==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-MAR-12 4E2P . COMPND 2 MOLECULE: CYTOCHROME P450 107B1 (P450CVIIB1); . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES HIMASTATINICUS; . AUTHOR H.D.ZHANG,J.CHEN,H.WANG,L.HUANG,H.J.ZHANG . 370 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17129.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 15 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 138 37.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 1 1 1 1 2 0 1 0 1 1 0 1 0 1 1 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 4 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 164 0, 0.0 2,-0.3 0, 0.0 229,-0.1 0.000 360.0 360.0 360.0 129.0 36.3 64.7 -9.4 2 2 A T - 0 0 75 227,-0.1 5,-0.0 1,-0.1 0, 0.0 -0.505 360.0-134.0 -71.6 122.6 38.4 67.2 -7.5 3 3 A T > - 0 0 18 -2,-0.3 4,-1.7 1,-0.1 3,-0.3 -0.279 20.8-111.4 -70.9 157.5 38.3 66.8 -3.7 4 4 A P H > S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 6,-0.2 0.861 118.8 58.4 -53.7 -37.8 37.7 69.7 -1.2 5 5 A A H >>S+ 0 0 1 1,-0.2 4,-1.2 2,-0.2 5,-1.0 0.867 108.4 43.1 -61.3 -41.2 41.3 69.1 -0.1 6 6 A E H 45S+ 0 0 112 -3,-0.3 -1,-0.2 3,-0.2 -4,-0.1 0.798 110.9 57.2 -74.6 -31.0 42.8 69.7 -3.6 7 7 A R H <5S+ 0 0 117 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.853 126.3 12.7 -69.9 -38.1 40.5 72.7 -4.2 8 8 A W H <5S- 0 0 53 -4,-1.7 -2,-0.2 344,-0.0 -1,-0.2 0.360 103.7-107.3-125.3 3.5 41.6 74.8 -1.2 9 9 A G T <5 - 0 0 39 -4,-1.2 2,-0.3 -5,-0.2 -3,-0.2 0.940 41.2-165.1 68.6 50.5 44.7 73.1 0.1 10 10 A I < - 0 0 2 -5,-1.0 -1,-0.2 -6,-0.2 4,-0.1 -0.552 63.6 -29.1 -70.1 124.3 43.3 71.6 3.3 11 11 A H > - 0 0 16 -2,-0.3 3,-1.7 1,-0.1 -1,-0.2 0.819 62.7-164.7 30.3 80.0 46.1 70.5 5.7 12 12 A P T 3 S+ 0 0 81 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.792 87.9 60.7 -58.1 -29.2 48.9 69.6 3.2 13 13 A E T 3 S+ 0 0 104 1,-0.2 2,-1.7 2,-0.1 3,-0.1 0.663 82.3 86.7 -72.8 -18.5 50.7 67.8 6.0 14 14 A H X - 0 0 0 -3,-1.7 3,-1.8 1,-0.2 4,-0.3 -0.627 62.4-177.2 -81.4 81.1 47.7 65.4 6.3 15 15 A F G > >S+ 0 0 34 -2,-1.7 5,-1.9 1,-0.3 3,-1.3 0.732 72.6 65.0 -56.4 -29.0 49.0 63.0 3.6 16 16 A W G > 5S+ 0 0 13 1,-0.3 3,-1.2 3,-0.2 -1,-0.3 0.731 90.0 65.4 -68.8 -25.1 45.9 60.8 3.8 17 17 A L G < 5S+ 0 0 6 -3,-1.8 -1,-0.3 1,-0.2 -12,-0.2 0.629 104.8 46.8 -69.6 -14.2 43.7 63.6 2.5 18 18 A Y G < 5S- 0 0 65 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.2 0.132 123.6-101.1-115.7 16.5 45.6 63.4 -0.8 19 19 A G T < 5S+ 0 0 49 -3,-1.2 2,-0.3 1,-0.3 -3,-0.2 0.469 74.8 142.4 81.4 3.4 45.5 59.6 -1.2 20 20 A R < - 0 0 143 -5,-1.9 -1,-0.3 -6,-0.1 -2,-0.2 -0.626 43.3-136.8 -82.7 133.5 49.1 