==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-JUN-05 2CWT . COMPND 2 MOLECULE: PHENYLETHYLAMINE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER GLOBIFORMIS; . AUTHOR Y.C.CHIU,T.OKAJIMA,T.MURAKAWA,M.UCHIDA,M.TAKI,S.HIROTA, . 1240 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41066.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 843 68.0 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 . 427 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 . 148 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 123 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.3 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 4 4 0 0 1 1 0 2 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 5 9 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 0 125 0, 0.0 46,-0.1 0, 0.0 225,-0.0 0.000 360.0 360.0 360.0 -68.5 15.2 15.8 57.8 2 10 A S > - 0 0 30 1,-0.1 3,-1.7 224,-0.1 227,-0.0 -0.470 360.0-144.5 -70.1 130.3 12.6 13.1 57.1 3 11 A P T 3 S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 46,-0.0 0.550 102.8 55.8 -70.8 -4.0 14.1 9.7 56.2 4 12 A F T 3 S+ 0 0 41 34,-0.1 3,-0.1 246,-0.0 246,-0.1 0.187 80.7 131.4-110.6 13.1 11.1 9.4 53.8 5 13 A R < - 0 0 67 -3,-1.7 222,-0.1 1,-0.1 3,-0.1 -0.238 66.2 -92.7 -65.8 155.4 11.7 12.6 51.9 6 14 A L - 0 0 41 1,-0.1 -1,-0.1 233,-0.1 2,-0.1 -0.290 47.5 -95.1 -66.5 153.2 11.7 12.6 48.1 7 15 A A - 0 0 23 234,-0.3 312,-0.5 312,-0.2 2,-0.2 -0.447 42.5-138.3 -68.6 142.9 14.9 12.1 46.3 8 16 A S > - 0 0 54 -2,-0.1 4,-1.7 1,-0.1 5,-0.2 -0.631 19.5-115.6-100.7 162.5 16.5 15.4 45.3 9 17 A A H > S+ 0 0 47 1,-0.2 4,-2.3 -2,-0.2 5,-0.1 0.873 118.5 56.6 -62.7 -35.2 18.2 16.2 42.0 10 18 A G H > S+ 0 0 41 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.868 102.8 52.6 -64.5 -38.2 21.4 16.6 44.0 11 19 A E H > S+ 0 0 17 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.895 109.7 48.9 -65.4 -39.1 21.2 13.1 45.4 12 20 A I H X S+ 0 0 2 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.933 110.9 50.8 -64.5 -45.0 20.8 11.7 41.9 13 21 A S H X S+ 0 0 48 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.861 109.3 51.5 -59.8 -37.5 23.8 13.7 40.8 14 22 A E H X S+ 0 0 104 -4,-2.1 4,-3.2 2,-0.2 -1,-0.2 0.904 107.3 51.4 -67.2 -42.4 25.8 12.4 43.7 15 23 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.924 110.7 50.0 -59.5 -43.4 25.0 8.8 42.8 16 24 A Q H X S+ 0 0 26 -4,-2.2 4,-2.6 309,-0.3 -2,-0.2 0.929 113.2 45.5 -60.1 -46.8 26.2 9.5 39.3 17 25 A G H X S+ 0 0 30 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.903 112.4 50.6 -64.0 -43.0 29.4 11.0 40.6 18 26 A