==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JUN-08 3DKI . COMPND 2 MOLECULE: CYSTEINE SYNTHASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR D.AGREN,R.SCHNELL,G.SCHNEIDER . 606 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23551.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 423 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 83 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 3.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 30 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 196 32.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.5 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 0 0 1 0 2 5 0 1 1 5 0 2 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 4 2 6 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 PARALLEL BRIDGES PER LADDER . 7 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 3 A R 0 0 182 0, 0.0 2,-0.4 0, 0.0 329,-0.2 0.000 360.0 360.0 360.0 9.9 13.8 1.9 -7.6 2 4 A Y B -a 330 0A 63 327,-2.2 329,-2.6 1,-0.1 3,-0.1 -0.988 360.0-167.3-125.7 134.3 17.3 3.5 -7.4 3 5 A D S S+ 0 0 67 -2,-0.4 330,-0.4 327,-0.2 2,-0.3 0.584 82.4 23.9 -87.7 -13.6 18.1 7.2 -7.4 4 6 A S S > S- 0 0 28 328,-0.1 3,-1.8 1,-0.1 4,-0.4 -0.989 74.6-122.6-150.9 143.2 21.8 6.5 -8.1 5 7 A L G > S+ 0 0 5 -2,-0.3 3,-1.7 326,-0.3 -1,-0.1 0.834 110.5 70.0 -51.2 -37.3 23.9 3.8 -9.6 6 8 A L G 3 S+ 0 0 25 1,-0.3 -1,-0.3 80,-0.1 3,-0.2 0.730 94.3 54.5 -49.9 -29.4 25.7 3.7 -6.3 7 9 A Q G < S+ 0 0 102 -3,-1.8 2,-0.9 1,-0.2 -1,-0.3 0.631 91.3 73.7 -83.0 -16.5 22.6 2.2 -4.7 8 10 A A S < S+ 0 0 2 -3,-1.7 2,-0.4 -4,-0.4 -1,-0.2 -0.333 78.7 114.3 -90.9 48.5 22.5 -0.6 -7.3 9 11 A L - 0 0 41 -2,-0.9 34,-0.1 -3,-0.2 -3,-0.0 -0.925 64.8 -3.3-125.9 141.0 25.4 -2.3 -5.5 10 12 A G S S+ 0 0 12 -2,-0.4 152,-0.0 30,-0.1 153,-0.0 -0.201 73.7 104.5 73.6-166.3 25.6 -5.6 -3.6 11 13 A N + 0 0 106 1,-0.1 -1,-0.1 151,-0.0 152,-0.0 0.890 62.5 178.5 50.5 44.3 22.7 -7.8 -3.0 12 14 A T - 0 0 2 1,-0.1 -1,-0.1 26,-0.0 28,-0.1 -0.305 30.7 -92.5 -78.3 155.0 24.2 -10.0 -5.7 13 15 A P - 0 0 13 0, 0.0 26,-2.5 0, 0.0 2,-0.5 -0.382 24.6-150.1 -65.4 146.1 22.8 -13.4 -6.8 14 16 A L E -Hi 38 316B 0 301,-3.3 303,-3.2 24,-0.2 2,-0.4 -0.991 22.6-172.0-110.2 121.1 23.8 -16.7 -5.3 15 17 A V E -Hi 37 317B 1 22,-2.5 22,-3.4 -2,-0.5 303,-0.2 -0.971 20.0-127.9-126.9 126.9 23.5 -19.4 -8.0 16 18 A G E -H 36 0B 1 301,-2.4 2,-0.9 -2,-0.4 20,-0.2 -0.423 12.0-142.3 -72.9 139.4 23.8 -23.2 -7.5 17 19 A L > + 0 0 1 18,-2.9 4,-2.1 1,-0.2 18,-0.3 -0.718 27.3 172.6-104.1 80.3 26.2 -25.0 -9.9 18 20 A Q T 4 S+ 0 0 83 -2,-0.9 