59.0 0.1 21 21 A R - 0 0 205 -2,-0.3 2,-0.2 -3,-0.1 -1,-0.0 -0.582 18.3-111.6 -88.1 147.0 49.7 56.0 2.2 22 22 A P - 0 0 31 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.574 18.4-131.0 -74.0 143.0 51.8 55.9 5.4 23 23 A R S S+ 0 0 228 -2,-0.2 2,-0.3 1,-0.2 -2,-0.0 0.920 95.9 12.2 -55.9 -47.3 55.0 53.9 5.2 24 24 A Q S S- 0 0 93 1,-0.1 -1,-0.2 -3,-0.0 3,-0.1 -0.965 70.9-132.4-130.4 149.3 54.0 52.2 8.5 25 25 A M S S+ 0 0 51 -2,-0.3 13,-3.0 1,-0.2 14,-1.2 0.687 104.5 40.9 -74.0 -18.9 50.7 52.2 10.3 26 26 A V E S+A 37 0A 2 11,-0.2 2,-0.4 246,-0.2 -1,-0.2 -0.958 78.5 171.8-130.2 114.0 52.6 52.9 13.5 27 27 A E E -A 36 0A 52 9,-2.5 9,-3.6 -2,-0.4 2,-0.4 -0.975 24.7-141.3-129.2 135.0 55.4 55.5 13.3 28 28 A F E -A 35 0A 65 -2,-0.4 2,-0.5 7,-0.2 7,-0.2 -0.753 14.5-156.3 -91.6 138.7 57.6 57.2 15.8 29 29 A D E >> -A 34 0A 54 5,-2.1 5,-1.4 -2,-0.4 4,-1.3 -0.973 11.0-166.2-118.9 123.8 58.5 60.9 15.3 30 30 A E T 45S+ 0 0 155 -2,-0.5 -1,-0.1 2,-0.2 5,-0.0 0.869 91.6 51.9 -72.9 -39.7 61.7 62.4 16.9 31 31 A K T 45S+ 0 0 199 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.887 120.3 34.3 -63.3 -42.4 60.7 66.0 16.2 32 32 A M T 45S- 0 0 74 2,-0.2 -1,-0.2 0, 0.0 -2,-0.2 0.706 97.8-140.4 -82.5 -22.8 57.2 65.5 17.8 33 33 A N T <5 + 0 0 111 -4,-1.3 248,-0.5 1,-0.2 2,-0.3 0.945 66.3 102.3 51.6 54.3 58.5 63.0 20.4 34 34 A A E - 0 0 0 -14,-1.2 4,-1.8 1,-0.1 250,-0.2 -0.482 67.8-137.1 -85.6 149.9 45.9 52.5 10.7 40 40 A Y H > S+ 0 0 10 249,-0.3 4,-2.1 2,-0.2 5,-0.2 0.938 105.0 43.6 -66.7 -51.9 42.3 51.6 11.4 41 41 A A H > S+ 0 0 54 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.887 115.6 49.4 -62.1 -41.3 42.9 48.3 13.1 42 42 A E H > S+ 0 0 19 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.844 109.3 52.8 -67.0 -36.1 45.8 49.7 15.1 43 43 A A H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.908 108.6 49.4 -63.5 -45.0 43.6 52.6 16.2 44 44 A I H X S+ 0 0 41 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.871 110.7 51.0 -62.2 -40.0 40.9 50.3 17.5 45 45 A E H < S+ 0 0 101 -4,-1.8 4,-0.3 2,-0.2 -1,-0.2 0.903 113.2 44.4 -64.0 -44.6 43.5 48.3 19.4 46 46 A V H >< S+ 0 0 1 -4,-2.0 3,-1.1 1,-0.2 7,-0.3 0.938 117.3 44.6 -65.7 -48.2 44.9 51.4 21.1 47 47 A L H 3< S+ 0 0 6 -4,-2.8 271,-0.4 1,-0.2 272,-0.2 0.781 109.4 58.0 -67.2 -29.3 41.5 52.8 21.8 48 48 A G T 3< S+ 0 0 58 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.461 101.1 58.8 -82.0 -2.9 40.3 49.4 23.1 49 49 A D <> + 0 0 58 -3,-1.1 4,-2.8 -4,-0.3 3,-0.4 -0.684 54.7 161.2-127.7 77.5 43.0 49.2 25.7 50 50 A P T 4 S+ 0 0 29 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.747 73.0 63.9 -70.2 -24.0 42.6 