==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-DEC-04 1WUH . COMPND 2 MOLECULE: PERIPLASMIC [NIFE] HYDROGENASE SMALL SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: DESULFOVIBRIO VULGARIS STR. 'MIYAZAKI . AUTHOR H.OGATA,S.HIROTA,A.NAKAHARA,H.KOMORI,N.SHIBATA,T.KATO, . 801 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25179.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 574 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.9 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 . 2 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 . 43 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 247 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.6 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 4 1 1 1 1 2 1 0 3 0 1 0 0 0 1 0 0 0 0 1 0 0 0 1 1 RESIDUES PER ALPHA HELIX . 3 0 2 1 0 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 PARALLEL BRIDGES PER LADDER . 12 3 0 1 1 1 1 1 1 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 . 2 2 3 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 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 1 S L 0 0 8 0, 0.0 433,-2.7 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -36.6 52.0 19.9 78.2 2 2 S M + 0 0 21 430,-0.2 3,-0.1 431,-0.2 66,-0.1 -0.803 360.0 160.2-172.8 150.5 51.8 18.3 74.9 3 3 S G - 0 0 15 1,-0.6 5,-0.1 -2,-0.2 428,-0.1 -0.258 66.2 -23.8-155.5-139.7 51.7 15.1 73.1 4 4 S P S S+ 0 0 82 0, 0.0 2,-0.9 0, 0.0 -1,-0.6 0.142 108.2 49.5 -74.2-150.5 50.4 14.6 69.6 5 5 S R S S+ 0 0 199 -3,-0.1 36,-0.0 2,-0.0 -3,-0.0 -0.493 98.7 43.8 77.8-100.8 48.1 16.9 67.9 6 6 S R S S- 0 0 21 -2,-0.9 34,-0.2 424,-0.1 -3,-0.2 -0.697 91.2-103.0 -90.4 144.7 49.0 20.6 68.2 7 7 S P - 0 0 44 0, 0.0 34,-2.8 0, 0.0 2,-0.3 -0.392 39.7-119.4 -64.3 134.7 52.7 21.6 67.6 8 8 S S E -ab 41 70A 2 61,-0.5 63,-2.9 32,-0.2 2,-0.4 -0.608 26.0-166.0 -82.2 132.6 54.5 22.3 70.9 9 9 S V E -ab 42 71A 7 32,-3.0 34,-2.6 -2,-0.3 35,-0.8 -0.977 6.6-164.5-119.5 129.2 55.9 25.8 71.5 10 10 S V E -ab 44 72A 0 61,-2.8 63,-2.5 -2,-0.4 2,-0.5 -0.982 12.3-162.8-109.6 118.9 58.4 26.5 74.3 11 11 S Y E - b 0 73A 8 33,-2.1 35,-0.4 -2,-0.5 2,-0.3 -0.940 6.3-164.9-110.2 121.8 58.6 30.2 74.9 12 12 S L E - b 0 74A 6 61,-2.4 63,-2.8 -2,-0.5 2,-0.5 -0.856 10.6-151.1-112.7 145.0 61.6 31.5 76.9 13 13 S H E + b 0 75A 7 -2,-0.3 63,-0.2 61,-0.2 3,-0.1 -0.971 25.5 158.4-116.7 115.0 62.2 34.9 78.6 14 14 S N - 0 0 2 61,-2.9 2,-1.1 -2,-0.5 64,-0.2 0.439 69.5 -17.6 -99.2-122.8 65.8 36.1 78.9 15 15 S A B S+E 77 0B 0 62,-2.6 62,-2.0 72,-0.1 2,-0.3 -0.812 99.1 132.4 -89.7 99.0 66.8 39.8 79.4 16 16 S E - 0 0 5 -2,-1.1 -3,-0.0 60,-0.3 59,-0.0 -0.895 64.6-135.7-149.0 166.1 63.5 41.3 78.3 17 17 S C - 0 0 17 -2,-0.3 315,-3.1 314,-0.1 316,-0.6 0.376 49.4-117.7-107.5 -4.2 