#!rasmol -script # Creator: RasMol Version 2.6 background white load pdb inline set ambient 60 set specular on set specpower 8 reset slab off rotate z -86 rotate y -54 rotate x 153 zoom 98 set axes off set boundingbox off set unitcell off set bondmode and dots off # Avoid Colour Problems! select all colour bonds none colour backbone none colour hbonds none colour ssbonds none colour ribbons none colour white # Atoms select (atomno>=1) and (atomno<=582) color atoms cpk spacefill 50 set shadow on # Bonds select all wireframe on select all # Ribbons ribbons off # Backbone backbone 50 # Labels labels off ssbonds off hbonds off exit HEADER GENE REGULATING PROTEIN 08-DEC-88 2CRO 2CRO 3 COMPND 434 CRO PROTEIN 2CRO 4 SOURCE PHAGE 434 2CRO 5 AUTHOR A.MONDRAGON,C.WOLBERGER,S.C.HARRISON 2CRO 6 REVDAT 1 15-OCT-89 2CRO 0 2CRO 7 JRNL AUTH A.MONDRAGON,C.WOLBERGER,S.C.HARRISON 2CRO 8 JRNL TITL STRUCTURE OF PHAGE 434 CRO PROTEIN AT 2.35 2CRO 9 JRNL TITL 2 ANGSTROMS RESOLUTION 2CRO 10 JRNL REF J.MOL.BIOL. V. 205 179 1989 2CRO 11 JRNL REFN ASTM JMOBAK UK ISSN 0022-2836 070 2CRO 12 REMARK 1 2CRO 13 REMARK 2 2CRO 14 REMARK 2 RESOLUTION. 2.35 ANGSTROMS. 2CRO 15 REMARK 3 2CRO 16 REMARK 3 REFINEMENT. BY THE RESTRAINED LEAST SQUARES PROCEDURE OF J. 2CRO 17 REMARK 3 KONNERT AND W. HENDRICKSON (PROGRAM *PROLSQ*). THE R 2CRO 18 REMARK 3 VALUE IS 0.195. 2CRO 19 REMARK 3 2CRO 20 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES (THE VALUES OF 2CRO 21 REMARK 3 SIGMA, IN PARENTHESES, ARE THE INPUT ESTIMATED 2CRO 22 REMARK 3 STANDARD DEVIATIONS THAT DETERMINE THE RELATIVE 2CRO 23 REMARK 3 WEIGHTS OF THE CORRESPONDING RESTRAINTS) 2CRO 24 REMARK 3 DISTANCE RESTRAINTS (ANGSTROMS) 2CRO 25 REMARK 3 BOND DISTANCE 0.006(0.020) 2CRO 26 REMARK 3 ANGLE DISTANCE 0.026(0.040) 2CRO 27 REMARK 3 PLANAR 1-4 DISTANCE 0.025(0.050) 2CRO 28 REMARK 3 PLANE RESTRAINT (ANGSTROMS) 0.005(0.020) 2CRO 29 REMARK 3 CHIRAL-CENTER RESTRAINT (ANGSTROMS**3) 0.076(0.150) 2CRO 30 REMARK 3 NON-BONDED CONTACT RESTRAINTS (ANGSTROMS) 2CRO 31 REMARK 3 SINGLE TORSION CONTACT 0.203(0.500) 2CRO 32 REMARK 3 MULTIPLE TORSION CONTACT 0.313(0.500) 2CRO 33 REMARK 3 POSSIBLE HYDROGEN BOND 0.258(0.500) 2CRO 34 REMARK 3 CONFORMATIONAL TORSION ANGLE RESTRAINT (DEGREES) 2CRO 35 REMARK 3 PLANAR (OMEGA) 0.9(3.0) 2CRO 36 REMARK 3 STAGGERED 18.8(15.0) 2CRO 37 REMARK 3 TRANSVERSE 11.8(20.0) 2CRO 38 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS (ANGSTROMS**2) 2CRO 39 REMARK 3 MAIN-CHAIN BOND 1.150(2.500) 2CRO 40 REMARK 3 MAIN-CHAIN ANGLE 2.010(5.000) 2CRO 41 REMARK 3 SIDE-CHAIN BOND 1.260(2.500) 2CRO 42 REMARK 3 SIDE-CHAIN ANGLE 8.170(5.000) 2CRO 43 REMARK 4 2CRO 44 REMARK 4 THE RESIDUE NUMBERING IS THE SAME AS THAT USED FOR R1-69, 2CRO 45 REMARK 4 WITH THE FIRST TWO RESIDUES NUMBERED -1 AND 0. THE 2CRO 46 REMARK 4 NUMBERING OF THE FIVE ALPHA HELICES COINCIDES WITH THAT 2CRO 47 REMARK 4 USED FOR SIMILAR REPRESSORS. 2CRO 48 REMARK 5 2CRO 49 REMARK 5 DENSITY FOR THE LAST SIX CARBOXY TERMINAL RESIDUES (64 - 2CRO 50 REMARK 5 70) WAS NEVER SEEN IN THE MAP AT ANY STAGE OF REFINEMENT, 2CRO 51 REMARK 5 AND THESE RESIDUES ARE PROBABLY DISORDERED. 2CRO 52 SEQRES 1 71 MET GLN THR LEU SER GLU ARG LEU LYS LYS ARG ARG ILE 2CRO 53 SEQRES 2 71 ALA LEU LYS MET THR GLN THR GLU LEU ALA THR LYS ALA 2CRO 54 SEQRES 3 71 GLY VAL LYS GLN GLN SER ILE GLN LEU ILE GLU ALA GLY 2CRO 55 SEQRES 4 71 VAL THR LYS ARG PRO ARG PHE LEU PHE GLU ILE ALA MET 2CRO 56 SEQRES 5 71 ALA LEU ASN CYS ASP PRO VAL TRP LEU GLN TYR GLY THR 2CRO 57 SEQRES 6 71 LYS ARG GLY LYS ALA ALA 2CRO 58 FTNOTE 1 2CRO 59 FTNOTE 1 SEE REMARK 5. 2CRO 60 FORMUL 2 HOH *17(H2 O1) 2CRO 61 HELIX 1 H1 THR 1 ALA 12 1 2CRO 62 HELIX 2 H2 THR 16 THR 22 1 2CRO 63 HELIX 3 H3 GLN 28 ALA 36 1 2CRO 64 HELIX 4 H4 LEU 45 ALA 51 1 2CRO 65 HELIX 5 H5 PRO 56 TYR 61 1 2CRO 66 CRYST1 49.820 49.820 154.200 90.00 90.00 120.00 R 32 18 2CRO 67 ORIGX1 1.000000 0.000000 0.000000 0.00000 2CRO 68 ORIGX2 0.000000 1.000000 0.000000 0.00000 2CRO 69 ORIGX3 0.000000 0.000000 1.000000 0.00000 2CRO 70 SCALE1 0.020072 0.011589 0.000000 0.00000 2CRO 71 SCALE2 0.000000 0.023177 0.000000 0.00000 2CRO 72 SCALE3 0.000000 0.000000 0.006485 0.00000 2CRO 73 ATOM 1 N MET -1 22.763 5.580 12.506 1.00 57.49 2CRO 74 ATOM 2 CA MET -1 21.346 5.232 12.330 1.00 57.64 2CRO 75 ATOM 3 C MET -1 21.110 4.818 10.877 1.00 57.49 2CRO 76 ATOM 4 O MET -1 19.943 4.746 10.455 1.00 58.01 2CRO 77 ATOM 5 CB MET -1 20.461 6.417 12.700 1.00 58.15 2CRO 78 ATOM 6 CG MET -1 19.112 6.002 13.207 1.00 