==== 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 2HL0 . COMPND 2 MOLECULE: THREONYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS ABYSSI; . AUTHOR T.HUSSAIN,S.P.KRUPARANI,B.PAL,R.SANKARANARAYANAN . 144 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7929.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 108 75.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 22.9 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 . 14 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 . 1 0 0 0 1 0 0 1 0 0 0 1 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 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 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,-2.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 139.4 2.5 29.6 29.7 2 2 A R E -AB 44 138A 82 42,-2.5 42,-2.6 136,-0.2 2,-0.4 -0.961 360.0-174.5-115.1 129.8 1.0 32.4 27.5 3 3 A V E -AB 43 137A 0 134,-2.8 134,-2.3 -2,-0.5 2,-0.5 -0.984 13.8-166.5-128.3 134.7 -0.8 31.4 24.3 4 4 A L E -AB 42 136A 60 38,-2.4 38,-2.6 -2,-0.4 2,-0.6 -0.981 14.7-158.7-119.0 116.1 -2.3 33.7 21.6 5 5 A L E -AB 41 135A 1 130,-3.8 130,-2.2 -2,-0.5 2,-0.5 -0.863 11.5-179.5-102.0 117.2 -4.6 31.7 19.3 6 6 A I E -AB 40 134A 16 34,-2.4 34,-2.8 -2,-0.6 2,-0.7 -0.949 20.6-146.0-120.5 113.0 -5.3 33.2 15.9 7 7 A H E -A 39 0A 17 126,-2.2 121,-2.5 -2,-0.5 122,-0.4 -0.686 36.8-176.0 -77.0 115.3 -7.6 31.4 13.5 8 8 A S E -AC 38 127A 0 30,-3.5 30,-1.9 -2,-0.7 119,-0.2 -0.813 48.7-138.5-123.9 157.8 -6.0 32.1 10.1 9 9 A D E S- 0 0 54 117,-2.4 28,-2.2 1,-0.3 2,-0.3 0.831 96.1 -19.5 -73.0 -32.9 -6.4 31.7 6.4 10 10 A Y E -AC 36 126A 72 116,-0.7 116,-1.5 26,-0.3 2,-0.3 -0.987 52.8-152.3-167.3 162.7 -2.7 31.0 6.4 11 11 A I E -AC 35 125A 0 24,-2.0 24,-1.9 -2,-0.3 2,-0.3 -0.986 15.7-179.1-143.1 134.0 0.6 31.4 8.3 12 12 A E E -AC 34 124A 58 112,-2.4 112,-2.2 -2,-0.3 2,-0.3 -0.961 3.7-173.0-131.2 151.0 4.0 31.6 6.7 13 13 A Y E -AC 33 123A 21 20,-1.8 20,-1.5 -2,-0.3 2,-0.4 -0.975 12.3-161.9-143.5 155.8 7.4 32.0 8.4 14 14 A E E -AC 32 122A 61 108,-2.4 108,-2.7 -2,-0.3 18,-0.2 -0.957 25.5-126.8-140.6 117.7 11.0 32.5 7.4 15 15 A V E + C 0 121A 19 16,-3.3 106,-0.2 -2,-0.4 3,-0.1 -0.476 36.7 169.6 -66.4 131.6 13.9 31.7 9.7 16 16 A K E - 0 0 121 104,-2.8 105,-0.1 1,-0.4 -1,-0.1 0.182 47.4 -4.3-112.1-129.9 16.2 34.7 10.1 17 17 A D E S- 0 0 121 1,-0.1 103,-2.9 102,-0.1 -1,-0.4 -0.314 77.2-102.4 -68.9 150.8 19.1 35.2 12.6 18 18 A K E - C 0 119A 55 101,-0.2 101,-0.3 1,-0.1 -1,-0.1 -0.461 26.8-165.0 -69.1 142.8 19.8 32.6 15.3 19 19 A A S S+ 0 0 24 99,-2.8 2,-0.3 -2,-0.1 100,-0.2 0.521 73.2 43.3-105.2 -11.9 18.5 33.8 18.7 20 20 A L S S- 0 0 48 98,-1.2 -1,-0.1 1,-0.1 -2,-0.0 -0.917 85.9-116.0-131.2 156.5 20.4 31.3 20.7 21 21 A K S S+ 0 0 182 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.1 0.927 113.1 25.7 -56.9 -47.9 24.0 30.0 20.5 22 22 A N S S+ 0 0 136 -3,-0.1 -1,-0.3 3,-0.0 0, 0.0 -0.702 84.0 173.6-122.0 78.9 22.9 26.5 19.6 23 23 A P - 0 0 28 0, 0.0 95,-0.2 0, 0.0 96,-0.0 -0.099 50.1 -63.0 -75.2 179.7 19.4 26.6 17.9 24 24 A E - 0 0 66 93,-2.8 2,-0.1 1,-0.1 0, 0.0 -0.481 57.8-121.3 -65.6 121.7 17.6 23.7 16.4 25 25 A P - 0 0 119 0, 0.0 2,-0.3 0, 0.0 92,-0.1 -0.455 42.4-178.7 -65.3 135.7 19.7 22.4 13.4 26 26 A I - 0 0 47 -2,-0.1 2,-0.1 90,-0.1 5,-0.0 -0.931 25.2-122.9-138.6 163.7 17.6 22.6 10.2 27 27 A S > - 0 0 54 -2,-0.3 3,-1.1 1,-0.1 4,-0.4 -0.386 40.5 -99.8 -92.8 174.4 17.7 21.9 6.5 28 28 A E G > S+ 0 0 136 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.900 123.5 59.0 -61.6 -40.2 17.1 24.3 3.7 29 29 A D G 3 S+ 0 0 137 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.649 102.5 53.9 -64.0 -17.0 13.6 23.0 3.4 30 30 A M G < S+ 0 0 65 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.493 83.3 83.2 -98.5 -4.0 12.9 24.0 7.0 31 31 A K S < S+ 0 0 85 -3,-1.5 -16,-3.3 -4,-0.4 2,-0.3 0.814 101.6 31.4 -67.1 -29.7 13.9 27.7 6.8 32 32 A R E +A 14 0A 156 -4,-0.4 2,-0.3 -18,-0.2 -18,-0.2 -0.905 68.6 167.5-128.1 156.9 10.5 28.5 5.4 33 33 A G E -A 13 0A 23 -20,-1.5 -20,-1.8 -2,-0.3 2,-0.3 -0.989 11.5-167.3-162.5 161.2 7.0 27.0 5.9 34 34 A R E -A 12 0A 114 -2,-0.3 2,-0.3 -22,-0.2 -22,-0.2 -0.988 3.5-178.9-155.1 146.1 3.3 27.7 5.3 35 35 A M E -A 11 0A 28 -24,-1.9 -24,-2.0 -2,-0.3 2,-0.3 -0.987 14.6-149.3-145.1 144.2 -0.0 26.2 6.5 36 36 A E E S+A 10 0A 111 -2,-0.3 -26,-0.3 -26,-0.2 -27,-0.2 -0.776 71.7 16.9-115.7 161.9 -3.6 27.2 5.5 37 37 A E E S+ 0 0 99 -28,-2.2 38,-0.7 -2,-0.3 37,-0.4 0.941 95.8 150.7 42.2 64.8 -7.0 27.2 7.3 38 38 A V E -Ad 8 75A 0 -30,-1.9 -30,-3.5 -3,-0.2 2,-0.8 -0.924 57.9-130.9-134.2 149.6 -5.1 26.9 10.5 39 39 A L E -Ad 7 76A 1 36,-2.5 38,-2.2 -2,-0.3 2,-0.5 -0.880 33.6-149.7 -95.0 109.8 -5.3 27.8 14.2 40 40 A V E -Ad 6 77A 0 -34,-2.8 -34,-2.4 -2,-0.8 2,-0.8 -0.733 6.2-158.6 -86.2 126.1 -2.0 29.4 14.9 41 41 A A E -Ad 5 78A 1 36,-3.4 38,-2.6 -2,-0.5 2,-0.6 -0.856 3.4-165.8-108.1 96.9 -0.8 28.9 18.5 42 42 A F E -Ad 4 79A 10 -38,-2.6 -38,-2.4 -2,-0.8 2,-0.4 -0.739 19.5-167.0 -80.3 121.2 1.7 31.6 19.4 43 43 A I E -Ad 3 80A 0 36,-2.6 38,-2.9 -2,-0.6 2,-0.5 -0.949 25.0-173.6-125.2 134.0 3.3 30.3 22.6 44 44 A S E -A 2 0A 0 -42,-2.6 -42,-2.5 -2,-0.4 2,-0.5 -0.985 21.7-144.6-118.8 116.8 5.6 31.8 25.2 45 45 A V - 0 0 0 -2,-0.5 44,-2.2 -44,-0.2 2,-0.2 -0.725 22.9-147.9 -84.6 128.8 6.8 29.3 27.8 46 46 A E B > -F 88 0B 23 -2,-0.5 3,-1.3 42,-0.3 4,-0.4 -0.576 22.8-110.3-101.3 161.9 7.1 30.9 31.2 47 47 A K G > S+ 0 0 104 40,-2.2 3,-1.9 1,-0.3 4,-0.3 0.885 115.7 57.4 -51.7 -46.6 9.3 30.5 34.2 48 48 A V G > S+ 0 0 53 39,-0.3 3,-1.4 1,-0.3 4,-0.3 0.756 94.0 68.7 -60.2 -24.3 6.5 29.0 36.4 49 49 A D G X S+ 0 0 0 -3,-1.3 3,-1.1 1,-0.3 -1,-0.3 0.706 80.8 76.0 -67.8 -20.3 6.1 26.3 33.8 50 50 A E G < S+ 0 0 58 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.760 81.7 70.5 -62.2 -23.8 9.5 24.9 34.8 51 51 A K G < S+ 0 0 136 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.834 122.7 1.8 -63.1 -35.1 7.8 23.5 37.9 52 52 A N <> + 0 0 64 -3,-1.1 4,-2.3 -4,-0.3 5,-0.3 -0.482 64.8 174.7-156.4 79.1 5.9 20.9 35.8 53 53 A P H > S+ 0 0 31 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.894 84.0 49.4 -53.3 -46.2 6.5 20.8 32.1 54 54 A E H > S+ 0 0 109 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.938 111.6 47.9 -62.6 -46.8 4.4 17.7 31.4 55 55 A E H > S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.946 114.6 45.1 -59.0 -50.8 1.3 19.0 33.3 56 56 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 -7,-0.2 -1,-0.2 0.894 112.8 52.9 -60.3 -40.9 1.4 22.4 31.6 57 57 A S H X S+ 0 0 1 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.939 109.5 46.9 -60.9 -48.3 1.9 20.8 28.3 58 58 A L H X S+ 0 0 96 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.859 111.5 51.5 -63.3 -36.1 -1.1 18.5 28.7 59 59 A K H X S+ 0 0 67 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.899 111.2 48.2 -66.0 -41.6 -3.2 21.4 29.8 60 60 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.908 108.7 53.4 -64.6 -44.0 -2.2 23.4 26.7 61 61 A I H X S+ 0 0 6 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.920 112.1 45.4 -56.8 -45.3 -2.9 20.5 24.4 62 62 A E H X S+ 0 0 88 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.934 114.5 47.1 -64.9 -48.8 -6.4 20.2 25.8 63 63 A E H X S+ 0 0 47 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.926 114.5 45.8 -61.3 -46.3 -7.1 23.9 25.7 64 64 A I H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 -1,-0.2 0.878 111.5 54.4 -64.9 -36.1 -5.8 24.3 22.1 65 65 A S H X S+ 0 0 1 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.919 107.3 50.0 -62.8 -44.5 -7.8 21.2 21.1 66 66 A K H X S+ 0 0 123 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.929 112.6 46.1 -60.8 -46.8 -11.0 22.7 22.5 67 67 A V H X S+ 0 0 3 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.936 111.4 51.2 -63.0 -46.5 -10.5 25.9 20.6 68 68 A A H X>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 4,-0.7 0.924 113.4 45.9 -56.4 -45.6 -9.6 24.2 17.3 69 69 A E H <5S+ 0 0 124 -4,-2.4 3,-0.4 3,-0.2 -1,-0.2 0.904 112.1 51.5 -64.5 -41.2 -12.7 22.1 17.6 70 