==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 11-MAR-08 3CIN . COMPND 2 MOLECULE: MYO-INOSITOL-1-PHOSPHATE SYNTHASE-RELATED PROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA MSB8; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 382 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16501.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 266 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 7.6 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 . 1 0.3 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 . 25 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 1 1 2 0 2 0 0 2 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 0 3 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 . 3 0 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 A H 0 0 159 0, 0.0 42,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 77.3 6.0 35.1 49.7 2 1 A M - 0 0 93 40,-0.1 2,-0.4 331,-0.0 45,-0.2 -0.783 360.0-157.7-124.6 155.2 5.5 32.2 47.3 3 2 A V E -a 47 0A 0 43,-2.7 45,-2.7 -2,-0.3 2,-0.5 -0.969 8.1-154.6-138.4 124.0 7.5 30.1 44.8 4 3 A K E -a 48 0A 31 -2,-0.4 122,-2.5 43,-0.2 123,-2.2 -0.867 18.7-161.8 -97.7 131.9 6.1 28.2 41.9 5 4 A V E -ab 49 127A 0 43,-2.8 45,-2.5 -2,-0.5 46,-1.0 -0.927 14.1-163.9-123.9 134.6 8.2 25.2 40.9 6 5 A L E -ab 51 128A 0 121,-2.7 123,-2.8 -2,-0.4 2,-0.4 -0.957 16.4-148.1-114.3 134.2 8.4 23.2 37.6 7 6 A I E -ab 52 129A 1 44,-2.5 46,-2.4 -2,-0.4 2,-0.6 -0.854 5.9-158.7-107.0 134.6 10.1 19.8 37.7 8 7 A L E S+ab 53 130A 0 121,-3.2 123,-3.1 -2,-0.4 46,-0.2 -0.952 76.0 21.1-109.8 110.9 12.0 18.2 34.8 9 8 A G - 0 0 9 44,-2.9 2,-1.5 -2,-0.6 5,-0.3 0.835 69.4-145.9 100.3 95.0 12.3 14.5 35.3 10 9 A Q + 0 0 0 43,-0.5 -1,-0.1 -3,-0.1 2,-0.1 -0.531 55.5 114.8 -92.9 68.7 9.8 12.8 37.6 11 10 A G S > S- 0 0 16 -2,-1.5 4,-2.5 120,-0.3 5,-0.2 -0.053 82.1 -48.9-111.2-144.6 11.9 10.1 39.2 12 11 A Y H > S+ 0 0 74 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.943 132.2 42.9 -64.9 -51.6 13.2 9.2 42.6 13 12 A V H > S+ 0 0 31 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.958 118.3 45.7 -58.6 -52.0 14.7 12.6 43.6 14 13 A A H > S+ 0 0 2 -5,-0.3 4,-2.2 117,-0.3 -1,-0.2 0.867 113.8 47.9 -57.5 -43.6 11.8 14.5 42.2 15 14 A S H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.841 110.9 50.6 -72.3 -31.4 9.2 12.3 43.8 16 15 A T H X S+ 0 0 13 -4,-2.3 4,-2.9 -5,-0.2 5,-0.3 0.912 109.6 52.5 -71.0 -40.5 11.0 12.4 47.2 17 16 A F H X S+ 0 0 2 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.936 114.2 43.1 -54.3 -47.6 11.1 16.2 47.0 18 17 A V H X S+ 0 0 5 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.932 116.7 44.5 -69.3 -44.8 7.4 16.3 46.3 19 18 A