58.97 2CRO 79 ATOM 7 SD MET -1 17.861 7.269 12.766 1.00 59.76 2CRO 80 ATOM 8 CE MET -1 17.868 7.083 10.966 1.00 59.45 2CRO 81 ATOM 9 N GLN 0 22.192 4.566 10.163 1.00 56.85 2CRO 82 ATOM 10 CA GLN 0 22.164 4.178 8.746 1.00 55.76 2CRO 83 ATOM 11 C GLN 0 22.051 2.676 8.526 1.00 53.89 2CRO 84 ATOM 12 O GLN 0 21.931 2.223 7.373 1.00 54.19 2CRO 85 ATOM 13 CB GLN 0 23.322 4.782 7.937 1.00 56.91 2CRO 86 ATOM 14 CG GLN 0 23.118 6.275 7.768 1.00 58.47 2CRO 87 ATOM 15 CD GLN 0 23.796 6.904 6.584 1.00 59.80 2CRO 88 ATOM 16 OE1 GLN 0 24.382 6.277 5.702 1.00 60.52 2CRO 89 ATOM 17 NE2 GLN 0 23.697 8.239 6.554 1.00 60.33 2CRO 90 ATOM 18 N THR 1 22.063 1.925 9.607 1.00 51.39 2CRO 91 ATOM 19 CA THR 1 21.913 0.457 9.535 1.00 48.63 2CRO 92 ATOM 20 C THR 1 20.559 0.124 10.166 1.00 46.38 2CRO 93 ATOM 21 O THR 1 20.084 0.861 11.055 1.00 45.76 2CRO 94 ATOM 22 CB THR 1 23.150 -0.280 10.159 1.00 48.67 2CRO 95 ATOM 23 OG1 THR 1 23.194 -1.611 9.544 1.00 49.00 2CRO 96 ATOM 24 CG2 THR 1 23.165 -0.380 11.679 1.00 48.43 2CRO 97 ATOM 25 N LEU 2 19.961 -0.954 9.700 1.00 44.02 2CRO 98 ATOM 26 CA LEU 2 18.666 -1.453 10.170 1.00 42.05 2CRO 99 ATOM 27 C LEU 2 18.631 -1.733 11.675 1.00 41.54 2CRO 100 ATOM 28 O LEU 2 17.643 -1.419 12.366 1.00 41.97 2CRO 101 ATOM 29 CB LEU 2 18.302 -2.689 9.340 1.00 40.72 2CRO 102 ATOM 30 CG LEU 2 17.302 -3.634 9.980 1.00 39.85 2CRO 103 ATOM 31 CD1 LEU 2 15.948 -2.969 10.182 1.00 39.33 2CRO 104 ATOM 32 CD2 LEU 2 17.192 -4.857 9.079 1.00 39.89 2CRO 105 ATOM 33 N SER 3 19.699 -2.322 12.173 1.00 40.19 2CRO 106 ATOM 34 CA SER 3 19.839 -2.651 13.587 1.00 39.34 2CRO 107 ATOM 35 C SER 3 19.859 -1.355 14.403 1.00 38.88 2CRO 108 ATOM 36 O SER 3 19.322 -1.317 15.518 1.00 38.66 2CRO 109 ATOM 37 CB SER 3 21.058 -3.507 13.851 1.00 39.44 2CRO 110 ATOM 38 OG SER 3 22.303 -2.923 13.556 1.00 38.93 2CRO 111 ATOM 39 N GLU 4 20.471 -0.343 13.833 1.00 38.77 2CRO 112 ATOM 40 CA GLU 4 20.623 0.977 14.431 1.00 39.66 2CRO 113 ATOM 41 C GLU 4 19.319 1.768 14.451 1.00 37.65 2CRO 114 ATOM 42 O GLU 4 18.969 2.503 15.387 1.00 38.14 2CRO 115 ATOM 43 CB GLU 4 21.579 1.856 13.627 1.00 42.91 2CRO 116 ATOM 44 CG GLU 4 23.086 1.642 13.781 1.00 46.51 2CRO 117 ATOM 45 CD GLU 4 23.855 2.486 12.792 1.00 49.08 2CRO 118 ATOM 46 OE1 GLU 4 23.632 2.457 11.590 1.00 49.88 2CRO 119 ATOM 47 OE2 GLU 4 24.695 3.200 13.385 1.00 50.92 2CRO 120 ATOM 48 N ARG 5 18.640 1.594 13.342 1.00 34.90 2CRO 121 ATOM 49 CA ARG 5 17.347 2.233 13.068 1.00 32.27 2CRO 122 ATOM 50 C ARG 5 16.286 1.642 13.986 1.00 29.84 2CRO 123 ATOM 51 O ARG 5 15.512 2.414 14.585 1.00 29.46 2CRO 124 ATOM 52 CB ARG 5 17.083 2.109 11.578 1.00 32.93 2CRO 125 ATOM 53 CG ARG 5 16.173 3.135 10.934 1.00 34.28 2CRO 126 ATOM 54 CD ARG 5 16.620 3.401 9.533 1.00 35.38 2CRO 127 ATOM 55 NE ARG 5 16.735 2.143 8.798 1.00 36.27 2CRO 128 ATOM 56 CZ ARG 5 17.712 2.002 7.895 1.00 37.05 2CRO 129 ATOM 57 NH1 ARG 5 18.542 3.015 7.674 1.00 37.52 2CRO 130 ATOM 58 NH2 ARG 5 17.850 0.835 7.275 1.00 37.54 2CRO 131 ATOM 59 N LEU 6 16.277 0.332 14.150 1.00 27.18 2CRO 132 ATOM 60 CA LEU 6 15.284 -0.320 15.005 1.00 26.16 2CRO 133 ATOM 61 C LEU 6 15.518 -0.048 16.481 1.00 25.67 2CRO 134 ATOM 62 O LEU 6 14.522 0.131 17.208 1.00 25.37 2CRO 135 ATOM 63 CB LEU 6 15.188 -1.797 14.631 1.00 26.41 2CRO 136 ATOM 64 CG LEU 6 14.659 -2.819 15.620 1.00 26.28 2CRO 137 ATOM 65 CD1 LEU 6 13.429 -2.353 16.360 1.00 26.32 2CRO 138 ATOM 66 CD2 LEU 6 14.276 -4.063 14.819 1.00 27.07 2CRO 139 ATOM 67 N LYS 7 16.768 -0.035 16.879 1.00 25.77 2CRO 140 ATOM 68 CA LYS 7 17.154 0.201 18.284 1.00 25.85 2CRO 141 ATOM 69 C LYS 7 16.807 1.621 18.705 1.00 23.56 2CRO 142 ATOM 70 O LYS 7 16.228 1.837 19.773 1.00 22.14 2CRO 143 ATOM 71 CB LYS 7 18.634 -0.107 18.559 1.00 27.99 2CRO 144 ATOM 72 CG LYS 7 18.949 0.009 20.053 1.00 30.13 2CRO 145 ATOM 73 CD LYS 7 20.101 -0.870 20.507 1.00 31.77 2CRO 146 ATOM 74 CE LYS 7 21.421 -0.438 19.913 1.00 33.44 2CRO 147 ATOM 75 NZ LYS 7 22.547 -0.841 20.813 1.00 35.19 2CRO 148 ATOM 76 N LYS 8 17.166 2.551 17.849 1.00 22.90 2CRO 149 ATOM 77 CA LYS 8 16.890 3.975 18.064 1.00 24.32 2CRO 150 ATOM 78 C LYS 8 15.390 4.255 18.138 1.00 23.47 2CRO 151 ATOM 79 O LYS 8 14.972 5.001 19.045 1.00 25.25 2CRO 152 ATOM 80 CB LYS 8 17.555 4.827 16.988 1.00 25.85 2CRO 153 ATOM 81 CG LYS 8 18.969 5.271 17.318 1.00 28.56 2CRO 154 ATOM 82 CD LYS 8 19.667 4.428 18.381 1.00 31.08 2CRO 155 ATOM 83 CE LYS 8 21.147 4.776 18.489 1.00 32.47 2CRO 156 ATOM 84 NZ LYS 8 21.711 4.425 19.827 1.00 32.68 2CRO 157 ATOM 85 N ARG 9 14.593 3.714 17.237 