==== 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 BIOSYNTHETIC PROTEIN 27-JUL-04 1VLI . COMPND 2 MOLECULE: SPORE COAT POLYSACCHARIDE BIOSYNTHESIS PROTEIN SP . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 358 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16115.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 65.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 5.6 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 . 1 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 . 18 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 3 1 0 0 4 0 1 0 1 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 3 2 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 PARALLEL BRIDGES PER LADDER . 5 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 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 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 2 A A 0 0 61 0, 0.0 11,-2.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 103.9 -20.6 28.7 83.7 2 3 A A E +A 11 0A 60 9,-0.3 2,-0.3 195,-0.1 9,-0.2 -0.975 360.0 164.0-155.7 152.9 -19.5 29.8 87.2 3 4 A F E -A 10 0A 19 7,-1.8 7,-2.3 -2,-0.3 2,-0.5 -0.958 34.5 -94.3-161.4 178.8 -17.4 28.5 90.2 4 5 A Q E -A 9 0A 96 -2,-0.3 2,-0.7 5,-0.2 5,-0.2 -0.900 17.0-170.1-109.0 121.3 -15.6 29.5 93.4 5 6 A I E > S-A 8 0A 0 3,-2.8 3,-1.8 -2,-0.5 2,-0.2 -0.937 76.4 -52.0 -98.0 112.9 -11.9 30.2 93.8 6 7 A A T 3 S- 0 0 54 -2,-0.7 89,-0.0 109,-0.4 -2,-0.0 -0.442 125.2 -18.1 57.7-118.7 -11.5 30.4 97.6 7 8 A N T 3 S+ 0 0 128 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.125 122.8 88.9-101.2 20.8 -14.2 32.9 98.7 8 9 A K E < -A 5 0A 73 -3,-1.8 -3,-2.8 6,-0.0 2,-0.2 -0.954 68.9-125.7-134.6 134.7 -14.7 34.4 95.3 9 10 A T E -A 4 0A 59 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.501 19.3-167.6 -81.5 145.4 -16.9 33.8 92.2 10 11 A V E +A 3 0A 0 -7,-2.3 -7,-1.8 -2,-0.2 2,-0.3 -0.999 52.3 14.5-131.9 126.1 -15.4 33.4 88.8 11 12 A G E > S+A 2 0A 0 -2,-0.4 3,-2.2 4,-0.3 -9,-0.3 -0.803 96.3 40.5 114.6-153.7 -17.6 33.5 85.6 12 13 A K T 3 S- 0 0 77 -11,-2.4 -2,-0.1 -2,-0.3 -9,-0.0 -0.027 129.4 -11.3 -44.3 119.3 -21.2 34.5 84.8 13 14 A D T 3 S+ 0 0 159 1,-0.2 -1,-0.3 -11,-0.0 -11,-0.1 0.249 107.9 117.7 74.6 -10.5 -22.1 37.8 86.6 14 15 A A S < S- 0 0 9 -3,-2.2 -1,-0.2 1,-0.1 -3,-0.2 -0.535 75.3 -95.7 -79.2 153.7 -19.0 37.6 88.8 15 16 A P - 0 0 81 0, 0.0 -4,-0.3 0, 0.0 -1,-0.1 -0.302 54.1 -84.9 -60.5 150.2 -16.3 40.4 88.7 16 17 A V - 0 0 2 -6,-0.1 2,-0.7 239,-0.1 207,-0.2 -0.370 44.4-126.8 -55.9 