6,-0.4 300,-0.4 -1,-0.2 0.770 75.9 39.4 -66.5 -28.0 24.2 -28.2 -10.5 19 21 A R T 4 S+ 0 0 133 -3,-0.1 -1,-0.2 236,-0.1 237,-0.1 0.878 119.8 42.7 -87.3 -45.8 26.4 -29.6 -13.2 20 22 A L T 4 S+ 0 0 14 232,-0.1 -2,-0.2 15,-0.1 -1,-0.1 0.663 90.0 102.5 -76.5 -17.6 29.9 -28.6 -11.8 21 23 A S S < S- 0 0 9 -4,-2.1 3,-0.5 14,-0.2 13,-0.1 -0.477 80.4-126.5 -65.0 136.6 29.1 -29.5 -8.2 22 24 A P S S- 0 0 44 0, 0.0 2,-0.2 0, 0.0 12,-0.1 0.873 98.1 -1.7 -49.6 -41.6 30.7 -32.9 -7.3 23 25 A R B +J 33 0B 65 10,-2.3 10,-2.9 1,-0.1 -4,-0.1 -0.662 63.1 177.5-154.4 102.0 27.2 -34.0 -6.2 24 26 A W S S+ 0 0 16 -3,-0.5 2,-0.4 -6,-0.4 8,-0.1 0.896 70.3 55.9 -67.6 -42.9 24.2 -31.7 -6.4 25 27 A D S S- 0 0 112 -7,-0.1 2,-0.2 6,-0.1 8,-0.1 -0.767 84.5-121.4 -99.2 134.0 21.6 -34.3 -5.2 26 28 A D - 0 0 90 -2,-0.4 2,-0.2 6,-0.1 -2,-0.1 -0.514 36.1-164.4 -64.3 140.7 21.7 -36.2 -1.9 27 29 A G - 0 0 32 3,-2.8 3,-0.2 -2,-0.2 5,-0.0 -0.704 35.4-106.0-119.0 172.4 21.7 -39.9 -2.6 28 30 A R S S+ 0 0 262 -2,-0.2 -2,-0.0 1,-0.2 -1,-0.0 0.760 122.8 46.2 -67.3 -24.7 21.0 -43.0 -0.5 29 31 A D S S+ 0 0 127 1,-0.3 -1,-0.2 2,-0.0 -3,-0.0 0.581 125.7 0.8 -96.2 -14.4 24.8 -43.7 -0.6 30 32 A G - 0 0 15 -3,-0.2 -3,-2.8 253,-0.0 -1,-0.3 -0.928 68.6-106.2-171.3 151.4 26.1 -40.1 0.2 31 33 A P - 0 0 39 0, 0.0 -6,-0.1 0, 0.0 251,-0.1 -0.248 51.7 -82.7 -75.3 168.2 25.1 -36.5 1.1 32 34 A H - 0 0 17 -8,-0.1 253,-2.0 252,-0.1 2,-0.4 -0.214 25.2-159.6 -74.2 155.2 25.4 -33.6 -1.4 33 35 A V E -Jk 23 285B 0 -10,-2.9 -10,-2.3 251,-0.2 2,-0.4 -0.904 27.3-175.7-132.6 101.3 28.5 -31.6 -2.2 34 36 A R E - k 0 286B 40 251,-2.7 253,-3.3 -2,-0.4 2,-0.4 -0.826 21.9-152.5-113.0 142.1 27.2 -28.3 -3.7 35 37 A L E - k 0 287B 0 -2,-0.4 -18,-2.9 -18,-0.3 2,-0.4 -0.937 12.1-168.6-110.3 134.6 28.9 -25.3 -5.2 36 38 A W E -Hk 16 288B 0 251,-2.9 253,-2.6 -2,-0.4 2,-0.6 -0.996 11.8-145.2-129.7 123.8 27.1 -22.0 -5.0 37 39 A A E -Hk 15 289B 0 -22,-3.4 -22,-2.5 -2,-0.4 2,-0.7 -0.819 0.2-152.0-100.4 120.2 28.4 -19.0 -7.1 38 40 A K E -Hk 14 290B 0 251,-3.0 253,-2.5 -2,-0.6 2,-1.6 -0.812 17.7-145.1 -87.7 110.0 28.2 -15.5 -5.7 39 41 A L E > + k 0 291B 1 -26,-2.5 3,-1.6 -2,-0.7 253,-0.1 -0.521 30.4 166.0 -90.9 82.7 28.0 -13.3 -8.8 40 42 A E G > + 0 0 0 251,-1.6 3,-0.8 -2,-1.6 10,-0.2 0.524 64.6 80.0 -75.8 -2.7 29.8 -10.1 -7.9 41 43 A D G 3 S+ 0 0 35 250,-0.4 -1,-0.3 1,-0.2 253,-0.1 0.538 72.8 80.9 -76.8 -5.2 29.9 -9.0 -11.6 42 44 A R G < S+ 0 0 20 -3,-1.6 -1,-0.2 -29,-0.1 -2,-0.1 0.225 74.4 106.2 -85.3 18.5 26.3 -7.8 -11.1 43 45 A N S X S- 0 0 4 -3,-0.8 3,-1.5 -34,-0.1 -34,-0.2 -0.464 92.1 -88.4 -91.5 