==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 27-AUG-01 1IQX . COMPND 2 MOLECULE: CO(II)-SUBSTITUTED AMINE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER GLOBIFORMIS; . AUTHOR S.KISHISHITA,T.OKAJIMA,M.MURE,M.KIM,H.YAMAGUCHI,S.HIROTA, . 1240 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40589.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 831 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 426 34.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 12 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.0 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 0.1 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 . 139 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 127 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.2 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 5 4 2 0 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 0 PARALLEL BRIDGES PER LADDER . 12 4 9 6 6 8 8 6 2 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 2 2 2 0 0 0 0 0 4 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 9 A A 0 0 121 0, 0.0 225,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -25.9 15.3 16.4 57.6 2 10 A S > - 0 0 37 1,-0.1 3,-1.5 224,-0.1 227,-0.0 -0.503 360.0-137.8 -71.5 136.5 12.9 13.5 57.2 3 11 A P T 3 S+ 0 0 59 0, 0.0 -1,-0.1 0, 0.0 46,-0.0 0.479 104.3 59.6 -72.8 -0.9 14.5 10.3 56.0 4 12 A F T 3 S+ 0 0 44 34,-0.1 3,-0.1 2,-0.0 246,-0.1 0.239 77.5 126.8-107.4 8.1 11.4 9.9 53.8 5 13 A R S < S- 0 0 49 -3,-1.5 2,-0.1 1,-0.1 222,-0.1 -0.172 70.6 -91.4 -63.2 159.0 11.8 13.2 51.9 6 14 A L - 0 0 41 1,-0.1 -1,-0.1 234,-0.1 234,-0.1 -0.482 51.1 -89.5 -71.8 148.5 11.9 13.1 48.1 7 15 A A - 0 0 22 234,-0.3 312,-0.5 312,-0.2 2,-0.2 -0.278 44.6-136.0 -59.8 137.4 15.2 12.7 46.3 8 16 A S > - 0 0 65 1,-0.1 4,-1.6 -3,-0.1 3,-0.2 -0.605 18.2-116.7 -94.6 156.8 16.9 16.0 45.6 9 17 A A H > S+ 0 0 44 1,-0.2 4,-2.5 -2,-0.2 3,-0.4 0.945 118.6 55.3 -56.4 -43.4 18.6 17.0 42.3 10 18 A G H > S+ 0 0 43 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.822 102.6 53.2 -59.1 -38.0 21.8 17.2 44.4 11 19 A E H > S+ 0 0 19 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.869 110.8 47.6 -67.1 -35.9 21.5 13.7 45.7 