==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-JAN-12 4AF1 . COMPND 2 MOLECULE: PEPTIDE CHAIN RELEASE FACTOR SUBUNIT 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARUM; . AUTHOR J.L.KARLSEN,M.KJELDGAARD . 410 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21449.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 293 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 16.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 32 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 30.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 1 0 0 0 3 2 0 1 0 0 1 1 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 2 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 1 0 4 1 1 1 1 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 . 0 1 2 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 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 7 A V 0 0 118 0, 0.0 3,-0.1 0, 0.0 110,-0.0 0.000 360.0 360.0 360.0 105.0 29.7 -19.4 34.5 2 8 A P - 0 0 82 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.115 360.0 -51.8 -70.1-175.3 27.1 -20.0 31.7 3 9 A S > - 0 0 56 1,-0.1 4,-2.3 4,-0.0 5,-0.1 -0.163 46.0-124.5 -59.2 153.5 27.3 -19.0 28.0 4 10 A E H > S+ 0 0 36 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.881 112.2 49.7 -69.6 -39.8 28.0 -15.3 27.1 5 11 A D H > S+ 0 0 32 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.867 113.1 48.6 -64.8 -36.4 24.9 -14.9 25.0 6 12 A R H > S+ 0 0 52 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.873 109.9 51.0 -70.9 -40.0 22.9 -16.4 27.9 7 13 A R H X S+ 0 0 37 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.903 108.4 52.5 -63.5 -42.2 24.6 -14.1 30.4 8 14 A K H X S+ 0 0 37 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.896 111.1 47.2 -58.6 -41.5 23.7 -11.1 28.2 9 15 A Y H X S+ 0 0 8 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.897 111.4 50.0 -70.1 -42.1 20.1 -12.2 28.2 10 16 A E H X S+ 0 0 71 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.917 111.4 49.7 -60.1 -45.0 19.9 -12.8 31.9 11 17 A F H X S+ 0 0 6 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.932 108.7 49.8 -63.8 -48.9 21.4 -9.4 32.6 12 18 A R H X S+ 0 0 98 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.897 113.2 49.5 -56.1 -41.3 19.1 -7.4 30.4 13 19 A K H X S+ 0 0 13 -4,-1.8 4,-1.8 2,-0.2 3,-0.3 0.966 113.3 42.8 -63.1 -55.7 16.1 -9.2 32.0 14 20 A V H X S+ 0 0 9 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.883 110.4 58.1 -60.1 -40.4 17.2 -8.5 35.6 15 21 A I H X S+ 0 0 17 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.900 105.8 49.7 -54.4 -42.9 18.1 -4.9 34.7 16 22 A E H X S+ 0 0 46 -4,-1.7 4,-0.7 -3,-0.3 -1,-0.2 0.880 111.5 49.0 -66.2 -38.4 14.5 -4.4 33.5 17 23 A E H >< S+ 0 0 100 -4,-1.8 3,-1.1 1,-0.2 4,-0.4 0.950 110.6 49.8 -62.1 -51.2 13.2 -5.8 36.8 18 24 A L H >< S+ 0 0 3 -4,-3.1 3,-1.1 1,-0.3 109,-0.4 0.833 107.1 54.6 -59.2 -35.3 15.5 -3.7 39.0 19 25 A K H 3< S+ 0 0 77 