70 A Q H <5S+ 0 0 114 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.876 116.5 38.2 -65.4 -38.7 -14.8 25.1 18.4 71 71 A V H <5S- 0 0 20 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.463 113.4-116.7 -92.5 0.2 -13.7 27.2 15.5 72 72 A K T <5 + 0 0 185 -4,-0.7 2,-0.6 -3,-0.4 -3,-0.2 0.833 58.3 155.9 69.8 36.1 -13.6 24.1 13.2 73 73 A A < + 0 0 6 -5,-2.8 -1,-0.2 -6,-0.2 -35,-0.1 -0.840 22.5 178.6 -96.0 123.6 -9.8 24.2 12.5 74 74 A E + 0 0 153 -2,-0.6 37,-2.3 -37,-0.4 2,-0.4 0.615 69.8 65.2 -95.0 -17.6 -8.4 20.8 11.5 75 75 A N E -de 38 111A 32 -38,-0.7 -36,-2.5 35,-0.2 2,-0.4 -0.881 63.5-176.8-109.2 138.3 -4.9 22.3 11.1 76 76 A V E -de 39 112A 0 35,-2.5 37,-2.6 -2,-0.4 2,-0.5 -0.995 10.8-156.5-135.7 139.3 -2.9 23.7 14.0 77 77 A F E -de 40 113A 5 -38,-2.2 -36,-3.4 -2,-0.4 2,-0.8 -0.972 8.6-149.0-121.8 121.6 0.5 25.4 14.0 78 78 A V E -de 41 114A 5 35,-2.8 37,-1.0 -2,-0.5 -36,-0.2 -0.788 23.0-173.5 -90.1 108.2 2.7 25.5 17.1 79 79 A Y E -d 42 0A 0 -38,-2.6 -36,-2.6 -2,-0.8 2,-0.3 -0.902 23.1-132.4-111.8 114.5 4.6 28.8 16.8 80 80 A P E +d 43 0A 5 0, 0.0 -36,-0.2 0, 0.0 2,-0.1 -0.478 35.9 163.7 -64.7 123.7 7.4 29.7 19.3 81 81 A F > + 0 0 50 -38,-2.9 3,-1.1 -2,-0.3 4,-0.2 -0.625 9.7 173.7-144.4 77.2 6.8 33.3 20.3 82 82 A A G > S+ 0 0 0 63,-2.5 3,-1.8 1,-0.3 2,-0.4 0.855 70.2 70.5 -55.2 -40.6 8.8 34.1 23.5 83 83 A H G 3 S+ 0 0 144 62,-0.6 -1,-0.3 1,-0.3 -39,-0.1 0.168 73.0 84.8 -70.7 22.3 7.9 37.8 23.6 84 84 A L G < S+ 0 0 36 -3,-1.1 -1,-0.3 -2,-0.4 2,-0.3 0.706 97.6 40.3 -88.6 -23.6 4.2 37.1 24.5 85 85 A S < - 0 0 15 -3,-1.8 3,-0.2 -4,-0.2 -40,-0.1 -0.793 65.4-148.3-121.7 164.7 5.4 37.0 28.1 86 86 A S S S+ 0 0 103 -2,-0.3 2,-0.6 1,-0.2 -1,-0.1 0.572 90.9 59.6-106.0 -16.9 7.9 38.9 30.3 87 87 A E S S- 0 0 118 0, 0.0 -40,-2.2 0, 0.0 -39,-0.3 -0.764 79.0-170.2-116.0 84.6 8.9 36.0 32.6 88 88 A L B -F 46 0B 58 -2,-0.6 -42,-0.3 -42,-0.3 2,-0.2 -0.367 19.9-123.3 -80.3 152.3 10.3 33.4 30.3 89 89 A A - 0 0 4 -44,-2.2 -42,-0.2 1,-0.1 -44,-0.1 -0.543 46.4 -84.3 -85.1 156.3 11.3 29.8 31.1 90 90 A K >> - 0 0 97 -2,-0.2 4,-2.0 -43,-0.1 3,-0.7 -0.253 46.5-105.4 -58.9 151.0 14.9 28.7 30.3 91 91 A P H 3> S+ 0 0 61 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.796 116.9 53.5 -47.8 -42.8 15.4 27.6 26.7 92 92 A S H 3> S+ 0 0 65 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.886 110.7 47.1 -66.6 -36.5 15.6 23.9 27.3 93 93 A V H <> S+ 0 0 18 -3,-0.7 4,-2.9 2,-0.2 5,-0.2 0.882 111.8 50.4 -70.7 -38.6 12.3 23.9 29.1 94 94 A A H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-0.3 0.933 112.2 47.6 -63.7 -45.0 10.7 26.0 26.3 95 95 A M H X S+ 0 0 113 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.941 