==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 23-NOV-11 3USE . COMPND 2 MOLECULE: HYDROGENASE-1 SMALL CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.VOLBEDA,J.C.FONTECILLA-CAMPS,C.DARNAULT . 1698 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48024.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1165 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 180 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 14 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 . 4 0.2 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 . 86 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 234 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 494 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 39 2.3 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 6 6 6 6 0 2 1 7 0 1 7 0 2 0 0 0 2 2 0 0 0 2 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 8 0 0 2 4 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 PARALLEL BRIDGES PER LADDER . 29 4 4 4 2 0 4 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 8 6 4 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 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 4 S K 0 0 242 0, 0.0 443,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 159.7 1.9 -29.5 -7.7 2 5 S P - 0 0 97 0, 0.0 2,-0.3 0, 0.0 36,-0.0 -0.247 360.0-129.5 -56.6 149.5 1.1 -28.8 -11.4 3 6 S R - 0 0 35 34,-0.1 34,-0.2 1,-0.1 33,-0.1 -0.698 29.6 -90.5-102.8 152.8 -1.2 -25.8 -12.0 4 7 S I E -a 37 0A 63 32,-0.6 34,-3.0 -2,-0.3 2,-0.2 -0.436 44.7-118.7 -64.6 125.4 -4.3 -25.8 -14.2 5 8 S P E -a 38 0A 12 0, 0.0 64,-2.4 0, 0.0 2,-0.4 -0.461 32.2-170.6 -66.3 135.4 -3.4 -24.8 -17.8 6 9 S V E -ab 39 69A 14 32,-2.7 34,-2.4 62,-0.2 35,-0.9 -0.996 11.8-164.4-130.5 128.5 -5.2 -21.7 -19.0 7 10 S V E -ab 41 70A 0 62,-2.7 64,-3.3 -2,-0.4 2,-0.6 -0.965 9.4-165.8-109.7 122.2 -5.3 -20.4 -22.6 8 11 S W E -ab 42 71A 5 33,-2.6 35,-0.6 -2,-0.5 2,-0.3 -0.936 10.5-178.9-112.8 114.7 -6.5 -16.8 -22.8 9 12 S I E - b 0 72A 0 62,-2.7 64,-2.3 -2,-0.6 2,-0.4 -0.755 14.7-144.3-114.0 162.5 -7.4 -15.5 -26.3 10 13 S H E + b 0 73A 7 -2,-0.3 64,-0.2 62,-0.2 3,-0.1 -0.983 18.5 170.3-131.0 122.9 -8.7 -12.2 -27.6 11 14 S G - 0 0 0 62,-2.6 2,-0.5 -2,-0.4 63,-0.1 0.181 69.1 -22.7 -95.2-138.8 -11.2 -11.4 -30.3 12 15 S L B S+E 75 0B 0 63,-2.8 63,-1.5 73,-0.1 -1,-0.3 -0.684 94.5 129.1 -70.4 120.7 -12.6 -7.9 -31.0 