167.2 27.7 -4.7 -9.5 44 46 A P T 3 S+ 0 0 14 0, 0.0 510,-0.4 0, 0.0 -35,-0.1 0.826 126.3 24.9 -40.0 -52.7 27.9 -1.1 -11.1 45 47 A T T 3 S- 0 0 5 2,-0.3 3,-0.1 508,-0.1 -3,-0.1 0.242 119.9 -98.6-103.2 11.3 31.3 -1.6 -12.8 46 48 A G S < S+ 0 0 10 -3,-1.5 248,-0.7 1,-0.2 2,-0.3 0.675 88.6 79.6 86.8 20.8 31.2 -5.4 -13.1 47 49 A S B > S-O 293 0C 1 246,-0.2 3,-1.4 -6,-0.1 -2,-0.3 -0.988 84.2-107.2-153.3 166.8 33.3 -6.5 -10.1 48 50 A I T > S+ 0 0 1 244,-2.2 3,-1.7 -2,-0.3 245,-0.1 0.674 103.2 80.6 -62.8 -22.2 33.4 -7.1 -6.4 49 51 A X T 3> S+ 0 0 15 243,-0.3 4,-2.2 1,-0.3 -1,-0.2 0.592 71.1 79.1 -68.6 -12.0 35.6 -3.9 -5.9 50 52 A D H <> S+ 0 0 0 -3,-1.4 4,-1.9 -10,-0.2 -1,-0.3 0.826 90.8 56.8 -57.6 -33.7 32.5 -1.7 -6.1 51 53 A R H <> S+ 0 0 13 -3,-1.7 4,-2.2 -4,-0.2 5,-0.2 0.987 113.5 32.6 -67.0 -61.4 31.9 -2.7 -2.5 52 54 A P H > S+ 0 0 1 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.873 115.9 60.3 -64.0 -33.6 35.2 -1.6 -0.9 53 55 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.953 110.6 39.3 -55.7 -51.5 35.5 1.3 -3.3 54 56 A V H X S+ 0 0 8 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.928 117.4 49.4 -69.5 -40.7 32.3 2.8 -2.1 55 57 A R H X S+ 0 0 81 -4,-2.2 4,-2.7 -5,-0.2 5,-0.2 0.888 107.6 53.9 -68.6 -38.6 32.9 2.0 1.6 56 58 A M H X S+ 0 0 0 -4,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.916 111.0 46.2 -61.3 -40.1 36.4 3.4 1.6 57 59 A I H X S+ 0 0 0 -4,-1.6 4,-1.7 -5,-0.3 -2,-0.2 0.918 115.0 46.3 -67.3 -43.6 35.2 6.7 0.2 58 60 A E H X S+ 0 0 92 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.856 111.6 50.6 -70.0 -35.8 32.3 6.9 2.7 59 61 A Q H X S+ 0 0 65 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.894 110.1 51.7 -67.6 -36.6 34.4 5.9 5.6 60 62 A A H <>S+ 0 0 5 -4,-1.9 5,-2.8 -5,-0.2 6,-1.1 0.829 110.6 47.8 -64.5 -38.2 36.9 8.7 4.6 61 63 A E H ><5S+ 0 0 61 -4,-1.7 3,-2.0 4,-0.2 -2,-0.2 0.949 110.3 52.0 -67.5 -49.5 34.0 11.1 4.5 62 64 A A H 3<5S+ 0 0 78 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.896 109.1 50.7 -50.9 -43.1 32.8 9.9 7.9 63 65 A D T 3<5S- 0 0 97 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.458 116.7-114.5 -76.0 -3.1 36.3 10.5 9.3 64 66 A G T < 5S+ 0 0 52 -3,-2.0 -3,-0.2 2,-0.2 -2,-0.1 0.715 85.1 118.1 75.1 23.1 36.4 14.0 7.9 65 67 A L < + 0 0 97 -5,-2.8 2,-0.4 -6,-0.2 -4,-0.2 0.768 67.6 49.4 -89.6 -29.1 39.2 13.2 5.4 66 68 A L + 0 0 6 -6,-1.1 -2,-0.2 -9,-0.1 -1,-0.1 -0.937 60.6 164.8-119.5 139.9 37.2 13.9 2.2 67 69 A R > - 0 0 193 -2,-0.4 3,-2.2 76,-0.2 -6,-0.0 -0.866 51.9 -56.2-148.2 176.7 35.1 16.9 1.2 68 70 A P T 3 S+ 0 0 108 