==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 17-NOV-06 2E2T . COMPND 2 MOLECULE: PHENYLETHYLAMINE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER GLOBIFORMIS; . AUTHOR T.MURAKAWA,T.OKAJIMA,M.TAKI,Y.YAMAMOTO,S.KURODA,H.HAYASHI,K. . 620 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27109.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 407 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 210 33.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 0 0.0 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 . 68 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.5 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 3 2 0 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 6 3 3 3 3 4 4 3 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 1 1 0 0 0 0 1 1 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 0 129 0, 0.0 47,-0.2 0, 0.0 46,-0.1 0.000 360.0 360.0 360.0 -18.2 14.5 16.8 58.0 2 10 A S > - 0 0 38 1,-0.1 3,-1.4 2,-0.1 227,-0.0 -0.280 360.0-143.2 -59.1 133.1 12.1 14.0 57.2 3 11 A P T 3 S+ 0 0 46 0, 0.0 -1,-0.1 0, 0.0 46,-0.0 0.593 100.5 58.8 -70.9 -10.9 13.8 10.7 56.0 4 12 A F T 3 S+ 0 0 45 34,-0.1 3,-0.1 236,-0.0 246,-0.1 0.202 76.7 129.9-104.5 14.5 10.8 10.3 53.7 5 13 A R < - 0 0 71 -3,-1.4 222,-0.1 1,-0.1 3,-0.1 -0.259 67.4 -93.1 -67.4 156.2 11.2 13.5 51.8 6 14 A L - 0 0 39 1,-0.1 2,-0.2 233,-0.1 -1,-0.1 -0.200 49.8 -91.7 -63.1 161.2 11.2 13.4 48.0 7 15 A A - 0 0 22 234,-0.2 312,-0.5 312,-0.2 2,-0.2 -0.525 42.6-139.0 -74.4 144.6 14.5 13.2 46.2 8 16 A S > - 0 0 55 -2,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.653 20.8-115.4-100.9 162.1 16.0 16.6 45.4 9 17 A A H > S+ 0 0 44 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.852 118.6 58.7 -62.7 -30.7 17.8 17.4 42.1 10 18 A G H > S+ 0 0 48 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.868 102.2 50.2 -66.5 -39.0 20.8 17.9 44.3 11 19 A E H > S+ 0 0 16 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.917 110.6 50.2 -66.3 -41.1 20.8 14.3 45.6 12 20 A I H X S+ 0 0 2 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.953 111.9 47.7 -60.3 -48.8 20.5 13.0 42.1 13 21 A S H X S+ 0 0 49 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.855 112.1 50.4 -59.6 -36.9 23.5 15.1 41.0 14 22 A E H X S+ 0 0 89 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.861 107.5 52.1 -70.8 -37.2 25.4 14.0 44.1 15 23 A V H X S+ 0 0 1 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.935 110.7 50.3 -62.1 -43.3 24.6 10.3 43.3 16 24 A Q