==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 06-JUL-06 2HL1 . COMPND 2 MOLECULE: THREONYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS ABYSSI; . AUTHOR T.HUSSAIN,S.P.KRUPARANI,B.PAL,R.SANKARANARAYANAN . 292 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13355.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 76.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 24.3 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 . 0 0.0 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 . 29 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 22.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 2 0 0 0 3 0 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 1 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 A M 0 0 0 0, 0.0 138,-3.2 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 130.3 22.3 -7.2 -1.6 2 2 A R E -AB 44 138A 82 42,-2.3 42,-2.3 136,-0.2 2,-0.4 -0.958 360.0-168.5-110.4 122.9 20.6 -5.7 1.4 3 3 A V E -AB 43 137A 4 134,-3.6 134,-2.5 -2,-0.5 2,-0.5 -0.944 11.9-171.3-118.0 131.7 16.8 -5.2 1.0 4 4 A L E -AB 42 136A 9 38,-2.7 38,-2.7 -2,-0.4 2,-0.6 -0.959 11.6-161.6-122.0 111.6 14.5 -3.3 3.3 5 5 A L E -AB 41 135A 1 130,-3.4 130,-2.4 -2,-0.5 2,-0.5 -0.844 8.8-177.7-100.4 121.0 10.8 -3.7 2.5 6 6 A I E -AB 40 134A 3 34,-2.5 34,-2.1 -2,-0.6 2,-0.5 -0.905 18.8-148.3-121.4 102.8 8.4 -1.1 3.8 7 7 A H E -A 39 0A 21 126,-1.8 121,-2.0 -2,-0.5 122,-0.4 -0.566 37.0-176.7 -68.4 119.2 4.7 -1.6 3.1 8 8 A S E -AC 38 127A 0 30,-3.2 30,-1.9 -2,-0.5 119,-0.2 -0.871 48.8-135.4-129.6 157.6 3.5 2.0 2.9 9 9 A D E S- 0 0 52 117,-2.5 28,-2.4 -2,-0.3 2,-0.3 0.832 95.8 -22.7 -71.4 -29.8 0.5 4.2 2.5 10 10 A Y E -AC 36 126A 43 116,-0.6 116,-1.5 26,-0.3 2,-0.3 -0.977 54.1-145.8-171.3 164.9 2.7 6.2 0.2 11 11 A I E -AC 35 125A 1 24,-2.3 24,-1.8 -2,-0.3 2,-0.3 -0.990 16.7-178.3-141.5 139.4 6.2 7.1 -0.8 12 12 A E E +AC 34 124A 69 112,-2.2 112,-1.9 -2,-0.3 2,-0.3 -0.990 3.2 175.8-139.6 145.8 7.5 10.5 -2.2 13 13 A Y E -AC 33 123A 22 20,-1.6 20,-1.4 -2,-0.3 2,-0.3 -0.974 14.8-163.1-147.6 160.7 10.9 11.6 -3.3 14 14 A E E -AC 32 122A 59 108,-2.1 108,-2.4 -2,-0.3 18,-0.2 -0.945 26.4-124.7-148.8 120.9 12.5 14.6 -4.8 15 15 A V E + C 0 121A 10 16,-3.5 106,-0.2 -2,-0.3 3,-0.1 -0.489 38.0 166.2 -68.5 133.1 15.9 14.5 -6.5 16 16 A K E - 0 0 81 104,-2.9 -1,-0.1 1,-0.5 258,-0.1 0.018 47.9 -5.7-117.7-133.6 18.4 17.0 -5.0 17 17 A D E S- 0 0 102 256,-0.3 103,-3.1 1,-0.1 -1,-0.5 -0.100 78.4 -99.5 -61.1 164.1 