13 16 S E - 0 0 5 -2,-0.5 -3,-0.0 61,-0.2 60,-0.0 -0.937 65.7-128.5-160.8 173.0 -12.1 -6.1 -27.7 14 17 S C - 0 0 6 -2,-0.3 331,-2.8 330,-0.1 332,-0.5 0.388 51.6-119.2-110.9 -5.1 -10.7 -3.1 -25.9 15 18 S T S > S+ 0 0 3 329,-0.2 4,-2.3 330,-0.2 5,-0.2 0.485 74.5 129.9 82.5 6.7 -8.7 -5.1 -23.4 16 19 S C H > S+ 0 0 7 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.829 70.9 55.2 -60.4 -32.1 -10.6 -3.7 -20.4 17 20 S C H > S+ 0 0 6 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.911 107.9 46.8 -70.1 -42.5 -11.2 -7.2 -19.1 18 21 S T H > S+ 0 0 4 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.911 114.6 49.1 -61.1 -41.3 -7.5 -8.1 -19.1 19 22 S E H X S+ 0 0 13 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.924 108.7 51.5 -67.6 -42.2 -6.8 -4.8 -17.4 20 23 S S H >< S+ 0 0 0 -4,-2.8 3,-1.3 1,-0.2 4,-0.3 0.936 105.3 57.7 -57.4 -45.6 -9.4 -5.4 -14.8 21 24 S F H >< S+ 0 0 2 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.911 104.5 50.1 -51.4 -47.9 -7.9 -8.9 -14.1 22 25 S I H 3< S+ 0 0 7 -4,-1.7 7,-0.3 1,-0.3 -1,-0.3 0.640 98.9 67.5 -73.9 -9.9 -4.5 -7.3 -13.2 23 26 S R T << S+ 0 0 4 -3,-1.3 -1,-0.3 -4,-0.8 -2,-0.2 0.545 71.9 134.5 -76.7 -8.0 -6.1 -4.9 -10.8 24 27 S S < > - 0 0 1 -3,-1.8 5,-0.7 -4,-0.3 458,-0.1 -0.153 39.2-167.5 -50.1 132.7 -7.0 -7.8 -8.5 25 28 S A B 5 +F 28 0C 9 1,-0.3 3,-0.3 3,-0.2 -1,-0.1 0.751 69.6 51.3 -89.9 -29.1 -6.3 -7.0 -4.9 26 29 S H T 5S+ 0 0 4 1,-0.6 -1,-0.3 2,-0.0 1352,-0.2 -0.799 121.1 16.1-164.0 111.8 -6.7 -10.5 -3.5 27 30 S P T 5S- 0 0 21 0, 0.0 -1,-0.6 0, 0.0 127,-0.1 0.627 101.4-127.4 -68.7 153.1 -5.2 -12.7 -4.7 28 31 S L B >5 -F 25 0C 29 -3,-0.3 4,-2.0 -2,-0.1 3,-0.4 -0.405 17.8-119.0 -61.7 145.6 -2.9 -10.4 -6.6 29 32 S A H > S+ 0 0 43 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.920 106.7 43.9 -49.0 -50.1 0.9 -11.9 -9.7 31 34 S D H >>S+ 0 0 63 -3,-0.4 4,-2.2 2,-0.2 5,-0.9 0.817 109.6 55.9 -72.0 -30.6 0.1 -14.7 -7.3 32 35 S V H X>S+ 0 0 0 -4,-2.0 5,-2.4 3,-0.2 4,-1.4 0.956 114.8 39.8 -61.6 -48.0 -2.7 -16.0 -9.6 33 36 S I H <5S+ 0 0 11 -4,-2.5 6,-0.4 3,-0.2 -2,-0.2 0.871 122.1 40.9 -70.5 -39.0 -0.2 -16.4 -12.4 34 37 S L H <5S+ 0 0 29 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.857 135.2 8.5 -80.3 -31.0 2.7 -17.6 -10.3 35 38 S S H <5S+ 0 0 79 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.655 123.8 45.1-127.2 -26.0 0.9 -20.0 -7.9 36 39 S L T <> -a 8 