==== 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 DNA BINDING PROTEIN 07-AUG-09 3ILE . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ACIDIANUS FILAMENTOUS VIRUS 1; . AUTHOR A.GOULET,J.LICHIERE,D.PRANGISHVILI,H.VAN TILBEURGH,C.CAMBILL . 149 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8762.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 108 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 34.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 16 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 17.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.0 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 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 2 0 1 0 0 0 1 1 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 1 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 6 A V 0 0 120 0, 0.0 2,-0.3 0, 0.0 45,-0.2 0.000 360.0 360.0 360.0 168.9 -51.0 -1.1 7.1 2 7 A V - 0 0 26 43,-0.4 43,-2.6 71,-0.0 2,-0.3 -0.952 360.0-124.8-153.2 132.4 -49.0 -0.4 3.9 3 8 A E E -A 44 0A 131 -2,-0.3 2,-0.3 41,-0.2 41,-0.2 -0.564 31.2-179.6 -77.9 138.0 -45.3 -0.5 3.2 4 9 A Y E -A 43 0A 37 39,-2.2 39,-1.9 -2,-0.3 2,-0.4 -0.887 13.2-141.4-136.7 162.9 -43.6 2.6 1.7 5 10 A E E +A 42 0A 103 -2,-0.3 2,-0.3 37,-0.2 37,-0.2 -0.979 19.0 165.7-136.7 126.1 -40.1 3.6 0.6 6 11 A V E -A 41 0A 2 35,-2.2 35,-2.2 -2,-0.4 2,-0.4 -0.817 34.2-104.3-125.3 172.9 -37.8 6.7 0.7 7 12 A V E +A 40 0A 36 -2,-0.3 11,-2.5 33,-0.2 2,-0.3 -0.795 32.1 166.0-101.3 137.1 -34.0 7.5 0.2 8 13 A S E +C 17 0B 0 31,-1.4 2,-0.3 -2,-0.4 9,-0.2 -0.831 25.5 136.8-148.5 101.7 -31.5 8.2 3.0 9 14 A K E -C 16 0B 59 7,-2.8 7,-1.8 -2,-0.3 2,-0.3 -0.986 32.2-167.7-154.7 138.3 -27.9 8.0 1.8 10 15 A N E +C 15 0B 14 109,-0.6 108,-2.8 -2,-0.3 5,-0.2 -0.742 24.4 162.5-132.7 90.2 -24.8 10.1 2.2 11 16 A L - 0 0 61 3,-1.5 108,-0.0 -2,-0.3 -2,-0.0 -0.102 52.7 -83.3 -93.7-173.3 -21.9 9.3 -0.2 12 17 A T S S+ 0 0 108 1,-0.1 3,-0.1 -2,-0.1 105,-0.0 0.937 121.8 21.4 -60.3 -52.5 -18.7 11.0 -1.3 13 18 A S S S+ 0 0 62 46,-0.1 46,-2.2 1,-0.1 47,-0.8 0.836 126.7 18.3 -90.6 -37.2 -20.2 13.3 -4.0 14 19 A K E - D 0 58B 85 44,-0.2 -3,-1.5 45,-0.1 2,-0.3 -0.838 54.0-149.7-134.2 169.7 -24.0 