22.2 17.2 -5.4 18 18 A K E - C 0 119A 119 101,-0.2 101,-0.3 1,-0.1 -1,-0.1 -0.616 24.4-167.5 -86.0 145.0 24.1 14.6 -7.3 19 19 A A S S+ 0 0 26 99,-2.7 2,-0.3 -2,-0.3 100,-0.2 0.457 76.0 43.8-108.8 -6.9 25.9 11.9 -5.4 20 20 A L S S- 0 0 43 98,-1.1 -1,-0.1 1,-0.1 -2,-0.0 -0.931 78.6-127.6-133.4 157.2 27.9 10.6 -8.4 21 21 A K S S+ 0 0 193 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.731 111.2 33.4 -76.9 -21.4 29.8 12.5 -11.1 22 22 A N S S+ 0 0 153 3,-0.0 -1,-0.3 96,-0.0 2,-0.1 -0.592 83.9 168.6-134.5 71.8 27.9 10.5 -13.7 23 23 A P - 0 0 17 0, 0.0 95,-0.2 0, 0.0 3,-0.1 -0.295 51.6 -71.3 -80.2 167.6 24.4 9.7 -12.3 24 24 A E - 0 0 37 93,-2.3 -2,-0.0 1,-0.1 0, 0.0 -0.407 59.8-115.8 -59.3 119.3 21.4 8.3 -14.3 25 25 A P + 0 0 113 0, 0.0 2,-0.3 0, 0.0 92,-0.1 -0.300 43.8 179.8 -59.6 142.6 20.3 11.1 -16.6 26 26 A I - 0 0 39 -3,-0.1 2,-0.2 90,-0.1 3,-0.0 -0.940 23.7-133.2-143.5 165.9 16.8 12.4 -15.9 27 27 A S > - 0 0 60 -2,-0.3 4,-0.8 1,-0.0 3,-0.5 -0.535 42.3 -93.9-108.4 177.6 14.2 14.9 -17.0 28 28 A E T >4 S+ 0 0 138 1,-0.2 3,-1.2 2,-0.2 4,-0.4 0.903 122.9 58.4 -60.5 -43.1 12.1 17.2 -14.8 29 29 A D G >4 S+ 0 0 141 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.829 107.3 47.8 -56.5 -34.5 9.2 14.8 -14.6 30 30 A M G 34 S+ 0 0 70 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.630 87.0 89.0 -82.0 -15.0 11.6 12.2 -13.1 31 31 A K G << S+ 0 0 62 -3,-1.2 -16,-3.5 -4,-0.8 2,-0.3 0.751 104.2 9.6 -54.0 -26.5 12.9 14.8 -10.6 32 32 A R E < +A 14 0A 149 -3,-0.7 2,-0.3 -4,-0.4 -18,-0.2 -0.990 69.5 168.0-152.6 157.9 10.1 13.8 -8.3 33 33 A G E -A 13 0A 24 -20,-1.4 -20,-1.6 -2,-0.3 2,-0.3 -0.992 14.3-152.5-164.7 166.6 7.4 11.1 -7.9 34 34 A R E -A 12 0A 116 -2,-0.3 2,-0.3 -22,-0.2 -22,-0.2 -0.994 6.7-177.4-152.4 140.3 4.9 9.5 -5.7 35 35 A M E -A 11 0A 26 -24,-1.8 -24,-2.3 -2,-0.3 2,-0.3 -0.968 13.7-150.5-133.6 151.2 3.2 6.1 -5.3 36 36 A E E S+A 10 0A 98 -2,-0.3 -26,-0.3 -26,-0.2 -27,-0.2 -0.892 71.6 15.7-125.1 155.5 0.5 5.0 -2.9 37 37 A E E S+ 0 0 100 -28,-2.4 38,-0.7 -2,-0.3 37,-0.4 0.972 96.5 152.3 47.9 62.8 -0.5 1.7 -1.2 38 38 A V E -Ad 8 75A 0 -30,-1.9 -30,-3.2 -3,-0.2 2,-0.8 -0.939 57.4-131.0-132.8 147.7 3.0 0.5 -2.1 39 39 A L E -Ad 7 76A 1 36,-2.7 38,-2.0 -2,-0.3 2,-0.5 -0.852 33.1-153.4 -91.9 109.8 5.6 -2.0 -1.1 40 40 A V E -Ad 6 77A 0 -34,-2.1 -34,-2.5 -2,-0.8 2,-0.7 -0.760 4.4-157.8 -88.8 129.8 8.8 0.2 -1.1 41 41 A A E -Ad 5 78A 0 36,-3.2 38,-2.1 -2,-0.5 2,-0.5 -0.823 3.2-164.7-111.8 92.3 12.0 -1.8 -1.7 42 