52.2 28.1 51 51 A G T 4 S+ 0 0 51 1,-0.1 3,-0.2 -3,-0.1 -2,-0.1 0.864 116.0 29.0 -65.6 -39.6 44.7 50.5 30.8 52 52 A T T 4 S+ 0 0 7 -3,-0.4 214,-2.0 1,-0.2 2,-0.9 0.882 127.5 45.2 -83.5 -46.8 47.8 50.4 28.6 53 53 A F E < S-C 265 0A 2 -4,-2.8 212,-0.2 -7,-0.3 -1,-0.2 -0.752 86.8-161.2-104.2 85.5 46.9 53.6 26.6 54 54 A S E -C 264 0A 0 210,-2.7 210,-2.4 -2,-0.9 -3,-0.1 -0.215 22.8-151.1 -67.2 152.2 45.8 56.1 29.3 55 55 A S S S+ 0 0 2 208,-0.2 2,-1.2 -5,-0.1 -1,-0.1 0.472 73.1 101.0 -96.9 -7.7 43.7 59.2 28.6 56 56 A H > - 0 0 64 1,-0.2 3,-1.2 208,-0.2 4,-0.2 -0.678 51.3-176.6 -82.0 96.0 45.3 61.0 31.5 57 57 A M G > + 0 0 34 -2,-1.2 3,-1.5 1,-0.3 4,-0.3 0.675 69.0 79.4 -71.7 -19.1 47.8 63.2 29.7 58 58 A S G > S+ 0 0 42 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.668 76.4 77.2 -62.5 -18.9 49.3 64.6 33.0 59 59 A R G < S+ 0 0 102 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.1 0.828 90.0 54.1 -57.4 -36.2 51.3 61.3 33.3 60 60 A L G < 0 0 52 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.633 360.0 360.0 -77.4 -16.1 53.7 62.5 30.6 61 61 A L < 0 0 184 -3,-0.9 -1,-0.2 -4,-0.3 -2,-0.2 0.716 360.0 360.0 -80.5 360.0 54.4 65.8 32.6 62 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 63 69 A F 0 0 177 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -44.3 42.5 70.5 37.4 64 70 A T > + 0 0 23 6,-0.1 3,-1.5 4,-0.0 2,-0.3 0.296 360.0 123.2-120.5 1.9 41.4 67.5 35.2 65 71 A E T 3 S+ 0 0 80 1,-0.2 138,-0.3 6,-0.0 139,-0.2 -0.502 78.9 19.7 -67.7 126.0 39.1 66.0 37.9 66 72 A G T 3 S+ 0 0 6 -2,-0.3 2,-0.8 1,-0.3 -1,-0.2 0.147 93.9 118.3 96.8 -17.7 35.5 65.7 36.5 67 73 A D X - 0 0 21 -3,-1.5 3,-0.9 1,-0.2 4,-0.3 -0.761 51.4-161.2 -84.1 108.8 36.8 65.9 32.9 68 74 A L G > S+ 0 0 9 -2,-0.8 3,-1.1 1,-0.2 -1,-0.2 0.819 86.0 61.6 -60.2 -35.9 35.8 62.6 31.2 69 75 A L G 3 S+ 0 0 87 1,-0.3 -1,-0.2 -3,-0.1 250,-0.0 0.806 111.2 38.4 -61.0 -33.2 38.4 63.0 28.4 70 76 A Q G < S+ 0 0 51 -3,-0.9 2,-0.4 -6,-0.2 -1,-0.3 0.299 101.3 97.6-100.7 7.4 41.3 63.1 30.9 71 77 A T < - 0 0 17 -3,-1.1 -6,-0.0 -4,-0.3 -3,-0.0 -0.848 53.1-162.1-108.8 131.3 39.8 60.4 33.2 72 78 A D > - 0 0 41 -2,-0.4 4,-1.8 1,-0.1 3,-0.4 -0.587 38.8 -49.9 -95.4 162.8 40.6 56.6 33.2 73 79 A P T 4 S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.396 112.4 34.4 -60.5 151.7 38.6 53.8 34.7 74 80 A P T > S+ 0 0 79 0, 0.0 4,-1.8 0, 0.0 3,-0.2 -0.972 128.4 39.6 -81.6 -20.9 37.3 53.2 37.4 75 81 A D H > S+ 0 0 52 -3,-0.4 4,-2.4 1,-0.2 5,-0.2 0.857 117.9 51.4 -55.3 -39.6 36.5 56.9 37.9 76 82 A H H X S+ 0 0 5 -4,-1.8 4,-2.5 2,-0.2 5,-0.3 0.885 105.5 55.6 -63.2 -41.9 35.6 57.2 34.2 77 83 A R H > S+ 0 0 163 -3,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.905 113.6 39.9 -58.6 -45.5 33.3 54.2 34.3 78 84 A E H X S+ 0 0 86 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.915 116.6 48.3 -70.6 -46.6 31.2 55.7 37.2 79 85 A L H X S+ 0 0 6 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.870 114.0 45.8 -66.5 -40.0 31.2 59.3 35.9 80 86 A R H >X S+ 0 0 51 -4,-2.5 4,-1.4 2,-0.2 3,-0.6 0.924 111.5 52.2 -67.1 -46.1 30.1 58.4 32.4 81 87 A K H 3< S+ 0 0 166 -4,-1.6 4,-0.4 -5,-0.3 -2,-0.2 0.841 108.1 53.2 -56.2 -36.9 27.4 56.0 33.6 82 88 A L H 3< S+ 0 0 27 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.770 117.0 35.4 -73.0 -28.3 26.0 58.8 35.8 83 89 A V H X< S+ 0 0 0 -4,-1.0 3,-1.5 -3,-0.6 -1,-0.2 0.492 89.4 96.8-104.2 -6.2 25.7 61.3 32.9 84 90 A S G >< S+ 0 0 42 -4,-1.4 3,-1.7 1,-0.3 4,-0.3 0.798 73.7 65.5 -53.6 -37.3 24.7 58.8 30.1 85 91 A H G > S+ 0 0 77 -4,-0.4 3,-0.8 1,-0.3 -1,-0.3 0.767 93.6 60.2 -59.2 -30.0 21.0 59.5 30.5 86 92 A A G < S+ 0 0 9 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.417 105.5 47.7 -82.0 1.5 21.4 63.1 29.3 87 93 A F G < S+ 0 0 10 -3,-1.7 -1,-0.2 -4,-0.2 239,-0.2 0.313 83.7 120.1-124.0 4.5 22.8 62.1 25.9 88 94 A T S X> S- 0 0 54 -3,-0.8 4,-1.7 -4,-0.3 3,-0.7 -0.149 80.9-102.6 -69.4 162.6 20.3 59.4 24.9 89 95 A P H 3> S+ 0 0 96 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.719 122.6 64.5 -54.6 -23.3 18.1 59.5 21.7 90 96 A K H 3> S+ 0 0 132 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.909 103.6 43.4 -65.5 -45.4 15.3 60.4 24.1 91 97 A V H <> S+ 0 0 21 -3,-0.7 4,-1.5 -6,-0.2 -1,-0.2 0.820 110.4 58.1 -69.0 -33.0 17.0 63.7 25.0 92 98 A V H X S+ 0 0 16 -4,-1.7 4,-1.1 1,-0.2 -2,-0.2 0.919 108.4 44.6 -60.1 -46.6 17.8 64.2 21.3 93 99 A A H < S+ 0 0 61 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.802 111.7 53.7 -69.2 -31.7 14.0 64.0 20.4 94 100 A E H < S+ 0 0 124 -4,-1.5 4,-0.2 1,-0.2 -1,-0.2 0.782 114.5 40.0 -73.5 -28.8 13.2 66.4 23.3 95 101 A L H >X S+ 0 0 17 -4,-1.5 4,-1.8 -3,-0.2 3,-0.5 0.600 92.1 87.5 -96.4 -14.8 15.6 69.1 22.2 96 102 A E H 3X S+ 0 0 51 -4,-1.1 4,-2.8 1,-0.2 5,-0.2 0.871 83.9 54.0 -56.6 -46.1 15.0 68.8 18.4 97 103 A P H 3> S+ 0 0 90 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.852 109.9 49.1 -59.0 -34.9 12.1 71.3 18.3 98 104 A R H <> S+ 0 0 124 -3,-0.5 4,-2.0 -4,-0.2 -2,-0.2 0.905 114.2 43.8 -68.6 -44.2 14.2 74.0 20.0 99 105 A I H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.847 112.8 53.2 -70.8 -35.6 17.2 73.5 17.7 100 106 A T H X S+ 0 0 35 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.929 110.0 48.0 -60.7 -47.3 14.8 73.4 14.7 101 107 A A H X S+ 0 0 46 