1.00 20.97 2CRO 158 ATOM 86 CA ARG 9 13.134 3.908 17.214 1.00 19.63 2CRO 159 ATOM 87 C ARG 9 12.501 3.208 18.412 1.00 20.38 2CRO 160 ATOM 88 O ARG 9 11.665 3.792 19.116 1.00 20.75 2CRO 161 ATOM 89 CB ARG 9 12.548 3.479 15.897 1.00 19.76 2CRO 162 ATOM 90 CG ARG 9 11.045 3.536 15.718 1.00 18.47 2CRO 163 ATOM 91 CD ARG 9 10.558 4.938 15.662 1.00 17.10 2CRO 164 ATOM 92 NE ARG 9 9.115 4.866 15.403 1.00 17.11 2CRO 165 ATOM 93 CZ ARG 9 8.406 6.007 15.316 1.00 16.20 2CRO 166 ATOM 94 NH1 ARG 9 9.071 7.135 15.497 1.00 15.07 2CRO 167 ATOM 95 NH2 ARG 9 7.104 5.944 15.042 1.00 15.09 2CRO 168 ATOM 96 N ARG 10 12.926 1.998 18.718 1.00 20.66 2CRO 169 ATOM 97 CA ARG 10 12.429 1.244 19.871 1.00 19.98 2CRO 170 ATOM 98 C ARG 10 12.567 2.106 21.136 1.00 20.95 2CRO 171 ATOM 99 O ARG 10 11.630 2.267 21.947 1.00 20.87 2CRO 172 ATOM 100 CB ARG 10 13.170 -0.092 20.087 1.00 17.85 2CRO 173 ATOM 101 CG ARG 10 12.739 -0.746 21.403 1.00 17.18 2CRO 174 ATOM 102 CD ARG 10 13.145 -2.177 21.520 1.00 16.50 2CRO 175 ATOM 103 NE ARG 10 14.596 -2.303 21.488 1.00 16.15 2CRO 176 ATOM 104 CZ ARG 10 15.354 -1.903 22.519 1.00 16.48 2CRO 177 ATOM 105 NH1 ARG 10 14.823 -1.369 23.624 1.00 15.40 2CRO 178 ATOM 106 NH2 ARG 10 16.675 -2.085 22.405 1.00 16.97 2CRO 179 ATOM 107 N ILE 11 13.764 2.641 21.290 1.00 21.45 2CRO 180 ATOM 108 CA ILE 11 14.121 3.477 22.434 1.00 23.05 2CRO 181 ATOM 109 C ILE 11 13.413 4.824 22.433 1.00 23.79 2CRO 182 ATOM 110 O ILE 11 13.174 5.343 23.539 1.00 26.00 2CRO 183 ATOM 111 CB ILE 11 15.673 3.616 22.592 1.00 23.74 2CRO 184 ATOM 112 CG1 ILE 11 16.260 2.296 23.136 1.00 23.22 2CRO 185 ATOM 113 CG2 ILE 11 16.006 4.851 23.475 1.00 24.39 2CRO 186 ATOM 114 CD1 ILE 11 17.785 2.295 23.371 1.00 24.11 2CRO 187 ATOM 115 N ALA 12 13.095 5.349 21.278 1.00 23.12 2CRO 188 ATOM 116 CA ALA 12 12.381 6.630 21.145 1.00 22.68 2CRO 189 ATOM 117 C ALA 12 10.959 6.456 21.653 1.00 23.41 2CRO 190 ATOM 118 O ALA 12 10.303 7.320 22.247 1.00 25.21 2CRO 191 ATOM 119 CB ALA 12 12.466 7.069 19.698 1.00 22.06 2CRO 192 ATOM 120 N LEU 13 10.416 5.275 21.457 1.00 23.70 2CRO 193 ATOM 121 CA LEU 13 9.077 4.870 21.859 1.00 22.78 2CRO 194 ATOM 122 C LEU 13 9.059 4.338 23.277 1.00 23.01 2CRO 195 ATOM 123 O LEU 13 8.028 3.789 23.672 1.00 23.70 2CRO 196 ATOM 124 CB LEU 13 8.553 3.852 20.828 1.00 22.11 2CRO 197 ATOM 125 CG LEU 13 7.658 4.453 19.749 1.00 21.24 2CRO 198 ATOM 126 CD1 LEU 13 8.383 5.629 19.106 1.00 20.87 2CRO 199 ATOM 127 CD2 LEU 13 7.338 3.340 18.758 1.00 20.79 2CRO 200 ATOM 128 N LYS 14 10.158 4.483 23.973 1.00 24.03 2CRO 201 ATOM 129 CA LYS 14 10.322 4.036 25.359 1.00 23.85 2CRO 202 ATOM 130 C LYS 14 9.975 2.578 25.557 1.00 23.23 2CRO 203 ATOM 131 O LYS 14 9.286 2.325 26.555 1.00 24.24 2CRO 204 ATOM 132 CB LYS 14 9.435 4.836 26.321 1.00 25.19 2CRO 205 ATOM 133 CG LYS 14 10.137 6.027 26.975 1.00 26.95 2CRO 206 ATOM 134 CD LYS 14 11.119 6.760 26.068 1.00 27.59 2CRO 207 ATOM 135 CE LYS 14 10.569 8.134 25.699 1.00 28.72 2CRO 208 ATOM 136 NZ LYS 14 10.166 8.850 26.943 1.00 29.39 2CRO 209 ATOM 137 N MET 15 10.416 1.692 24.693 1.00 22.91 2CRO 210 ATOM 138 CA MET 15 10.122 0.267 24.817 1.00 22.33 2CRO 211 ATOM 139 C MET 15 11.424 -0.521 25.031 1.00 22.49 2CRO 212 ATOM 140 O MET 15 12.519 -0.135 24.618 1.00 22.00 2CRO 213 ATOM 141 CB MET 15 9.455 -0.372 23.621 1.00 22.64 2CRO 214 ATOM 142 CG MET 15 8.145 0.171 23.173 1.00 24.19 2CRO 215 ATOM 143 SD MET 15 7.622 -0.854 21.737 1.00 24.90 2CRO 216 ATOM 144 CE MET 15 6.463 0.274 20.975 1.00 26.00 2CRO 217 ATOM 145 N THR 16 11.177 -1.661 25.641 1.00 24.08 2CRO 218 ATOM 146 CA THR 16 12.197 -2.681 25.951 1.00 25.18 2CRO 219 ATOM 147 C THR 16 12.128 -3.686 24.802 1.00 25.64 2CRO 220 ATOM 148 O THR 16 11.115 -3.616 24.069 1.00 27.17 2CRO 221 ATOM 149 CB THR 16 11.966 -3.365 27.351 1.00 24.68 2CRO 222 ATOM 150 OG1 THR 16 10.613 -3.920 27.270 1.00 24.70 2CRO 223 ATOM 151 CG2 THR 16 12.160 -2.404 28.524 1.00 23.86 2CRO 224 ATOM 152 N GLN 17 13.112 -4.538 24.653 1.00 25.17 2CRO 225 ATOM 153 CA GLN 17 13.119 -5.528 23.564 1.00 25.59 2CRO 226 ATOM 154 C GLN 17 11.984 -6.540 23.719 1.00 25.94 2CRO 227 ATOM 155 O GLN 17 11.485 -7.113 22.735 1.00 25.91 2CRO 228 ATOM 156 CB GLN 17 14.458 -6.263 23.497 1.00 25.92 2CRO 229 ATOM 157 CG GLN 17 15.607 -5.368 23.096 1.00 27.15 2CRO 230 ATOM 158 CD GLN 17 16.928 -6.058 23.344 1.00 28.44 2CRO 231 ATOM 159 OE1 GLN 17 17.004 -6.849 24.281 1.00 29.80 2CRO 232 ATOM 160 NE2 GLN 17 17.912 -5.759 22.507 1.00 28.48 2CRO 233 ATOM 161 N THR 18 11.640 -6.751 24.980 1.00 25.58 2CRO 