.472 -7.445 1.00 0.00 C ATOM 798 C PHE B 51 12.856 -9.572 -8.536 1.00 0.00 C ATOM 799 O PHE B 51 14.014 -9.156 -8.464 1.00 0.00 O ATOM 800 CB PHE B 51 11.367 -9.711 -6.485 1.00 0.00 C ATOM 801 CG PHE B 51 11.951 -8.451 -5.895 1.00 0.00 C ATOM 802 CD1 PHE B 51 12.835 -8.514 -4.809 1.00 0.00 C ATOM 803 CD2 PHE B 51 11.591 -7.208 -6.433 1.00 0.00 C ATOM 804 CE1 PHE B 51 13.354 -7.334 -4.259 1.00 0.00 C ATOM 805 CE2 PHE B 51 12.088 -6.029 -5.866 1.00 0.00 C ATOM 806 CZ PHE B 51 12.977 -6.089 -4.789 1.00 0.00 C ATOM 0 H PHE B 51 14.175 -10.547 -6.543 1.00 0.00 H new ATOM 0 HA PHE B 51 11.676 -11.228 -7.942 1.00 0.00 H new ATOM 0 HB2 PHE B 51 10.449 -9.453 -7.014 1.00 0.00 H new ATOM 0 HB3 PHE B 51 11.088 -10.379 -5.670 1.00 0.00 H new ATOM 0 HD1 PHE B 51 13.116 -9.472 -4.396 1.00 0.00 H new ATOM 0 HD2 PHE B 51 10.930 -7.160 -7.286 1.00 0.00 H new ATOM 0 HE1 PHE B 51 14.043 -7.382 -3.429 1.00 0.00 H new ATOM 0 HE2 PHE B 51 11.784 -5.071 -6.261 1.00 0.00 H new ATOM 0 HZ PHE B 51 13.374 -5.179 -4.365 1.00 0.00 H new ATOM 816 N ALA B 52 12.042 -9.275 -9.549 1.00 0.00 N ATOM 817 CA ALA B 52 12.475 -8.507 -10.705 1.00 0.00 C ATOM 818 C ALA B 52 11.290 -7.803 -11.363 1.00 0.00 C ATOM 819 O ALA B 52 10.161 -7.914 -10.886 1.00 0.00 O ATOM 820 CB ALA B 52 13.121 -9.479 -11.687 1.00 0.00 C ATOM 0 H ALA B 52 11.064 -9.563 -9.586 1.00 0.00 H new ATOM 0 HA ALA B 52 13.185 -7.738 -10.400 1.00 0.00 H new ATOM 0 HB1 ALA B 52 13.458 -8.935 -12.569 1.00 0.00 H new ATOM 0 HB2 ALA B 52 13.974 -9.964 -11.211 1.00 0.00 H new ATOM 0 HB3 ALA B 52 12.393 -10.234 -11.983 1.00 0.00 H new ATOM 826 N PHE B 53 11.546 -7.075 -12.452 1.00 0.00 N ATOM 827 CA PHE B 53 10.510 -6.378 -13.202 1.00 0.00 C ATOM 828 C PHE B 53 10.800 -6.459 -14.697 1.00 0.00 C ATOM 829 O PHE B 53 11.925 -6.753 -15.096 1.00 0.00 O ATOM 830 CB PHE B 53 10.416 -4.914 -12.753 1.00 0.00 C ATOM 831 CG PHE B 53 10.135 -4.719 -11.287 1.00 0.00 C ATOM 832 CD1 PHE B 53 11.178 -4.863 -10.364 1.00 0.00 C ATOM 833 CD2 PHE B 53 8.849 -4.390 -10.852 1.00 0.00 C ATOM 834 CE1 PHE B 53 10.927 -4.703 -8.999 1.00 0.00 C ATOM 835 CE2 PHE B 53 8.594 -4.226 -9.483 1.00 0.00 C ATOM 836 CZ PHE B 53 9.633 -4.390 -8.558 1.00 0.00 C ATOM 0 H PHE B 53 12.483 -6.955 -12.836 1.00 0.00 H new ATOM 0 HA PHE B 53 9.552 -6.860 -13.005 1.00 0.00 H new ATOM 0 HB2 PHE B 53 11.352 -4.413 -12.999 1.00 0.00 H new ATOM 0 HB3 PHE B 53 9.631 -4.422 -13.327 1.00 0.00 H new ATOM 0 HD1 PHE B 53 12.175 -5.097 -10.707 1.00 0.00 H new ATOM 0 HD2 PHE B 53 8.052 -4.262 -11.569 1.00 0.00 H new ATOM 0 HE1 PHE B 53 11.728 -4.820 -8.284 1.00 0.00 H new ATOM 0 HE2 PHE B 53 7.600 -3.974 -9.143 1.00 0.00 H new ATOM 0 HZ PHE B 53 9.437 -4.275 -7.502 1.00 0.00 H new ATOM 846 N VAL B 54 9.795 -6.197 -15.532 1.00 0.00 N ATOM 847 CA VAL B 54 9.957 -6.209 -16.980 1.00 0.00 C ATOM 848 C VAL B 54 8.931 -5.284 -17.619 1.00 0.00 C ATOM 849 O VAL B 54 7.784 -5.251 -17.184 1.00 0.00 O ATOM 850 CB VAL B 54 9.807 -7.635 -17.526 1.00 0.00 C ATOM 851 CG1 VAL B 54 8.571 -8.329 -17.032 1.00 0.00 C ATOM 852 CG2 VAL B 54 9.809 -7.665 -19.055 1.00 0.00 C ATOM 0 H VAL B 54 8.850 -5.971 -15.222 1.00 0.00 H new ATOM 0 HA VAL B 54 10.957 -5.854 -17.227 1.00 0.00 H new ATOM 0 HB VAL B 54 10.677 -8.172 -17.148 1.00 0.00 H new ATOM 0 HG11 VAL B 54 8.524 -9.333 -17.454 1.00 0.00 H new ATOM 0 HG12 VAL B 54 8.600 -8.394 -15.944 1.00 0.00 H new ATOM 0 HG13 VAL B 54 7.690 -7.765 -17.338 1.00 0.00 H new ATOM 0 HG21 VAL B 54 9.701 -8.694 -19.399 1.00 0.00 H new ATOM 0 HG22 VAL B 54 8.979 -7.067 -19.432 1.00 0.00 H new ATOM 0 HG23 VAL B 54 10.749 -7.256 -19.426 1.00 0.00 H new ATOM 862 N THR B 55 9.344 -4.538 -18.646 1.00 0.00 N ATOM 863 CA THR B 55 8.452 -3.647 -19.375 1.00 0.00 C ATOM 864 C THR B 55 8.241 -4.163 -20.791 1.00 0.00 C ATOM 865 O THR B 55 9.196 -4.333 -21.549 1.00 0.00 O ATOM 866 CB THR B 55 8.994 -2.217 -19.392 1.00 0.00 C ATOM 867 OG1 THR B 55 9.267 -1.790 -18.076 1.00 0.00 O ATOM 868 CG2 THR B 55 7.955 -1.279 -20.001 1.00 0.00 C ATOM 0 H THR B 55 10.304 -4.538 -18.991 1.00 0.00 H new ATOM 0 HA THR B 55 7.490 -3.629 -18.863 1.00 0.00 H new ATOM 0 HB THR B 55 9.909 -2.198 -19.985 1.00 0.00 H new ATOM 0 HG1 THR B 55 9.615 -0.874 -18.095 1.00 0.00 H new ATOM 0 HG21 THR B 55 8.345 -0.261 -20.011 1.00 0.00 H new ATOM 0 HG22 THR B 55 7.735 -1.593 -21.021 1.00 0.00 H new ATOM 0 HG23 THR B 55 7.042 -1.312 -19.406 1.00 0.00 H new ATOM 876 N PHE B 56 6.978 -4.406 -21.139 1.00 0.00 N ATOM 877 CA PHE B 56 6.568 -4.829 -22.466 1.00 0.00 C ATOM 878 C PHE B 56 6.203 -3.638 -23.349 1.00 0.00 C ATOM 879 O PHE B 56 5.845 -2.573 -22.852 1.00 0.00 O ATOM 880 CB PHE B 56 5.354 -5.740 -22.325 1.00 0.00 C ATOM 881 CG PHE B 56 5.668 -7.116 -21.794 1.00 0.00 C ATOM 882 CD1 PHE B 56 6.170 -7.304 -20.496 1.00 0.00 C ATOM 883 CD2 PHE B 56 5.450 -8.217 -22.626 1.00 0.00 C ATOM 884 CE1 PHE B 56 6.446 -8.599 -20.035 1.00 0.00 C ATOM 885 CE2 PHE B 56 5.705 -9.508 -22.159 1.00 0.00 C ATOM 886 CZ PHE B 56 6.189 -9.704 -20.859 1.00 0.00 C ATOM 0 H PHE B 56 6.199 -4.310 -20.488 1.00 0.00 H new ATOM 0 HA PHE B 56 7.399 -5.352 -22.939 1.00 0.00 H new ATOM 0 HB2 PHE B 56 4.632 -5.264 -21.662 1.00 0.00 H new ATOM 0 HB3 PHE B 56 4.875 -5.840 -23.299 1.00 0.00 H new ATOM 0 HD1 PHE B 56 6.343 -6.453 -19.854 1.00 0.00 H new ATOM 0 HD2 PHE B 56 5.084 -8.069 -23.631 1.00 0.00 H new ATOM 0 HE1 PHE B 56 6.856 -8.745 -19.047 1.00 0.00 H new ATOM 0 HE2 PHE B 56 5.529 -10.358 -22.802 1.00 0.00 H new ATOM 0 HZ PHE B 56 6.364 -10.705 -20.492 1.00 0.00 H new ATOM 896 N GLU B 57 6.288 -3.819 -24.671 1.00 0.00 N ATOM 897 CA GLU B 57 5.872 -2.812 -25.625 1.00 0.00 C ATOM 898 C GLU B 57 4.346 -2.732 -25.710 1.00 0.00 C ATOM 899 O GLU B 57 3.815 -1.705 -26.135 1.00 0.00 O ATOM 900 CB GLU B 57 6.447 -3.164 -26.993 1.00 0.00 C ATOM 901 CG GLU B 57 7.877 -2.650 -27.145 1.00 0.00 C ATOM 902 CD GLU B 57 8.375 -2.703 -28.587 1.00 0.00 C ATOM 903 OE1 GLU B 57 7.528 -2.723 -29.511 1.00 0.00 O ATOM 904 OE2 GLU B 57 9.614 -2.727 -28.758 1.00 0.00 O ATOM 0 H GLU B 57 6.649 -4.671 -25.100 1.00 0.00 H new ATOM 0 HA GLU B 57 