==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 13-MAR-02 1L6R . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN TA0175; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM; . AUTHOR Y.KIM,A.JOACHIMIAK,A.M.EDWARDS,X.XU,M.PENNYCOOKE,J.GU,F.CHEU . 450 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19667.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 322 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 19 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 26.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 3.1 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 0 2 0 0 3 3 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 2 2 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 PARALLEL BRIDGES PER LADDER . 4 0 6 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 0 0 0 2 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 0 A H 0 0 147 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 176.2 32.5 43.3 -0.9 2 1 A M - 0 0 153 1,-0.1 2,-0.4 167,-0.0 220,-0.0 -0.730 360.0-110.4 -95.3 139.8 32.3 44.0 -4.6 3 2 A I + 0 0 19 -2,-0.3 167,-0.2 219,-0.2 166,-0.1 -0.508 41.3 165.0 -69.3 122.1 30.3 41.9 -7.1 4 3 A R + 0 0 122 165,-2.8 34,-2.0 -2,-0.4 2,-0.3 0.596 62.7 32.1-111.2 -19.6 32.6 39.9 -9.3 5 4 A L E -ab 38 170A 1 164,-1.8 166,-2.8 32,-0.2 2,-0.4 -1.000 58.3-160.9-144.9 140.1 30.1 37.5 -10.8 6 5 A A E -ab 39 171A 0 32,-2.5 34,-2.7 -2,-0.3 2,-0.6 -0.987 5.7-160.1-122.3 128.5 26.5 37.5 -11.8 7 6 A A E -ab 40 172A 0 164,-2.7 166,-2.3 -2,-0.4 2,-0.4 -0.945 18.7-165.3-108.7 121.1 24.5 34.2 -12.3 8 7 A I E -ab 41 173A 0 32,-2.6 34,-3.0 -2,-0.6 2,-0.7 -0.922 24.4-129.1-120.4 134.6 21.3 34.8 -14.3 9 8 A D E > -a 42 0A 2 164,-2.1 4,-2.1 -2,-0.4 5,-0.4 -0.647 24.4-158.3 -74.5 111.2 18.2 32.8 -14.9 10 9 A V H > S+ 0 0 5 32,-2.8 4,-2.3 -2,-0.7 5,-0.2 0.964 85.2 35.9 -59.5 -57.9 17.9 32.8 -18.7 11 10 A D H 4 S+ 0 0 32 31,-0.3 4,-0.2 1,-0.2 -1,-0.2 0.828 120.9 47.8 -70.3 -31.4 14.2 32.1 -19.2 12 11 A G H 4 S+ 0 0 18 161,-0.1 199,-0.3 1,-0.1 -1,-0.2 0.820 129.5 13.3 -79.0 -28.3 13.1 34.0 -16.2 13 12 A N H < S+ 0 0 0 -4,-2.1 202,-0.3 160,-0.1 199,-0.3 0.541 118.0 55.8-128.3 -11.2 15.0 37.2 -16.8 14 13 A L S < S+ 0 0 1 -4,-2.3 8,-2.9 -5,-0.4 2,-0.3 0.335 94.0 75.6-109.0 8.3 16.5 37.5 -20.3 15 14 A T B -H 21 0B 20 6,-0.3 6,-0.2 -4,-0.2 2,-0.1 -0.809 66.6-132.0-121.7 159.2 13.4 37.1 -22.3 16 15 A D > - 0 0 51 4,-2.4 3,-2.2 -2,-0.3 195,-0.1 -0.216 50.6 -73.7 -93.9-170.1 10.4 39.1 -23.3 17 16 A R T 3 S+ 0 0 182 1,-0.3 -1,-0.0 2,-0.1 194,-0.0 0.731 134.3 48.0 -56.5 -26.4 6.6 38.2 -23.2 18 17 A D T 3 S- 0 0 109 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.173 120.7-105.7-102.2 16.8 7.1 36.0 -26.3 19 18 A R S < S+ 0 0 112 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.601 74.3 143.0 69.3 15.7 10.1 34.2 -24.9 20 19 A L - 0 0 103 1,-0.1 -4,-2.4 -5,-0.0 -1,-0.3 -0.586 60.5 -98.9 -85.2 148.7 12.5 36.1 -27.2 21 20 A I B -H 15 0B 60 -6,-0.2 2,-0.6 -2,-0.2 -6,-0.3 -0.416 37.3-119.1 -67.6 137.0 15.9 37.2 -26.0 22 21 A S > - 0 0 13 -8,-2.9 4,-2.0 1,-0.2 