234 ATOM 162 CA THR 18 10.604 -7.664 25.447 1.00 24.42 2CRO 235 ATOM 163 C THR 18 9.222 -7.154 25.088 1.00 23.30 2CRO 236 ATOM 164 O THR 18 8.404 -7.946 24.590 1.00 22.53 2CRO 237 ATOM 165 CB THR 18 10.760 -7.902 27.003 1.00 25.52 2CRO 238 ATOM 166 OG1 THR 18 12.056 -8.582 27.105 1.00 26.15 2CRO 239 ATOM 167 CG2 THR 18 9.594 -8.655 27.642 1.00 25.51 2CRO 240 ATOM 168 N GLU 19 9.032 -5.867 25.333 1.00 22.75 2CRO 241 ATOM 169 CA GLU 19 7.753 -5.245 24.993 1.00 24.16 2CRO 242 ATOM 170 C GLU 19 7.634 -5.176 23.475 1.00 23.66 2CRO 243 ATOM 171 O GLU 19 6.516 -5.352 22.955 1.00 25.13 2CRO 244 ATOM 172 CB GLU 19 7.596 -3.854 25.590 1.00 27.04 2CRO 245 ATOM 173 CG GLU 19 7.679 -3.761 27.101 1.00 30.79 2CRO 246 ATOM 174 CD GLU 19 7.800 -2.410 27.736 1.00 32.96 2CRO 247 ATOM 175 OE1 GLU 19 7.374 -1.383 27.256 1.00 33.86 2CRO 248 ATOM 176 OE2 GLU 19 8.374 -2.469 28.848 1.00 34.62 2CRO 249 ATOM 177 N LEU 20 8.727 -4.914 22.778 1.00 22.35 2CRO 250 ATOM 178 CA LEU 20 8.693 -4.831 21.308 1.00 21.67 2CRO 251 ATOM 179 C LEU 20 8.217 -6.212 20.837 1.00 22.63 2CRO 252 ATOM 180 O LEU 20 7.244 -6.327 20.081 1.00 25.06 2CRO 253 ATOM 181 CB LEU 20 10.034 -4.416 20.713 1.00 20.62 2CRO 254 ATOM 182 CG LEU 20 10.097 -3.777 19.331 1.00 19.69 2CRO 255 ATOM 183 CD1 LEU 20 11.389 -4.103 18.586 1.00 18.37 2CRO 256 ATOM 184 CD2 LEU 20 8.909 -4.173 18.467 1.00 19.06 2CRO 257 ATOM 185 N ALA 21 8.898 -7.232 21.323 1.00 21.48 2CRO 258 ATOM 186 CA ALA 21 8.629 -8.630 21.010 1.00 20.14 2CRO 259 ATOM 187 C ALA 21 7.179 -9.001 21.260 1.00 19.59 2CRO 260 ATOM 188 O ALA 21 6.585 -9.588 20.347 1.00 20.39 2CRO 261 ATOM 189 CB ALA 21 9.565 -9.532 21.799 1.00 20.85 2CRO 262 ATOM 190 N THR 22 6.632 -8.704 22.407 1.00 19.34 2CRO 263 ATOM 191 CA THR 22 5.237 -9.020 22.752 1.00 20.31 2CRO 264 ATOM 192 C THR 22 4.286 -8.381 21.748 1.00 21.43 2CRO 265 ATOM 193 O THR 22 3.518 -9.111 21.112 1.00 22.95 2CRO 266 ATOM 194 CB THR 22 4.828 -8.645 24.228 1.00 20.05 2CRO 267 ATOM 195 OG1 THR 22 5.681 -9.443 25.103 1.00 19.49 2CRO 268 ATOM 196 CG2 THR 22 3.357 -8.861 24.580 1.00 19.69 2CRO 269 ATOM 197 N LYS 23 4.342 -7.080 21.595 1.00 21.68 2CRO 270 ATOM 198 CA LYS 23 3.520 -6.293 20.676 1.00 21.43 2CRO 271 ATOM 199 C LYS 23 3.587 -6.665 19.205 1.00 21.55 2CRO 272 ATOM 200 O LYS 23 2.614 -6.436 18.449 1.00 22.07 2CRO 273 ATOM 201 CB LYS 23 3.928 -4.810 20.759 1.00 21.60 2CRO 274 ATOM 202 CG LYS 23 3.670 -4.228 22.152 1.00 23.08 2CRO 275 ATOM 203 CD LYS 23 3.612 -2.707 22.051 1.00 24.84 2CRO 276 ATOM 204 CE LYS 23 3.025 -2.098 23.309 1.00 26.44 2CRO 277 ATOM 205 NZ LYS 23 4.104 -1.478 24.129 1.00 28.29 2CRO 278 ATOM 206 N ALA 24 4.706 -7.217 18.782 1.00 21.44 2CRO 279 ATOM 207 CA ALA 24 4.945 -7.614 17.388 1.00 21.22 2CRO 280 ATOM 208 C ALA 24 4.618 -9.086 17.203 1.00 22.83 2CRO 281 ATOM 209 O ALA 24 4.375 -9.559 16.086 1.00 24.01 2CRO 282 ATOM 210 CB ALA 24 6.384 -7.294 17.008 1.00 20.24 2CRO 283 ATOM 211 N GLY 25 4.616 -9.794 18.312 1.00 24.44 2CRO 284 ATOM 212 CA GLY 25 4.324 -11.224 18.351 1.00 26.73 2CRO 285 ATOM 213 C GLY 25 5.460 -12.081 17.827 1.00 28.42 2CRO 286 ATOM 214 O GLY 25 5.162 -13.082 17.162 1.00 29.73 2CRO 287 ATOM 215 N VAL 26 6.698 -11.730 18.103 1.00 29.86 2CRO 288 ATOM 216 CA VAL 26 7.870 -12.497 17.675 1.00 31.53 2CRO 289 ATOM 217 C VAL 26 8.703 -12.800 18.929 1.00 33.72 2CRO 290 ATOM 218 O VAL 26 8.407 -12.312 20.026 1.00 34.40 2CRO 291 ATOM 219 CB VAL 26 8.686 -11.853 16.550 1.00 30.97 2CRO 292 ATOM 220 CG1 VAL 26 7.895 -11.654 15.263 1.00 30.91 2CRO 293 ATOM 221 CG2 VAL 26 9.348 -10.557 16.975 1.00 30.81 2CRO 294 ATOM 222 N LYS 27 9.719 -13.612 18.734 1.00 35.98 2CRO 295 ATOM 223 CA LYS 27 10.624 -14.018 19.810 1.00 38.04 2CRO 296 ATOM 224 C LYS 27 11.561 -12.860 20.152 1.00 38.11 2CRO 297 ATOM 225 O LYS 27 12.121 -12.187 19.274 1.00 38.16 2CRO 298 ATOM 226 CB LYS 27 11.488 -15.215 19.429 1.00 39.93 2CRO 299 ATOM 227 CG LYS 27 10.768 -16.511 19.080 1.00 41.83 2CRO 300 ATOM 228 CD LYS 27 11.691 -17.448 18.296 1.00 43.17 2CRO 301 ATOM 229 CE LYS 27 10.957 -18.692 17.839 1.00 44.16 2CRO 302 ATOM 230 NZ LYS 27 11.720 -19.377 16.760 1.00 44.89 2CRO 303 ATOM 231 N GLN 28 11.755 -12.700 21.439 1.00 38.39 2CRO 304 ATOM 232 CA GLN 28 12.645 -11.653 21.967 1.00 39.41 2CRO 305 ATOM 233 C GLN 28 14.088 -11.856 21.505 1.00 39.49 2CRO 306 ATOM 234 O GLN 28 14.873 -10.891 21.443 1.00 39.84 2CRO 307 ATOM 235 CB GLN 28 12.470 -11.567 23.473 1.00 40.14 2CRO 308 ATOM 236 CG GLN 28 12.742 -10.152 23.956 1.00 41.80 2CRO 309 ATOM 237 CD GLN 