6.242 -1.840 -25.298 1.00 0.00 H new ATOM 0 HB2 GLU B 57 6.431 -4.245 -27.129 1.00 0.00 H new ATOM 0 HB3 GLU B 57 5.820 -2.735 -27.774 1.00 0.00 H new ATOM 0 HG2 GLU B 57 7.929 -1.622 -26.785 1.00 0.00 H new ATOM 0 HG3 GLU B 57 8.540 -3.242 -26.515 1.00 0.00 H new ATOM 911 N SER B 58 3.638 -3.797 -25.315 1.00 0.00 N ATOM 912 CA SER B 58 2.186 -3.768 -25.246 1.00 0.00 C ATOM 913 C SER B 58 1.745 -4.074 -23.825 1.00 0.00 C ATOM 914 O SER B 58 2.330 -4.935 -23.170 1.00 0.00 O ATOM 915 CB SER B 58 1.605 -4.760 -26.249 1.00 0.00 C ATOM 916 OG SER B 58 0.212 -4.890 -26.061 1.00 0.00 O ATOM 0 H SER B 58 4.054 -4.686 -25.040 1.00 0.00 H new ATOM 0 HA SER B 58 1.814 -2.778 -25.508 1.00 0.00 H new ATOM 0 HB2 SER B 58 1.812 -4.423 -27.265 1.00 0.00 H new ATOM 0 HB3 SER B 58 2.087 -5.731 -26.131 1.00 0.00 H new ATOM 0 HG SER B 58 -0.148 -5.528 -26.712 1.00 0.00 H new ATOM 922 N PRO B 59 0.712 -3.378 -23.334 1.00 0.00 N ATOM 923 CA PRO B 59 0.227 -3.558 -21.986 1.00 0.00 C ATOM 924 C PRO B 59 -0.549 -4.863 -21.869 1.00 0.00 C ATOM 925 O PRO B 59 -0.921 -5.243 -20.764 1.00 0.00 O ATOM 926 CB PRO B 59 -0.702 -2.374 -21.746 1.00 0.00 C ATOM 927 CG PRO B 59 -1.296 -2.160 -23.130 1.00 0.00 C ATOM 928 CD PRO B 59 -0.077 -2.378 -24.028 1.00 0.00 C ATOM 0 HA PRO B 59 1.039 -3.604 -21.261 1.00 0.00 H new ATOM 0 HB2 PRO B 59 -1.467 -2.599 -21.003 1.00 0.00 H new ATOM 0 HB3 PRO B 59 -0.162 -1.496 -21.392 1.00 0.00 H new ATOM 0 HG2 PRO B 59 -2.096 -2.869 -23.346 1.00 0.00 H new ATOM 0 HG3 PRO B 59 -1.716 -1.161 -23.245 1.00 0.00 H new ATOM 0 HD2 PRO B 59 -0.371 -2.723 -25.019 1.00 0.00 H new ATOM 0 HD3 PRO B 59 0.485 -1.454 -24.165 1.00 0.00 H new ATOM 936 N ALA B 60 -0.797 -5.541 -22.994 1.00 0.00 N ATOM 937 CA ALA B 60 -1.574 -6.770 -23.007 1.00 0.00 C ATOM 938 C ALA B 60 -0.697 -7.964 -23.365 1.00 0.00 C ATOM 939 O ALA B 60 -1.093 -9.105 -23.138 1.00 0.00 O ATOM 940 CB ALA B 60 -2.759 -6.612 -23.958 1.00 0.00 C ATOM 0 H ALA B 60 -0.464 -5.250 -23.913 1.00 0.00 H new ATOM 0 HA ALA B 60 -1.967 -6.964 -22.009 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -3.342 -7.533 -23.969 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -3.388 -5.788 -23.622 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -2.393 -6.403 -24.963 1.00 0.00 H new ATOM 946 N ASP B 61 0.494 -7.718 -23.915 1.00 0.00 N ATOM 947 CA ASP B 61 1.478 -8.773 -24.069 1.00 0.00 C ATOM 948 C ASP B 61 1.994 -9.120 -22.678 1.00 0.00 C ATOM 949 O ASP B 61 2.406 -10.249 -22.419 1.00 0.00 O ATOM 950 CB ASP B 61 2.624 -8.282 -24.948 1.00 0.00 C ATOM 951 CG ASP B 61 2.262 -8.181 -26.430 1.00 0.00 C ATOM 952 OD1 ASP B 61 1.110 -8.513 -26.784 1.00 0.00 O ATOM 953 OD2 ASP B 61 3.152 -7.765 -27.205 1.00 0.00 O ATOM 0 H ASP B 61 0.792 -6.804 -24.256 1.00 0.00 H new ATOM 0 HA ASP B 61 1.038 -9.651 -24.542 1.00 0.00 H new ATOM 0 HB2 ASP B 61 2.948 -7.303 -24.595 1.00 0.00 H new ATOM 0 HB3 ASP B 61 3.472 -8.958 -24.835 1.00 0.00 H new ATOM 958 N ALA B 62 1.963 -8.128 -21.779 1.00 0.00 N ATOM 959 CA ALA B 62 2.314 -8.318 -20.389 1.00 0.00 C ATOM 960 C ALA B 62 1.176 -9.000 -19.638 1.00 0.00 C ATOM 961 O ALA B 62 1.428 -9.744 -18.696 1.00 0.00 O ATOM 962 CB ALA B 62 2.608 -6.954 -19.776 1.00 0.00 C ATOM 0 H ALA B 62 1.691 -7.172 -22.008 1.00 0.00 H new ATOM 0 HA ALA B 62 3.194 -8.958 -20.316 1.00 0.00 H new ATOM 0 HB1 ALA B 62 2.875 -7.077 -18.726 1.00 0.00 H new ATOM 0 HB2 ALA B 62 3.436 -6.486 -20.309 1.00 0.00 H new ATOM 0 HB3 ALA B 62 1.723 -6.322 -19.854 1.00 0.00 H new ATOM 968 N LYS B 63 -0.077 -8.761 -20.047 1.00 0.00 N ATOM 969 CA LYS B 63 -1.217 -9.441 -19.444 1.00 0.00 C ATOM 970 C LYS B 63 -1.167 -10.905 -19.831 1.00 0.00 C ATOM 971 O LYS B 63 -1.470 -11.764 -19.011 1.00 0.00 O ATOM 972 CB LYS B 63 -2.535 -8.845 -19.949 1.00 0.00 C ATOM 973 CG LYS B 63 -2.764 -7.447 -19.369 1.00 0.00 C ATOM 974 CD LYS B 63 -3.983 -6.771 -19.994 1.00 0.00 C ATOM 975 CE LYS B 63 -5.233 -7.624 -19.763 1.00 0.00 C ATOM 976 NZ LYS B 63 -6.426 -6.991 -20.356 1.00 0.00 N ATOM 0 H LYS B 63 -0.320 -8.105 -20.789 1.00 0.00 H new ATOM 0 HA LYS B 63 -1.168 -9.321 -18.362 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -2.521 -8.793 -21.038 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -3.363 -9.498 -19.672 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -2.900 -7.518 -18.290 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -1.880 -6.833 -19.539 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -4.123 -5.781 -19.559 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -3.822 -6.629 -21.063 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -5.088 -8.613 -20.199 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -5.387 -7.766 -18.693 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -7.258 -7.590 -20.185 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -6.576 -6.058 -19.922 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -6.286 -6.878 -21.380 1.00 0.00 H new ATOM 990 N ASP B 64 -0.786 -11.194 -21.074 1.00 0.00 N ATOM 991 CA ASP B 64 -0.744 -12.563 -21.555 1.00 0.00 C ATOM 992 C ASP B 64 0.341 -13.341 -20.823 1.00 0.00 C ATOM 993 O ASP B 64 0.163 -14.521 -20.534 1.00 0.00 O ATOM 994 CB ASP B 64 -0.472 -12.532 -23.055 1.00 0.00 C ATOM 995 CG ASP B 64 -0.682 -13.898 -23.701 1.00 0.00 C ATOM 996 OD1 ASP B 64 -1.813 -14.418 -23.594 1.00 0.00 O ATOM 997 OD2 ASP B 64 0.292 -14.409 -24.298 1.00 0.00 O ATOM 0 H ASP B 64 -0.503 -10.495 -21.761 1.00 0.00 H new ATOM 0 HA ASP B 64 -1.694 -13.062 -21.366 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -1.129 -11.802 -23.528 1.00 0.00 H new ATOM 0 HB3 ASP B 64 0.551 -12.201 -23.231 1.00 0.00 H new ATOM 1002 N ALA B 65 1.462 -12.682 -20.517 1.00 0.00 N ATOM 1003 CA ALA B 65 2.520 -13.305 -19.745 1.00 0.00 C ATOM 1004 C ALA B 65 2.087 -13.448 -18.293 1.00 0.00 C ATOM 1005 O ALA B 65 2.298 -14.490 -17.676 1.00 0.00 O ATOM 1006 CB ALA B 65 3.789 -12.456 -19.823 1.00 0.00 C ATOM 0 H ALA B 65 1.652 -11.719 -20.795 1.00 0.00 H new ATOM 0 HA ALA B 65 2.724 -14.294 -20.156 1.00 0.00 H new ATOM 0 HB1 ALA B 65 4.580 -12.929 -19.241 1.00 0.00 