12 20 A I H X S+ 0 0 1 -4,-1.6 4,-2.1 -3,-0.4 -2,-0.2 0.905 111.4 49.3 -71.0 -42.1 21.2 12.4 42.2 13 21 A S H X S+ 0 0 50 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.948 110.9 52.4 -59.6 -45.0 24.2 14.5 41.0 14 22 A E H X S+ 0 0 93 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.822 106.9 51.2 -60.2 -35.5 26.1 13.1 44.0 15 23 A V H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.918 110.1 50.7 -66.9 -44.0 25.2 9.5 43.0 16 24 A Q H X S+ 0 0 15 -4,-2.1 4,-2.8 309,-0.4 -2,-0.2 0.924 111.0 48.1 -58.7 -47.1 26.5 10.2 39.5 17 25 A G H X S+ 0 0 24 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.975 111.4 49.5 -58.0 -55.7 29.8 11.6 40.9 18 26 A I H X S+ 0 0 17 -4,-2.4 4,-2.0 1,-0.2 6,-0.2 0.871 114.2 45.9 -50.5 -44.9 30.3 8.6 43.2 19 27 A L H <>S+ 0 0 0 -4,-2.6 5,-2.2 2,-0.2 6,-1.2 0.926 112.0 50.1 -67.2 -46.4 29.6 6.2 40.3 20 28 A R H ><5S+ 0 0 141 -4,-2.8 3,-2.3 4,-0.3 5,-0.3 0.969 111.1 50.0 -52.2 -59.8 31.9 8.1 37.9 21 29 A T H 3<5S+ 0 0 128 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.851 107.7 51.7 -48.2 -47.9 34.7 8.2 40.4 22 30 A A T 3<5S- 0 0 57 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.474 117.5-114.0 -73.2 -0.4 34.5 4.4 41.2 23 31 A G T < 5S+ 0 0 59 -3,-2.3 -3,-0.2 -4,-0.3 -2,-0.2 0.569 88.8 118.5 78.7 9.4 34.7 3.8 37.4 24 32 A L < + 0 0 16 -5,-2.2 2,-0.5 -6,-0.2 -4,-0.3 0.657 67.7 60.6 -78.9 -19.0 31.2 2.5 37.5 25 33 A L + 0 0 26 -6,-1.2 -2,-0.2 -5,-0.3 -1,-0.1 -0.954 68.8 129.9-116.3 127.4 30.1 5.3 35.1 26 34 A G > - 0 0 36 -2,-0.5 3,-1.5 0, 0.0 -6,-0.0 -0.902 68.2 -64.8-155.3-173.6 31.7 5.7 31.7 27 35 A P T 3 S+ 0 0 108 0, 0.0 32,-0.0 0, 0.0 -2,-0.0 0.740 128.6 40.1 -55.4 -35.3 30.9 6.1 27.9 28 36 A E T 3 S+ 0 0 82 30,-0.1 31,-3.6 31,-0.0 32,-0.3 0.355 97.0 100.9 -98.8 4.0 29.2 2.8 27.4 29 37 A K E < -A 58 0A 32 -3,-1.5 2,-0.4 29,-0.2 29,-0.2 -0.706 46.1-177.1 -95.1 143.2 27.3 2.8 30.7 30 38 A R E -A 57 0A 33 27,-2.3 27,-3.6 -2,-0.3 2,-0.9 -0.999 29.2-125.3-138.1 134.2 23.6 3.8 31.1 31 39 A I E +A 56 0A 12 292,-2.8 25,-0.2 -2,-0.4 3,-0.1 -0.737 28.1 178.1 -81.5 105.4 21.6 4.1 34.3 32 40 A A E S+ 0 0 9 23,-2.2 2,-0.3 -2,-0.9 -1,-0.2 0.673 71.1 7.3 -80.3 -22.2 18.6 1.8 33.7 33 41 A Y E +A 55 