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.682 96.7 66.0 -76.3 -16.1 14.5 -0.5 37.1 20 26 A D T << S+ 0 0 108 -3,-1.1 -1,-0.3 -4,-0.7 2,-0.2 0.644 89.1 89.8 -74.9 -14.5 10.8 -1.2 37.8 21 27 A Y < + 0 0 87 -3,-1.1 2,-0.3 -4,-0.4 106,-0.3 -0.588 53.6 178.1 -87.8 145.3 11.6 -0.7 41.5 22 28 A E - 0 0 128 74,-0.3 74,-2.8 -2,-0.2 104,-0.2 -0.985 16.1-146.4-147.3 134.9 11.4 2.6 43.4 23 29 A G - 0 0 2 102,-1.4 72,-0.1 -2,-0.3 5,-0.0 -0.490 28.5-116.3 -90.7 168.1 12.0 3.6 47.0 24 30 A S S S- 0 0 64 70,-0.4 2,-0.2 -2,-0.2 -1,-0.1 0.799 95.1 -10.7 -73.9 -28.4 10.1 6.4 48.8 25 31 A G S S- 0 0 22 99,-0.1 2,-1.1 36,-0.1 -2,-0.3 -0.464 110.1 -40.8-141.1-146.2 13.4 8.3 49.1 26 32 A T S S+ 0 0 75 1,-0.2 99,-0.2 -2,-0.2 39,-0.1 -0.739 89.2 110.1 -96.2 88.6 17.1 7.8 48.7 27 33 A Q + 0 0 1 -2,-1.1 2,-0.6 97,-0.9 67,-0.4 0.309 36.2 109.0-146.3 3.2 17.6 4.3 50.0 28 34 A L E -A 124 0A 0 96,-2.8 96,-3.0 -3,-0.3 2,-0.4 -0.819 53.9-154.7 -92.4 123.6 18.4 2.1 47.1 29 35 A V E -AB 123 92A 0 63,-3.9 63,-2.7 -2,-0.6 2,-0.4 -0.837 13.7-176.3-106.2 131.7 22.0 0.9 47.2 30 36 A T E -AB 122 91A 0 92,-3.4 92,-3.2 -2,-0.4 2,-0.5 -0.992 1.7-175.8-125.7 129.5 24.1 -0.1 44.2 31 37 A I E -AB 121 90A 0 59,-2.7 59,-3.1 -2,-0.4 2,-0.5 -0.974 10.4-160.3-127.7 119.1 27.7 -1.4 44.5 32 38 A Y E -AB 120 89A 8 88,-2.5 88,-1.7 -2,-0.5 57,-0.2 -0.855 13.9-168.4 -92.2 127.6 29.9 -2.3 41.5 33 39 A I E - B 0 88A 0 55,-3.3 55,-2.2 -2,-0.5 83,-0.2 -0.928 11.8-143.6-126.1 109.0 32.7 -4.6 42.6 34 40 A P > - 0 0 6 0, 0.0 3,-1.4 0, 0.0 53,-0.2 -0.267 30.0-110.8 -60.8 152.8 35.7 -5.3 40.3 35 41 A P T 3 S+ 0 0 44 0, 0.0 52,-0.1 0, 0.0 82,-0.1 0.623 118.9 49.5 -64.9 -14.9 37.2 -8.9 40.4 36 42 A D T 3 S+ 0 0 124 46,-0.1 2,-0.6 2,-0.1 -3,-0.0 0.513 86.1 99.1-101.1 -9.7 40.4 -7.5 42.0 37 43 A K S < S- 0 0 65 -3,-1.4 5,-0.0 1,-0.1 2,-0.0 -0.707 79.3-124.1 -78.2 121.0 38.6 -5.5 44.7 38 44 A Q > - 0 0 77 -2,-0.6 4,-1.3 44,-0.1 3,-0.4 -0.322 5.8-132.2 -71.0 148.1 38.6 -7.6 47.9 39 45 A I H > S+ 0 0 8 42,-2.8 4,-3.1 1,-0.2 5,-0.3 0.905 105.8 56.3 -67.8 -43.7 35.3 -8.4 49.6 40 46 A S H > S+ 0 0 68 41,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.738 104.5 58.2 -60.8 -22.1 36.5 -7.5 53.1 41 47 A D H > S+ 0 0 82 -3,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.913 110.4 38.5 -72.9 -45.9 37.2 -4.1 51.6 42 48 A V H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 5,-0.2 0.894 113.5 56.2 -73.5 -38.3 33.7 -3.4 50.4 43 49 A V H X S+ 0 0 42 -4,-3.1 4,-1.5 1,-0.2 -1,-0.2 0.866 109.0 48.9 -54.9 -36.4 32.3 -5.0 53.6 44 50 A A H X S+ 0 0 59 -4,-1.1 4,-1.5 -5,-0.3 -1,-0.2 0.841 108.5 53.4 -72.4 -33.3 34.4 -2.4 55.4 45 51 A H H X S+ 0 0 64 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.868 108.0 48.7 -70.3 -37.0 33.0 0.3 53.2 46 52 A V H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 -1,-0.2 0.874 106.2 56.7 -72.4 -35.6 29.4 -0.5 53.9 47 53 A T H X S+ 0 0 55 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.898 106.9 