60.8 43.8 79.1 18 18 S T S > S+ 0 0 1 313,-0.2 4,-2.5 314,-0.2 5,-0.2 0.408 84.1 118.7 78.1 2.5 57.9 41.5 78.3 19 19 S G H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.844 72.1 53.5 -64.1 -32.5 56.8 43.9 75.5 20 20 S C H > S+ 0 0 16 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.945 108.4 48.5 -69.6 -42.6 57.3 41.1 73.0 21 21 S S H > S+ 0 0 4 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.934 110.7 52.2 -59.0 -44.1 55.1 38.8 74.9 22 22 S E H X S+ 0 0 8 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.911 104.1 57.1 -57.6 -39.6 52.5 41.6 75.2 23 23 S S H >< S+ 0 0 1 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.904 102.7 54.2 -60.1 -36.5 52.7 42.0 71.4 24 24 S V H >< S+ 0 0 22 -4,-1.8 3,-2.0 1,-0.3 -1,-0.2 0.886 100.9 60.0 -64.6 -34.5 51.7 38.4 70.9 25 25 S L H 3< S+ 0 0 16 -4,-1.5 7,-0.4 1,-0.3 -1,-0.3 0.746 96.4 62.9 -64.2 -20.6 48.6 38.9 73.1 26 26 S R T << S+ 0 0 8 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.433 74.2 143.6 -85.0 5.0 47.6 41.5 70.5 27 27 S A < > - 0 0 2 -3,-2.0 5,-0.6 -4,-0.1 2,-0.4 -0.111 33.8-160.0 -48.5 137.4 47.3 38.9 67.8 28 28 S F T 5 + 0 0 74 3,-0.2 3,-0.2 1,-0.2 -1,-0.1 -0.989 59.1 15.2-129.8 121.0 44.4 39.6 65.4 29 29 S E T 5S+ 0 0 141 -2,-0.4 -1,-0.2 0, 0.0 2,-0.1 0.906 135.4 40.8 48.5 68.9 42.7 37.1 63.1 30 30 S P T 5S- 0 0 46 0, 0.0 2,-0.1 0, 0.0 128,-0.1 0.257 100.5-159.9 -84.6 149.1 43.9 34.8 64.5 31 31 S Y T >5 - 0 0 37 -3,-0.2 4,-2.2 -2,-0.1 -3,-0.2 -0.358 33.6-100.0 -80.0 168.6 43.5 36.0 68.0 32 32 S I H > S+ 0 0 26 2,-0.2 4,-2.2 1,-0.2 5,-0.4 0.941 108.7 46.2 -65.2 -42.0 42.8 32.3 72.1 34 34 S T H >>S+ 0 0 38 1,-0.2 4,-2.6 2,-0.2 5,-2.0 0.911 112.1 52.2 -60.6 -41.8 42.6 30.5 68.7 35 35 S L H <>S+ 0 0 9 -4,-2.2 5,-2.5 3,-0.2 -1,-0.2 0.911 115.7 39.1 -59.9 -43.5 46.4 30.3 68.6 36 36 S I H <5S+ 0 0 22 -4,-2.2 6,-0.4 3,-0.2 -1,-0.2 0.757 126.2 35.2 -81.6 -27.6 46.6 28.7 72.1 37 37 S L H <5S+ 0 0 24 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.776 135.0 12.1 -97.0 -32.2 43.5 26.4 71.8 38 38 S D T <5S+ 0 0 75 -4,-2.6 -3,-0.2 -5,-0.4 -2,-0.1 0.768 125.5 39.1-116.2 -43.6 43.6 25.4 68.1 39 39 S T T > - 0 0 15 -2,-0.3 4,-2.4 -35,-0.1 3,-0.9 -0.657 31.8-154.3-166.5 103.3 55.4 30.7 79.0 46 46 S E T 34 S+ 0 0 17 -35,-0.4 236,-2.7 1,-0.3 237,-0.4 0.766 89.2 59.3 -61.1 -26.5 56.4 32.3 82.3 47 47 S T T 34 S+ 0 0 10 234,-0.2 -1,-0.3 235,-0.2 234,-0.0 0.862 123.9 12.9 -70.9 -35.7 54.0 35.2 81.9 48 48 S I T <4 S+ 0 0 16 -3,-0.9 -2,-0.2 234,-0.1 -1,-0.1 0.539 92.2 117.3-122.4 -7.1 50.7 33.3 81.7 49 49 S M < - 0 0 5 -4,-2.4 387,-0.2 1,-0.1 7,-0.1 -0.273 57.5-138.1 -71.7 148.3 51.4 29.7 82.7 50 50 S A S S+ 0 0 2 385,-3.2 390,-0.3 387,-0.1 386,-0.1 0.901 79.1 78.9 -69.1 -42.8 49.6 28.3 85.7 51 51 S A - 0 0 0 386,-0.5 2,-0.3 