HEADER COAGULATION INHIBITOR 19-DEC-88 4HIR 4HIR 3 COMPND HIRUDIN (MUTANT WITH LYS 47 REPLACED BY GLU) (/K47E$) 4HIR 4 COMPND 2 (/NMR$,32 SIMULATED ANNEALING STRUCTURES) 4HIR 5 SOURCE LEECH (HIRUDO $MEDICINALIS) RECOMBINANT IN 4HIR 6 SOURCE 2 (ESCHERICHIA $COLI) USING CHEMICALLY SYNTHESIZED GENE 4HIR 7 EXPDTA NMR 4HIR 8 AUTHOR G.M.CLORE,A.M.GRONENBORN 4HIR 9 REVDAT 1 15-JAN-90 4HIR 0 4HIR 10 JRNL AUTH P.J.M.FOLKERS,G.M.CLORE,P.C.DRISCOLL,J.DODT, 4HIR 11 JRNL AUTH 2 S.KOEHLER,A.M.GRONENBORN 4HIR 12 JRNL TITL SOLUTION STRUCTURE OF RECOMBINANT HIRUDIN AND THE 4HIR 13 JRNL TITL 2 LYS-47 (RIGHT ARROW) GLU MUTANT. A NUCLEAR 4HIR 14 JRNL TITL 4 MAGNETIC RESONANCE AND HYBRID DISTANCE 4HIR 15 JRNL TITL 5 GEOMETRY-*DYNAMICAL SIMULATED ANNEALING STUDY 4HIR 16 JRNL REF BIOCHEMISTRY V. 28 2601 1989 4HIR 17 JRNL REFN ASTM BICHAW US ISSN 0006-2960 033 4HIR 18 REMARK 1 4HIR 19 REMARK 2 4HIR 20 REMARK 2 RESOLUTION. NOT APPLICABLE. SEE REMARK 4. 4HIR 21 REMARK 3 4HIR 22 REMARK 3 REFINEMENT. THE METHOD USED TO DETERMINE AND REFINE THE 4HIR 23 REMARK 3 STRUCTURE IS THE HYBRID METRIC MATRIX DISTANCE 4HIR 24 REMARK 3 GEOMETRY-DYNAMICAL SIMULATED ANNEALING METHOD 4HIR 25 REMARK 3 (M.NILGES, G.M.CLORE, A.M. GRONENBORN, FEBS LETT. 229, 4HIR 26 REMARK 3 317-324 (1988)) USING THE PROGRAM XPLOR (A.T. BRUENGER, 4HIR 27 REMARK 3 YALE UNIVERSITY, CT 06511). 4HIR 28 REMARK 3 4HIR 29 REMARK 3 STRUCTURAL STATISTICS - THESE ARE CALCULATED FROM ALL THE 4HIR 30 REMARK 3 32 MODELS GIVEN IN THIS ENTRY. 4HIR 31 REMARK 3 NUMBERS ENCLOSED IN PARENTHESIS 4HIR 32 REMARK 3 ARE THE STANDARD DEVIATIONS. 4HIR 33 REMARK 3 4HIR 34 REMARK 3 RMS DEVIATION FROM EXPERIMENTAL RESTRAINTS *(1)* 4HIR 35 REMARK 3 4HIR 36 REMARK 3 RESTRAINT TYPE NUMBER OF RESTRAINTS RMS (ANGSTROMS) 4HIR 37 REMARK 3 4HIR 38 REMARK 3 ALL 677 0.077 4HIR 39 REMARK 3 INTERRESIDUE 4HIR 40 REMARK 3 SHORT RANGE 234 0.092 4HIR 41 REMARK 3 INTERRESIDUE 4HIR 42 REMARK 3 LONG RANGE 199 0.066 4HIR 43 REMARK 3 INTRARESIDUE 228 0.067 4HIR 44 REMARK 3 HBOND *(2)* 16 0.083 4HIR 45 REMARK 3 4HIR 46 REMARK 3 POTENTIAL ENERGY TERMS 4HIR 47 REMARK 3 4HIR 48 REMARK 3 TYPE ENERGY (KCAL/MOL) 4HIR 49 REMARK 3 4HIR 50 REMARK 3 F(NOE) *(3)* 201 4HIR 51 REMARK 3 F(TOR) *(4)* 12 4HIR 52 REMARK 3 F(REPEL) *(5)* 42 4HIR 53 REMARK 3 4HIR 54 REMARK 3 LENNARD-JONES VAN DER WAALS ENERGY (E(L-J)) CALCULATED 4HIR 55 REMARK 3 USING THE *CHARMM* EMPIRICAL ENERGY FUNCTION IS 4HIR 56 REMARK 3 -66 KCAL/MOL. 4HIR 57 REMARK 3 4HIR 58 REMARK 3 DEVIATIONS FROM IDEALIZED GEOMETRY *(6)* 4HIR 59 REMARK 3 4HIR 60 REMARK 3 TYPE TOTAL NUMBER RMS DEVIATION 4HIR 61 REMARK 3 4HIR 62 REMARK 3 BONDS 669 0.011 (ANGSTROMS) 4HIR 63 REMARK 3 ANGLES 1208 2.754 (DEGREES) 4HIR 64 REMARK 3 IMPROPERS 132 0.609 (DEGREES) 4HIR 65 REMARK 3 4HIR 66 REMARK 3 NOTES. 4HIR 67 REMARK 3 *(1)* THE RMS DEVIATION FROM THE EXPERIMENTAL RESTRAINTS 4HIR 68 REMARK 3 ARE CALCULATED WITH RESPECT TO THE UPPER AND 4HIR 69 REMARK 3 LOWER LIMITS OF THE DISTANCE RESTRAINTS. NONE OF 4HIR 70 REMARK 3 THE STRUCTURES EXHIBITED VIOLATIONS GREATER THAN 4HIR 71 REMARK 3 0.5 ANGSTROMS. 4HIR 72 REMARK 3 *(2)* FOR EACH BACKBONE HYDROGEN BOND THERE ARE TWO 4HIR 73 REMARK 3 RESTRAINTS - R(NH-O) .LT. 2.3 ANGSTROMS AND 4HIR 74 REMARK 3 R(N-O) .LT. 3.3 ANGSTROMS. THE LOWER LIMITS 4HIR 75 REMARK 3 ARE GIVEN BY THE SUM OF THE VAN DER WAALS RADII 4HIR 76 REMARK 3 OF THE RELEVANT ATOMS. 4HIR 77 REMARK 3 *(3)* THE VALUES OF THE SQUARE-WELL NOE POTENTIAL 4HIR 78 REMARK 3 F(NOE) ARE CALCULATED WITH A FORCE CONSTANT OF 4HIR 79 REMARK 3 50 KCAL/MOL/ANGSTROM**2. 4HIR 80 REMARK 3 *(4)* THE VALUES OF F(PHI) ARE CALCULATED WITH A FORCE 4HIR 81 REMARK 3 CONSTANT OF 200 KCAL/MOL/RAD**2. F(PHI) IS A 4HIR 82 REMARK 3 SQUARE-WELL DIHEDRAL POTENTIAL WHICH IS USED TO 4HIR 83 REMARK 3 RESTRICT THE RANGES OF 26 PHI AND 25 CHI1 TORSION 4HIR 84 REMARK 3 ANGLES. 4HIR 85 REMARK 3 *(5)* THE VALUE OF THE VAN DER WAALS REPULSION TERM 4HIR 86 REMARK 3 F(REPEL) IS CALCULATED WITH A FORCE CONSTANT OF 4HIR 87 REMARK 3 4 KCAL/MOL/ANGSTROM**4 WITH THE HARD SPHERE 4HIR 88 REMARK 3 VAN DER WAALS RADII SET TO 0.8 TIMES THE STANDARD 4HIR 89 REMARK 3 VALUES USED IN THE *CHARMM* EMPIRICAL ENERGY 4HIR 90 REMARK 3 FUNCTION. 4HIR 91 REMARK 3 *(6)* THE IMPROPER TERMS SERVE TO MAINTAIN PLANARITY 4HIR 92 REMARK 3 AND APPROPRIATE CHIRALITY. THEY ALSO MAINTAIN THE 4HIR 93 REMARK 3 PEPTIDE BONDS OF ALL RESIDUES (WITH THE EXCEPTION 4HIR 94 REMARK 3 OF PROLINES) IN THE TRANS CONFORMATION. IN THE 4HIR 95 REMARK 3 DYNAMICAL SIMULATED ANNEALING CALCULATIONS, THE 4HIR 96 REMARK 3 RESTRAINTS FOR THE DISULFIDE BRIDGES ARE INCLUDED 4HIR 97 REMARK 3 IN THE BOND AND ANGLE TERMS. 4HIR 98 REMARK 4 4HIR 99 REMARK 4 THESE COORDINATES WERE GENERATED FROM SOLUTION NMR DATA. 4HIR 100 REMARK 4 PROTEIN DATA BANK CONVENTIONS REQUIRE THAT *CRYST1* AND 4HIR 101 REMARK 4 *SCALE* RECORDS BE INCLUDED, BUT THE VALUES ON THESE 4HIR 102 REMARK 4 RECORDS ARE OBVIOUSLY MEANINGLESS. 4HIR 103 REMARK 5 4HIR 104 REMARK 5 ALTOGETHER, 32 STRUCTURES CONSISTENT WITH THE NMR DATA 4HIR 105 REMARK 5 WERE CALCULATED. THE COORDINATES FOR THESE STRUCTURES ARE 4HIR 106 REMARK 5 DELINEATED IN THIS ENTRY BY THE PROTEIN DATA BANK KEYWORDS 4HIR 107 REMARK 5 *MODEL* AND *ENDMDL*. ENTRY *6HIR* CONTAINS THE 4HIR 108 REMARK 5 COORDINATES FOR THE MINIMIZED-AVERAGE STRUCTURE. 4HIR 109 REMARK 6 4HIR 110 REMARK 6 ALL THE INTERPROTON DISTANCE AND TORSION ANGLE RESTRAINTS 4HIR 111 REMARK 6 ARE AVAILABLE IN THE PDB STRUCTURE FACTOR FILE *R5HIRNMR*. 4HIR 112 REMARK 7 4HIR 113 REMARK 7 ONLY RESIDUES 1-49 ARE WELL DEFINED. RESIDUES 50-65 FORM 4HIR 114 REMARK 7 A DISORDERED C-TERMINAL TAIL. 4HIR 115 REMARK 8 4HIR 116 REMARK 8 HYDROGEN ATOMS IN THIS ENTRY HAVE BEEN ASSIGNED NAMES 4HIR 117 REMARK 8 CONSISTENT WITH THE RECOMMENDATIONS OF THE IUPAC-IUB 4HIR 118 REMARK 8 COMMISSION ON BIOCHEMICAL NOMENCLATURE (SEE,E.G., J.MOL. 4HIR 119 REMARK 8 BIOL. 52, 1-17 (1970)). WE HAVE FOLLOWED RULE 4.4 OF 4HIR 120 REMARK 8 THE RECOMMENDATIONS WITH THE FOLLOWING MODIFICATION- 4HIR 121 REMARK 8 WHEN MORE THAN ONE HYDROGEN ATOM IS BONDED TO A SINGLE 4HIR 122 REMARK 8 NON-HYDROGEN ATOM, THE HYDROGEN ATOM NUMBER DESIGNATION IS 4HIR 123 REMARK 8 GIVEN AS THE FIRST CHARACTER OF THE ATOM NAME RATHER THAN 4HIR 124 REMARK 8 AS THE LAST CHARACTER (E.G. H*BETA*1 IS DENOTED AS 1HB ). 4HIR 125 SEQRES 1 65 VAL VAL TYR THR ASP CYS THR GLU SER GLY GLN ASN LEU 4HIR 126 SEQRES 2 65 CYS LEU CYS GLU GLY SER ASN VAL CYS GLY GLN GLY ASN 4HIR 127 SEQRES 3 65 LYS CYS ILE LEU GLY SER ASP GLY GLU LYS ASN GLN CYS 4HIR 128 SEQRES 4 65 VAL THR GLY GLU GLY THR PRO GLU PRO GLN SER HIS ASN 4HIR 129 SEQRES 5 65 ASP GLY ASP PHE GLU GLU ILE PRO GLU GLU TYR LEU GLN 4HIR 130 SHEET 1 A 3 SER 9 GLN 11 0 4HIR 131 SHEET 2 A 3 LYS 27 GLY 31 -1 4HIR 132 SHEET 3 A 3 LYS 36 VAL 40 -1 4HIR 133 SHEET 1 B 2 CYS 14 CYS 16 0 4HIR 134 SHEET 2 B 2 VAL 21 CYS 22 -1 4HIR 135 TURN 1 T1 GLU 17 ASN 20 TYPE II 4HIR 136 TURN 2 T2 SER 32 GLU 35 BETA TURN 4HIR 137 SSBOND 1 CYS 6 CYS 14 4HIR 138 SSBOND 2 CYS 16 CYS 28 4HIR 139 SSBOND 3 CYS 22 CYS 39 4HIR 140 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 4HIR 141 ORIGX1 1.000000 0.000000 0.000000 0.00000 4HIR 142 ORIGX2 0.000000 1.000000 0.000000 0.00000 4HIR 143 ORIGX3 0.000000 0.000000 1.000000 0.00000 4HIR 144 SCALE1 1.000000 0.000000 0.000000 0.00000 4HIR 145 SCALE2 0.000000 1.000000 0.000000 0.00000 4HIR 146 SCALE3 0.000000 0.000000 1.000000 0.00000 4HIR 147 MODEL 1 4HIR 148 ATOM 1 N VAL 1 -14.321 5.487 -6.348 1.00 0.00 4HIR 149 ATOM 2 CA VAL 1 -13.620 4.226 -5.975 1.00 0.00 4HIR 150 ATOM 3 C VAL 1 -12.238 4.558 -5.405 1.00 0.00 4HIR 151 ATOM 4 O VAL 1 -11.232 4.056 -5.867 1.00 0.00 4HIR 152 ATOM 5 CB VAL 1 -13.463 3.318 -7.198 1.00 0.00 4HIR 153 ATOM 6 CG1 VAL 1 -13.081 1.907 -6.738 1.00 0.00 4HIR 154 ATOM 7 CG2 VAL 1 -14.794 3.256 -7.949 1.00 0.00 4HIR 155 ATOM 8 1H VAL 1 -14.309 6.142 -5.541 1.00 0.00 4HIR 156 ATOM 9 2H VAL 1 -13.836 5.925 -7.159 1.00 0.00 4HIR 157 ATOM 10 3H VAL 1 -15.304 5.273 -6.607 1.00 0.00 4HIR 158 ATOM 11 HA VAL 1 -14.197 3.715 -5.219 1.00 0.00 4HIR 159 ATOM 12 HB VAL 1 -12.695 3.710 -7.849 1.00 0.00 4HIR 160 ATOM 13 1HG1 VAL 1 -12.264 1.961 -6.035 1.00 0.00 4HIR 161 ATOM 14 2HG1 VAL 1 -13.927 1.437 -6.265 1.00 0.00 4HIR 162 ATOM 15 3HG1 VAL 1 -12.779 1.317 -7.591 1.00 0.00 4HIR 163 ATOM 16 1HG2 VAL 1 -15.582 2.973 -7.266 1.00 0.00 4HIR 164 ATOM 17 2HG2 VAL 1 -15.020 4.222 -8.373 1.00 0.00 4HIR 165 ATOM 18 3HG2 VAL 1 -14.731 2.525 -8.742 1.00 0.00 4HIR 166 ATOM 19 N VAL 2 -12.222 5.409 -4.411 1.00 0.00 4HIR 167 ATOM 20 CA VAL 2 -10.933 5.781 -3.768 1.00 0.00 4HIR 168 ATOM 21 C VAL 2 -10.836 5.114 -2.394 1.00 0.00 4HIR 169 ATOM 22 O VAL 2 -11.826 4.640 -1.870 1.00 0.00 4HIR 170 ATOM 23 CB VAL 2 -10.903 7.299 -3.602 1.00 0.00 4HIR 171 ATOM 24 CG1 VAL 2 -9.452 7.781 -3.529 1.00 0.00 4HIR 172 ATOM 25 CG2 VAL 2 -11.586 7.948 -4.807 1.00 0.00 4HIR 173 ATOM 26 H VAL 2 -13.058 5.808 -4.089 1.00 0.00 4HIR 174 ATOM 27 HA VAL 2 -10.109 5.461 -4.386 1.00 0.00 4HIR 175 ATOM 28 HB VAL 2 -11.426 7.571 -2.700 1.00 0.00 4HIR 176 ATOM 29 1HG1 VAL 2 -8.903 7.183 -2.818 1.00 0.00 4HIR 177 ATOM 30 2HG1 VAL 2 -8.989 7.693 -4.500 1.00 0.00 4HIR 178 ATOM 31 3HG1 VAL 2 -9.427 8.815 -3.216 1.00 0.00 4HIR 179 ATOM 32 1HG2 VAL 2 -11.390 7.365 -5.695 1.00 0.00 4HIR 180 ATOM 33 2HG2 VAL 2 -12.652 7.996 -4.639 1.00 0.00 4HIR 181 ATOM 34 3HG2 VAL 2 -11.204 8.948 -4.948 1.00 0.00 4HIR 182 ATOM 35 N TYR 3 -9.648 5.090 -1.839 1.00 0.00 4HIR 183 ATOM 36 CA TYR 3 -9.471 4.449 -0.496 1.00 0.00 4HIR 184 ATOM 37 C TYR 3 -8.805 5.414 0.489 1.00 0.00 4HIR 185 ATOM 38 O TYR 3 -8.703 6.598 0.233 1.00 0.00 4HIR 186 ATOM 39 CB TYR 3 -8.597 3.201 -0.658 1.00 0.00 4HIR 187 ATOM 40 CG TYR 3 -9.429 2.094 -1.314 1.00 0.00 4HIR 188 ATOM 41 CD1 TYR 3 -10.253 1.290 -0.553 1.00 0.00 4HIR 189 ATOM 42 CD2 TYR 3 -9.370 1.887 -2.676 1.00 0.00 4HIR 190 ATOM 43 CE1 TYR 3 -11.005 0.297 -1.147 1.00 0.00 4HIR 191 ATOM 44 CE2 TYR 3 -10.122 0.894 -3.268 1.00 0.00 4HIR 192 ATOM 45 CZ TYR 3 -10.945 0.092 -2.509 1.00 0.00 4HIR 193 ATOM 46 OH TYR 3 -11.699 -0.901 -3.103 1.00 0.00 4HIR 194 ATOM 47 H TYR 3 -8.881 5.484 -2.300 1.00 0.00 4HIR 195 ATOM 48 HA TYR 3 -10.433 4.162 -0.103 1.00 0.00 4HIR 196 ATOM 49 1HB TYR 3 -7.740 3.426 -1.277 1.00 0.00 4HIR 197 ATOM 50 2HB TYR 3 -8.259 2.868 0.305 1.00 0.00 4HIR 198 ATOM 51 HD1 TYR 3 -10.309 1.441 0.514 1.00 0.00 4HIR 199 ATOM 52 HD2 TYR 3 -8.735 2.505 -3.281 1.00 0.00 4HIR 200 ATOM 53 HE1 TYR 3 -11.649 -0.323 -0.539 1.00 0.00 4HIR 201 ATOM 54 HE2 TYR 3 -10.064 0.743 -4.337 1.00 0.00 4HIR 202 ATOM 55 HH TYR 3 -12.291 -1.263 -2.440 1.00 0.00 4HIR 203 ATOM 56 N THR 4 -8.365 4.878 1.597 1.00 0.00 4HIR 204 ATOM 57 CA THR 4 -7.716 5.728 2.633 1.00 0.00 4HIR 205 ATOM 58 C THR 4 -6.216 5.485 2.613 1.00 0.00 4HIR 206 ATOM 59 O THR 4 -5.739 4.706 1.836 1.00 0.00 4HIR 207 ATOM 60 CB THR 4 -8.285 5.339 3.999 1.00 0.00 4HIR 208 ATOM 61 OG1 THR 4 -8.322 3.919 3.990 1.00 0.00 4HIR 209 ATOM 62 CG2 THR 4 -9.739 5.769 4.125 1.00 0.00 4HIR 210 ATOM 63 H THR 4 -8.442 3.910 1.737 1.00 0.00 4HIR 211 ATOM 64 HA THR 4 -7.920 6.768 2.429 1.00 0.00 4HIR 212 ATOM 65 HB THR 4 -7.684 5.705 4.815 1.00 0.00 4HIR 213 ATOM 66 HG1 THR 4 -8.662 3.635 3.138 1.00 0.00 4HIR 214 ATOM 67 1HG2 THR 4 -10.178 5.856 3.143 1.00 0.00 4HIR 215 ATOM 68 2HG2 THR 4 -10.285 5.034 4.698 1.00 0.00 4HIR 216 ATOM 69 3HG2 THR 4 -9.793 6.724 4.623 1.00 0.00 4HIR 217 ATOM 70 N ASP 5 -5.497 6.152 3.458 1.00 0.00 4HIR 218 ATOM 71 CA ASP 5 -4.036 5.933 3.463 1.00 0.00 4HIR 219 ATOM 72 C ASP 5 -3.679 4.706 4.302 1.00 0.00 4HIR 220 ATOM 73 O ASP 5 -4.424 4.298 5.169 1.00 0.00 4HIR 221 ATOM 74 CB ASP 5 -3.360 