51.6 -58.5 -41.8 30.0 -0.6 57.6 48 54 A Q H X S+ 0 0 105 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.917 112.1 44.4 -58.9 -46.8 31.3 2.9 57.2 49 55 A E H X S+ 0 0 52 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.861 110.1 55.6 -69.2 -36.0 28.1 3.9 55.4 50 56 A H H < S+ 0 0 55 -4,-3.1 4,-0.3 2,-0.2 -1,-0.2 0.899 111.7 43.9 -61.0 -42.0 25.9 2.1 58.0 51 57 A S H >< S+ 0 0 69 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.897 113.8 50.1 -68.9 -41.5 27.6 4.1 60.7 52 58 A E H >< S+ 0 0 95 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.795 97.1 70.8 -66.5 -28.5 27.3 7.3 58.7 53 59 A A G >< S+ 0 0 5 -4,-2.0 3,-1.5 1,-0.3 -1,-0.2 0.679 80.2 74.7 -65.0 -18.1 23.6 6.5 58.1 54 60 A S G < S+ 0 0 70 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.766 88.4 62.3 -62.6 -24.0 23.0 7.3 61.7 55 61 A N G < S+ 0 0 113 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.590 74.7 119.7 -78.3 -11.1 23.4 10.9 60.7 56 62 A I < - 0 0 50 -3,-1.5 6,-0.1 -4,-0.2 -3,-0.0 -0.362 60.8-142.2 -61.5 130.3 20.3 10.7 58.3 57 63 A K S S+ 0 0 204 -2,-0.1 2,-0.4 4,-0.1 -1,-0.1 0.862 78.4 61.8 -66.8 -44.4 17.7 13.3 59.4 58 64 A S S > S- 0 0 57 1,-0.1 4,-2.2 2,-0.0 5,-0.1 -0.708 71.9-144.1 -91.8 137.6 14.5 11.4 58.8 59 65 A K H > S+ 0 0 152 -2,-0.4 4,-3.0 1,-0.2 5,-0.2 0.917 97.3 54.3 -65.6 -46.6 13.8 8.1 60.7 60 66 A Q H > S+ 0 0 126 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.894 113.0 42.9 -56.0 -44.3 12.1 6.3 57.9 61 67 A T H > S+ 0 0 25 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.919 113.4 52.5 -68.7 -44.0 14.9 6.9 55.5 62 68 A R H X S+ 0 0 69 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.914 110.9 47.1 -57.2 -46.5 17.5 6.1 58.2 63 69 A T H X S+ 0 0 59 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.913 115.0 46.0 -62.7 -45.8 15.8 2.8 59.0 64 70 A N H X S+ 0 0 16 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.927 113.6 47.7 -64.7 -47.1 15.5 1.8 55.3 65 71 A V H X S+ 0 0 7 -4,-3.2 4,-2.3 2,-0.2 5,-0.2 0.942 114.4 46.5 -59.5 -47.5 19.1 2.8 54.4 66 72 A Q H X S+ 0 0 45 -4,-2.5 4,-2.4 -5,-0.3 -2,-0.2 0.903 111.3 51.6 -65.6 -41.1 20.5 0.9 57.4 67 73 A D H X S+ 0 0 82 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.847 110.2 50.3 -58.8 -37.2 18.4 -2.2 56.7 68 74 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.934 112.5 45.1 -68.8 -45.5 19.6 -2.2 53.1 69 75 A L H X S+ 0 0 1 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.848 112.0 52.9 -65.3 -36.6 23.3 -2.0 54.1 70 76 A T H X S+ 0 0 66 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.917 107.6 51.4 -64.1 -43.4 22.7 -4.7 56.8 71 77 A S H X S+ 0 0 29 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.844 107.3 53.9 -62.9 -35.1 21.2 -6.9 54.1 72 78 A I H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.945 106.5 51.2 -63.3 -48.9 24.3 -6.3 51.9 73 79 A K H < S+ 0 0 66 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.910 110.2 50.2 -52.2 -47.2 26.6 -7.4 54.7 74 