5,-0.1 -0.676 16.1-158.9 -78.6 119.7 16.0 40.8 -24.9 23 22 A T H > S+ 0 0 102 -2,-0.6 4,-2.4 1,-0.2 5,-0.2 0.856 94.6 55.8 -68.4 -31.4 18.4 42.8 -26.9 24 23 A K H > S+ 0 0 123 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.909 107.6 49.3 -65.0 -39.3 18.7 45.4 -24.2 25 24 A A H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.904 108.9 53.5 -65.5 -39.1 19.6 42.6 -21.7 26 25 A I H X S+ 0 0 22 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.942 110.8 45.2 -60.3 -47.7 22.2 41.4 -24.2 27 26 A E H X S+ 0 0 105 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.873 111.2 53.5 -66.8 -34.0 23.8 44.8 -24.5 28 27 A S H X S+ 0 0 13 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.921 110.1 48.3 -64.4 -42.6 23.7 45.3 -20.7 29 28 A I H X S+ 0 0 3 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.948 112.8 46.8 -62.5 -47.6 25.5 42.0 -20.2 30 29 A R H X S+ 0 0 93 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.896 112.5 50.8 -62.9 -38.5 28.2 42.9 -22.8 31 30 A S H X S+ 0 0 29 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.948 112.5 45.5 -63.4 -48.5 28.6 46.4 -21.2 32 31 A A H <>S+ 0 0 0 -4,-2.6 5,-2.2 1,-0.2 3,-0.3 0.895 111.5 52.6 -62.9 -40.3 29.1 44.9 -17.7 33 32 A E H ><5S+ 0 0 27 -4,-2.6 3,-1.8 1,-0.2 -1,-0.2 0.899 104.7 55.2 -63.4 -39.1 31.4 42.2 -19.0 34 33 A K H 3<5S+ 0 0 170 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.832 105.8 53.8 -62.2 -30.0 33.6 44.8 -20.7 35 34 A K T 3<5S- 0 0 116 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.392 134.2 -88.3 -84.2 2.1 33.8 46.6 -17.3 36 35 A G T < 5S+ 0 0 58 -3,-1.8 -3,-0.2 1,-0.3 2,-0.2 0.392 78.6 139.7 111.9 -4.6 35.0 43.3 -15.6 37 36 A L < - 0 0 5 -5,-2.2 2,-0.5 187,-0.2 -1,-0.3 -0.508 43.5-141.1 -76.0 138.9 32.0 41.4 -14.6 38 37 A T E -a 5 0A 30 -34,-2.0 -32,-2.5 -2,-0.2 2,-0.4 -0.876 20.9-160.1 -97.4 129.8 31.9 37.6 -15.1 39 38 A V E -a 6 0A 0 -2,-0.5 22,-1.5 -34,-0.2 2,-0.4 -0.931 11.4-173.3-116.4 136.9 28.5 36.4 -16.2 40 39 A S E -a 7 0A 0 -34,-2.7 -32,-2.6 -2,-0.4 2,-0.4 -0.983 15.1-143.2-125.2 137.8 27.1 32.9 -16.0 41 40 A L E -ac 8 63A 0 21,-0.7 23,-3.0 -2,-0.4 2,-0.4 -0.858 9.6-162.0-104.0 138.3 23.8 31.8 -17.5 42 41 A L E +ac 9 64A 2 -34,-3.0 -32,-2.8 -2,-0.4 -31,-0.3 -0.976 20.7 160.3-119.2 128.4 21.5 29.3 -15.8 43 42 A S - 0 0 3 21,-1.5 24,-2.4 -2,-0.4 25,-0.5 -0.977 47.4-137.8-146.4 158.9 18.8 27.5 -17.7 44 43 A G S S+ 0 0 2 -2,-0.3 21,-0.1 22,-0.3 3,-0.1 0.516 81.0 97.3 -89.2 -7.2 16.5 24.5 -17.7 45 44 A N S S- 0 0 25 19,-0.2 21,-2.5 1,-0.1 22,-0.2 -0.194 87.4 -77.4 -77.3 174.2 17.2 24.0 -21.4 46 45 A V >> - 0 0 0 19,-0.2 4,-1.9 1,-0.1 3,-0.9 -0.277 40.7-109.7 -72.9 155.4 19.8 21.6 -22.9 47 46 A I H 3> S+ 0 0 4 61,-0.4 4,-2.5 1,-0.2 5,-0.2 0.827 114.8 55.3 -59.1 -35.6 23.5 22.3 -22.9 48 47 A P H 3> S+ 0 0 57 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.857 109.2 51.0 -67.5 -26.8 23.9 22.9 -26.7 49 48 A V H <> S+ 0 0 51 -3,-0.9 4,-1.7 2,-0.2 -2,-0.2 0.930 113.7 41.8 -71.5 -44.5 21.1 25.5 -26.5 50 49 A V H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.844 111.8 56.8 -70.8 -29.6 22.9 27.4 -23.6 51 50 A Y H X S+ 0 0 96 -4,-2.5 4,-2.7 -5,-0.3 5,-0.3 0.920 103.8 53.8 -64.1 -42.9 26.2 26.9 -25.4 52 51 A A H X S+ 0 0 35 -4,-1.9 4,-2.5 1,-0.2 5,-0.4 0.922 108.8 48.8 -57.6 -42.9 24.6 28.7 -28.4 53 52 A L H X>S+ 0 0 36 -4,-1.7 4,-2.6 2,-0.2 5,-0.7 0.920 109.3 53.2 -64.5 -40.0 23.7 31.6 -26.0 54 53 A K H X>S+ 0 0 20 -4,-2.3 5,-1.9 1,-0.2 4,-1.2 0.953 115.8 37.4 -60.3 -49.3 27.3 31.6 -24.6 55 54 A I H <5S+ 0 0 86 -4,-2.7 -1,-0.2 3,-0.2 -2,-0.2 0.841 125.4 37.2 -76.0 -30.0 29.0 31.9 -28.0 56 55 A F H <5S+ 0 0 156 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.857 121.6 40.8 -90.4 -37.4 26.4 34.2 -29.7 57 56 A L H <5S- 0 0 15 -4,-2.6 -3,-0.2 -5,-0.4 -2,-0.2 0.836 110.8-119.7 -77.9 -29.3 25.5 36.5 -26.8 58 57 A G T << - 0 0 35 -4,-1.2 2,-0.5 -5,-0.7 -3,-0.2 0.905 40.7-179.8 91.2 54.2 29.1 36.6 -25.7 59 58 A I < - 0 0 7 -5,-1.9 -1,-0.2 -6,-0.3 -19,-0.1 -0.764 15.2-162.2 -90.1 127.2 29.0 35.2 -22.2 60 59 A N + 0 0 60 -2,-0.5 -20,-0.1 -23,-0.2 -1,-0.1 0.524 66.2 58.3 -90.3 -4.4 32.4 35.1 -20.5 61 60 A G S S- 0 0 0 -22,-1.5 -20,-0.1 1,-0.2 -21,-0.1 -0.543 98.6 -69.8-113.8-177.5 31.7 32.6 -17.7 62 61 A P - 0 0 0 0, 0.0 -21,-0.7 0, 0.0 2,-0.4 -0.291 46.1-145.4 -67.4 157.3 30.5 29.0 -17.6 63 62 A V E -cD 41 72A 0 9,-2.0 9,-2.8 -23,-0.2 2,-0.4 -0.960 6.8-148.6-126.2 146.4 26.9 28.3 -18.6 64 63 A F E -cD 42 71A 0 -23,-3.0 -21,-1.5 -2,-0.4 7,-0.2 -0.932 10.9-173.8-117.7 140.2 24.6 25.7 -17.1 65 64 A G E > > + D 0 70A 0 5,-2.4 3,-2.1 -2,-0.4 5,-1.4 -0.596 66.2 41.5-114.8 180.0 21.7 23.7 -18.7 66 65 A E G > 5S- 0 0 0 -21,-2.5 3,-1.5 1,-0.3 -22,-0.3 0.849 131.6 -63.0 46.4 43.8 19.2 21.3 -17.1 67 66 A N G 3 5S- 0 0 3 -24,-2.4 -1,-0.3 1,-0.3 88,-0.3 0.665 109.3 -38.6 59.6 23.1 18.8 23.6 -14.1 68 67 A G G < 5S+ 0 0 0 -3,-2.1 -1,-0.3 -25,-0.5 83,-0.2 0.277 113.1 108.8 113.1 -6.4 22.4 23.2 -13.0 69 68 A G T < 5S+ 0 0 0 -3,-1.5 12,-2.8 -4,-0.5 13,-0.8 0.636 81.1 34.1 -77.9 -15.3 23.0 19.6 -13.8 70 69 A I E < -DE 65 80A 0 -5,-1.4 -5,-2.4 10,-0.2 2,-0.4 -0.996 69.1-165.7-142.5 143.8 25.3 20.1 -16.8 71 70 A M E -DE 64 79A 0 8,-2.8 8,-2.5 -2,-0.3 2,-0.6 -0.984 18.3-152.7-137.1 140.3 27.9 22.8 -17.5 72 71 A F E -DE 63 78A 26 -9,-2.8 -9,-2.0 -2,-0.4 6,-0.2 -0.959 32.1-159.9-107.5 117.4 29.8 24.1 -20.5 73 72 A D > - 0 0 10 4,-2.5 3,-1.3 -2,-0.6 -12,-0.1 -0.335 30.8-100.1 -94.6 178.3 33.0 25.7 -19.1 74 73 A N T 3 S+ 0 0 86 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.523 116.6 64.8 -75.3 -6.5 35.6 28.2 -20.4 75 74 A D T 3 S- 0 0 118 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.262 119.5-107.7 -96.6 10.4 38.0 25.5 -21.5 76 75 A G S < S+ 0 0 48 -3,-1.3 2,-0.2 1,-0.3 -2,-0.1 0.551 78.8 125.2 79.5 9.1 35.4 24.3 -24.0 77 76 A S - 0 0 41 2,-0.0 -4,-2.5 0, 0.0 2,-0.5 -0.595 53.7-135.0-101.3 162.7 34.5 21.1 -22.1 78 77 A I E -E 72 0A 85 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.968 20.5-176.2-117.3 128.4 31.2 19.8 -20.9 79 78 A K E -E 71 0A 88 -8,-2.5 -8,-2.8 -2,-0.5 2,-0.4 -0.986 6.4-163.1-125.2 130.4 30.8 18.4 -17.4 80 79 A K E -E 70 0A 91 -2,-0.4 -10,-0.2 -10,-0.2 -11,-0.1 -0.898 8.0-167.8-112.6 148.6 27.6 16.8 -16.1 81 80 A F S S+ 0 0 61 -12,-2.8 2,-0.3 -2,-0.4 -11,-0.1 0.468 70.9 34.5-112.6 -5.7 27.1 16.3 -12.4 82 81 A F S S- 0 0 45 -13,-0.8 2,-0.3 68,-0.0 30,-0.1 -0.932 75.2-122.4-143.1 164.5 24.0 14.0 -12.4 83 82 A S - 0 0 52 -2,-0.3 4,-0.4 28,-0.1 28,-0.3 -0.773 2.3-149.8-113.0 157.1 22.7 11.3 -14.7 84 83 A N S > S+ 0 0 28 26,-1.0 4,-2.5 -2,-0.3 5,-0.2 0.263 73.8 97.8-106.3 10.0 19.4 10.9 -16.6 85 84 A E H > S+ 0 0 135 25,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.939 91.1 39.2 -63.9 -45.1 19.2 7.1 -16.5 86 85 A G H > S+ 0 0 28 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.934 117.9 46.7 -70.4 -46.9 16.9 7.1 -13.5 87 86 A T H > S+ 0 0 0 -4,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.889 112.0 51.8 -64.7 -36.5 14.8 10.1 -14.6 88 87 A N H X S+ 0 0 66 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.916 110.0 49.3 -65.0 -41.8 14.5 8.7 -18.1 89 88 A K H X S+ 0 0 103 -4,-1.7 4,-2.3 -5,-0.2 -2,-0.2 0.896 108.5 53.7 -63.3 -41.2 13.3 5.3 -16.7 90 89 A F H X S+ 0 0 3 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.934 110.3 46.3 -59.1 -47.9 10.7 7.1 -14.5 91 90 A L H X S+ 0 0 11 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.921 109.4 55.1 -61.8 -43.4 9.2 9.0 -17.5 92 91 A E H < S+ 0 0 107 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.919 115.2 39.0 -55.7 -45.1 9.2 5.8 -19.6 93 92 A E H >< S+ 0 0 102 -4,-2.3 3,-1.4 1,-0.2 4,-0.4 0.938 116.4 48.9 -71.3 -48.7 7.1 4.0 -16.9 94 93 A M H >X S+ 0 0 3 -4,-3.0 3,-1.3 1,-0.3 4,-0.9 0.815 100.5 64.8 -63.5 -32.1 4.9 7.0 -16.0 95 94 A S T 3< S+ 0 0 53 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.680 93.3 65.1 -66.9 -14.2 4.0 7.7 -19.6 96 95 A K T <4 S+ 0 0 163 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.731 117.0 21.8 -80.4 -21.6 2.3 4.4 -19.7 97 96 A R T <4 S+ 0 0 144 -3,-1.3 2,-0.3 -4,-0.4 -2,-0.2 0.268 124.5 37.8-130.7 12.8 -0.4 5.3 -17.2 98 97 A T S < S- 0 0 25 -4,-0.9 19,-0.0 2,-0.2 23,-0.0 -0.873 87.4 -97.7-147.9-179.8 -0.5 9.1 -17.2 99 98 A S S S+ 0 0 22 -2,-0.3 17,-0.1 19,-0.1 -4,-0.1 0.421 76.0 128.9 -85.0 0.6 -0.3 12.0 -19.7 100 99 A M + 0 0 2 -6,-0.3 2,-0.3 17,-0.1 17,-0.2 -0.360 38.2 174.9 -59.0 130.4 3.4 12.6 -18.8 101 100 A R B -I 116 0C 108 15,-2.6 15,-2.3 -2,-0.1 -9,-0.1 -0.986 31.2-104.6-146.3 153.6 5.3 12.6 -22.0 102 101 A S - 0 0 75 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.197 29.7-143.9 -69.1 160.2 8.7 13.2 -23.5 103 102 A I > - 0 0 23 11,-0.4 3,-1.9 1,-0.1 4,-0.3 -0.903 25.1-108.9-125.7 156.6 9.7 16.4 -25.4 104 103 A L G > S+ 0 0 121 -2,-0.3 3,-2.1 1,-0.3 4,-0.2 0.876 111.9 62.0 -53.4 -44.2 12.0 16.8 -28.4 105 104 A T G > S+ 0 0 33 1,-0.3 3,-2.2 2,-0.2 -1,-0.3 0.638 80.4 84.2 -63.2 -10.6 14.8 18.4 -26.5 106 105 A N G X S+ 0 0 22 -3,-1.9 3,-1.5 1,-0.3 -1,-0.3 0.766 74.0 74.6 -62.0 -19.9 15.3 15.3 -24.4 107 106 A R G < S+ 0 0 192 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.699 103.2 40.1 -64.6 -15.7 17.4 14.0 -27.3 108 107 A W G < S+ 0 0 106 -3,-2.2 -61,-0.4 -4,-0.2 -1,-0.3 0.311 93.8 106.7-113.7 5.9 