0A 1 -2,-0.3 4,-2.3 -35,-0.2 3,-1.2 -0.649 32.8-151.8-169.1 104.5 -2.0 -14.7 -23.5 43 46 S D T 34 S+ 0 0 9 -35,-0.6 251,-3.0 1,-0.2 252,-0.5 0.773 95.3 53.7 -53.3 -30.0 -1.3 -12.2 -26.3 44 47 S T T 34 S+ 0 0 12 249,-0.2 -1,-0.2 250,-0.2 249,-0.0 0.769 123.3 20.7 -81.6 -22.8 -1.1 -9.2 -24.0 45 48 S L T <4 S+ 0 0 8 -3,-1.2 -2,-0.2 249,-0.1 -1,-0.1 0.634 91.4 110.5-118.8 -19.9 1.6 -10.6 -21.6 46 49 S M < - 0 0 4 -4,-2.3 404,-0.2 1,-0.1 403,-0.1 -0.256 57.9-141.3 -73.1 147.7 3.5 -13.4 -23.2 47 50 S A S S+ 0 0 1 402,-2.9 246,-0.1 404,-0.1 403,-0.1 0.915 79.7 81.4 -67.5 -45.6 7.1 -13.2 -24.3 48 51 S A - 0 0 0 403,-0.5 2,-0.3 401,-0.3 405,-0.1 -0.348 58.5-178.9 -68.0 140.9 6.7 -15.1 -27.5 49 52 S A >> - 0 0 0 243,-0.1 3,-1.4 244,-0.1 4,-1.0 -0.855 47.5 -7.1-127.9 169.2 5.4 -13.4 -30.7 50 53 S G H 3> S+ 0 0 0 241,-3.3 4,-2.4 -2,-0.3 3,-0.2 -0.132 132.6 1.2 51.5-128.4 4.6 -14.5 -34.3 51 54 S T H 3> S+ 0 0 59 237,-0.4 4,-2.2 1,-0.2 -1,-0.3 0.846 134.9 55.2 -65.4 -33.6 5.6 -18.0 -35.1 52 55 S Q H <> S+ 0 0 18 -3,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.912 109.5 47.6 -63.4 -40.3 6.9 -18.5 -31.6 53 56 S A H X S+ 0 0 0 -4,-1.0 4,-2.3 1,-0.2 -2,-0.2 0.890 110.2 52.1 -67.3 -40.3 3.5 -17.5 -30.2 54 57 S E H X S+ 0 0 78 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.882 108.2 52.4 -59.2 -41.1 1.8 -19.9 -32.7 55 58 S E H X S+ 0 0 92 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.900 108.8 49.2 -64.2 -40.1 4.0 -22.7 -31.5 56 59 S V H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.954 112.0 48.7 -62.3 -49.4 3.0 -22.1 -27.9 57 60 S F H X S+ 0 0 18 -4,-2.3 4,-2.4 1,-0.2 5,-0.3 0.939 115.4 43.8 -55.4 -52.1 -0.7 -22.1 -28.8 58 61 S E H X S+ 0 0 81 -4,-2.6 4,-1.6 1,-0.2 5,-0.2 0.905 114.4 49.0 -61.5 -46.1 -0.4 -25.3 -30.8 59 62 S D H X S+ 0 0 72 -4,-2.7 4,-3.0 -5,-0.2 5,-0.3 0.913 113.6 46.5 -62.8 -42.8 1.8 -27.1 -28.2 60 63 S I H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.941 113.0 45.8 -69.0 -49.5 -0.5 -26.2 -25.3 61 64 S I H < S+ 0 0 6 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.809 119.4 44.4 -65.3 -25.8 -3.9 -27.1 -26.9 62 65 S T H >< S+ 0 0 80 -4,-1.6 3,-1.5 -5,-0.3 -2,-0.2 0.963 116.2 42.5 -78.1 -58.0 -2.3 -30.4 -28.1 63 66 S Q H 3< S+ 0 0 114 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.852 126.3 34.6 -57.3 -38.8 -0.5 -31.4 -24.9 64 67 S Y T >X S+ 0 0 52 -4,-2.4 3,-3.1 -5,-0.3 