80 A D H >< S+ 0 0 92 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.881 110.7 48.5 -61.0 -41.5 24.6 -10.6 55.1 75 81 A R H >< S+ 0 0 73 -4,-1.9 3,-1.9 1,-0.2 -1,-0.2 0.892 104.6 58.4 -68.3 -39.7 24.7 -11.4 51.4 76 82 A L G >< S+ 0 0 6 -4,-2.4 3,-1.0 1,-0.3 -1,-0.2 0.543 88.0 76.4 -70.3 -6.6 28.5 -10.8 51.2 77 83 A R G < S+ 0 0 184 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.616 89.1 59.6 -75.9 -12.1 29.0 -13.5 53.8 78 84 A Y G < S+ 0 0 156 -3,-1.9 2,-0.3 -4,-0.2 -1,-0.2 0.255 95.4 78.9 -99.4 10.2 28.3 -16.0 51.1 79 85 A Y S < S- 0 0 35 -3,-1.0 -3,-0.0 1,-0.2 0, 0.0 -0.879 72.8-131.3-119.2 152.8 31.2 -14.9 48.9 80 86 A D - 0 0 138 2,-0.4 -1,-0.2 -2,-0.3 -41,-0.1 0.340 53.0 -59.7 -81.3-147.7 34.9 -15.6 49.2 81 87 A T S S+ 0 0 79 1,-0.1 -42,-2.8 -42,-0.1 -41,-0.3 0.871 120.9 25.8 -68.1 -39.1 37.9 -13.3 49.2 82 88 A F S S- 0 0 94 -44,-0.2 -2,-0.4 -43,-0.1 -44,-0.1 -0.927 88.1-103.3-127.4 149.9 37.2 -11.9 45.8 83 89 A P - 0 0 8 0, 0.0 4,-0.1 0, 0.0 5,-0.1 -0.287 53.5 -91.3 -61.2 157.7 34.0 -11.5 43.6 84 90 A P S > S- 0 0 40 0, 0.0 3,-1.9 0, 0.0 27,-0.1 0.202 70.4 -40.1 -60.8-173.8 33.6 -14.1 40.8 85 91 A D T 3 S+ 0 0 103 1,-0.3 26,-0.3 26,-0.1 0, 0.0 -0.158 130.2 9.1 -49.9 140.6 34.9 -13.8 37.2 86 92 A N T 3 S- 0 0 34 25,-0.2 30,-3.1 -3,-0.1 -1,-0.3 0.478 119.7 -90.1 65.7 3.8 34.5 -10.3 35.7 87 93 A G < - 0 0 0 -3,-1.9 24,-1.7 28,-0.2 2,-0.3 -0.580 45.8 -93.2 96.0-156.6 33.4 -8.8 39.1 88 94 A M E -BC 33 110A 0 -55,-2.2 -55,-3.3 22,-0.2 2,-0.5 -0.976 14.6-147.8-167.3 140.2 30.1 -8.4 40.8 89 95 A V E -BC 32 109A 0 20,-2.1 20,-3.0 -2,-0.3 2,-0.4 -0.977 14.5-159.8-123.7 125.2 27.2 -5.9 41.2 90 96 A V E -BC 31 108A 0 -59,-3.1 -59,-2.7 -2,-0.5 2,-0.4 -0.857 5.8-172.0-106.3 131.5 25.2 -5.7 44.4 91 97 A F E +BC 30 107A 0 16,-4.0 16,-3.3 -2,-0.4 2,-0.3 -0.981 13.6 162.1-120.5 131.4 21.7 -4.1 44.6 92 98 A S E +BC 29 106A 0 -63,-2.7 -63,-3.9 -2,-0.4 2,-0.3 -0.970 9.1 120.1-152.1 136.4 19.9 -3.6 47.8 93 99 A G E - C 0 105A 0 12,-2.4 12,-3.0 -2,-0.3 2,-0.8 -0.889 57.5 -99.4 176.3 151.5 17.0 -1.5 49.1 94 100 A A E - C 0 104A 2 -67,-0.4 -70,-0.4 -2,-0.3 10,-0.3 -0.763 49.6-158.3 -81.6 111.6 13.6 -1.3 50.6 95 101 A V E - C 0 103A 4 8,-3.1 8,-1.6 -2,-0.8 2,-0.8 -0.526 20.1-103.8 -97.3 159.2 11.3 -0.8 47.7 96 102 A D E + C 0 102A 86 -74,-2.8 -74,-0.3 6,-0.2 6,-0.2 -0.719 43.7 166.3 -83.8 111.5 7.8 0.7 47.5 97 103 A S - 0 0 63 4,-2.0 3,-0.3 -2,-0.8 2,-0.3 0.222 51.3 -44.7 -89.3-135.5 5.1 -2.0 47.1 98 104 A G S > S+ 0 0 45 1,-0.2 3,-1.6 2,-0.1 -1,-0.2 -0.692 111.1 10.1 -99.4 153.4 1.5 -1.2 47.7 99 105 A G T 3 S- 0 0 78 1,-0.3 -1,-0.2 -2,-0.3 3,-0.1 0.788 126.6 -54.3 60.5 39.6 -0.2 0.9 50.4 100 106 A G T 3 S+ 0 0 76 -3,-0.3 -1,-0.3 1,-0.3 2,-0.2 0.494 105.1 131.0 76.1 2.7 2.8 2.4 52.2 101 107 A R < - 0 0 186 -3,-1.6 -4,-2.0 -5,-0.0 -1,-0.3 -0.588 42.5-152.4 -87.6 150.1 4.3 -1.1 52.7 102 108 A T E -C 96 0A 76 -2,-0.2 2,-0.4 -6,-0.2 -6,-0.2 -0.817 6.8-158.3-120.1 163.7 7.9 -1.9 51.8 