13.6 -3.1 15 20 A M E -CD 10 57B 3 42,-1.7 42,-3.0 -2,-0.3 2,-0.6 -0.959 2.2-167.6-145.6 124.4 -26.5 13.1 -0.4 16 21 A S E +CD 9 56B 20 -7,-1.8 -7,-2.8 -2,-0.3 2,-0.6 -0.952 14.3 179.5-112.7 114.0 -30.2 12.2 -0.7 17 22 A H E +CD 8 55B 0 38,-3.0 38,-2.4 -2,-0.6 2,-0.5 -0.927 4.8 169.3-122.9 103.2 -32.0 12.7 2.6 18 23 A E E + D 0 54B 19 -11,-2.5 2,-0.3 -2,-0.6 36,-0.2 -0.972 3.3 174.2-120.2 128.2 -35.7 11.9 2.7 19 24 A L E - D 0 53B 0 34,-2.3 34,-3.3 -2,-0.5 2,-0.5 -0.953 21.2-139.5-125.7 149.8 -37.8 11.7 5.8 20 25 A L E - D 0 52B 0 -2,-0.3 9,-2.8 32,-0.3 2,-0.3 -0.951 13.9-156.6-117.0 136.0 -41.5 11.2 6.2 21 26 A F E -ED 28 51B 1 30,-3.8 30,-1.1 -2,-0.5 2,-0.6 -0.745 18.3-123.5-105.5 144.2 -43.5 13.1 8.8 22 27 A S E >> -ED 27 50B 6 5,-2.7 4,-1.8 -2,-0.3 5,-0.8 -0.833 13.6-161.9 -95.3 120.8 -46.8 12.0 10.3 23 28 A V T 45S+ 0 0 22 26,-1.6 111,-0.2 -2,-0.6 -1,-0.2 0.925 94.8 42.0 -65.1 -43.2 -49.5 14.6 9.8 24 29 A K T 45S+ 0 0 187 25,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.981 118.2 44.0 -65.1 -58.1 -51.7 13.1 12.4 25 30 A K T 45S- 0 0 138 2,-0.1 -2,-0.2 1,-0.1 -1,-0.2 0.641 97.6-140.7 -67.1 -13.4 -48.8 12.4 14.9 26 31 A R T <5S+ 0 0 92 -4,-1.8 104,-1.6 1,-0.2 2,-0.3 0.818 73.8 68.6 54.5 34.1 -47.4 15.9 14.2 27 32 A W E > +B 40 0A 24 5,-3.5 5,-2.1 -2,-0.4 4,-0.9 -0.864 18.7 172.4-117.0 92.6 -31.0 -0.0 4.7 36 41 A R T 45S+ 0 0 137 -2,-0.8 -1,-0.2 3,-0.2 5,-0.0 0.876 81.9 59.6 -58.6 -39.0 -27.4 1.3 5.0 37 42 A Q T 45S+ 0 0 174 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.943 122.0 18.5 -61.5 -56.3 -26.6 -1.0 2.0 38 43 A L T 45S- 0 0 119 2,-0.1 -1,-0.2 -29,-0.0 -2,-0.2 0.347 109.1-116.1 -98.1 7.7 -28.9 0.5 -0.5 39 44 A G T <5 + 0 0 4 -4,-0.9 -31,-1.4 1,-0.2 2,-0.3 0.989 64.8 139.1 61.4 67.2 -29.4 3.8 1.4 40 45 A K E < -AB 7 35A 41 -5,-2.1 -5,-3.5 -33,-0.3 2,-0.4 -0.997 48.0-143.1-147.7 148.4 -33.1 3.5 2.2 41 46 A L E -AB 6 34A 0 -35,-2.2 -35,-2.2 -2,-0.3 2,-0.5 -0.921 18.8-154.3-111.8 136.7 -35.7 4.0 4.9 42 47 A H E -AB 5 33A 17 -9,-2.6 -10,-1.5 -2,-0.4 -9,-1.4 -0.948 12.3-170.3-117.5 125.6 -38.7 1.6 5.2 43 48 A Y E -A 4 0A 0 -39,-1.9 -39,-2.2 -2,-0.5 2,-0.7 -0.869 23.4-154.6-120.1 146.1 -42.0 2.6 6.6 44 49 A K E -A 3 0A 117 -14,-0.4 