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.883 112.4 48.9 -61.0 -41.6 13.3 76.7 15.8 102 108 A L H X S+ 0 0 32 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.901 109.5 51.7 -65.2 -43.8 16.8 78.2 16.2 103 109 A T H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.899 110.7 49.0 -59.4 -42.6 17.9 77.0 12.8 104 110 A Q H X S+ 0 0 62 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.927 111.8 48.5 -62.4 -46.5 14.8 78.6 11.3 105 111 A E H X S+ 0 0 124 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.899 111.8 49.0 -60.9 -43.0 15.5 81.9 13.1 106 112 A L H X S+ 0 0 32 -4,-2.7 4,-0.6 1,-0.2 3,-0.3 0.856 112.9 47.0 -66.1 -36.7 19.1 81.9 12.0 107 113 A L H X S+ 0 0 1 -4,-2.0 4,-0.6 1,-0.2 -1,-0.2 0.660 101.1 66.1 -81.1 -17.4 18.2 81.3 8.4 108 114 A D H < S+ 0 0 95 -4,-1.4 4,-0.3 1,-0.2 3,-0.3 0.815 98.1 56.1 -65.9 -32.3 15.5 84.0 8.5 109 115 A A H < S+ 0 0 69 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.800 116.9 31.9 -70.0 -32.8 18.3 86.5 8.9 110 116 A V H >< S+ 0 0 7 -4,-0.6 3,-1.6 1,-0.1 -1,-0.2 0.333 86.9 106.9-108.5 4.6 20.1 85.4 5.7 111 117 A A T 3< S+ 0 0 28 -4,-0.6 -1,-0.1 1,-0.3 -2,-0.1 0.817 87.1 36.9 -55.3 -39.4 17.1 84.4 3.6 112 118 A D T 3 S+ 0 0 159 -4,-0.3 -1,-0.3 -3,-0.2 2,-0.2 0.223 92.9 117.9-101.5 12.6 17.2 87.5 1.3 113 119 A R < - 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0 0 1 -5,-2.8 -1,-0.2 -6,-0.2 5,-0.1 -0.629 38.6-107.0 -70.8 123.6 22.2 77.6 31.8 138 144 A P > - 0 0 54 0, 0.0 3,-2.2 0, 0.0 4,-0.5 -0.264 23.4-121.2 -53.8 137.9 19.5 80.3 32.1 139 145 A S G > S+ 0 0 98 1,-0.3 3,-0.6 2,-0.2 4,-0.3 0.750 112.2 59.1 -54.6 -28.1 18.3 81.5 28.7 140 146 A A G 3 S+ 0 0 69 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.686 106.4 46.6 -74.4 -21.1 19.4 85.1 29.7 141 147 A D G X> S+ 0 0 49 -3,-2.2 4,-0.9 1,-0.1 3,-0.6 0.394 86.3 90.1-101.4 0.9 23.0 84.0 30.2 142 148 A R H <> S+ 0 0 31 -3,-0.6 4,-1.5 -4,-0.5 -1,-0.1 0.774 77.4 63.4 -72.0 -26.6 23.4 82.0 27.0 143 149 A H H 3> S+ 0 0 124 -4,-0.3 4,-1.8 -3,-0.2 -1,-0.2 0.799 96.8 59.7 -64.3 -31.0 24.6 85.0 25.0 144 150 A L H <> S+ 0 0 53 -3,-0.6 4,-2.6 1,-0.2 -1,-0.2 0.910 105.8 46.2 -63.0 -44.6 27.6 85.1 27.3 145 151 A F H X S+ 0 0 1 -4,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.794 107.4 58.3 -68.9 -30.3 28.6 81.6 26.2 146 152 A E H X S+ 0 0 48 -4,-1.5 4,-1.0 2,-0.2 -1,-0.2 0.896 112.5 40.8 -62.4 -41.6 28.0 82.6 22.6 147 153 A G H X S+ 0 0 33 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.899 115.1 50.0 -72.2 -44.2 30.6 85.3 23.0 148 154 A W H X S+ 0 0 31 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.888 110.3 48.8 -64.0 -42.9 33.1 