7.150 4.070 1.00 0.00 4HIR 222 ATOM 75 CG ASP 5 -4.175 8.405 3.748 1.00 0.00 4HIR 223 ATOM 76 OD1 ASP 5 -5.277 8.482 4.266 1.00 0.00 4HIR 224 ATOM 77 OD2 ASP 5 -3.649 9.216 3.005 1.00 0.00 4HIR 225 ATOM 78 H ASP 5 -5.907 6.791 4.076 1.00 0.00 4HIR 226 ATOM 79 HA ASP 5 -3.692 5.788 2.450 1.00 0.00 4HIR 227 ATOM 80 1HB ASP 5 -3.302 7.023 5.131 1.00 0.00 4HIR 228 ATOM 81 2HB ASP 5 -2.364 7.257 3.665 1.00 0.00 4HIR 229 ATOM 83 N CYS 6 -2.541 4.145 4.015 1.00 0.00 4HIR 230 ATOM 84 CA CYS 6 -2.074 2.980 4.786 1.00 0.00 4HIR 231 ATOM 85 C CYS 6 -1.562 3.408 6.141 1.00 0.00 4HIR 232 ATOM 86 O CYS 6 -1.596 4.574 6.486 1.00 0.00 4HIR 233 ATOM 87 CB CYS 6 -0.878 2.373 4.055 1.00 0.00 4HIR 234 ATOM 88 SG CYS 6 -0.701 2.673 2.289 1.00 0.00 4HIR 235 ATOM 89 H CYS 6 -2.042 4.435 3.242 1.00 0.00 4HIR 236 ATOM 90 HA CYS 6 -2.867 2.255 4.895 1.00 0.00 4HIR 237 ATOM 91 1HB CYS 6 0.003 2.762 4.520 1.00 0.00 4HIR 238 ATOM 92 2HB CYS 6 -0.890 1.304 4.211 1.00 0.00 4HIR 239 ATOM 94 N THR 7 -1.101 2.443 6.884 1.00 0.00 4HIR 240 ATOM 95 CA THR 7 -0.502 2.750 8.205 1.00 0.00 4HIR 241 ATOM 96 C THR 7 0.904 2.204 8.268 1.00 0.00 4HIR 242 ATOM 97 O THR 7 1.718 2.646 9.048 1.00 0.00 4HIR 243 ATOM 98 CB THR 7 -1.358 2.120 9.307 1.00 0.00 4HIR 244 ATOM 99 OG1 THR 7 -0.842 0.806 9.469 1.00 0.00 4HIR 245 ATOM 100 CG2 THR 7 -2.804 1.920 8.844 1.00 0.00 4HIR 246 ATOM 101 H THR 7 -1.170 1.517 6.576 1.00 0.00 4HIR 247 ATOM 102 HA THR 7 -0.457 3.778 8.323 1.00 0.00 4HIR 248 ATOM 103 HB THR 7 -1.302 2.676 10.230 1.00 0.00 4HIR 249 ATOM 104 HG1 THR 7 -0.669 0.669 10.404 1.00 0.00 4HIR 250 ATOM 105 1HG2 THR 7 -3.218 2.863 8.518 1.00 0.00 4HIR 251 ATOM 106 2HG2 THR 7 -2.833 1.217 8.024 1.00 0.00 4HIR 252 ATOM 107 3HG2 THR 7 -3.399 1.537 9.660 1.00 0.00 4HIR 253 ATOM 108 N GLU 8 1.144 1.276 7.425 1.00 0.00 4HIR 254 ATOM 109 CA GLU 8 2.484 0.619 7.380 1.00 0.00 4HIR 255 ATOM 110 C GLU 8 2.703 -0.133 6.062 1.00 0.00 4HIR 256 ATOM 111 O GLU 8 1.770 -0.439 5.345 1.00 0.00 4HIR 257 ATOM 112 CB GLU 8 2.571 -0.374 8.537 1.00 0.00 4HIR 258 ATOM 113 CG GLU 8 3.547 0.161 9.577 1.00 0.00 4HIR 259 ATOM 114 CD GLU 8 3.490 -0.715 10.830 1.00 0.00 4HIR 260 ATOM 115 OE1 GLU 8 2.709 -0.364 11.700 1.00 0.00 4HIR 261 ATOM 116 OE2 GLU 8 4.231 -1.684 10.847 1.00 0.00 4HIR 262 ATOM 117 H GLU 8 0.458 1.031 6.813 1.00 0.00 4HIR 263 ATOM 118 HA GLU 8 3.257 1.371 7.476 1.00 0.00 4HIR 264 ATOM 119 1HB GLU 8 1.594 -0.498 8.984 1.00 0.00 4HIR 265 ATOM 120 2HB GLU 8 2.917 -1.328 8.170 1.00 0.00 4HIR 266 ATOM 121 1HG GLU 8 4.545 0.147 9.174 1.00 0.00 4HIR 267 ATOM 122 2HG GLU 8 3.285 1.170 9.839 1.00 0.00 4HIR 268 ATOM 124 N SER 9 3.947 -0.423 5.792 1.00 0.00 4HIR 269 ATOM 125 CA SER 9 4.304 -1.149 4.575 1.00 0.00 4HIR 270 ATOM 126 C SER 9 3.669 -2.524 4.624 1.00 0.00 4HIR 271 ATOM 127 O SER 9 3.618 -3.150 5.674 1.00 0.00 4HIR 272 ATOM 128 CB SER 9 5.810 -1.244 4.551 1.00 0.00 4HIR 273 ATOM 129 OG SER 9 6.228 -0.370 5.588 1.00 0.00 4HIR 274 ATOM 130 H SER 9 4.638 -0.195 6.413 1.00 0.00 4HIR 275 ATOM 131 HA SER 9 3.955 -0.629 3.700 1.00 0.00 4HIR 276 ATOM 132 1HB SER 9 6.110 -2.220 4.764 1.00 0.00 4HIR 277 ATOM 133 2HB SER 9 6.208 -0.915 3.610 1.00 0.00 4HIR 278 ATOM 134 HG SER 9 7.150 -0.152 5.437 1.00 0.00 4HIR 279 ATOM 135 N GLY 10 3.238 -2.974 3.484 1.00 0.00 4HIR 280 ATOM 136 CA GLY 10 2.434 -4.224 3.425 1.00 0.00 4HIR 281 ATOM 137 C GLY 10 0.946 -4.338 3.133 1.00 0.00 4HIR 282 ATOM 138 O GLY 10 0.467 -5.345 2.649 1.00 0.00 4HIR 283 ATOM 139 H GLY 10 3.477 -2.507 2.659 1.00 0.00 4HIR 284 ATOM 140 1HA GLY 10 2.414 -3.947 2.381 1.00 0.00 4HIR 285 ATOM 141 2HA GLY 10 1.993 -3.751 4.283 1.00 0.00 4HIR 286 ATOM 142 N GLN 11 0.241 -3.274 3.453 1.00 0.00 4HIR 287 ATOM 143 CA GLN 11 -1.232 -3.251 3.187 1.00 0.00 4HIR 288 ATOM 144 C GLN 11 -1.489 -3.144 1.674 1.00 0.00 4HIR 289 ATOM 145 O GLN 11 -0.564 -3.252 0.894 1.00 0.00 4HIR 290 ATOM 146 CB GLN 11 -1.850 -2.064 3.923 1.00 0.00 4HIR 291 ATOM 147 CG GLN 11 -2.217 -2.516 5.342 1.00 0.00 4HIR 292 ATOM 148 CD GLN 11 -2.664 -1.311 6.172 1.00 0.00 4HIR 293 ATOM 149 OE1 GLN 11 -3.415 -1.445 7.118 1.00 0.00 4HIR 294 ATOM 150 NE2 GLN 11 -2.229 -0.127 5.859 1.00 0.00 4HIR 295 ATOM 151 H GLN 11 0.690 -2.494 3.879 1.00 0.00 4HIR 296 ATOM 152 HA GLN 11 -1.673 -4.169 3.551 1.00 0.00 4HIR 297 ATOM 153 1HB GLN 11 -1.140 -1.253 3.968 1.00 0.00 4HIR 298 ATOM 154 2HB GLN 11 -2.733 -1.736 3.402 1.00 0.00 4HIR 299 ATOM 155 1HG GLN 11 -3.021 -3.235 5.299 1.00 0.00 4HIR 300 ATOM 156 2HG GLN 11 -1.357 -2.971 5.813 1.00 0.00 4HIR 301 ATOM 157 1HE2 GLN 11 -1.429 -0.029 5.303 1.00 0.00 4HIR 302 ATOM 158 2HE2 GLN 11 -2.702 0.668 6.179 1.00 0.00 4HIR 303 ATOM 159 N ASN 12 -2.737 -2.936 1.283 1.00 0.00 4HIR 304 ATOM 160 CA ASN 12 -3.039 -2.934 -0.195 1.00 0.00 4HIR 305 ATOM 161 C ASN 12 -3.942 -1.811 -0.650 1.00 0.00 4HIR 306 ATOM 162 O ASN 12 -3.512 -0.925 -1.357 1.00 0.00 4HIR 307 ATOM 163 CB ASN 12 -3.717 -4.265 -0.552 1.00 0.00 4HIR 308 ATOM 164 CG ASN 12 -2.723 -5.420 -0.408 1.00 0.00 4HIR 309 ATOM 165 OD1 ASN 12 -1.799 -5.369 0.375 1.00 0.00 4HIR 310 ATOM 166 ND2 ASN 12 -2.880 -6.485 -1.146 1.00 0.00 4HIR 311 ATOM 167 H ASN 12 -3.450 -2.800 1.941 1.00 0.00 4HIR 312 ATOM 168 HA ASN 12 -2.140 -2.835 -0.730 1.00 0.00 4HIR 313 ATOM 169 1HB ASN 12 -4.554 -4.433 0.110 1.00 0.00 4HIR 314 ATOM 170 2HB ASN 12 -4.076 -4.228 -1.569 1.00 0.00 4HIR 315 ATOM 171 1HD2 ASN 12 -3.703 -7.013 -1.072 1.00 0.00 4HIR 316 ATOM 172 2HD2 ASN 12 -2.178 -6.754 -1.773 1.00 0.00 4HIR 317 ATOM 173 N LEU 13 -5.163 -1.872 -0.281 1.00 0.00 4HIR 318 ATOM 174 CA LEU 13 -6.097 -0.850 -0.780 1.00 0.00 4HIR 319 ATOM 175 C LEU 13 -5.925 0.445 -0.038 1.00 0.00 4HIR 320 ATOM 176 O LEU 13 -6.876 1.010 0.457 1.00 0.00 4HIR 321 ATOM 177 CB LEU 13 -7.539 -1.345 -0.615 1.00 0.00 4HIR 322 ATOM 178 CG LEU 13 -7.849 -2.396 -1.697 1.00 0.00 4HIR 323 ATOM 179 CD1 LEU 13 -9.249 -2.980 -1.453 1.00 0.00 4HIR 324 ATOM 180 CD2 LEU 13 -7.827 -1.744 -3.090 1.00 0.00 4HIR 325 ATOM 181 H LEU 13 -5.463 -2.576 0.298 1.00 0.00 4HIR 326 ATOM 182 HA LEU 13 -5.881 -0.680 -1.816 1.00 0.00 4HIR 327 ATOM 183 1HB LEU 13 -7.653 -1.787 0.364 1.00 0.00 4HIR 328 ATOM 184 2HB LEU 13 -8.222 -0.514 -0.708 1.00 0.00 4HIR 329 ATOM 185 HG LEU 13 -7.109 -3.184 -1.652 1.00 0.00 4HIR 330 ATOM 186 1HD1 LEU 13 -9.445 -3.041 -0.397 1.00 0.00 4HIR 331 ATOM 187 2HD1 LEU 13 -9.993 -2.347 -1.913 1.00 0.00 4HIR 332 ATOM 188 3HD1 LEU 13 -9.312 -3.970 -1.882 1.00 0.00 4HIR 333 ATOM 189 1HD2 LEU 13 -8.078 -0.699 -3.011 1.00 0.00 4HIR 334 ATOM 190 2HD2 LEU 13 -6.844 -1.837 -3.520 1.00 0.00 4HIR 335 ATOM 191 3HD2 LEU 13 -8.541 -2.235 -3.736 1.00 0.00 4HIR 336 ATOM 192 N CYS 14 -4.705 0.881 0.045 1.00 0.00 4HIR 337 ATOM 193 CA CYS 14 -4.441 2.185 0.673 1.00 0.00 4HIR 338 ATOM 194 C CYS 14 -3.696 3.075 -0.284 1.00 0.00 4HIR 339 ATOM 195 O CYS 14 -3.683 2.832 -1.465 1.00 0.00 4HIR 340 ATOM 196 CB CYS 14 -3.541 1.969 1.842 1.00 0.00 4HIR 341 ATOM 197 SG CYS 14 -1.913 1.305 1.480 1.00 0.00 4HIR 342 ATOM 198 H CYS 14 -3.948 0.322 -0.274 1.00 0.00 4HIR 343 ATOM 199 HA CYS 14 -5.367 2.653 0.978 1.00 0.00 4HIR 344 ATOM 200 1HB CYS 14 -3.411 2.902 2.327 1.00 0.00 4HIR 345 ATOM 201 2HB CYS 14 -4.010 1.324 2.520 1.00 0.00 4HIR 346 ATOM 203 N LEU 15 -3.071 4.089 0.261 1.00 0.00 4HIR 347 ATOM 204 CA LEU 15 -2.244 4.986 -0.583 1.00 0.00 4HIR 348 ATOM 205 C LEU 15 -0.791 4.839 -0.201 1.00 0.00 4HIR 349 ATOM 206 O LEU 15 -0.425 5.056 0.938 1.00 0.00 4HIR 350 ATOM 207 CB LEU 15 -2.665 6.427 -0.386 1.00 0.00 4HIR 351 ATOM 208 CG LEU 15 -4.159 6.501 -0.535 1.00 0.00 4HIR 352 ATOM 209 CD1 LEU 15 -4.611 7.936 -0.338 1.00 0.00 4HIR 353 ATOM 210 CD2 LEU 15 -4.571 6.004 -1.916 1.00 0.00 4HIR 354 ATOM 211 H LEU 15 -3.155 4.258 1.222 1.00 0.00 4HIR 355 ATOM 212 HA LEU 15 -2.374 4.720 -1.597 1.00 0.00 4HIR 356 ATOM 213 1HB LEU 15 -2.378 6.761 0.599 1.00 0.00 4HIR 357 ATOM 214 2HB LEU 15 -2.191 7.051 -1.130 1.00 0.00 4HIR 358 ATOM 215 HG LEU 15 -4.596 5.882 0.191 1.00 0.00 4HIR 359 ATOM 216 1HD1 LEU 15 -4.123 8.568 -1.062 1.00 0.00 4HIR 360 ATOM 217 2HD1 LEU 15 -5.679 8.001 -0.462 1.00 0.00 4HIR 361 ATOM 218 3HD1 LEU 15 -4.349 8.263 0.657 1.00 0.00 4HIR 362 ATOM 219 1HD2 LEU 15 -3.791 6.219 -2.633 1.00 0.00 4HIR 363 ATOM 220 2HD2 LEU 15 -4.731 4.937 -1.870 1.00 0.00 4HIR 364 ATOM 221 3HD2 LEU 15 -5.480 6.485 -2.226 1.00 0.00 4HIR 365 ATOM 222 N CYS 16 0.007 4.472 -1.155 1.00 0.00 4HIR 366 ATOM 223 CA CYS 16 1.476 4.297 -0.851 1.00 0.00 4HIR 367 ATOM 224 C CYS 16 2.325 5.076 -1.852 1.00 0.00 4HIR 368 ATOM 225 O CYS 16 3.396 5.549 -1.526 1.00 0.00 4HIR 369 ATOM 226 CB CYS 16 1.840 2.808 -0.892 1.00 0.00 4HIR 370 ATOM 227 SG CYS 16 3.427 2.354 -1.636 1.00 0.00 4HIR 371 ATOM 228 H CYS 16 -0.356 4.325 -2.077 1.00 0.00 4HIR 372 ATOM 229 HA CYS 16 1.681 4.680 0.136 1.00 0.00 4HIR 373 ATOM 230 1HB CYS 16 1.844 2.440 0.124 1.00 0.00 4HIR 374 ATOM 231 2HB CYS 16 1.067 2.285 -1.420 1.00 0.00 4HIR 375 ATOM 233 N GLU 17 1.834 5.194 -3.048 1.00 0.00 4HIR 376 ATOM 234 CA GLU 17 2.582 5.984 -4.062 1.00 0.00 4HIR 377 ATOM 235 C GLU 17 2.172 7.459 -3.941 1.00 0.00 4HIR 378 ATOM 236 O GLU 17 1.325 7.942 -4.664 1.00 0.00 4HIR 379 ATOM 237 CB GLU 17 2.248 5.436 -5.463 1.00 0.00 4HIR 380 ATOM 238 CG GLU 17 3.528 4.911 -6.126 1.00 0.00 4HIR 381 ATOM 239 CD GLU 17 4.428 6.092 -6.501 1.00 0.00 4HIR 382 ATOM 240 OE1 GLU 17 3.958 7.205 -6.334 1.00 0.00 4HIR 383 ATOM 241 OE2 GLU 17 5.534 5.813 -6.937 1.00 0.00 4HIR 384 ATOM 242 H GLU 17 0.984 4.768 -3.277 1.00 0.00 4HIR 385 ATOM 243 HA GLU 17 3.639 5.895 -3.873 1.00 0.00 4HIR 386 ATOM 244 1HB GLU 17 1.533 4.629 -5.374 1.00 0.00 4HIR 387 ATOM 245 2HB GLU 17 1.826 6.215 -6.075 1.00 0.00 4HIR 388 ATOM 246 1HG GLU 17 4.056 4.260 -5.444 1.00 0.00 4HIR 389 ATOM 247 2HG GLU 17 3.277 4.359 -7.019 1.00 0.00 4HIR 390 ATOM 249 N GLY 18 2.778 8.143 -3.006 1.00 0.00 4HIR 391 ATOM 250 CA GLY 18 2.407 9.568 -2.792 1.00 0.00 4HIR 392 ATOM 251 C GLY 18 0.957 9.654 -2.310 1.00 0.00 4HIR 393 ATOM 252 O GLY 18 0.698 9.785 -1.130 1.00 0.00 4HIR 394 ATOM 253 H GLY 18 3.467 7.720 -2.451 1.00 0.00 4HIR 395 ATOM 254 1HA GLY 18 3.061 10.003 -2.048 1.00 0.00 4HIR 396 ATOM 255 2HA GLY 18 2.510 10.109 -3.721 1.00 0.00 4HIR 397 ATOM 256 N SER 19 0.045 9.582 -3.240 1.00 0.00 4HIR 398 ATOM 257 CA SER 19 -1.391 9.626 -2.868 1.00 0.00 4HIR 399 ATOM 258 C SER 19 -2.188 8.678 -3.719 1.00 0.00 4HIR 400 ATOM 259 O SER 19 -3.389 8.549 -3.588 1.00 0.00 4HIR 401 ATOM 260 CB SER 19 -1.888 11.021 -3.099 1.00 0.00 4HIR 402 ATOM 261 OG SER 19 -2.951 10.864 -4.027 1.00 0.00 4HIR 403 ATOM 262 H SER 19 0.303 9.531 -4.165 1.00 0.00 4HIR 404 ATOM 263 HA SER 19 -1.488 9.352 -1.872 1.00 0.00 4HIR 405 ATOM 264 1HB SER 19 -2.239 11.469 -2.183 1.00 0.00 4HIR 406 ATOM 265 2HB SER 19 -1.106 11.599 -3.534 1.00 0.00 4HIR 407 ATOM 266 HG SER 19 -3.319 11.731 -4.205 1.00 0.00 4HIR 408 ATOM 267 N ASN 20 -1.496 8.043 -4.559 1.00 0.00 4HIR 409 ATOM 268 CA ASN 20 -2.143 7.071 -5.480 1.00 0.00 4HIR 410 ATOM 269 C ASN 20 -2.313 5.720 -4.791 1.00 0.00 4HIR 411 ATOM 270 O ASN 20 -1.523 5.342 -3.935 1.00 0.00 4HIR 412 ATOM 271 CB ASN 20 -1.272 6.903 -6.724 1.00 0.00 4HIR 413 ATOM 272 CG ASN 20 -1.820 7.795 -7.840 1.00 0.00 4HIR 414 ATOM 273 OD1 ASN 20 -2.335 7.320 -8.830 1.00 0.00 4HIR 415 ATOM 274 ND2 ASN 20 -1.727 9.091 -7.716 1.00 0.00 4HIR 416 ATOM 275 H ASN 20 -0.546 8.201 -4.586 1.00 0.00 4HIR 417 ATOM 276 HA ASN 20 -3.113 7.447 -5.766 1.00 0.00 4HIR 418 ATOM 277 1HB ASN 20 -0.257 7.190 -6.503 1.00 0.00 4HIR 419 ATOM 278 2HB ASN 20 -1.293 5.875 -7.047 1.00 0.00 4HIR 420 ATOM 279 1HD2 ASN 20 -1.204 9.609 -8.363 1.00 0.00 4HIR 421 ATOM 280 2HD2 ASN 20 -2.185 9.547 -6.978 1.00 0.00 4HIR 422 ATOM 281 N VAL 21 -3.343 5.018 -5.168 1.00 0.00 4HIR 423 ATOM 282 CA