I H X S+ 0 0 16 -4,-3.2 4,-1.4 1,-0.2 -2,-0.2 0.931 114.1 44.4 -60.7 -47.0 30.0 8.2 43.1 19 27 A L H <>S+ 0 0 1 -4,-2.7 5,-2.8 -5,-0.2 6,-0.5 0.915 114.0 50.0 -64.5 -44.0 29.5 5.5 40.4 20 28 A R H ><5S+ 0 0 131 -4,-2.6 3,-1.9 -5,-0.2 5,-0.3 0.956 112.0 46.0 -59.8 -53.2 31.6 7.4 37.9 21 29 A T H 3<5S+ 0 0 129 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.772 109.0 57.0 -62.0 -27.1 34.6 7.9 40.3 22 30 A A T 3<5S- 0 0 53 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.485 117.6-115.0 -82.5 -2.8 34.3 4.2 41.3 23 31 A G T < 5S+ 0 0 63 -3,-1.9 3,-0.3 -4,-0.3 -3,-0.2 0.693 86.3 115.7 77.5 20.4 34.7 3.3 37.6 24 32 A L < + 0 0 26 -5,-2.8 -4,-0.2 1,-0.2 -5,-0.1 0.345 63.4 61.0-102.0 4.3 31.2 1.8 37.4 25 33 A L + 0 0 12 -6,-0.5 -1,-0.2 -5,-0.3 -5,-0.1 -0.364 67.7 156.3-130.0 56.6 29.8 4.3 34.8 26 34 A G > - 0 0 27 -3,-0.3 3,-1.8 1,-0.1 -2,-0.0 -0.064 62.3 -84.0 -70.4 179.1 31.9 4.0 31.7 27 35 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.790 129.6 50.7 -54.4 -34.1 30.7 4.9 28.1 28 36 A E T 3 S+ 0 0 68 30,-0.1 31,-2.7 2,-0.0 32,-0.3 0.464 93.1 98.5 -86.2 -3.4 29.0 1.5 27.7 29 37 A K E < -A 58 0A 26 -3,-1.8 2,-0.3 29,-0.2 29,-0.2 -0.604 48.3-176.4 -90.5 148.5 27.1 1.7 31.0 30 38 A R E -A 57 0A 35 27,-2.5 27,-3.1 -2,-0.2 2,-0.9 -0.994 29.6-122.1-141.6 144.3 23.5 2.8 31.4 31 39 A I E +A 56 0A 10 292,-2.8 25,-0.2 -2,-0.3 294,-0.2 -0.799 30.4 173.3 -89.4 109.1 21.3 3.3 34.4 32 40 A A E S+ 0 0 7 23,-2.5 2,-0.3 -2,-0.9 -1,-0.2 0.693 71.8 5.5 -86.8 -22.9 18.3 0.9 33.9 33 41 A Y E +A 55 0A 11 22,-1.1 22,-2.6 -3,-0.1 -1,-0.3 -0.954 61.0 175.5-160.6 142.5 16.9 1.6 37.3 34 42 A L E +A 54 0A 14 -2,-0.3 209,-0.5 20,-0.2 2,-0.3 -0.939 15.5 151.9-152.9 125.1 17.7 3.9 40.2 35 43 A G E -A 53 0A 6 18,-2.3 18,-3.5 -2,-0.3 2,-0.2 -0.995 43.2-104.8-153.8 155.1 15.8 4.4 43.4 36 44 A V E -A 52 0A 36 -2,-0.3 2,-0.4 16,-0.3 16,-0.3 -0.565 38.8-121.9 -80.2 145.4 16.2 5.3 47.1 37 45 A L - 0 0 42 14,-2.9 14,-0.4 -2,-0.2 3,-0.1 -0.726 22.2-122.6 -90.3 135.9 16.1 2.5 49.6 38 46 A D - 0 0 59 -2,-0.4 -34,-0.1 1,-0.1 -1,-0.1 -0.361 40.5 -88.6 -71.0 156.9 13.5 2.6 52.4 39 47 A P - 0 0 36 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.354 45.3-116.1 -65.8 146.2 14.8 2.5 56.0 40 48 A A - 0 0 60 2,-0.2 2,-0.5 1,-0.1 -3,-0.0 -0.260 47.3 -71.0 -76.5 169.9 15.2 -1.0 57.4 41 49 A R S S+ 0 0 91 1,-0.1 -1,-0.1 2,-0.1 499,-0.0 -0.499 111.9 48.4 -66.2 113.6 13.2 -2.2 60.4 42 50 A G > - 0 0 62 -2,-0.5 3,-0.5 -3,-0.1 -2,-0.2 0.553 52.9-169.2 118.1 91.4 14.5 -0.3 63.4 43 51 A A T 3 + 0 0 94 1,-0.2 4,-0.1 -4,-0.1 -2,-0.1 0.005 57.9 111.5 -95.0 28.4 15.0 