0A 8 22,-1.3 22,-2.9 -3,-0.1 2,-0.3 -0.921 62.4 172.3-161.3 137.3 17.1 2.4 37.2 34 42 A L E +A 54 0A 15 -2,-0.3 209,-0.5 20,-0.2 2,-0.3 -0.976 13.8 151.4-148.4 132.5 18.0 4.7 40.1 35 43 A G E -A 53 0A 6 18,-2.0 18,-2.8 -2,-0.3 207,-0.1 -0.970 43.3-102.8-163.4 147.2 16.0 5.2 43.3 36 44 A V E -A 52 0A 32 -2,-0.3 2,-0.3 16,-0.2 16,-0.2 -0.296 39.3-123.9 -68.0 150.8 16.4 6.2 46.9 37 45 A L - 0 0 51 14,-2.5 14,-0.3 1,-0.0 3,-0.1 -0.804 20.5-117.8 -99.2 144.5 16.2 3.4 49.5 38 46 A D - 0 0 67 -2,-0.3 -34,-0.1 1,-0.1 -1,-0.0 -0.511 40.7 -90.1 -79.8 149.8 13.8 3.4 52.4 39 47 A P - 0 0 52 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.188 36.6-121.3 -54.0 152.0 15.1 3.4 56.0 40 48 A A - 0 0 73 2,-0.1 500,-0.1 -3,-0.1 -2,-0.0 -0.100 46.8 -97.0 -95.3 41.7 15.7 -0.2 57.4 41 49 A R S S+ 0 0 84 -2,-0.2 -1,-0.1 1,-0.1 -3,-0.0 0.958 98.9 91.2 41.9 76.3 13.4 -0.0 60.5 42 50 A G > + 0 0 51 4,-0.0 3,-1.6 0, 0.0 -2,-0.1 -0.069 42.0 176.1 171.0 64.4 15.8 0.8 63.3 43 51 A A G > + 0 0 97 1,-0.3 3,-1.9 2,-0.1 -2,-0.0 0.480 64.9 92.3 -62.2 -3.1 16.0 4.6 63.7 44 52 A G G 3 + 0 0 73 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.613 67.6 77.0 -67.2 -11.5 18.2 4.1 66.7 45 53 A S G < S- 0 0 109 -3,-1.6 -1,-0.3 1,-0.1 3,-0.2 0.641 85.9-173.0 -71.5 -13.6 21.1 4.4 64.2 46 54 A E < + 0 0 158 -3,-1.9 -1,-0.1 1,-0.2 -2,-0.1 0.125 46.1 61.2 48.3-166.6 20.4 8.1 64.4 47 55 A A S S- 0 0 104 1,-0.1 2,-0.2 -3,-0.1 -1,-0.2 -0.314 98.2 -85.5 55.2-122.5 22.1 10.7 62.1 48 56 A E - 0 0 81 -3,-0.2 2,-0.4 2,-0.0 -1,-0.1 -0.825 32.4-168.5 179.3 133.1 21.1 9.8 58.5 49 57 A D - 0 0 70 -2,-0.2 2,-0.8 23,-0.1 -3,-0.0 -0.837 11.0-167.2-134.5 95.8 22.3 7.4 55.7 50 58 A R - 0 0 10 -2,-0.4 21,-2.7 -14,-0.0 22,-0.8 -0.769 13.8-175.3 -85.6 109.5 20.6 8.1 52.4 51 59 A R E - B 0 70A 99 -2,-0.8 -14,-2.5 -14,-0.3 2,-0.4 -0.799 10.1-157.9-105.8 150.2 21.4 5.2 50.1 52 60 A F E -AB 36 69A 1 17,-2.3 17,-2.6 -2,-0.3 2,-0.4 -0.974 8.0-144.6-128.4 141.1 20.5 4.9 46.4 53 61 A R E -AB 35 68A 6 -18,-2.8 -18,-2.0 -2,-0.4 2,-0.4 -0.890 21.0-172.3-105.1 137.8 20.1 1.7 44.4 54 62 A V E -AB 34 67A 0 13,-2.6 13,-2.7 -2,-0.4 2,-0.5 -0.990 20.6-154.6-137.3 139.3 21.2 1.8 40.7 55 63 A F E -AB 33 66A 0 -22,-2.9 -23,-2.2 -2,-0.4 -22,-1.3 -0.971 22.4-160.8-109.7 120.6 21.0 -0.7 37.8 56 64 A I E -AB 31 65A 1 9,-2.9 9,-1.9 -2,-0.5 2,-0.3 -0.937 3.3-161.3-113.8 123.0 23.8 0.0 35.3 57 65 A H E -A 30 0A 15 -27,-3.6 -27,-2.3 -2,-0.5 2,-0.6 -0.697 10.3-141.9 -97.2 151.4 23.7 -1.1 31.7 58 66 A D E > -A 29 0A 12 4,-0.5 3,-0.5 -2,-0.3 -29,-0.2 -0.924 3.9-162.7-119.6 108.0 26.6 -1.5 29.3 59 67 A V T 3 S+ 0 0 49 -31,-3.6 -30,-0.1 -2,-0.6 -1,-0.1 0.650 89.1 61.0 -59.6 -20.2 25.9 -0.5 25.7 60 68 A S T 3 S- 0 0 73 -32,-0.3 -1,-0.2 115,-0.0 -31,-0.1 0.914 123.2 -97.7 -73.8 -44.6 29.1 -2.4 24.6 61 69 A G S < S+ 0 0 49 -3,-0.5 -2,-0.1 1,-0.2 114,-0.1 0.316 76.3 138.9 140.0 -0.8 27.9 -5.7 25.8 62 70 A A - 0 0 51 1,-0.1 -4,-0.5 -34,-0.1 -1,-0.2 -0.269 65.8 -80.8 -67.3 160.6 29.6 -6.0 29.2 63 71 A R - 0 0 118 -6,-0.1 -1,-0.1 1,-0.1 20,-0.1 -0.375 47.0-121.8 -66.5 136.4 27.7 -7.3 32.1 64 72 A P - 0 0 10 0, 0.0 18,-3.1 0, 0.0 2,-0.3 -0.310 26.5-139.8 -72.6 164.1 25.4 -4.8 33.9 65 73 A Q E -BC 56 81A 36 -9,-1.9 -9,-2.9 16,-0.2 2,-0.6 -0.965 9.8-143.5-133.1 146.8 25.8 -4.1 37.6 66 74 A E E +BC 55 80A 45 14,-2.5 14,-2.5 -2,-0.3 2,-0.4 -0.945 31.9 179.9-105.5 121.5 23.6 -3.5 40.6 67 75 A V E -BC 54 79A 0 -13,-2.7 -13,-2.6 -2,-0.6 2,-0.5 -0.977 21.1-162.3-130.7 136.6 25.1 -0.8 42.8 68 76 A T E -BC 53 78A 16 10,-1.2 9,-2.7 -2,-0.4 10,-1.7 -0.963 17.5-172.3-115.2 123.8 24.0 0.7 46.1 69 77 A V E -BC 52 76A 0 -17,-2.6 -17,-2.3 -2,-0.5 2,-0.6 -0.794 21.9-134.6-114.5 158.6 25.7 4.0 47.0 70 78 A S E >> -BC 51 75A 0 5,-3.0 5,-1.7 -2,-0.3 4,-0.7 -0.978 15.3-174.2-111.7 114.6 25.6 6.1 50.1 71 79 A V T 45S+ 0 0 20 -21,-2.7 -20,-0.1 -2,-0.6 -1,-0.1 0.734 83.4 59.9 -79.4 -24.6 25.1 9.8 49.3 72 80 A T T 45S+ 0 0 61 -22,-0.8 -1,-0.2 1,-0.2 -21,-0.1 0.849 121.5 24.7 -71.0 -35.1 25.5 10.9 52.9 73 81 A N T 45S- 0 0 106 -23,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.437 103.7-125.2-107.7 -6.5 29.0 9.4 53.0 74 82 A G T <5 + 0 0 33 -4,-0.7 2,-0.3 1,-0.2 -3,-0.2 0.855 65.0 131.4 63.3 39.8 29.8 9.6 49.3 75 83 A T E < -C 70 0A 66 -5,-1.7 -5,-3.0 -53,-0.0 2,-0.6 -0.764 63.8-121.6-124.2 163.7 30.6 5.8 49.1 76 84 A V E -C 69 0A 52 -2,-0.3 -7,-0.3 -7,-0.2 3,-0.1 -0.932 25.7-175.6-100.4 117.5 29.8 