VAL 21 -3.591 3.715 -4.534 1.00 0.00 4HIR 424 ATOM 283 C VAL 21 -2.534 2.718 -4.921 1.00 0.00 4HIR 425 ATOM 284 O VAL 21 -1.993 2.755 -6.010 1.00 0.00 4HIR 426 ATOM 285 CB VAL 21 -4.970 3.202 -4.947 1.00 0.00 4HIR 427 ATOM 286 CG1 VAL 21 -5.012 1.667 -4.901 1.00 0.00 4HIR 428 ATOM 287 CG2 VAL 21 -6.021 3.738 -3.984 1.00 0.00 4HIR 429 ATOM 288 H VAL 21 -3.947 5.354 -5.851 1.00 0.00 4HIR 430 ATOM 289 HA VAL 21 -3.558 3.849 -3.496 1.00 0.00 4HIR 431 ATOM 290 HB VAL 21 -5.184 3.539 -5.932 1.00 0.00 4HIR 432 ATOM 291 1HG1 VAL 21 -4.564 1.313 -3.984 1.00 0.00 4HIR 433 ATOM 292 2HG1 VAL 21 -6.040 1.335 -4.938 1.00 0.00 4HIR 434 ATOM 293 3HG1 VAL 21 -4.479 1.253 -5.743 1.00 0.00 4HIR 435 ATOM 294 1HG2 VAL 21 -5.894 4.799 -3.859 1.00 0.00 4HIR 436 ATOM 295 2HG2 VAL 21 -7.003 3.543 -4.382 1.00 0.00 4HIR 437 ATOM 296 3HG2 VAL 21 -5.921 3.249 -3.023 1.00 0.00 4HIR 438 ATOM 297 N CYS 22 -2.262 1.841 -4.019 1.00 0.00 4HIR 439 ATOM 298 CA CYS 22 -1.236 0.820 -4.296 1.00 0.00 4HIR 440 ATOM 299 C CYS 22 -1.568 -0.470 -3.539 1.00 0.00 4HIR 441 ATOM 300 O CYS 22 -1.419 -0.535 -2.337 1.00 0.00 4HIR 442 ATOM 301 CB CYS 22 0.088 1.373 -3.822 1.00 0.00 4HIR 443 ATOM 302 SG CYS 22 1.414 1.585 -5.042 1.00 0.00 4HIR 444 ATOM 303 H CYS 22 -2.734 1.863 -3.138 1.00 0.00 4HIR 445 ATOM 304 HA CYS 22 -1.194 0.620 -5.348 1.00 0.00 4HIR 446 ATOM 305 1HB CYS 22 -0.099 2.338 -3.380 1.00 0.00 4HIR 447 ATOM 306 2HB CYS 22 0.446 0.725 -3.053 1.00 0.00 4HIR 448 ATOM 308 N GLY 23 -1.995 -1.481 -4.260 1.00 0.00 4HIR 449 ATOM 309 CA GLY 23 -2.393 -2.742 -3.576 1.00 0.00 4HIR 450 ATOM 310 C GLY 23 -3.282 -3.908 -4.026 1.00 0.00 4HIR 451 ATOM 311 O GLY 23 -2.934 -5.052 -3.842 1.00 0.00 4HIR 452 ATOM 312 H GLY 23 -2.015 -1.425 -5.243 1.00 0.00 4HIR 453 ATOM 313 1HA GLY 23 -1.820 -3.129 -4.397 1.00 0.00 4HIR 454 ATOM 314 2HA GLY 23 -3.353 -2.237 -3.602 1.00 0.00 4HIR 455 ATOM 315 N GLN 24 -4.414 -3.605 -4.603 1.00 0.00 4HIR 456 ATOM 316 CA GLN 24 -5.304 -4.705 -5.043 1.00 0.00 4HIR 457 ATOM 317 C GLN 24 -4.551 -5.674 -5.941 1.00 0.00 4HIR 458 ATOM 318 O GLN 24 -4.071 -5.309 -6.995 1.00 0.00 4HIR 459 ATOM 319 CB GLN 24 -6.500 -4.125 -5.802 1.00 0.00 4HIR 460 ATOM 320 CG GLN 24 -7.528 -5.231 -6.046 1.00 0.00 4HIR 461 ATOM 321 CD GLN 24 -7.932 -5.233 -7.522 1.00 0.00 4HIR 462 ATOM 322 OE1 GLN 24 -7.108 -5.386 -8.401 1.00 0.00 4HIR 463 ATOM 323 NE2 GLN 24 -9.189 -5.070 -7.835 1.00 0.00 4HIR 464 ATOM 324 H GLN 24 -4.675 -2.679 -4.736 1.00 0.00 4HIR 465 ATOM 325 HA GLN 24 -5.642 -5.233 -4.180 1.00 0.00 4HIR 466 ATOM 326 1HB GLN 24 -6.951 -3.342 -5.222 1.00 0.00 4HIR 467 ATOM 327 2HB GLN 24 -6.170 -3.720 -6.744 1.00 0.00 4HIR 468 ATOM 328 1HG GLN 24 -7.102 -6.190 -5.789 1.00 0.00 4HIR 469 ATOM 329 2HG GLN 24 -8.402 -5.056 -5.437 1.00 0.00 4HIR 470 ATOM 330 1HE2 GLN 24 -9.430 -4.627 -8.674 1.00 0.00 4HIR 471 ATOM 331 2HE2 GLN 24 -9.891 -5.391 -7.231 1.00 0.00 4HIR 472 ATOM 332 N GLY 25 -4.468 -6.896 -5.501 1.00 0.00 4HIR 473 ATOM 333 CA GLY 25 -3.742 -7.908 -6.300 1.00 0.00 4HIR 474 ATOM 334 C GLY 25 -2.238 -7.765 -6.085 1.00 0.00 4HIR 475 ATOM 335 O GLY 25 -1.485 -8.682 -6.348 1.00 0.00 4HIR 476 ATOM 336 H GLY 25 -4.881 -7.142 -4.647 1.00 0.00 4HIR 477 ATOM 337 1HA GLY 25 -4.055 -8.896 -5.995 1.00 0.00 4HIR 478 ATOM 338 2HA GLY 25 -3.970 -7.768 -7.347 1.00 0.00 4HIR 479 ATOM 339 N ASN 26 -1.832 -6.606 -5.610 1.00 0.00 4HIR 480 ATOM 340 CA ASN 26 -0.400 -6.370 -5.375 1.00 0.00 4HIR 481 ATOM 341 C ASN 26 -0.158 -6.027 -3.899 1.00 0.00 4HIR 482 ATOM 342 O ASN 26 -1.037 -6.176 -3.077 1.00 0.00 4HIR 483 ATOM 343 CB ASN 26 -0.007 -5.188 -6.226 1.00 0.00 4HIR 484 ATOM 344 CG ASN 26 -1.216 -4.732 -7.045 1.00 0.00 4HIR 485 ATOM 345 OD1 ASN 26 -2.082 -4.033 -6.559 1.00 0.00 4HIR 486 ATOM 346 ND2 ASN 26 -1.315 -5.109 -8.292 1.00 0.00 4HIR 487 ATOM 347 H ASN 26 -2.471 -5.883 -5.425 1.00 0.00 4HIR 488 ATOM 348 HA ASN 26 0.166 -7.230 -5.649 1.00 0.00 4HIR 489 ATOM 349 1HB ASN 26 0.301 -4.411 -5.596 1.00 0.00 4HIR 490 ATOM 350 2HB ASN 26 0.790 -5.447 -6.887 1.00 0.00 4HIR 491 ATOM 351 1HD2 ASN 26 -1.649 -4.482 -8.968 1.00 0.00 4HIR 492 ATOM 352 2HD2 ASN 26 -1.054 -6.016 -8.554 1.00 0.00 4HIR 493 ATOM 353 N LYS 27 1.035 -5.590 -3.585 1.00 0.00 4HIR 494 ATOM 354 CA LYS 27 1.298 -5.183 -2.171 1.00 0.00 4HIR 495 ATOM 355 C LYS 27 2.397 -4.126 -2.102 1.00 0.00 4HIR 496 ATOM 356 O LYS 27 3.518 -4.357 -2.514 1.00 0.00 4HIR 497 ATOM 357 CB LYS 27 1.734 -6.401 -1.361 1.00 0.00 4HIR 498 ATOM 358 CG LYS 27 1.555 -6.078 0.126 1.00 0.00 4HIR 499 ATOM 359 CD LYS 27 2.406 -7.041 0.973 1.00 0.00 4HIR 500 ATOM 360 CE LYS 27 3.854 -6.529 1.068 1.00 0.00 4HIR 501 ATOM 361 NZ LYS 27 4.580 -7.231 2.164 1.00 0.00 4HIR 502 ATOM 362 H LYS 27 1.752 -5.553 -4.261 1.00 0.00 4HIR 503 ATOM 363 HA LYS 27 0.392 -4.778 -1.748 1.00 0.00 4HIR 504 ATOM 364 1HB LYS 27 1.126 -7.253 -1.626 1.00 0.00 4HIR 505 ATOM 365 2HB LYS 27 2.769 -6.624 -1.567 1.00 0.00 4HIR 506 ATOM 366 1HG LYS 27 1.854 -5.059 0.312 1.00 0.00 4HIR 507 ATOM 367 2HG LYS 27 0.519 -6.187 0.392 1.00 0.00 4HIR 508 ATOM 368 1HD LYS 27 1.983 -7.116 1.964 1.00 0.00 4HIR 509 ATOM 369 2HD LYS 27 2.401 -8.019 0.515 1.00 0.00 4HIR 510 ATOM 370 1HE LYS 27 4.364 -6.712 0.135 1.00 0.00 4HIR 511 ATOM 371 2HE LYS 27 3.864 -5.466 1.276 1.00 0.00 4HIR 512 ATOM 372 1HZ LYS 27 3.897 -7.745 2.757 1.00 0.00 4HIR 513 ATOM 373 2HZ LYS 27 5.258 -7.903 1.754 1.00 0.00 4HIR 514 ATOM 374 3HZ LYS 27 5.089 -6.534 2.744 1.00 0.00 4HIR 515 ATOM 375 N CYS 28 2.071 -2.979 -1.576 1.00 0.00 4HIR 516 ATOM 376 CA CYS 28 3.124 -1.944 -1.482 1.00 0.00 4HIR 517 ATOM 377 C CYS 28 3.960 -2.120 -0.278 1.00 0.00 4HIR 518 ATOM 378 O CYS 28 3.643 -2.845 0.644 1.00 0.00 4HIR 519 ATOM 379 CB CYS 28 2.546 -0.543 -1.399 1.00 0.00 4HIR 520 ATOM 380 SG CYS 28 3.043 0.656 -2.663 1.00 0.00 4HIR 521 ATOM 381 H CYS 28 1.162 -2.808 -1.256 1.00 0.00 4HIR 522 ATOM 382 HA CYS 28 3.745 -2.018 -2.340 1.00 0.00 4HIR 523 ATOM 383 1HB CYS 28 1.513 -0.624 -1.426 1.00 0.00 4HIR 524 ATOM 384 2HB CYS 28 2.815 -0.130 -0.437 1.00 0.00 4HIR 525 ATOM 386 N ILE 29 5.020 -1.439 -0.335 1.00 0.00 4HIR 526 ATOM 387 CA ILE 29 5.947 -1.393 0.815 1.00 0.00 4HIR 527 ATOM 388 C ILE 29 6.305 0.060 1.101 1.00 0.00 4HIR 528 ATOM 389 O ILE 29 7.262 0.579 0.561 1.00 0.00 4HIR 529 ATOM 390 CB ILE 29 7.219 -2.151 0.490 1.00 0.00 4HIR 530 ATOM 391 CG1 ILE 29 6.909 -3.574 -0.029 1.00 0.00 4HIR 531 ATOM 392 CG2 ILE 29 8.082 -2.236 1.750 1.00 0.00 4HIR 532 ATOM 393 CD1 ILE 29 6.563 -4.513 1.140 1.00 0.00 4HIR 533 ATOM 394 H ILE 29 5.216 -0.948 -1.168 1.00 0.00 4HIR 534 ATOM 395 HA ILE 29 5.478 -1.813 1.664 1.00 0.00 4HIR 535 ATOM 396 HB ILE 29 7.742 -1.612 -0.257 1.00 0.00 4HIR 536 ATOM 397 1HG1 ILE 29 6.083 -3.539 -0.720 1.00 0.00 4HIR 537 ATOM 398 2HG1 ILE 29 7.775 -3.959 -0.548 1.00 0.00 4HIR 538 ATOM 399 1HG2 ILE 29 7.483 -2.578 2.584 1.00 0.00 4HIR 539 ATOM 400 2HG2 ILE 29 8.895 -2.926 1.588 1.00 0.00 4HIR 540 ATOM 401 3HG2 ILE 29 8.480 -1.264 1.979 1.00 0.00 4HIR 541 ATOM 402 1HD1 ILE 29 5.827 -4.055 1.780 1.00 0.00 4HIR 542 ATOM 403 2HD1 ILE 29 6.169 -5.428 0.753 1.00 0.00 4HIR 543 ATOM 404 3HD1 ILE 29 7.447 -4.733 1.714 1.00 0.00 4HIR 544 ATOM 405 N LEU 30 5.537 0.694 1.944 1.00 0.00 4HIR 545 ATOM 406 CA LEU 30 5.810 2.127 2.218 1.00 0.00 4HIR 546 ATOM 407 C LEU 30 6.965 2.300 3.219 1.00 0.00 4HIR 547 ATOM 408 O LEU 30 6.942 1.773 4.313 1.00 0.00 4HIR 548 ATOM 409 CB LEU 30 4.535 2.807 2.703 1.00 0.00 4HIR 549 ATOM 410 CG LEU 30 4.228 2.391 4.117 1.00 0.00 4HIR 550 ATOM 411 CD1 LEU 30 4.712 3.466 5.097 1.00 0.00 4HIR 551 ATOM 412 CD2 LEU 30 2.709 2.232 4.264 1.00 0.00 4HIR 552 ATOM 413 H LEU 30 4.795 0.236 2.381 1.00 0.00 4HIR 553 ATOM 414 HA LEU 30 6.082 2.574 1.323 1.00 0.00 4HIR 554 ATOM 415 1HB LEU 30 4.655 3.871 2.657 1.00 0.00 4HIR 555 ATOM 416 2HB LEU 30 3.720 2.514 2.062 1.00 0.00 4HIR 556 ATOM 417 HG LEU 30 4.717 1.466 4.316 1.00 0.00 4HIR 557 ATOM 418 1HD1 LEU 30 5.639 3.893 4.754 1.00 0.00 4HIR 558 ATOM 419 2HD1 LEU 30 3.970 4.245 5.175 1.00 0.00 4HIR 559 ATOM 420 3HD1 LEU 30 4.864 3.025 6.072 1.00 0.00 4HIR 560 ATOM 421 1HD2 LEU 30 2.202 3.012 3.713 1.00 0.00 4HIR 561 ATOM 422 2HD2 LEU 30 2.403 1.272 3.879 1.00 0.00 4HIR 562 ATOM 423 3HD2 LEU 30 2.435 2.307 5.304 1.00 0.00 4HIR 563 ATOM 424 N GLY 31 7.976 3.027 2.810 1.00 0.00 4HIR 564 ATOM 425 CA GLY 31 9.117 3.245 3.723 1.00 0.00 4HIR 565 ATOM 426 C GLY 31 9.725 1.907 4.103 1.00 0.00 4HIR 566 ATOM 427 O GLY 31 9.321 1.297 5.072 1.00 0.00 4HIR 567 ATOM 428 H GLY 31 7.993 3.403 1.907 1.00 0.00 4HIR 568 ATOM 429 1HA GLY 31 9.858 3.852 3.234 1.00 0.00 4HIR 569 ATOM 430 2HA GLY 31 8.772 3.749 4.615 1.00 0.00 4HIR 570 ATOM 431 N SER 32 10.685 1.465 3.339 1.00 0.00 4HIR 571 ATOM 432 CA SER 32 11.298 0.185 3.665 1.00 0.00 4HIR 572 ATOM 433 C SER 32 12.064 0.338 4.934 1.00 0.00 4HIR 573 ATOM 434 O SER 32 11.572 0.866 5.892 1.00 0.00 4HIR 574 ATOM 435 CB SER 32 12.234 -0.244 2.527 1.00 0.00 4HIR 575 ATOM 436 OG SER 32 11.367 -0.421 1.415 1.00 0.00 4HIR 576 ATOM 437 H SER 32 11.018 1.990 2.592 1.00 0.00 4HIR 577 ATOM 438 HA SER 32 10.557 -0.551 3.802 1.00 0.00 4HIR 578 ATOM 439 1HB SER 32 12.957 0.519 2.317 1.00 0.00 4HIR 579 ATOM 440 2HB SER 32 12.727 -1.173 2.768 1.00 0.00 4HIR 580 ATOM 441 HG SER 32 11.468 -1.323 1.102 1.00 0.00 4HIR 581 ATOM 442 N ASP 33 13.268 0.018 4.851 1.00 0.00 4HIR 582 ATOM 443 CA ASP 33 14.121 -0.002 6.070 1.00 0.00 4HIR 583 ATOM 444 C ASP 33 14.421 1.416 6.468 1.00 0.00 4HIR 584 ATOM 445 O ASP 33 15.538 1.887 6.392 1.00 0.00 4HIR 585 ATOM 446 CB ASP 33 15.425 -0.740 5.765 1.00 0.00 4HIR 586 ATOM 447 CG ASP 33 15.221 -2.238 5.989 1.00 0.00 4HIR 587 ATOM 448 OD1 ASP 33 15.215 -2.939 4.990 1.00 0.00 4HIR 588 ATOM 449 OD2 ASP 33 15.080 -2.598 7.146 1.00 0.00 4HIR 589 ATOM 450 H ASP 33 13.622 -0.167 3.997 1.00 0.00 4HIR 590 ATOM 451 HA ASP 33 13.593 -0.498 6.872 1.00 0.00 4HIR 591 ATOM 452 1HB ASP 33 15.714 -0.568 4.738 1.00 0.00 4HIR 592 ATOM 453 2HB ASP 33 16.208 -0.385 6.418 1.00 0.00 4HIR 593 ATOM 455 N GLY 34 13.386 2.060 6.889 1.00 0.00 4HIR 594 ATOM 456 CA GLY 34 13.493 3.473 7.259 1.00 0.00 4HIR 595 ATOM 457 C GLY 34 13.771 4.264 6.004 1.00 0.00 4HIR 596 ATOM 458 O GLY 34 14.367 5.323 6.061 1.00 0.00 4HIR 597 ATOM 459 H GLY 34 12.536 1.604 6.943 1.00 0.00 4HIR 598 ATOM 460 1HA GLY 34 12.566 3.804 7.702 1.00 0.00 4HIR 599 ATOM 461 2HA GLY 34 14.302 3.607 7.962 1.00 0.00 4HIR 600 ATOM 462 N GLU 35 13.320 3.733 4.873 1.00 0.00 4HIR 601 ATOM 463 CA GLU 35 13.617 4.400 3.607 1.00 0.00 4HIR 602 ATOM 464 C GLU 35 12.371 4.891 2.902 1.00 0.00 4HIR 603 ATOM 465 O GLU 35 11.493 5.498 3.481 1.00 0.00 4HIR 604 ATOM 466 CB GLU 35 14.352 3.414 2.704 1.00 0.00 4HIR 605 ATOM 467 CG GLU 35 15.443 2.703 3.512 1.00 0.00 4HIR 606 ATOM 468 CD GLU 35 16.648 2.434 2.608 1.00 0.00 4HIR 607 ATOM 469 OE1 GLU 35 16.665 1.357 2.036 1.00 0.00 4HIR 608 ATOM 470 OE2 GLU 35 17.484 3.321 2.542 1.00 0.00 4HIR 609 ATOM 471 H GLU 35 12.796 2.913 4.869 1.00 0.00 4HIR 610 ATOM 472 HA GLU 35 14.241 5.221 3.783 1.00 0.00 4HIR 611 ATOM 473 1HB GLU 35 13.655 2.692 2.319 1.00 0.00 4HIR 612 ATOM 474 2HB GLU 35 14.803 3.947 1.879 1.00 0.00 4HIR 613 ATOM 475 1HG GLU 35 15.749 3.326 4.340 1.00 0.00 4HIR 614 ATOM 476 2HG GLU 35 15.065 1.765 3.891 1.00 0.00 4HIR 615 ATOM 478 N LYS 36 12.363 4.617 1.661 1.00 0.00 4HIR 616 ATOM 479 CA LYS 36 11.287 5.114 0.762 1.00 0.00 4HIR 617 ATOM 480 C LYS 36 10.128 4.121 0.582 1.00 0.00 4HIR 618 ATOM 481 O LYS 36 10.152 3.011 1.078 1.00 0.00 4HIR 619 ATOM 482 CB LYS 36 11.904 5.397 -0.610 1.00 0.00 4HIR 620 ATOM 483 CG LYS 36 12.552 6.785 -0.596 1.00 0.00 4HIR 621 ATOM 484 CD LYS 36 13.178 7.075 -1.977 1.00 0.00 4HIR 622 ATOM 485 CE LYS 36 14.586 6.451 -2.074 1.00 0.00 4HIR 623 ATOM 486 NZ LYS 36 14.495 4.984 -2.315 1.00 0.00 4HIR 624 ATOM 487 H LYS 36 13.053 4.064 1.322 1.00 0.00 4HIR 625 ATOM 488 HA LYS 36 10.906 6.022 1.172 1.00 0.00 4HIR 626 ATOM 489 1HB LYS 36 12.650 4.650 -0.828 1.00 0.00 4HIR 627 ATOM 490 2HB LYS 36 11.136 5.362 -1.369 1.00 0.00 4HIR 628 ATOM 491 1HG LYS 36 11.797 7.529 -0.384 1.00 0.00 4HIR 629 ATOM 492 2HG LYS 36 13.306 6.825 0.172 1.00 0.00 4HIR 630 ATOM 493 1HD LYS 36 12.548 6.659 -2.749 1.00 0.00 4HIR 631 ATOM 494 2HD LYS 36 13.248 8.142 -2.121 1.00 0.00 4HIR 632 ATOM 495 1HE LYS 36 15.120 6.904 -2.895 1.00 0.00 4HIR 633 ATOM 496 2HE LYS 36 15.135 6.628 -1.163 1.00 0.00 4HIR 634 ATOM 497 1HZ LYS 36 13.612 4.768 -2.819 1.00 0.00 4HIR 635 ATOM 498 2HZ LYS 36 15.306 4.676 -2.889 1.00 0.00 4HIR 636 ATOM 499 3HZ LYS 36 14.506 4.481 -1.403 1.00 0.00 4HIR 637 ATOM 500 N ASN 37 9.130 4.572 -0.146 1.00 0.00 4HIR 638 ATOM 501 CA ASN 37 7.955 3.709 -0.455 1.00 0.00 4HIR 639 ATOM 502 C ASN 37 8.036 3.192 -1.899 1.00 0.00 4HIR 640 ATOM 503 O ASN 37 8.626 3.827 -2.752 1.00 0.00 4HIR 641 ATOM 504 CB ASN 37 6.697 4.575 -0.345 1.00 0.00 4HIR 642 ATOM 505 CG ASN 37 6.678 5.289 1.003 1.00 0.00 4HIR 643 ATOM 506 OD1 ASN 37 7.589 5.172 1.795 1.00 0.00 4HIR 644 ATOM 507 ND2 ASN 37 5.665 6.047 1.296 1.00 0.00 4HIR 645 ATOM 508 H ASN 37 9.144 5.494 -0.466 1.00 0.00 4HIR 646 ATOM 509 HA ASN 37 7.911 2.873 0.241 1.00 0.00 4HIR 647 ATOM 510 1HB ASN 37 6.702 5.316 -1.131 1.00 0.00 4HIR 648 ATOM 511 2HB ASN 37 5.814 3.965 -0.446 1.00 0.00 4HIR 649 ATOM 512 1HD2 ASN 37 5.531 6.350 2.216 1.00 0.00 4HIR 650 ATOM 513 2HD2 ASN 37 5.038 6.316 0.594 1.00 0.00 4HIR 651 ATOM 514 N GLN 38 7.445 2.055 -2.144 1.00 0.00 4HIR 652 ATOM 515 CA GLN 38 7.418 1.535 -3.534 1.00 0.00 4HIR 653 ATOM 516 C GLN 38 6.329 0.470 -3.684 1.00 0.00 4HIR 654 ATOM 517 O GLN 38 5.938 -0.157 -2.718 1.00 0.00 4HIR 655 ATOM 518 CB GLN 38 8.779 0.930 -3.891 1.00 0.00 4HIR 656 ATOM 519 CG GLN 38 8.764 0.501 -5.365 1.00 0.00 4HIR 657 ATOM 520 CD GLN 38 10.189 0.573 -5.924 1.00 0.00 4HIR 658 ATOM 521 OE1 GLN 38 10.837 1.602 -5.872 1.00 0.00 4HIR 659 ATOM 522 NE2 GLN 38 10.713 -0.491 -6.468 1.00 0.00 4HIR 660 ATOM 523 H GLN 38 7.017 1.559 -1.432 1.00 0.00 4HIR 661 ATOM 524 HA GLN 38 7.199 2.349 -4.189 1.00 0.00 4HIR 662 ATOM 525 1HB GLN 38 9.556 1.662 -3.733 1.00 0.00 4HIR 663 ATOM 526 2HB GLN 38 8.969 0.070 -3.265 1.00 0.00 4HIR 664 ATOM 527 1HG GLN 38 8.398 -0.511 -5.447 1.00 0.00 4HIR 665 ATOM 528 2HG GLN 38 8.123 1.159 -5.936 1.00 0.00 4HIR 666 ATOM 529 1HE2 GLN 38 11.492 -0.409 -7.056 1.00 0.00 4HIR 667 ATOM 530 2HE2 GLN 38 10.326 -1.374 -6.285 1.00 0.00 4HIR 668 ATOM 531 N CYS 39 5.866 0.284 -4.899 1.00 0.00 4HIR 669 ATOM 532 CA CYS 39 4.801 -0.739 -5.135 1.00 0.00 4HIR 670 ATOM 533 C CYS 39 5.316 -2.007 -5.761 1.00 0.00 4HIR 671 ATOM 534 O CYS 39 5.884 -1.995 -6.836 1.00 0.00 4HIR 672 ATOM 535 CB CYS 39 3.712 -0.176 -6.026 1.00 0.00 4HIR 673 ATOM 536 SG CYS 39 2.011 -0.296 -5.405 1.00 0.00 4HIR 674 ATOM 537 H CYS 39 6.215 0.814 -5.646 1.00 0.00 4HIR 675 ATOM 538 HA CYS 39 4.372 -0.993 -4.215 1.00 0.00 4HIR 676 ATOM 539 1HB CYS 39 3.933 0.864 -6.210 1.00 0.00 4HIR 677 ATOM 540 2HB CYS 39 3.755 -0.695 -6.963 1.00 0.00 4HIR 678 ATOM 542 N VAL 40 5.107 -3.092 -5.055 1.00 0.00 4HIR 679 ATOM 543 CA VAL 40 5.454 -4.419 -5.641 1.00 0.00 4HIR 680 ATOM 544 C VAL 40 4.302 -5.392 -5.471 1.00 0.00 4HIR 681 ATOM 545 O VAL 40 3.448 -5.222 -4.640 1.00 0.00 4HIR 682 ATOM 546 CB VAL 40 6.686 -4.974 -4.958 1.00 0.00 4HIR 683 ATOM 547 CG1 VAL 40 6.512 -4.850 -3.448 1.00 0.00 4HIR 684 ATOM 548 CG2 VAL 40 6.873 -6.445 -5.329 1.00 0.00 4HIR 685 ATOM 549 H VAL 40 4.751 -3.023 -4.115 1.00 0.00 4HIR 686 ATOM 550 HA VAL 40 5.654 -4.299 -6.695 1.00 0.00 4HIR 687 ATOM 551 HB VAL 40 7.532 -4.425 -5.280 1.00 0.00 4HIR 688 ATOM 552 1HG1 VAL 40 5.575 -5.300 -3.153 1.00 0.00 4HIR 689 ATOM 553 2HG1 VAL 40 7.321 -5.354 -2.945 1.00 0.00 4HIR 690 ATOM 554 3HG1 VAL 40 6.510 -3.807 -3.167 1.00 0.00 4HIR 691 ATOM 555 1HG2 VAL 40 6.698 -6.582 -6.386 1.00 0.00 4HIR 692 ATOM 556 2HG2 VAL 40 7.882 -6.753 -5.098 1.00 0.00 4HIR 693 ATOM 557 3HG2 VAL 40 6.184 -7.052 -4.770 1.00 0.00 4HIR 694 ATOM 558 N THR 41 4.313 -6.381 -6.280 1.00 0.00 4HIR 695 ATOM 559 CA THR 41 3.274 -7.389 -6.232 1.00 0.00 4HIR 696 ATOM 560 C THR 41 3.558 -8.448 -5.158 1.00 0.00 4HIR 697 ATOM 561 O THR 41 4.689 -8.822 -4.935 1.00 0.00 4HIR 698 ATOM 562 CB THR 41 3.248 -8.045 -7.585 1.00 0.00 4HIR 699 ATOM 563 OG1 THR 41 4.224 -7.350 -8.349 1.00 0.00 4HIR 700 ATOM 564 CG2 THR 41 1.920 -7.821 -8.315 1.00 0.00 4HIR 701 ATOM 565 H THR 41 4.994 -6.449 -6.930 1.00 0.00 4HIR 702 ATOM 566 HA THR 41 2.354 -6.925 -6.041 1.00 0.00 4HIR 703 ATOM 567 HB THR 41 3.497 -9.057 -7.507 1.00 0.00 4HIR 704 ATOM 568 HG1 THR 41 4.019 -6.413 -8.312 1.00 0.00 4HIR 705 ATOM 569 1HG2 THR 41 1.096 -8.049 -7.655 1.00 0.00 4HIR 706 ATOM 570 2HG2 THR 41 1.847 -6.791 -8.633 1.00 0.00 4HIR 707 ATOM 571 3HG2 THR 41 1.869 -8.465 -9.182 1.00 0.00 4HIR 708 ATOM 572 N GLY 42 2.515 -8.917 -4.525 1.00 0.00 4HIR 709 ATOM 573 CA GLY 42 2.705 -9.950 -3.466 1.00 0.00 4HIR 710 ATOM 574 C GLY 42 1.697 -10.643 -2.542 1.00 0.00 4HIR 711 ATOM 575 O GLY 42 0.737 -11.232 -2.997 1.00 0.00 4HIR 712 ATOM 576 H GLY 42 1.617 -8.594 -4.747 1.00 0.00 4HIR 713 ATOM 577 1HA GLY 42 2.136 -10.516 -4.191 1.00 0.00 4HIR 714 ATOM 578 2HA GLY 42 2.386 -9.113 -2.866 1.00 0.00 4HIR 715 ATOM 579 N GLU 43 1.949 -10.558 -1.259 1.00 0.00 4HIR 716 ATOM 580 CA GLU 43 1.025 -11.198 -0.271 1.00 0.00 4HIR 717 ATOM 581 C GLU 43 0.667 -10.201 0.836 1.00 0.00 4HIR 718 ATOM 582 O GLU 43 1.496 -9.870 1.663 1.00 0.00 4HIR 719 ATOM 583 CB GLU 43 1.733 -12.406 0.363 1.00 0.00 4HIR 720 ATOM 584 CG GLU 43 1.445 -13.671 -0.458 1.00 0.00 4HIR 721 ATOM 585 CD GLU 43 2.027 -14.884 0.271 1.00 0.00 4HIR 722 ATOM 586 OE1 GLU 43 1.303 -15.863 0.357 1.00 0.00 4HIR 723 ATOM 587 OE2 GLU 43 3.161 -14.763 0.702 1.00 0.00 4HIR 724 ATOM 588 H GLU 43 2.743 -10.077 -0.946 1.00 0.00 4HIR 725 ATOM 589 HA GLU 43 0.125 -11.515 -0.768 1.00 0.00 4HIR 726 ATOM 590 1HB GLU 43 2.798 -12.227 0.388 1.00 0.00 4HIR 727 ATOM 591 2HB GLU 43 1.376 -12.542 1.372 1.00 0.00 4HIR 728 ATOM 592 1HG GLU 43 0.380 -13.806 -0.572 1.00 0.00 4HIR 729 ATOM 593 2HG GLU 43 1.902 -13.588 -1.433 1.00 0.00 4HIR 730 ATOM 595 N GLY 44 -0.554 -9.744 0.833 1.00 0.00 4HIR 731 ATOM 596 CA GLY 44 -0.965 -8.766 1.885 1.00 0.00 4HIR 732 ATOM 597 C GLY 44 -2.484 -8.760 2.063 1.00 0.00 4HIR 733 ATOM 598 O GLY 44 -3.164 -9.678 1.649 1.00 0.00 4HIR 734 ATOM 599 H GLY 44 -1.194 -10.038 0.152 1.00 0.00 4HIR 735 ATOM 600 1HA GLY 44 -0.500 -9.036 2.821 1.00 0.00 4HIR 736 ATOM 601 2HA GLY 44 -0.640 -7.783 1.602 1.00 0.00 4HIR 737 ATOM 602 N THR 45 -2.980 -7.716 2.683 1.00 0.00 4HIR 738 ATOM 603 CA THR 45 -4.448 -7.633 2.919 1.00 0.00 4HIR 739 ATOM 604 C THR 45 -4.935 -6.162 2.789 1.00 0.00 4HIR 740 ATOM 605 O THR 45 -4.168 -5.238 2.978 1.00 0.00 4HIR 741 ATOM 606 CB THR 45 -4.712 -8.165 4.333 1.00 0.00 4HIR 742 ATOM 607 OG1 THR 45 -5.695 -9.176 4.169 1.00 0.00 4HIR 743 ATOM 608 CG2 THR 45 -5.363 -7.125 5.257 1.00 0.00 4HIR 744 ATOM 609 H THR 45 -2.391 -7.005 2.999 1.00 0.00 4HIR 745 ATOM 610 HA THR 45 -4.942 -8.255 2.206 1.00 0.00 4HIR 746 ATOM 611 HB THR 45 -3.816 -8.570 4.762 1.00 0.00 4HIR 747 ATOM 612 HG1 THR 45 -5.581 -9.561 3.297 1.00 0.00 4HIR 748 ATOM 613 1HG2 THR 45 -4.720 -6.261 5.351 1.00 0.00 4HIR 749 ATOM 614 2HG2 THR 45 -6.318 -6.821 4.860 1.00 0.00 4HIR 750 ATOM 615 3HG2 THR 45 -5.513 -7.558 6.235 1.00 0.00 4HIR 751 ATOM 616 N PRO 46 -6.215 -5.979 2.469 1.00 0.00 4HIR 752 ATOM 617 CA PRO 46 -6.820 -4.634 2.418 1.00 0.00 4HIR 753 ATOM 618 C PRO 46 -6.613 -3.876 3.743 1.00 0.00 4HIR 754 ATOM 619 O PRO 46 -6.554 -4.478 4.796 1.00 0.00 4HIR 755 ATOM 620 CB PRO 46 -8.322 -4.896 2.204 1.00 0.00 4HIR 756 ATOM 621 CG PRO 46 -8.511 -6.427 2.014 1.00 0.00 4HIR 757 ATOM 622 CD PRO 46 -7.135 -7.081 2.136 1.00 0.00 4HIR 758 ATOM 623 HA PRO 46 -6.411 -4.068 1.583 1.00 0.00 4HIR 759 ATOM 624 1HB PRO 46 -8.879 -4.568 3.066 1.00 0.00 4HIR 760 ATOM 625 2HB PRO 46 -8.666 -4.372 1.331 1.00 0.00 4HIR 761 ATOM 626 1HG PRO 46 -9.167 -6.816 2.774 1.00 0.00 4HIR 762 ATOM 627 2HG PRO 46 -8.925 -6.631 1.039 1.00 0.00 4HIR 763 ATOM 628 1HD PRO 46 -7.134 -7.819 2.919 1.00 0.00 4HIR 764 ATOM 629 2HD PRO 46 -6.853 -7.530 1.195 1.00 0.00 4HIR 765 ATOM 630 N GLU 47 -6.505 -2.567 3.667 1.00 0.00 4HIR 766 ATOM 631 CA GLU 47 -6.333 -1.784 4.897 1.00 0.00 4HIR 767 ATOM 632 C GLU 47 -7.685 -1.495 5.616 1.00 0.00 4HIR 768 ATOM 633 O GLU 47 -7.734 -1.504 6.830 1.00 0.00 4HIR 769 ATOM 634 CB GLU 47 -5.614 -0.466 4.567 1.00 0.00 4HIR 770 ATOM 635 CG GLU 47 -5.539 0.386 5.824 1.00 0.00 4HIR 771 ATOM 636 CD GLU 47 -6.620 1.470 5.766 1.00 0.00 4HIR 772 ATOM 637 OE1 GLU 47 -6.332 2.491 5.164 1.00 0.00 4HIR 773 ATOM 638 OE2 GLU 47 -7.673 1.217 6.329 1.00 0.00 4HIR 774 ATOM 639 H GLU 47 -6.520 -2.121 2.816 1.00 0.00 4HIR 775 ATOM 640 HA GLU 47 -5.714 -2.353 5.560 1.00 0.00 4HIR 776 ATOM 641 1HB GLU 47 -4.618 -0.677 4.220 1.00 0.00 4HIR 777 ATOM 642 2HB GLU 47 -6.141 0.068 3.804 1.00 0.00 4HIR 778 ATOM 643 1HG GLU 47 -5.697 -0.232 6.692 1.00 0.00 4HIR 779 ATOM 644 2HG GLU 47 -4.571 0.850 5.886 1.00 0.00 4HIR 780 ATOM 646 N PRO 48 -8.768 -1.242 4.869 1.00 0.00 4HIR 781 ATOM 647 CA PRO 48 -10.051 -0.911 5.505 1.00 0.00 4HIR 782 ATOM 648 C PRO 48 -10.540 -2.064 6.384 1.00 0.00 4HIR 783 ATOM 649 O PRO 48 -10.400 -3.218 6.033 1.00 0.00 4HIR 784 ATOM 650 CB PRO 48 -11.032 -0.676 4.346 1.00 0.00 4HIR 785 ATOM 651 CG PRO 48 -10.227 -0.801 3.021 1.00 0.00 4HIR 786 ATOM 652 CD PRO 48 -8.808 -1.271 3.389 1.00 0.00 4HIR 787 ATOM 653 HA PRO 48 -9.947 -0.014 6.096 1.00 0.00 4HIR 788 ATOM 654 1HB PRO 48 -11.819 -1.418 4.371 1.00 0.00 4HIR 789 ATOM 655 2HB PRO 48 -11.466 0.310 4.423 1.00 0.00 4HIR 790 ATOM 656 1HG PRO 48 -10.698 -1.522 2.370 1.00 0.00 4HIR 791 ATOM 657 2HG PRO 48 -10.180 0.158 2.528 1.00 0.00 4HIR 792 ATOM 658 1HD PRO 48 -8.656 -2.268 3.031 1.00 0.00 4HIR 793 ATOM 659 2HD PRO 48 -8.077 -0.608 2.975 1.00 0.00 4HIR 794 ATOM 660 N GLN 49 -11.104 -1.724 7.511 1.00 0.00 4HIR 795 ATOM 661 CA GLN 49 -11.604 -2.787 8.431 1.00 0.00 4HIR 796 ATOM 662 C GLN 49 -12.986 -3.271 7.989 1.00 0.00 4HIR 797 ATOM 663 O GLN 49 -13.462 -4.200 8.620 1.00 0.00 4HIR 798 ATOM 664 CB GLN 49 -11.700 -2.212 9.845 1.00 0.00 4HIR 799 ATOM 665 CG GLN 49 -12.896 -1.262 9.924 1.00 0.00 4HIR 800 ATOM 666 CD GLN 49 -14.143 -2.052 10.326 1.00 0.00 4HIR 801 ATOM 667 OE1 GLN 49 -14.203 -2.641 11.387 1.00 0.00 4HIR 802 ATOM 668 NE2 GLN 49 -15.159 -2.089 9.508 1.00 0.00 4HIR 803 ATOM 669 OXT GLN 49 -13.488 -2.683 7.045 1.00 0.00 4HIR 804 ATOM 670 H GLN 49 -11.200 -0.779 7.751 1.00 0.00 4HIR 805 ATOM 671 HA GLN 49 -10.916 -3.619 8.422 1.00 0.00 4HIR 806 ATOM 672 1HB GLN 49 -11.827 -3.015 10.556 1.00 0.00 4HIR 807 ATOM 673 2HB GLN 49 -10.792 -1.673 10.080 1.00 0.00 4HIR 808 ATOM 674 1HG GLN 49 -12.705 -0.495 10.660 1.00 0.00 4HIR 809 ATOM 675 2HG GLN 49 -13.059 -0.800 8.962 1.00 0.00 4HIR 810 ATOM 676 1HE2 GLN 49 -15.443 -2.942 9.117 1.00 0.00 4HIR 811 ATOM 677 2HE2 GLN 49 -15.639 -1.264 9.284 1.00 0.00 4HIR 812 ENDMDL 4HIR 813 MODEL 2 4HIR 814 ATOM 815 N VAL 1 -14.706 6.297 -6.489 1.00 0.00 4HIR 815 ATOM 816 CA VAL 1 -14.367 6.153 -5.046 1.00 0.00 4HIR 816 ATOM 817 C VAL 1 -12.873 5.879 -4.887 1.00 0.00 4HIR 817 ATOM 818 O VAL 1 -12.287 5.154 -5.666 1.00 0.00 4HIR 818 ATOM 819 CB VAL 1 -15.143 4.988 -4.422 1.00 0.00 4HIR 819 ATOM 820 CG1 VAL 1 -15.076 3.776 -5.357 1.00 0.00 4HIR 820 ATOM 821 CG2 VAL 1 -14.504 4.621 -3.080 1.00 0.00 4HIR 821 ATOM 822 1H VAL 1 -13.980 6.873 -6.960 1.00 0.00 4HIR 822 ATOM 823 2H VAL 1 -14.744 5.356 -6.931 1.00 0.00 4HIR 823 ATOM 824 3H