3.4 63.4 44 52 A G T 3 + 0 0 66 1,-0.1 2,-1.1 2,-0.1 -1,-0.2 0.776 53.5 88.6 -71.5 -26.1 16.9 3.5 66.6 45 53 A S S < S- 0 0 91 -3,-0.5 -1,-0.1 1,-0.1 -3,-0.0 -0.636 85.6-127.9 -78.7 100.7 20.1 4.4 64.9 46 54 A E S S+ 0 0 169 -2,-1.1 -2,-0.1 2,-0.1 -1,-0.1 0.003 79.8 22.4 -45.1 149.8 20.1 8.2 64.8 47 55 A A S S- 0 0 88 -4,-0.1 2,-0.1 -46,-0.1 -1,-0.0 0.905 87.2-125.4 52.1 103.9 20.6 9.9 61.4 48 56 A E - 0 0 60 1,-0.1 2,-0.7 -5,-0.0 -1,-0.1 -0.453 14.8-120.0 -78.0 150.0 19.7 7.5 58.6 49 57 A D - 0 0 49 -2,-0.1 2,-0.6 23,-0.0 -1,-0.1 -0.822 26.0-133.0 -92.2 112.5 22.2 6.7 55.9 50 58 A R + 0 0 11 -2,-0.7 21,-2.2 20,-0.1 22,-1.0 -0.553 33.9 179.7 -69.6 111.8 20.6 7.7 52.5 51 59 A R E - B 0 70A 108 -2,-0.6 -14,-2.9 -14,-0.4 2,-0.4 -0.885 15.5-157.3-118.1 147.5 21.2 4.8 50.2 52 60 A F E -AB 36 69A 1 17,-2.5 17,-2.4 -2,-0.3 2,-0.4 -0.940 9.7-142.5-122.9 144.9 20.2 4.3 46.6 53 61 A R E -AB 35 68A 10 -18,-3.5 -18,-2.3 -2,-0.4 2,-0.4 -0.900 23.7-172.4-105.9 134.1 19.8 1.0 44.6 54 62 A V E -AB 34 67A 0 13,-2.8 13,-2.9 -2,-0.4 2,-0.6 -0.986 21.9-154.9-135.2 139.9 20.9 1.0 41.0 55 63 A F E -AB 33 66A 1 -22,-2.6 -23,-2.5 -2,-0.4 -22,-1.1 -0.957 19.8-159.8-108.9 116.6 20.7 -1.5 38.1 56 64 A I E -AB 31 65A 0 9,-3.4 9,-2.3 -2,-0.6 2,-0.3 -0.888 3.7-162.4-105.3 118.3 23.6 -0.9 35.7 57 65 A H E -A 30 0A 12 -27,-3.1 -27,-2.5 -2,-0.6 2,-0.5 -0.655 7.9-146.6 -94.6 151.6 23.1 -2.1 32.1 58 66 A D E > -A 29 0A 3 4,-0.4 3,-1.7 -2,-0.3 -29,-0.2 -0.963 2.2-158.3-122.7 112.8 26.1 -2.6 29.7 59 67 A V T 3 S+ 0 0 47 -31,-2.7 -30,-0.1 -2,-0.5 -1,-0.1 0.570 89.2 65.1 -66.5 -9.1 25.3 -2.0 26.0 60 68 A S T 3 S- 0 0 85 -32,-0.3 -1,-0.3 3,-0.1 3,-0.1 0.395 119.9-102.9 -94.0 2.6 28.3 -4.1 24.9 61 69 A G S < S+ 0 0 48 -3,-1.7 -2,-0.1 1,-0.3 114,-0.0 0.398 74.9 144.0 92.9 -3.7 26.8 -7.3 26.3 62 70 A A - 0 0 42 1,-0.2 -4,-0.4 -34,-0.1 -1,-0.3 -0.221 65.3 -71.9 -65.8 160.9 29.0 -7.3 29.4 63 71 A R - 0 0 124 -6,-0.1 -1,-0.2 -3,-0.1 20,-0.1 -0.270 51.4-134.4 -56.0 129.2 27.6 -8.5 32.7 64 72 A P - 0 0 9 0, 0.0 18,-2.9 0, 0.0 2,-0.3 -0.301 22.3-142.1 -78.6 173.1 25.1 -6.0 34.2 65 73 A Q E -BC 56 81A 30 -9,-2.3 -9,-3.4 16,-0.2 2,-0.6 -0.974 16.0-143.4-141.9 154.4 25.3 -5.0 37.9 66 74 A E E -BC 55 80A 47 14,-2.3 14,-2.6 -2,-0.3 2,-0.4 -0.977 32.0-175.3-113.1 119.3 23.2 -4.2 40.9 67 75 A V E -BC 54 79A 0 -13,-2.9 -13,-2.8 -2,-0.6 2,-0.5 -0.950 18.1-160.2-124.0 139.2 24.9 -1.5 43.0 68 76 A T E -BC 53 78A 25 10,-2.6 9,-2.1 -2,-0.4 10,-1.8 -0.964 19.0-176.2-114.7 128.3 24.0 0.1 46.3 69 77 A V E -BC 52 76A 0 -17,-2.4 -17,-2.5 -2,-0.5 2,-0.6 -0.921 24.0-137.3-127.7 153.1 