2,-0.6 -2,-0.4 -41,-0.2 -0.971 31.8-165.7-117.0 105.9 -45.1 0.9 7.7 45 50 A L - 0 0 0 -43,-2.6 -43,-0.4 -2,-0.7 3,-0.1 -0.881 21.4-134.7-104.3 122.0 -47.7 3.6 7.4 46 51 A L - 0 0 113 -2,-0.6 27,-0.1 -45,-0.2 2,-0.1 -0.379 51.5 -91.2 -58.3 134.8 -51.1 3.5 8.8 47 52 A P S S+ 0 0 49 0, 0.0 2,-0.3 0, 0.0 27,-0.1 -0.369 89.2 89.8 -47.9 124.1 -53.3 4.8 5.9 48 53 A G S S- 0 0 24 25,-0.2 25,-2.3 23,-0.1 2,-0.4 -0.957 79.3 -44.0 174.4-159.8 -53.5 8.6 6.3 49 54 A N E + F 0 72B 60 -2,-0.3 -26,-1.6 23,-0.2 -25,-0.6 -0.821 51.3 176.8-103.1 138.9 -51.8 11.8 5.4 50 55 A Y E -DF 22 71B 15 21,-1.4 21,-3.4 -2,-0.4 2,-0.5 -1.000 23.4-142.5-142.0 137.3 -48.0 12.3 5.4 51 56 A I E -DF 21 70B 1 -30,-1.1 -30,-3.8 -2,-0.3 2,-0.6 -0.874 15.8-154.5 -95.8 127.7 -45.5 14.9 4.6 52 57 A K E -DF 20 69B 29 17,-2.7 17,-2.6 -2,-0.5 2,-0.7 -0.907 6.6-150.9 -98.7 126.6 -42.2 13.8 3.0 53 58 A F E -DF 19 68B 0 -34,-3.3 -34,-2.3 -2,-0.6 2,-0.5 -0.866 13.6-164.3 -98.7 117.5 -39.3 16.1 3.6 54 59 A G E +DF 18 67B 0 13,-1.2 13,-2.8 -2,-0.7 2,-0.4 -0.858 15.2 175.5-105.2 128.3 -36.7 16.0 0.8 55 60 A L E -DF 17 66B 0 -38,-2.4 -38,-3.0 -2,-0.5 2,-0.5 -0.963 7.8-176.7-129.0 118.7 -33.1 17.3 1.0 56 61 A Y E -DF 16 65B 31 9,-2.4 9,-3.0 -2,-0.4 2,-0.5 -0.947 6.7-172.3-121.7 122.3 -30.9 16.6 -2.1 57 62 A V E -DF 15 64B 4 -42,-3.0 -42,-1.7 -2,-0.5 2,-0.9 -0.911 25.0-169.3-134.3 114.6 -27.3 17.7 -2.0 58 63 A L E > -DF 14 63B 74 5,-1.0 5,-3.0 -2,-0.5 -44,-0.2 -0.862 17.7-169.1 -91.8 106.9 -24.5 17.8 -4.6 59 64 A K T > 5S+ 0 0 66 -46,-2.2 3,-2.7 -2,-0.9 -1,-0.2 0.962 82.9 50.5 -66.6 -52.0 -21.7 18.6 -2.2 60 65 A N T 3 5S+ 0 0 128 -47,-0.8 -1,-0.2 1,-0.3 -46,-0.1 0.691 112.8 49.2 -59.3 -22.0 -19.1 19.3 -5.0 61 66 A Q T 3 5S- 0 0 142 -48,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.411 105.9-129.8 -93.6 2.0 -21.7 21.7 -6.5 62 67 A D T < 5 + 0 0 63 -3,-2.7 29,-1.9 1,-0.2 2,-0.4 0.840 63.1 151.8 43.0 39.2 -22.4 23.3 -3.1 63 68 A Y E < +FG 58 90B 56 -5,-3.0 -5,-1.0 27,-0.3 2,-0.4 -0.794 29.4 175.6-107.5 135.2 -25.9 22.5 -4.2 64 69 A A E -FG 57 89B 1 25,-2.7 25,-3.2 -2,-0.4 2,-0.5 -0.981 9.2-169.6-140.7 128.0 -28.9 21.8 -2.2 65 70 A R E -FG 56 88B 73 -9,-3.0 -9,-2.4 -2,-0.4 2,-0.5 -0.964 