134.7 -13.3 39.6 86.5 17 18 A F E -b 223 0B 2 205,-2.9 207,-1.9 -3,-0.1 2,-0.6 -0.827 25.4-154.1 -93.3 116.1 -10.8 37.5 88.5 18 19 A I E -b 224 0B 0 -2,-0.7 29,-2.1 205,-0.2 28,-2.0 -0.829 9.3-166.7-103.6 122.1 -7.3 39.2 88.3 19 20 A I E -bc 225 47B 0 205,-2.9 207,-1.9 -2,-0.6 2,-0.6 -0.910 8.1-155.5-108.8 112.4 -4.1 37.2 88.7 20 21 A A E -bc 226 48B 0 27,-2.7 29,-3.0 -2,-0.6 2,-0.8 -0.818 15.9-146.9 -85.6 122.6 -0.9 39.1 89.3 21 22 A E E +bc 227 49B 26 205,-3.0 207,-2.0 -2,-0.6 29,-0.2 -0.802 25.2 171.9-101.9 102.0 1.9 36.9 88.1 22 23 A A E > + 0 0 0 27,-2.5 3,-2.3 -2,-0.8 2,-0.3 0.748 15.2 173.7 -80.4 -28.8 5.0 37.4 90.2 23 24 A G E 3 S- c 0 50B 3 26,-1.4 28,-2.0 1,-0.3 -1,-0.2 -0.398 70.3 -33.3 63.7-115.8 6.9 34.5 88.6 24 25 A I T > S+ 0 0 48 -2,-0.3 3,-1.8 26,-0.1 4,-0.3 0.156 99.3 122.8-119.3 14.3 10.5 34.5 90.0 25 26 A N T < + 0 0 1 -3,-2.3 205,-0.3 1,-0.3 -2,-0.1 0.333 53.0 82.9 -67.0 8.7 10.7 38.3 90.3 26 27 A H T > S- 0 0 6 203,-0.1 3,-2.3 -4,-0.1 6,-0.3 0.494 90.1-142.0 -82.2 -8.6 11.5 38.1 94.1 27 28 A D T < - 0 0 53 -3,-1.8 -2,-0.1 1,-0.3 3,-0.1 0.728 61.9 -61.1 53.1 31.3 15.1 37.4 93.0 28 29 A G T 3 S+ 0 0 54 -4,-0.3 2,-0.6 1,-0.2 -1,-0.3 0.633 109.4 122.6 71.2 16.8 15.6 34.9 95.8 29 30 A K X> - 0 0 99 -3,-2.3 4,-1.6 1,-0.1 3,-0.6 -0.948 52.1-156.2-114.4 116.0 14.9 37.5 98.5 30 31 A L H 3> S+ 0 0 51 -2,-0.6 4,-2.1 1,-0.3 5,-0.1 0.829 95.1 54.0 -59.2 -38.4 12.0 36.6 100.8 31 32 A D H 3> S+ 0 0 117 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.837 107.2 52.2 -66.6 -31.2 11.3 40.3 101.8 32 33 A Q H <> S+ 0 0 25 -3,-0.6 4,-1.8 -6,-0.3 -2,-0.2 0.804 105.9 54.7 -72.5 -32.7 11.1 41.1 98.0 33 34 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 -7,-0.2 -2,-0.2 0.930 108.4 48.3 -62.1 -45.6 8.5 38.2 97.8 34 35 A F H X S+ 0 0 57 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.845 109.5 53.9 -60.4 -36.7 6.5 40.0 100.5 35 36 A A H X S+ 0 0 30 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.864 106.1 51.2 -69.2 -34.8 6.8 43.3 98.6 36 37 A L H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.975 109.1 51.0 -65.1 -51.1 5.4 41.7 95.4 37 38 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.908 110.3 51.0 -42.9 -51.2 2.5 40.4 97.5 38 39 A D H X S+ 0 0 37 -4,-2.3 4,-3.0 1,-0.2 5,-0.3 0.902 109.0 49.5 -55.3 -49.5 2.1 44.0 98.8 39 40 A A H X S+ 0 0 3 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.895 111.3 49.0 -60.0 -43.1 2.1 45.5 95.3 40 41 A A H X>S+ 0 0 0 -4,-2.5 5,-2.4 2,-0.2 4,-0.5 0.899 114.6 45.8 -60.4 -46.9 -0.5 43.0 