25.5 3.5 47.1 70 78 A S E >> -BC 51 75A 0 5,-2.9 5,-1.5 -2,-0.3 4,-1.3 -0.936 12.0-174.6-107.9 115.3 25.5 5.8 50.1 71 79 A V T 45S+ 0 0 20 -21,-2.2 -20,-0.1 -2,-0.6 -1,-0.1 0.700 85.0 62.5 -80.5 -18.1 25.0 9.5 49.1 72 80 A T T 45S+ 0 0 79 -22,-1.0 -1,-0.2 1,-0.2 -21,-0.1 0.936 120.3 21.6 -69.9 -46.4 25.5 10.5 52.7 73 81 A N T 45S- 0 0 113 -23,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.539 103.8-124.7 -98.0 -10.3 29.1 9.1 52.8 74 82 A G T <5 + 0 0 35 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.892 66.2 124.5 67.9 41.8 29.7 9.2 49.0 75 83 A T E < -C 70 0A 66 -5,-1.5 -5,-2.9 -53,-0.0 2,-0.7 -0.865 67.6-113.0-132.5 164.7 30.6 5.5 48.8 76 84 A V E -C 69 0A 50 -2,-0.3 -7,-0.3 -7,-0.2 3,-0.1 -0.872 27.9-176.3 -95.9 114.1 29.7 2.3 47.0 77 85 A I E - 0 0 66 -9,-2.1 2,-0.3 -2,-0.7 -8,-0.2 0.888 66.7 -3.9 -78.6 -41.2 28.3 -0.1 49.6 78 86 A S E -C 68 0A 54 -10,-1.8 -10,-2.6 2,-0.0 2,-0.3 -0.995 52.2-173.7-154.5 150.4 27.9 -3.1 47.4 79 87 A A E -C 67 0A 48 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.896 12.4-177.8-149.1 112.7 28.3 -4.1 43.7 80 88 A V E -C 66 0A 78 -14,-2.6 -14,-2.3 -2,-0.3 2,-0.2 -0.950 25.8-126.6-119.7 132.3 27.2 -7.5 42.4 81 89 A E E -C 65 0A 136 -2,-0.4 2,-0.4 -16,-0.2 -16,-0.2 -0.550 29.8-136.0 -73.1 135.7 27.5 -8.9 38.9 82 90 A L - 0 0 13 -18,-2.9 2,-1.0 -2,-0.2 3,-0.1 -0.769 7.8-149.6 -99.7 139.2 24.2 -10.1 37.6 83 91 A D >> - 0 0 64 -2,-0.4 4,-2.6 1,-0.2 3,-1.8 -0.803 16.3-175.0-103.6 87.4 23.6 -13.3 35.7 84 92 A T H 3> S+ 0 0 26 -2,-1.0 4,-1.7 1,-0.3 -1,-0.2 0.794 79.3 61.8 -55.4 -32.8 20.7 -12.3 33.5 85 93 A A H 34 S+ 0 0 72 2,-0.2 -1,-0.3 1,-0.1 4,-0.1 0.758 117.7 31.1 -66.3 -22.3 20.3 -15.8 32.0 86 94 A A H <4 S+ 0 0 57 -3,-1.8 468,-0.2 2,-0.2 -2,-0.2 0.883 133.5 24.1 -98.9 -56.0 19.6 -17.0 35.6 87 95 A T H < S- 0 0 67 -4,-2.6 462,-0.4 1,-0.2 -3,-0.2 0.416 113.4 -96.6 -95.5 0.8 17.9 -14.1 37.4 88 96 A G < - 0 0 1 -4,-1.7 -1,-0.2 -5,-0.4 464,-0.2 -0.080 39.6 -68.3 104.6 155.8 16.4 -12.1 34.5 89 97 A E - 0 0 17 462,-2.8 462,-0.4 460,-0.2 464,-0.1 -0.389 52.9-102.4 -79.2 158.3 17.2 -9.2 32.2 90 98 A L - 0 0 0 1,-0.2 -1,-0.1 460,-0.1 3,-0.1 -0.343 53.2 -74.2 -76.4 160.9 17.2 -5.6 33.4 91 99 A P - 0 0 2 0, 0.0 203,-0.2 0, 0.0 -1,-0.2 -0.144 61.1 -91.9 -53.2 151.3 14.3 -3.2 32.7 92 100 A V - 0 0 1 201,-2.1 2,-0.3 -3,-0.1 38,-0.0 -0.427 38.3-130.0 -69.4 138.4 14.0 -1.9 29.1 93 101 A L >> - 0 0 7 -2,-0.1 4,-1.4 1,-0.1 3,-1.2 -0.656 12.4-127.3 -88.3 144.7 15.8 1.3 28.4 94 102 A E H 3> S+ 0 0 75 -2,-0.3 4,-1.1 1,-0.3 3,-0.3 0.890 112.1 55.8 -57.2 -38.6 13.9 4.1 26.6 95 103 A E H 3> S+ 