9.8-165.2-112.9 119.8 -32.5 21.2 -3.3 66 71 A F E +FG 55 87B 5 21,-2.4 21,-1.7 -2,-0.5 2,-0.2 -0.898 13.0 172.9-108.7 134.3 -35.1 21.2 -0.6 67 72 A E E -FG 54 86B 30 -13,-2.8 -13,-1.2 -2,-0.5 2,-0.3 -0.770 22.5-154.4-126.2 169.1 -38.6 19.8 -1.3 68 73 A I E -FG 53 85B 1 17,-1.7 16,-3.1 -2,-0.2 17,-1.0 -0.939 17.2-170.4-144.0 126.6 -41.8 18.9 0.5 69 74 A A E -FG 52 83B 2 -17,-2.6 -17,-2.7 -2,-0.3 2,-0.6 -0.922 20.1-132.2-122.0 145.8 -44.2 16.3 -0.9 70 75 A W E -FG 51 82B 75 12,-3.4 12,-1.5 -2,-0.4 2,-0.6 -0.871 21.6-163.4 -97.0 124.7 -47.7 15.4 0.2 71 76 A V E -FG 50 81B 0 -21,-3.4 -21,-1.4 -2,-0.6 2,-0.6 -0.871 5.0-171.6-116.4 104.0 -48.2 11.6 0.6 72 77 A H E -FG 49 80B 55 8,-2.6 8,-1.3 -2,-0.6 2,-0.5 -0.808 1.5-171.4-101.9 124.7 -51.7 10.4 0.6 73 78 A V E - G 0 79B 3 -25,-2.3 6,-0.2 -2,-0.6 2,-0.2 -0.940 6.1-156.1-119.7 124.8 -52.4 6.7 1.5 74 79 A D > - 0 0 62 4,-2.2 3,-2.7 -2,-0.5 -26,-0.1 -0.572 32.8-108.3 -99.6 166.4 -55.8 5.0 1.2 75 80 A K T 3 S+ 0 0 199 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.685 118.4 66.5 -65.9 -19.6 -57.2 2.0 2.9 76 81 A D T 3 S- 0 0 119 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.400 120.4-111.4 -74.9 0.0 -56.9 0.1 -0.4 77 82 A G < + 0 0 27 -3,-2.7 2,-0.3 1,-0.3 -2,-0.2 0.475 67.8 150.8 84.6 3.3 -53.1 0.5 0.1 78 83 A K - 0 0 94 1,-0.0 -4,-2.2 -76,-0.0 2,-0.4 -0.504 30.4-156.4 -74.3 128.8 -52.8 3.0 -2.8 79 84 A I E +G 73 0B 58 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.890 16.2 172.3-110.9 140.6 -50.0 5.6 -2.5 80 85 A E E -G 72 0B 97 -8,-1.3 -8,-2.6 -2,-0.4 2,-0.3 -0.949 6.4-175.0-149.1 117.3 -49.9 9.0 -4.3 81 86 A A E -G 71 0B 45 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.858 1.9-178.9-114.7 152.8 -47.3 11.6 -3.6 82 87 A R E -G 70 0B 175 -12,-1.5 -12,-3.4 -2,-0.3 2,-0.3 -0.992 28.6-118.3-146.7 141.5 -47.1 15.2 -5.0 83 88 A T E +G 69 0B 75 -2,-0.3 -14,-0.3 -14,-0.3 3,-0.1 -0.636 27.9 174.5 -81.4 141.1 -44.6 17.9 -4.5 84 89 A V E + 0 0 82 -16,-3.1 2,-0.3 1,-0.4 -15,-0.2 0.441 67.8 17.1-120.1 -7.9 -46.0 21.1 -2.9 85 90 A Y E +G 68 0B 24 -17,-1.0 -17,-1.7 2,-0.0 -1,-0.4 -0.971 58.5 168.1-165.5 149.6 -42.8 23.0 -2.5 86 91 A S E +G 67 0B 54 -2,-0.3 2,-0.3 -19,-0.2 -19,-0.2 -0.931 2.6 