2.8 47.0 77 85 A I E - 0 0 62 -9,-2.7 2,-0.3 -2,-0.6 -8,-0.2 0.833 66.4 -4.3 -84.3 -34.3 28.3 0.3 49.5 78 86 A S E -C 68 0A 45 -10,-1.7 -10,-1.2 2,-0.0 -1,-0.3 -0.984 51.6-175.8-155.0 158.4 28.0 -2.6 46.9 79 87 A A E -C 67 0A 46 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.769 14.5-179.8-160.9 105.9 28.6 -3.3 43.2 80 88 A V E -C 66 0A 82 -14,-2.5 -14,-2.5 -2,-0.2 2,-0.3 -0.938 26.0-129.7-118.0 138.1 27.6 -6.7 41.8 81 89 A E E -C 65 0A 107 -2,-0.4 2,-0.4 -16,-0.2 -16,-0.2 -0.662 30.8-136.0 -79.9 137.1 28.0 -7.9 38.2 82 90 A L - 0 0 12 -18,-3.1 2,-1.0 -2,-0.3 3,-0.1 -0.759 11.0-149.2-102.9 137.7 24.7 -9.4 37.0 83 91 A D >> - 0 0 76 -2,-0.4 4,-2.8 1,-0.2 3,-1.5 -0.833 19.3-170.7 -99.8 91.8 24.3 -12.6 35.1 84 92 A T H 3> S+ 0 0 18 -2,-1.0 4,-2.1 1,-0.3 57,-0.2 0.726 80.7 60.9 -56.6 -31.0 21.1 -11.5 33.2 85 93 A A H 34 S+ 0 0 58 2,-0.2 -1,-0.3 55,-0.2 469,-0.2 0.811 116.6 35.0 -67.2 -27.8 20.5 -15.0 31.8 86 94 A A H <4 S+ 0 0 60 -3,-1.5 -2,-0.2 2,-0.1 468,-0.2 0.934 134.2 22.5 -88.3 -56.4 20.1 -16.1 35.4 87 95 A T H < S- 0 0 63 -4,-2.8 462,-0.4 1,-0.2 -3,-0.2 0.429 113.3-101.0 -96.2 0.0 18.6 -13.1 37.1 88 96 A G < - 0 0 1 -4,-2.1 -1,-0.2 -5,-0.3 464,-0.2 -0.023 39.9 -70.4 98.1 156.5 16.9 -11.4 34.2 89 97 A E - 0 0 12 462,-2.8 462,-0.4 1,-0.1 464,-0.1 -0.328 53.8 -98.1 -80.0 164.3 17.7 -8.4 31.9 90 98 A L - 0 0 1 1,-0.2 -1,-0.1 460,-0.1 3,-0.1 -0.341 54.3 -72.1 -80.0 161.8 17.6 -4.8 33.1 91 99 A P - 0 0 3 0, 0.0 203,-0.2 0, 0.0 -1,-0.2 -0.202 61.3 -91.4 -52.4 144.4 14.6 -2.4 32.5 92 100 A V - 0 0 1 201,-2.3 2,-0.3 -3,-0.1 38,-0.0 -0.356 42.8-128.3 -61.4 128.7 14.1 -1.2 28.9 93 101 A L > - 0 0 9 1,-0.1 3,-2.3 -3,-0.1 4,-0.4 -0.658 8.3-130.9 -80.7 139.5 16.0 2.1 28.4 94 102 A E G > S+ 0 0 93 -2,-0.3 3,-1.8 1,-0.3 4,-0.3 0.866 108.3 62.2 -57.5 -34.7 13.9 4.9 26.9 95 103 A E G 3 S+ 0 0 68 1,-0.3 4,-0.5 2,-0.2 -1,-0.3 0.519 94.5 62.3 -70.3 -4.4 16.7 5.5 24.4 96 104 A E G <> S+ 0 0 12 -3,-2.3 4,-0.9 1,-0.2 -1,-0.3 0.525 80.3 85.0 -96.3 -5.4 16.1 2.0 23.1 97 105 A F T <4 S+ 0 0 33 -3,-1.8 4,-0.3 -4,-0.4 -1,-0.2 0.747 95.4 40.7 -65.8 -25.5 12.6 2.9 22.0 98 106 A E T >> S+ 0 0 74 -4,-0.3 4,-1.7 -3,-0.3 3,-0.9 0.825 99.2 76.4 -90.2 -37.0 13.9 4.3 18.7 