20.1 16.4 -26.0 109 108 A R < + 0 0 14 -3,-1.5 -25,-0.1 -4,-0.2 -63,-0.1 -0.597 30.7 165.3 -86.9 151.2 19.6 16.0 -22.3 110 109 A E S S+ 0 0 76 -2,-0.2 -26,-1.0 -27,-0.1 -25,-0.2 0.488 73.0 37.3-136.7 -15.4 22.2 14.1 -20.2 111 110 A A S S+ 0 0 0 -28,-0.3 36,-0.4 -27,-0.1 2,-0.3 0.346 119.7 3.1-127.0 4.8 21.4 14.9 -16.5 112 111 A S S S- 0 0 0 34,-0.1 2,-0.4 -30,-0.1 34,-0.2 -0.928 71.2-104.9-171.3-177.4 17.7 15.1 -16.1 113 112 A T E -J 145 0D 0 32,-2.1 32,-3.0 -2,-0.3 2,-0.2 -0.990 19.1-151.9-135.3 127.4 14.5 14.6 -18.1 114 113 A G E +J 144 0D 0 -2,-0.4 -11,-0.4 30,-0.2 2,-0.3 -0.555 25.2 169.6 -89.4 159.8 12.1 17.3 -19.5 115 114 A F E -J 143 0D 0 28,-1.9 28,-2.5 -2,-0.2 2,-0.3 -0.996 32.6-131.7-163.8 164.5 8.4 16.5 -20.0 116 115 A D B +I 101 0C 59 -15,-2.3 -15,-2.6 -2,-0.3 2,-0.3 -0.853 31.4 175.0-114.7 155.1 4.9 17.8 -20.8 117 116 A I - 0 0 14 -2,-0.3 -17,-0.1 -17,-0.2 5,-0.1 -0.980 35.8-105.8-161.8 147.0 2.0 16.7 -18.6 118 117 A D >> - 0 0 65 -2,-0.3 3,-2.1 1,-0.1 4,-0.5 -0.568 36.8-120.4 -73.4 140.2 -1.8 17.5 -18.3 119 118 A P G >4 S+ 0 0 108 0, 0.0 3,-1.1 0, 0.0 4,-0.4 0.829 110.6 63.8 -50.2 -34.8 -2.4 19.7 -15.2 120 119 A E G 34 S+ 0 0 154 1,-0.2 4,-0.3 2,-0.1 3,-0.1 0.721 102.3 48.4 -64.2 -23.4 -4.6 16.9 -13.8 121 120 A D G <> S+ 0 0 41 -3,-2.1 4,-2.4 1,-0.1 5,-0.2 0.495 85.5 92.2 -96.3 -3.3 -1.7 14.5 -13.5 122 121 A V H S+ 0 0 113 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.923 114.4 45.7 -61.2 -44.1 -0.1 16.0 -8.2 124 123 A Y H > S+ 0 0 89 -4,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.942 114.5 46.7 -64.8 -47.9 0.1 12.2 -8.7 125 124 A V H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.879 110.2 53.7 -64.2 -35.9 3.4 12.4 -10.8 126 125 A R H X S+ 0 0 76 -4,-2.6 4,-2.8 -5,-0.2 5,-0.2 0.935 109.3 48.9 -63.6 -43.1 5.0 14.7 -8.2 127 126 A K H X S+ 0 0 147 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.938 114.2 45.5 -60.4 -46.7 4.2 12.2 -5.4 128 127 A E H < S+ 0 0 58 -4,-2.4 4,-0.5 2,-0.2 -2,-0.2 0.910 113.2 50.7 -63.4 -41.6 5.6 9.3 -7.5 129 128 A A H ><>S+ 0 0 0 -4,-3.0 5,-2.5 1,-0.2 3,-1.4 0.937 109.8 48.1 -63.1 -46.4 8.7 11.4 -8.4 130 129 A E H ><5S+ 0 0 49 -4,-2.8 3,-1.4 1,-0.3 -1,-0.2 0.837 104.4 60.7 -66.0 -28.7 9.5 12.4 -4.9 131 130 A S T 3<5S+ 0 0 57 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.658 107.4 48.0 -71.2 -12.5 9.1 8.8 -3.7 132 131 A R T < 5S- 0 0 113 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.260 126.5 -96.9-109.2 8.5 11.9 8.0 -6.2 133 132 A G T < 5S+ 0 0 10 -3,-1.4 15,-2.1 1,-0.3 -3,-0.2 0.650 89.4 110.5 86.5 14.7 14.3 10.8 -5.1 134 133 A F E < -K 147 0D 11 -5,-2.5 -1,-0.3 13,-0.2 2,-0.3 -0.642 49.7-152.7-114.7 172.0 13.3 13.2 -7.8 135 134 A V E -K 146 0D 27 11,-2.2 11,-2.6 -2,-0.2 2,-0.4 -0.949 6.9-148.7-139.1 158.8 11.4 16.5 -7.9 136 135 A I E +K 145 0D 6 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.983 25.1 145.7-132.4 146.3 9.4 18.2 -10.7 137 136 A F E -K 144 0D 42 7,-1.3 7,-2.3 -2,-0.4 2,-0.4 -0.956 41.3-104.1-164.6 166.3 8.8 21.9 -11.5 138 137 A Y E +K 143 0D 94 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.805 