H X S+ 0 0 17 -4,-2.5 4,-2.0 309,-0.3 -2,-0.2 0.915 112.1 46.5 -59.3 -45.0 26.0 11.1 39.8 17 25 A G H X S+ 0 0 24 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.895 111.1 51.6 -66.1 -40.9 29.1 12.6 41.4 18 26 A I H X S+ 0 0 15 -4,-2.9 4,-2.0 1,-0.2 6,-0.2 0.954 111.9 45.9 -60.1 -51.5 29.6 9.7 43.8 19 27 A L H <>S+ 0 0 1 -4,-2.7 5,-2.7 1,-0.2 6,-0.9 0.864 113.9 50.3 -59.6 -38.9 29.4 7.1 41.0 20 28 A R H ><5S+ 0 0 138 -4,-2.0 3,-1.5 -5,-0.2 -1,-0.2 0.939 109.4 48.9 -65.5 -48.7 31.7 9.2 38.8 21 29 A T H 3<5S+ 0 0 132 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.840 111.5 51.5 -61.3 -32.1 34.4 9.6 41.6 22 30 A A T 3<5S- 0 0 56 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.505 115.3-116.1 -83.4 -4.2 34.2 5.9 42.2 23 31 A G T < 5S+ 0 0 62 -3,-1.5 3,-0.3 -4,-0.3 -3,-0.2 0.645 86.2 114.8 78.9 14.5 34.7 5.1 38.5 24 32 A L S - 0 0 35 -3,-0.3 3,-1.4 -7,-0.1 -6,-0.0 -0.008 65.6 -77.7 -73.4-173.1 32.2 6.6 32.8 27 35 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.728 130.0 52.3 -58.6 -29.7 31.2 7.7 29.3 28 36 A E T 3 S+ 0 0 94 30,-0.1 31,-2.6 2,-0.0 32,-0.4 0.469 92.0 98.6 -89.4 -2.6 29.8 4.2 28.3 29 37 A K E < -A 58 0A 40 -3,-1.4 2,-0.3 29,-0.2 29,-0.2 -0.552 49.5-172.5 -89.2 152.5 27.6 4.0 31.4 30 38 A R E -A 57 0A 37 27,-2.4 27,-3.1 -2,-0.2 2,-0.8 -0.997 26.2-124.8-142.8 141.1 23.9 4.7 31.6 31 39 A I E +A 56 0A 10 292,-3.0 25,-0.2 -2,-0.3 294,-0.2 -0.791 28.6 173.6 -89.5 109.9 21.5 4.9 34.6 32 40 A A E S+ 0 0 7 23,-2.5 2,-0.3 -2,-0.8 -1,-0.2 0.710 72.5 7.9 -86.5 -24.2 18.6 2.4 33.8 33 41 A Y E +A 55 0A 12 22,-1.1 22,-2.2 -3,-0.1 2,-0.3 -0.972 61.3 173.5-157.1 142.6 17.1 2.9 37.2 34 42 A L E +A 54 0A 15 -2,-0.3 209,-0.4 20,-0.2 2,-0.3 -0.923 13.8 153.0-154.4 124.7 17.7 5.2 40.2 35 43 A G E -A 53 0A 6 18,-2.0 18,-3.1 -2,-0.3 2,-0.3 -0.984 42.7-105.6-149.9 158.1 15.6 5.5 43.3 36 44 A V E -A 52 0A 37 -2,-0.3 16,-0.3 16,-0.2 2,-0.3 -0.670 36.7-125.7 -86.2 139.9 15.9 6.5 47.0 37 45 A L - 0 0 38 14,-3.0 14,-0.4 -2,-0.3 3,-0.1 -0.623 24.3-115.4 -84.5 144.2 15.9 3.6 49.5 38 46 A D - 0 0 61 -2,-0.3 2,-0.1 1,-0.1 -34,-0.1 -0.395 43.6 -85.0 -74.6 156.4 13.4 3.7 52.3 39 47 A P - 0 0 46 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.411 52.6-109.6 -62.3 134.8 14.7 4.0 55.9 40 48 A A - 0 0 65 1,-0.2 2,-0.1 2,-0.1 -3,-0.0 -0.191 48.3 -75.0 -62.1 157.7 15.6 0.6 57.3 41 49 A R S S+ 0 0 70 1,-0.1 -1,-0.2 2,-0.1 3,-0.0 -0.337 111.9 34.6 -57.2 126.2 13.4 -0.9 60.0 42 50 A G - 0 0 64 -3,-0.1 3,-0.5 1,-0.1 -2,-0.1 0.857 56.6-163.8 91.3 