83.3 25.1 149 155 A M H X S+ 0 0 5 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.803 109.6 53.1 -69.9 -30.7 33.1 80.3 22.7 150 156 A T H X S+ 0 0 37 -4,-1.0 4,-2.2 -5,-0.2 -1,-0.2 0.907 108.2 50.3 -67.3 -44.3 33.7 82.6 19.7 151 157 A E H X S+ 0 0 101 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.892 110.2 48.4 -62.6 -43.9 36.7 84.2 21.3 152 158 A I H < S+ 0 0 43 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.844 113.6 48.5 -66.0 -35.1 38.4 80.9 22.2 153 159 A V H < S+ 0 0 21 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.848 106.6 58.4 -69.2 -36.6 37.8 79.8 18.6 154 160 A H H < 0 0 136 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.864 360.0 360.0 -62.2 -40.6 39.2 83.1 17.3 155 161 A S < 0 0 125 -4,-1.6 0, 0.0 -5,-0.1 0, 0.0 -0.711 360.0 360.0 -91.1 360.0 42.6 82.6 19.0 156 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 157 182 A M > 0 0 158 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -38.1 43.0 82.7 28.3 158 183 A A H > + 0 0 61 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.890 360.0 44.5 -66.2 -45.5 40.8 85.8 29.2 159 184 A P H > S+ 0 0 13 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.806 113.2 54.3 -68.4 -27.2 37.5 84.6 27.8 160 185 A M H > S+ 0 0 33 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.885 105.0 53.2 -68.6 -41.7 38.2 81.1 29.4 161 186 A R H X S+ 0 0 150 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.893 109.9 47.3 -59.1 -44.2 38.8 82.8 32.8 162 187 A K H X S+ 0 0 109 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.864 112.5 49.4 -67.1 -38.4 35.4 84.6 32.7 163 188 A M H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.904 112.0 47.2 -67.8 -43.5 33.6 81.4 31.6 164 189 A L H X S+ 0 0 32 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.850 109.8 55.1 -64.5 -35.8 35.2 79.3 34.4 165 190 A E H X S+ 0 0 121 -4,-1.9 4,-1.2 -5,-0.2 -2,-0.2 0.886 110.2 45.7 -62.8 -41.9 34.3 82.1 36.9 166 191 A Y H X S+ 0 0 44 -4,-1.8 4,-2.3 1,-0.2 3,-0.3 0.922 110.7 52.3 -65.5 -46.9 30.6 81.9 35.8 167 192 A L H X S+ 0 0 3 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.742 103.5 58.9 -65.8 -25.8 30.5 78.1 36.0 168 193 A R H X S+ 0 0 117 -4,-1.4 4,-1.2 2,-0.2 -1,-0.2 0.911 112.4 38.2 -67.7 -44.5 31.9 78.2 39.5 169 194 A E H X S+ 0 0 98 -4,-1.2 4,-2.2 -3,-0.3 -2,-0.2 0.810 112.8 58.4 -75.5 -31.4 29.0 80.2 40.8 170 195 A H H X S+ 0 0 10 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.876 106.4 48.6 -63.1 -39.4 26.6 78.3 38.5 171 196 A A H X S+ 0 0 1 -4,-1.8 4,-0.5 2,-0.2 -1,-0.2 0.853 113.0 47.4 -67.3 -37.1 27.6 75.1 40.3 172 197 A A H X S+ 0 0 17 -4,-1.2 4,-0.5 1,-0.2 