103 109 A D E -C 95 0A 98 -8,-1.6 -8,-3.1 -2,-0.3 2,-0.7 -0.997 23.5-121.6-140.1 135.0 9.8 -5.0 50.7 104 110 A M E -C 94 0A 64 -2,-0.4 2,-0.6 -10,-0.3 -10,-0.2 -0.689 26.0-167.5 -82.4 114.4 13.5 -5.6 50.9 105 111 A V E +C 93 0A 12 -12,-3.0 -12,-2.4 -2,-0.7 2,-0.4 -0.905 12.1 170.2-100.3 121.6 15.1 -6.3 47.6 106 112 A T E +C 92 0A 20 -2,-0.6 2,-0.3 -14,-0.2 -14,-0.2 -0.963 10.5 160.4-132.6 117.4 18.6 -7.6 47.7 107 113 A E E -C 91 0A 91 -16,-3.3 -16,-4.0 -2,-0.4 2,-0.4 -0.978 23.6-158.1-140.3 149.0 20.2 -8.9 44.5 108 114 A V E -C 90 0A 13 -2,-0.3 2,-0.7 -18,-0.2 -18,-0.2 -0.994 6.2-155.8-130.5 127.7 23.6 -9.6 43.0 109 115 A L E -C 89 0A 11 -20,-3.0 -20,-2.1 -2,-0.4 2,-0.4 -0.909 21.4-159.3-103.0 111.9 24.5 -9.8 39.4 110 116 A E E -C 88 0A 89 -2,-0.7 -22,-0.2 -22,-0.2 -24,-0.1 -0.741 54.0 -1.0 -99.2 137.1 27.6 -12.0 39.0 111 117 A S - 0 0 6 -24,-1.7 -1,-0.2 -2,-0.4 -25,-0.2 0.975 67.5-152.9 59.0 78.1 30.1 -12.1 36.1 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-5,-0.4 3,-0.6 -0.553 98.9-115.0 -67.4 129.3 53.4 -12.4 1.0 235 241 A D T 3 5S+ 0 0 111 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.1 -0.472 80.8 112.9 -72.6 82.6 52.8 -15.7 2.8 236 242 A Y T 3 < + 0 0 59 -2,-2.1 -1,-0.2 -5,-0.6 -34,-0.1 0.625 60.7 69.9-111.4 -35.4 54.6 -15.0 6.0 237 243 A L S < S- 0 0 0 -3,-0.6 4,-0.3 -6,-0.5 -2,-0.1 0.456 107.8-111.5 -71.0 -1.4 51.6 -15.0 8.4 238 244 A H >> - 0 0 84 3,-0.1 3,-2.2 2,-0.1 4,-1.3 0.729 19.7-110.4 67.0 121.6 51.1 -18.8 8.0 239 245 A H H 3> S+ 0 0 102 1,-0.3 4,-1.5 2,-0.2 -1,-0.1 0.756 110.8 71.9 -50.5 -33.1 47.9 -19.9 6.2 240 246 A E H 34 S+ 0 0 108 1,-0.3 4,-0.3 2,-0.2 -1,-0.3 0.721 110.0 31.9 -60.9 -22.8 46.3 -21.2 9.4 241 247 A L H <4 S+ 0 0 12 -3,-2.2 4,-0.4 -4,-0.3 3,-0.3 0.619 106.1 71.0-106.7 -21.5 45.7 -17.7 10.6 242 248 A Q H >< S+ 0 0 59 -4,-1.3 3,-0.7 1,-0.2 -2,-0.2 0.794 92.5 64.6 -60.2 -29.2 45.3 -16.2 7.1 243 249 A D T 3< S+ 0 0 97 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.931 103.8 40.6 -58.7 -50.9 42.0 -18.1 7.2 244 250 A K T 3 S+ 0 0 63 -4,-0.3 -25,-2.3 -3,-0.3 2,-0.4 0.350 82.5 122.3 -90.4 6.4 40.4 -16.2 10.0 245 251 A V E < -g 219 0B 27 -3,-0.7 -25,-0.2 -4,-0.4 3,-0.1 -0.578 45.8-163.4 -70.0 122.7 41.6 -12.7 8.9 246 252 A L E - 0 0 61 -27,-2.9 2,-0.2 -2,-0.4 -26,-0.2 0.787 58.4 -54.8 -79.9 -29.4 38.6 -10.5 8.4 247 253 A G E -g 220 0B 22 -28,-0.8 -26,-1.8 2,-0.0 2,-0.4 -0.881 49.5 -92.0 165.5 166.1 40.4 -7.9 6.4 248 254 A K E -g 221 0B 73 -2,-0.2 2,-0.3 -28,-0.2 -26,-0.2 -0.841 38.9-165.2-103.9 139.9 43.3 -5.5 6.1 249 255 A F E -g 222 0B 36 -28,-2.4 -26,-1.6 -2,-0.4 2,-1.0 -0.938 26.0-111.4-132.6 147.2 42.9 -1.9 7.2 250 256 A D E +g 223 0B 128 -2,-0.3 2,-0.4 -28,-0.2 -28,-0.1 -0.634 47.0 156.3 -81.0 101.5 44.8 1.4 6.8 251 257 A V - 0 0 1 -2,-1.0 -104,-0.1 -28,-0.8 -2,-0.1 -0.982 22.4-172.6-128.7 119.5 46.3 2.4 10.2 252 258 A S + 0 0 73 -2,-0.4 2,-0.5 -29,-0.2 -1,-0.1 0.419 66.9 76.3 -96.8 1.2 49.3 4.7 10.2 253 259 A Y + 0 0 