99 107 A V H 3> S+ 0 0 17 -4,-0.5 4,-2.5 1,-0.2 5,-0.3 0.767 86.0 58.7 -46.5 -42.4 16.4 1.6 18.1 100 108 A V H 3X S+ 0 0 0 -4,-0.9 4,-1.5 1,-0.2 -1,-0.2 0.900 110.0 42.9 -60.9 -40.6 14.0 -1.1 16.9 101 109 A E H <> S+ 0 0 53 -3,-0.9 4,-2.0 25,-0.3 -1,-0.2 0.921 114.2 51.5 -70.0 -45.4 12.6 1.0 14.0 102 110 A Q H < S+ 0 0 112 -4,-1.7 4,-0.4 1,-0.2 -2,-0.2 0.933 111.4 45.3 -57.3 -52.1 16.1 2.2 13.0 103 111 A L H >< S+ 0 0 26 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 0.867 114.1 49.9 -62.5 -37.3 17.6 -1.2 12.8 104 112 A L H >< S+ 0 0 0 -4,-1.5 3,-2.0 -5,-0.3 7,-0.3 0.839 94.9 72.4 -71.2 -31.8 14.6 -2.6 10.9 105 113 A A T 3< S+ 0 0 36 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.625 105.4 38.1 -58.7 -17.9 14.7 0.2 8.3 106 114 A T T < S+ 0 0 115 -3,-0.8 2,-0.6 -4,-0.4 -1,-0.3 0.263 89.6 111.5-116.2 6.2 17.8 -1.2 6.7 107 115 A D <> - 0 0 23 -3,-2.0 4,-2.8 1,-0.1 5,-0.2 -0.731 59.6-149.7 -86.3 125.4 16.9 -4.8 7.0 108 116 A E H > S+ 0 0 143 -2,-0.6 4,-1.6 1,-0.2 -1,-0.1 0.791 97.3 53.5 -63.2 -30.5 16.1 -6.4 3.7 109 117 A R H > S+ 0 0 109 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.897 112.3 44.8 -69.7 -40.6 13.6 -8.9 5.2 110 118 A W H > S+ 0 0 2 2,-0.2 4,-2.6 -6,-0.2 -2,-0.2 0.937 114.6 48.0 -66.5 -48.2 11.7 -6.0 6.8 111 119 A L H X S+ 0 0 63 -4,-2.8 4,-2.2 -7,-0.3 -1,-0.2 0.805 108.6 55.6 -61.8 -33.7 11.9 -3.9 3.6 112 120 A K H X S+ 0 0 140 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.914 109.6 46.4 -64.8 -45.9 10.8 -7.0 1.6 113 121 A A H X S+ 0 0 4 -4,-1.8 4,-0.9 2,-0.2 -2,-0.2 0.926 113.5 47.6 -64.8 -44.4 7.7 -7.2 3.8 114 122 A L H ><>S+ 0 0 3 -4,-2.6 5,-2.9 1,-0.2 3,-0.6 0.892 110.4 53.0 -64.8 -38.3 6.9 -3.5 3.6 115 123 A A H ><5S+ 0 0 63 -4,-2.2 3,-1.5 1,-0.2 -1,-0.2 0.898 103.3 56.0 -65.1 -39.6 7.3 -3.6 -0.2 116 124 A A H 3<5S+ 0 0 65 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.768 113.4 42.3 -64.6 -21.0 4.9 -6.4 -0.6 117 125 A R T <<5S- 0 0 22 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.321 112.3-121.0-105.3 1.2 2.3 -4.2 1.3 118 126 A N T < 5 + 0 0 147 -3,-1.5 2,-0.5 1,-0.2 -3,-0.2 0.815 58.9 154.2 61.4 38.0 3.3 -1.1 -0.6 119 127 A L < - 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