384,-0.4 388,-0.1 -0.408 58.9-176.4 -73.2 148.4 52.5 26.4 87.2 52 52 S A >> - 0 0 0 386,-0.2 3,-1.3 228,-0.1 4,-0.8 -0.855 46.8 -3.3-132.5 165.6 55.2 28.1 89.2 53 53 S G H >> S- 0 0 1 226,-2.9 4,-2.6 -2,-0.3 3,-0.6 -0.098 130.0 -1.4 60.2-138.2 58.5 27.0 90.8 54 54 S D H 3> S+ 0 0 118 222,-0.4 4,-2.3 1,-0.3 -1,-0.3 0.855 134.6 56.9 -57.3 -36.5 59.4 23.4 90.6 55 55 S A H <> S+ 0 0 21 -3,-1.3 4,-1.8 2,-0.2 -1,-0.3 0.848 107.9 47.3 -67.2 -35.4 56.1 22.6 88.8 56 56 S A H < S+ 0 0 0 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.904 113.6 48.5 -69.8 -45.2 58.1 19.9 76.8 64 64 S V H 3< S+ 0 0 13 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.875 114.3 45.2 -67.1 -35.7 61.7 20.1 75.8 65 65 S N T 3< S+ 0 0 75 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.369 82.0 130.3 -94.0 12.4 62.3 16.4 76.0 66 66 S S X - 0 0 19 -3,-1.0 3,-1.0 1,-0.2 4,-0.1 -0.365 58.8-138.9 -66.7 138.5 59.1 15.3 74.2 67 67 S P T 3 S+ 0 0 129 0, 0.0 -1,-0.2 0, 0.0 -64,-0.1 0.667 101.4 67.9 -68.0 -13.8 59.6 12.9 71.4 68 68 S H T 3 S- 0 0 108 1,-0.1 -60,-0.1 -66,-0.1 -2,-0.1 0.739 105.3-130.1 -78.5 -20.3 57.1 14.9 69.4 69 69 S G < - 0 0 12 -3,-1.0 -61,-0.5 -6,-0.1 2,-0.3 -0.027 18.3-127.1 91.2 159.9 59.5 17.8 69.2 70 70 S F E -b 8 0A 4 34,-0.3 36,-3.1 -6,-0.1 37,-0.7 -0.986 4.6-130.6-145.3 159.3 59.0 21.5 69.9 71 71 S I E -bc 9 107A 7 -63,-2.9 -61,-2.8 -2,-0.3 2,-0.5 -0.888 26.4-142.5-102.6 135.7 59.5 25.0 68.4 72 72 S A E -bc 10 108A 0 35,-2.8 37,-2.9 -2,-0.4 2,-0.5 -0.893 12.8-169.5-102.1 131.9 61.3 27.5 70.6 73 73 S V E -bc 11 109A 2 -63,-2.5 -61,-2.4 -2,-0.5 2,-0.5 -0.996 14.5-161.6-115.0 126.8 60.3 31.2 70.7 74 74 S V E -bc 12 110A 0 35,-2.7 37,-3.0 -2,-0.5 2,-0.4 -0.952 11.0-171.1-120.3 124.9 62.8 33.3 72.5 75 75 S E E +b 13 0A 2 -63,-2.8 -61,-2.9 -2,-0.5 37,-0.1 -0.948 52.8 20.9-111.1 129.8 62.2 36.8 74.0 76 76 S G S S- 0 0 1 35,-0.5 -60,-0.3 -2,-0.4 57,-0.1 0.116 81.9 -76.7 101.4 152.8 65.2 38.8 75.3 77 77 S G B -E 15 0B 0 -62,-2.0 -62,-2.6 41,-0.3 55,-0.2 -0.427 42.4-115.7 -77.6 160.3 68.9 39.0 75.0 78 78 S I E -F 131 0C 0 53,-2.9 53,-1.8 36,-0.2 2,-0.5 -0.881 21.9-140.3 -99.2 115.2 71.2 36.6 76.7 79 79 S P E +F 130 0C 0 0, 0.0 16,-0.4 0, 0.0 51,-0.3 -0.630 28.2 169.2 -75.9 123.2 73.5 38.3 79.3 80 80 S T > + 0 0 34 49,-1.4 3,-0.7 -2,-0.5 4,-0.5 0.580 34.3 109.9-111.6 -11.9 76.9 36.7 79.0 81 81 S A G > >S+ 0 0 28 47,-2.3 3,-1.5 1,-0.2 5,-0.6 -0.249 83.5 17.0 -62.4 155.1 79.2 38.9 81.2 82 82 S A G > 5S- 0 0 63 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.875 138.3 -57.6 48.9 44.8 80.5 37.4 84.4 83 83 S N G < 5S- 0 0 141 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.747 98.4 -61.6 58.4 29.9 79.7 33.9 83.3 84 84 S G G X 5S+ 0 0 0 -3,-1.5 3,-1.5 -4,-0.5 10,-0.5 0.464 95.5 132.9 90.5 4.5 76.0 34.7 