42 A F E -Ad 4 79A 11 -38,-2.7 -38,-2.7 -2,-0.7 2,-0.4 -0.654 20.1-170.3 -74.7 121.7 15.0 0.1 -0.4 43 43 A I E -Ad 3 80A 0 36,-2.0 38,-2.8 -2,-0.5 2,-0.5 -0.963 25.6-174.4-127.9 133.5 18.0 -1.6 -1.9 44 44 A S E -A 2 0A 0 -42,-2.3 -42,-2.3 -2,-0.4 2,-0.5 -0.984 22.5-144.5-117.6 121.6 21.7 -1.4 -1.4 45 45 A V - 0 0 0 -2,-0.5 44,-2.8 -44,-0.2 2,-0.2 -0.789 19.7-145.3 -91.1 131.0 23.7 -3.5 -3.9 46 46 A E B >> -L 88 0B 16 -2,-0.5 3,-0.7 42,-0.3 4,-0.7 -0.539 21.8-113.1 -98.7 160.4 26.8 -5.0 -2.5 47 47 A K G >4 S+ 0 0 100 40,-2.5 3,-1.1 1,-0.3 4,-0.3 0.860 115.4 57.8 -55.3 -40.9 30.2 -5.8 -3.8 48 48 A V G >4 S+ 0 0 40 39,-0.3 3,-2.1 1,-0.3 4,-0.4 0.851 94.3 66.5 -60.7 -34.5 29.7 -9.5 -3.6 49 49 A D G X4 S+ 0 0 0 -3,-0.7 3,-1.6 1,-0.3 -1,-0.3 0.827 83.8 75.2 -56.2 -31.4 26.6 -9.2 -5.8 50 50 A E G << S+ 0 0 47 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.754 82.5 69.9 -52.5 -26.3 29.1 -8.3 -8.6 51 51 A K G < S+ 0 0 140 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.865 121.3 5.8 -61.9 -39.8 30.0 -11.9 -8.8 52 52 A N <> + 0 0 58 -3,-1.6 4,-2.0 -4,-0.4 -1,-0.3 -0.526 67.1 174.3-149.4 77.1 26.7 -13.0 -10.3 53 53 A P H > S+ 0 0 36 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.906 82.6 50.9 -47.7 -55.2 24.4 -10.0 -11.1 54 54 A E H > S+ 0 0 116 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.921 109.1 51.3 -53.8 -48.4 21.7 -12.1 -12.8 55 55 A E H > S+ 0 0 37 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.951 111.1 45.8 -55.1 -56.0 21.5 -14.5 -9.8 56 56 A V H X S+ 0 0 0 -4,-2.0 4,-2.6 -7,-0.2 5,-0.2 0.940 111.5 54.0 -51.9 -52.5 21.0 -11.8 -7.2 57 57 A S H X S+ 0 0 3 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.903 107.9 48.9 -48.9 -51.5 18.4 -10.1 -9.3 58 58 A L H X S+ 0 0 94 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.927 112.3 47.3 -57.8 -49.4 16.3 -13.2 -9.7 59 59 A K H X S+ 0 0 71 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.861 112.6 50.0 -62.7 -36.0 16.3 -14.0 -6.0 60 60 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.2 5,-0.3 0.927 109.6 51.6 -68.2 -42.8 15.5 -10.4 -5.2 61 61 A I H X S+ 0 0 15 -4,-2.9 4,-2.1 -5,-0.2 -2,-0.2 0.895 112.6 45.4 -61.1 -39.9 12.6 -10.4 -7.7 62 62 A E H X S+ 0 0 94 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.900 114.7 47.0 -72.4 -38.9 11.2 -13.6 -6.1 63 63 A E H X S+ 0 0 56 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.932 116.0 44.2 -65.6 -47.6 11.6 -12.4 -2.5 64 64 A I H X S+ 0 0 2 