H new ATOM 0 HB2 ALA B 65 4.106 -12.369 -20.862 1.00 0.00 H new ATOM 0 HB3 ALA B 65 3.588 -11.463 -19.421 1.00 0.00 H new ATOM 1012 N ALA B 66 1.471 -12.403 -17.735 1.00 0.00 N ATOM 1013 CA ALA B 66 1.043 -12.407 -16.347 1.00 0.00 C ATOM 1014 C ALA B 66 -0.151 -13.342 -16.139 1.00 0.00 C ATOM 1015 O ALA B 66 -0.564 -13.584 -15.006 1.00 0.00 O ATOM 1016 CB ALA B 66 0.722 -10.963 -15.947 1.00 0.00 C ATOM 0 H ALA B 66 1.259 -11.539 -18.234 1.00 0.00 H new ATOM 0 HA ALA B 66 1.838 -12.790 -15.707 1.00 0.00 H new ATOM 0 HB1 ALA B 66 0.397 -10.937 -14.907 1.00 0.00 H new ATOM 0 HB2 ALA B 66 1.613 -10.346 -16.064 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -0.073 -10.577 -16.585 1.00 0.00 H new ATOM 1022 N ARG B 67 -0.701 -13.868 -17.238 1.00 0.00 N ATOM 1023 CA ARG B 67 -1.759 -14.870 -17.232 1.00 0.00 C ATOM 1024 C ARG B 67 -1.242 -16.261 -17.601 1.00 0.00 C ATOM 1025 O ARG B 67 -2.048 -17.175 -17.773 1.00 0.00 O ATOM 1026 CB ARG B 67 -2.859 -14.429 -18.196 1.00 0.00 C ATOM 1027 CG ARG B 67 -3.606 -13.221 -17.625 1.00 0.00 C ATOM 1028 CD ARG B 67 -4.513 -12.571 -18.672 1.00 0.00 C ATOM 1029 NE ARG B 67 -5.560 -13.497 -19.127 1.00 0.00 N ATOM 1030 CZ ARG B 67 -6.274 -13.330 -20.241 1.00 0.00 C ATOM 1031 NH1 ARG B 67 -6.075 -12.276 -21.030 1.00 0.00 N ATOM 1032 NH2 ARG B 67 -7.201 -14.223 -20.575 1.00 0.00 N ATOM 0 H ARG B 67 -0.412 -13.598 -18.178 1.00 0.00 H new ATOM 0 HA ARG B 67 -2.156 -14.947 -16.220 1.00 0.00 H new ATOM 0 HB2 ARG B 67 -2.425 -14.174 -19.163 1.00 0.00 H new ATOM 0 HB3 ARG B 67 -3.555 -15.250 -18.365 1.00 0.00 H new ATOM 0 HG2 ARG B 67 -4.204 -13.534 -16.769 1.00 0.00 H new ATOM 0 HG3 ARG B 67 -2.887 -12.487 -17.260 1.00 0.00 H new ATOM 0 HD2 ARG B 67 -4.974 -11.677 -18.251 1.00 0.00 H new ATOM 0 HD3 ARG B 67 -3.914 -12.250 -19.524 1.00 0.00 H new ATOM 0 HE ARG B 67 -5.753 -14.319 -18.555 1.00 0.00 H new ATOM 0 HH11 ARG B 67 -5.368 -11.582 -20.786 1.00 0.00 H new ATOM 0 HH12 ARG B 67 -6.629 -12.162 -21.879 1.00 0.00 H new ATOM 0 HH21 ARG B 67 -7.365 -15.035 -19.979 1.00 0.00 H new ATOM 0 HH22 ARG B 67 -7.748 -14.096 -21.427 1.00 0.00 H new ATOM 1046 N ASP B 68 0.074 -16.446 -17.727 1.00 0.00 N ATOM 1047 CA ASP B 68 0.636 -17.718 -18.134 1.00 0.00 C ATOM 1048 C ASP B 68 1.744 -18.112 -17.179 1.00 0.00 C ATOM 1049 O ASP B 68 1.761 -19.213 -16.632 1.00 0.00 O ATOM 1050 CB ASP B 68 1.270 -17.521 -19.504 1.00 0.00 C ATOM 1051 CG ASP B 68 0.458 -18.193 -20.607 1.00 0.00 C ATOM 1052 OD1 ASP B 68 0.433 -19.443 -20.623 1.00 0.00 O ATOM 1053 OD2 ASP B 68 -0.134 -17.456 -21.430 1.00 0.00 O ATOM 0 H ASP B 68 0.768 -15.720 -17.550 1.00 0.00 H new ATOM 0 HA ASP B 68 -0.141 -18.482 -18.146 1.00 0.00 H new ATOM 0 HB2 ASP B 68 1.356 -16.455 -19.714 1.00 0.00 H new ATOM 0 HB3 ASP B 68 2.281 -17.928 -19.498 1.00 0.00 H new ATOM 1058 N MET B 69 2.666 -17.171 -17.001 1.00 0.00 N ATOM 1059 CA MET B 69 3.861 -17.308 -16.211 1.00 0.00 C ATOM 1060 C MET B 69 3.606 -17.077 -14.724 1.00 0.00 C ATOM 1061 O MET B 69 4.485 -17.334 -13.902 1.00 0.00 O ATOM 1062 CB MET B 69 4.842 -16.286 -16.769 1.00 0.00 C ATOM 1063 CG MET B 69 5.746 -16.895 -17.828 1.00 0.00 C ATOM 1064 SD MET B 69 6.754 -18.302 -17.292 1.00 0.00 S ATOM 1065 CE MET B 69 7.631 -17.461 -15.960 1.00 0.00 C ATOM 0 H MET B 69 2.585 -16.249 -17.431 1.00 0.00 H new ATOM 0 HA MET B 69 4.252 -18.323 -16.276 1.00 0.00 H new ATOM 0 HB2 MET B 69 4.291 -15.449 -17.198 1.00 0.00 H new ATOM 0 HB3 MET B 69 5.450 -15.885 -15.958 1.00 0.00 H new ATOM 0 HG2 MET B 69 5.127 -17.214 -18.667 1.00 0.00 H new ATOM 0 HG3 MET B 69 6.412 -16.117 -18.201 1.00 0.00 H new ATOM 0 HE1 MET B 69 8.661 -17.816 -15.921 1.00 0.00 H new ATOM 0 HE2 MET B 69 7.624 -16.386 -16.142 1.00 0.00 H new ATOM 0 HE3 MET B 69 7.139 -17.672 -15.011 1.00 0.00 H new ATOM 1075 N ASN B 70 2.416 -16.593 -14.363 1.00 0.00 N ATOM 1076 CA ASN B 70 2.081 -16.373 -12.966 1.00 0.00 C ATOM 1077 C ASN B 70 1.830 -17.716 -12.282 1.00 0.00 C ATOM 1078 O ASN B 70 1.003 -18.504 -12.738 1.00 0.00 O ATOM 1079 CB ASN B 70 0.862 -15.453 -12.870 1.00 0.00 C ATOM 1080 CG ASN B 70 0.522 -15.098 -11.428 1.00 0.00 C ATOM 1081 OD1 ASN B 70 1.335 -15.274 -10.524 1.00 0.00 O ATOM 1082 ND2 ASN B 70 -0.685 -14.587 -11.206 1.00 0.00 N ATOM 0 H ASN B 70 1.675 -16.349 -15.020 1.00 0.00 H new ATOM 0 HA ASN B 70 2.911 -15.886 -12.454 1.00 0.00 H new ATOM 0 HB2 ASN B 70 1.053 -14.539 -13.432 1.00 0.00 H new ATOM 0 HB3 ASN B 70 0.004 -15.939 -13.335 1.00 0.00 H new ATOM 0 HD21 ASN B 70 -0.962 -14.327 -10.260 1.00 0.00 H new ATOM 0 HD22 ASN B 70 -1.334 -14.455 -11.982 1.00 0.00 H new ATOM 1089 N GLY B 71 2.546 -17.971 -11.184 1.00 0.00 N ATOM 1090 CA GLY B 71 2.401 -19.197 -10.413 1.00 0.00 C ATOM 1091 C GLY B 71 3.282 -20.321 -10.952 1.00 0.00 C ATOM 1092 O GLY B 71 3.358 -21.387 -10.344 1.00 0.00 O ATOM 0 H GLY B 71 3.243 -17.328 -10.808 1.00 0.00 H new ATOM 0 HA2 GLY B 71 2.658 -19.003 -9.372 1.00 0.00 H new ATOM 0 HA3 GLY B 71 1.358 -19.514 -10.430 1.00 0.00 H new ATOM 1096 N LYS B 72 3.951 -20.088 -12.085 1.00 0.00 N ATOM 1097 CA LYS B 72 4.916 -20.992 -12.665 1.00 0.00 C ATOM 1098 C LYS B 72 6.252 -20.838 -11.958 1.00 0.00 C ATOM 1099 O LYS B 72 6.307 -20.434 -10.798 1.00 0.00 O ATOM 1100 CB LYS B 72 5.038 -20.651 -14.142 1.00 0.00 C ATOM 1101 CG LYS B 72 3.693 -20.665 -14.874 1.00 0.00 C ATOM 1102 CD LYS B 72 3.003 -22.020 -14.732 1.00 0.00 C ATOM 1103 CE LYS B 72 1.704 -22.031 -15.538 1.00 0.00 C ATOM 1104 NZ LYS B 72 1.012 -23.329 -15.420 1.00 0.00 N ATOM 0 H LYS B 72 3.823 -19.236 -12.631 1.00 0.00 H new ATOM 0 HA LYS B 72 4.599 -22.029 -12.551 1.00 0.00 H new ATOM 0 HB2 LYS B 72 5.491 -19.665 -14.245 1.00 0.00 H new ATOM 0 HB3 LYS B 72 5.712 -21.363 -14.619 1.00 0.00 H new ATOM 0 HG2 LYS B 72 3.049 -19.882 -14.473 1.00 0.00 H new ATOM 0 HG3 LYS B 72 3.848 -20.441 -15.929 1.00 0.00 H new ATOM 0 HD2 LYS B 72 3.664 -22.813 -15.081 1.00 0.00 H new ATOM 0 HD3 LYS B 72 2.791 -22.221 -13.682 1.00 0.00 H new ATOM 0 HE2 LYS B 72 1.049 -21.234 -15.187 1.00 0.00 H new ATOM 0 HE3 LYS B 72 1.922 -21.826 -16.586 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 0.134 -23.306 -15.977 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 1.630 -24.085 -15.777 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 0.784 -23.511 -14.422 1.00 0.00 H new ATOM 1118 N SER B 73 7.326 -21.163 -12.671 1.00 0.00 N ATOM 1119 CA SER B 73 8.663 -21.193 -12.116 1.00 0.00 C ATOM 1120 C SER B 73 9.705 -20.629 -13.062 1.00 0.00 C ATOM 1121 O SER B 73 9.514 -20.566 -14.276 1.00 0.00 O ATOM 1122 CB SER B 73 8.949 -22.649 -11.775 1.00 0.00 C ATOM 1123 OG SER B 73 10.177 -22.803 -11.104 1.00 0.00 O ATOM 0 H SER B 73 7.286 -21.414 -13.659 1.00 0.00 H new ATOM 0 HA SER B 73 8.717 -20.557 -11.232 1.00 0.00 H new ATOM 0 HB2 SER B 73 8.144 -23.040 -11.152 1.00 0.00 H new ATOM 0 HB3 SER B 73 8.960 -23.240 -12.691 1.00 0.00 H new ATOM 0 HG SER B 73 10.323 -23.751 -10.902 1.00 0.00 H new ATOM 1129 N LEU B 74 10.824 -20.220 -12.462 1.00 0.00 N ATOM 1130 CA LEU B 74 11.973 -19.694 -13.165 1.00 0.00 C ATOM 1131 C LEU B 74 13.210 -20.312 -12.554 1.00 0.00 C ATOM 1132 O LEU B 74 13.382 -20.284 -11.338 1.00 0.00 O ATOM 1133 CB LEU B 74 12.067 -18.177 -12.996 1.00 0.00 C ATOM 1134 CG LEU B 74 12.383 -17.438 -14.295 1.00 0.00 C ATOM 1135 CD1 LEU B 74 13.604 -17.972 -15.043 1.00 0.00 C ATOM 1136 CD2 LEU B 74 11.179 -17.545 -15.218 1.00 0.00 C ATOM 0 H LEU B 74 10.950 -20.250 -11.450 1.00 0.00 H new ATOM 0 HA LEU B 74 11.883 -19.927 -14.226 1.00 0.00 H new ATOM 0 HB2 LEU B 74 11.124 -17.805 -12.596 1.00 0.00 H new ATOM 0 HB3 LEU B 74 12.838 -17.948 -12.260 1.00 0.00 H new ATOM 0 HG LEU B 74 12.610 -16.409 -14.015 1.00 0.00 H new ATOM 0 HD11 LEU B 74 13.756 -17.391 -15.953 1.00 0.00 H new ATOM 0 HD12 LEU B 74 14.485 -17.889 -14.407 1.00 0.00 H new ATOM 0 HD13 LEU B 74 13.442 -19.018 -15.304 1.00 0.00 H new ATOM 0 HD21 LEU B 74 11.388 -17.022 -16.151 1.00 0.00 H new ATOM 0 HD22 LEU B 74 10.974 -18.595 -15.428 1.00 0.00 H new ATOM 0 HD23 LEU B 74 10.311 -17.095 -14.737 1.00 0.00 H new ATOM 1148 N ASP B 75 14.075 -20.867 -13.398 1.00 0.00 N ATOM 1149 CA ASP B 75 15.299 -21.481 -12.936 1.00 0.00 C ATOM 1150 C ASP B 75 15.046 -22.518 -11.846 1.00 0.00 C ATOM 1151 O ASP B 75 15.935 -22.841 -11.058 1.00 0.00 O ATOM 1152 CB ASP B 75 16.256 -20.383 -12.483 1.00 0.00 C ATOM 1153 CG ASP B 75 17.727 -20.742 -12.673 1.00 0.00 C ATOM 1154 OD1 ASP B 75 18.063 -21.944 -12.577 1.00 0.00 O ATOM 1155 OD2 ASP B 75 18.514 -19.801 -12.913 1.00 0.00 O ATOM 0 H ASP B 75 13.943 -20.900 -14.409 1.00 0.00 H new ATOM 0 HA ASP B 75 15.756 -22.033 -13.757 1.00 0.00 H new ATOM 0 HB2 ASP B 75 16.038 -19.470 -13.038 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.076 -20.167 -11.430 1.00 0.00 H new ATOM 1160 N GLY B 76 13.823 -23.044 -11.793 1.00 0.00 N ATOM 1161 CA GLY B 76 13.467 -24.082 -10.857 1.00 0.00 C ATOM 1162 C GLY B 76 12.741 -23.573 -9.611 1.00 0.00 C ATOM 1163 O GLY B 76 12.350 -24.379 -8.770 1.00 0.00 O ATOM 0 H GLY B 76 13.058 -22.755 -12.403 1.00 0.00 H new ATOM 0 HA2 GLY B 76 12.833 -24.811 -11.362 1.00 0.00 H new ATOM 0 HA3 GLY B 76 14.372 -24.606 -10.549 1.00 0.00 H new ATOM 1167 N LYS B 77 12.554 -22.253 -9.481 1.00 0.00 N ATOM 1168 CA LYS B 77 11.927 -21.652 -8.309 1.00 0.00 C ATOM 1169 C LYS B 77 10.606 -20.995 -8.687 1.00 0.00 C ATOM 1170 O LYS B 77 10.548 -20.224 -9.641 1.00 0.00 O ATOM 1171 CB LYS B 77 12.886 -20.664 -7.643 1.00 0.00 C ATOM 1172 CG LYS B 77 14.262 -21.296 -7.413 1.00 0.00 C ATOM 1173 CD LYS B 77 14.190 -22.547 -6.535 1.00 0.00 C ATOM 1174 CE LYS B 77 15.526 -23.283 -6.613 1.00 0.00 C ATOM 1175 NZ LYS B 77 15.544 -24.451 -5.709 1.00 0.00 N ATOM 0 H LYS B 77 12.836 -21.576 -10.190 1.00 0.00 H new ATOM 0 HA LYS B 77 11.704 -22.435 -7.584 1.00 0.00 H new ATOM 0 HB2 LYS B 77 12.990 -19.777 -8.268 1.00 0.00 H new ATOM 0 HB3 LYS B 77 12.470 -20.336 -6.691 1.00 0.00 H new ATOM 0 HG2 LYS B 77 14.705 -21.555 -8.375 1.00 0.00 H new ATOM 0 HG3 LYS B 77 14.921 -20.565 -6.945 1.00 0.00 H new ATOM 0 HD2 LYS B 77 13.971 -22.272 -5.503 1.00 0.00 H new ATOM 0 HD3 LYS B 77 13.381 -23.197 -6.870 1.00 0.00 H new ATOM 0 HE2 LYS B 77 15.705 -23.609 -7.637 1.00 0.00 H new ATOM 0 HE3 LYS B 77 16.335 -22.602 -6.349 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 16.463 -24.932 -5.782 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 15.396 -24.134 -4.730 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 14.786 -25.110 -5.978 1.00 0.00 H new ATOM 1189 N ALA B 78 9.548 -21.305 -7.936 1.00 0.00 N ATOM 1190 CA ALA B 78 8.204 -20.850 -8.263 1.00 0.00 C ATOM 1191 C ALA B 78 8.052 -19.344 -8.040 1.00 0.00 C ATOM 1192 O ALA B 78 8.541 -18.805 -7.048 1.00 0.00 O ATOM 1193 CB ALA B 78 7.178 -21.638 -7.454 1.00 0.00 C ATOM 0 H ALA B 78 9.602 -21.874 -7.091 1.00 0.00 H new ATOM 0 HA ALA B 78 8.026 -21.033 -9.323 1.00 0.00 H new ATOM 0 HB1 ALA B 78 6.175 -21.292 -7.704 1.00 0.00 H new ATOM 0 HB2 ALA B 78 7.266 -22.699 -7.690 1.00 0.00 H new ATOM 0 HB3 ALA B 78 7.360 -21.487 -6.390 1.00 0.00 H new ATOM 1199 N ILE B 79 7.370 -18.672 -8.973 1.00 0.00 N ATOM 1200 CA ILE B 79 7.238 -17.221 -8.977 1.00 0.00 C ATOM 1201 C ILE B 79 5.800 -16.717 -8.938 1.00 0.00 C ATOM 1202 O ILE B 79 4.836 -17.482 -8.939 1.00 0.00 O ATOM 1203 CB ILE B 79 7.927 -16.644 -10.218 1.00 0.00 C ATOM 1204 CG1 ILE B 79 7.106 -16.912 -11.486 1.00 0.00 C ATOM 1205 CG2 ILE B 79 9.333 -17.218 -10.369 1.00 0.00 C ATOM 1206 CD1 ILE B 79 7.679 -16.157 -12.682 1.00 0.00 C ATOM 0 H ILE B 79 6.892 -19.128 -9.750 1.00 0.00 H new ATOM 0 HA ILE B 79 7.713 -16.881 -8.057 1.00 0.00 H new ATOM 0 HB ILE B 79 8.001 -15.565 -10.084 1.00 0.00 H new ATOM 0 HG12 ILE B 79 7.097 -17.981 -11.698 1.00 0.00 H new ATOM 0 HG13 ILE B 79 6.071 -16.610 -11.323 1.00 0.00 H new ATOM 0 HG21 ILE B 79 9.805 -16.796 -11.256 1.00 0.00 H new ATOM 0 HG22 ILE B 79 9.925 -16.967 -9.489 1.00 0.00 H new ATOM 0 HG23 ILE B 79 9.275 -18.302 -10.470 1.00 0.00 H new ATOM 0 HD11 ILE B 79 7.077 -16.366 -13.566 1.00 0.00 H new ATOM 0 HD12 ILE B 79 7.664 -15.086 -12.478 1.00 0.00 H new ATOM 0 HD13 ILE B 79 8.706 -16.479 -12.858 1.00 0.00 H new ATOM 1218 N LYS B 80 5.707 -15.385 -8.908 1.00 0.00 N