89.0 14.2 0.8 63.3 43 51 A A + 0 0 77 1,-0.2 -1,-0.1 -4,-0.1 -2,-0.1 0.057 53.0 125.6 -88.6 25.8 15.1 4.5 63.2 44 52 A G + 0 0 78 1,-0.2 2,-0.8 -3,-0.0 -1,-0.2 0.646 59.3 77.3 -58.3 -12.3 16.4 4.2 66.7 45 53 A S S S- 0 0 86 -3,-0.5 -1,-0.2 2,-0.0 -3,-0.0 -0.858 84.5-142.6-104.3 99.7 19.6 5.6 65.1 46 54 A E S S+ 0 0 163 -2,-0.8 -2,-0.0 2,-0.1 -1,-0.0 0.119 72.1 53.2 -49.5 173.6 19.1 9.4 64.7 47 55 A A S S- 0 0 90 -46,-0.1 -2,-0.0 -4,-0.0 0, 0.0 0.907 86.4-125.3 56.3 100.4 20.4 11.1 61.6 48 56 A E - 0 0 65 -47,-0.2 2,-0.6 1,-0.1 -2,-0.1 -0.236 7.4-130.6 -70.8 162.8 19.1 9.2 58.6 49 57 A D - 0 0 56 23,-0.1 2,-0.7 -46,-0.0 -1,-0.1 -0.864 19.0-146.1-117.5 92.5 21.4 7.8 55.9 50 58 A R - 0 0 11 -2,-0.6 21,-2.4 20,-0.1 22,-1.0 -0.453 27.7-179.5 -62.3 106.6 20.0 8.9 52.6 51 59 A R E - B 0 70A 95 -2,-0.7 -14,-3.0 -14,-0.4 2,-0.4 -0.853 14.5-159.6-113.1 147.6 20.8 6.0 50.3 52 60 A F E -AB 36 69A 1 17,-2.5 17,-2.8 -2,-0.3 2,-0.4 -0.952 8.7-144.2-125.8 146.0 20.0 5.5 46.6 53 61 A R E -AB 35 68A 6 -18,-3.1 -18,-2.0 -2,-0.4 2,-0.4 -0.915 21.7-174.4-110.0 133.6 19.9 2.4 44.6 54 62 A V E -AB 34 67A 0 13,-3.2 13,-3.1 -2,-0.4 2,-0.6 -0.983 23.0-154.8-135.1 142.1 21.1 2.4 41.0 55 63 A F E -AB 33 66A 1 -22,-2.2 -23,-2.5 -2,-0.4 -22,-1.1 -0.966 22.6-158.2-109.8 115.8 21.2 -0.0 38.1 56 64 A I E -AB 31 65A 1 9,-2.9 9,-1.9 -2,-0.6 2,-0.2 -0.875 4.1-161.8-105.2 117.0 24.0 0.9 35.8 57 65 A H E -A 30 0A 11 -27,-3.1 -27,-2.4 -2,-0.6 2,-0.5 -0.615 9.0-143.5 -91.9 150.0 23.9 -0.2 32.1 58 66 A D E > -A 29 0A 11 4,-0.4 3,-1.6 -2,-0.2 -29,-0.2 -0.956 6.0-162.9-119.4 113.6 26.9 -0.4 29.8 59 67 A V T 3 S+ 0 0 40 -31,-2.6 -30,-0.1 -2,-0.5 -1,-0.1 0.584 88.7 69.1 -69.5 -9.7 26.4 0.5 26.2 60 68 A S T 3 S- 0 0 83 -32,-0.4 -1,-0.3 3,-0.1 3,-0.1 0.576 119.6-104.7 -84.5 -10.6 29.7 -1.1 25.4 61 69 A G S < S+ 0 0 51 -3,-1.6 -2,-0.1 1,-0.3 114,-0.1 0.332 76.3 137.1 103.3 -6.8 28.3 -4.6 26.1 62 70 A A - 0 0 49 1,-0.1 -4,-0.4 -5,-0.0 -1,-0.3 -0.127 65.8 -76.9 -65.3 169.9 30.0 -4.9 29.5 63 71 A R - 0 0 116 -6,-0.1 -1,-0.1 1,-0.1 20,-0.1 -0.429 46.4-123.3 -73.3 142.8 28.1 -6.3 32.5 64 72 A P - 0 0 12 0, 0.0 18,-3.2 0, 0.0 2,-0.3 -0.283 25.6-143.6 -77.6 170.1 25.6 -4.1 34.3 65 73 A Q E -BC 56 81A 40 -9,-1.9 -9,-2.9 16,-0.3 2,-0.6 -0.967 12.0-141.0-138.9 152.8 25.9 -3.4 38.0 66 74 A E E -BC 55 80A 43 14,-2.5 14,-2.8 -2,-0.3 2,-0.4 -0.968 32.0-176.6-110.3 121.8 23.6 -2.8 40.9 67 75 A V E -BC 54 79A 0 -13,-3.1 -13,-3.2 -2,-0.6 2,-0.5 -0.965 19.9-161.1-128.1 139.7 25.0 -0.1 43.2 68 76 A T E -BC 