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.945 114.3 48.0 -63.3 -50.1 10.0 -9.0 -3.2 65 65 A S H X S+ 0 0 1 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.858 110.7 54.6 -60.9 -33.2 7.2 -10.4 -5.3 66 66 A K H X S+ 0 0 101 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.928 111.2 41.8 -66.5 -46.2 6.6 -12.9 -2.5 67 67 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.794 110.9 59.2 -70.9 -26.2 6.3 -10.3 0.2 68 68 A A H <>S+ 0 0 0 -4,-2.3 5,-2.7 -5,-0.2 4,-0.2 0.900 107.9 45.2 -66.0 -39.7 4.2 -8.2 -2.3 69 69 A E H ><5S+ 0 0 113 -4,-1.9 3,-0.8 3,-0.2 -2,-0.2 0.907 111.4 53.8 -67.6 -44.7 1.8 -11.2 -2.5 70 70 A Q H 3<5S+ 0 0 73 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.890 116.5 35.2 -60.0 -44.3 1.8 -11.6 1.3 71 71 A V T 3<5S- 0 0 19 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.382 109.3-122.6 -93.1 6.8 0.8 -8.0 2.0 72 72 A K T < 5 + 0 0 160 -3,-0.8 2,-0.5 -4,-0.2 -3,-0.2 0.889 52.6 162.1 55.7 43.7 -1.4 -7.8 -1.1 73 73 A A < - 0 0 5 -5,-2.7 -1,-0.2 -6,-0.2 -35,-0.1 -0.843 24.0-178.2 -97.1 128.0 0.5 -4.9 -2.5 74 74 A E + 0 0 149 -2,-0.5 37,-2.4 -37,-0.4 2,-0.4 0.632 69.0 66.1 -95.1 -21.0 -0.0 -4.3 -6.2 75 75 A N E -de 38 111A 33 -38,-0.7 -36,-2.7 35,-0.2 2,-0.4 -0.869 61.9-176.7-107.0 136.1 2.4 -1.4 -6.4 76 76 A V E -de 39 112A 0 35,-2.5 37,-2.6 -2,-0.4 2,-0.5 -0.992 8.8-160.7-132.3 139.8 6.1 -1.7 -5.8 77 77 A F E -de 40 113A 9 -38,-2.0 -36,-3.2 -2,-0.4 2,-0.7 -0.975 9.8-148.6-125.6 118.8 8.7 1.0 -5.8 78 78 A V E -de 41 114A 0 35,-2.8 37,-2.3 -2,-0.5 -36,-0.2 -0.772 20.3-173.5 -87.2 115.3 12.4 0.3 -6.3 79 79 A Y E -d 42 0A 0 -38,-2.1 -36,-2.0 -2,-0.7 2,-0.2 -0.899 22.3-134.5-119.6 105.7 14.4 2.8 -4.2 80 80 A P E +d 43 0A 0 0, 0.0 2,-0.2 0, 0.0 -36,-0.2 -0.360 33.4 169.1 -56.7 119.8 18.2 3.0 -4.5 81 81 A F > + 0 0 6 -38,-2.8 3,-1.1 -2,-0.2 4,-0.1 -0.702 14.0 179.9-141.3 84.3 19.4 3.2 -0.9 82 82 A A G > S+ 0 0 4 211,-2.6 3,-1.9 1,-0.3 2,-0.3 0.844 71.3 74.1 -52.0 -43.0 23.1 2.8 -0.6 83 83 A H G 3 S+ 0 0 54 210,-0.5 -1,-0.3 1,-0.3 198,-0.1 0.280 72.1 83.2 -63.6 15.1 23.2 3.2 3.2 84 84 A L G < S+ 0 0 12 -3,-1.1 2,-0.3 -2,-0.3 -1,-0.3 0.627 102.3 28.0 -89.2 -14.0 21.7 -0.2 3.9 85 85 A S < - 0 0 5 -3,-1.9 3,-0.2 -4,-0.1 -1,-0.1 -0.949 61.3-147.7-141.5 159.8 25.2 -1.7 3.5 86 86 A S S S+ 0 0 77 -2,-0.3 2,-0.1 1,-0.2 -3,-0.1 0.214 93.2 65.1-111.7 11.8 28.8 -0.6 4.0 87 87 A E S S- 0 0 131 -43,-0.0 -40,-2.5 0, 0.0 -39,-0.3 -0.558 75.7-178.9-132.7 65.1 30.1 -2.8 1.2 88 88 A L B -L 46 0B 60 -42,-0.3 -42,-0.3 -3,-0.2 2,-0.1 -0.278 21.6-121.6 -70.3 151.5 28.5 -1.3 -1.9 89 89 A A - 0 0 7 -44,-2.8 -42,-0.2 1,-0.2 -44,-0.1 -0.269 44.6 -71.2 -84.1 174.2 28.9 -2.6 -5.4 90 90 A K >> - 0 0 101 -44,-0.1 4,-2.5 -43,-0.1 3,-0.9 -0.460 46.0-123.2 -65.9 134.9 30.3 -0.7 -8.4 91 91 A P H 3> S+ 0 0 51 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.885 110.0 55.6 -47.8 -49.1 27.7 2.0 -9.5 92 92 A S H 3> S+ 0 0 78 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.848 113.8 41.5 -54.7 -37.2 27.5 0.6 -13.1 93 93 A V H <> S+ 0 0 28 -3,-0.9 4,-2.8 2,-0.2 -1,-0.2 0.841 112.0 53.4 -80.6 -36.1 26.6 -2.8 -11.7 94 94 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.922 110.2 49.9 -63.1 -43.1 24.2 -1.5 -9.0 95 95 A M H X S+ 0 0 36 -4,-3.1 4,-2.5 -5,-0.2 -2,-0.2 0.946 112.1 45.8 -60.2 -52.2 22.4 0.4 -11.7 96 96 A D H X S+ 0 0 67 -4,-1.7 4,-2.3 -5,-0.2 -2,-0.2 0.913 114.5 48.7 -58.7 -45.1 22.1 -2.7 -14.0 97 97 A I H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.926 110.1 50.2 -63.9 -44.5 21.0 -4.9 -11.1 98 98 A L H X S+ 0 0 1 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.927 111.6 49.3 -60.1 -42.5 18.4 -2.4 -9.9 99 99 A N H X S+ 0 0 55 -4,-2.5 4,-3.0 2,-0.2 5,-0.3 0.891 108.9 52.9 -63.1 -38.3 17.1 -2.2 -13.5 100 100 A R H X S+ 0 0 102 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.935 111.7 45.5 -61.3 -46.1 17.0 -6.0 -13.6 101 101 A V H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 5,-0.2 0.895 112.9 51.5 -64.7 -39.3 14.9 -6.0 -10.4 102 102 A Y H X S+ 0 0 47 -4,-2.7 4,-2.4 -5,-0.2 3,-0.3 0.980 115.0 40.4 -60.5 -56.6 12.7 -3.3 -11.8 103 103 A Q H X S+ 0 0 106 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.887 111.6 57.7 -60.6 -41.2 12.0 -5.1 -15.0 104 104 A G H X S+ 0 0 16 -4,-2.8 4,-1.1 -5,-0.3 -1,-0.2 0.862 110.7 42.2 -58.0 -40.2 11.7 -8.4 -13.3 105 105 A L H <>S+ 0 0 0 -4,-1.9 5,-1.4 -3,-0.3 4,-0.4 0.877 111.6 55.4 -72.4 -40.6 8.9 -7.2 -11.1 106 106 A K H ><5S+ 0 0 100 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.897 104.6 55.4 -57.7 -39.8 7.3 -5.3 -14.0 107 107 A E H 3<5S+ 0 0 161 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.868 98.4 60.8 -60.6 -41.3 7.3 -8.7 -15.8 108 108 A R T 3<5S- 0 0 118 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.537 123.5-102.4 -65.7 -8.3 5.3 -10.3 -12.9 109 109 A G T < 5S+ 0 0 69 -3,-1.4 2,-0.2 -4,-0.4 -3,-0.2 0.668 74.4 138.0 95.8 16.8 2.5 -7.9 -13.6 110 110 A F < - 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