ATOM 1219 CA LYS B 80 4.499 -14.598 -9.046 1.00 0.00 C ATOM 1220 C LYS B 80 4.706 -13.652 -10.222 1.00 0.00 C ATOM 1221 O LYS B 80 5.806 -13.129 -10.391 1.00 0.00 O ATOM 1222 CB LYS B 80 4.286 -13.774 -7.772 1.00 0.00 C ATOM 1223 CG LYS B 80 2.975 -12.984 -7.841 1.00 0.00 C ATOM 1224 CD LYS B 80 2.910 -11.954 -6.714 1.00 0.00 C ATOM 1225 CE LYS B 80 1.630 -11.129 -6.853 1.00 0.00 C ATOM 1226 NZ LYS B 80 1.561 -10.060 -5.836 1.00 0.00 N ATOM 0 H LYS B 80 6.532 -14.799 -8.778 1.00 0.00 H new ATOM 0 HA LYS B 80 3.633 -15.240 -9.207 1.00 0.00 H new ATOM 0 HB2 LYS B 80 4.271 -14.435 -6.905 1.00 0.00 H new ATOM 0 HB3 LYS B 80 5.121 -13.088 -7.635 1.00 0.00 H new ATOM 0 HG2 LYS B 80 2.897 -12.482 -8.805 1.00 0.00 H new ATOM 0 HG3 LYS B 80 2.128 -13.666 -7.767 1.00 0.00 H new ATOM 0 HD2 LYS B 80 2.929 -12.456 -5.746 1.00 0.00 H new ATOM 0 HD3 LYS B 80 3.782 -11.301 -6.752 1.00 0.00 H new ATOM 0 HE2 LYS B 80 1.586 -10.688 -7.849 1.00 0.00 H new ATOM 0 HE3 LYS B 80 0.763 -11.782 -6.755 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 1.163 -9.199 -6.263 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 0.955 -10.368 -5.049 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 2.517 -9.859 -5.478 1.00 0.00 H new ATOM 1240 N VAL B 81 3.666 -13.427 -11.024 1.00 0.00 N ATOM 1241 CA VAL B 81 3.720 -12.427 -12.082 1.00 0.00 C ATOM 1242 C VAL B 81 2.466 -11.574 -12.004 1.00 0.00 C ATOM 1243 O VAL B 81 1.357 -12.102 -11.938 1.00 0.00 O ATOM 1244 CB VAL B 81 3.897 -13.074 -13.457 1.00 0.00 C ATOM 1245 CG1 VAL B 81 4.045 -11.993 -14.526 1.00 0.00 C ATOM 1246 CG2 VAL B 81 5.152 -13.942 -13.473 1.00 0.00 C ATOM 0 H VAL B 81 2.778 -13.925 -10.959 1.00 0.00 H new ATOM 0 HA VAL B 81 4.592 -11.788 -11.941 1.00 0.00 H new ATOM 0 HB VAL B 81 3.020 -13.687 -13.663 1.00 0.00 H new ATOM 0 HG11 VAL B 81 4.171 -12.461 -15.502 1.00 0.00 H new ATOM 0 HG12 VAL B 81 3.153 -11.367 -14.536 1.00 0.00 H new ATOM 0 HG13 VAL B 81 4.917 -11.378 -14.304 1.00 0.00 H new ATOM 0 HG21 VAL B 81 5.267 -14.397 -14.457 1.00 0.00 H new ATOM 0 HG22 VAL B 81 6.024 -13.325 -13.254 1.00 0.00 H new ATOM 0 HG23 VAL B 81 5.063 -14.725 -12.719 1.00 0.00 H new ATOM 1256 N GLU B 82 2.641 -10.253 -12.012 1.00 0.00 N ATOM 1257 CA GLU B 82 1.541 -9.325 -11.803 1.00 0.00 C ATOM 1258 C GLU B 82 1.925 -7.964 -12.368 1.00 0.00 C ATOM 1259 O GLU B 82 3.101 -7.716 -12.619 1.00 0.00 O ATOM 1260 CB GLU B 82 1.275 -9.234 -10.294 1.00 0.00 C ATOM 1261 CG GLU B 82 -0.007 -8.469 -9.977 1.00 0.00 C ATOM 1262 CD GLU B 82 -0.366 -8.601 -8.499 1.00 0.00 C ATOM 1263 OE1 GLU B 82 0.452 -8.168 -7.657 1.00 0.00 O ATOM 1264 OE2 GLU B 82 -1.463 -9.135 -8.214 1.00 0.00 O ATOM 0 H GLU B 82 3.544 -9.803 -12.163 1.00 0.00 H new ATOM 0 HA GLU B 82 0.638 -9.665 -12.309 1.00 0.00 H new ATOM 0 HB2 GLU B 82 1.208 -10.239 -9.878 1.00 0.00 H new ATOM 0 HB3 GLU B 82 2.118 -8.743 -9.808 1.00 0.00 H new ATOM 0 HG2 GLU B 82 0.119 -7.417 -10.233 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -0.824 -8.850 -10.590 1.00 0.00 H new ATOM 1271 N GLN B 83 0.960 -7.066 -12.571 1.00 0.00 N ATOM 1272 CA GLN B 83 1.283 -5.715 -12.995 1.00 0.00 C ATOM 1273 C GLN B 83 1.970 -5.015 -11.815 1.00 0.00 C ATOM 1274 O GLN B 83 1.491 -5.083 -10.683 1.00 0.00 O ATOM 1275 CB GLN B 83 0.007 -5.026 -13.482 1.00 0.00 C ATOM 1276 CG GLN B 83 0.297 -3.744 -14.257 1.00 0.00 C ATOM 1277 CD GLN B 83 0.704 -2.602 -13.346 1.00 0.00 C ATOM 1278 OE1 GLN B 83 0.248 -2.508 -12.206 1.00 0.00 O ATOM 1279 NE2 GLN B 83 1.567 -1.722 -13.838 1.00 0.00 N ATOM 0 H GLN B 83 -0.036 -7.251 -12.449 1.00 0.00 H new ATOM 0 HA GLN B 83 1.974 -5.688 -13.838 1.00 0.00 H new ATOM 0 HB2 GLN B 83 -0.553 -5.712 -14.117 1.00 0.00 H new ATOM 0 HB3 GLN B 83 -0.627 -4.794 -12.626 1.00 0.00 H new ATOM 0 HG2 GLN B 83 1.091 -3.930 -14.980 1.00 0.00 H new ATOM 0 HG3 GLN B 83 -0.588 -3.456 -14.824 1.00 0.00 H new ATOM 0 HE21 GLN B 83 1.923 -1.833 -14.787 1.00 0.00 H new ATOM 0 HE22 GLN B 83 1.874 -0.935 -13.267 1.00 0.00 H new ATOM 1288 N ALA B 84 3.096 -4.348 -12.075 1.00 0.00 N ATOM 1289 CA ALA B 84 3.943 -3.824 -11.013 1.00 0.00 C ATOM 1290 C ALA B 84 3.410 -2.526 -10.413 1.00 0.00 C ATOM 1291 O ALA B 84 2.788 -1.719 -11.101 1.00 0.00 O ATOM 1292 CB ALA B 84 5.348 -3.598 -11.553 1.00 0.00 C ATOM 0 H ALA B 84 3.440 -4.160 -13.017 1.00 0.00 H new ATOM 0 HA ALA B 84 3.952 -4.564 -10.213 1.00 0.00 H new ATOM 0 HB1 ALA B 84 5.984 -3.206 -10.760 1.00 0.00 H new ATOM 0 HB2 ALA B 84 5.756 -4.543 -11.912 1.00 0.00 H new ATOM 0 HB3 ALA B 84 5.311 -2.883 -12.375 1.00 0.00 H new ATOM 1298 N THR B 85 3.671 -2.330 -9.115 1.00 0.00 N ATOM 1299 CA THR B 85 3.305 -1.097 -8.436 1.00 0.00 C ATOM 1300 C THR B 85 4.546 -0.319 -8.043 1.00 0.00 C ATOM 1301 O THR B 85 5.660 -0.839 -8.094 1.00 0.00 O ATOM 1302 CB THR B 85 2.442 -1.358 -7.202 1.00 0.00 C ATOM 1303 OG1 THR B 85 3.158 -2.102 -6.241 1.00 0.00 O ATOM 1304 CG2 THR B 85 1.165 -2.112 -7.564 1.00 0.00 C ATOM 0 H THR B 85 4.135 -3.015 -8.519 1.00 0.00 H new ATOM 0 HA THR B 85 2.715 -0.506 -9.137 1.00 0.00 H new ATOM 0 HB THR B 85 2.173 -0.387 -6.787 1.00 0.00 H new ATOM 0 HG1 THR B 85 2.590 -2.258 -5.458 1.00 0.00 H new ATOM 0 HG21 THR B 85 0.575 -2.281 -6.663 1.00 0.00 H new ATOM 0 HG22 THR B 85 0.584 -1.523 -8.274 1.00 0.00 H new ATOM 0 HG23 THR B 85 1.424 -3.071 -8.014 1.00 0.00 H new ATOM 1312 N LYS B 86 4.351 0.940 -7.649 1.00 0.00 N ATOM 1313 CA LYS B 86 5.435 1.828 -7.263 1.00 0.00 C ATOM 1314 C LYS B 86 6.226 1.250 -6.087 1.00 0.00 C ATOM 1315 O LYS B 86 5.660 0.535 -5.257 1.00 0.00 O ATOM 1316 CB LYS B 86 4.847 3.190 -6.909 1.00 0.00 C ATOM 1317 CG LYS B 86 4.167 3.799 -8.133 1.00 0.00 C ATOM 1318 CD LYS B 86 3.770 5.248 -7.863 1.00 0.00 C ATOM 1319 CE LYS B 86 2.752 5.689 -8.912 1.00 0.00 C ATOM 1320 NZ LYS B 86 2.451 7.126 -8.785 1.00 0.00 N ATOM 0 H LYS B 86 3.428 1.370 -7.590 1.00 0.00 H new ATOM 0 HA LYS B 86 6.131 1.936 -8.095 1.00 0.00 H new ATOM 0 HB2 LYS B 86 4.127 3.085 -6.097 1.00 0.00 H new ATOM 0 HB3 LYS B 86 5.635 3.854 -6.552 1.00 0.00 H new ATOM 0 HG2 LYS B 86 4.840 3.754 -8.989 1.00 0.00 H new ATOM 0 HG3 LYS