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.580 124.9 18.2 -37.0 -66.9 33.6 18.4 -2.0 69 71 A G T 3 S+ 0 0 68 24,-0.1 24,-0.1 2,-0.0 23,-0.1 -0.113 90.3 139.8-101.5 37.2 36.4 18.9 -4.6 70 72 A A < - 0 0 4 -3,-2.2 24,-2.1 22,-0.1 2,-0.4 -0.267 46.9-129.9 -70.3 163.5 39.0 16.6 -3.0 71 73 A T E -pq 94 144D 6 72,-2.0 74,-3.0 22,-0.2 2,-0.5 -0.973 11.4-150.4-116.8 132.2 41.2 14.4 -5.1 72 74 A I E -pq 95 145D 0 22,-3.2 24,-2.9 -2,-0.4 2,-0.5 -0.892 8.8-162.5 -99.7 131.9 41.7 10.7 -4.4 73 75 A L E +pq 96 146D 0 72,-3.0 74,-0.8 -2,-0.5 75,-0.4 -0.971 12.3 176.4-110.7 129.4 45.0 9.1 -5.3 74 76 A E E -p 97 0D 0 22,-2.2 24,-2.3 -2,-0.5 2,-1.5 -0.994 31.1-138.2-135.3 130.4 45.2 5.3 -5.6 75 77 A P + 0 0 8 0, 0.0 2,-0.3 0, 0.0 24,-0.1 -0.673 65.7 111.4 -80.4 86.7 48.1 3.1 -6.6 76 78 A T - 0 0 11 -2,-1.5 -2,-0.1 22,-0.4 0, 0.0 -0.988 43.0-179.0-154.6 147.8 46.1 0.7 -8.8 77 79 A S S S+ 0 0 19 -2,-0.3 34,-0.2 20,-0.1 -1,-0.1 0.326 70.5 67.0-124.2 1.9 45.6 -0.2 -12.4 78 80 A G S >> S- 0 0 24 32,-0.1 4,-1.6 3,-0.0 3,-0.6 0.158 106.5 -45.9-101.7-145.2 42.9 -2.9 -11.9 79 81 A N H 3> S+ 0 0 13 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.799 127.4 58.3 -62.6 -36.6 39.3 -3.3 -10.8 80 82 A T H 3> S+ 0 0 4 2,-0.2 4,-3.3 1,-0.2 -1,-0.3 0.886 105.6 51.4 -62.0 -38.6 39.6 -1.1 -7.7 81 83 A G H <> S+ 0 0 0 -3,-0.6 4,-1.9 2,-0.2 -2,-0.2 0.901 111.2 47.2 -63.4 -42.8 40.7 1.8 -10.0 82 84 A I H X S+ 0 0 5 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.916 115.8 45.3 -60.0 -47.9 37.7 1.2 -12.2 83 85 A S H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.916 114.0 47.8 -67.0 -43.0 35.4 1.1 -9.1 84 86 A L H X S+ 0 0 0 -4,-3.3 4,-2.6 1,-0.2 5,-0.3 0.844 109.0 55.8 -68.2 -29.4 37.0 4.1 -7.4 85 87 A A H X S+ 0 0 2 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.922 112.1 41.9 -67.1 -45.8 36.7 6.0 -10.7 86 88 A M H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.955 120.0 41.3 -63.4 -54.8 33.0 5.4 -10.9 87 89 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.931 114.3 52.1 -59.9 -50.0 32.2 6.0 -7.2 88 90 A A H <>S+ 0 0 0 -4,-2.6 5,-3.6 -5,-0.3 4,-0.5 0.907 111.9 46.8 -52.4 -48.2 34.6 9.1 -6.9 89 91 A R H ><5S+ 0 0 62 -4,-1.7 3,-1.0 -5,-0.3 -1,-0.2 0.916 112.3 47.6 -65.0 -47.5 32.9 10.7 -9.9 90 92 A L H 3<5S+ 0 0 40 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.873 114.5 48.6 -61.7 -34.4 29.4 10.1 -8.8 91 93 A K T 3<5S- 0 0 60 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.477 122.3-106.2 -85.9 -2.6 30.3 11.4 -5.3 92 94 A G T < 5S+ 0 0 47 -3,-1.0 2,-0.3 -4,-0.5 -3,-0.2 0.680 75.9 126.1 89.3 21.4 32.0 