4,-0.8 0.074 81.0 160.4-108.3 22.7 -3.4 -30.5 -22.7 65 68 S N T <4 S+ 0 0 106 -3,-1.5 38,-0.1 1,-0.3 -3,-0.1 -0.206 75.8 9.0 -46.2 125.0 -6.2 -31.4 -25.0 66 69 S G T 34 S+ 0 0 43 36,-2.9 -1,-0.3 -5,-0.1 37,-0.1 0.314 122.9 73.0 86.0 -6.0 -9.4 -31.8 -22.9 67 70 S K T <4 S+ 0 0 148 -3,-3.1 2,-0.3 35,-0.2 -2,-0.2 0.459 72.6 85.6-124.3 -7.6 -7.6 -30.4 -19.8 68 71 S Y E < - c 0 103A 0 -4,-0.8 36,-3.0 34,-0.6 37,-0.7 -0.697 68.3-126.9 -99.4 153.6 -7.2 -26.7 -20.2 69 72 S I E -bc 6 105A 25 -64,-2.4 -62,-2.7 -2,-0.3 2,-0.6 -0.832 21.2-143.1 -89.9 132.7 -9.6 -23.8 -19.4 70 73 S L E -bc 7 106A 0 35,-2.5 37,-3.0 -2,-0.5 2,-0.5 -0.901 12.5-164.7 -97.5 118.7 -10.2 -21.4 -22.3 71 74 S A E -bc 8 107A 2 -64,-3.3 -62,-2.7 -2,-0.6 2,-0.5 -0.880 8.5-164.2 -97.7 131.7 -10.6 -17.8 -21.3 72 75 S V E -bc 9 108A 0 35,-3.1 37,-2.1 -2,-0.5 2,-0.4 -0.980 12.2-177.5-122.8 129.5 -12.1 -15.6 -23.9 73 76 S E E +bc 10 109A 2 -64,-2.3 -62,-2.6 -2,-0.5 37,-0.1 -0.939 61.3 3.0-119.6 136.3 -12.0 -11.8 -24.0 74 77 S G S S- 0 0 0 35,-0.5 -61,-0.2 -2,-0.4 57,-0.2 -0.243 82.5 -95.9 82.6-169.2 -13.8 -10.0 -26.9 75 78 S N B -E 12 0B 0 -63,-1.5 -63,-2.8 41,-0.1 38,-0.1 -0.952 24.3 -97.5-148.1 161.3 -15.8 -11.6 -29.6 76 79 S P - 0 0 0 0, 0.0 53,-2.2 0, 0.0 2,-0.4 -0.685 29.2-142.1 -82.1 132.5 -15.8 -12.9 -33.3 77 80 S P B -G 128 0D 1 0, 0.0 51,-0.3 0, 0.0 16,-0.2 -0.809 6.7-163.1 -88.4 134.8 -17.0 -10.7 -36.1 78 81 S L > + 0 0 81 49,-2.1 3,-0.5 -2,-0.4 4,-0.2 0.612 59.0 100.4 -89.5 -14.5 -18.9 -12.6 -38.8 79 82 S G G > >S+ 0 0 3 47,-2.5 3,-1.6 1,-0.2 5,-0.8 -0.285 80.5 20.2 -70.4 157.5 -18.7 -9.8 -41.4 80 83 S E G > 5S- 0 0 71 1,-0.3 3,-2.4 2,-0.2 -1,-0.2 0.874 135.5 -61.3 51.4 43.6 -16.2 -9.8 -44.2 81 84 S Q G < 5S- 0 0 134 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.2 0.754 98.4 -59.0 55.8 29.8 -15.7 -13.6 -43.9 82 85 S G G X 5S+ 0 0 3 -3,-1.6 3,-1.4 -4,-0.2 10,-0.7 0.453 107.7 125.7 83.4 3.4 -14.5 -13.0 -40.3 83 86 S M T < 5 + 0 0 0 -3,-2.4 3,-0.2 1,-0.3 -3,-0.1 0.379 46.7 86.6 -86.1 8.3 -11.6 -10.7 -41.5 84 87 S F T 3 S-I 90 0F 7 3,-3.2 3,-1.6 -2,-0.5 8,-0.1 -0.988 76.6 -13.2-128.5 120.9 -5.0 -13.8 -36.3 88 91 S S T 3 S- 0 0 30 -2,-0.4 -1,-0.1 1,-0.3 202,-0.1 0.907 129.0 -55.6 54.3 42.4 -2.0 -15.4 -38.0 89 92 S G T 3 S+ 0 0 0 1,-0.2 565,-2.9 564,-0.1 -1,-0.3 0.456 123.0 90.0 77.8 1.1 -3.4 -14.3 -41.3 90 93 S R E < S-I 87 0F 103 -3,-1.6 -3,-3.2 563,-0.2 -1,-0.2 -0.836 89.4 -73.5-129.8 161.0 -6.8 -16.1 -40.8 91 94 S P E >> -I 86 0F 4 0, 0.0 3,-1.6 0, 0.0 4,-0.9 -0.289 37.2-130.3 -56.0 136.2 -10.2 -15.2 -39.2 92 95 S F H >> S+ 0 0 0 -7,-3.0 4,-2.4 -10,-0.7 3,-0.6 0.850 105.4 69.9 -50.7 -39.0 -10.1 -15.0 -35.4 93 96 S I H 3> S+ 0 0 26 -8,-0.3 4,-2.4 -11,-0.3 -1,-0.3 0.820 93.8 55.8 -54.4 -30.8 -13.2 -17.3 -35.4 94 97 S E H <> S+ 0 0 88 -3,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.904 108.6 46.5 -67.7 -39.3 -11.0 -20.2 -36.6 95 98 S K H < S+ 0 0 2 -4,-2.8 3,-0.9 -5,-0.2 -1,-0.2 0.883 99.9 65.2 -64.8 -35.8 -12.7 -24.2 -27.8 101 104 S A H 3< S+ 0 0 67 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.824 109.4 36.0 -58.8 -35.5 -12.5 -27.7 -29.2 102 105 S G H 3< S+ 0 0 3 -4,-0.9 -36,-2.9 -3,-0.5 -34,-0.6 0.489 94.9 109.1 -97.1 -4.6 -9.8 -28.9 -26.7 103 106 S A E << -c 68 0A 0 -3,-0.9 -34,-0.2 -4,-0.6 3,-0.1 -0.412 58.3-151.6 -73.9 146.3 -11.1 -26.8 -23.7 104 107 S S E S- 0 0 52 -36,-3.0 2,-0.3 1,-0.4 -35,-0.2 0.768 84.3 -10.0 -81.2 -30.5 -12.7 -28.5 -20.7 105 108 S A E -c 69 0A 4 -37,-0.7 -35,-2.5 33,-0.1 2,-0.4 -0.970 68.3-128.9-161.3 161.3 -14.7 -25.3 -20.1 106 109 S I E -cd 70 140A 0 33,-2.8 35,-2.8 -2,-0.3 2,-0.6 -0.959 5.2-154.7-122.6 134.0 -14.8 -21.7 -21.3 107 110 S I E -cd 71 141A 4 -37,-3.0 -35,-3.1 -2,-0.4 2,-1.0 -0.950 8.7-157.9-104.2 119.0 -14.8 -18.5 -19.4 108 111 S A E -cd 72 142A 1 33,-3.1 35,-2.7 -2,-0.6 2,-0.3 -0.817 16.6-157.1 -95.7 94.3 -16.4 -15.6 -21.3 109 112 S W E > -cd 73 143A 5 -37,-2.1 4,-1.0 -2,-1.0 -35,-0.5 -0.584 47.9 -8.5 -75.0 131.0 -14.9 -12.6 -19.7 110 113 S G H > S- 0 0 0 33,-2.6 4,-2.2 -2,-0.3 33,-0.3 0.169 92.7 -65.6 80.6 167.7 -16.9 -9.3 -20.0 111 114 S T H >>S+ 0 0 2 34,-1.9 4,-3.0 1,-0.2 5,-2.6 0.814 126.9 62.1 -63.3 -30.8 -19.9 -8.1 -21.8 112 115 S C H 45S+ 0 0 15 33,-0.3 -1,-0.2 3,-0.2 -2,-0.2 0.976 112.6 33.1 -58.3 -56.3 -18.0 -8.5 -25.2 113 116 S A H <5S+ 0 0 1 -4,-1.0 18,-1.9 1,-0.2 19,-0.5 0.856 125.2 45.7 -72.8 -32.3 -17.5 -12.3 -24.8 114 117 S S H <5S- 0 0 0 -4,-2.2 18,-0.2 16,-0.2 -2,-0.2 0.899 138.7 -11.6 -75.0 -42.0 -20.9 -12.7 -23.0 115 118 S W T <5S- 0 0 39 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.1 0.660 96.8 -88.3-136.3 -37.1 -23.2 -10.6 -25.1 116 119 S G >< - 0 0 0 -5,-2.6 4,-0.6 13,-0.2 3,-0.4 -0.131 50.6-164.2 143.8 -43.3 -21.5 -8.3 -27.7 117 120 S C H >> - 0 0 11 -6,-0.4 3,-1.5 1,-0.2 4,-0.5 -0.115 58.9 -16.4 52.4-150.5 -20.8 -5.1 -25.9 118 121 S V H >4 S+ 0 0 2 1,-0.3 3,-1.5 2,-0.2 6,-0.2 0.841 134.0 52.7 -62.6 -40.6 -19.9 -1.9 -27.8 119 122 S Q H 34 S+ 0 0 1 -3,-0.4 7,-0.4 1,-0.3 9,-0.3 0.761 109.0 53.3 -64.2 -24.3 -19.0 -3.3 -31.2 120 123 S A H << S+ 0 0 29 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.504 85.8 110.1 -87.4 -5.3 -22.4 -5.1 -31.2 121 124 S A S X< S- 0 0 2 -3,-1.5 3,-3.1 -4,-0.5 133,-0.0 -0.326 81.5 -30.5 -66.7 154.6 -24.3 -1.9 -30.5 122 125 S R T 3 S+ 0 0 190 1,-0.4 -1,-0.2 2,-0.1 -2,-0.0 -0.160 136.4 13.8 -49.8 132.3 -26.5 -0.5 -33.4 123 126 S P T 3 S- 0 0 79 0, 0.0 -1,-0.4 0, 0.0 4,-0.1 -0.891 83.9-151.1 -97.0 22.1 -25.7 -0.9 -36.3 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11.2-158.9-124.8 120.9 -16.0 20.9 22.3 992 144 T I E -k 958 0X 9 -35,-2.8 -33,-2.7 -2,-0.5 2,-0.5 -0.874 15.3-147.7 -96.9 118.5 -16.2 18.8 19.1 993 145 T K E +k 959 0X 15 31,-2.5 -33,-0.2 -2,-0.6 -31,-0.1 -0.761 18.3 179.5 -90.0 124.9 -18.0 15.4 19.8 994 146 T V E -k 960 0X 0 -35,-2.6 -33,-2.9 -2,-0.5 -30,-0.1 -0.704 22.1-173.1-122.3 75.8 -16.7 12.5 17.7 995 147 T P + 0 0 0 0, 0.0 106,-0.2 0, 0.0 2,-0.2 -0.095 29.1 97.8 -79.2 173.9 -18.9 9.7 19.0 996 148 T G S S- 0 0 0 104,-0.6 -34,-2.1 3,-0.1 -33,-0.3 -0.405 78.3 -84.9 124.3 154.3 -18.8 6.0 18.4 997 149 T C S S- 0 0 4 1,-0.8 103,-0.1 -36,-0.2 104,-0.1 -0.715 126.1 -10.7-126.4 77.8 -17.3 3.1 20.3 998 150 T P S S- 0 0 0 0, 0.0 -1,-0.8 0, 0.0 -130,-0.1 0.737 97.1-123.4 -86.9 174.2 -14.8 3.7 18.8 999 151 T P - 0 0 0 0, 0.0 -3,-0.1 0, 0.0 77,-0.0 -0.263 49.6 -76.7 -61.6 162.9 -15.3 6.2 16.0 1000 152 T I >> - 0 0 1 1,-0.1 4,-2.5 2,-0.1 3,-0.9 -0.460 38.8-129.3 -65.2 132.0 -14.2 5.1 12.5 1001 153 T P H 3> S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 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-512,-2.5 -512,-0.1 2,-0.3 -0.608 41.7-136.6 -77.4 128.8 16.3 -4.8 40.7 1675 556 M K B -Y 1161 0k 124 -2,-0.4 2,-0.5 -514,-0.2 -514,-0.2 -0.651 15.3-155.5 -81.2 134.0 19.3 -2.6 40.5 1676 557 M M - 0 0 1 -516,-2.7 -520,-0.0 -2,-0.3 -2,-0.0 -0.957 10.5-160.1-111.5 131.2 18.7 1.0 39.3 1677 558 M A S S+ 0 0 44 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.911 90.0 16.5 -71.9 -41.7 21.5 3.0 37.7 1678 559 M I S > S- 0 0 51 3,-0.4 3,-2.0 1,-0.1 -1,-0.3 -0.940 70.6-155.4-136.2 104.1 19.8 6.4 38.3 1679 560 M P T 3 S+ 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.815 