82.8 85 85 S I T < 5 + 0 0 28 -3,-1.4 -3,-0.1 -4,-0.4 3,-0.1 0.595 53.1 78.3 -73.4 -10.3 75.1 35.7 86.4 86 86 S Y T 3 S-H 92 0E 9 3,-2.3 3,-2.0 -2,-0.3 189,-0.1 -0.996 87.3 -3.8-131.0 129.4 65.8 31.6 86.2 90 90 S A T 3 S- 0 0 14 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.820 131.2 -63.8 55.7 31.4 65.4 28.8 88.8 91 91 S N T 3 S+ 0 0 66 1,-0.2 2,-0.4 215,-0.0 -1,-0.3 0.660 113.4 116.2 61.9 24.6 69.0 29.7 89.6 92 92 S H E < S-H 89 0E 64 -3,-2.0 -3,-2.3 -8,-0.0 -1,-0.2 -0.943 72.3-109.3-107.9 141.5 70.4 28.7 86.3 93 93 S T E > -H 88 0E 26 -2,-0.4 4,-2.7 -5,-0.2 -5,-0.3 -0.330 20.7-124.5 -67.4 151.9 71.9 31.4 84.1 94 94 S M H > S+ 0 0 0 -7,-2.5 4,-3.0 -10,-0.5 5,-0.3 0.885 112.7 58.2 -61.6 -32.3 69.9 32.3 81.0 95 95 S L H > S+ 0 0 36 -16,-0.4 4,-2.6 -8,-0.4 -1,-0.2 0.944 109.5 43.0 -59.6 -46.8 73.0 31.4 78.9 96 96 S D H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.945 113.9 52.3 -65.6 -48.5 73.1 27.9 80.3 97 97 S I H X S+ 0 0 22 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.954 114.5 40.9 -58.3 -51.8 69.3 27.5 79.9 98 98 S C H X S+ 0 0 0 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.861 112.2 55.6 -68.6 -36.2 69.4 28.6 76.4 99 99 S S H < S+ 0 0 31 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.852 114.2 41.5 -61.2 -33.5 72.5 26.5 75.6 100 100 S R H < S+ 0 0 121 -4,-2.1 -2,-0.2 -5,-0.2 4,-0.2 0.869 123.7 34.1 -81.4 -39.6 70.8 23.4 76.9 101 101 S I H >X S+ 0 0 12 -4,-2.5 3,-1.7 -5,-0.2 4,-0.5 0.896 106.7 59.3 -85.7 -46.0 67.4 23.9 75.4 102 102 S L G >< S+ 0 0 2 -4,-1.9 3,-1.7 -5,-0.3 -3,-0.1 0.887 98.1 58.0 -64.5 -37.2 67.7 25.6 72.0 103 103 S P G 34 S+ 0 0 65 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.724 104.3 56.2 -61.8 -17.5 69.9 23.0 70.3 104 104 S K G <4 S+ 0 0 105 -3,-1.7 -34,-0.3 -4,-0.2 -2,-0.2 0.553 86.6 104.3 -86.1 -10.3 67.1 20.5 71.0 105 105 S A << - 0 0 18 -3,-1.7 -34,-0.2 -4,-0.5 3,-0.1 -0.395 69.6-139.9 -71.9 148.7 64.4 22.6 69.2 106 106 S Q S S- 0 0 131 -36,-3.1 2,-0.3 1,-0.3 -35,-0.2 0.859 92.5 -2.5 -69.5 -34.3 63.1 21.6 65.8 107 107 S A E -c 71 0A 17 -37,-0.7 -35,-2.8 2,-0.0 2,-0.4 -0.979 69.1-148.4-151.1 150.7 63.2 25.4 65.0 108 108 S V E -c 72 0A 13 35,-0.4 37,-2.7 -2,-0.3 2,-0.5 -0.991 5.9-165.9-124.1 132.3 64.0 28.5 67.0 109 109 S I E -cd 73 145A 3 -37,-2.9 -35,-2.7 -2,-0.4 2,-0.7 -0.988 10.7-152.0-116.1 122.9 62.5 31.9 66.5 110 110 S A E -cd 74 146A 0 35,-2.8 37,-3.0 -2,-0.5 2,-0.6 -0.884 20.0-159.1 -89.0 114.0 64.2 34.9 68.1 111 111 S Y E + d 0 147A 0 -37,-3.0 -35,-0.5 -2,-0.7 4,-0.3 -0.917 50.8 9.6-110.8 114.7 61.3 37.3 68.7 112 112 S G S > S- 0 0 0 35,-3.1 4,-2.7 -2,-0.6 3,-0.3 0.129 90.7 -80.4 98.6 152.6 62.1 40.9 69.1 113 113 S T H >>S+ 0 0 3 36,-2.5 4,-2.8 1,-0.2 5,-0.9 0.785 125.6 58.8 -54.4 -33.4 65.3 43.0 68.7 114 