157 5,-0.1 8,-0.1 1,-0.1 -106,-0.0 -0.965 52.9 178.2-114.1 127.1 50.0 4.5 14.0 254 260 A T + 0 0 3 -2,-0.5 -106,-0.1 4,-0.1 -108,-0.1 0.288 44.1 100.3-120.0 8.3 51.7 1.2 15.1 255 261 A D S > S- 0 0 67 -108,-0.1 3,-1.5 1,-0.1 4,-0.4 0.010 100.3 -73.1 -73.9-165.7 52.3 1.6 18.8 256 262 A E T > S+ 0 0 120 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.794 134.1 60.4 -62.8 -27.1 50.0 -0.0 21.3 257 263 A S T 3> S+ 0 0 65 1,-0.2 4,-1.1 2,-0.2 3,-0.3 0.600 87.1 74.7 -78.3 -11.3 47.4 2.6 20.5 258 264 A G H <> S+ 0 0 0 -3,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.777 84.7 65.4 -70.1 -27.1 47.3 1.4 16.9 259 265 A L H <> S+ 0 0 0 -3,-0.9 4,-1.8 -4,-0.4 -1,-0.2 0.868 101.2 49.1 -61.1 -38.2 45.4 -1.7 18.0 260 266 A S H > S+ 0 0 45 -4,-0.4 4,-2.0 -3,-0.3 -1,-0.2 0.840 108.9 52.8 -69.4 -34.9 42.5 0.6 19.0 261 267 A D H X S+ 0 0 56 -4,-1.1 4,-3.0 2,-0.2 -2,-0.2 0.885 106.4 53.5 -67.4 -38.8 42.6 2.3 15.7 262 268 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.918 108.3 49.2 -60.1 -46.5 42.4 -1.0 13.9 263 269 A V H < S+ 0 0 11 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.900 112.2 50.3 -58.8 -42.1 39.3 -1.9 15.9 264 270 A D H >< S+ 0 0 106 -4,-2.0 3,-1.4 1,-0.2 4,-0.2 0.961 113.7 42.5 -59.6 -54.2 37.9 1.5 14.9 265 271 A A H 3< S+ 0 0 50 -4,-3.0 3,-0.3 1,-0.3 -1,-0.2 0.768 117.1 47.7 -66.5 -27.9 38.6 1.1 11.2 266 272 A G T 3X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.3 0.117 74.6 115.8-101.9 21.8 37.4 -2.5 11.1 267 273 A Q H <> S+ 0 0 89 -3,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.900 77.9 47.7 -58.9 -44.9 34.2 -1.8 13.0 268 274 A A H > S+ 0 0 85 -3,-0.3 4,-1.3 -4,-0.2 -1,-0.2 0.904 111.5 50.4 -62.4 -43.0 32.0 -2.8 10.0 269 275 A A H > S+ 0 0 28 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.818 110.6 51.4 -65.7 -31.5 34.0 -6.0 9.4 270 276 A L H X S+ 0 0 4 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.913 104.5 53.7 -70.9 -46.0 33.6 -6.9 13.1 271 277 A A H X S+ 0 0 53 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.798 110.9 48.4 -62.9 -28.5 29.9 -6.5 13.3 272 278 A E H < S+ 0 0 93 -4,-1.3 3,-0.4 2,-0.2 -1,-0.2 0.825 108.5 53.0 -78.6 -34.4 29.6 -8.9 10.3 273 279 A A H >< S+ 0 0 14 -4,-1.3 3,-1.6 1,-0.2 4,-0.3 0.847 102.0 60.7 -67.1 -33.8 31.9 -11.4 12.0 274 280 A D H 3< S+ 0 0 37 -4,-2.1 4,-0.3 1,-0.3 3,-0.3 0.804 100.3 55.7 -61.3 -29.7 29.7 -11.3 15.1 275 281 A L T 3X S+ 0 0 20 -4,-0.5 4,-3.0 -3,-0.4 5,-0.3 0.315 78.6 101.7 -88.5 8.4 26.8 -12.5 13.0 276 282 A M H <> S+ 0 0 125 -3,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.944 85.3 37.3 -60.8 -55.0 28.6 -15.7 11.8 277 283 A D H > S+ 0 0 81 -3,-0.3 4,-1.6 -4,-0.3 -1,-0.2 0.849 119.6 50.7 -67.1 -34.4 27.1 -18.3 14.0 278 284 A D H > S+ 0 0 14 -4,-0.3 4,-2.7 2,-0.2 5,-0.3 0.953 110.0 46.9 -67.7 -51.5 23.7 -16.6 13.8 279 285 A K H X S+ 0 0 67 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.830 113.8 49.6 -61.7 -33.2 23.5 -16.3 10.1 280 286 A S H X S+ 0 0 