28 14.097 -10.141 24.631 1.00 42.92 2CRO 310 ATOM 238 OE1 GLN 28 15.063 -10.391 23.921 1.00 44.06 2CRO 311 ATOM 239 NE2 GLN 28 14.053 -9.873 25.931 1.00 42.89 2CRO 312 ATOM 240 N GLN 29 14.444 -13.075 21.162 1.00 39.12 2CRO 313 ATOM 241 CA GLN 29 15.762 -13.473 20.676 1.00 38.94 2CRO 314 ATOM 242 C GLN 29 15.870 -13.038 19.211 1.00 38.27 2CRO 315 ATOM 243 O GLN 29 16.975 -13.029 18.649 1.00 39.14 2CRO 316 ATOM 244 CB GLN 29 16.045 -14.978 20.789 1.00 40.19 2CRO 317 ATOM 245 CG GLN 29 17.244 -15.406 19.961 1.00 41.99 2CRO 318 ATOM 246 CD GLN 29 17.626 -16.864 20.001 1.00 43.11 2CRO 319 ATOM 247 OE1 GLN 29 16.943 -17.763 19.503 1.00 43.61 2CRO 320 ATOM 248 NE2 GLN 29 18.784 -17.131 20.614 1.00 43.38 2CRO 321 ATOM 249 N SER 30 14.726 -12.703 18.631 1.00 36.56 2CRO 322 ATOM 250 CA SER 30 14.654 -12.257 17.236 1.00 34.65 2CRO 323 ATOM 251 C SER 30 15.046 -10.784 17.134 1.00 32.36 2CRO 324 ATOM 252 O SER 30 15.640 -10.396 16.113 1.00 32.71 2CRO 325 ATOM 253 CB SER 30 13.289 -12.463 16.597 1.00 35.56 2CRO 326 ATOM 254 OG SER 30 13.156 -13.793 16.132 1.00 36.83 2CRO 327 ATOM 255 N ILE 31 14.700 -10.042 18.159 1.00 29.69 2CRO 328 ATOM 256 CA ILE 31 14.994 -8.609 18.237 1.00 28.78 2CRO 329 ATOM 257 C ILE 31 16.479 -8.338 18.496 1.00 29.23 2CRO 330 ATOM 258 O ILE 31 17.127 -7.501 17.848 1.00 27.89 2CRO 331 ATOM 259 CB ILE 31 14.077 -7.911 19.307 1.00 27.28 2CRO 332 ATOM 260 CG1 ILE 31 12.583 -8.227 19.062 1.00 25.42 2CRO 333 ATOM 261 CG2 ILE 31 14.388 -6.392 19.354 1.00 27.14 2CRO 334 ATOM 262 CD1 ILE 31 11.894 -7.520 17.884 1.00 23.83 2CRO 335 ATOM 263 N GLN 32 17.015 -9.060 19.463 1.00 30.95 2CRO 336 ATOM 264 CA GLN 32 18.424 -8.979 19.878 1.00 32.06 2CRO 337 ATOM 265 C GLN 32 19.311 -9.209 18.654 1.00 32.14 2CRO 338 ATOM 266 O GLN 32 20.227 -8.403 18.432 1.00 33.98 2CRO 339 ATOM 267 CB GLN 32 18.795 -9.963 20.971 1.00 33.32 2CRO 340 ATOM 268 CG GLN 32 17.774 -10.052 22.094 1.00 35.25 2CRO 341 ATOM 269 CD GLN 32 18.227 -11.053 23.142 1.00 36.70 2CRO 342 ATOM 270 OE1 GLN 32 18.285 -12.260 22.897 1.00 37.58 2CRO 343 ATOM 271 NE2 GLN 32 18.563 -10.505 24.306 1.00 36.93 2CRO 344 ATOM 272 N LEU 33 19.024 -10.250 17.905 1.00 30.84 2CRO 345 ATOM 273 CA LEU 33 19.756 -10.614 16.692 1.00 30.28 2CRO 346 ATOM 274 C LEU 33 19.704 -9.502 15.638 1.00 29.86 2CRO 347 ATOM 275 O LEU 33 20.677 -9.230 14.898 1.00 28.77 2CRO 348 ATOM 276 CB LEU 33 19.172 -11.950 16.232 1.00 30.99 2CRO 349 ATOM 277 CG LEU 33 19.487 -13.208 17.024 1.00 31.61 2CRO 350 ATOM 278 CD1 LEU 33 18.945 -14.440 16.299 1.00 31.57 2CRO 351 ATOM 279 CD2 LEU 33 21.002 -13.336 17.198 1.00 31.81 2CRO 352 ATOM 280 N ILE 34 18.539 -8.862 15.554 1.00 29.26 2CRO 353 ATOM 281 CA ILE 34 18.363 -7.768 14.596 1.00 28.68 2CRO 354 ATOM 282 C ILE 34 19.167 -6.573 15.136 1.00 29.01 2CRO 355 ATOM 283 O ILE 34 19.953 -5.971 14.384 1.00 28.57 2CRO 356 ATOM 284 CB ILE 34 16.881 -7.380 14.284 1.00 28.09 2CRO 357 ATOM 285 CG1 ILE 34 16.020 -8.561 13.775 1.00 26.87 2CRO 358 ATOM 286 CG2 ILE 34 16.786 -6.206 13.255 1.00 28.13 2CRO 359 ATOM 287 CD1 ILE 34 14.490 -8.291 13.891 1.00 25.96 2CRO 360 ATOM 288 N GLU 35 18.941 -6.269 16.407 1.00 29.74 2CRO 361 ATOM 289 CA GLU 35 19.641 -5.117 17.013 1.00 31.55 2CRO 362 ATOM 290 C GLU 35 21.143 -5.344 17.099 1.00 33.08 2CRO 363 ATOM 291 O GLU 35 21.912 -4.361 16.990 1.00 34.39 2CRO 364 ATOM 292 CB GLU 35 19.048 -4.661 18.338 1.00 30.84 2CRO 365 ATOM 293 CG GLU 35 17.641 -4.058 18.301 1.00 30.28 2CRO 366 ATOM 294 CD GLU 35 17.097 -3.519 19.587 1.00 30.19 2CRO 367 ATOM 295 OE1 GLU 35 16.061 -2.894 19.729 1.00 29.94 2CRO 368 ATOM 296 OE2 GLU 35 17.813 -3.754 20.581 1.00 30.58 2CRO 369 ATOM 297 N ALA 36 21.573 -6.585 17.256 1.00 33.33 2CRO 370 ATOM 298 CA ALA 36 23.005 -6.905 17.327 1.00 33.74 2CRO 371 ATOM 299 C ALA 36 23.599 -7.020 15.924 1.00 34.64 2CRO 372 ATOM 300 O ALA 36 24.756 -7.435 15.771 1.00 35.72 2CRO 373 ATOM 301 CB ALA 36 23.237 -8.155 18.159 1.00 33.35 2CRO 374 ATOM 302 N GLY 37 22.853 -6.678 14.898 1.00 34.88 2CRO 375 ATOM 303 CA GLY 37 23.214 -6.692 13.505 1.00 35.71 2CRO 376 ATOM 304 C GLY 37 23.415 -8.021 12.818 1.00 37.22 2CRO 377 ATOM 305 O GLY 37 23.930 -8.014 11.677 1.00 37.82 2CRO 378 ATOM 306 N VAL 38 23.028 -9.123 13.437 1.00 38.11 2CRO 379 ATOM 307 CA VAL 38 23.164 -10.482 12.869 1.00 37.93 2CRO 380 ATOM 308 C VAL 38 22.164 -10.677 11.731 1.00 38.81 2CRO 381 ATOM 309 O VAL 38 22.553 -10.981 10.587 1.00 39.30 2CRO 382 ATOM 310 CB VAL 38 23.038 -11.533 13.983 1.00 37.06 2CRO 383 ATOM 311 CG1 VAL 38 22.923 -12.964 13.501 1.00 36.44 2CRO 384 ATOM 312 CG2 VAL 38 24.170 -11.432 14.986 1.00 37.31 2CRO 385 ATOM 313 N THR 39 20.896 -10.478 12.044 1.00 39.36 2CRO 386 ATOM 314 CA THR 39 19.827 -10.627 11.038 1.00 40.66 2CRO 387 ATOM 315 C THR 39 19.617 -9.322 10.281 1.00 41.67 2CRO 388 ATOM 316 O THR 39 19.081 -8.310 10.757 1.00 41.68 2CRO 389 ATOM 317 CB THR 39 18.539 -11.197 11.741 1.00 40.83 2CRO 390 ATOM 318 OG1 THR 39 19.079 -11.803 12.965 1.00 41.33 2CRO 391 ATOM 319 CG2 THR 39 17.756 -12.232 10.936 1.00 40.74 2CRO 392 ATOM 320 N LYS 40 20.059 -9.366 9.042 1.00 43.03 2CRO 393 ATOM 321 CA LYS 40 20.012 -8.278 8.074 1.00 44.55 2CRO 394 ATOM 322 C LYS 40 18.640 -8.206 7.403 1.00 44.72 2CRO 395 ATOM 323 O LYS 40 18.187 -7.082 7.121 1.00 45.19 2CRO 396 ATOM 324 CB LYS 40 21.070 -8.385 6.987 1.00 45.86 2CRO 397 ATOM 325 CG LYS 40 22.495 -8.748 7.359 1.00 47.04 2CRO 398 ATOM 326 CD LYS 40 23.133 -7.883 8.419 1.00 48.03 2CRO 399 ATOM 327 CE LYS 40 22.564 -6.482 8.479 1.00 49.06 2CRO 400 ATOM 328 NZ LYS 40 22.239 -5.975 7.118 1.00 49.71 2CRO 401 ATOM 329 N ARG 41 18.050 -9.358 7.163 1.00 44.60 2CRO 402 ATOM 330 CA ARG 41 16.726 -9.423 6.524 1.00 45.52 2CRO 403 ATOM 331 C ARG 41 15.726 -10.130 7.434 1.00 44.41 2CRO 404 ATOM 332 O ARG 41 15.565 -11.356 7.305 1.00 45.49 2CRO 405 ATOM 333 CB ARG 41 16.785 -10.131 5.165 1.00 47.43 2CRO 406 ATOM 334 CG ARG 41 17.254 -11.583 5.232 1.00 49.52 2CRO 407 ATOM 335 CD ARG 41 18.549 -11.721 5.965 1.00 51.09 2CRO 408 ATOM 336 NE ARG 41 18.467 -12.743 6.998 1.00 52.65 2CRO 409 ATOM 337 CZ ARG 41 19.460 -13.064 7.832 1.00 53.76 2CRO 410 ATOM 338 NH1 ARG 41 19.279 -13.991 8.780 1.00 54.18 2CRO 411 ATOM 339 NH2 ARG 41 20.637 -12.442 7.716 1.00 54.14 2CRO 412 ATOM 340 N PRO 42 15.106 -9.373 8.327 1.00 42.42 2CRO 413 ATOM 341 CA PRO 42 14.127 -9.922 9.261 1.00 41.54 2CRO 414 ATOM 342 C PRO 42 12.884 -10.502 8.596 1.00 41.09 2CRO 415 ATOM 343 O PRO 42 12.292 -9.953 7.649 1.00 40.47 2CRO 416 ATOM 344 CB PRO 42 13.801 -8.762 10.191 1.00 41.61 2CRO 417 ATOM 345 CG PRO 42 14.310 -7.516 9.544 1.00 41.56 2CRO 418 ATOM 346 CD PRO 42 15.306 -7.929 8.489 1.00 41.71 2CRO 419 ATOM 347 N ARG 43 12.470 -11.648 9.121 1.00 41.01 2CRO 420 ATOM 348 CA ARG 43 11.286 -12.365 8.629 1.00 41.54 2CRO 421 ATOM 349 C ARG 43 10.002 -11.581 8.895 1.00 40.94 2CRO 422 ATOM 350 O ARG 43 9.209 -11.421 7.942 1.00 42.01 2CRO 423 ATOM 351 CB ARG 43 11.201 -13.769 9.217 1.00 42.94 2CRO 424 ATOM 352 CG ARG 43 10.234 -14.716 8.515 1.00 44.27 2CRO 425 ATOM 353 CD ARG 43 10.775 -16.117 8.576 1.00 45.39 2CRO 426 ATOM 354 NE ARG 43 10.274 -16.808 9.754 1.00 46.15 2CRO 427 ATOM 355 CZ ARG 43 9.017 -17.273 9.721 1.00 47.33 2CRO 428 ATOM 356 NH1 ARG 43 8.267 -17.142 8.626 1.00 47.42 2CRO 429 ATOM 357 NH2 ARG 43 8.532 -17.839 10.826 1.00 48.13 2CRO 430 ATOM 358 N PHE 44 9.804 -11.104 10.114 1.00 38.83 2CRO 431 ATOM 359 CA PHE 44 8.590 -10.333 10.448 1.00 36.87 2CRO 432 ATOM 360 C PHE 44 8.811 -8.819 10.500 1.00 33.87 2CRO 433 ATOM 361 O PHE 44 8.339 -8.208 11.486 1.00 34.99 2CRO 434 ATOM 362 CB PHE 44 8.003 -10.835 11.772 1.00 38.20 2CRO 435 ATOM 363 CG PHE 44 7.790 -12.321 11.792 1.00 39.85 2CRO 436 ATOM 364 CD1 PHE 44 6.612 -12.860 11.259 1.00 40.48 2CRO 437 ATOM 365 CD2 PHE 44 8.761 -13.165 12.322 1.00 40.37 2CRO 438 ATOM 366 CE1 PHE 44 6.408 -14.231 11.262 1.00 41.07 2CRO 439 ATOM 367 CE2 PHE 44 8.569 -14.552 12.339 1.00 40.87 2CRO 440 ATOM 368 CZ PHE 44 7.384 -15.080 11.801 1.00 41.13 2CRO 441 ATOM 369 N LEU 45 9.456 -8.225 9.527 1.00 29.15 2CRO 442 ATOM 370 CA LEU 45 9.728 -6.804 9.497 1.00 26.95 2CRO 443 ATOM 371 C LEU 45 8.460 -5.950 9.571 1.00 25.60 2CRO 444 ATOM 372 O LEU 45 8.427 -4.885 10.217 1.00 24.76 2CRO 445 ATOM 373 CB LEU 45 10.563 -6.433 8.245 1.00 26.71 2CRO 446 ATOM 374 CG LEU 45 11.024 -4.973 8.272 1.00 25.98 2CRO 447 ATOM 375 CD1 LEU 45 12.311 -4.847 9.073 1.00 25.61 2CRO 448 ATOM 376 CD2 LEU 45 11.222 -4.466 6.868 1.00 26.38 2CRO 449 ATOM 377 N PHE 46 7.450 -6.416 8.873 1.00 24.03 2CRO 450 ATOM 378 CA PHE 46 6.147 -5.755 8.802 1.00 23.21 2CRO 451 ATOM 379 C PHE 46 5.540 -5.565 10.190 1.00 22.50 2CRO 452 ATOM 380 O PHE 46 5.184 -4.455 10.616 1.00 21.16 2CRO 453 ATOM 381 CB PHE 46 5.216 -6.538 7.856 1.00 23.99 2CRO 454 ATOM 382 CG PHE 46 3.910 -5.797 7.706 1.00 24.22 2CRO 455 ATOM 383 CD1 PHE 46 2.806 -6.189 8.445 1.00 24.10 2CRO 456 ATOM 384 CD2 PHE 46 3.839 -4.692 6.866 1.00 24.76 2CRO 457 ATOM 385 CE1 PHE 46 1.617 -5.501 8.350 1.00 24.58 2CRO 458 ATOM 386 CE2 PHE 46 2.651 -3.974 6.747 1.00 