94.1 41 42 A A H ><5S+ 0 0 23 -4,-2.3 3,-1.2 -5,-0.2 -2,-0.2 0.915 112.3 48.6 -61.9 -50.8 -2.8 43.8 97.1 42 43 A E H 3<5S+ 0 0 138 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.867 109.5 55.3 -63.5 -35.7 -2.4 47.6 96.8 43 44 A A H 3<5S- 0 0 4 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.669 116.1-117.9 -66.6 -18.9 -3.2 47.2 93.1 44 45 A G T <<5 + 0 0 37 -3,-1.2 -3,-0.2 -4,-0.5 -26,-0.1 0.772 55.6 159.8 81.2 27.3 -6.5 45.4 94.0 45 46 A A < - 0 0 8 -5,-2.4 -1,-0.2 -6,-0.1 -26,-0.2 -0.400 39.0-141.1 -69.7 158.5 -5.6 42.1 92.3 46 47 A D S S+ 0 0 15 -28,-2.0 49,-1.9 1,-0.2 2,-0.3 0.754 78.9 19.3 -90.4 -31.0 -7.5 38.9 93.3 47 48 A A E -cd 19 95B 0 -29,-2.1 -27,-2.7 47,-0.2 2,-0.4 -0.936 60.0-148.9-142.5 154.3 -4.7 36.5 93.2 48 49 A V E -cd 20 96B 0 47,-2.5 49,-2.2 -2,-0.3 2,-0.5 -0.999 18.9-152.7-131.1 132.8 -0.9 36.5 93.3 49 50 A K E -cd 21 97B 9 -29,-3.0 -27,-2.5 -2,-0.4 -26,-1.4 -0.939 13.0-178.9-118.0 126.8 1.0 33.8 91.4 50 51 A F E -c 23 0B 0 47,-1.9 2,-0.5 -2,-0.5 49,-0.5 -0.907 30.7-117.1-117.6 144.2 4.5 32.4 92.2 51 52 A Q + 0 0 70 -28,-2.0 26,-0.1 -2,-0.3 3,-0.1 -0.697 33.0 172.7 -74.8 125.3 6.6 29.7 90.5 52 53 A X + 0 0 7 -2,-0.5 24,-3.4 47,-0.4 25,-0.5 0.747 55.9 57.9-102.3 -30.2 7.2 26.9 92.9 53 54 A F B S-J 75 0C 12 46,-0.3 22,-0.2 22,-0.3 2,-0.1 -0.813 79.1-116.9-114.7 144.3 8.9 24.3 90.7 54 55 A Q > - 0 0 59 20,-2.2 3,-0.6 -2,-0.3 4,-0.1 -0.433 20.8-127.2 -75.2 150.6 12.1 24.4 88.6 55 56 A A G > S+ 0 0 43 1,-0.2 3,-2.0 2,-0.1 4,-0.4 0.756 96.9 75.5 -72.1 -27.8 11.9 23.9 84.8 56 57 A D G >> S+ 0 0 110 1,-0.3 3,-2.0 2,-0.2 4,-1.5 0.851 84.6 64.5 -50.6 -44.3 14.5 21.1 84.6 57 58 A R G <4 S+ 0 0 37 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.1 0.592 95.5 62.2 -59.7 -12.6 12.0 18.5 85.9 58 59 A X G <4 S+ 0 0 26 -3,-2.0 260,-3.3 -4,-0.1 -1,-0.3 0.702 109.7 35.6 -86.4 -19.7 9.9 19.0 82.8 59 60 A Y T <4 S+ 0 0 95 -3,-2.0 2,-0.3 -4,-0.4 -2,-0.2 0.647 124.6 28.9-109.1 -25.3 12.6 17.9 80.2 60 61 A Q S < S- 0 0 63 -4,-1.5 2,-0.3 257,-0.0 -1,-0.3 -0.999 77.9-119.4-141.7 134.7 14.3 15.0 82.2 61 62 A K - 0 0 81 -2,-0.3 -3,-0.1 -3,-0.1 -4,-0.0 -0.607 31.9-145.0 -69.4 130.1 13.0 12.6 84.9 62 63 A D 0 0 134 -2,-0.3 -1,-0.0 1,-0.2 -5,-0.0 -0.895 360.0 360.0-105.8 122.1 15.0 13.0 88.1 63 64 A P 0 0 151 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.886 360.0 360.0 -80.2 360.0 15.9 10.0 90.3 64 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 65 74 A D 0 0 159 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 101.6 11.7 6.1 