65 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.2 0.827 111.1 49.5 -75.4 -32.9 24.6 -20.0 9.7 281 287 A D H X S+ 0 0 5 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.936 114.9 42.5 -67.7 -47.8 22.0 -21.1 12.2 282 288 A M H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.851 110.6 55.3 -71.7 -34.7 19.1 -19.2 10.5 283 289 A E H X S+ 0 0 89 -4,-1.8 4,-1.7 -5,-0.3 -1,-0.2 0.912 111.6 46.2 -60.4 -41.2 20.2 -20.2 7.0 284 290 A E H X S+ 0 0 69 -4,-1.4 4,-1.2 2,-0.2 -2,-0.2 0.842 112.2 51.2 -69.3 -34.5 20.0 -23.8 8.3 285 291 A F H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 3,-0.3 0.942 110.2 47.3 -67.7 -48.5 16.7 -23.2 9.9 286 292 A F H X S+ 0 0 32 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.849 107.8 56.1 -63.3 -35.7 15.1 -21.6 6.7 287 293 A E H X S+ 0 0 119 -4,-1.7 4,-1.4 -5,-0.2 -1,-0.2 0.846 109.3 47.3 -65.3 -32.5 16.4 -24.5 4.6 288 294 A E H <>S+ 0 0 52 -4,-1.2 5,-0.8 -3,-0.3 4,-0.3 0.809 110.3 52.4 -77.1 -30.7 14.6 -26.9 6.8 289 295 A L H ><5S+ 0 0 46 -4,-1.8 3,-1.3 2,-0.2 -2,-0.2 0.963 115.2 40.1 -64.8 -53.7 11.4 -24.8 6.7 290 296 A N H 3<5S+ 0 0 138 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.811 110.5 60.6 -62.5 -31.3 11.5 -24.8 2.9 291 297 A G T 3<5S- 0 0 55 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.582 107.3-132.0 -73.1 -10.9 12.5 -28.5 3.1 292 298 A G T < 5S+ 0 0 65 -3,-1.3 2,-0.3 -4,-0.3 -3,-0.2 0.330 72.8 73.6 80.7 -7.8 9.3 -29.1 4.9 293 299 A K S S- 0 0 22 102,-2.3 4,-1.9 99,-0.8 5,-0.3 0.139 84.7 -89.2 84.6 149.9 6.2 -20.7 17.9 299 305 A F H > S+ 0 0 9 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.931 122.0 48.0 -59.6 -49.0 6.3 -21.2 21.7 300 306 A E H > S+ 0 0 71 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.964 115.8 40.0 -58.6 -59.9 3.9 -24.1 21.8 301 307 A Q H > S+ 0 0 60 -4,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.819 114.6 53.4 -63.7 -34.2 5.4 -26.3 19.1 302 308 A T H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.939 108.1 50.7 -66.2 -44.6 8.9 -25.6 20.1 303 309 A R H X S+ 0 0 39 -4,-2.3 4,-1.9 -5,-0.3 -2,-0.2 0.912 108.9 52.1 -57.5 -45.0 8.2 -26.6 23.7 304 310 A R H X S+ 0 0 133 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.922 110.0 46.8 -59.6 -48.3 6.7 -29.9 22.5 305 311 A N H <>S+ 0 0 19 -4,-1.9 5,-1.8 1,-0.2 6,-0.5 0.825 108.3 57.3 -64.0 -32.4 9.7 -30.9 20.4 306 312 A L H ><5S+ 0 0 0 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.906 104.6 51.5 -63.9 -42.9 12.0 -30.0 23.2 307 313 A I H 3<5S+ 0 0 67 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.882 106.2 54.4 -61.1 -39.8 10.2 -32.4 25.5 308 314 A M T 3<5S- 0 0 112 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.575 108.5-126.8 -72.2 -8.1 10.6 -35.2 23.0 309 315 A G T < 5S+ 0 0 17 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.723 75.5 124.7 67.7 22.3 14.4 -34.5 22.9 310 316 A S < + 0 0 0 -5,-1.8 95,-2.6 95,-0.1 96,-0.7 0.427 38.0 106.0 -91.8 -0.9 14.1 -34.2 19.1 311 317 A V