25.41 2CRO 459 ATOM 387 CZ PHE 46 1.542 -4.406 7.498 1.00 25.56 2CRO 460 ATOM 388 N GLU 47 5.387 -6.670 10.901 1.00 23.10 2CRO 461 ATOM 389 CA GLU 47 4.840 -6.715 12.261 1.00 22.94 2CRO 462 ATOM 390 C GLU 47 5.714 -5.868 13.197 1.00 21.82 2CRO 463 ATOM 391 O GLU 47 5.149 -5.130 14.027 1.00 23.06 2CRO 464 ATOM 392 CB GLU 47 4.791 -8.115 12.875 1.00 23.89 2CRO 465 ATOM 393 CG GLU 47 3.859 -9.100 12.193 1.00 25.97 2CRO 466 ATOM 394 CD GLU 47 4.179 -9.498 10.793 1.00 27.79 2CRO 467 ATOM 395 OE1 GLU 47 5.261 -9.429 10.238 1.00 28.66 2CRO 468 ATOM 396 OE2 GLU 47 3.169 -9.953 10.214 1.00 29.48 2CRO 469 ATOM 397 N ILE 48 7.024 -5.990 13.032 1.00 18.83 2CRO 470 ATOM 398 CA ILE 48 7.941 -5.212 13.882 1.00 17.80 2CRO 471 ATOM 399 C ILE 48 7.696 -3.731 13.679 1.00 16.41 2CRO 472 ATOM 400 O ILE 48 7.603 -2.995 14.668 1.00 16.11 2CRO 473 ATOM 401 CB ILE 48 9.425 -5.689 13.724 1.00 18.19 2CRO 474 ATOM 402 CG1 ILE 48 9.490 -7.123 14.317 1.00 17.90 2CRO 475 ATOM 403 CG2 ILE 48 10.448 -4.704 14.362 1.00 16.88 2CRO 476 ATOM 404 CD1 ILE 48 10.805 -7.903 14.043 1.00 18.25 2CRO 477 ATOM 405 N ALA 49 7.565 -3.306 12.447 1.00 16.92 2CRO 478 ATOM 406 CA ALA 49 7.314 -1.925 12.020 1.00 15.95 2CRO 479 ATOM 407 C ALA 49 5.956 -1.451 12.525 1.00 17.28 2CRO 480 ATOM 408 O ALA 49 5.823 -0.289 12.937 1.00 18.53 2CRO 481 ATOM 409 CB ALA 49 7.323 -1.805 10.510 1.00 14.86 2CRO 482 ATOM 410 N MET 50 4.984 -2.358 12.481 1.00 17.73 2CRO 483 ATOM 411 CA MET 50 3.630 -1.978 12.966 1.00 17.27 2CRO 484 ATOM 412 C MET 50 3.760 -1.624 14.450 1.00 16.20 2CRO 485 ATOM 413 O MET 50 3.255 -0.567 14.851 1.00 17.18 2CRO 486 ATOM 414 CB MET 50 2.582 -3.015 12.630 1.00 17.47 2CRO 487 ATOM 415 CG MET 50 2.209 -3.121 11.178 1.00 17.80 2CRO 488 ATOM 416 SD MET 50 1.591 -1.557 10.514 1.00 19.39 2CRO 489 ATOM 417 CE MET 50 3.084 -0.833 9.803 1.00 19.25 2CRO 490 ATOM 418 N ALA 51 4.427 -2.449 15.233 1.00 15.09 2CRO 491 ATOM 419 CA ALA 51 4.620 -2.184 16.668 1.00 15.22 2CRO 492 ATOM 420 C ALA 51 5.404 -0.911 16.957 1.00 15.64 2CRO 493 ATOM 421 O ALA 51 5.219 -0.305 18.035 1.00 15.60 2CRO 494 ATOM 422 CB ALA 51 5.201 -3.414 17.347 1.00 14.47 2CRO 495 ATOM 423 N LEU 52 6.268 -0.476 16.059 1.00 17.03 2CRO 496 ATOM 424 CA LEU 52 7.088 0.737 16.174 1.00 16.38 2CRO 497 ATOM 425 C LEU 52 6.438 1.936 15.491 1.00 17.06 2CRO 498 ATOM 426 O LEU 52 7.053 3.012 15.348 1.00 17.34 2CRO 499 ATOM 427 CB LEU 52 8.494 0.468 15.652 1.00 15.67 2CRO 500 ATOM 428 CG LEU 52 9.384 -0.522 16.391 1.00 15.04 2CRO 501 ATOM 429 CD1 LEU 52 10.687 -0.690 15.605 1.00 14.61 2CRO 502 ATOM 430 CD2 LEU 52 9.661 -0.046 17.801 1.00 12.82 2CRO 503 ATOM 431 N ASN 53 5.194 1.768 15.080 1.00 18.40 2CRO 504 ATOM 432 CA ASN 53 4.404 2.826 14.436 1.00 19.89 2CRO 505 ATOM 433 C ASN 53 5.209 3.571 13.382 1.00 19.82 2CRO 506 ATOM 434 O ASN 53 5.273 4.790 13.485 1.00 20.47 2CRO 507 ATOM 435 CB ASN 53 3.879 3.835 15.488 1.00 20.14 2CRO 508 ATOM 436 CG ASN 53 2.874 3.171 16.401 1.00 20.77 2CRO 509 ATOM 437 OD1 ASN 53 2.804 3.415 17.600 1.00 22.69 2CRO 510 ATOM 438 ND2 ASN 53 2.058 2.269 15.878 1.00 21.39 2CRO 511 ATOM 439 N CYS 54 5.773 2.863 12.437 1.00 20.62 2CRO 512 ATOM 440 CA CYS 54 6.600 3.459 11.369 1.00 19.77 2CRO 513 ATOM 441 C CYS 54 6.385 2.671 10.075 1.00 20.06 2CRO 514 ATOM 442 O CYS 54 5.716 1.632 10.052 1.00 18.83 2CRO 515 ATOM 443 CB CYS 54 8.082 3.502 11.774 1.00 17.46 2CRO 516 ATOM 444 SG CYS 54 8.894 1.892 11.902 1.00 14.19 2CRO 517 ATOM 445 N ASP 55 6.969 3.195 9.025 1.00 22.05 2CRO 518 ATOM 446 CA ASP 55 6.888 2.591 7.685 1.00 24.25 2CRO 519 ATOM 447 C ASP 55 7.949 1.498 7.583 1.00 23.18 2CRO 520 ATOM 448 O ASP 55 9.142 1.739 7.837 1.00 21.73 2CRO 521 ATOM 449 CB ASP 55 7.040 3.713 6.654 1.00 28.19 2CRO 522 ATOM 450 CG ASP 55 6.949 3.176 5.238 1.00 31.49 2CRO 523 ATOM 451 OD1 ASP 55 7.654 2.253 4.815 1.00 32.45 2CRO 524 ATOM 452 OD2 ASP 55 6.076 3.724 4.532 1.00 34.72 2CRO 525 ATOM 453 N PRO 56 7.486 0.320 7.200 1.00 23.41 2CRO 526 ATOM 454 CA PRO 56 8.364 -0.849 7.046 1.00 24.44 2CRO 527 ATOM 455 C PRO 56 9.507 -0.578 6.071 1.00 26.09 2CRO 528 ATOM 456 O PRO 56 10.666 -0.964 6.309 1.00 26.83 2CRO 529 ATOM 457 CB PRO 56 7.449 -1.993 6.651 1.00 23.12 2CRO 530 ATOM 458 CG PRO 56 6.059 -1.516 6.912 1.00 23.06 2CRO 531 ATOM 459 CD PRO 56 6.090 -0.003 6.873 1.00 22.87 2CRO 532 ATOM 460 N VAL 57 9.186 0.091 4.984 1.00 27.03 2CRO 533 ATOM 461 CA VAL 57 10.144 0.460 3.931 1.00 27.72 2CRO 534 ATOM 462 C VAL 57 11.203 1.311 4.609 1.00 28.51 2CRO 535 ATOM 463 O VAL 57 12.400 1.005 4.479 