VAL 1 -15.632 6.761 -6.581 1.00 0.00 4HIR 824 ATOM 825 HA VAL 1 -14.615 7.069 -4.531 1.00 0.00 4HIR 825 ATOM 826 HB VAL 1 -16.172 5.275 -4.269 1.00 0.00 4HIR 826 ATOM 827 1HG1 VAL 1 -14.052 3.600 -5.654 1.00 0.00 4HIR 827 ATOM 828 2HG1 VAL 1 -15.453 2.902 -4.848 1.00 0.00 4HIR 828 ATOM 829 3HG1 VAL 1 -15.674 3.959 -6.236 1.00 0.00 4HIR 829 ATOM 830 1HG2 VAL 1 -14.136 5.513 -2.594 1.00 0.00 4HIR 830 ATOM 831 2HG2 VAL 1 -15.235 4.146 -2.445 1.00 0.00 4HIR 831 ATOM 832 3HG2 VAL 1 -13.679 3.941 -3.243 1.00 0.00 4HIR 832 ATOM 833 N VAL 2 -12.291 6.478 -3.881 1.00 0.00 4HIR 833 ATOM 834 CA VAL 2 -10.847 6.238 -3.604 1.00 0.00 4HIR 834 ATOM 835 C VAL 2 -10.708 5.573 -2.240 1.00 0.00 4HIR 835 ATOM 836 O VAL 2 -11.654 5.524 -1.479 1.00 0.00 4HIR 836 ATOM 837 CB VAL 2 -10.108 7.581 -3.594 1.00 0.00 4HIR 837 ATOM 838 CG1 VAL 2 -8.594 7.340 -3.622 1.00 0.00 4HIR 838 ATOM 839 CG2 VAL 2 -10.510 8.387 -4.833 1.00 0.00 4HIR 839 ATOM 840 H VAL 2 -12.803 7.087 -3.309 1.00 0.00 4HIR 840 ATOM 841 HA VAL 2 -10.432 5.591 -4.362 1.00 0.00 4HIR 841 ATOM 842 HB VAL 2 -10.370 8.126 -2.704 1.00 0.00 4HIR 842 ATOM 843 1HG1 VAL 2 -8.350 6.604 -4.372 1.00 0.00 4HIR 843 ATOM 844 2HG1 VAL 2 -8.084 8.264 -3.855 1.00 0.00 4HIR 844 ATOM 845 3HG1 VAL 2 -8.262 6.989 -2.657 1.00 0.00 4HIR 845 ATOM 846 1HG2 VAL 2 -10.310 7.810 -5.724 1.00 0.00 4HIR 846 ATOM 847 2HG2 VAL 2 -11.564 8.621 -4.790 1.00 0.00 4HIR 847 ATOM 848 3HG2 VAL 2 -9.943 9.305 -4.868 1.00 0.00 4HIR 848 ATOM 849 N TYR 3 -9.541 5.081 -1.954 1.00 0.00 4HIR 849 ATOM 850 CA TYR 3 -9.341 4.408 -0.641 1.00 0.00 4HIR 850 ATOM 851 C TYR 3 -8.703 5.370 0.355 1.00 0.00 4HIR 851 ATOM 852 O TYR 3 -8.607 6.556 0.103 1.00 0.00 4HIR 852 ATOM 853 CB TYR 3 -8.427 3.196 -0.834 1.00 0.00 4HIR 853 ATOM 854 CG TYR 3 -9.243 2.046 -1.426 1.00 0.00 4HIR 854 ATOM 855 CD1 TYR 3 -10.091 1.307 -0.625 1.00 0.00 4HIR 855 ATOM 856 CD2 TYR 3 -9.147 1.731 -2.766 1.00 0.00 4HIR 856 ATOM 857 CE1 TYR 3 -10.835 0.274 -1.156 1.00 0.00 4HIR 857 ATOM 858 CE2 TYR 3 -9.890 0.696 -3.298 1.00 0.00 4HIR 858 ATOM 859 CZ TYR 3 -10.741 -0.041 -2.496 1.00 0.00 4HIR 859 ATOM 860 OH TYR 3 -11.487 -1.075 -3.027 1.00 0.00 4HIR 860 ATOM 861 H TYR 3 -8.802 5.163 -2.589 1.00 0.00 4HIR 861 ATOM 862 HA TYR 3 -10.295 4.082 -0.257 1.00 0.00 4HIR 862 ATOM 863 1HB TYR 3 -7.614 3.445 -1.501 1.00 0.00 4HIR 863 ATOM 864 2HB TYR 3 -8.025 2.892 0.115 1.00 0.00 4HIR 864 ATOM 865 HD1 TYR 3 -10.176 1.544 0.425 1.00 0.00 4HIR 865 ATOM 866 HD2 TYR 3 -8.487 2.299 -3.403 1.00 0.00 4HIR 866 ATOM 867 HE1 TYR 3 -11.495 -0.293 -0.518 1.00 0.00 4HIR 867 ATOM 868 HE2 TYR 3 -9.806 0.461 -4.348 1.00 0.00 4HIR 868 ATOM 869 HH TYR 3 -11.370 -1.065 -3.978 1.00 0.00 4HIR 869 ATOM 870 N THR 4 -8.276 4.833 1.463 1.00 0.00 4HIR 870 ATOM 871 CA THR 4 -7.630 5.679 2.495 1.00 0.00 4HIR 871 ATOM 872 C THR 4 -6.137 5.418 2.461 1.00 0.00 4HIR 872 ATOM 873 O THR 4 -5.668 4.655 1.649 1.00 0.00 4HIR 873 ATOM 874 CB THR 4 -8.202 5.305 3.873 1.00 0.00 4HIR 874 ATOM 875 OG1 THR 4 -7.176 5.595 4.809 1.00 0.00 4HIR 875 ATOM 876 CG2 THR 4 -8.427 3.794 3.989 1.00 0.00 4HIR 876 ATOM 877 H THR 4 -8.356 3.864 1.602 1.00 0.00 4HIR 877 ATOM 878 HA THR 4 -7.820 6.721 2.287 1.00 0.00 4HIR 878 ATOM 879 HB THR 4 -9.094 5.863 4.099 1.00 0.00 4HIR 879 ATOM 880 HG1 THR 4 -7.267 6.514 5.073 1.00 0.00 4HIR 880 ATOM 881 1HG2 THR 4 -7.678 3.269 3.414 1.00 0.00 4HIR 881 ATOM 882 2HG2 THR 4 -8.356 3.494 5.023 1.00 0.00 4HIR 882 ATOM 883 3HG2 THR 4 -9.406 3.542 3.611 1.00 0.00 4HIR 883 ATOM 884 N ASP 5 -5.414 6.048 3.319 1.00 0.00 4HIR 884 ATOM 885 CA ASP 5 -3.965 5.813 3.323 1.00 0.00 4HIR 885 ATOM 886 C ASP 5 -3.624 4.639 4.225 1.00 0.00 4HIR 886 ATOM 887 O ASP 5 -4.373 4.288 5.116 1.00 0.00 4HIR 887 ATOM 888 CB ASP 5 -3.269 7.058 3.844 1.00 0.00 4HIR 888 ATOM 889 CG ASP 5 -4.092 8.293 3.472 1.00 0.00 4HIR 889 ATOM 890 OD1 ASP 5 -5.060 8.531 4.175 1.00 0.00 4HIR 890 ATOM 891 OD2 ASP 5 -3.707 8.928 2.504 1.00 0.00 4HIR 891 ATOM 892 H ASP 5 -5.821 6.667 3.961 1.00 0.00 4HIR 892 ATOM 893 HA ASP 5 -3.629 5.599 2.323 1.00 0.00 4HIR 893 ATOM 894 1HB ASP 5 -3.186 6.993 4.911 1.00 0.00 4HIR 894 ATOM 895 2HB ASP 5 -2.283 7.138 3.410 1.00 0.00 4HIR 895 ATOM 897 N CYS 6 -2.501 4.061 3.969 1.00 0.00 4HIR 896 ATOM 898 CA CYS 6 -2.047 2.931 4.817 1.00 0.00 4HIR 897 ATOM 899 C CYS 6 -1.586 3.418 6.171 1.00 0.00 4HIR 898 ATOM 900 O CYS 6 -1.557 4.601 6.450 1.00 0.00 4HIR 899 ATOM 901 CB CYS 6 -0.812 2.301 4.171 1.00 0.00 4HIR 900 ATOM 902 SG CYS 6 -1.027 0.933 3.044 1.00 0.00 4HIR 901 ATOM 903 H CYS 6 -2.011 4.299 3.161 1.00 0.00 4HIR 902 ATOM 904 HA CYS 6 -2.836 2.201 4.928 1.00 0.00 4HIR 903 ATOM 905 1HB CYS 6 -0.295 3.069 3.651 1.00 0.00 4HIR 904 ATOM 906 2HB CYS 6 -0.165 1.963 4.951 1.00 0.00 4HIR 905 ATOM 908 N THR 7 -1.243 2.471 6.975 1.00 0.00 4HIR 906 ATOM 909 CA THR 7 -0.696 2.786 8.329 1.00 0.00 4HIR 907 ATOM 910 C THR 7 0.664 2.142 8.495 1.00 0.00 4HIR 908 ATOM 911 O THR 7 1.454 2.518 9.338 1.00 0.00 4HIR 909 ATOM 912 CB THR 7 -1.655 2.267 9.408 1.00 0.00 4HIR 910 ATOM 913 OG1 THR 7 -2.194 1.066 8.873 1.00 0.00 4HIR 911 ATOM 914 CG2 THR 7 -2.861 3.196 9.581 1.00 0.00 4HIR 912 ATOM 915 H THR 7 -1.346 1.543 6.681 1.00 0.00 4HIR 913 ATOM 916 HA THR 7 -0.578 3.816 8.411 1.00 0.00 4HIR 914 ATOM 917 HB THR 7 -1.149 2.084 10.343 1.00 0.00 4HIR 915 ATOM 918 HG1 THR 7 -2.735 0.656 9.552 1.00 0.00 4HIR 916 ATOM 919 1HG2 THR 7 -2.870 3.937 8.796 1.00 0.00 4HIR 917 ATOM 920 2HG2 THR 7 -3.773 2.621 9.536 1.00 0.00 4HIR 918 ATOM 921 3HG2 THR 7 -2.803 3.693 10.539 1.00 0.00 4HIR 919 ATOM 922 N GLU 8 0.885 1.194 7.681 1.00 0.00 4HIR 920 ATOM 923 CA GLU 8 2.192 0.473 7.688 1.00 0.00 4HIR 921 ATOM 924 C GLU 8 2.377 -0.312 6.387 1.00 0.00 4HIR 922 ATOM 925 O GLU 8 1.437 -0.557 5.658 1.00 0.00 4HIR 923 ATOM 926 CB GLU 8 2.263 -0.475 8.891 1.00 0.00 4HIR 924 ATOM 927 CG GLU 8 1.098 -1.464 8.847 1.00 0.00 4HIR 925 ATOM 928 CD GLU 8 0.660 -1.784 10.278 1.00 0.00 4HIR 926 ATOM 929 OE1 GLU 8 1.512 -2.260 11.011 1.00 0.00 4HIR 927 ATOM 930 OE2 GLU 8 -0.501 -1.532 10.558 1.00 0.00 4HIR 928 ATOM 931 H GLU 8 0.205 0.972 7.042 1.00 0.00 4HIR 929 ATOM 932 HA GLU 8 2.990 1.202 7.757 1.00 0.00 4HIR 930 ATOM 933 1HB GLU 8 3.197 -1.015 8.868 1.00 0.00 4HIR 931 ATOM 934 2HB GLU 8 2.214 0.100 9.804 1.00 0.00 4HIR 932 ATOM 935 1HG GLU 8 0.270 -1.034 8.311 1.00 0.00 4HIR 933 ATOM 936 2HG GLU 8 1.409 -2.374 8.357 1.00 0.00 4HIR 934 ATOM 938 N SER 9 3.591 -0.690 6.139 1.00 0.00 4HIR 935 ATOM 939 CA SER 9 3.916 -1.412 4.897 1.00 0.00 4HIR 936 ATOM 940 C SER 9 3.255 -2.805 4.879 1.00 0.00 4HIR 937 ATOM 941 O SER 9 2.889 -3.329 5.911 1.00 0.00 4HIR 938 ATOM 942 CB SER 9 5.432 -1.532 4.886 1.00 0.00 4HIR 939 ATOM 943 OG SER 9 5.856 -0.536 5.805 1.00 0.00 4HIR 940 ATOM 944 H SER 9 4.302 -0.510 6.784 1.00 0.00 4HIR 941 ATOM 945 HA SER 9 3.581 -0.845 4.043 1.00 0.00 4HIR 942 ATOM 946 1HB SER 9 5.728 -2.481 5.227 1.00 0.00 4HIR 943 ATOM 947 2HB SER 9 5.840 -1.332 3.921 1.00 0.00 4HIR 944 ATOM 948 HG SER 9 6.365 -0.967 6.495 1.00 0.00 4HIR 945 ATOM 949 N GLY 10 3.119 -3.377 3.697 1.00 0.00 4HIR 946 ATOM 950 CA GLY 10 2.461 -4.730 3.604 1.00 0.00 4HIR 947 ATOM 951 C GLY 10 0.950 -4.620 3.300 1.00 0.00 4HIR 948 ATOM 952 O GLY 10 0.356 -5.545 2.783 1.00 0.00 4HIR 949 ATOM 953 H GLY 10 3.473 -2.938 2.889 1.00 0.00 4HIR 950 ATOM 954 1HA GLY 10 2.931 -5.298 2.820 1.00 0.00 4HIR 951 ATOM 955 2HA GLY 10 2.595 -5.250 4.539 1.00 0.00 4HIR 952 ATOM 956 N GLN 11 0.366 -3.501 3.624 1.00 0.00 4HIR 953 ATOM 957 CA GLN 11 -1.110 -3.333 3.387 1.00 0.00 4HIR 954 ATOM 958 C GLN 11 -1.447 -3.430 1.887 1.00 0.00 4HIR 955 ATOM 959 O GLN 11 -0.629 -3.867 1.102 1.00 0.00 4HIR 956 ATOM 960 CB GLN 11 -1.517 -1.980 3.938 1.00 0.00 4HIR 957 ATOM 961 CG GLN 11 -2.287 -2.170 5.241 1.00 0.00 4HIR 958 ATOM 962 CD GLN 11 -2.367 -0.827 5.967 1.00 0.00 4HIR 959 ATOM 963 OE1 GLN 11 -3.361 -0.133 5.910 1.00 0.00 4HIR 960 ATOM 964 NE2 GLN 11 -1.340 -0.423 6.655 1.00 0.00 4HIR 961 ATOM 965 H GLN 11 0.886 -2.770 4.018 1.00 0.00 4HIR 962 ATOM 966 HA GLN 11 -1.644 -4.108 3.908 1.00 0.00 4HIR 963 ATOM 967 1HB GLN 11 -0.630 -1.403 4.133 1.00 0.00 4HIR 964 ATOM 968 2HB GLN 11 -2.134 -1.463 3.224 1.00 0.00 4HIR 965 ATOM 969 1HG GLN 11 -3.281 -2.527 5.029 1.00 0.00 4HIR 966 ATOM 970 2HG GLN 11 -1.777 -2.883 5.872 1.00 0.00 4HIR 967 ATOM 971 1HE2 GLN 11 -0.503 -0.934 6.630 1.00 0.00 4HIR 968 ATOM 972 2HE2 GLN 11 -1.401 0.389 7.196 1.00 0.00 4HIR 969 ATOM 973 N ASN 12 -2.651 -3.022 1.515 1.00 0.00 4HIR 970 ATOM 974 CA ASN 12 -3.052 -3.180 0.076 1.00 0.00 4HIR 971 ATOM 975 C ASN 12 -3.918 -2.058 -0.466 1.00 0.00 4HIR 972 ATOM 976 O ASN 12 -3.435 -1.196 -1.159 1.00 0.00 4HIR 973 ATOM 977 CB ASN 12 -3.809 -4.514 -0.052 1.00 0.00 4HIR 974 ATOM 978 CG ASN 12 -4.151 -4.789 -1.518 1.00 0.00 4HIR 975 ATOM 979 OD1 ASN 12 -4.903 -4.067 -2.138 1.00 0.00 4HIR 976 ATOM 980 ND2 ASN 12 -3.629 -5.830 -2.106 1.00 0.00 4HIR 977 ATOM 981 H ASN 12 -3.269 -2.635 2.169 1.00 0.00 4HIR 978 ATOM 982 HA ASN 12 -2.184 -3.201 -0.515 1.00 0.00 4HIR 979 ATOM 983 1HB ASN 12 -3.195 -5.319 0.324 1.00 0.00 4HIR 980 ATOM 984 2HB ASN 12 -4.723 -4.467 0.521 1.00 0.00 4HIR 981 ATOM 985 1HD2 ASN 12 -2.656 -5.919 -2.173 1.00 0.00 4HIR 982 ATOM 986 2HD2 ASN 12 -4.211 -6.525 -2.481 1.00 0.00 4HIR 983 ATOM 987 N LEU 13 -5.156 -2.083 -0.164 1.00 0.00 4HIR 984 ATOM 988 CA LEU 13 -6.053 -1.093 -0.784 1.00 0.00 4HIR 985 ATOM 989 C LEU 13 -5.871 0.274 -0.158 1.00 0.00 4HIR 986 ATOM 990 O LEU 13 -6.829 0.917 0.194 1.00 0.00 4HIR 987 ATOM 991 CB LEU 13 -7.501 -1.544 -0.592 1.00 0.00 4HIR 988 ATOM 992 CG LEU 13 -7.766 -2.781 -1.470 1.00 0.00 4HIR 989 ATOM 993 CD1 LEU 13 -9.144 -3.364 -1.132 1.00 0.00 4HIR 990 ATOM 994 CD2 LEU 13 -7.740 -2.393 -2.958 1.00 0.00 4HIR 991 ATOM 995 H LEU 13 -5.494 -2.739 0.435 1.00 0.00 4HIR 992 ATOM 996 HA LEU 13 -5.830 -1.041 -1.824 1.00 0.00 4HIR 993 ATOM 997 1HB LEU 13 -7.663 -1.792 0.446 1.00 0.00 4HIR 994 ATOM 998 2HB LEU 13 -8.173 -0.744 -0.870 1.00 0.00 4HIR 995 ATOM 999 HG LEU 13 -7.005 -3.518 -1.282 1.00 0.00 4HIR 996 ATOM 1000 1HD1 LEU 13 -9.313 -3.320 -0.067 1.00 0.00 4HIR 997 ATOM 1001 2HD1 LEU 13 -9.912 -2.799 -1.639 1.00 0.00 4HIR 998 ATOM 1002 3HD1 LEU 13 -9.192 -4.393 -1.455 1.00 0.00 4HIR 999 ATOM 1003 1HD2 LEU 13 -8.007 -1.354 -3.077 1.00 0.00 4HIR1000 ATOM 1004 2HD2 LEU 13 -6.750 -2.553 -3.358 1.00 0.00 4HIR1001 ATOM 1005 3HD2 LEU 13 -8.444 -3.003 -3.504 1.00 0.00 4HIR1002 ATOM 1006 N CYS 14 -4.635 0.698 -0.041 1.00 0.00 4HIR1003 ATOM 1007 CA CYS 14 -4.381 2.060 0.527 1.00 0.00 4HIR1004 ATOM 1008 C CYS 14 -3.639 2.915 -0.456 1.00 0.00 4HIR1005 ATOM 1009 O CYS 14 -3.728 2.729 -1.641 1.00 0.00 4HIR1006 ATOM 1010 CB CYS 14 -3.486 1.957 1.733 1.00 0.00 4HIR1007 ATOM 1011 SG CYS 14 -1.726 1.788 1.394 1.00 0.00 4HIR1008 ATOM 1012 H CYS 14 -3.872 0.116 -0.322 1.00 0.00 4HIR1009 ATOM 1013 HA CYS 14 -5.312 2.541 0.789 1.00 0.00 4HIR1010 ATOM 1014 1HB CYS 14 -3.631 2.838 2.328 1.00 0.00 4HIR1011 ATOM 1015 2HB CYS 14 -3.782 1.130 2.317 1.00 0.00 4HIR1012 ATOM 1017 N LEU 15 -2.893 3.835 0.092 1.00 0.00 4HIR1013 ATOM 1018 CA LEU 15 -2.086 4.748 -0.754 1.00 0.00 4HIR1014 ATOM 1019 C LEU 15 -0.628 4.672 -0.368 1.00 0.00 4HIR1015 ATOM 1020 O LEU 15 -0.289 4.718 0.799 1.00 0.00 4HIR1016 ATOM 1021 CB LEU 15 -2.579 6.169 -0.562 1.00 0.00 4HIR1017 ATOM 1022 CG LEU 15 -4.038 6.247 -0.987 1.00 0.00 4HIR1018 ATOM 1023 CD1 LEU 15 -4.736 7.305 -0.158 1.00 0.00 4HIR1019 ATOM 1024 CD2 LEU 15 -4.107 6.617 -2.454 1.00 0.00 4HIR1020 ATOM 1025 H LEU 15 -2.860 3.915 1.074 1.00 0.00 4HIR1021 ATOM 1026 HA LEU 15 -2.185 4.468 -1.776 1.00 0.00 4HIR1022 ATOM 1027 1HB LEU 15 -2.485 6.449 0.477 1.00 0.00 4HIR1023 ATOM 1028 2HB LEU 15 -1.987 6.842 -1.166 1.00 0.00 4HIR1024 ATOM 