3,-0.2 0.805 110.6 52.1 -73.6 -31.9 27.1 76.8 43.7 173 198 A E H >X S+ 0 0 74 -4,-2.2 4,-0.9 1,-0.2 3,-0.8 0.846 104.2 56.3 -71.6 -36.1 23.7 78.1 42.6 174 199 A C H 3< S+ 0 0 6 -4,-1.7 5,-0.2 1,-0.2 -1,-0.2 0.658 98.3 62.5 -71.8 -17.4 22.5 74.7 41.5 175 200 A R H 3< S+ 0 0 93 -4,-0.5 -1,-0.2 -3,-0.2 -2,-0.2 0.759 106.2 45.3 -73.5 -27.7 23.3 73.4 45.0 176 201 A R H << S+ 0 0 154 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.666 112.4 55.7 -86.8 -21.2 20.6 75.8 46.3 177 202 A R S < S- 0 0 103 -4,-0.9 2,-0.5 2,-0.0 -1,-0.2 -0.825 77.7-160.3-116.1 90.3 18.2 74.8 43.6 178 203 A P + 0 0 110 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.588 24.8 154.6 -76.3 120.6 17.6 71.0 43.6 179 204 A R - 0 0 184 -2,-0.5 2,-1.4 -5,-0.2 5,-0.2 -0.984 53.8-110.7-144.7 152.9 16.2 69.7 40.3 180 205 A G S S+ 0 0 83 -2,-0.3 2,-0.1 4,-0.1 0, 0.0 -0.186 80.1 109.8 -79.5 44.7 16.1 66.4 38.4 181 206 A D S > S- 0 0 33 -2,-1.4 4,-1.9 -46,-0.0 5,-0.2 -0.386 88.8 -85.6-104.8-172.7 18.4 67.7 35.6 182 207 A L H > S+ 0 0 6 -48,-0.4 4,-1.3 2,-0.2 -47,-0.1 0.893 128.3 49.0 -63.4 -42.6 22.1 66.9 34.7 183 208 A M H > S+ 0 0 2 -49,-0.3 4,-1.6 2,-0.2 3,-0.3 0.922 109.5 52.7 -61.1 -46.4 23.5 69.5 37.2 184 209 A G H > S+ 0 0 10 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.858 108.2 50.0 -58.5 -40.5 21.3 68.1 40.0 185 210 A K H < S+ 0 0 93 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.778 108.3 53.7 -69.4 -28.7 22.5 64.6 39.4 186 211 A L H < S+ 0 0 1 -4,-1.3 10,-0.4 -3,-0.3 -2,-0.2 0.784 106.4 53.1 -73.6 -29.9 26.1 65.8 39.5 187 212 A I H < S+ 0 0 9 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.888 116.5 37.2 -69.5 -41.6 25.4 67.5 42.9 188 213 A E S < S+ 0 0 127 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.424 98.0 122.4 -90.0 -0.2 24.1 64.2 44.4 189 214 A A - 0 0 3 -4,-0.3 7,-0.6 -5,-0.1 2,-0.4 -0.123 47.6-154.5 -66.1 155.6 26.7 62.1 42.5 190 215 A E E +G 195 0C 119 5,-0.2 2,-0.4 -112,-0.1 5,-0.2 -0.962 14.9 172.7-134.4 118.0 29.2 59.8 44.0 191 216 A V E > S-G 194 0C 8 3,-2.5 3,-0.8 -2,-0.4 -116,-0.1 -0.997 78.9 -0.9-123.0 126.9 32.5 58.9 42.2 192 217 A D T 3 S- 0 0 97 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.784 130.8 -61.9 64.4 30.9 35.1 56.8 44.1 193 218 A G T 3 S+ 0 0 62 1,-0.2 2,-0.4 -3,-0.1 -1,-0.2 0.684 118.1 106.3 70.3 20.8 32.8 56.8 47.1 194 219 A R E < S-G 191 0C 131 -3,-0.8 -3,-2.5 3,-0.0 -1,-0.2 -0.980 74.6-113.1-134.7 141.1 33.0 60.6 47.4 195 220 A R E -G 190 0C 125 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.520 42.1-109.2 -69.8 137.0 30.7 63.5 46.5 196 221 A L - 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