0 0 61 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.701 101.4 58.1 -68.3 -20.1 16.8 4.3 24.1 96 104 A E H <> S+ 0 0 12 -3,-1.2 4,-1.0 2,-0.2 -1,-0.2 0.859 97.7 58.4 -77.7 -36.7 16.4 0.6 23.3 97 105 A F H X S+ 0 0 26 -4,-1.4 4,-0.6 -3,-0.3 3,-0.5 0.896 106.3 52.3 -57.8 -37.0 12.7 1.0 22.3 98 106 A E H X S+ 0 0 109 -4,-1.1 4,-1.4 1,-0.2 3,-0.3 0.839 99.3 61.4 -68.0 -36.6 14.0 3.4 19.7 99 107 A V H X S+ 0 0 15 -4,-1.0 4,-2.8 1,-0.2 5,-0.2 0.769 91.7 68.7 -64.4 -27.2 16.7 1.1 18.2 100 108 A V H X S+ 0 0 0 -4,-1.0 4,-2.2 -3,-0.5 -1,-0.2 0.949 103.3 40.3 -58.2 -53.4 14.0 -1.5 17.1 101 109 A E H X S+ 0 0 47 -4,-0.6 4,-1.7 -3,-0.3 -1,-0.2 0.907 116.7 51.1 -63.5 -41.9 12.5 0.7 14.4 102 110 A Q H < S+ 0 0 133 -4,-1.4 4,-0.3 1,-0.2 -2,-0.2 0.909 111.7 46.1 -62.8 -44.6 15.9 2.0 13.3 103 111 A L H >< S+ 0 0 31 -4,-2.8 3,-1.4 1,-0.2 4,-0.2 0.911 111.3 51.0 -66.0 -43.2 17.4 -1.5 12.9 104 112 A L H >< S+ 0 0 0 -4,-2.2 3,-1.7 1,-0.3 7,-0.3 0.835 96.1 71.6 -63.0 -32.6 14.4 -2.9 11.1 105 113 A A T 3< S+ 0 0 38 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.657 105.3 38.6 -58.7 -17.7 14.5 -0.0 8.6 106 114 A T T < S+ 0 0 110 -3,-1.4 2,-0.5 -4,-0.3 -1,-0.3 0.334 90.0 108.7-115.0 4.2 17.7 -1.5 7.1 107 115 A D <> - 0 0 24 -3,-1.7 4,-2.8 -4,-0.2 5,-0.2 -0.734 61.2-147.0 -87.6 124.5 16.8 -5.2 7.3 108 116 A E H > S+ 0 0 146 -2,-0.5 4,-2.2 1,-0.2 5,-0.2 0.849 97.6 52.3 -56.5 -40.0 16.1 -6.8 3.9 109 117 A R H > S+ 0 0 109 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.930 112.5 45.1 -63.3 -45.8 13.4 -9.1 5.2 110 118 A W H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.932 113.2 50.1 -63.4 -46.7 11.5 -6.3 6.9 111 119 A L H X S+ 0 0 61 -4,-2.8 4,-2.7 -7,-0.3 -1,-0.2 0.866 109.7 51.5 -60.8 -37.5 11.8 -4.1 3.9 112 120 A K H X S+ 0 0 147 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.870 108.2 51.2 -68.0 -37.6 10.5 -6.9 1.6 113 121 A A H X S+ 0 0 6 -4,-1.9 4,-0.7 2,-0.2 -2,-0.2 0.894 114.5 43.7 -66.2 -38.6 7.5 -7.4 3.9 114 122 A L H <>S+ 0 0 2 -4,-2.1 5,-2.3 2,-0.2 3,-0.4 0.891 110.9 54.6 -72.4 -40.0 6.7 -3.7 3.7 115 123 A A H ><5S+ 0 0 61 -4,-2.7 3,-1.5 1,-0.3 -2,-0.2 0.896 104.1 54.4 -60.3 -42.1 7.3 -3.5 -0.0 116 124 A A H 3<5S+ 0 0 65 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.807 112.4 45.3 -61.9 -28.2 4.8 -6.3 -0.6 117 125 A R T 3<5S- 0 0 22 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.361 112.9-121.9 -95.6 2.2 2.3 -4.2 1.3 118 126 A N T < 5 + 0 0 146 -3,-1.5 2,-0.5 -4,-0.2 -3,-0.2 0.896 59.5 151.6 56.7 44.2 3.3 -1.0 -0.6 119 127 A L < - 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