1029 HG LEU 15 -4.515 5.309 -0.838 1.00 0.00 4HIR1025 ATOM 1030 1HD1 LEU 15 -4.185 8.229 -0.215 1.00 0.00 4HIR1026 ATOM 1031 2HD1 LEU 15 -5.733 7.458 -0.530 1.00 0.00 4HIR1027 ATOM 1032 3HD1 LEU 15 -4.785 6.982 0.870 1.00 0.00 4HIR1028 ATOM 1033 1HD2 LEU 15 -3.512 5.925 -3.030 1.00 0.00 4HIR1029 ATOM 1034 2HD2 LEU 15 -5.126 6.579 -2.795 1.00 0.00 4HIR1030 ATOM 1035 3HD2 LEU 15 -3.725 7.600 -2.588 1.00 0.00 4HIR1031 ATOM 1036 N CYS 16 0.205 4.557 -1.362 1.00 0.00 4HIR1032 ATOM 1037 CA CYS 16 1.679 4.478 -1.081 1.00 0.00 4HIR1033 ATOM 1038 C CYS 16 2.412 5.621 -1.768 1.00 0.00 4HIR1034 ATOM 1039 O CYS 16 2.933 6.506 -1.118 1.00 0.00 4HIR1035 ATOM 1040 CB CYS 16 2.229 3.151 -1.598 1.00 0.00 4HIR1036 ATOM 1041 SG CYS 16 2.244 1.753 -0.447 1.00 0.00 4HIR1037 ATOM 1042 H CYS 16 -0.139 4.526 -2.297 1.00 0.00 4HIR1038 ATOM 1043 HA CYS 16 1.847 4.544 -0.018 1.00 0.00 4HIR1039 ATOM 1044 1HB CYS 16 1.655 2.864 -2.458 1.00 0.00 4HIR1040 ATOM 1045 2HB CYS 16 3.245 3.314 -1.925 1.00 0.00 4HIR1041 ATOM 1047 N GLU 17 2.444 5.580 -3.065 1.00 0.00 4HIR1042 ATOM 1048 CA GLU 17 3.138 6.660 -3.805 1.00 0.00 4HIR1043 ATOM 1049 C GLU 17 2.197 7.852 -4.004 1.00 0.00 4HIR1044 ATOM 1050 O GLU 17 1.501 7.947 -4.999 1.00 0.00 4HIR1045 ATOM 1051 CB GLU 17 3.579 6.123 -5.170 1.00 0.00 4HIR1046 ATOM 1052 CG GLU 17 4.710 5.105 -4.978 1.00 0.00 4HIR1047 ATOM 1053 CD GLU 17 5.979 5.628 -5.656 1.00 0.00 4HIR1048 ATOM 1054 OE1 GLU 17 5.866 5.973 -6.820 1.00 0.00 4HIR1049 ATOM 1055 OE2 GLU 17 6.988 5.653 -4.971 1.00 0.00 4HIR1050 ATOM 1056 H GLU 17 2.013 4.845 -3.550 1.00 0.00 4HIR1051 ATOM 1057 HA GLU 17 4.002 6.981 -3.237 1.00 0.00 4HIR1052 ATOM 1058 1HB GLU 17 2.742 5.647 -5.657 1.00 0.00 4HIR1053 ATOM 1059 2HB GLU 17 3.927 6.940 -5.784 1.00 0.00 4HIR1054 ATOM 1060 1HG GLU 17 4.902 4.956 -3.925 1.00 0.00 4HIR1055 ATOM 1061 2HG GLU 17 4.431 4.162 -5.425 1.00 0.00 4HIR1056 ATOM 1063 N GLY 18 2.188 8.730 -3.043 1.00 0.00 4HIR1057 ATOM 1064 CA GLY 18 1.329 9.938 -3.161 1.00 0.00 4HIR1058 ATOM 1065 C GLY 18 -0.153 9.577 -3.043 1.00 0.00 4HIR1059 ATOM 1066 O GLY 18 -0.579 8.984 -2.071 1.00 0.00 4HIR1060 ATOM 1067 H GLY 18 2.741 8.595 -2.245 1.00 0.00 4HIR1061 ATOM 1068 1HA GLY 18 1.588 10.633 -2.375 1.00 0.00 4HIR1062 ATOM 1069 2HA GLY 18 1.505 10.406 -4.118 1.00 0.00 4HIR1063 ATOM 1070 N SER 19 -0.906 9.945 -4.045 1.00 0.00 4HIR1064 ATOM 1071 CA SER 19 -2.361 9.690 -4.008 1.00 0.00 4HIR1065 ATOM 1072 C SER 19 -2.710 8.461 -4.790 1.00 0.00 4HIR1066 ATOM 1073 O SER 19 -3.860 8.087 -4.919 1.00 0.00 4HIR1067 ATOM 1074 CB SER 19 -3.046 10.871 -4.632 1.00 0.00 4HIR1068 ATOM 1075 OG SER 19 -3.780 10.321 -5.716 1.00 0.00 4HIR1069 ATOM 1076 H SER 19 -0.516 10.389 -4.807 1.00 0.00 4HIR1070 ATOM 1077 HA SER 19 -2.653 9.570 -3.021 1.00 0.00 4HIR1071 ATOM 1078 1HB SER 19 -3.706 11.359 -3.929 1.00 0.00 4HIR1072 ATOM 1079 2HB SER 19 -2.308 11.546 -4.998 1.00 0.00 4HIR1073 ATOM 1080 HG SER 19 -3.543 10.803 -6.511 1.00 0.00 4HIR1074 ATOM 1081 N ASN 20 -1.720 7.873 -5.284 1.00 0.00 4HIR1075 ATOM 1082 CA ASN 20 -1.926 6.634 -6.090 1.00 0.00 4HIR1076 ATOM 1083 C ASN 20 -2.136 5.422 -5.177 1.00 0.00 4HIR1077 ATOM 1084 O ASN 20 -1.348 5.170 -4.269 1.00 0.00 4HIR1078 ATOM 1085 CB ASN 20 -0.698 6.392 -6.967 1.00 0.00 4HIR1079 ATOM 1086 CG ASN 20 -0.726 7.352 -8.160 1.00 0.00 4HIR1080 ATOM 1087 OD1 ASN 20 0.288 7.882 -8.568 1.00 0.00 4HIR1081 ATOM 1088 ND2 ASN 20 -1.864 7.599 -8.750 1.00 0.00 4HIR1082 ATOM 1089 H ASN 20 -0.833 8.250 -5.136 1.00 0.00 4HIR1083 ATOM 1090 HA ASN 20 -2.799 6.758 -6.713 1.00 0.00 4HIR1084 ATOM 1091 1HB ASN 20 0.201 6.561 -6.394 1.00 0.00 4HIR1085 ATOM 1092 2HB ASN 20 -0.706 5.373 -7.326 1.00 0.00 4HIR1086 ATOM 1093 1HD2 ASN 20 -2.060 7.205 -9.626 1.00 0.00 4HIR1087 ATOM 1094 2HD2 ASN 20 -2.524 8.179 -8.317 1.00 0.00 4HIR1088 ATOM 1095 N VAL 21 -3.201 4.693 -5.426 1.00 0.00 4HIR1089 ATOM 1096 CA VAL 21 -3.461 3.495 -4.600 1.00 0.00 4HIR1090 ATOM 1097 C VAL 21 -2.583 2.371 -5.059 1.00 0.00 4HIR1091 ATOM 1098 O VAL 21 -2.243 2.274 -6.221 1.00 0.00 4HIR1092 ATOM 1099 CB VAL 21 -4.959 3.081 -4.690 1.00 0.00 4HIR1093 ATOM 1100 CG1 VAL 21 -5.102 1.548 -4.846 1.00 0.00 4HIR1094 ATOM 1101 CG2 VAL 21 -5.716 3.480 -3.412 1.00 0.00 4HIR1095 ATOM 1102 H VAL 21 -3.807 4.936 -6.139 1.00 0.00 4HIR1096 ATOM 1103 HA VAL 21 -3.211 3.721 -3.621 1.00 0.00 4HIR1097 ATOM 1104 HB VAL 21 -5.401 3.569 -5.528 1.00 0.00 4HIR1098 ATOM 1105 1HG1 VAL 21 -4.554 1.042 -4.060 1.00 0.00 4HIR1099 ATOM 1106 2HG1 VAL 21 -6.145 1.277 -4.765 1.00 0.00 4HIR1100 ATOM 1107 3HG1 VAL 21 -4.733 1.231 -5.808 1.00 0.00 4HIR1101 ATOM 1108 1HG2 VAL 21 -5.215 4.279 -2.905 1.00 0.00 4HIR1102 ATOM 1109 2HG2 VAL 21 -6.711 3.798 -3.670 1.00 0.00 4HIR1103 ATOM 1110 3HG2 VAL 21 -5.782 2.625 -2.751 1.00 0.00 4HIR1104 ATOM 1111 N CYS 22 -2.228 1.546 -4.140 1.00 0.00 4HIR1105 ATOM 1112 CA CYS 22 -1.348 0.407 -4.513 1.00 0.00 4HIR1106 ATOM 1113 C CYS 22 -1.644 -0.798 -3.648 1.00 0.00 4HIR1107 ATOM 1114 O CYS 22 -1.544 -0.730 -2.441 1.00 0.00 4HIR1108 ATOM 1115 CB CYS 22 0.089 0.839 -4.309 1.00 0.00 4HIR1109 ATOM 1116 SG CYS 22 0.912 1.667 -5.689 1.00 0.00 4HIR1110 ATOM 1117 H CYS 22 -2.540 1.680 -3.189 1.00 0.00 4HIR1111 ATOM 1118 HA CYS 22 -1.510 0.150 -5.551 1.00 0.00 4HIR1112 ATOM 1119 1HB CYS 22 0.108 1.509 -3.472 1.00 0.00 4HIR1113 ATOM 1120 2HB CYS 22 0.671 -0.032 -4.047 1.00 0.00 4HIR1114 ATOM 1122 N GLY 23 -1.979 -1.892 -4.272 1.00 0.00 4HIR1115 ATOM 1123 CA GLY 23 -2.326 -3.079 -3.470 1.00 0.00 4HIR1116 ATOM 1124 C GLY 23 -2.908 -4.190 -4.330 1.00 0.00 4HIR1117 ATOM 1125 O GLY 23 -2.197 -5.039 -4.785 1.00 0.00 4HIR1118 ATOM 1126 H GLY 23 -1.980 -1.933 -5.252 1.00 0.00 4HIR1119 ATOM 1127 1HA GLY 23 -1.445 -3.438 -2.968 1.00 0.00 4HIR1120 ATOM 1128 2HA GLY 23 -3.048 -2.795 -2.747 1.00 0.00 4HIR1121 ATOM 1129 N GLN 24 -4.203 -4.153 -4.525 1.00 0.00 4HIR1122 ATOM 1130 CA GLN 24 -4.871 -5.227 -5.316 1.00 0.00 4HIR1123 ATOM 1131 C GLN 24 -4.025 -5.633 -6.529 1.00 0.00 4HIR1124 ATOM 1132 O GLN 24 -3.605 -4.799 -7.308 1.00 0.00 4HIR1125 ATOM 1133 CB GLN 24 -6.231 -4.700 -5.774 1.00 0.00 4HIR1126 ATOM 1134 CG GLN 24 -6.839 -5.670 -6.784 1.00 0.00 4HIR1127 ATOM 1135 CD GLN 24 -8.332 -5.366 -6.943 1.00 0.00 4HIR1128 ATOM 1136 OE1 GLN 24 -8.824 -4.359 -6.475 1.00 0.00 4HIR1129 ATOM 1137 NE2 GLN 24 -9.084 -6.209 -7.596 1.00 0.00 4HIR1130 ATOM 1138 H GLN 24 -4.732 -3.421 -4.159 1.00 0.00 4HIR1131 ATOM 1139 HA GLN 24 -5.010 -6.087 -4.685 1.00 0.00 4HIR1132 ATOM 1140 1HB GLN 24 -6.888 -4.607 -4.918 1.00 0.00 4HIR1133 ATOM 1141 2HB GLN 24 -6.109 -3.730 -6.228 1.00 0.00 4HIR1134 ATOM 1142 1HG GLN 24 -6.347 -5.557 -7.738 1.00 0.00 4HIR1135 ATOM 1143 2HG GLN 24 -6.715 -6.684 -6.435 1.00 0.00 4HIR1136 ATOM 1144 1HE2 GLN 24 -8.789 -7.135 -7.719 1.00 0.00 4HIR1137 ATOM 1145 2HE2 GLN 24 -9.944 -5.915 -7.963 1.00 0.00 4HIR1138 ATOM 1146 N GLY 25 -3.797 -6.918 -6.658 1.00 0.00 4HIR1139 ATOM 1147 CA GLY 25 -2.943 -7.416 -7.778 1.00 0.00 4HIR1140 ATOM 1148 C GLY 25 -1.488 -7.460 -7.313 1.00 0.00 4HIR1141 ATOM 1149 O GLY 25 -0.677 -8.202 -7.833 1.00 0.00 4HIR1142 ATOM 1150 H GLY 25 -4.186 -7.552 -6.020 1.00 0.00 4HIR1143 ATOM 1151 1HA GLY 25 -3.260 -8.408 -8.063 1.00 0.00 4HIR1144 ATOM 1152 2HA GLY 25 -3.031 -6.751 -8.626 1.00 0.00 4HIR1145 ATOM 1153 N ASN 26 -1.205 -6.655 -6.334 1.00 0.00 4HIR1146 ATOM 1154 CA ASN 26 0.175 -6.602 -5.766 1.00 0.00 4HIR1147 ATOM 1155 C ASN 26 0.103 -6.377 -4.249 1.00 0.00 4HIR1148 ATOM 1156 O ASN 26 -0.917 -6.609 -3.631 1.00 0.00 4HIR1149 ATOM 1157 CB ASN 26 0.934 -5.440 -6.415 1.00 0.00 4HIR1150 ATOM 1158 CG ASN 26 1.263 -5.775 -7.874 1.00 0.00 4HIR1151 ATOM 1159 OD1 ASN 26 2.410 -5.803 -8.276 1.00 0.00 4HIR1152 ATOM 1160 ND2 ASN 26 0.286 -6.026 -8.702 1.00 0.00 4HIR1153 ATOM 1161 H ASN 26 -1.902 -6.084 -5.971 1.00 0.00 4HIR1154 ATOM 1162 HA ASN 26 0.675 -7.511 -5.968 1.00 0.00 4HIR1155 ATOM 1163 1HB ASN 26 0.349 -4.603 -6.397 1.00 0.00 4HIR1156 ATOM 1164 2HB ASN 26 1.836 -5.228 -5.872 1.00 0.00 4HIR1157 ATOM 1165 1HD2 ASN 26 0.471 -6.455 -9.563 1.00 0.00 4HIR1158 ATOM 1166 2HD2 ASN 26 -0.634 -5.787 -8.460 1.00 0.00 4HIR1159 ATOM 1167 N LYS 27 1.193 -5.960 -3.682 1.00 0.00 4HIR1160 ATOM 1168 CA LYS 27 1.187 -5.624 -2.224 1.00 0.00 4HIR1161 ATOM 1169 C LYS 27 2.007 -4.356 -2.002 1.00 0.00 4HIR1162 ATOM 1170 O LYS 27 2.994 -4.139 -2.666 1.00 0.00 4HIR1163 ATOM 1171 CB LYS 27 1.783 -6.789 -1.406 1.00 0.00 4HIR1164 ATOM 1172 CG LYS 27 3.182 -7.153 -1.925 1.00 0.00 4HIR1165 ATOM 1173 CD LYS 27 3.902 -8.008 -0.873 1.00 0.00 4HIR1166 ATOM 1174 CE LYS 27 4.571 -7.093 0.169 1.00 0.00 4HIR1167 ATOM 1175 NZ LYS 27 4.402 -7.653 1.539 1.00 0.00 4HIR1168 ATOM 1176 H LYS 27 2.015 -5.877 -4.205 1.00 0.00 4HIR1169 ATOM 1177 HA LYS 27 0.171 -5.445 -1.906 1.00 0.00 4HIR1170 ATOM 1178 1HB LYS 27 1.849 -6.501 -0.367 1.00 0.00 4HIR1171 ATOM 1179 2HB LYS 27 1.136 -7.650 -1.487 1.00 0.00 4HIR1172 ATOM 1180 1HG LYS 27 3.092 -7.709 -2.846 1.00 0.00 4HIR1173 ATOM 1181 2HG LYS 27 3.750 -6.263 -2.109 1.00 0.00 4HIR1174 ATOM 1182 1HD LYS 27 3.189 -8.653 -0.382 1.00 0.00 4HIR1175 ATOM 1183 2HD LYS 27 4.653 -8.615 -1.356 1.00 0.00 4HIR1176 ATOM 1184 1HE LYS 27 5.627 -7.008 -0.048 1.00 0.00 4HIR1177 ATOM 1185 2HE LYS 27 4.126 -6.109 0.140 1.00 0.00 4HIR1178 ATOM 1186 1HZ LYS 27 3.882 -8.552 1.484 1.00 0.00 4HIR1179 ATOM 1187 2HZ LYS 27 5.335 -7.816 1.964 1.00 0.00 4HIR1180 ATOM 1188 3HZ LYS 27 3.866 -6.979 2.124 1.00 0.00 4HIR1181 ATOM 1189 N CYS 28 1.585 -3.528 -1.096 1.00 0.00 4HIR1182 ATOM 1190 CA CYS 28 2.376 -2.296 -0.866 1.00 0.00 4HIR1183 ATOM 1191 C CYS 28 3.420 -2.516 0.167 1.00 0.00 4HIR1184 ATOM 1192 O CYS 28 3.364 -3.425 0.961 1.00 0.00 4HIR1185 ATOM 1193 CB CYS 28 1.508 -1.173 -0.374 1.00 0.00 4HIR1186 ATOM 1194 SG CYS 28 1.312 0.265 -1.447 1.00 0.00 4HIR1187 ATOM 1195 H CYS 28 0.771 -3.711 -0.581 1.00 0.00 4HIR1188 ATOM 1196 HA CYS 28 2.847 -1.993 -1.780 1.00 0.00 4HIR1189 ATOM 1197 1HB CYS 28 0.573 -1.562 -0.181 1.00 0.00 4HIR1190 ATOM 1198 2HB CYS 28 1.915 -0.826 0.565 1.00 0.00 4HIR1191 ATOM 1200 N ILE 29 4.331 -1.654 0.121 1.00 0.00 4HIR1192 ATOM 1201 CA ILE 29 5.427 -1.657 1.106 1.00 0.00 4HIR1193 ATOM 1202 C ILE 29 5.862 -0.210 1.353 1.00 0.00 4HIR1194 ATOM 1203 O ILE 29 6.684 0.315 0.628 1.00 0.00 4HIR1195 ATOM 1204 CB ILE 29 6.607 -2.440 0.546 1.00 0.00 4HIR1196 ATOM 1205 CG1 ILE 29 6.312 -3.956 0.531 1.00 0.00 4HIR1197 ATOM 1206 CG2 ILE 29 7.857 -2.163 1.387 1.00 0.00 4HIR1198 ATOM 1207 CD1 ILE 29 6.055 -4.490 1.951 1.00 0.00 4HIR1199 ATOM 1208 H ILE 29 4.295 -0.986 -0.577 1.00 0.00 4HIR1200 ATOM 1209 HA ILE 29 5.085 -2.095 2.002 1.00 0.00 4HIR1201 ATOM 1210 HB ILE 29 6.775 -2.112 -0.447 1.00 0.00 4HIR1202 ATOM 1211 1HG1 ILE 29 5.448 -4.146 -0.085 1.00 0.00 4HIR1203 ATOM 1212 2HG1 ILE 29 7.159 -4.473 0.109 1.00 0.00 4HIR1204 ATOM 1213 1HG2 ILE 29 7.573 -1.840 2.379 1.00 0.00 4HIR1205 ATOM 1214 2HG2 ILE 29 8.448 -3.064 1.464 1.00 0.00 4HIR1206 ATOM 1215 3HG2 ILE 29 8.445 -1.392 0.919 1.00 0.00 4HIR1207 ATOM 1216 1HD1 ILE 29 6.470 -3.832 2.686 1.00 0.00 4HIR1208 ATOM 1217 2HD1 ILE 29 5.002 -4.575 2.115 1.00 0.00 4HIR1209 ATOM 1218 3HD1 ILE 29 6.506 -5.462 2.054 1.00 0.00 4HIR1210 ATOM 1219 N LEU 30 5.314 0.407 2.369 1.00 0.00 4HIR1211 ATOM 1220 CA LEU 30 5.649 1.833 2.605 1.00 0.00 4HIR1212 ATOM 1221 C LEU 30 6.804 2.009 3.610 1.00 0.00 4HIR1213 ATOM 1222 O LEU 30 6.842 1.369 4.641 1.00 0.00 4HIR1214 ATOM 1223 CB LEU 30 4.405 2.581 3.065 1.00 0.00 4HIR1215 ATOM 1224 CG LEU 30 4.071 2.218 4.491 1.00 0.00 4HIR1216 ATOM 1225 CD1 LEU 30 4.543 3.331 5.440 1.00 0.00 4HIR1217 ATOM 1226 CD2 LEU 30 2.549 2.079 4.620 1.00 0.00 4HIR1218 ATOM 1227 H LEU 30 4.698 -0.059 2.956 1.00 0.00 4HIR1219 ATOM 1228 HA LEU 30 5.935 2.238 1.703 1.00 0.00 4HIR1220 