A H X S+ 0 0 4 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.904 115.6 47.9 -69.2 -41.9 6.4 13.7 48.9 20 19 A G H X S+ 0 0 25 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.915 110.9 51.2 -62.1 -44.9 8.7 15.3 51.6 21 20 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.3 5,-0.2 0.865 106.8 54.6 -63.9 -38.2 7.4 18.7 50.8 22 21 A E H X S+ 0 0 12 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.936 109.6 46.6 -59.0 -47.1 3.8 17.5 51.2 23 22 A K H <>S+ 0 0 45 -4,-2.0 5,-2.5 1,-0.2 6,-0.8 0.871 111.6 53.2 -63.1 -36.1 4.6 16.1 54.7 24 23 A L H ><5S+ 0 0 9 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.864 110.6 44.0 -68.3 -40.2 6.3 19.4 55.6 25 24 A R H 3<5S+ 0 0 52 -4,-2.3 -1,-0.2 19,-0.2 -2,-0.2 0.793 116.0 49.8 -71.1 -27.6 3.4 21.6 54.6 26 25 A K T 3<5S- 0 0 111 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.339 110.2-126.6 -92.2 7.2 1.1 19.0 56.4 27 26 A G T < 5S+ 0 0 56 -3,-0.6 -3,-0.2 2,-0.1 -4,-0.1 0.697 71.5 130.1 62.0 18.8 3.4 19.1 59.5 28 27 A E S + 0 0 12 0, 0.0 3,-1.9 0, 0.0 6,-0.2 -0.111 57.8 159.3 -77.7 44.3 12.5 19.7 58.1 32 31 A Y T 3 + 0 0 198 -2,-1.3 -3,-0.0 1,-0.3 0, 0.0 -0.330 68.4 29.2 -57.8 144.7 15.5 17.5 58.9 33 32 A G T 3 S+ 0 0 58 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.385 93.6 105.5 77.9 -4.7 17.8 17.4 55.9 34 33 A V X - 0 0 11 -3,-1.9 3,-1.2 1,-0.2 -1,-0.2 -0.907 63.1-154.5-103.7 102.1 16.7 20.9 54.8 35 34 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.850 89.4 34.0 -50.7 -44.9 19.7 23.0 55.8 36 35 A L T > S+ 0 0 0 1,-0.2 3,-2.8 -3,-0.1 4,-0.3 0.449 86.1 177.2 -95.4 0.8 18.0 26.4 56.3 37 36 A A T < - 0 0 30 -3,-1.2 3,-0.4 1,-0.3 -1,-0.2 -0.060 69.1 -15.7 42.6-125.1 14.8 24.8 57.6 38 37 A R T 3 S+ 0 0 133 1,-0.2 -1,-0.3 -4,-0.1 -2,-0.0 0.114 109.8 100.2 -98.9 20.0 12.3 27.6 58.6 39 38 A E < + 0 0 88 -3,-2.8 -1,-0.2 2,-0.0 -2,-0.1 0.649 65.2 83.0 -78.9 -17.1 14.9 30.4 58.6 40 39 A L S S- 0 0 11 -3,-0.4 337,-0.1 -4,-0.3 291,-0.0 -0.525 86.6-120.0 -88.0 157.5 13.9 31.7 55.2 41 40 A P S S+ 0 0 82 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.647 97.3 77.4 -66.8 -19.7 10.9 34.1 54.6 42 41 A I S S- 0 0 2 -40,-0.0 -2,-0.2 2,-0.0 2,-0.2 -0.858 75.3-153.1 -94.8 121.0 9.3 31.5 52.3 43 42 A G > - 0 0 18 -2,-0.5 3,-1.4 -42,-0.4 4,-0.1 -0.489 28.9-103.6 -91.0 172.0 7.6 28.7 54.2 44 43 A F G > S+ 0 0 1 1,-0.3 3,-1.4 2,-0.2 -19,-0.2 0.851 120.6 57.6 -68.1 -33.0 7.0 25.2 53.1 45 44 A E G 3 S+ 0 0 122 1,-0.3 -1,-0.3 -21,-0.2 -20,-0.1 0.664 99.1 63.0 -64.9 -21.1 3.3 25.8 52.5 46 45 A D G < S+ 0 0 47 -3,-1.4 -43,-2.7 -45,-0.1 2,-0.6 0.336 80.0 93.7 -86.9 -1.1 4.4 28.6 50.1 47 46 A I E < -a 3 0A 0 -3,-1.4 2,-0.5 -45,-0.2 -43,-0.2 -0.888 58.8-171.8 -95.5 116.9 6.2 26.2 47.6 48 47 A K E -a 4 0A 95 -45,-2.7 -43,-2.8 -2,-0.6 2,-0.8 -0.962 20.0-141.0-115.9 124.5 3.7 25.2 44.8 49 48 A I E +a 5 0A 4 -2,-0.5 -43,-0.2 -45,-0.2 3,-0.1 -0.739 25.3 172.6 -81.9 110.9 4.5 22.5 42.2 50 49 A V E + 0 0 16 -45,-2.5 2,-0.3 -2,-0.8 -44,-0.2 0.527 58.1 2.1 -95.8 -8.2 3.0 23.8 39.0 51 50 A G E -a 6 0A 2 -46,-1.0 -44,-2.5 31,-0.1 2,-0.3 -0.974 47.2-159.4-174.3 156.5 4.3 21.2 36.6 52 51 A S E -a 7 0A 0 31,-0.5 33,-2.8 -2,-0.3 2,-0.4 -0.971 13.6-164.5-147.3 129.3 6.2 18.0 36.0 53 52 A Y E +ac 8 85A 0 -46,-2.4 -44,-2.9 -2,-0.3 -43,-0.5 -0.906 15.2 156.9-116.9 144.4 7.8 16.8 32.7 54 53 A D E - c 0 86A 21 31,-2.6 33,-2.5 -2,-0.4 35,-0.0 -0.885 38.2-142.0-147.5 178.4 9.1 13.4 31.7 55 54 A V + 0 0 12 -2,-0.3 46,-2.3 31,-0.2 2,-0.5 0.363 66.7 112.6-122.9 -5.2 9.8 11.3 28.6 56 55 A D B >> -G 100 0B 24 44,-0.2 4,-2.5 1,-0.2 3,-1.6 -0.578 59.1-150.8 -73.0 121.0 8.6 8.0 30.1 57 56 A R T 34 S+ 0 0 133 42,-2.9 -1,-0.2 -2,-0.5 43,-0.1 0.808 97.8 60.8 -63.1 -28.6 5.5 6.9 28.2 58 57 A A T 34 S+ 0 0 60 41,-0.3 -1,-0.3 1,-0.2 42,-0.1 0.701 114.7 34.1 -67.0 -22.3 4.4 5.1 31.5 59 58 A K T X4 S+ 0 0 18 -3,-1.6 3,-2.2 2,-0.1 25,-0.4 0.742 89.0 101.9-104.1 -34.6 4.4 8.5 33.3 60 59 A I T 3< S+ 0 0 35 -4,-2.5 25,-0.2 1,-0.3 3,-0.1 -0.363 93.7 16.4 -61.6 126.9 3.3 11.0 30.7 61 60 A G T 3 S+ 0 0 40 23,-2.6 -1,-0.3 1,-0.4 2,-0.2 0.279 98.2 118.3 93.5 -11.7 -0.4 11.9 31.4 62 61 A K S < S- 0 0 77 -3,-2.2 22,-2.9 1,-0.1 -1,-0.4 -0.482 74.3-102.8 -75.4 154.4 -0.5 10.5 34.9 63 62 A K B >> -H 83 0C 41 20,-0.2 4,-1.4 -2,-0.2 3,-0.8 -0.568 30.3-116.1 -70.9 147.2 -1.2 12.7 37.8 64 63 A L H 3> S+ 0 0 0 18,-2.2 4,-2.9 1,-0.2 3,-0.3 0.903 116.1 58.1 -47.4 -45.9 1.9 13.7 39.8 65 64 A S H 3> S+ 0 0 18 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.828 100.8 54.8 -54.4 -38.4 0.4 11.8 42.8 66 65 A E H <> S+ 0 0 100 -3,-0.8 4,-0.6 2,-0.2 -1,-0.2 0.878 113.9 41.2 -67.7 -37.1 0.1 8.5 40.9 67 66 A V H >X S+ 0 0 0 -4,-1.4 3,-1.0 -3,-0.3 4,-0.7 0.923 112.5 53.3 -76.7 -47.5 3.8 8.6 40.0 68 67 A V H >X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 3,-1.7 0.918 104.0 57.8 -54.6 -42.7 5.0 9.9 43.5 69 68 A K H 3< S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.767 94.9 65.0 -62.2 -25.1 3.1 6.9 45.2 70 69 A Q H << S+ 0 0 117 -3,-1.0 -1,-0.3 -4,-0.6 3,-0.2 0.812 114.2 31.8 -64.3 -29.9 5.2 4.5 43.1 71 70 A Y H << S+ 0 0 55 -3,-1.7 2,-0.5 -4,-0.7 -2,-0.2 0.809 133.8 28.3 -93.2 -35.7 8.2 5.8 45.1 72 71 A W >< - 0 0 74 -4,-2.6 3,-1.9 3,-0.1 -1,-0.3 -0.892 66.1-167.7-132.7 96.2 6.5 6.6 48.4 73 72 A N T 3 S+ 0 0 122 -2,-0.5 -4,-0.1 1,-0.3 -1,-0.1 0.640 81.2 69.2 -64.1 -17.9 3.5 4.4 49.0 74 73 