93.7 56.2 -53.6 -33.9 16.9 6.4 40.9 1680 561 M E T 3 S+ 0 0 103 1,-0.2 -778,-0.1 2,-0.1 0, 0.0 0.621 102.1 61.0 -76.6 -13.1 15.2 9.5 39.3 1681 562 M Q S < S- 0 0 59 -3,-2.0 2,-1.9 -779,-0.1 3,-0.5 -0.897 73.8-159.7-117.9 97.7 15.0 7.8 35.9 1682 563 M P > + 0 0 9 0, 0.0 4,-2.5 0, 0.0 5,-0.2 -0.043 44.5 132.7 -77.0 41.5 12.8 4.6 36.2 1683 564 M L H > S+ 0 0 0 -2,-1.9 4,-2.8 -5,-0.3 5,-0.2 0.903 72.8 49.3 -61.3 -42.1 14.1 2.8 33.1 1684 565 M E H > S+ 0 0 5 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.902 112.2 49.0 -63.0 -40.3 14.6 -0.6 34.8 1685 566 M I H > S+ 0 0 1 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.934 112.6 47.7 -62.4 -47.1 11.2 -0.4 36.4 1686 567 M L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.3 0.901 108.7 55.3 -60.8 -43.1 9.6 0.4 33.0 1687 568 M R H X S+ 0 0 1 -4,-2.8 4,-1.5 -5,-0.2 -1,-0.2 0.949 113.6 39.7 -57.0 -51.1 11.5 -2.4 31.3 1688 569 M T H X S+ 0 0 0 -4,-2.0 4,-0.6 2,-0.2 -2,-0.2 0.947 117.5 46.7 -68.0 -48.0 10.2 -5.0 33.6 1689 570 M L H >< S+ 0 0 0 -4,-2.9 3,-1.8 1,-0.2 4,-0.3 0.964 113.6 49.4 -58.5 -49.6 6.6 -3.7 33.9 1690 571 M H H >< S+ 0 0 0 -4,-3.0 3,-2.5 1,-0.3 -1,-0.2 0.833 95.8 71.9 -59.4 -30.4 6.3 -3.3 30.1 1691 572 M S H 3< S+ 0 0 0 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.736 98.4 49.1 -61.0 -21.4 7.6 -6.8 29.6 1692 573 M F T << S- 0 0 4 -3,-1.8 -1,-0.3 -4,-0.6 -2,-0.2 0.468 108.2-127.6 -88.2 -8.2 4.2 -8.1 30.9 1693 574 M D < - 0 0 1 -3,-2.5 -3,-0.1 -4,-0.3 -2,-0.1 0.989 29.7-141.0 55.0 66.3 2.2 -5.7 28.6 1694 575 M P - 0 0 0 0, 0.0 -547,-1.9 0, 0.0 2,-0.5 -0.373 21.5-171.2 -63.2 132.7 0.1 -4.3 31.4 1695 576 M C B > -x 1147 0j 0 -549,-0.2 4,-2.1 1,-0.1 -547,-0.2 -0.908 4.7-180.0-121.7 98.9 -3.6 -3.6 30.6 1696 577 M L H > S+ 0 0 0 -549,-2.7 4,-1.4 -2,-0.5 5,-0.3 0.806 79.6 55.3 -76.6 -29.4 -5.0 -1.7 33.5 1697 578 M A H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.909 112.3 46.3 -65.1 -42.6 -8.6 -1.4 32.1 1698 579 M C H 4 S+ 0 0 3 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.926 109.0 55.4 -57.3 -47.8 -8.6 -5.2 31.8 1699 580 M S H < S+ 0 0 1 -4,-2.1 -181,-0.4 1,-0.2 -50,-0.2 0.803 123.2 23.5 -60.8 -30.8 -7.2 -5.6 35.3 1700 581 M T H < 0 0 2 -4,-1.4 -526,-0.2 -3,-0.2 -1,-0.2 0.732 360.0 360.0-109.5 -33.0 -9.9 -3.6 37.0 1701 582 M H < 0 0 6 -4,-2.6 -526,-1.8 -5,-0.3 -525,-0.8 0.840 360.0 360.0 38.3 360.0 -12.9 -3.8 34.6