ATOM 1229 1HB LEU 30 4.578 3.636 2.993 1.00 0.00 4HIR1221 ATOM 1230 2HB LEU 30 3.581 2.310 2.426 1.00 0.00 4HIR1222 ATOM 1231 HG LEU 30 4.552 1.294 4.736 1.00 0.00 4HIR1223 ATOM 1232 1HD1 LEU 30 4.060 4.261 5.178 1.00 0.00 4HIR1224 ATOM 1233 2HD1 LEU 30 4.285 3.073 6.456 1.00 0.00 4HIR1225 ATOM 1234 3HD1 LEU 30 5.610 3.453 5.366 1.00 0.00 4HIR1226 ATOM 1235 1HD2 LEU 30 2.062 2.871 4.070 1.00 0.00 4HIR1227 ATOM 1236 2HD2 LEU 30 2.234 1.125 4.224 1.00 0.00 4HIR1228 ATOM 1237 3HD2 LEU 30 2.264 2.149 5.657 1.00 0.00 4HIR1229 ATOM 1238 N GLY 31 7.747 2.870 3.271 1.00 0.00 4HIR1230 ATOM 1239 CA GLY 31 8.861 3.132 4.210 1.00 0.00 4HIR1231 ATOM 1240 C GLY 31 9.556 1.836 4.575 1.00 0.00 4HIR1232 ATOM 1241 O GLY 31 9.158 1.158 5.503 1.00 0.00 4HIR1233 ATOM 1242 H GLY 31 7.733 3.311 2.400 1.00 0.00 4HIR1234 ATOM 1243 1HA GLY 31 9.572 3.800 3.747 1.00 0.00 4HIR1235 ATOM 1244 2HA GLY 31 8.472 3.591 5.107 1.00 0.00 4HIR1236 ATOM 1245 N SER 32 10.581 1.505 3.847 1.00 0.00 4HIR1237 ATOM 1246 CA SER 32 11.297 0.278 4.165 1.00 0.00 4HIR1238 ATOM 1247 C SER 32 12.132 0.515 5.379 1.00 0.00 4HIR1239 ATOM 1248 O SER 32 11.693 1.109 6.328 1.00 0.00 4HIR1240 ATOM 1249 CB SER 32 12.177 -0.129 2.983 1.00 0.00 4HIR1241 ATOM 1250 OG SER 32 11.294 -0.113 1.871 1.00 0.00 4HIR1242 ATOM 1251 H SER 32 10.894 2.076 3.123 1.00 0.00 4HIR1243 ATOM 1252 HA SER 32 10.612 -0.498 4.374 1.00 0.00 4HIR1244 ATOM 1253 1HB SER 32 12.975 0.575 2.835 1.00 0.00 4HIR1245 ATOM 1254 2HB SER 32 12.575 -1.124 3.127 1.00 0.00 4HIR1246 ATOM 1255 HG SER 32 11.804 0.115 1.090 1.00 0.00 4HIR1247 ATOM 1256 N ASP 33 13.334 0.189 5.252 1.00 0.00 4HIR1248 ATOM 1257 CA ASP 33 14.244 0.232 6.434 1.00 0.00 4HIR1249 ATOM 1258 C ASP 33 14.583 1.665 6.731 1.00 0.00 4HIR1250 ATOM 1259 O ASP 33 15.701 2.114 6.572 1.00 0.00 4HIR1251 ATOM 1260 CB ASP 33 15.523 -0.566 6.141 1.00 0.00 4HIR1252 ATOM 1261 CG ASP 33 16.258 0.050 4.955 1.00 0.00 4HIR1253 ATOM 1262 OD1 ASP 33 15.696 -0.023 3.875 1.00 0.00 4HIR1254 ATOM 1263 OD2 ASP 33 17.339 0.560 5.193 1.00 0.00 4HIR1255 ATOM 1264 H ASP 33 13.651 -0.017 4.387 1.00 0.00 4HIR1256 ATOM 1265 HA ASP 33 13.738 -0.195 7.287 1.00 0.00 4HIR1257 ATOM 1266 1HB ASP 33 16.169 -0.549 7.007 1.00 0.00 4HIR1258 ATOM 1267 2HB ASP 33 15.267 -1.589 5.910 1.00 0.00 4HIR1259 ATOM 1269 N GLY 34 13.578 2.347 7.163 1.00 0.00 4HIR1260 ATOM 1270 CA GLY 34 13.721 3.776 7.455 1.00 0.00 4HIR1261 ATOM 1271 C GLY 34 13.880 4.515 6.149 1.00 0.00 4HIR1262 ATOM 1272 O GLY 34 14.505 5.558 6.106 1.00 0.00 4HIR1263 ATOM 1273 H GLY 34 12.724 1.909 7.277 1.00 0.00 4HIR1264 ATOM 1274 1HA GLY 34 12.841 4.131 7.968 1.00 0.00 4HIR1265 ATOM 1275 2HA GLY 34 14.593 3.935 8.071 1.00 0.00 4HIR1266 ATOM 1276 N GLU 35 13.303 3.960 5.088 1.00 0.00 4HIR1267 ATOM 1277 CA GLU 35 13.470 4.590 3.782 1.00 0.00 4HIR1268 ATOM 1278 C GLU 35 12.152 4.992 3.165 1.00 0.00 4HIR1269 ATOM 1279 O GLU 35 11.272 5.530 3.806 1.00 0.00 4HIR1270 ATOM 1280 CB GLU 35 14.185 3.615 2.857 1.00 0.00 4HIR1271 ATOM 1281 CG GLU 35 15.441 3.101 3.553 1.00 0.00 4HIR1272 ATOM 1282 CD GLU 35 16.458 2.651 2.500 1.00 0.00 4HIR1273 ATOM 1283 OE1 GLU 35 17.198 3.515 2.057 1.00 0.00 4HIR1274 ATOM 1284 OE2 GLU 35 16.438 1.469 2.197 1.00 0.00 4HIR1275 ATOM 1285 H GLU 35 12.773 3.147 5.162 1.00 0.00 4HIR1276 ATOM 1286 HA GLU 35 14.059 5.449 3.882 1.00 0.00 4HIR1277 ATOM 1287 1HB GLU 35 13.528 2.792 2.625 1.00 0.00 4HIR1278 ATOM 1288 2HB GLU 35 14.462 4.118 1.942 1.00 0.00 4HIR1279 ATOM 1289 1HG GLU 35 15.875 3.889 4.151 1.00 0.00 4HIR1280 ATOM 1290 2HG GLU 35 15.190 2.270 4.187 1.00 0.00 4HIR1281 ATOM 1292 N LYS 36 12.075 4.709 1.933 1.00 0.00 4HIR1282 ATOM 1293 CA LYS 36 10.922 5.162 1.115 1.00 0.00 4HIR1283 ATOM 1294 C LYS 36 9.806 4.123 1.001 1.00 0.00 4HIR1284 ATOM 1295 O LYS 36 9.879 3.042 1.551 1.00 0.00 4HIR1285 ATOM 1296 CB LYS 36 11.424 5.520 -0.288 1.00 0.00 4HIR1286 ATOM 1297 CG LYS 36 12.008 6.936 -0.258 1.00 0.00 4HIR1287 ATOM 1298 CD LYS 36 10.880 7.953 -0.539 1.00 0.00 4HIR1288 ATOM 1299 CE LYS 36 11.325 9.376 -0.142 1.00 0.00 4HIR1289 ATOM 1300 NZ LYS 36 11.873 10.100 -1.323 1.00 0.00 4HIR1290 ATOM 1301 H LYS 36 12.750 4.158 1.557 1.00 0.00 4HIR1291 ATOM 1302 HA LYS 36 10.525 6.036 1.574 1.00 0.00 4HIR1292 ATOM 1303 1HB LYS 36 12.186 4.818 -0.592 1.00 0.00 4HIR1293 ATOM 1304 2HB LYS 36 10.602 5.479 -0.989 1.00 0.00 4HIR1294 ATOM 1305 1HG LYS 36 12.441 7.117 0.713 1.00 0.00 4HIR1295 ATOM 1306 2HG LYS 36 12.775 7.028 -1.011 1.00 0.00 4HIR1296 ATOM 1307 1HD LYS 36 10.637 7.935 -1.591 1.00 0.00 4HIR1297 ATOM 1308 2HD LYS 36 10.000 7.683 0.026 1.00 0.00 4HIR1298 ATOM 1309 1HE LYS 36 10.475 9.924 0.237 1.00 0.00 4HIR1299 ATOM 1310 2HE LYS 36 12.081 9.333 0.625 1.00 0.00 4HIR1300 ATOM 1311 1HZ LYS 36 11.466 9.702 -2.193 1.00 0.00 4HIR1301 ATOM 1312 2HZ LYS 36 11.630 11.109 -1.255 1.00 0.00 4HIR1302 ATOM 1313 3HZ LYS 36 12.908 9.994 -1.345 1.00 0.00 4HIR1303 ATOM 1314 N ASN 37 8.787 4.500 0.267 1.00 0.00 4HIR1304 ATOM 1315 CA ASN 37 7.634 3.597 0.047 1.00 0.00 4HIR1305 ATOM 1316 C ASN 37 7.665 2.995 -1.363 1.00 0.00 4HIR1306 ATOM 1317 O ASN 37 8.319 3.516 -2.245 1.00 0.00 4HIR1307 ATOM 1318 CB ASN 37 6.362 4.442 0.198 1.00 0.00 4HIR1308 ATOM 1319 CG ASN 37 6.409 5.181 1.539 1.00 0.00 4HIR1309 ATOM 1320 OD1 ASN 37 7.344 5.051 2.302 1.00 0.00 4HIR1310 ATOM 1321 ND2 ASN 37 5.427 5.973 1.857 1.00 0.00 4HIR1311 ATOM 1322 H ASN 37 8.773 5.393 -0.113 1.00 0.00 4HIR1312 ATOM 1323 HA ASN 37 7.662 2.807 0.774 1.00 0.00 4HIR1313 ATOM 1324 1HB ASN 37 6.316 5.169 -0.601 1.00 0.00 4HIR1314 ATOM 1325 2HB ASN 37 5.485 3.819 0.154 1.00 0.00 4HIR1315 ATOM 1326 1HD2 ASN 37 5.617 6.868 2.210 1.00 0.00 4HIR1316 ATOM 1327 2HD2 ASN 37 4.503 5.678 1.743 1.00 0.00 4HIR1317 ATOM 1328 N GLN 38 6.954 1.903 -1.553 1.00 0.00 4HIR1318 ATOM 1329 CA GLN 38 6.935 1.280 -2.892 1.00 0.00 4HIR1319 ATOM 1330 C GLN 38 5.744 0.329 -3.041 1.00 0.00 4HIR1320 ATOM 1331 O GLN 38 5.204 -0.156 -2.067 1.00 0.00 4HIR1321 ATOM 1332 CB GLN 38 8.230 0.498 -3.099 1.00 0.00 4HIR1322 ATOM 1333 CG GLN 38 8.174 -0.201 -4.459 1.00 0.00 4HIR1323 ATOM 1334 CD GLN 38 9.594 -0.366 -5.001 1.00 0.00 4HIR1324 ATOM 1335 OE1 GLN 38 10.221 -1.392 -4.829 1.00 0.00 4HIR1325 ATOM 1336 NE2 GLN 38 10.137 0.620 -5.660 1.00 0.00 4HIR1326 ATOM 1337 H GLN 38 6.431 1.517 -0.831 1.00 0.00 4HIR1327 ATOM 1338 HA GLN 38 6.859 2.053 -3.626 1.00 0.00 4HIR1328 ATOM 1339 1HB GLN 38 9.072 1.174 -3.072 1.00 0.00 4HIR1329 ATOM 1340 2HB GLN 38 8.340 -0.237 -2.316 1.00 0.00 4HIR1330 ATOM 1341 1HG GLN 38 7.717 -1.174 -4.351 1.00 0.00 4HIR1331 ATOM 1342 2HG GLN 38 7.596 0.391 -5.151 1.00 0.00 4HIR1332 ATOM 1343 1HE2 GLN 38 10.470 0.476 -6.570 1.00 0.00 4HIR1333 ATOM 1344 2HE2 GLN 38 10.210 1.506 -5.246 1.00 0.00 4HIR1334 ATOM 1345 N CYS 39 5.366 0.089 -4.271 1.00 0.00 4HIR1335 ATOM 1346 CA CYS 39 4.242 -0.848 -4.543 1.00 0.00 4HIR1336 ATOM 1347 C CYS 39 4.780 -2.133 -5.175 1.00 0.00 4HIR1337 ATOM 1348 O CYS 39 4.959 -2.201 -6.376 1.00 0.00 4HIR1338 ATOM 1349 CB CYS 39 3.277 -0.181 -5.513 1.00 0.00 4HIR1339 ATOM 1350 SG CYS 39 2.870 1.554 -5.225 1.00 0.00 4HIR1340 ATOM 1351 H CYS 39 5.817 0.530 -5.013 1.00 0.00 4HIR1341 ATOM 1352 HA CYS 39 3.739 -1.079 -3.631 1.00 0.00 4HIR1342 ATOM 1353 1HB CYS 39 3.695 -0.255 -6.496 1.00 0.00 4HIR1343 ATOM 1354 2HB CYS 39 2.354 -0.740 -5.507 1.00 0.00 4HIR1344 ATOM 1356 N VAL 40 5.026 -3.130 -4.360 1.00 0.00 4HIR1345 ATOM 1357 CA VAL 40 5.604 -4.405 -4.927 1.00 0.00 4HIR1346 ATOM 1358 C VAL 40 4.567 -5.504 -5.076 1.00 0.00 4HIR1347 ATOM 1359 O VAL 40 3.663 -5.630 -4.307 1.00 0.00 4HIR1348 ATOM 1360 CB VAL 40 6.725 -4.902 -4.020 1.00 0.00 4HIR1349 ATOM 1361 CG1 VAL 40 6.363 -4.627 -2.562 1.00 0.00 4HIR1350 ATOM 1362 CG2 VAL 40 6.937 -6.411 -4.198 1.00 0.00 4HIR1351 ATOM 1363 H VAL 40 4.844 -3.039 -3.386 1.00 0.00 4HIR1352 ATOM 1364 HA VAL 40 6.018 -4.194 -5.902 1.00 0.00 4HIR1353 ATOM 1365 HB VAL 40 7.622 -4.395 -4.283 1.00 0.00 4HIR1354 ATOM 1366 1HG1 VAL 40 5.293 -4.539 -2.460 1.00 0.00 4HIR1355 ATOM 1367 2HG1 VAL 40 6.708 -5.443 -1.947 1.00 0.00 4HIR1356 ATOM 1368 3HG1 VAL 40 6.828 -3.711 -2.235 1.00 0.00 4HIR1357 ATOM 1369 1HG2 VAL 40 6.916 -6.664 -5.245 1.00 0.00 4HIR1358 ATOM 1370 2HG2 VAL 40 7.897 -6.689 -3.790 1.00 0.00 4HIR1359 ATOM 1371 3HG2 VAL 40 6.165 -6.957 -3.678 1.00 0.00 4HIR1360 ATOM 1372 N THR 41 4.752 -6.264 -6.095 1.00 0.00 4HIR1361 ATOM 1373 CA THR 41 3.867 -7.426 -6.356 1.00 0.00 4HIR1362 ATOM 1374 C THR 41 4.015 -8.498 -5.275 1.00 0.00 4HIR1363 ATOM 1375 O THR 41 5.092 -8.735 -4.766 1.00 0.00 4HIR1364 ATOM 1376 CB THR 41 4.230 -8.014 -7.716 1.00 0.00 4HIR1365 ATOM 1377 OG1 THR 41 3.059 -8.681 -8.154 1.00 0.00 4HIR1366 ATOM 1378 CG2 THR 41 5.289 -9.111 -7.594 1.00 0.00 4HIR1367 ATOM 1379 H THR 41 5.455 -6.052 -6.704 1.00 0.00 4HIR1368 ATOM 1380 HA THR 41 2.870 -7.098 -6.376 1.00 0.00 4HIR1369 ATOM 1381 HB THR 41 4.521 -7.246 -8.412 1.00 0.00 4HIR1370 ATOM 1382 HG1 THR 41 3.213 -8.992 -9.050 1.00 0.00 4HIR1371 ATOM 1383 1HG2 THR 41 6.061 -8.801 -6.907 1.00 0.00 4HIR1372 ATOM 1384 2HG2 THR 41 4.832 -10.020 -7.230 1.00 0.00 4HIR1373 ATOM 1385 3HG2 THR 41 5.731 -9.300 -8.561 1.00 0.00 4HIR1374 ATOM 1386 N GLY 42 2.916 -9.128 -4.954 1.00 0.00 4HIR1375 ATOM 1387 CA GLY 42 2.942 -10.186 -3.906 1.00 0.00 4HIR1376 ATOM 1388 C GLY 42 1.570 -10.277 -3.229 1.00 0.00 4HIR1377 ATOM 1389 O GLY 42 0.581 -9.846 -3.787 1.00 0.00 4HIR1378 ATOM 1390 H GLY 42 2.076 -8.904 -5.405 1.00 0.00 4HIR1379 ATOM 1391 1HA GLY 42 3.181 -11.137 -4.363 1.00 0.00 4HIR1380 ATOM 1392 2HA GLY 42 3.694 -9.944 -3.167 1.00 0.00 4HIR1381 ATOM 1393 N GLU 43 1.538 -10.835 -2.043 1.00 0.00 4HIR1382 ATOM 1394 CA GLU 43 0.234 -10.950 -1.316 1.00 0.00 4HIR1383 ATOM 1395 C GLU 43 0.163 -9.916 -0.185 1.00 0.00 4HIR1384 ATOM 1396 O GLU 43 0.908 -9.990 0.772 1.00 0.00 4HIR1385 ATOM 1397 CB GLU 43 0.105 -12.366 -0.737 1.00 0.00 4HIR1386 ATOM 1398 CG GLU 43 1.231 -12.617 0.269 1.00 0.00 4HIR1387 ATOM 1399 CD GLU 43 1.537 -14.116 0.319 1.00 0.00 4HIR1388 ATOM 1400 OE1 GLU 43 2.267 -14.550 -0.557 1.00 0.00 4HIR1389 ATOM 1401 OE2 GLU 43 1.021 -14.744 1.230 1.00 0.00 4HIR1390 ATOM 1402 H GLU 43 2.362 -11.175 -1.636 1.00 0.00 4HIR1391 ATOM 1403 HA GLU 43 -0.577 -10.769 -2.005 1.00 0.00 4HIR1392 ATOM 1404 1HB GLU 43 -0.850 -12.470 -0.245 1.00 0.00 4HIR1393 ATOM 1405 2HB GLU 43 0.169 -13.087 -1.537 1.00 0.00 4HIR1394 ATOM 1406 1HG GLU 43 2.119 -12.081 -0.031 1.00 0.00 4HIR1395 ATOM 1407 2HG GLU 43 0.926 -12.284 1.251 1.00 0.00 4HIR1396 ATOM 1409 N GLY 44 -0.735 -8.969 -0.330 1.00 0.00 4HIR1397 ATOM 1410 CA GLY 44 -0.879 -7.904 0.716 1.00 0.00 4HIR1398 ATOM 1411 C GLY 44 -2.245 -8.008 1.406 1.00 0.00 4HIR1399 ATOM 1412 O GLY 44 -2.951 -8.983 1.242 1.00 0.00 4HIR1400 ATOM 1413 H GLY 44 -1.311 -8.957 -1.123 1.00 0.00 4HIR1401 ATOM 1414 1HA GLY 44 -0.100 -8.016 1.454 1.00 0.00 4HIR1402 ATOM 1415 2HA GLY 44 -0.789 -6.936 0.250 1.00 0.00 4HIR1403 ATOM 1416 N THR 45 -2.584 -6.995 2.173 1.00 0.00 4HIR1404 ATOM 1417 CA THR 45 -3.895 -7.018 2.886 1.00 0.00 4HIR1405 ATOM 1418 C THR 45 -4.536 -5.591 2.896 1.00 0.00 4HIR1406 ATOM 1419 O THR 45 -3.829 -4.603 2.920 1.00 0.00 4HIR1407 ATOM 1420 CB THR 45 -3.622 -7.499 4.315 1.00 0.00 4HIR1408 ATOM 1421 OG1 THR 45 -4.663 -8.419 4.605 1.00 0.00 4HIR1409 ATOM 1422 CG2 THR 45 -3.773 -6.382 5.354 1.00 0.00 4HIR1410 ATOM 1423 H THR 45 -1.976 -6.242 2.292 1.00 0.00 4HIR1411 ATOM 1424 HA THR 45 -4.539 -7.714 2.392 1.00 0.00 4HIR1412 ATOM 1425 HB THR 45 -2.659 -7.975 4.381 1.00 0.00 4HIR1413 ATOM 1426 HG1 THR 45 -5.398 -7.928 4.980 1.00 0.00 4HIR1414 ATOM 1427 1HG2 THR 45 -3.159 -5.537 5.077 1.00 0.00 4HIR1415 ATOM 1428 2HG2 THR 45 -4.805 -6.073 5.416 1.00 0.00 4HIR1416 ATOM 1429 3HG2 THR 45 -3.454 -6.745 6.321 1.00 0.00 