1.00 30.10 2CRO 536 ATOM 464 CB VAL 57 9.416 1.092 2.735 1.00 28.04 2CRO 537 ATOM 465 CG1 VAL 57 10.312 1.792 1.727 1.00 28.44 2CRO 538 ATOM 466 CG2 VAL 57 8.550 0.065 2.017 1.00 27.90 2CRO 539 ATOM 467 N TRP 58 10.774 2.327 5.328 1.00 29.10 2CRO 540 ATOM 468 CA TRP 58 11.678 3.224 6.055 1.00 29.54 2CRO 541 ATOM 469 C TRP 58 12.611 2.436 6.990 1.00 29.90 2CRO 542 ATOM 470 O TRP 58 13.828 2.716 7.075 1.00 30.70 2CRO 543 ATOM 471 CB TRP 58 10.943 4.283 6.896 1.00 29.67 2CRO 544 ATOM 472 CG TRP 58 11.933 4.929 7.822 1.00 29.92 2CRO 545 ATOM 473 CD1 TRP 58 12.843 5.894 7.508 1.00 29.92 2CRO 546 ATOM 474 CD2 TRP 58 12.137 4.620 9.211 1.00 30.11 2CRO 547 ATOM 475 NE1 TRP 58 13.588 6.219 8.612 1.00 30.20 2CRO 548 ATOM 476 CE2 TRP 58 13.182 5.453 9.669 1.00 30.29 2CRO 549 ATOM 477 CE3 TRP 58 11.536 3.740 10.099 1.00 29.84 2CRO 550 ATOM 478 CZ2 TRP 58 13.639 5.416 10.983 1.00 30.24 2CRO 551 ATOM 479 CZ3 TRP 58 11.996 3.706 11.400 1.00 29.74 2CRO 552 ATOM 480 CH2 TRP 58 13.027 4.522 11.845 1.00 29.73 2CRO 553 ATOM 481 N LEU 59 12.020 1.473 7.687 1.00 28.97 2CRO 554 ATOM 482 CA LEU 59 12.806 0.664 8.629 1.00 28.63 2CRO 555 ATOM 483 C LEU 59 13.874 -0.165 7.931 1.00 29.27 2CRO 556 ATOM 484 O LEU 59 15.011 -0.209 8.432 1.00 29.64 2CRO 557 ATOM 485 CB LEU 59 11.843 -0.157 9.492 1.00 27.91 2CRO 558 ATOM 486 CG LEU 59 12.415 -0.882 10.700 1.00 26.98 2CRO 559 ATOM 487 CD1 LEU 59 13.160 0.078 11.629 1.00 26.38 2CRO 560 ATOM 488 CD2 LEU 59 11.262 -1.556 11.440 1.00 25.98 2CRO 561 ATOM 489 N GLN 60 13.507 -0.803 6.838 1.00 29.89 2CRO 562 ATOM 490 CA GLN 60 14.406 -1.673 6.083 1.00 30.56 2CRO 563 ATOM 491 C GLN 60 15.485 -0.954 5.304 1.00 30.97 2CRO 564 ATOM 492 O GLN 60 16.648 -1.390 5.377 1.00 31.52 2CRO 565 ATOM 493 CB GLN 60 13.641 -2.616 5.164 1.00 31.93 2CRO 566 ATOM 494 CG GLN 60 14.510 -3.586 4.398 1.00 33.80 2CRO 567 ATOM 495 CD GLN 60 14.892 -4.842 5.120 1.00 35.23 2CRO 568 ATOM 496 OE1 GLN 60 14.097 -5.538 5.740 1.00 36.21 2CRO 569 ATOM 497 NE2 GLN 60 16.179 -5.189 5.048 1.00 36.11 2CRO 570 ATOM 498 N TYR 61 15.117 0.099 4.608 1.00 31.62 2CRO 571 ATOM 499 CA TYR 61 16.036 0.885 3.774 1.00 31.04 2CRO 572 ATOM 500 C TYR 61 16.461 2.245 4.285 1.00 31.45 2CRO 573 ATOM 501 O TYR 61 17.462 2.784 3.775 1.00 31.99 2CRO 574 ATOM 502 CB TYR 61 15.370 1.034 2.380 1.00 29.67 2CRO 575 ATOM 503 CG TYR 61 15.077 -0.324 1.786 1.00 29.10 2CRO 576 ATOM 504 CD1 TYR 61 13.787 -0.824 1.671 1.00 29.33 2CRO 577 ATOM 505 CD2 TYR 61 16.124 -1.124 1.345 1.00 29.37 2CRO 578 ATOM 506 CE1 TYR 61 13.560 -2.083 1.123 1.00 29.91 2CRO 579 ATOM 507 CE2 TYR 61 15.925 -2.383 0.797 1.00 29.30 2CRO 580 ATOM 508 CZ TYR 61 14.634 -2.850 0.685 1.00 30.02 2CRO 581 ATOM 509 OH TYR 61 14.445 -4.094 0.139 1.00 31.79 2CRO 582 ATOM 510 N GLY 62 15.731 2.807 5.217 1.00 31.84 2CRO 583 ATOM 511 CA GLY 62 16.027 4.115 5.796 1.00 32.22 2CRO 584 ATOM 512 C GLY 62 15.468 5.310 5.040 1.00 31.89 2CRO 585 ATOM 513 O GLY 62 15.937 6.454 5.267 1.00 34.48 2CRO 586 ATOM 514 N THR 63 14.493 5.115 4.168 1.00 28.56 1 2CRO 587 ATOM 515 CA THR 63 13.922 6.249 3.431 1.00 24.57 1 2CRO 588 ATOM 516 C THR 63 12.482 6.492 3.898 1.00 19.64 1 2CRO 589 ATOM 517 O THR 63 11.691 5.636 3.380 1.00 22.66 1 2CRO 590 ATOM 518 CB THR 63 13.911 5.968 1.881 1.00 27.20 1 2CRO 591 ATOM 519 OG1 THR 63 12.982 4.842 1.761 1.00 29.48 1 2CRO 592 ATOM 520 CG2 THR 63 15.304 5.713 1.304 1.00 27.64 1 2CRO 593 HETATM 566 O HOH 100 8.469 8.827 21.523 1.00 30.96 2CRO 594 HETATM 567 O HOH 101 7.434 12.809 22.549 1.00 40.10 2CRO 595 HETATM 568 O HOH 102 20.485 -6.196 11.306 1.00 36.40 2CRO 596 HETATM 569 O HOH 103 11.966 7.656 15.677 1.00 39.46 2CRO 597 HETATM 570 O HOH 104 20.304 -0.545 24.556 1.00 37.58 2CRO 598 HETATM 571 O HOH 105 14.057 -6.842 27.891 1.00 28.47 2CRO 599 HETATM 572 O HOH 106 9.122 -11.646 25.097 1.00 52.85 2CRO 600 HETATM 573 O HOH 107 5.657 3.862 23.109 1.00 89.85 2CRO 601 HETATM 574 O HOH 108 7.622 -9.030 7.184 1.00 38.09 2CRO 602 HETATM 575 O HOH 109 0.874 -9.776 9.416 1.00 28.64 2CRO 603 HETATM 576 O HOH 110 3.675 1.325 20.409 1.00 49.64 2CRO 604 HETATM 577 O HOH 113 9.873 -14.941 16.095 1.00 37.61 2CRO 605 HETATM 578 O HOH 115 13.292 -15.440 25.041 1.00 47.15 2CRO 606 HETATM 579 O HOH 117 4.479 -12.465 13.780 1.00 60.67 2CRO 607 HETATM 580 O HOH 118 20.264 -15.033 11.593 1.00 52.76 2CRO 608 HETATM 581 O HOH 119 6.108 -15.433 19.196 1.00 35.83 2CRO 609 HETATM 582 O HOH 120 18.076 -11.130 8.588 1.00 99.41 2CRO 610 MASTER 40 2 0 5 0 0 0 6 537 0 0 6 2CRO 611 END 2CRO 612 .