171.4-168.3 147.2 -39.3 23.0 -3.9 87 92 A I E -G 66 0B 23 -21,-1.7 -21,-2.4 -2,-0.3 2,-0.4 -0.965 19.0-143.4-156.8 154.8 -36.3 25.4 -3.8 88 93 A E E +G 65 0B 125 -2,-0.3 2,-0.3 -23,-0.2 -23,-0.2 -0.972 33.3 138.8-126.5 135.6 -32.7 25.2 -4.8 89 94 A T E -G 64 0B 21 -25,-3.2 -25,-2.7 -2,-0.4 2,-0.1 -0.912 53.1 -56.5-158.3-178.1 -29.8 26.9 -2.9 90 95 A Y E > -G 63 0B 144 -2,-0.3 4,-1.5 -27,-0.2 -27,-0.3 -0.429 37.0-139.1 -72.3 143.4 -26.3 26.6 -1.7 91 96 A W H > S+ 0 0 34 -29,-1.9 4,-3.1 1,-0.2 5,-0.3 0.881 103.9 62.3 -71.3 -36.0 -25.6 23.7 0.6 92 97 A H H > S+ 0 0 93 -30,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.830 103.6 49.0 -56.1 -35.5 -23.5 26.0 2.7 93 98 A I H > S+ 0 0 45 -3,-0.2 4,-1.3 2,-0.2 3,-0.4 0.898 111.0 49.4 -72.4 -39.4 -26.6 28.0 3.4 94 99 A F H X S+ 0 0 6 -4,-1.5 4,-0.8 1,-0.2 3,-0.5 0.914 108.4 52.2 -65.6 -42.5 -28.6 25.0 4.3 95 100 A I H < S+ 0 0 70 -4,-3.1 4,-0.5 1,-0.2 -1,-0.2 0.714 106.7 57.6 -64.2 -18.1 -25.9 23.7 6.7 96 101 A D H >< S+ 0 0 96 -4,-0.6 3,-0.7 -3,-0.4 4,-0.3 0.812 91.5 67.1 -83.2 -32.3 -26.1 27.1 8.3 97 102 A I H >< S+ 0 0 2 -4,-1.3 3,-2.1 -3,-0.5 -1,-0.2 0.837 86.9 70.6 -55.4 -36.7 -29.8 26.8 9.0 98 103 A E T 3< S+ 0 0 56 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.2 0.915 102.4 43.6 -45.7 -49.8 -29.0 24.1 11.6 99 104 A N T < S+ 0 0 129 -3,-0.7 2,-0.6 -4,-0.5 -1,-0.3 0.425 83.9 120.7 -79.9 1.3 -27.4 26.7 13.8 100 105 A D < - 0 0 47 -3,-2.1 3,-0.4 -4,-0.3 8,-0.1 -0.571 48.9-160.5 -73.4 117.6 -30.2 29.2 13.3 101 106 A L S S+ 0 0 173 -2,-0.6 2,-1.3 1,-0.3 -1,-0.2 0.959 83.4 42.8 -63.2 -58.9 -31.7 29.9 16.7 102 107 A N S S+ 0 0 150 2,-0.0 -1,-0.3 3,-0.0 -2,-0.0 -0.604 91.4 117.2 -93.5 75.2 -35.0 31.4 15.7 103 108 A C S S- 0 0 22 -2,-1.3 2,-0.5 -3,-0.4 38,-0.1 -0.863 78.9 -71.3-134.2 168.3 -36.0 29.0 12.9 104 109 A P > - 0 0 24 0, 0.0 4,-2.6 0, 0.0 5,-0.3 -0.471 47.8-148.7 -64.0 113.3 -38.8 26.5 12.1 105 110 A Y H > S+ 0 0 109 -2,-0.5 4,-3.0 1,-0.3 5,-0.3 0.944 92.3 52.8 -57.4 -58.0 -37.8 23.8 14.5 106 111 A V H > S+ 0 0 6 2,-0.2 4,-3.5 1,-0.2 -1,-0.3 0.873 113.1 49.4 -46.9 -36.9 -39.0 20.7 12.6 107 112 A L H > S+ 0 0 1 1,-0.2 4,-2.3 -3,-0.2 5,-0.3 0.990 110.8 46.6 -65.9 -55.7 -36.9 22.2 9.7 108 