53 78A 19 10,-2.8 9,-1.8 -2,-0.4 10,-1.7 -0.972 18.6-173.0-115.1 124.3 23.9 1.3 46.5 69 77 A V E -BC 52 76A 0 -17,-2.8 -17,-2.5 -2,-0.5 2,-0.7 -0.899 22.9-138.5-121.4 151.3 25.3 4.8 47.4 70 78 A S E >> -BC 51 75A 0 5,-3.1 5,-2.0 -2,-0.3 4,-1.0 -0.924 14.2-175.4-105.8 108.5 25.1 6.9 50.5 71 79 A V T 45S+ 0 0 21 -21,-2.4 -1,-0.2 -2,-0.7 -20,-0.1 0.793 84.0 61.4 -72.0 -27.7 24.5 10.5 49.5 72 80 A T T 45S+ 0 0 70 -22,-1.0 -1,-0.2 1,-0.2 -21,-0.1 0.932 118.2 25.6 -62.3 -48.5 24.8 11.4 53.2 73 81 A N T 45S- 0 0 104 -23,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.458 104.7-123.3 -96.7 -3.6 28.4 10.2 53.4 74 82 A G T <5 + 0 0 31 -4,-1.0 2,-0.3 1,-0.2 -3,-0.2 0.911 69.4 122.7 62.0 43.8 29.2 10.6 49.8 75 83 A T E < -C 70 0A 60 -5,-2.0 -5,-3.1 -53,-0.0 2,-0.8 -0.881 69.6-112.6-135.3 165.5 30.2 6.9 49.4 76 84 A V E -C 69 0A 45 -2,-0.3 -7,-0.3 -7,-0.2 3,-0.1 -0.879 24.5-169.6 -97.3 110.4 29.4 3.7 47.5 77 85 A I E - 0 0 63 -9,-1.8 2,-0.3 -2,-0.8 -8,-0.2 0.953 69.3 -18.3 -64.3 -50.4 27.8 1.3 50.0 78 86 A S E -C 68 0A 52 -10,-1.7 -10,-2.8 -3,-0.1 2,-0.4 -0.990 52.9-164.0-157.8 151.4 28.1 -1.6 47.6 79 87 A A E -C 67 0A 47 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.963 13.1-173.4-141.9 119.8 28.5 -2.3 43.9 80 88 A V E -C 66 0A 76 -14,-2.8 -14,-2.5 -2,-0.4 2,-0.1 -0.962 23.2-129.6-122.1 129.9 27.7 -5.7 42.4 81 89 A E E -C 65 0A 114 -2,-0.4 2,-0.4 -16,-0.2 -16,-0.3 -0.484 32.0-137.4 -69.6 140.9 28.3 -6.9 38.8 82 90 A L - 0 0 13 -18,-3.2 2,-0.8 -2,-0.1 3,-0.1 -0.835 13.2-151.5-109.1 145.3 25.1 -8.4 37.4 83 91 A D >> - 0 0 66 -2,-0.4 4,-2.1 1,-0.2 3,-1.8 -0.834 16.3-175.1-110.0 87.2 24.7 -11.6 35.3 84 92 A T H 3> S+ 0 0 19 -2,-0.8 4,-2.2 1,-0.3 57,-0.2 0.797 77.1 66.7 -55.4 -34.2 21.6 -10.6 33.3 85 93 A A H 34 S+ 0 0 36 56,-0.2 -1,-0.3 2,-0.2 469,-0.2 0.775 115.9 29.2 -59.9 -25.3 21.3 -14.1 31.7 86 94 A A H <4 S+ 0 0 58 -3,-1.8 468,-0.2 2,-0.1 -2,-0.2 0.888 133.0 27.4 -97.5 -60.4 20.5 -15.4 35.2 87 95 A T H < S- 0 0 64 -4,-2.1 462,-0.3 1,-0.2 -3,-0.2 0.520 114.7 -97.8 -84.5 -8.2 18.8 -12.6 37.1 88 96 A G < - 0 0 2 -4,-2.2 -1,-0.2 -5,-0.4 464,-0.2 -0.128 38.5 -69.3 109.1 154.5 17.3 -10.7 34.2 89 97 A E - 0 0 11 462,-2.7 462,-0.4 460,-0.1 3,-0.1 -0.392 52.1-102.8 -78.5 157.9 17.9 -7.7 32.0 90 98 A L - 0 0 0 1,-0.2 -1,-0.1 460,-0.1 3,-0.1 -0.322 54.4 -73.0 -74.8 161.4 17.7 -4.1 33.3 91 99 A P - 0 0 5 0, 0.0 203,-0.2 0, 0.0 -1,-0.2 -0.169 63.4 -91.5 -53.5 148.5 14.7 -1.9 32.5 92 100 A V - 0 0 3 201,-2.2 2,-0.3 -3,-0.1 38,-0.0 -0.395 40.5-127.5 -65.6 