114 S C H >5S+ 0 0 19 35,-0.3 4,-1.6 4,-0.2 -1,-0.2 0.963 112.6 37.8 -61.0 -52.9 66.6 41.9 72.0 115 115 S A H 45S+ 0 0 0 -4,-0.3 18,-2.9 -3,-0.3 19,-0.4 0.842 122.8 44.3 -65.8 -35.9 66.5 38.2 71.1 116 116 S T H <5S+ 0 0 7 -4,-2.7 18,-0.3 16,-0.2 19,-0.2 0.937 137.2 0.9 -74.7 -46.0 67.6 38.9 67.6 117 117 S F H <5S- 0 0 40 -4,-2.8 15,-0.5 -5,-0.2 -3,-0.2 0.457 104.4 -90.7-127.6 -6.0 70.4 41.4 68.0 118 118 S G << - 0 0 0 -4,-1.6 3,-0.4 -5,-0.9 4,-0.4 -0.228 59.6-162.9 117.7 -43.8 71.0 42.1 71.7 119 119 S G > - 0 0 9 -6,-0.6 3,-1.4 1,-0.2 4,-0.4 -0.116 48.4 -13.4 66.1-153.2 68.6 45.0 72.1 120 120 S V G > S+ 0 0 2 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.856 132.4 50.1 -64.3 -39.2 68.3 47.6 74.8 121 121 S Q G 3 S+ 0 0 0 -3,-0.4 7,-0.5 1,-0.3 9,-0.4 0.696 106.3 59.7 -73.0 -14.3 70.5 46.0 77.4 122 122 S A G < S+ 0 0 22 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.481 80.8 112.1 -86.4 -4.0 73.2 45.5 74.8 123 123 S A S X S- 0 0 2 -3,-1.5 3,-2.9 -4,-0.4 7,-0.1 -0.351 79.0 -34.7 -67.0 153.1 73.5 49.3 74.1 124 124 S K T 3 S+ 0 0 139 1,-0.3 -1,-0.2 2,-0.1 -2,-0.1 -0.197 133.8 17.7 -52.9 138.4 76.7 50.9 75.2 125 125 S P T 3 S- 0 0 86 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 -0.899 83.4-157.3 -93.5 21.2 78.4 50.2 77.5 126 126 S N X - 0 0 47 -3,-2.9 3,-1.6 -6,-0.2 -2,-0.1 0.927 10.6-173.6 48.4 61.1 76.5 46.9 77.7 127 127 S P T 3 S+ 0 0 30 0, 0.0 -1,-0.1 0, 0.0 183,-0.1 0.800 79.8 45.5 -62.7 -28.7 77.3 46.2 81.4 128 128 S T T 3 S- 0 0 0 -7,-0.5 -47,-2.3 181,-0.3 -48,-0.4 0.382 106.4-120.7 -96.0 6.1 75.7 42.6 81.3 129 129 S G < - 0 0 16 -3,-1.6 -49,-1.4 -49,-0.2 -7,-0.1 0.880 43.6-172.4 55.8 34.8 77.4 41.5 78.0 130 130 S A E +F 79 0C 3 -9,-0.4 2,-0.3 -51,-0.3 -1,-0.2 -0.398 6.0 179.7 -49.9 127.7 74.0 40.9 76.5 131 131 S K E -F 78 0C 77 -53,-1.8 -53,-2.9 -2,-0.1 -13,-0.3 -0.955 31.1-103.4-133.6 152.9 74.0 39.2 73.1 132 132 S G > - 0 0 1 -15,-0.5 4,-2.9 -2,-0.3 -16,-0.2 -0.313 44.2-102.5 -65.7 164.0 71.3 38.1 70.6 133 133 S V H > S+ 0 0 0 -18,-2.9 4,-2.3 1,-0.2 -17,-0.1 0.901 119.0 46.3 -59.1 -49.9 70.6 34.4 70.4 134 134 S N H 4 S+ 0 0 30 -19,-0.4 4,-0.5 -18,-0.3 -1,-0.2 0.854 115.3 47.9 -68.2 -32.4 72.5 33.6 67.3 135 135 S D H >4 S+ 0 0 79 -19,-0.2 3,-0.9 2,-0.2 4,-0.3 0.963 115.1 44.4 -66.3 -54.2 75.5 35.6 68.5 136 136 S A H 3< S+ 0 0 8 -4,-2.9 3,-0.2 1,-0.2 -2,-0.2 0.830 124.2 34.1 -58.9 -35.1 75.5 34.0 71.9 137 137 S L T ><>S+ 0 0 0 -4,-2.3 3,-2.1 -5,-0.2 5,-1.5 0.148 76.6 117.3-115.3 17.1 75.0 30.5 70.7 138 138 S K G X 5S+ 0 0 138 -3,-0.9 3,-1.8 -4,-0.5 -1,-0.2 0.843 75.0 59.4 -46.4 -42.7 76.9 30.5 67.4 139 139 S H G 3 5S+ 0 0 131 1,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.667 103.2 51.1 -71.8 -14.2 79.2 27.8 68.8 140 140 S L G < 5S- 0 0 71 -3,-2.1 -1,-0.3 2,-0.1 -2,-0.2 0.413 115.9-111.7-104.7 6.6 76.3 25.4 69.3 141 141 S G T < 5 + 0 0 54 -3,-1.8 2,-0.4 1,-0.3 -3,-0.2 0.587 59.5 158.3 78.7 10.9 75.0 25.8 65.8 142 142 S V < + 0 0 10 -5,-1.5 2,-0.4 -9,-0.1 -1,-0.3 -0.580 15.2 178.7 -70.2 127.5 71.8 27.6 66.8 143 143 S K - 0 0 171 -2,-0.4 -35,-0.4 2,-0.0 2,-0.2 -0.805 10.4-169.9-132.1 88.3 70.4 29.6 63.8 144 144 S A - 0 0 0 -2,-0.4 2,-0.4 -37,-0.1 -35,-0.2 -0.558 29.0-114.4 -77.0 140.7 67.2 31.3 65.0 145 145 S I E -d 109 0A 11 -37,-2.7 -35,-2.8 -2,-0.2 2,-0.7 -0.649 37.6-135.5 -67.0 126.2 64.8 33.0 62.6 146 146 S N E -d 110 0A 7 31,-2.9 2,-0.8 -2,-0.4 -35,-0.2 -0.805 24.6-177.1 -98.3 115.8 65.1 36.6 63.6 147 147 S I E -d 111 0A 0 -37,-3.0 -35,-3.1 -2,-0.7 -31,-0.2 -0.886 24.2-163.1-108.9 99.2 61.8 38.6 63.8 148 148 S A + 0 0 0 -2,-0.8 5,-0.4 -37,-0.2 105,-0.2 -0.302 34.0 95.6 -89.1 167.3 63.1 42.0 64.7 149 149 S G S S- 0 0 0 103,-0.5 -36,-2.5 3,-0.2 -35,-0.3 -0.472 74.3 -91.3 122.9 163.4 61.3 45.1 66.2 150 150 S C S S- 0 0 10 1,-1.0 103,-0.1 -38,-0.2 102,-0.1 -0.565 128.2 -6.6-133.9 69.8 60.9 46.5 69.6 151 151 S P S S- 0 0 5 0, 0.0 -1,-1.0 0, 0.0 -3,-0.1 0.582 103.4-134.1 -89.5 168.1 58.4 44.9 69.8 152 152 S P - 0 0 1 0, 0.0 -3,-0.2 0, 0.0 -4,-0.0 -0.215 34.9 -87.7 -66.6 167.2 57.8 43.3 66.4 153 153 S N >> - 0 0 8 -5,-0.4 3,-1.8 1,-0.2 4,-0.8 -0.680 32.9-139.6 -69.2 125.4 54.5 43.2 64.7 154 154 S P H 3> S+ 0 0 18 0, 0.0 4,-2.5 0, 0.0 3,-0.3 0.768 99.8 71.8 -66.0 -19.7 52.8 40.1 66.0 155 155 S Y H 3> S+ 0 0 130 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.857 95.8 53.5 -54.1 -34.4 51.6 39.5 62.4 156 156 S N H <> S+ 0 0 0 -3,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.827 107.4 48.1 -76.3 -31.6 55.2 38.7 61.6 157 157 S L H X S+ 0 0 7 -4,-0.8 4,-2.5 -3,-0.3 5,-0.2 0.951 115.1 44.1 -69.6 -51.1 55.5 36.1 64.3 158 158 S V H X S+ 0 0 22 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.928 112.9 52.1 -61.3 -43.4 52.3 34.3 63.4 159 159 S G H X S+ 0 0 22 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.2 0.883 110.3 48.4 -60.7 -35.5 53.0 34.5 59.7 160 160 S T H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.938 112.9 47.1 -68.1 -46.3 56.4 32.9 60.3 161 161 S I H X S+ 0 0 12 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.919 112.5 49.8 -62.5 -45.3 55.0 30.1 62.5 162 162 S V H X S+ 0 0 76 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.920 111.6 48.6 -59.0 -42.8 52.2 29.4 60.0 163 163 S Y H X S+ 0 0 82 -4,-1.9 4,-3.0 -5,-0.3 6,-0.4 0.926 111.6 49.7 -61.1 -47.2 54.7 29.2 57.2 164 164 S Y H X S+ 0 0 48 -4,-2.3 4,-2.0 1,-0.2 5,-0.3 0.897 111.6 48.2 -62.2 -42.3 57.0 26.9 59.1 165 165 S L H < S+ 0 0 53 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.878 116.9 42.6 -67.9 -35.2 54.2 24.6 60.0 166 166 S K H < S+ 0 0 