38.0 159.5-103.9 141.2 8.2 24.0 -14.6 139 138 A S E > -K 142 0D 6 3,-2.5 3,-1.6 -2,-0.4 2,-0.6 -0.905 58.9 -31.4-158.9 131.6 10.8 26.4 -16.2 140 139 A G T 3 S- 0 0 18 -2,-0.3 3,-0.0 1,-0.2 -2,-0.0 -0.458 127.7 -3.5 69.2-109.5 11.0 27.9 -19.6 141 140 A Y T 3 S- 0 0 127 -2,-0.6 2,-0.3 2,-0.1 -1,-0.2 0.546 125.9 -0.9 -97.0 -10.3 9.6 25.5 -22.2 142 141 A S E < S- K 0 139D 2 -3,-1.6 -3,-2.5 -26,-0.1 2,-0.2 -0.933 76.9 -74.8-162.2-179.7 8.6 22.5 -20.1 143 142 A W E -JK 115 138D 49 -28,-2.5 -28,-1.9 -2,-0.3 2,-0.4 -0.509 43.9-143.5 -83.2 163.1 8.4 20.6 -16.9 144 143 A H E -JK 114 137D 3 -7,-2.3 -7,-1.3 -30,-0.2 2,-0.7 -0.999 10.1-154.6-136.1 131.2 11.7 19.1 -15.5 145 144 A L E +JK 113 136D 0 -32,-3.0 -32,-2.1 -2,-0.4 2,-0.3 -0.943 33.4 178.8-106.0 108.2 12.2 15.9 -13.7 146 145 A M E - K 0 135D 0 -11,-2.6 -11,-2.2 -2,-0.7 2,-0.2 -0.771 34.8-109.1-115.0 156.3 15.3 16.5 -11.6 147 146 A N E > - K 0 134D 33 -36,-0.4 3,-2.3 -2,-0.3 -13,-0.2 -0.571 56.8 -89.5 -76.3 143.7 17.4 14.6 -9.2 148 147 A R T 3 S+ 0 0 37 -15,-2.1 -1,-0.1 1,-0.3 3,-0.1 -0.364 116.5 20.6 -57.6 128.8 17.0 16.0 -5.7 149 148 A G T 3 S+ 0 0 7 1,-0.2 2,-1.5 -2,-0.1 -1,-0.3 0.371 85.8 122.3 93.7 -4.7 19.6 18.8 -5.2 150 149 A E < + 0 0 3 -3,-2.3 2,-0.2 4,-0.1 -81,-0.2 -0.689 52.0 109.5 -92.0 84.0 20.2 19.3 -8.9 151 150 A D S > S- 0 0 23 -2,-1.5 4,-1.8 -83,-0.2 3,-0.2 -0.774 86.3 -74.4-145.8-172.7 19.3 23.0 -8.9 152 151 A K H > S+ 0 0 5 26,-0.3 4,-2.5 1,-0.2 5,-0.2 0.776 123.2 58.2 -65.5 -26.6 20.4 26.6 -9.1 153 152 A A H > S+ 0 0 12 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.909 104.6 51.4 -68.6 -41.4 22.0 26.5 -5.7 154 153 A F H > S+ 0 0 29 -3,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.940 112.7 46.5 -58.7 -45.8 24.2 23.6 -6.8 155 154 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 -88,-0.3 -2,-0.2 0.916 112.3 48.0 -64.2 -44.8 25.3 25.7 -9.8 156 155 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.903 111.4 50.5 -65.7 -40.0 26.0 28.9 -7.9 157 156 A N H X S+ 0 0 13 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.891 109.3 52.7 -64.2 -35.5 28.0 27.0 -5.3 158 157 A K H X S+ 0 0 35 -4,-1.9 4,-2.8 -5,-0.2 -2,-0.2 0.912 109.4 48.0 -65.2 -42.0 30.0 25.4 -8.1 159 158 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.908 108.2 55.9 -63.5 -40.8 30.7 28.9 -9.6 160 159 A K H <>S+ 0 0 31 -4,-2.4 5,-2.2 1,-0.2 4,-0.5 0.924 112.2 42.3 -57.1 -46.0 31.8 30.1 -6.2 161 160 A E H ><5S+ 0 0 76 -4,-2.1 3,-1.2 3,-0.2 -2,-0.2 0.947 112.0 53.8 -66.6 -48.5 34.3 27.3 -5.9 162 161 A M H 3<5S+ 0 0 75 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.851 119.2 33.8 -54.6 -39.1 35.5 27.7 -9.5 163 162 A Y T 3<5S- 0 0 64 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.355 104.9-124.9-100.6 5.8 36.2 31.4 -9.1 164 163 A S T < 5 + 0 0 102 -3,-1.2 2,-0.2 -4,-0.5 -3,-0.2 0.934 57.6 156.6 48.8 54.3 37.3 31.1 -5.4 165 164 A L < - 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0 0 8 -5,-2.3 2,-0.3 -6,-0.2 -1,-0.2 -0.599 46.0-122.4-105.8 164.3 36.5 19.2 2.8 392 165 B E > - 0 0 102 -2,-0.2 3,-2.2 1,-0.1 