4HIR1417 ATOM 1430 N PRO 46 -5.872 -5.516 2.881 1.00 0.00 4HIR1418 ATOM 1431 CA PRO 46 -6.578 -4.217 2.898 1.00 0.00 4HIR1419 ATOM 1432 C PRO 46 -6.188 -3.367 4.118 1.00 0.00 4HIR1420 ATOM 1433 O PRO 46 -5.570 -3.852 5.044 1.00 0.00 4HIR1421 ATOM 1434 CB PRO 46 -8.071 -4.580 2.980 1.00 0.00 4HIR1422 ATOM 1435 CG PRO 46 -8.175 -6.134 3.006 1.00 0.00 4HIR1423 ATOM 1436 CD PRO 46 -6.759 -6.693 2.848 1.00 0.00 4HIR1424 ATOM 1437 HA PRO 46 -6.373 -3.674 1.985 1.00 0.00 4HIR1425 ATOM 1438 1HB PRO 46 -8.501 -4.168 3.880 1.00 0.00 4HIR1426 ATOM 1439 2HB PRO 46 -8.593 -4.190 2.119 1.00 0.00 4HIR1427 ATOM 1440 1HG PRO 46 -8.594 -6.462 3.943 1.00 0.00 4HIR1428 ATOM 1441 2HG PRO 46 -8.795 -6.475 2.191 1.00 0.00 4HIR1429 ATOM 1442 1HD PRO 46 -6.522 -7.364 3.657 1.00 0.00 4HIR1430 ATOM 1443 2HD PRO 46 -6.671 -7.201 1.898 1.00 0.00 4HIR1431 ATOM 1444 N GLU 47 -6.567 -2.106 4.090 1.00 0.00 4HIR1432 ATOM 1445 CA GLU 47 -6.236 -1.214 5.236 1.00 0.00 4HIR1433 ATOM 1446 C GLU 47 -7.232 -1.453 6.397 1.00 0.00 4HIR1434 ATOM 1447 O GLU 47 -8.315 -1.961 6.184 1.00 0.00 4HIR1435 ATOM 1448 CB GLU 47 -6.288 0.267 4.793 1.00 0.00 4HIR1436 ATOM 1449 CG GLU 47 -6.479 0.361 3.285 1.00 0.00 4HIR1437 ATOM 1450 CD GLU 47 -7.934 0.022 2.938 1.00 0.00 4HIR1438 ATOM 1451 OE1 GLU 47 -8.529 -0.678 3.739 1.00 0.00 4HIR1439 ATOM 1452 OE2 GLU 47 -8.366 0.483 1.897 1.00 0.00 4HIR1440 ATOM 1453 H GLU 47 -7.044 -1.760 3.327 1.00 0.00 4HIR1441 ATOM 1454 HA GLU 47 -5.260 -1.446 5.545 1.00 0.00 4HIR1442 ATOM 1455 1HB GLU 47 -7.104 0.767 5.290 1.00 0.00 4HIR1443 ATOM 1456 2HB GLU 47 -5.363 0.756 5.057 1.00 0.00 4HIR1444 ATOM 1457 1HG GLU 47 -6.259 1.366 2.963 1.00 0.00 4HIR1445 ATOM 1458 2HG GLU 47 -5.810 -0.324 2.785 1.00 0.00 4HIR1446 ATOM 1460 N PRO 48 -6.845 -1.077 7.615 1.00 0.00 4HIR1447 ATOM 1461 CA PRO 48 -7.700 -1.293 8.792 1.00 0.00 4HIR1448 ATOM 1462 C PRO 48 -9.018 -0.518 8.690 1.00 0.00 4HIR1449 ATOM 1463 O PRO 48 -9.210 0.270 7.785 1.00 0.00 4HIR1450 ATOM 1464 CB PRO 48 -6.887 -0.756 9.982 1.00 0.00 4HIR1451 ATOM 1465 CG PRO 48 -5.592 -0.113 9.409 1.00 0.00 4HIR1452 ATOM 1466 CD PRO 48 -5.555 -0.414 7.902 1.00 0.00 4HIR1453 ATOM 1467 HA PRO 48 -7.899 -2.348 8.917 1.00 0.00 4HIR1454 ATOM 1468 1HB PRO 48 -7.462 -0.015 10.517 1.00 0.00 4HIR1455 ATOM 1469 2HB PRO 48 -6.633 -1.566 10.650 1.00 0.00 4HIR1456 ATOM 1470 1HG PRO 48 -5.608 0.955 9.570 1.00 0.00 4HIR1457 ATOM 1471 2HG PRO 48 -4.724 -0.537 9.891 1.00 0.00 4HIR1458 ATOM 1472 1HD PRO 48 -5.469 0.498 7.339 1.00 0.00 4HIR1459 ATOM 1473 2HD PRO 48 -4.733 -1.075 7.683 1.00 0.00 4HIR1460 ATOM 1474 N GLN 49 -9.895 -0.765 9.633 1.00 0.00 4HIR1461 ATOM 1475 CA GLN 49 -11.206 -0.046 9.642 1.00 0.00 4HIR1462 ATOM 1476 C GLN 49 -11.226 0.994 10.766 1.00 0.00 4HIR1463 ATOM 1477 O GLN 49 -11.846 2.021 10.543 1.00 0.00 4HIR1464 ATOM 1478 CB GLN 49 -12.331 -1.062 9.882 1.00 0.00 4HIR1465 ATOM 1479 CG GLN 49 -12.421 -2.028 8.696 1.00 0.00 4HIR1466 ATOM 1480 CD GLN 49 -13.853 -2.553 8.583 1.00 0.00 4HIR1467 ATOM 1481 OE1 GLN 49 -14.380 -3.155 9.498 1.00 0.00 4HIR1468 ATOM 1482 NE2 GLN 49 -14.519 -2.345 7.480 1.00 0.00 4HIR1469 ATOM 1483 OXT GLN 49 -10.622 0.701 11.785 1.00 0.00 4HIR1470 ATOM 1484 H GLN 49 -9.692 -1.421 10.332 1.00 0.00 4HIR1471 ATOM 1485 HA GLN 49 -11.353 0.452 8.696 1.00 0.00 4HIR1472 ATOM 1486 1HB GLN 49 -12.129 -1.618 10.786 1.00 0.00 4HIR1473 ATOM 1487 2HB GLN 49 -13.270 -0.540 9.995 1.00 0.00 4HIR1474 ATOM 1488 1HG GLN 49 -12.157 -1.518 7.781 1.00 0.00 4HIR1475 ATOM 1489 2HG GLN 49 -11.748 -2.859 8.847 1.00 0.00 4HIR1476 ATOM 1490 1HE2 GLN 49 -14.432 -1.490 7.010 1.00 0.00 4HIR1477 ATOM 1491 2HE2 GLN 49 -15.104 -3.045 7.121 1.00 0.00 4HIR1478 ENDMDL 4HIR1479 MODEL 3 4HIR1480 ATOM 1629 N VAL 1 -13.606 3.156 -6.545 1.00 0.00 4HIR1481 ATOM 1630 CA VAL 1 -13.685 4.270 -5.559 1.00 0.00 4HIR1482 ATOM 1631 C VAL 1 -12.324 4.447 -4.874 1.00 0.00 4HIR1483 ATOM 1632 O VAL 1 -11.476 3.579 -4.944 1.00 0.00 4HIR1484 ATOM 1633 CB VAL 1 -14.760 3.976 -4.504 1.00 0.00 4HIR1485 ATOM 1634 CG1 VAL 1 -16.135 3.983 -5.179 1.00 0.00 4HIR1486 ATOM 1635 CG2 VAL 1 -14.518 2.592 -3.887 1.00 0.00 4HIR1487 ATOM 1636 1H VAL 1 -12.839 3.345 -7.221 1.00 0.00 4HIR1488 ATOM 1637 2H VAL 1 -13.413 2.264 -6.044 1.00 0.00 4HIR1489 ATOM 1638 3H VAL 1 -14.508 3.080 -7.055 1.00 0.00 4HIR1490 ATOM 1639 HA VAL 1 -13.935 5.180 -6.082 1.00 0.00 4HIR1491 ATOM 1640 HB VAL 1 -14.728 4.730 -3.731 1.00 0.00 4HIR1492 ATOM 1641 1HG1 VAL 1 -16.081 3.450 -6.118 1.00 0.00 4HIR1493 ATOM 1642 2HG1 VAL 1 -16.858 3.503 -4.536 1.00 0.00 4HIR1494 ATOM 1643 3HG1 VAL 1 -16.445 4.999 -5.364 1.00 0.00 4HIR1495 ATOM 1644 1HG2 VAL 1 -13.464 2.453 -3.694 1.00 0.00 4HIR1496 ATOM 1645 2HG2 VAL 1 -15.064 2.509 -2.959 1.00 0.00 4HIR1497 ATOM 1646 3HG2 VAL 1 -14.857 1.824 -4.565 1.00 0.00 4HIR1498 ATOM 1647 N VAL 2 -12.143 5.566 -4.227 1.00 0.00 4HIR1499 ATOM 1648 CA VAL 2 -10.848 5.812 -3.542 1.00 0.00 4HIR1500 ATOM 1649 C VAL 2 -10.815 5.073 -2.200 1.00 0.00 4HIR1501 ATOM 1650 O VAL 2 -11.826 4.575 -1.743 1.00 0.00 4HIR1502 ATOM 1651 CB VAL 2 -10.713 7.318 -3.310 1.00 0.00 4HIR1503 ATOM 1652 CG1 VAL 2 -9.229 7.711 -3.281 1.00 0.00 4HIR1504 ATOM 1653 CG2 VAL 2 -11.399 8.060 -4.457 1.00 0.00 4HIR1505 ATOM 1654 H VAL 2 -12.855 6.239 -4.187 1.00 0.00 4HIR1506 ATOM 1655 HA VAL 2 -10.041 5.462 -4.167 1.00 0.00 4HIR1507 ATOM 1656 HB VAL 2 -11.184 7.582 -2.381 1.00 0.00 4HIR1508 ATOM 1657 1HG1 VAL 2 -8.634 6.879 -2.951 1.00 0.00 4HIR1509 ATOM 1658 2HG1 VAL 2 -8.911 8.002 -4.272 1.00 0.00 4HIR1510 ATOM 1659 3HG1 VAL 2 -9.086 8.539 -2.604 1.00 0.00 4HIR1511 ATOM 1660 1HG2 VAL 2 -11.248 7.523 -5.382 1.00 0.00 4HIR1512 ATOM 1661 2HG2 VAL 2 -12.458 8.136 -4.260 1.00 0.00 4HIR1513 ATOM 1662 3HG2 VAL 2 -10.983 9.053 -4.550 1.00 0.00 4HIR1514 ATOM 1663 N TYR 3 -9.653 5.019 -1.593 1.00 0.00 4HIR1515 ATOM 1664 CA TYR 3 -9.526 4.295 -0.293 1.00 0.00 4HIR1516 ATOM 1665 C TYR 3 -8.800 5.150 0.752 1.00 0.00 4HIR1517 ATOM 1666 O TYR 3 -8.695 6.354 0.618 1.00 0.00 4HIR1518 ATOM 1667 CB TYR 3 -8.729 3.012 -0.535 1.00 0.00 4HIR1519 ATOM 1668 CG TYR 3 -9.605 2.008 -1.293 1.00 0.00 4HIR1520 ATOM 1669 CD1 TYR 3 -10.389 1.105 -0.605 1.00 0.00 4HIR1521 ATOM 1670 CD2 TYR 3 -9.619 1.989 -2.672 1.00 0.00 4HIR1522 ATOM 1671 CE1 TYR 3 -11.175 0.196 -1.287 1.00 0.00 4HIR1523 ATOM 1672 CE2 TYR 3 -10.402 1.081 -3.353 1.00 0.00 4HIR1524 ATOM 1673 CZ TYR 3 -11.188 0.180 -2.667 1.00 0.00 4HIR1525 ATOM 1674 OH TYR 3 -11.970 -0.730 -3.349 1.00 0.00 4HIR1526 ATOM 1675 H TYR 3 -8.870 5.444 -1.994 1.00 0.00 4HIR1527 ATOM 1676 HA TYR 3 -10.502 4.045 0.082 1.00 0.00 4HIR1528 ATOM 1677 1HB TYR 3 -7.840 3.230 -1.112 1.00 0.00 4HIR1529 ATOM 1678 2HB TYR 3 -8.442 2.591 0.397 1.00 0.00 4HIR1530 ATOM 1679 HD1 TYR 3 -10.390 1.109 0.475 1.00 0.00 4HIR1531 ATOM 1680 HD2 TYR 3 -9.017 2.695 -3.222 1.00 0.00 4HIR1532 ATOM 1681 HE1 TYR 3 -11.786 -0.502 -0.737 1.00 0.00 4HIR1533 ATOM 1682 HE2 TYR 3 -10.402 1.077 -4.432 1.00 0.00 4HIR1534 ATOM 1683 HH TYR 3 -12.291 -0.302 -4.145 1.00 0.00 4HIR1535 ATOM 1684 N THR 4 -8.318 4.498 1.775 1.00 0.00 4HIR1536 ATOM 1685 CA THR 4 -7.596 5.220 2.846 1.00 0.00 4HIR1537 ATOM 1686 C THR 4 -6.098 5.098 2.604 1.00 0.00 4HIR1538 ATOM 1687 O THR 4 -5.684 4.547 1.609 1.00 0.00 4HIR1539 ATOM 1688 CB THR 4 -7.951 4.574 4.186 1.00 0.00 4HIR1540 ATOM 1689 OG1 THR 4 -8.396 3.266 3.857 1.00 0.00 4HIR1541 ATOM 1690 CG2 THR 4 -9.163 5.250 4.823 1.00 0.00 4HIR1542 ATOM 1691 H THR 4 -8.414 3.526 1.824 1.00 0.00 4HIR1543 ATOM 1692 HA THR 4 -7.881 6.258 2.847 1.00 0.00 4HIR1544 ATOM 1693 HB THR 4 -7.112 4.539 4.856 1.00 0.00 4HIR1545 ATOM 1694 HG1 THR 4 -8.095 3.066 2.969 1.00 0.00 4HIR1546 ATOM 1695 1HG2 THR 4 -9.993 5.234 4.134 1.00 0.00 4HIR1547 ATOM 1696 2HG2 THR 4 -9.439 4.724 5.725 1.00 0.00 4HIR1548 ATOM 1697 3HG2 THR 4 -8.921 6.274 5.068 1.00 0.00 4HIR1549 ATOM 1698 N ASP 5 -5.310 5.627 3.496 1.00 0.00 4HIR1550 ATOM 1699 CA ASP 5 -3.849 5.500 3.330 1.00 0.00 4HIR1551 ATOM 1700 C ASP 5 -3.315 4.338 4.165 1.00 0.00 4HIR1552 ATOM 1701 O ASP 5 -3.922 3.929 5.133 1.00 0.00 4HIR1553 ATOM 1702 CB ASP 5 -3.200 6.784 3.811 1.00 0.00 4HIR1554 ATOM 1703 CG ASP 5 -4.174 7.949 3.624 1.00 0.00 4HIR1555 ATOM 1704 OD1 ASP 5 -3.848 8.805 2.818 1.00 0.00 4HIR1556 ATOM 1705 OD2 ASP 5 -5.192 7.918 4.297 1.00 0.00 4HIR1557 ATOM 1706 H ASP 5 -5.673 6.121 4.257 1.00 0.00 4HIR1558 ATOM 1707 HA ASP 5 -3.614 5.335 2.289 1.00 0.00 4HIR1559 ATOM 1708 1HB ASP 5 -2.961 6.685 4.852 1.00 0.00 4HIR1560 ATOM 1709 2HB ASP 5 -2.298 6.975 3.251 1.00 0.00 4HIR1561 ATOM 1711 N CYS 6 -2.194 3.835 3.760 1.00 0.00 4HIR1562 ATOM 1712 CA CYS 6 -1.562 2.742 4.516 1.00 0.00 4HIR1563 ATOM 1713 C CYS 6 -0.928 3.272 5.786 1.00 0.00 4HIR1564 ATOM 1714 O CYS 6 -0.520 4.416 5.847 1.00 0.00 4HIR1565 ATOM 1715 CB CYS 6 -0.441 2.180 3.662 1.00 0.00 4HIR1566 ATOM 1716 SG CYS 6 -0.511 2.453 1.883 1.00 0.00 4HIR1567 ATOM 1717 H CYS 6 -1.819 4.110 2.909 1.00 0.00 4HIR1568 ATOM 1718 HA CYS 6 -2.287 1.974 4.748 1.00 0.00 4HIR1569 ATOM 1719 1HB CYS 6 0.465 2.622 4.009 1.00 0.00 4HIR1570 ATOM 1720 2HB CYS 6 -0.379 1.119 3.833 1.00 0.00 4HIR1571 ATOM 1722 N THR 7 -0.857 2.423 6.779 1.00 0.00 4HIR1572 ATOM 1723 CA THR 7 -0.230 2.839 8.058 1.00 0.00 4HIR1573 ATOM 1724 C THR 7 1.010 2.019 8.350 1.00 0.00 4HIR1574 ATOM 1725 O THR 7 1.725 2.273 9.294 1.00 0.00 4HIR1575 ATOM 1726 CB THR 7 -1.248 2.650 9.177 1.00 0.00 4HIR1576 ATOM 1727 OG1 THR 7 -2.052 3.819 9.148 1.00 0.00 4HIR1577 ATOM 1728 CG2 THR 7 -0.577 2.666 10.534 1.00 0.00 4HIR1578 ATOM 1729 H THR 7 -1.233 1.526 6.687 1.00 0.00 4HIR1579 ATOM 1730 HA THR 7 0.052 3.845 7.988 1.00 0.00 4HIR1580 ATOM 1731 HB THR 7 -1.845 1.761 9.032 1.00 0.00 4HIR1581 ATOM 1732 HG1 THR 7 -2.330 3.965 8.242 1.00 0.00 4HIR1582 ATOM 1733 1HG2 THR 7 0.149 3.463 10.569 1.00 0.00 4HIR1583 ATOM 1734 2HG2 THR 7 -1.317 2.824 11.300 1.00 0.00 4HIR1584 ATOM 1735 3HG2 THR 7 -0.081 1.722 10.703 1.00 0.00 4HIR1585 ATOM 1736 N GLU 8 1.245 1.088 7.511 1.00 0.00 4HIR1586 ATOM 1737 CA GLU 8 2.429 0.194 7.691 1.00 0.00 4HIR1587 ATOM 1738 C GLU 8 2.794 -0.496 6.381 1.00 0.00 4HIR1588 ATOM 1739 O GLU 8 2.136 -0.323 5.373 1.00 0.00 4HIR1589 ATOM 1740 CB GLU 8 2.091 -0.874 8.738 1.00 0.00 4HIR1590 ATOM 1741 CG GLU 8 2.826 -0.575 10.045 1.00 0.00 4HIR1591 ATOM 1742 CD GLU 8 4.291 -0.993 9.911 1.00 0.00 4HIR1592 ATOM 1743 OE1 GLU 8 4.621 -2.004 10.508 1.00 0.00 4HIR1593 ATOM 1744 OE2 GLU 8 4.997 -0.277 9.220 1.00 0.00 4HIR1594 ATOM 1745 H GLU 8 0.658 0.985 6.761 1.00 0.00 4HIR1595 ATOM 1746 HA GLU 8 3.270 0.781 8.016 1.00 0.00 4HIR1596 ATOM 1747 1HB GLU 8 1.027 -0.879 8.915 1.00 0.00 4HIR1597 ATOM 1748 2HB GLU 8 2.389 -1.843 8.370 1.00 0.00 4HIR1598 ATOM 1749 1HG GLU 8 2.773 0.476 10.265 1.00 0.00 4HIR1599 ATOM 1750 2HG GLU 8 2.369 -1.130 10.847 1.00 0.00 4HIR1600 ATOM 1752 N SER 9 3.844 -1.275 6.425 1.00 0.00 4HIR1601 ATOM 1753 CA SER 9 4.276 -1.983 5.226 1.00 0.00 4HIR1602 ATOM 1754 C SER 9 3.400 -3.199 5.032 1.00 0.00 4HIR1603 ATOM 1755 O SER 9 3.084 -3.892 5.991 1.00 0.00 4HIR1604 ATOM 1756 CB SER 9 5.701 -2.421 5.431 1.00 0.00 4HIR1605 ATOM 1757 OG SER 9 6.113 -1.743 6.611 1.00 0.00 4HIR1606 ATOM 1758 H SER 9 4.325 -1.411 7.254 1.00 0.00 4HIR1607 ATOM 1759 HA SER 9 4.201 -1.336 4.365 1.00 0.00 4HIR1608 ATOM 1760 1HB SER 9 5.739 -3.467 5.578 1.00 0.00 4HIR1609 ATOM 1761 2HB SER 9 6.316 -2.130 4.603 1.00 0.00 4HIR1610 ATOM 1762 HG SER 9 6.212 -0.812 6.400 1.00 0.00 4HIR1611 ATOM 1763 N GLY 10 3.073 -3.452 3.793 1.00 0.00 4HIR1612 ATOM 1764 CA GLY 10 2.105 -4.560 3.469 1.00 0.00 4HIR1613 ATOM 1765 C GLY 10 0.616 -4.464 3.172 1.00 0.00 4HIR1614 ATOM 1766 O GLY 10 0.012 -5.380 2.649 1.00 0.00 4HIR1615 ATOM 1767 H GLY 10 3.493 -2.933 3.070 1.00 0.00 4HIR1616 ATOM 1768 1HA GLY 10 2.12