152 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.911 126.9 28.3 -71.4 -47.4 52.9 24.4 56.4 167 167 S N H < S- 0 0 65 -4,-3.0 -3,-0.2 2,-0.3 -2,-0.2 0.539 91.9-131.5-101.0 -9.0 56.2 24.1 54.6 168 168 S K S < S+ 0 0 168 -4,-2.0 2,-0.3 -5,-0.3 -4,-0.2 0.829 80.3 77.7 63.0 27.7 58.4 22.4 57.2 169 169 S A S S- 0 0 47 -6,-0.4 -2,-0.3 -5,-0.3 -1,-0.2 -0.987 88.0 -91.6-158.6 161.6 61.0 25.0 56.6 170 170 S A - 0 0 44 -2,-0.3 3,-0.1 1,-0.1 -9,-0.0 -0.453 45.1-117.0 -68.5 148.8 62.0 28.6 57.2 171 171 S P - 0 0 9 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.196 56.2 -59.4 -72.8 174.1 60.8 31.2 54.7 172 172 S E - 0 0 144 7,-0.1 8,-2.2 1,-0.1 9,-0.5 -0.408 63.6-155.2 -57.0 132.4 63.4 33.1 52.7 173 173 S L B -I 179 0F 50 6,-0.3 -1,-0.1 7,-0.1 -28,-0.0 -0.850 6.6-131.6-116.3 147.4 65.6 35.1 55.1 174 174 S D > - 0 0 35 4,-3.0 3,-2.2 -2,-0.3 -1,-0.1 -0.151 46.6 -82.3 -78.9-175.5 67.7 38.2 54.6 175 175 S S T 3 S+ 0 0 128 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.627 133.2 53.0 -72.6 -8.5 71.3 38.6 55.6 176 176 S L T 3 S- 0 0 54 2,-0.2 -1,-0.3 -30,-0.1 -30,-0.1 0.134 122.1-108.1-102.0 15.5 70.2 39.3 59.2 177 177 S N S < S+ 0 0 46 -3,-2.2 -31,-2.9 1,-0.2 -2,-0.1 0.700 76.0 138.0 64.4 27.8 68.2 36.1 59.2 178 178 S R - 0 0 10 -33,-0.2 -4,-3.0 5,-0.1 -1,-0.2 -0.783 64.7 -97.1 -98.8 141.7 64.8 38.0 59.1 179 179 S P B >> -I 173 0F 0 0, 0.0 4,-2.3 0, 0.0 3,-1.6 -0.408 23.4-147.1 -61.0 125.7 62.0 36.8 56.8 180 180 S T H 3> S+ 0 0 40 -8,-2.2 4,-1.1 1,-0.3 -7,-0.1 0.730 93.9 71.9 -64.2 -21.3 62.1 38.8 53.5 181 181 S M H 34 S+ 0 0 77 -9,-0.5 -1,-0.3 1,-0.2 -8,-0.1 0.729 117.4 18.6 -68.4 -17.1 58.2 38.5 53.4 182 182 S F H <4 S+ 0 0 18 -3,-1.6 3,-0.2 -26,-0.1 -2,-0.2 0.654 133.6 39.6-117.1 -28.6 58.1 41.0 56.2 183 183 S F H < S+ 0 0 1 -4,-2.3 -3,-0.2 1,-0.1 -2,-0.2 0.114 82.2 100.5-114.5 15.4 61.5 42.7 56.3 184 184 S G S < S+ 0 0 45 -4,-1.1 2,-0.4 -5,-0.2 -1,-0.1 0.579 77.0 55.0 -83.8 -10.0 62.2 43.2 52.6 185 185 S Q S S- 0 0 74 -3,-0.2 44,-1.4 44,-0.1 2,-0.1 -0.937 83.8-114.2-122.9 147.7 61.2 46.8 52.3 186 186 S T B > -J 228 0G 27 -2,-0.4 4,-0.7 42,-0.2 42,-0.3 -0.411 25.6-122.5 -67.7 153.4 62.3 49.9 54.1 187 187 S V T >4 S+ 0 0 2 40,-2.8 3,-1.1 37,-0.6 4,-0.2 0.939 112.1 57.3 -56.4 -44.2 59.7 51.6 56.3 188 188 S H G >4 S+ 0 0 37 36,-1.6 3,-1.8 39,-0.4 -1,-0.2 0.861 96.8 56.8 -59.4 -43.1 60.4 54.7 54.2 189 189 S E G 34 S+ 0 0 95 1,-0.3 -1,-0.3 35,-0.3 -2,-0.2 0.746 113.2 44.4 -64.7 -19.8 59.6 53.3 50.8 190 190 S Q G << S+ 0 0 38 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.327 89.9 118.7 -96.8 -0.2 56.2 52.4 52.2 191 191 S C X - 0 0 19 -3,-1.8 3,-1.8 -4,-0.2 -3,-0.0 -0.513 61.4-142.7 -82.9 134.4 55.6 55.8 54.0 192 192 S P T 3 S+ 0 0 76 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.742 