4,-0.2 -0.743 34.1-112.9 -97.5 152.3 34.9 17.9 -0.4 393 166 B Y G > S+ 0 0 27 -2,-0.3 3,-1.9 1,-0.3 21,-0.6 0.854 116.7 61.9 -54.4 -36.2 31.2 17.2 -0.2 394 167 B D G 3 S+ 0 0 47 1,-0.3 -1,-0.3 19,-0.2 19,-0.1 0.589 96.6 60.5 -67.3 -10.0 31.8 13.5 -0.7 395 168 B E G < S+ 0 0 25 -3,-2.2 -165,-2.9 -166,-0.1 -164,-1.7 0.367 93.5 82.5 -97.3 3.3 33.8 13.6 2.6 396 169 B I E < -m 231 0E 0 -3,-1.9 18,-3.0 -167,-0.2 2,-0.5 -0.924 59.6-163.6-114.9 132.5 30.7 14.7 4.5 397 170 B L E -mq 232 414E 0 -166,-2.9 -164,-2.8 -2,-0.4 2,-0.4 -0.944 7.6-161.9-111.6 131.0 28.0 12.5 5.9 398 171 B V E -mq 233 415E 0 16,-2.5 18,-2.2 -2,-0.5 2,-0.4 -0.924 2.8-165.2-114.5 141.8 24.6 14.0 6.9 399 172 B I E +mq 234 416E 0 -166,-2.2 -164,-2.5 -2,-0.4 2,-0.3 -0.993 27.2 136.7-127.4 122.4 22.1 12.3 9.1 400 173 B G - 0 0 0 16,-1.3 21,-0.1 -2,-0.4 -162,-0.1 -0.936 31.2-169.0-154.4 175.1 18.6 13.6 9.4 401 174 B D + 0 0 21 -2,-0.3 21,-2.1 -164,-0.2 2,-0.2 0.530 60.0 64.1-147.9 -20.1 14.9 12.5 9.4 402 175 B S S >> S- 0 0 24 -165,-0.2 3,-2.2 19,-0.2 4,-0.7 -0.616 86.0 -96.7-114.5 173.8 12.4 15.4 9.1 403 176 B N G >4 S+ 0 0 125 1,-0.3 3,-1.0 2,-0.2 -1,-0.0 0.843 120.8 57.6 -57.4 -35.6 11.4 18.0 6.5 404 177 B N G 34 S+ 0 0 24 1,-0.2 -26,-0.4 -40,-0.2 -1,-0.3 0.483 102.8 57.1 -75.8 1.0 13.6 20.7 8.1 405 178 B D G X> S+ 0 0 0 -3,-2.2 3,-1.6 1,-0.1 4,-0.9 0.587 80.9 88.7-100.4 -15.9 16.6 18.4 7.6 406 179 B M H 4 S+ 0 0 25 0, 0.0 3,-1.0 0, 0.0 -1,-0.3 0.895 98.2 49.8 -53.4 -36.5 18.2 21.1 3.2 408 181 B M H X4 S+ 0 0 0 -3,-1.6 3,-1.3 1,-0.2 5,-0.4 0.862 106.5 55.6 -66.9 -35.8 21.2 19.0 4.1 409 182 B F H 3< S+ 0 0 0 -4,-0.9 -1,-0.2 -3,-0.4 -3,-0.1 0.468 95.6 66.7 -77.7 -1.8 20.0 16.2 1.8 410 183 B Q T << S+ 0 0 65 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.434 86.5 87.3 -96.4 0.3 20.0 18.7 -1.1 411 184 B L S < S- 0 0 15 -3,-1.3 2,-1.2 -4,-0.1 -261,-0.1 -0.605 96.2-106.0 -93.5 158.7 23.8 19.0 -1.0 412 185 B P S S+ 0 0 49 0, 0.0 -16,-0.1 0, 0.0 2,-0.1 -0.058 81.3 122.4 -76.7 39.1 26.1 16.6 -2.9 413 186 B V S S- 0 0 8 -2,-1.2 2,-0.3 -5,-0.4 -19,-0.2 -0.316 74.8 -87.2 -94.0 176.6 27.0 14.9 0.4 414 187 B R E -q 397 0E 69 -18,-3.0 -16,-2.5 -21,-0.6 2,-0.4 -0.679 51.8-153.1 -82.4 140.8 26.8 11.4 1.6 415 188 B K E +q 398 0E 22 -2,-0.3 15,-2.1 -18,-0.2 16,-1.5 -0.957 23.3 162.4-128.9 137.7 23.3 10.8 3.1 416 189 B A E +qr 399 431E 0 -18,-2.2 -16,-1.3 -2,-0.4 16,-0.2 -0.979 7.2 178.2-146.4 156.6 21.8 8.5 5.8 417 190 B C E - r 0 432E 0 14,-1.6 16,-2.8 -2,-0.3 -16,-0.1 -0.979 32.0 -93.5-155.3 163.4 18.7 8.4 7.9 418 191 B P > - 0 0 0 0, 0.0 3,-1.7 0, 0.0 18,-0.3 -0.323 45.2-103.8 -76.1 165.9 16.8 6.4 10.5 419 192 B A T 3 S+ 0 0 36 16,-2.9 17,-0.2 1,-0.3 15,-0.1 0.753 120.4 52.2 -61.8 -25.1 14.1 3.8 9.5 420 193 B N T 3 S+ 0 0 65 15,-0.2 -1,-0.3 -182,-0.1 3,-0.1 0.139 80.5 124.2-101.0 21.7 11.3 6.3 10.5 421 194 B A S < S- 0 0 6 -3,-1.7 -19,-0.2 1,-0.2 -20,-0.1 -0.265 75.6 -75.9 -71.2 167.2 12.6 9.2 8.5 422 195 B T > - 0 0 53 -21,-2.1 4,-2.6 1,-0.1 5,-0.2 -0.206 40.4-113.9 -62.2 157.2 10.2 10.9 6.1 423 196 B D H > S+ 0 0 122 