A D T 3 S+ 0 0 91 2,-0.0 2,-0.8 1,-0.0 -1,-0.3 0.671 77.6 93.1 -76.5 -14.0 2.3 6.6 52.0 75 74 A V < + 0 0 12 -3,-1.9 -3,-0.1 1,-0.2 3,-0.1 -0.678 40.1 160.3 -84.5 109.0 1.4 9.4 49.6 76 75 A D + 0 0 126 -2,-0.8 2,-0.3 1,-0.3 -1,-0.2 0.483 65.8 7.2-106.7 -5.2 -2.3 9.1 48.6 77 76 A S - 0 0 67 -12,-0.1 2,-0.3 3,-0.0 -1,-0.3 -0.968 59.9-144.0-164.6 163.9 -2.8 12.7 47.5 78 77 A L - 0 0 16 -2,-0.3 3,-0.1 1,-0.1 -13,-0.1 -0.991 21.4-130.9-136.7 148.1 -1.1 16.0 46.9 79 78 A T S S+ 0 0 97 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.854 108.2 27.9 -64.8 -44.2 -2.2 19.6 47.4 80 79 A S S S+ 0 0 28 -3,-0.1 -1,-0.2 2,-0.0 -31,-0.1 -0.998 75.8 175.6-118.0 123.8 -1.1 20.5 43.8 81 80 A D + 0 0 52 -2,-0.4 -31,-0.1 -3,-0.1 -3,-0.0 -0.552 6.6 176.6-133.9 63.4 -1.4 17.5 41.5 82 81 A P - 0 0 28 0, 0.0 -18,-2.2 0, 0.0 2,-0.3 -0.282 35.4-103.5 -68.0 156.3 -0.6 18.4 37.9 83 82 A E B -H 63 0C 101 -20,-0.2 -31,-0.5 -19,-0.1 -20,-0.2 -0.591 39.6-107.8 -80.6 142.5 -0.5 15.9 35.1 84 83 A I - 0 0 3 -22,-2.9 -23,-2.6 -25,-0.4 -31,-0.2 -0.494 39.1-150.4 -75.8 133.5 2.9 14.9 33.9 85 84 A R E -c 53 0A 110 -33,-2.8 -31,-2.6 -2,-0.2 2,-0.4 -0.660 18.0 -96.8-107.2 159.7 3.8 16.4 30.5 86 85 A K E +c 54 0A 75 -2,-0.2 -31,-0.2 -33,-0.2 16,-0.1 -0.638 41.8 178.6 -80.3 126.7 6.0 15.4 27.6 87 86 A G - 0 0 0 -33,-2.5 16,-3.0 -2,-0.4 2,-0.4 0.229 38.9 -74.3 -93.6-146.9 9.5 16.8 27.4 88 87 A V - 0 0 1 14,-0.3 14,-0.1 15,-0.2 76,-0.1 -0.994 37.8-171.3-121.3 132.1 12.4 16.3 25.0 89 88 A H > + 0 0 29 -2,-0.4 3,-2.4 1,-0.1 71,-0.3 0.858 15.9 161.9 -95.5 -39.4 14.3 13.0 25.2 90 89 A L T 3 S- 0 0 9 1,-0.3 3,-0.2 69,-0.1 -1,-0.1 -0.221 80.7 -30.7 39.6-127.9 17.3 13.2 23.0 91 90 A G T > S+ 0 0 38 67,-0.4 3,-1.1 64,-0.2 4,-0.3 0.344 105.7 113.2 -93.3 8.6 19.7 10.4 24.2 92 91 A S T < S+ 0 0 14 -3,-2.4 3,-0.3 1,-0.3 -1,-0.2 0.838 86.6 20.6 -55.4 -51.6 18.7 10.4 27.9 93 92 A V T > S+ 0 0 10 -3,-0.2 3,-2.0 -4,-0.2 5,-0.5 0.144 84.8 117.3-105.7 16.8 17.0 7.0 28.4 94 93 A R T < S+ 0 0 173 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.790 82.6 42.4 -58.5 -32.1 18.5 5.2 25.4 95 94 A N T 3 S+ 0 0 77 153,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 0.344 104.6 81.4 -97.4 5.2 20.2 2.7 27.6 96 95 A L S < S- 0 0 14 -3,-2.0 2,-2.5 2,-0.1 -3,-0.0 -0.791 89.5-107.1-113.8 155.9 17.3 2.1 30.0 97 96 A P S S+ 0 0 120 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 -0.351 78.6 121.5 -78.9 60.5 14.2 -0.0 29.9 98 97 A I - 0 0 29 -2,-2.5 2,-0.9 -5,-0.5 -2,-0.1 -0.990 64.4-133.1-126.0 131.8 12.0 3.0 29.4 99 98 A E - 0 0 117 -2,-0.4 -42,-2.9 2,-0.0 -41,-0.3 -0.790 38.3-148.6 -83.9 107.3 9.7 3.6 26.4 100 99 A A B +G 56 0B 41 -2,-0.9 2,-0.3 -44,-0.2 -44,-0.2 -0.541 23.2 179.1 -87.6 141.7 10.6 7.2 25.5 101 100 A E + 0 0 48 -46,-2.3 -14,-0.3 -2,-0.2 2,-0.3 -0.997 8.8 173.1-137.0 148.8 8.5 10.0 24.0 102 101 A G > - 0 0 1 -2,-0.3 3,-1.6 -16,-0.1 4,-0.3 -0.991 44.0-119.6-151.9 146.9 9.6 13.5 23.2 103 102 A L G > S+ 0 0 11 -16,-3.0 3,-2.1 -2,-0.3 4,-0.4 0.891 111.3 64.6 -52.7 -35.8 8.4 16.7 21.5 104 103 A E G 3 S+ 0 0 4 1,-0.3 -1,-0.2 2,-0.2 5,-0.1 0.502 82.8 76.8 -80.7 0.6 11.4 16.4 19.1 105 104 A D G < S+ 0 0 99 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.689 111.3 25.5 -70.4 -24.5 10.0 13.2 17.6 106 105 A S S < S+ 0 0 90 -3,-2.1 2,-0.3 -4,-0.3 -2,-0.2 0.296 130.1 25.6-123.6 6.2 7.5 15.4 15.7 107 106 A M S S- 0 0 46 -4,-0.4 -1,-0.1 0, 0.0 2,-0.1 -0.970 84.9 -84.1-161.3 164.3 9.3 18.7 15.4 108 107 A T > - 0 0 52 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.335 43.8-107.9 -70.5 164.9 12.7 20.3 15.3 109 108 A L H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.908 121.9 53.8 -58.9 -40.4 14.6 21.2 18.5 110 109 A K H > S+ 0 0 92 40,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.913 111.9 44.4 -62.4 -42.5 14.0 24.9 17.9 111 110 A E H > S+ 0 0 99 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.878 111.1 53.4 -64.7 -42.2 10.3 24.2 17.6 112 111 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.912 109.0 50.4 -60.9 -43.3 10.3 21.9 20.7 113 112 A V H X S+ 0 0 1 -4,-2.9 4,-2.8 2,-0.2 -2,-0.2 0.944 109.7 48.9 -59.6 -49.9 11.9 24.7 22.7 114 113 A D H X S+ 0 0 93 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.875 111.4 51.7 -59.7 -36.8 9.3 27.3 21.5 115 114 A T H X S+ 0 0 44 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.926 110.0 47.8 -63.9 -49.4 6.6 24.7 22.5 116 115 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.941 111.0 52.0 -51.9 -49.2 8.1 24.3 26.0 117 116 A V H X S+ 0 0 15 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.922 109.4 48.9 -59.1 -48.6 8.3 28.1 26.4 118 117 A K H X S+ 0 0 66 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.939 114.0 46.3 -57.7 -46.5 4.7 28.5 25.5 119 118 A E H >X S+ 0 0 55 -4,-2.4 4,-1.7 1,-0.2 3,-0.6 0.930 112.7 49.9 -58.2 -45.8 3.6 25.7 28.0 120 119 A W H 3X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.850 101.4 62.3 -65.5 -34.4 5.8 27.1 30.7 121 120 A T H 3< S+ 0 0 61 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.854 107.5 44.9 -61.5 -31.5 4.4 30.6 30.3 122 121 A E H << S+ 0 0 162 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.812 114.4 46.5 -80.2 -31.8 1.0 29.3 31.2 123 122 A L H < S- 0 0 39 -4,-1.7 -2,-0.2 2,-0.0 -1,-0.2 0.768 95.6-156.3 -77.3 -29.3 2.3 27.2 34.2 124 123 A D < - 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