102.3 59.2 -61.5 -22.4 52.7 58.1 53.1 193 193 S R T >> S+ 0 0 31 1,-0.2 4,-1.9 2,-0.1 3,-1.1 0.424 72.7 105.4 -87.0 2.6 54.9 61.1 53.7 194 194 S L H <> S+ 0 0 43 -3,-1.8 4,-2.7 1,-0.3 -1,-0.2 0.837 74.0 57.5 -53.1 -40.9 57.4 59.9 50.9 195 195 S P H 3> S+ 0 0 89 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.879 106.5 49.9 -60.7 -33.0 56.1 62.6 48.5 196 196 S H H <4>S+ 0 0 48 -3,-1.1 5,-3.1 2,-0.2 4,-0.4 0.923 109.1 51.6 -67.0 -42.3 57.0 65.3 51.0 197 197 S F H ><5S+ 0 0 60 -4,-1.9 3,-1.7 1,-0.2 -1,-0.2 0.941 109.2 50.5 -55.2 -49.9 60.5 63.8 51.4 198 198 S D 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S S <> S- 0 0 12 -3,-0.8 4,-2.2 1,-0.1 5,-0.1 -0.123 76.4-124.1 -68.8 157.5 55.3 73.6 63.4 209 209 S E H > S+ 0 0 104 1,-0.2 4,-2.2 2,-0.2 6,-0.1 0.828 114.0 62.0 -65.6 -30.1 52.5 74.0 60.9 210 210 S E H 4>S+ 0 0 65 2,-0.2 5,-2.5 1,-0.2 4,-0.4 0.906 104.7 46.1 -63.1 -41.6 54.5 71.7 58.6 211 211 S A H >45S+ 0 0 5 -6,-0.4 3,-1.8 1,-0.2 -2,-0.2 0.953 111.0 53.0 -64.2 -42.9 54.2 68.9 61.2 212 212 S R H 3<5S+ 0 0 56 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.881 108.3 50.8 -56.6 -40.6 50.5 69.8 61.5 213 213 S K T 3<5S- 0 0 145 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.440 121.3-109.2 -77.0 -3.6 50.2 69.4 57.8 214 214 S G T < 5 + 0 0 16 -3,-1.8 -3,-0.2 -4,-0.4 -18,-0.1 0.752 55.7 168.8 81.6 25.4 52.0 66.0 57.9 215 215 S W < - 0 0 59 -5,-2.5 -13,-0.2 1,-0.1 -1,-0.1 -0.166 46.8 -68.8 -66.4 164.6 55.3 66.9 56.3 216 216 S C B -k 202 0H 9 -15,-1.8 -13,-2.6 -23,-0.2 3,-0.3 -0.251 33.9-148.6 -61.8 141.2 58.2 64.5 56.4 217 217 S L > > + 0 0 3 -15,-0.2 5,-2.0 1,-0.2 3,-0.7 0.206 65.9 109.1 -96.1 12.7 59.9 63.8 59.7 218 218 S Y G > 5S+ 0 0 76 1,-0.2 3,-2.0 3,-0.2 -1,-0.2 0.905 77.8 52.0 -58.9 -42.8 63.4 63.2 58.4 219 219 S E G 3 5S+ 0 0 108 -3,-0.3 48,-0.3 1,-0.3 -1,-0.2 0.795 106.1 57.0 -67.7 -22.2 64.8 66.5 59.8 220 220 S L G < 5S- 0 0 18 -3,-0.7 -1,-0.3 46,-0.1 -2,-0.2 0.223 134.0 -87.3 -90.7 14.4 63.3 65.5 63.2 221 221 S G T < 5 + 0 0 0 -3,-2.0 45,-0.3 1,-0.2 -3,-0.2 0.428 61.6 173.0 106.7 1.0 65.3 62.2 63.1 222 222 S C < - 0 0 13 -5,-2.0 -1,-0.2 1,-0.2 28,-0.2 -0.196 15.7-168.0 -55.4 126.2 63.2 59.7 61.2 223 223 S K > + 0 0 12 26,-2.4 3,-2.0 1,-0.2 4,-0.3 0.276 54.1 114.4 -97.4 10.5 65.1 56.5 60.6 224 224 S G G > + 0 0 1 1,-0.3 -36,-1.6 25,-0.2 3,-1.4 0.853 69.7 61.1 -45.7 -42.5 62.6 55.1 58.1 225 225 S P G 3 S+ 0 0 39 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.699 113.8 34.9 -63.1 -18.0 65.1 55.3 55.3 226 226 S V G < S+ 0 0 84 -3,-2.0 2,-0.4 -40,-0.0 -2,-0.2 0.123 101.9 90.7-121.0 16.9 67.5 52.9 57.1 227 227 S T < - 0 0 1 -3,-1.4 -40,-2.8 -4,-0.3 2,-0.6 -0.971 58.9-151.1-124.7 128.7 65.0 50.6 58.7 228 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