113.0 49.4 -59.2 -48.4 12.0 23.5 23.8 96 96 A D H X S+ 0 0 53 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.938 115.4 41.7 -56.0 -53.8 10.7 20.6 25.8 97 97 A I H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.905 112.3 53.1 -65.5 -43.3 7.2 22.1 26.3 98 98 A L H X S+ 0 0 12 -4,-2.9 4,-1.8 -5,-0.2 -1,-0.2 0.891 112.7 47.0 -59.9 -37.4 6.9 23.3 22.7 99 99 A N H X S+ 0 0 71 -4,-2.2 4,-2.9 -5,-0.3 -2,-0.2 0.906 110.2 51.6 -70.5 -41.1 7.7 19.8 21.6 100 100 A R H X S+ 0 0 95 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.877 109.8 49.3 -64.1 -37.6 5.3 18.2 24.0 101 101 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.930 113.2 47.3 -66.5 -44.9 2.4 20.4 22.8 102 102 A Y H X S+ 0 0 27 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.940 114.1 46.2 -60.7 -50.0 3.2 19.6 19.2 103 103 A Q H X S+ 0 0 64 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.920 112.9 51.0 -60.6 -44.7 3.5 15.8 19.8 104 104 A G H X S+ 0 0 8 -4,-2.5 4,-1.3 -5,-0.2 -1,-0.2 0.899 110.4 46.5 -60.9 -45.0 0.3 15.8 21.9 105 105 A L H <>S+ 0 0 1 -4,-2.3 5,-1.9 2,-0.2 -1,-0.2 0.884 113.8 50.1 -65.8 -37.1 -1.8 17.6 19.3 106 106 A K H ><5S+ 0 0 117 -4,-2.1 3,-2.1 -5,-0.2 -2,-0.2 0.942 109.0 50.7 -65.9 -46.2 -0.4 15.3 16.6 107 107 A E H 3<5S+ 0 0 155 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.770 103.5 61.3 -63.2 -24.3 -1.2 12.2 18.7 108 108 A R T 3<5S- 0 0 119 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.509 123.9-103.4 -81.1 -3.3 -4.7 13.6 19.1 109 109 A G T < 5S+ 0 0 68 -3,-2.1 -3,-0.2 1,-0.3 2,-0.1 0.546 74.4 135.5 97.6 6.8 -5.2 13.4 15.3 110 110 A F < - 0 0 32 -5,-1.9 2,-0.9 1,-0.0 -1,-0.3 -0.488 63.5-112.7 -84.6 158.7 -4.8 17.1 14.2 111 111 A N E -e 75 0A 97 -37,-2.3 -35,-2.5 -2,-0.1 2,-0.4 -0.850 50.1-170.2 -89.2 110.3 -2.8 18.1 11.2 112 112 A V E -e 76 0A 16 -2,-0.9 2,-0.3 -37,-0.2 -35,-0.2 -0.885 18.1-172.3-117.4 139.3 -0.0 20.0 13.1 113 113 A G E -e 77 0A 9 -37,-2.6 -35,-2.8 -2,-0.4 2,-0.3 -0.774 4.9-173.5-118.2 163.3 2.8 22.2 11.9 114 114 A K E -e 78 0A 96 -2,-0.3 -35,-0.2 -37,-0.2 3,-0.0 -0.968 16.5-133.5-151.1 162.5 5.8 23.7 13.8 115 115 A A - 0 0 8 -37,-1.0 -84,-0.1 -2,-0.3 -85,-0.0 -0.870 42.1 -84.7-118.1 152.7 8.6 26.1 13.2 116 116 A P - 0 0 5 0, 0.0 3,-0.5 0, 0.0 2,-0.3 -0.199 46.5-118.8 -57.7 147.7 12.3 25.6 14.2 117 117 A F S S+ 0 0 16 1,-0.2 -93,-2.8 -92,-0.1 -22,-0.0 -0.677 83.9 30.3 -92.8 140.6 13.3 26.5 17.7 118 118 A G S S+ 0 0 0 -2,-0.3 -99,-2.8 1,-0.3 -98,-1.2 0.699 91.3 108.4 92.5 23.6 15.9 29.1 18.7 119 119 A Y E -C 18 0A 21 -3,-0.5 2,-0.5 -101,-0.3 -1,-0.3 -0.885 68.7-121.3-132.2 160.6 15.5 31.7 15.9 120 120 A Y E - 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