113 A A H X S+ 0 0 14 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.769 116.8 48.5 -53.5 -25.4 -33.8 22.7 12.0 109 114 A K H X S+ 0 0 46 -4,-3.0 4,-1.8 -5,-0.3 -2,-0.2 0.931 107.4 51.6 -83.8 -48.5 -34.5 19.1 13.2 110 115 A F H >< S+ 0 0 0 -4,-3.5 3,-0.9 -5,-0.3 -2,-0.2 0.952 113.1 46.2 -43.6 -59.2 -34.9 17.5 9.8 111 116 A I H >< S+ 0 0 0 -4,-2.3 3,-2.0 1,-0.3 -1,-0.2 0.925 110.2 55.3 -49.8 -50.0 -31.6 18.9 8.7 112 117 A E H 3< S+ 0 0 97 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.740 102.9 54.7 -63.0 -24.5 -30.1 17.8 11.9 113 118 A M T << S+ 0 0 21 -4,-1.8 9,-0.3 -3,-0.9 -1,-0.3 0.083 78.9 138.2 -93.3 22.4 -31.2 14.2 11.4 114 119 A R < - 0 0 60 -3,-2.0 2,-0.1 1,-0.1 8,-0.1 -0.269 64.7 -83.3 -60.9 154.1 -29.4 14.1 8.0 115 120 A P - 0 0 2 0, 0.0 6,-0.2 0, 0.0 2,-0.2 -0.405 36.9-127.7 -63.5 134.8 -27.5 10.8 7.3 116 121 A E > - 0 0 131 4,-0.6 3,-3.0 1,-0.2 -106,-0.3 -0.462 59.5 -57.8 -72.0 152.9 -24.0 10.3 8.6 117 122 A F T 3 S- 0 0 117 1,-0.3 -106,-0.2 -2,-0.2 -1,-0.2 -0.029 121.8 -12.3 -44.2 121.5 -21.4 9.2 5.9 118 123 A H T 3 S+ 0 0 102 -108,-2.8 -1,-0.3 1,-0.2 2,-0.2 0.572 119.8 98.5 63.5 12.8 -22.6 6.0 4.2 119 124 A K S < S- 0 0 67 -3,-3.0 -109,-0.6 -109,-0.2 2,-0.3 -0.573 75.1-118.1-111.6 178.7 -25.2 5.5 6.9 120 125 A T - 0 0 6 -2,-0.2 -4,-0.6 -111,-0.1 -111,-0.1 -0.697 31.1-105.1-109.5 169.8 -28.8 6.3 6.8 121 126 A A - 0 0 5 -2,-0.3 2,-0.3 -6,-0.2 -7,-0.1 -0.346 38.3-146.5 -76.1 176.0 -30.5 8.8 9.0 122 127 A W - 0 0 130 -9,-0.3 2,-0.4 -8,-0.1 -92,-0.1 -0.994 6.7-138.5-147.8 153.1 -32.7 7.5 11.8 123 128 A V - 0 0 2 -2,-0.3 2,-0.3 -92,-0.1 3,-0.0 -0.894 21.5-134.9-112.8 143.4 -35.9 8.5 13.7 124 129 A E - 0 0 117 -2,-0.4 -96,-0.1 1,-0.1 -94,-0.1 -0.806 27.3 -94.3-107.4 149.2 -36.4 8.1 17.5 125 130 A E + 0 0 149 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 -0.087 61.3 160.0 -57.0 137.0 -39.2 6.9 19.6 126 131 A S - 0 0 42 -98,-0.1 -96,-0.1 1,-0.1 -99,-0.0 -0.997 48.6-174.3-156.1 151.0 -41.4 9.8 20.5 127 132 A N + 0 0 156 -2,-0.3 2,-0.1 2,-0.0 -1,-0.1 0.133 59.3 125.7-121.2 8.9 -44.8 11.1 21.7 128 133 A Y - 0 0 128 1,-0.0 2,-0.4 0, 0.0 -2,-0.0 -0.377 40.6-167.1 -72.3 146.8 -43.6 14.7 21.2 129 134 A S - 0 0 61 -2,-0.1 -102,-0.2 -102,-0.1 -103,-0.1 -0.997 16.1-128.5-137.8 139.7 -45.7 17.1 19.1 130 135 A I - 0 0 22 -104,-1.6 7,-0.0 -2,-0.4 -103,-0.0 -0.211 28.1-115.0 -72.4 169.8 -45.0 20.5 17.6 131 136 A A S S+ 0 0 102 2,-0.1 2,-0.1 6,-0.0 -1,-0.1 0.830 85.5 66.1 -77.6 -33.6 -47.4 23.4 18.1 132 137 A E S S- 0 0 68 1,-0.1 2,-0.1 -106,-0.1 -2,-0.1 -0.383 78.6-113.9 -92.2 161.5 -48.7 24.1 14.6 133 138 A D > - 0 0 66 -2,-0.1 4,-3.1 1,-0.1 5,-0.2 -0.458 44.5 -92.3 -83.0 171.5 -50.8 22.0 12.2 134 139 A D H > S+ 0 0 28 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.816 124.7 49.5 -58.0 -35.3 -49.3 20.8 8.9 135 140 A I H > S+ 0 0 101 2,-0.2 4,-3.0 3,-0.2 -1,-0.2 0.982 114.9 41.8 -64.9 -60.5 -50.5 23.9 6.9 136 141 A Q H > S+ 0 0 102 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.929 116.9 52.5 -47.7 -48.9 -49.1 26.4 9.3 137 142 A M H X S+ 0 0 3 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.932 110.6 42.8 -58.2 -59.3 -46.0 24.3 9.6 138 143 A V H X S+ 0 0 19 -4,-2.6 4,-2.4 1,-0.2 3,-0.3 0.915 115.5 51.8 -51.7 -47.5 -45.2 24.0 6.0 139 144 A E H X S+ 0 0 92 -4,-3.0 4,-3.3 1,-0.2 -2,-0.2 0.856 106.1 53.7 -61.2 -38.5 -46.0 27.7 5.5 140 145 A S H X S+ 0 0 37 -4,-2.8 4,-1.6 2,-0.2 -1,-0.2 0.827 110.4 47.7 -63.1 -35.2 -43.6 28.6 8.4 141 146 A I H X S+ 0 0 0 -4,-1.7 4,-2.6 -3,-0.3 -2,-0.2 0.919 113.7 46.6 -71.6 -44.3 -40.9 26.7 6.7 142 147 A K H X S+ 0 0 58 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.972 110.9 51.2 -61.6 -55.2 -41.7 28.3 3.3 143 148 A R H X S+ 0 0 169 -4,-3.3 4,-1.6 1,-0.2 -1,-0.2 0.847 113.7 46.8 -51.9 -42.6 -41.8 31.8 4.8 144 149 A Y H >X S+ 0 0 13 -4,-1.6 4,-3.0 -5,-0.2 3,-0.5 0.997 108.1 52.3 -63.3 -65.5 -38.5 31.3 6.4 145 150 A L H 3X S+ 0 0 5 -4,-2.6 4,-2.5 1,-0.3 -2,-0.2 0.798 107.4 54.2 -42.5 -40.8 -36.6 29.8 3.5 146 151 A E H 3< S+ 0 0 105 -4,-2.2 -1,-0.3 2,-0.2 -2,-0.2 0.964 113.6 40.7 -58.8 -54.4 -37.6 32.7 1.3 147 152 A R H << S+ 0 0 153 -4,-1.6 -2,-0.2 -3,-0.5 -1,-0.2 0.857 116.9 51.0 -59.2 -38.9 -36.2 35.2 3.8 148 153 A K H < 0 0 50 -4,-3.0 -1,-0.2 -5,-0.1 -2,-0.2 0.835 360.0 360.0 -66.8 -34.6 -33.2 32.9 4.3 149 154 A I < 0 0 98 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.887 360.0 360.0-100.8 360.0 -32.6 32.7 0.5