98.9 66 75 A V - 0 0 102 1,-0.1 2,-0.2 2,-0.0 0, 0.0 -0.335 360.0-128.4 -74.9 130.5 12.5 9.7 98.0 67 76 A S >> - 0 0 56 -2,-0.1 4,-2.3 1,-0.1 3,-0.8 -0.431 7.2-136.3 -76.1 139.9 14.2 12.1 100.5 68 77 A I H 3> S+ 0 0 93 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.783 105.4 63.4 -62.3 -26.9 12.8 15.6 101.3 69 78 A F H 34 S+ 0 0 161 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.786 106.9 41.2 -73.7 -27.5 16.3 16.9 101.0 70 79 A S H X> S+ 0 0 58 -3,-0.8 3,-1.1 2,-0.1 4,-0.6 0.884 110.1 59.6 -82.7 -38.5 16.4 16.0 97.4 71 80 A L H >< S+ 0 0 60 -4,-2.3 3,-1.9 1,-0.3 -2,-0.2 0.913 101.2 53.9 -48.8 -50.7 12.8 17.2 96.9 72 81 A V G >< S+ 0 0 57 -4,-2.3 3,-1.3 1,-0.3 -1,-0.3 0.733 96.4 65.9 -62.2 -23.8 13.7 20.8 97.9 73 82 A Q G <4 S+ 0 0 147 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.693 98.9 56.2 -68.0 -18.1 16.5 21.0 95.4 74 83 A S G << S+ 0 0 26 -3,-1.9 -20,-2.2 -4,-0.6 2,-0.3 0.383 91.8 91.3 -95.3 3.1 13.9 20.8 92.7 75 84 A X B < -J 53 0C 20 -3,-1.3 -22,-0.3 -22,-0.2 -23,-0.1 -0.684 69.7-137.3-105.0 153.8 11.9 23.8 93.9 76 85 A E S S+ 0 0 62 -24,-3.4 -23,-0.1 -2,-0.3 -24,-0.1 0.920 88.0 35.7 -75.4 -47.1 12.1 27.4 92.9 77 86 A X S S- 0 0 3 -25,-0.5 5,-0.1 -26,-0.1 -1,-0.0 -0.797 101.5 -87.8-105.6 152.3 11.8 29.1 96.3 78 87 A P > - 0 0 52 0, 0.0 3,-2.6 0, 0.0 4,-0.5 -0.331 35.1-125.6 -55.8 132.3 13.2 27.7 99.6 79 88 A A G > S+ 0 0 47 1,-0.3 3,-0.8 2,-0.2 4,-0.5 0.757 107.8 65.4 -51.5 -28.6 10.7 25.4 101.3 80 89 A E G 3 S+ 0 0 149 1,-0.2 -1,-0.3 2,-0.1 0, 0.0 0.576 93.7 62.5 -75.2 -7.1 10.8 27.5 104.5 81 90 A W G <> S+ 0 0 19 -3,-2.6 4,-2.8 2,-0.1 -1,-0.2 0.806 85.8 76.9 -77.3 -31.5 9.3 30.4 102.6 82 91 A I H <> S+ 0 0 12 -3,-0.8 4,-2.6 -4,-0.5 5,-0.2 0.839 92.3 42.4 -63.6 -53.3 6.0 28.7 101.8 83 92 A L H > S+ 0 0 120 -4,-0.5 4,-3.3 2,-0.2 -1,-0.2 0.960 117.9 49.1 -57.6 -51.4 3.9 28.8 105.0 84 93 A P H > S+ 0 0 53 0, 0.0 4,-2.7 0, 0.0 -2,-0.2 0.914 111.6 48.5 -51.2 -49.9 5.0 32.4 105.7 85 94 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.958 113.3 47.8 -56.5 -48.1 4.1 33.5 102.1 86 95 A L H X S+ 0 0 35 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.924 112.8 48.7 -59.4 -47.8 0.7 31.7 102.4 87 96 A D H X S+ 0 0 118 -4,-3.3 4,-2.0 1,-0.2 -1,-0.2 0.905 111.9 49.0 -52.9 -45.7 0.1 33.4 105.7 88 97 A Y H X S+ 0 0 50 -4,-2.7 4,-1.4 -5,-0.2 -2,-0.2 0.848 110.9 49.7 -71.1 -33.5 1.1 36.8 104.3 89 98 A C H <>S+ 0 0 2 -4,-2.7 5,-2.4 2,-0.2 4,-0.4 0.923 108.9 53.6 -62.5 -46.4 -1.3 36.3 101.3 90 99 A R H ><5S+ 0 0 122 