B 86 3.283 3.216 -8.392 1.00 0.00 H new ATOM 0 HD2 LYS B 86 3.345 5.342 -6.864 1.00 0.00 H new ATOM 0 HD3 LYS B 86 4.649 5.892 -7.898 1.00 0.00 H new ATOM 0 HE2 LYS B 86 3.140 5.482 -9.910 1.00 0.00 H new ATOM 0 HE3 LYS B 86 1.835 5.110 -8.800 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 1.732 7.393 -9.487 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 2.092 7.322 -7.829 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 3.317 7.678 -8.949 1.00 0.00 H new ATOM 1334 N PRO B 87 7.529 1.550 -6.003 1.00 0.00 N ATOM 1335 CA PRO B 87 8.405 1.052 -4.957 1.00 0.00 C ATOM 1336 C PRO B 87 8.039 1.679 -3.615 1.00 0.00 C ATOM 1337 O PRO B 87 7.429 2.748 -3.557 1.00 0.00 O ATOM 1338 CB PRO B 87 9.820 1.437 -5.398 1.00 0.00 C ATOM 1339 CG PRO B 87 9.585 2.706 -6.213 1.00 0.00 C ATOM 1340 CD PRO B 87 8.264 2.405 -6.918 1.00 0.00 C ATOM 0 HA PRO B 87 8.318 -0.026 -4.819 1.00 0.00 H new ATOM 0 HB2 PRO B 87 10.474 1.619 -4.545 1.00 0.00 H new ATOM 0 HB3 PRO B 87 10.285 0.653 -5.995 1.00 0.00 H new ATOM 0 HG2 PRO B 87 9.514 3.589 -5.578 1.00 0.00 H new ATOM 0 HG3 PRO B 87 10.392 2.888 -6.923 1.00 0.00 H new ATOM 0 HD2 PRO B 87 7.713 3.321 -7.129 1.00 0.00 H new ATOM 0 HD3 PRO B 87 8.432 1.907 -7.873 1.00 0.00 H new ATOM 1348 N SER B 88 8.417 1.008 -2.526 1.00 0.00 N ATOM 1349 CA SER B 88 8.068 1.407 -1.170 1.00 0.00 C ATOM 1350 C SER B 88 8.835 2.655 -0.733 1.00 0.00 C ATOM 1351 O SER B 88 8.521 3.246 0.303 1.00 0.00 O ATOM 1352 CB SER B 88 8.348 0.222 -0.238 1.00 0.00 C ATOM 1353 OG SER B 88 7.856 0.486 1.055 1.00 0.00 O ATOM 0 H SER B 88 8.983 0.160 -2.566 1.00 0.00 H new ATOM 0 HA SER B 88 7.011 1.671 -1.127 1.00 0.00 H new ATOM 0 HB2 SER B 88 7.880 -0.679 -0.635 1.00 0.00 H new ATOM 0 HB3 SER B 88 9.420 0.032 -0.194 1.00 0.00 H new ATOM 0 HG SER B 88 7.835 1.454 1.206 1.00 0.00 H new ATOM 1359 N PHE B 89 9.843 3.071 -1.511 1.00 0.00 N ATOM 1360 CA PHE B 89 10.607 4.276 -1.222 1.00 0.00 C ATOM 1361 C PHE B 89 10.253 5.406 -2.194 1.00 0.00 C ATOM 1362 O PHE B 89 10.894 6.453 -2.172 1.00 0.00 O ATOM 1363 CB PHE B 89 12.104 3.960 -1.206 1.00 0.00 C ATOM 1364 CG PHE B 89 12.695 3.709 -2.575 1.00 0.00 C ATOM 1365 CD1 PHE B 89 13.140 4.794 -3.342 1.00 0.00 C ATOM 1366 CD2 PHE B 89 12.801 2.407 -3.079 1.00 0.00 C ATOM 1367 CE1 PHE B 89 13.673 4.584 -4.620 1.00 0.00 C ATOM 1368 CE2 PHE B 89 13.350 2.194 -4.351 1.00 0.00 C ATOM 1369 CZ PHE B 89 13.779 3.279 -5.125 1.00 0.00 C ATOM 0 H PHE B 89 10.145 2.580 -2.352 1.00 0.00 H new ATOM 0 HA PHE B 89 10.338 4.634 -0.228 1.00 0.00 H new ATOM 0 HB2 PHE B 89 12.635 4.790 -0.739 1.00 0.00 H new ATOM 0 HB3 PHE B 89 12.273 3.082 -0.582 1.00 0.00 H new ATOM 0 HD1 PHE B 89 13.072 5.796 -2.946 1.00 0.00 H new ATOM 0 HD2 PHE B 89 12.461 1.569 -2.489 1.00 0.00 H new ATOM 0 HE1 PHE B 89 14.001 5.424 -5.215 1.00 0.00 H new ATOM 0 HE2 PHE B 89 13.442 1.189 -4.736 1.00 0.00 H new ATOM 0 HZ PHE B 89 14.191 3.112 -6.109 1.00 0.00 H new ATOM 1379 N GLU B 90 9.236 5.179 -3.037 1.00 0.00 N ATOM 1380 CA GLU B 90 8.736 6.110 -4.047 1.00 0.00 C ATOM 1381 C GLU B 90 9.830 6.707 -4.933 1.00 0.00 C ATOM 1382 O GLU B 90 10.978 6.266 -4.916 1.00 0.00 O ATOM 1383 CB GLU B 90 7.840 7.178 -3.402 1.00 0.00 C ATOM 1384 CG GLU B 90 8.625 8.164 -2.535 1.00 0.00 C ATOM 1385 CD GLU B 90 7.752 9.352 -2.136 1.00 0.00 C ATOM 1386 OE1 GLU B 90 6.983 9.203 -1.158 1.00 0.00 O ATOM 1387 OE2 GLU B 90 7.861 10.401 -2.811 1.00 0.00 O ATOM 0 H GLU B 90 8.719 4.300 -3.029 1.00 0.00 H new ATOM 0 HA GLU B 90 8.122 5.529 -4.735 1.00 0.00 H new ATOM 0 HB2 GLU B 90 7.315 7.727 -4.184 1.00 0.00 H new ATOM 0 HB3 GLU B 90 7.081 6.689 -2.792 1.00 0.00 H new ATOM 0 HG2 GLU B 90 8.989 7.658 -1.641 1.00 0.00 H new ATOM 0 HG3 GLU B 90 9.500 8.517 -3.080 1.00 0.00 H new ATOM 1394 N SER B 91 9.465 7.721 -5.719 1.00 0.00 N ATOM 1395 CA SER B 91 10.378 8.350 -6.655 1.00 0.00 C ATOM 1396 C SER B 91 10.046 9.829 -6.822 1.00 0.00 C ATOM 1397 O SER B 91 8.884 10.220 -6.728 1.00 0.00 O ATOM 1398 CB SER B 91 10.270 7.627 -7.997 1.00 0.00 C ATOM 1399 OG SER B 91 11.190 8.184 -8.911 1.00 0.00 O ATOM 0 H SER B 91 8.528 8.124 -5.719 1.00 0.00 H new ATOM 0 HA SER B 91 11.397 8.280 -6.275 1.00 0.00 H new ATOM 0 HB2 SER B 91 10.471 6.564 -7.866 1.00 0.00 H new ATOM 0 HB3 SER B 91 9.256 7.714 -8.388 1.00 0.00 H new ATOM 0 HG SER B 91 11.120 7.718 -9.770 1.00 0.00 H new ATOM 1405 N GLY B 92 11.066 10.653 -7.071 1.00 0.00 N ATOM 1406 CA GLY B 92 10.886 12.086 -7.255 1.00 0.00 C ATOM 1407 C GLY B 92 10.377 12.428 -8.651 1.00 0.00 C ATOM 1408 O GLY B 92 10.110 13.593 -8.941 1.00 0.00 O ATOM 0 H GLY B 92 12.034 10.343 -7.150 1.00 0.00 H new ATOM 0 HA2 GLY B 92 10.182 12.460 -6.512 1.00 0.00 H new ATOM 0 HA3 GLY B 92 11.834 12.595 -7.081 1.00 0.00 H new ATOM 1412 N ARG B 93 10.245 11.418 -9.519 1.00 0.00 N ATOM 1413 CA ARG B 93 9.817 11.603 -10.899 1.00 0.00 C ATOM 1414 C ARG B 93 8.365 11.185 -11.110 1.00 0.00 C ATOM 1415 O ARG B 93 7.689 11.744 -11.972 1.00 0.00 O ATOM 1416 CB ARG B 93 10.750 10.779 -11.789 1.00 0.00 C ATOM 1417 CG ARG B 93 10.462 10.993 -13.278 1.00 0.00 C ATOM 1418 CD ARG B 93 11.253 9.987 -14.112 1.00 0.00 C ATOM 1419 NE ARG B 93 12.700 10.164 -13.948 1.00 0.00 N ATOM 1420 CZ ARG B 93 13.432 11.075 -14.595 1.00 0.00 C ATOM 1421 NH1 ARG B 93 12.873 11.907 -15.471 1.00 0.00 N ATOM 1422 NH2 ARG B 93 14.741 11.157 -14.367 1.00 0.00 N ATOM 0 H ARG B 93 10.435 10.446 -9.276 1.00 0.00 H new ATOM 0 HA ARG B 93 9.871 12.661 -11.155 1.00 0.00 H new ATOM 0 HB2 ARG B 93 11.785 11.049 -11.578 1.00 0.00 H new ATOM 0 HB3 ARG B 93 10.641 9.722 -11.547 1.00 0.00 H new ATOM 0 HG2 ARG B 93 9.395 10.879 -13.471 1.00 0.00 H new ATOM 0 HG3 ARG B 93 10.731 12.009 -13.567 1.00 0.00 H new ATOM 0 HD2 ARG B 93 10.975 8.974 -13.820 1.00 0.00 H new ATOM 0 HD3 ARG B 93 10.990 10.099 -15.164 1.00 0.00 H new ATOM 0 HE ARG B 93 13.181 9.548 -13.293 1.00 0.00 H new ATOM 0 HH11 ARG B 93 11.871 11.855 -15.657 1.00 0.00 H new ATOM 0 HH12 ARG B 93 13.446 12.597 -15.957 1.00 0.00 H new ATOM 0 HH21 ARG B 93 15.183 10.525 -13.699 1.00 0.00 H new ATOM 0 HH22 ARG B 93 15.302 11.852 -14.860 1.00 0.00 H new ATOM 1436 N ARG B 94 7.879 10.207 -10.335 1.00 0.00 N ATOM 1437 CA ARG B 94 6.557 9.624 -10.540 1.00 0.00 C ATOM 1438 C ARG B 94 5.835 9.314 -9.227 1.00 0.00 C ATOM 1439 O ARG B 94 4.816 8.627 -9.242 1.00 0.00 O ATOM 1440 CB ARG B 94 6.687 8.354 -11.389 1.00 0.00 C ATOM 1441 CG ARG B 94 7.196 8.641 -12.802 1.00 0.00 C ATOM 1442 CD ARG B 94 7.155 7.346 -13.613 1.00 0.00 C ATOM 1443 NE ARG B 94 7.666 7.545 -14.973 1.00 0.00 N ATOM 1444 CZ ARG B 94 7.621 6.608 -15.925 1.00 0.00 C ATOM 1445 NH1 ARG B 94 7.080 5.417 -15.681 1.00 0.00 N ATOM 1446 NH2 ARG B 94 8.119 6.866 -17.132 1.00 0.00 N ATOM 0 H ARG B 94 8.393 9.802 -9.552 1.00 0.00 H new ATOM 0 HA ARG B 94 5.949 10.364 -11.061 1.00 0.00 H new ATOM 0 HB2 ARG B 94 7.367 7.660 -10.896 1.00 0.00 H new ATOM 0 HB3 ARG B 94 5.717 7.861 -11.449 1.00 0.00 H new ATOM 0 HG2 ARG B 94 6.579 9.404 -13.278 1.00 0.00 H new ATOM 0 HG3 ARG B 94 8.213 9.031 -12.765 1.00 0.00 H new ATOM 0 HD2 ARG B 94 7.747 6.582 -13.109 1.00 0.00 H new ATOM 0 HD3 ARG B 94 6.130 6.977 -13.659 1.00 0.00 H new ATOM 0 HE ARG B 94 8.079 8.448 -15.205 1.00 0.00 H new ATOM 0 HH11 ARG B 94 6.694 5.211 -14.760 1.00 0.00 H new ATOM 0 HH12 ARG B 94 7.051 4.710 -16.415 1.00 0.00 H new ATOM 0 HH21 ARG B 94 8.534 7.777 -17.329 1.00 0.00 H new ATOM 0 HH22 ARG B 94 8.086 6.153 -17.860 1.00 0.00 H new ATOM 1460 N GLY B 95 6.347 9.807 -8.097 1.00 0.00 N ATOM 1461 CA GLY B 95 5.742 9.572 -6.791 1.00 0.00 C ATOM 1462 C GLY B 95 4.364 10.218 -6.702 1.00 0.00 C ATOM 1463 O GLY B 95 4.313 11.467 -6.744 1.00 0.00 O ATOM 1464 OXT GLY B 95 3.379 9.457 -6.592 1.00 0.00 O ATOM 0 H GLY B 95 7.191 10.379 -8.065 1.00 0.00 H new ATOM 0 HA2 GLY B 95 5.657 8.500 -6.613 1.00 0.00 H new ATOM 0 HA3 GLY B 95 6.387 9.974 -6.010 1.00 0.00 H new TER 1468 GLY B 95 ATOM 1469 O5' A A 96 7.400 -11.392 3.531 1.00 0.00 O ATOM 1470 C5' A A 96 6.090 -11.099 3.974 1.00 0.00 C ATOM 1471 C4' A A 96 5.579 -12.224 4.877 1.00 0.00 C ATOM 1472 O4' A A 96 6.420 -12.340 6.021 1.00 0.00 O ATOM 1473 C3' A A 96 4.185 -11.857 5.395 1.00 0.00 C ATOM 1474 O3' A A 96 3.165 -12.771 5.036 1.00 0.00 O ATOM 1475 C2' A A 96 4.340 -11.909 6.914 1.00 0.00 C ATOM 1476 O2' A A 96 4.025 -13.194 7.423 1.00 0.00 O ATOM 1477 C1' A A 96 5.826 -11.665 7.120 1.00 0.00 C ATOM 1478 N9 A A 96 6.181 -10.223 7.121 1.00 0.00 N ATOM 1479 C8 A A 96 7.239 -9.616 6.493 1.00 0.00 C ATOM 1480 N7 A A 96 7.323 -8.331 6.688 1.00 0.00 N ATOM 1481 C5 A A 96 6.231 -8.054 7.508 1.00 0.00 C ATOM 1482 C6 A A 96 5.736 -6.866 8.082 1.00 0.00 C ATOM 1483 N6 A A 96 6.304 -5.669 7.911 1.00 0.00 N ATOM 1484 N1 A A 96 4.638 -6.935 8.845 1.00 0.00 N ATOM 1485 C2 A A 96 4.062 -8.112 9.034 1.00 0.00 C ATOM 1486 N3 A A 96 4.426 -9.296 8.562 1.00 0.00 N ATOM 1487 C4 A A 96 5.532 -9.200 7.784 1.00 0.00 C ATOM 0 H5' A A 96 5.426 -10.979 3.118 1.00 0.00 H new ATOM 0 H5'' A A 96 6.084 -10.154 4.517 1.00 0.00 H new ATOM 0 H4' A A 96 5.564 -13.152 4.305 1.00 0.00 H new ATOM 0 H3' A A 96 3.881 -10.898 4.975 1.00 0.00 H new ATOM 0 H2' A A 96 3.685 -11.196 7.414 1.00 0.00 H new ATOM 0 HO2' A A 96 3.563 -13.715 6.733 1.00 0.00 H new ATOM 0 HO5' A A 96 7.824 -12.017 4.155 1.00 0.00 H new ATOM 0 H1' A A 96 6.168 -12.023 8.091 1.00 0.00 H new ATOM 0 H8 A A 96 7.946 -10.161 5.885 1.00 0.00 H new ATOM 0 H61 A A 96 5.898 -4.844 8.353 1.00 0.00 H new ATOM 0 H62 A A 96 7.143 -5.580 7.338 1.00 0.00 H new ATOM 0 H2 A A 96 3.178 -8.107 9.655 1.00 0.00 H new ATOM 1500 P U A 97 2.580 -12.781 3.538 1.00 0.00 P ATOM 1501 OP1 U A 97 1.315 -13.553 3.545 1.00 0.00 O ATOM 1502 OP2 U A 97 3.669 -13.166 2.612 1.00 0.00 O ATOM 1503 O5' U A 97 2.237 -11.226 3.306 1.00 0.00 O ATOM 1504 C5' U A 97 1.266 -10.567 4.091 1.00 0.00 C ATOM 1505 C4' U A 97 1.216 -9.087 3.703 1.00 0.00 C ATOM 1506 O4' U A 97 0.129 -8.423 4.323 1.00 0.00 O ATOM 1507 C3' U A 97 2.495 -8.335 4.082 1.00 0.00 C ATOM 1508 O3' U A 97 2.977 -7.606 2.970 1.00 0.00 O ATOM 1509 C2' U A 97 2.060 -7.403 5.219 1.00 0.00 C ATOM 1510 O2' U A 97 2.076 -6.046 4.817 1.00 0.00 O ATOM 1511 C1' U A 97 0.606 -7.795 5.498 1.00 0.00 C ATOM 1512 N1 U A 97 0.449 -8.683 6.673 1.00 0.00 N ATOM 1513 C2 U A 97 -0.773 -8.644 7.331 1.00 0.00 C ATOM 1514 O2 U A 97 -1.708 -7.940 6.949 1.00 0.00 O ATOM 1515 N3 U A 97 -0.899 -9.443 8.454 1.00 0.00 N ATOM 1516 C4 U A 97 0.076 -10.274 8.970 1.00 0.00 C ATOM 1517 O4 U A 97 -0.134 -10.934 9.984 1.00 0.00 O ATOM 1518 C5 U A 97 1.308 -10.270 8.215 1.00 0.00 C ATOM 1519 C6 U A 97 1.458 -9.500 7.110 1.00 0.00 C ATOM 0 H5' U A 97 1.508 -10.669 5.149 1.00 0.00 H new ATOM 0 H5'' U A 97 0.289 -11.026 3.942 1.00 0.00 H new ATOM 0 H4' U A 97 1.100 -9.079 2.619 1.00 0.00 H new ATOM 0 H3' U A 97 3.307 -8.995 4.387 1.00 0.00 H new ATOM 0 H2' U A 97 2.726 -7.500 6.077 1.00 0.00 H new ATOM 0 HO2' U A 97 2.087 -5.995 3.838 1.00 0.00 H new ATOM 0 H1' U A 97 0.032 -6.902 5.747 1.00 0.00 H new ATOM 0 H3 U A 97 -1.793 -9.416 8.945 1.00 0.00 H new ATOM 0 H5 U A 97 2.128 -10.895 8.539 1.00 0.00 H new ATOM 0 H6 U A 97 2.389 -9.531 6.564 1.00 0.00 H new ATOM 1530 P C A 98 4.467 -7.002 2.961 1.00 0.00 P ATOM 1531 OP1 C A 98 4.934 -6.902 4.363 1.00 0.00 O ATOM 1532 OP2 C A 98 4.472 -5.796 2.100 1.00 0.00 O ATOM 1533 O5' C A 98 5.325 -8.155 2.228 1.00 0.00 O ATOM 1534 C5' C A 98 5.417 -8.199 0.818 1.00 0.00 C ATOM 1535 C4' C A 98 6.377 -9.310 0.394 1.00 0.00 C ATOM 1536 O4' C A 98 5.792 -10.596 0.528 1.00 0.00 O ATOM 1537 C3' C A 98 6.720 -9.148 -1.086 1.00 0.00 C ATOM 1538 O3' C A 98 7.937 -9.792 -1.403 1.00 0.00 O ATOM 1539 C2' C A 98 5.545 -9.886 -1.714 1.00 0.00 C ATOM 1540 O2' C A 98 5.838 -10.332 -3.023 1.00 0.00 O ATOM 1541 C1' C A 98 5.323 -11.037 -0.738 1.00 0.00 C ATOM 1542 N1 C A 98 3.889 -11.394 -0.675 1.00 0.00 N ATOM 1543 C2 C A 98 3.417 -12.397 -1.514 1.00 0.00 C ATOM 1544 O2 C A 98 4.186 -13.004 -2.260 1.00 0.00 O ATOM 1545 N3 C A 98 2.091 -12.692 -1.496 1.00 0.00 N ATOM 1546 C4 C A 98 1.265 -12.036 -0.679 1.00 0.00 C ATOM 1547 N4 C A 98 -0.026 -12.361 -0.695 1.00 0.00 N ATOM 1548 C5 C A 98 1.730 -11.011 0.207 1.00 0.00 C ATOM 1549 C6 C A 98 3.052 -10.732 0.178 1.00 0.00 C ATOM 0 H5' C A 98 5.767 -7.239 0.438 1.00 0.00 H new ATOM 0 H5'' C A 98 4.432 -8.373 0.386 1.00 0.00 H new ATOM 0 H4' C A 98 7.254 -9.231 1.036 1.00 0.00 H new ATOM 0 H3' C A 98 6.853 -8.117 -1.413 1.00 0.00 H new ATOM 0 H2' C A 98 4.660 -9.264 -1.848 1.00 0.00 H new ATOM 0 HO2' C A 98 6.802 -10.483 -3.109 1.00 0.00 H new ATOM 0 H1' C A 98 5.859 -11.931 -1.057 1.00 0.00 H new ATOM 0 H41 C A 98 -0.681 -11.877 -0.081 1.00 0.00 H new ATOM 0 H42 C A 98 -0.360 -13.094 -1.321 1.00 0.00 H new ATOM 0 H5 C A 98 1.056 -10.486 0.867 1.00 0.00 H new ATOM 0 H6 C A 98 3.452 -9.976 0.838 1.00 0.00 H new ATOM 1561 P A A 99 9.367 -9.118 -1.075 1.00 0.00 P ATOM 1562 OP1 A A 99 10.402 -10.156 -1.280 1.00 0.00 O ATOM 1563 OP2 A A 99 9.283 -8.423 0.230 1.00 0.00 O ATOM 1564 O5' A A 99 9.557 -8.007 -2.227 1.00 0.00 O ATOM 1565 C5' A A 99 9.090 -6.682 -2.052 1.00 0.00 C ATOM 1566 C4' A A 99 9.419 -5.848 -3.289 1.00 0.00 C ATOM 1567 O4' A A 99 8.525 -6.176 -4.342 1.00 0.00 O ATOM 1568 C3' A A 99 9.254 -4.353 -2.997 1.00 0.00 C ATOM 1569 O3' A A 99 10.323 -3.652 -3.598 1.00 0.00 O ATOM 1570 C2' A A 99 7.918 -4.043 -3.673 1.00 0.00 C ATOM 1571 O2' A A 99 7.762 -2.690 -4.058 1.00 0.00 O ATOM 1572 C1' A A 99 8.028 -4.965 -4.874 1.00 0.00 C ATOM 1573 N9 A A 99 6.740 -5.100 -5.586 1.00 0.00 N ATOM 1574 C8 A A 99 6.333 -4.354 -6.653 1.00 0.00 C ATOM 1575 N7 A A 99 5.167 -4.684 -7.138 1.00 0.00 N ATOM 1576 C5 A A 99 4.767 -5.734 -6.308 1.00 0.00 C ATOM 1577 C6 A A 99 3.623 -6.554 -6.291 1.00 0.00 C ATOM 1578 N6 A A 99 2.630 -6.451 -7.175 1.00 0.00 N ATOM 1579 N1 A A 99 3.520 -7.487 -5.335 1.00 0.00 N ATOM 1580 C2 A A 99 4.501 -7.598 -4.447 1.00 0.00 C ATOM 1581 N3 A A 99 5.627 -6.906 -4.356 1.00 0.00 N ATOM 1582 C4 A A 99 5.708 -5.977 -5.340 1.00 0.00 C ATOM 0 H5' A A 99 9.551 -6.238 -1.170 1.00 0.00 H new ATOM 0 H5'' A A 99 8.014 -6.686 -1.881 1.00 0.00 H new ATOM 0 H4' A A 99 10.450 -6.063 -3.569 1.00 0.00 H new ATOM 0 H3' A A 99 9.263 -4.077 -1.943 1.00 0.00 H new ATOM 0 H2' A A 99 7.051 -4.194 -3.029 1.00 0.00 H new ATOM 0 HO2' A A 99 8.253 -2.114 -3.435 1.00 0.00 H new ATOM 0 H1' A A 99 8.695 -4.581 -5.646 1.00 0.00 H new ATOM 0 H8 A A 99 6.929 -3.553 -7.064 1.00 0.00 H new ATOM 0 H61 A A 99 1.825 -7.074 -7.112 1.00 0.00 H new ATOM 0 H62 A A 99 2.676 -5.749 -7.914 1.00 0.00 H new ATOM 0 H2 A A 99 4.361 -8.359 -3.693 1.00 0.00 H new ATOM 1594 P A A 100 10.812 -2.235 -3.017 1.00 0.00 P ATOM 1595 OP1 A A 100 11.405 -2.453 -1.679 1.00 0.00 O ATOM 1596 OP2 A A 100 9.709 -1.266 -3.181 1.00 0.00 O ATOM 1597 O5' A A 100 11.983 -1.842 -4.042 1.00 0.00 O ATOM 1598 C5' A A 100 13.198 -2.548 -4.003 1.00 0.00 C ATOM 1599 C4' A A 100 13.847 -2.638 -5.388 1.00 0.00 C ATOM 1600 O4' A A 100 12.897 -3.006 -6.382 1.00 0.00 O ATOM 1601 C3' A A 100 14.404 -1.277 -5.777 1.00 0.00 C ATOM 1602 O3' A A 100 15.549 -1.443 -6.581 1.00 0.00 O ATOM 1603 C2' A A 100 13.247 -0.690 -6.563 1.00 0.00 C ATOM 1604 O2' A A 100 13.644 0.344 -7.442 1.00 0.00 O ATOM 1605 C1' A A 100 12.738 -1.923 -7.286 1.00 0.00 C ATOM 1606 N9 A A 100 11.332 -1.690 -7.661 1.00 0.00 N ATOM 1607 C8 A A 100 10.210 -1.765 -6.881 1.00 0.00 C ATOM 1608 N7 A A 100 9.102 -1.468 -7.511 1.00 0.00 N ATOM 1609 C5 A A 100 9.530 -1.170 -8.805 1.00 0.00 C ATOM 1610 C6 A A 100 8.866 -0.766 -9.981 1.00 0.00 C ATOM 1611 N6 A A 100 7.548 -0.593 -10.068 1.00 0.00 N ATOM 1612 N1 A A 100 9.597 -0.529 -11.081 1.00 0.00 N ATOM 1613 C2 A A 100 10.910 -0.688 -11.020 1.00 0.00 C ATOM 1614 N3 A A 100 11.654 -1.067 -9.992 1.00 0.00 N ATOM 1615 C4 A A 100 10.889 -1.301 -8.902 1.00 0.00 C ATOM 0 H5' A A 100 13.023 -3.552 -3.617 1.00 0.00 H new ATOM 0 H5'' A A 100 13.882 -2.056 -3.312 1.00 0.00 H new ATOM 0 H4' A A 100 14.633 -3.391 -5.334 1.00 0.00 H new ATOM 0 H3' A A 100 14.721 -0.651 -4.943 1.00 0.00 H new ATOM 0 H2' A A 100 12.496 -0.193 -5.948 1.00 0.00 H new ATOM 0 HO2' A A 100 12.860 0.684 -7.923 1.00 0.00 H new ATOM 0 H1' A A 100 13.280 -2.145 -8.205 1.00 0.00 H new ATOM 0 H8 A A 100 10.237 -2.044 -5.838 1.00 0.00 H new ATOM 0 H61 A A 100 7.129 -0.299 -10.950 1.00 0.00 H new ATOM 0 H62 A A 100 6.957 -0.755 -9.252 1.00 0.00 H new ATOM 0 H2 A A 100 11.448 -0.480 -11.933 1.00 0.00 H new ATOM 1627 P A A 101 17.010 -1.478 -5.924 1.00 0.00 P ATOM 1628 OP1 A A 101 17.973 -1.974 -6.931 1.00 0.00 O ATOM 1629 OP2 A A 101 16.912 -2.145 -4.608 1.00 0.00 O ATOM 1630 O5' A A 101 17.294 0.081 -5.676 1.00 0.00 O ATOM 1631 C5' A A 101 17.107 1.000 -6.730 1.00 0.00 C ATOM 1632 C4' A A 101 17.602 2.399 -6.367 1.00 0.00 C ATOM 1633 O4' A A 101 16.929 2.908 -5.225 1.00 0.00 O ATOM 1634 C3' A A 101 19.094 2.398 -6.046 1.00 0.00 C ATOM 1635 O3' A A 101 19.638 3.660 -6.384 1.00 0.00 O ATOM 1636 C2' A A 101 19.100 2.182 -4.541 1.00 0.00 C ATOM 1637 O2' A A 101 20.242 2.748 -3.926 1.00 0.00 O ATOM 1638 C1' A A 101 17.804 2.865 -4.104 1.00 0.00 C ATOM 1639 N9 A A 101 17.170 2.163 -2.968 1.00 0.00 N ATOM 1640 C8 A A 101 17.158 0.820 -2.683 1.00 0.00 C ATOM 1641 N7 A A 101 16.520 0.517 -1.585 1.00 0.00 N ATOM 1642 C5 A A 101 16.082 1.753 -1.105 1.00 0.00 C ATOM 1643 C6 A A 101 15.356 2.145 0.035 1.00 0.00 C ATOM 1644 N6 A A 101 14.897 1.290 0.954 1.00 0.00 N ATOM 1645 N1 A A 101 15.107 3.447 0.218 1.00 0.00 N ATOM 1646 C2 A A 101 15.551 4.316 -0.683 1.00 0.00 C ATOM 1647 N3 A A 101 16.237 4.084 -1.790 1.00 0.00 N ATOM 1648 C4 A A 101 16.471 2.760 -1.947 1.00 0.00 C ATOM 0 H5' A A 101 16.049 1.046 -6.987 1.00 0.00 H new ATOM 0 H5'' A A 101 17.635 0.647 -7.616 1.00 0.00 H new ATOM 0 H4' A A 101 17.401 3.024 -7.237 1.00 0.00 H new ATOM 0 H3' A A 101 19.680 1.652 -6.583 1.00 0.00 H new ATOM 0 H2' A A 101 19.148 1.131 -4.255 1.00 0.00 H new ATOM 0 HO2' A A 101 20.206 2.588 -2.960 1.00 0.00 H new ATOM 0 HO3' A A 101 20.240 3.958 -5.671 1.00 0.00 H new ATOM 0 H1' A A 101 18.026 3.875 -3.758 1.00 0.00 H new ATOM 0 H8 A A 101 17.634 0.081 -3.311 1.00 0.00 H new ATOM 0 H61 A A 101 14.377 1.638 1.759 1.00 0.00 H new ATOM 0 H62 A A 101 15.067 0.290 0.850 1.00 0.00 H new ATOM 0 H2 A A 101 15.321 5.352 -0.485 1.00 0.00 H new TER 1661 A A 101