138.0 14.6 -0.7 28.8 93 101 A L > - 0 0 9 1,-0.1 3,-0.9 -3,-0.1 4,-0.5 -0.627 8.5-130.9 -87.2 146.4 16.3 2.6 28.2 94 102 A E T >> S+ 0 0 96 1,-0.3 3,-1.6 -2,-0.3 4,-0.8 0.894 109.8 56.8 -61.9 -39.3 14.4 5.3 26.4 95 103 A E H 3> S+ 0 0 63 1,-0.3 4,-0.7 2,-0.2 -1,-0.3 0.701 99.3 61.8 -65.4 -19.1 17.3 5.8 24.0 96 104 A E H <> S+ 0 0 8 -3,-0.9 4,-0.5 1,-0.2 -1,-0.3 0.635 93.6 65.2 -81.3 -13.5 17.0 2.2 23.1 97 105 A F H X> S+ 0 0 28 -3,-1.6 3,-0.7 -4,-0.5 4,-0.7 0.904 98.3 49.2 -75.4 -42.4 13.4 2.7 21.8 98 106 A E H 3X S+ 0 0 99 -4,-0.8 4,-1.5 1,-0.2 -1,-0.2 0.808 101.1 65.7 -67.0 -30.7 14.3 5.0 18.9 99 107 A V H 3X S+ 0 0 16 -4,-0.7 4,-2.9 1,-0.2 5,-0.3 0.769 90.7 64.2 -64.6 -28.0 17.0 2.7 17.6 100 108 A V H < S+ 0 0 39 -4,-2.9 3,-1.3 1,-0.2 -2,-0.2 0.932 113.4 51.4 -66.5 -45.6 17.8 0.0 12.5 104 112 A L H >< S+ 0 0 0 -4,-2.4 3,-2.2 -5,-0.3 7,-0.2 0.848 95.2 72.6 -60.2 -34.7 14.9 -1.7 10.8 105 113 A A T 3< S+ 0 0 35 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.761 105.6 36.6 -52.9 -29.3 14.6 1.1 8.2 106 114 A T T < S+ 0 0 110 -3,-1.3 2,-0.6 -4,-0.5 -1,-0.3 0.187 90.3 110.5-111.2 16.9 17.8 -0.1 6.5 107 115 A D <> - 0 0 28 -3,-2.2 4,-2.9 1,-0.1 5,-0.2 -0.831 61.5-145.6 -95.8 121.6 17.3 -3.8 6.9 108 116 A E H > S+ 0 0 137 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.818 98.7 53.2 -53.3 -37.6 16.6 -5.6 3.6 109 117 A R H > S+ 0 0 110 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.942 112.5 44.6 -64.3 -45.8 14.3 -8.1 5.2 110 118 A W H > S+ 0 0 2 2,-0.2 4,-2.3 -3,-0.2 -2,-0.2 0.933 114.6 48.8 -62.7 -47.1 12.2 -5.4 6.8 111 119 A L H X S+ 0 0 50 -4,-2.9 4,-2.9 -7,-0.2 5,-0.2 0.901 110.1 51.7 -61.6 -40.1 12.2 -3.4 3.6 112 120 A K H X S+ 0 0 162 -4,-2.7 4,-1.6 -5,-0.2 -1,-0.2 0.885 109.4 50.6 -64.3 -36.5 11.2 -6.4 1.6 113 121 A A H < S+ 0 0 5 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.898 113.3 44.9 -67.3 -40.1 8.3 -7.0 4.0 114 122 A L H ><>S+ 0 0 2 -4,-2.3 5,-2.6 1,-0.2 3,-1.2 0.904 110.6 53.1 -70.5 -41.9 7.2 -3.4 3.7 115 123 A A H ><5S+ 0 0 63 -4,-2.9 3,-1.2 1,-0.3 -1,-0.2 0.841 102.2 59.4 -62.9 -32.5 7.5 -3.4 -0.1 116 124 A A T 3<5S+ 0 0 58 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.724 111.8 41.4 -68.2 -18.9 5.3 -6.5 -0.3 117 125 A R T < 5S- 0 0 18 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.276 114.1-120.1-108.6 6.3 2.7 -4.4 1.4 118 126 A N T < 5 + 0 0 149 -3,-1.2 2,-0.4 1,-0.2 -3,-0.2 0.874 61.1 152.4 56.3 41.0 3.4 -1.4 -0.7 119 127 A L < - 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