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.869 111.8 44.7 -60.9 -37.1 -4.1 35.3 103.7 91 100 A E H 3<5S+ 0 0 137 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.767 111.8 49.6 -83.0 -20.9 -3.6 38.5 105.7 92 101 A K T 3<5S- 0 0 81 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.341 113.7-120.8 -92.9 9.0 -3.3 40.8 102.7 93 102 A Q T < 5 + 0 0 165 -3,-0.5 2,-0.3 -4,-0.4 -3,-0.2 0.867 69.0 129.9 53.1 43.6 -6.5 39.1 101.4 94 103 A V < - 0 0 10 -5,-2.4 2,-0.7 -6,-0.1 -47,-0.2 -0.929 59.3-118.9-119.6 154.0 -5.0 37.9 98.2 95 104 A I E -d 47 0B 15 -49,-1.9 -47,-2.5 -2,-0.3 2,-0.3 -0.822 22.5-138.4 -98.5 117.9 -5.2 34.4 96.9 96 105 A F E +d 48 0B 22 -2,-0.7 19,-0.6 -49,-0.2 2,-0.3 -0.560 28.1 176.9 -72.8 131.2 -1.9 32.5 96.4 97 106 A L E +d 49 0B 5 -49,-2.2 -47,-1.9 -2,-0.3 2,-0.3 -0.984 7.7 174.3-134.3 148.1 -1.7 30.5 93.3 98 107 A S - 0 0 1 18,-0.4 20,-1.1 -2,-0.3 2,-0.4 -0.885 27.3-107.3-139.6-177.7 1.0 28.4 91.6 99 108 A T B -e 118 0B 33 -49,-0.5 -47,-0.4 -2,-0.3 2,-0.3 -0.881 20.6-156.1-115.7 137.9 1.5 26.0 88.7 100 109 A V + 0 0 0 18,-2.0 20,-0.5 -2,-0.4 3,-0.1 -0.864 14.0 177.1-111.3 149.7 1.9 22.2 88.6 101 110 A C + 0 0 9 -2,-0.3 2,-0.3 1,-0.2 28,-0.1 0.326 65.1 12.5-131.3 2.0 3.6 20.2 85.9 102 111 A D S > S- 0 0 22 1,-0.1 4,-2.4 27,-0.1 -1,-0.2 -0.970 85.0 -85.5-163.0 177.3 3.5 16.6 87.1 103 112 A E H > S+ 0 0 57 -2,-0.3 4,-1.6 1,-0.2 5,-0.1 0.899 123.7 48.6 -55.2 -42.9 2.0 14.2 89.7 104 113 A G H > S+ 0 0 32 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.861 110.7 46.8 -71.0 -42.5 4.7 15.1 92.3 105 114 A S H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.895 111.1 56.3 -63.0 -39.3 4.5 18.9 92.0 106 115 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.889 106.8 48.4 -57.0 -40.8 0.7 18.4 92.2 107 116 A D H X S+ 0 0 75 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.864 110.0 50.9 -71.2 -39.6 1.1 16.5 95.5 108 117 A L H < S+ 0 0 48 -4,-1.7 4,-0.3 2,-0.2 3,-0.3 0.956 114.4 43.0 -61.6 -50.3 3.4 19.2 97.0 109 118 A L H >< S+ 0 0 1 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.889 109.8 58.4 -61.6 -41.2 0.9 22.0 96.1 110 119 A Q H >< S+ 0 0 66 -4,-2.4 3,-2.6 1,-0.3 -1,-0.2 0.894 94.6 65.2 -56.1 -38.4 -2.0 19.8 97.3 111 120 A S T 3< S+ 0 0 93 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.628 98.4 54.7 -69.0 -7.7 -0.4 19.6 100.7 112 121 A T T < S- 0 0 31 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.234 114.8-114.5-101.9 11.7 -0.9 23.4 101.1 113 122 A S < - 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