14.5 -6.8 93 95 A Y < - 0 0 19 -5,-3.6 2,-0.3 -6,-0.2 -1,-0.3 -0.737 57.6-122.9-106.2 156.7 35.7 13.7 -6.3 94 96 A R E -p 71 0D 125 -24,-2.1 -22,-3.2 -2,-0.3 2,-0.5 -0.774 26.0-151.0 -90.4 145.2 38.6 13.6 -8.8 95 97 A L E -p 72 0D 7 -2,-0.3 22,-2.4 20,-0.3 2,-0.5 -0.983 12.6-173.7-123.6 124.4 40.4 10.3 -9.0 96 98 A I E -pr 73 117D 1 -24,-2.9 -22,-2.2 -2,-0.5 2,-0.5 -0.976 10.8-155.9-115.5 120.4 44.1 9.9 -10.0 97 99 A C E -pr 74 118D 0 20,-2.8 22,-2.7 -2,-0.5 2,-0.5 -0.831 4.7-154.3 -94.2 128.5 45.4 6.4 -10.5 98 100 A V E + r 0 119D 1 -24,-2.3 -22,-0.4 -2,-0.5 22,-0.2 -0.919 28.6 153.4-103.5 124.5 49.2 5.9 -10.1 99 101 A M E - r 0 120D 0 20,-2.8 22,-2.4 -2,-0.5 2,-0.1 -0.964 46.8 -81.4-146.4 159.9 50.7 3.0 -12.0 100 102 A P E > - r 0 121D 25 0, 0.0 3,-2.3 0, 0.0 22,-0.2 -0.380 35.5-123.4 -63.2 142.1 53.9 1.7 -13.5 101 103 A E T 3 S+ 0 0 126 20,-2.9 21,-0.1 1,-0.3 19,-0.0 0.811 111.5 70.5 -48.2 -37.2 54.8 3.1 -17.1 102 104 A N T 3 S+ 0 0 136 19,-0.2 -1,-0.3 2,-0.0 20,-0.1 0.434 74.8 127.8 -54.3 -7.6 54.9 -0.6 -18.0 103 105 A T < - 0 0 18 -3,-2.3 5,-0.0 1,-0.1 -4,-0.0 -0.311 66.7-102.9 -72.0 140.2 51.1 -0.8 -17.6 104 106 A S > - 0 0 62 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.264 14.9-135.1 -60.3 141.3 49.0 -2.3 -20.4 105 107 A V H > S+ 0 0 63 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.839 109.7 59.6 -65.0 -34.7 47.1 0.1 -22.7 106 108 A E H > S+ 0 0 105 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.913 108.1 45.2 -53.8 -46.3 44.1 -2.2 -22.3 107 109 A R H > S+ 0 0 104 1,-0.2 4,-1.3 2,-0.2 3,-0.2 0.936 114.6 47.0 -63.3 -48.3 44.3 -1.6 -18.5 108 110 A R H X S+ 0 0 51 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.849 105.1 60.5 -63.7 -39.3 44.7 2.2 -18.9 109 111 A Q H X S+ 0 0 62 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.884 101.6 52.2 -61.5 -40.4 41.9 2.5 -21.4 110 112 A L H X S+ 0 0 18 -4,-1.3 4,-1.4 -3,-0.2 -1,-0.2 0.953 111.8 46.1 -59.6 -48.6 39.3 1.2 -18.9 111 113 A L H <>S+ 0 0 0 -4,-1.3 5,-2.3 1,-0.2 4,-0.4 0.881 110.9 53.5 -64.1 -40.9 40.4 3.7 -16.2 112 114 A E H ><5S+ 0 0 75 -4,-2.4 3,-1.7 3,-0.2 -1,-0.2 0.929 104.2 53.8 -57.7 -51.0 40.4 6.6 -18.7 113 115 A L H 3<5S+ 0 0 13 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.865 107.5 51.3 -54.5 -41.0 36.8 6.0 -20.0 114 116 A Y T 3<5S- 0 0 6 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.508 126.9-101.9 -78.1 -7.1 35.4 6.1 -16.4 115 117 A G T < 5 + 0 0 15 -3,-1.7 -20,-0.3 -4,-0.4 -3,-0.2 0.505 68.4 147.3 106.1 8.3 37.2 9.4 -15.9 116 118 A A < - 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