E -I 404 0C 3 -6,-0.5 93,-0.3 93,-0.2 3,-0.2 -0.717 43.9-174.9 -93.0 122.4 15.6 -30.7 19.0 312 318 A D E S+ 0 0 57 91,-3.2 67,-1.0 -2,-0.5 2,-0.4 0.932 80.0 5.6 -73.0 -50.0 19.1 -30.3 17.6 313 319 A R E -Ij 403 379C 23 90,-1.4 90,-2.4 65,-0.2 2,-0.5 -0.988 65.9-142.2-139.7 127.6 19.3 -26.5 18.4 314 320 A L E -Ij 402 380C 0 65,-2.8 67,-2.9 -2,-0.4 2,-0.6 -0.762 21.2-159.5 -81.8 131.0 16.9 -24.3 20.2 315 321 A L E +Ij 401 381C 0 86,-3.4 86,-2.2 -2,-0.5 2,-0.4 -0.958 16.8 169.4-118.9 115.5 16.8 -20.9 18.5 316 322 A V E -Ij 400 382C 0 65,-2.3 67,-3.0 -2,-0.6 2,-0.3 -0.959 37.0-109.7-127.4 144.1 15.5 -18.0 20.5 317 323 A S E > - j 0 383C 0 82,-2.1 3,-1.3 -2,-0.4 67,-0.2 -0.530 15.5-146.1 -71.2 133.3 15.6 -14.3 19.8 318 324 A E T 3 S+ 0 0 35 65,-2.0 -1,-0.1 -2,-0.3 66,-0.1 0.635 101.0 57.6 -71.8 -14.1 17.9 -12.3 22.0 319 325 A D T 3 S+ 0 0 76 64,-0.4 -1,-0.3 80,-0.0 2,-0.1 0.243 78.4 128.4 -98.8 11.9 15.5 -9.4 21.9 320 326 A L < + 0 0 6 -3,-1.3 79,-0.1 79,-0.1 46,-0.0 -0.416 31.8 178.0 -66.9 141.7 12.6 -11.6 23.2 321 327 A R + 0 0 83 -2,-0.1 20,-1.8 2,-0.1 2,-0.3 -0.253 32.8 125.9-140.6 48.1 10.8 -10.0 26.2 322 328 A E E -K 340 0D 52 18,-0.2 43,-2.1 19,-0.1 44,-0.5 -0.804 43.6-149.4-113.1 151.5 8.0 -12.5 27.0 323 329 A D E -KL 339 364D 25 16,-2.6 16,-1.8 -2,-0.3 2,-0.5 -0.879 16.1-135.7-106.2 147.5 6.9 -14.4 30.1 324 330 A V E -KL 338 363D 0 39,-3.1 39,-2.4 -2,-0.4 2,-0.5 -0.906 16.2-154.4 -96.6 130.4 5.2 -17.7 30.0 325 331 A V E -KL 337 362D 0 12,-3.0 12,-1.7 -2,-0.5 2,-0.4 -0.945 10.0-146.9-106.7 125.4 2.2 -18.0 32.3 326 332 A I E -KL 336 361D 9 35,-2.2 34,-2.6 -2,-0.5 35,-1.3 -0.774 16.5-167.1 -99.8 133.8 1.4 -21.5 33.5 327 333 A Y E - L 0 359D 3 8,-1.9 2,-0.4 -2,-0.4 8,-0.4 -0.809 14.4-153.4-120.8 157.4 -2.1 -22.6 34.1 328 334 A E E - L 0 358D 98 30,-2.0 30,-1.6 -2,-0.3 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-14,-0.2 -0.905 25.6 157.5-106.8 137.0 2.9 -15.9 26.5 339 345 A I E -K 323 0D 24 -16,-1.8 -16,-2.6 -2,-0.4 6,-0.1 -0.913 48.2 -74.2-143.3 170.3 2.6 -12.2 27.1 340 346 A D E > -K 322 0D 52 -2,-0.3 3,-1.4 -18,-0.2 -18,-0.2 -0.374 45.8-117.1 -65.2 149.2 4.9 -9.2 27.4 341 347 A R T 3 S+ 0 0 34 -20,-1.8 -1,-0.1 1,-0.3 -19,-0.1 0.874 112.4 51.4 -54.7 -43.7 6.9 -9.0 30.7 342 348 A R T 3 S+ 0 0 160 -21,-0.2 2,-0.3 2,-0.1 -1,-0.3 0.489 93.6 96.2 -79.7 -2.2 5.3 -5.8 31.8 343 349 A N S < S- 0 0 88 -3,-1.4 -4,-0.1 1,-0.1 2,-0.1 -0.695 80.4-112.4 -94.3 140.9 1.8 -7.0 31.2 344 350 A T - 0 0 127 -2,-0.3 -4,-0.1 1,-0.1 -1,-0.1 -0.388 50.7 -85.5 -64.7 144.4 -0.5 -8.5 33.9 345 351 A S - 0 0 26 1,-0.1 -1,-0.1 -2,-0.1 14,-0.1 -0.306 53.2-121.2 -56.7 129.1 -1.2 -12.2 33.4 346 352 A P - 0 0 40 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.306 22.5-100.8 -75.8 154.5 -4.1 -12.6 31.0 347 353 A E - 0 0 172 11,-0.0 2,-0.6 -2,-0.0 11,-0.1 -0.615 42.8-152.2 -71.5 129.3 -7.4 -14.3 31.7 348 354 A H - 0 0 17 9,-0.5 9,-3.6 -2,-0.4 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