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.895 118.0 52.5 -60.1 -38.1 9.5 9.0 2.8 424 197 B N H > S+ 0 0 45 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.885 110.1 46.6 -67.0 -37.7 11.2 11.9 0.9 425 198 B I H >> S+ 0 0 0 -24,-0.2 4,-0.9 2,-0.2 3,-0.9 0.924 112.3 50.6 -69.2 -43.3 14.4 11.7 3.1 426 199 B K H >< S+ 0 0 80 -4,-2.6 3,-0.8 1,-0.2 -2,-0.2 0.913 105.5 58.1 -59.1 -41.5 14.5 7.9 2.7 427 200 B A H 3< S+ 0 0 34 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.701 112.9 37.7 -64.2 -21.3 14.2 8.3 -1.0 428 201 B V H << S+ 0 0 20 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.458 93.3 107.9-109.7 -1.8 17.3 10.4 -1.3 429 202 B S << - 0 0 19 -4,-0.9 -13,-0.2 -3,-0.8 3,-0.2 -0.454 61.6-146.3 -78.3 148.2 19.5 8.7 1.3 430 203 B D S S+ 0 0 96 -15,-2.1 2,-0.4 1,-0.3 -14,-0.2 0.790 93.1 23.0 -79.5 -30.1 22.5 6.6 0.4 431 204 B F E -r 416 0E 36 -16,-1.5 -14,-1.6 -13,-0.0 2,-0.6 -0.974 66.0-164.5-141.6 123.3 21.7 4.4 3.4 432 205 B V E -r 417 0E 50 -2,-0.4 -13,-0.1 -16,-0.2 -16,-0.0 -0.939 26.1-133.9-107.0 114.2 18.4 3.9 5.2 433 206 B S - 0 0 3 -16,-2.8 7,-0.1 -2,-0.6 8,-0.0 -0.180 8.2-135.1 -64.7 158.2 18.9 2.3 8.6 434 207 B D S S+ 0 0 113 5,-0.1 2,-0.2 6,-0.1 -1,-0.1 0.577 88.1 59.8 -86.1 -11.3 16.8 -0.6 9.9 435 208 B Y - 0 0 123 4,-0.1 -16,-2.9 5,-0.1 -15,-0.2 -0.659 59.8-174.3-117.9 172.3 16.6 1.3 13.2 436 209 B S > + 0 0 17 -18,-0.3 3,-2.0 -2,-0.2 -197,-0.1 -0.760 55.2 60.1-145.4-172.9 15.5 4.5 14.7 437 210 B Y T 3 S- 0 0 83 -199,-0.4 -186,-0.2 1,-0.3 -198,-0.1 0.803 131.1 -44.5 52.4 38.5 15.5 6.5 17.9 438 211 B G T >> S+ 0 0 0 -199,-0.4 3,-1.0 -200,-0.2 4,-0.5 0.040 123.9 96.9 98.7 -26.6 19.2 6.6 18.2 439 212 B E H <> S+ 0 0 101 -3,-2.0 4,-0.9 1,-0.2 3,-0.2 0.693 74.5 66.8 -69.1 -18.2 19.8 3.0 17.3 440 213 B E H 3> S+ 0 0 0 -201,-0.2 4,-2.8 1,-0.2 5,-0.3 0.774 83.7 72.8 -74.5 -25.0 20.4 4.0 13.7 441 214 B I H <> S+ 0 0 0 -3,-1.0 4,-2.8 -202,-0.3 5,-0.2 0.935 97.8 45.6 -57.7 -49.8 23.7 5.8 14.5 442 215 B G H X S+ 0 0 10 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.924 115.1 46.8 -59.6 -46.3 25.7 2.7 15.1 443 216 B Q H X S+ 0 0 41 -4,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.903 112.9 49.5 -64.0 -42.0 24.4 0.9 12.0 444 217 B I H X S+ 0 0 0 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.941 112.5 47.4 -61.8 -47.7 25.0 4.0 9.8 445 218 B F H <>S+ 0 0 0 -4,-2.8 5,-3.3 -5,-0.3 6,-0.5 0.906 111.6 50.6 -61.0 -41.9 28.5 4.4 11.1 446 219 B K H ><5S+ 0 0 150 -4,-2.6 3,-1.6 3,-0.2 -1,-0.2 0.899 106.8 56.0 -62.2 -40.5 29.3 0.7 10.6 447 220 B H H 3<5S+ 0 0 95 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.862 110.7 42.7 -60.2 -38.4 28.0 0.9 7.1 448 221 B F T 3<5S- 0 0 22 -4,-1.7 -219,-0.3 -3,-0.1 -1,-0.3 0.161 118.3-111.1 -94.9 18.4 30.4 3.7 6.2 449 222 B E T < 5S+ 0 0 179 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.875 78.2 131.3 54.9 45.2 33.2 2.0 8.0 450 223 B L < 0 0 22 -5,-3.3 -187,-0.3 -6,-0.1 -189,-0.2 0.475 360.0 360.0-104.0 -4.7 33.4 4.6 10.7 451 224 B M 0 0 69 -6,-0.5 -193,-0.0 -5,-0.1 -197,-0.0 -0.632 360.0 360.0-126.6 360.0 33.4 2.3 13.8