==== 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 STRUCTURAL PROTEIN 12-MAR-08 3CJB . COMPND 2 MOLECULE: ACTIN, ALPHA SKELETAL MUSCLE; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR M.R.SAWAYA,D.S.KUDRYASHOV,I.PASHKOV,E.REISLER,T.O.YEATES . 484 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21005.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 13.2 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 . 1 0.2 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 . 30 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.1 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 3 2 2 1 0 2 1 1 2 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 1 1 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 4 3 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 2 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 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 T 0 0 117 0, 0.0 17,-0.1 0, 0.0 332,-0.1 0.000 360.0 360.0 360.0 141.7 -24.0 -0.0 38.9 2 7 A A - 0 0 13 15,-0.2 15,-1.7 84,-0.2 2,-0.4 -0.222 360.0-151.5 -70.8 155.7 -20.9 0.9 36.8 3 8 A L E -Ab 16 88A 3 84,-2.3 86,-2.6 13,-0.3 2,-0.3 -0.983 4.9-151.3-127.3 139.1 -20.2 -0.3 33.3 4 9 A V E -Ab 15 89A 1 11,-1.6 11,-2.1 -2,-0.4 2,-0.3 -0.875 11.7-175.4-113.3 145.7 -16.7 -0.7 31.7 5 10 A C E -Ab 14 90A 6 84,-1.5 86,-0.9 -2,-0.3 2,-0.7 -0.840 11.1-168.9-149.0 104.6 -16.0 -0.4 28.0 6 11 A D E -A 13 0A 7 7,-2.0 7,-2.1 -2,-0.3 2,-1.1 -0.839 14.0-156.6 -95.0 110.1 -12.6 -1.0 26.1 7 12 A N E +A 12 0A 7 -2,-0.7 5,-0.2 84,-0.2 2,-0.1 -0.728 19.1 179.8 -91.2 92.9 -12.9 0.3 22.6 8 13 A G - 0 0 11 3,-1.2 48,-0.0 -2,-1.1 85,-0.0 -0.361 37.7-115.8 -85.9 170.3 -10.3 -1.6 20.6 9 14 A S S S+ 0 0 10 -2,-0.1 47,-0.3 135,-0.1 -1,-0.1 0.947 111.8 18.1 -69.5 -52.0 -9.6 -1.2 16.9 10 15 A G S S+ 0 0 5 1,-0.2 18,-3.1 17,-0.1 2,-0.3 0.885 131.1 30.3 -87.1 -44.8 -10.7 -4.7 15.9 11 16 A L E - C 0 27A 74 16,-0.3 -3,-1.2 17,-0.1 2,-0.7 -0.892 65.3-136.9-126.1 150.8 -12.8 -5.8 18.8 12 17 A V E -AC 7 26A 0 14,-3.5 14,-1.0 -2,-0.3 2,-0.4 -0.903 17.5-163.5-110.1 107.4 -15.0 -4.1 21.4 13 18 A K E +AC 6 25A 28 -7,-2.1 -7,-2.0 -2,-0.7 2,-0.3 -0.728 23.6 155.1 -89.0 134.2 -14.6 -5.4 25.0 14 19 A A E +AC 5 24A 0 10,-2.0 10,-2.9 -2,-0.4 2,-0.3 -0.985 1.2 119.8-161.2 150.1 -17.4 -4.5 27.3 15 20 A G E -A 4 0A 0 -11,-2.1 -11,-1.6 -2,-0.3 2,-0.4 -0.904 55.8 -45.7-177.0-156.2 -19.2 -5.6 30.5 16 21 A F E > -A 3 0A 41 5,-0.4 3,-2.3 -2,-0.3 2,-0.7 -0.867 51.8-111.7-108.3 135.7 -20.1 -4.7 34.1 17 22 A A T 3 S+ 0 0 14 -15,-1.7 -15,-0.2 -2,-0.4 3,-0.1 -0.520 108.7 37.8 -68.2 109.4 -17.8 -3.1 36.7 18 23 A G T 3 S+ 0 0 14 -2,-0.7 -1,-0.3 1,-0.6 2,-0.2 0.089 88.2 115.0 130.8 -19.5 -17.2 -5.9 39.2 19 24 A D < - 0 0 30 -3,-2.3 -1,-0.6 467,-0.2 467,-0.1 -0.510 69.2-132.5 -74.8 151.2 -17.2 -8.8 36.8 20 25 A D S S+ 0 0 108 -2,-0.2 -1,-0.1 -3,-0.1 306,-0.1 0.432 91.0 12.9 -79.4 -1.3 -13.9 -10.8 36.4 21 26 A A S S- 0 0 35 -5,-0.2 -5,-0.4 304,-0.1 2,-0.3 -0.980 92.8 -81.7-164.8 164.4 -14.4 -10.5 32.6 22 27 A P - 0 0 18 0, 0.0 -7,-0.3 0, 0.0 3,-0.1 -0.597 24.1-152.9 -77.8 136.0 -16.4 -8.7 30.0 23 28 A R S S+ 0 0 158 -2,-0.3 2,-0.4 1,-0.2 -8,-0.2 0.745 82.6 46.9 -75.4 -24.2 -19.9 -10.0 29.3 24 29 A A E +C 14 0A 2 -10,-2.9 -10,-2.0 2,-0.0 2,-0.3 -0.977 57.6 161.9-129.4 126.5 -19.8 -8.7 25.7 25 30 A V E +C 13 0A 55 -2,-0.4 -12,-0.2 -12,-0.2 -14,-0.0 -0.992 17.0 140.6-140.1 131.9 -17.0 -8.9 23.0 26 31 A F E -C 12 0A 4 -14,-1.0 -14,-3.5 -2,-0.3 2,-0.1 -0.982 53.0 -68.2-164.0 164.9 -17.5 -8.4 19.3 27 32 A P E -C 11 0A 14 0, 0.0 2,-2.1 0, 0.0 -16,-0.3 -0.391 40.5-126.5 -67.6 135.8 -15.9 -6.9 16.2 28 33 A S + 0 0 0 -18,-3.1 2,-0.3 -2,-0.1 28,-0.3 -0.536 65.6 129.0 -78.4 74.0 -15.7 -3.1 16.1 29 34 A I - 0 0 2 -2,-2.1 11,-2.0 25,-0.1 2,-0.4 -0.989 42.7-160.6-136.3 142.6 -17.5 -2.8 12.7 30 35 A V E -FG 39 53B 1 23,-2.4 23,-1.3 -2,-0.3 2,-0.4 -0.982 10.2-167.6-127.4 120.5 -20.4 -0.8 11.4 31 36 A G E +FG 38 52B 0 7,-3.1 7,-3.0 -2,-0.4 21,-0.2 -0.921 7.9 175.3-114.9 130.7 -22.4 -1.8 8.2 32 37 A R E - G 0 51B 79 19,-1.4 19,-3.7 -2,-0.4 5,-0.2 -0.887 44.6 -73.4-124.9 157.6 -24.9 0.4 6.3 33 38 A P E G 0 50B 83 0, 0.0 17,-0.2 0, 0.0 -1,-0.1 -0.078 360.0 360.0 -48.8 148.0 -26.8 -0.3 3.0 34 39 A R 0 0 199 15,-1.3 16,-0.0 16,-0.0 14,-0.0 -0.306 360.0 360.0 -65.5 360.0 -24.7 -0.1 -0.2 35 ! 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 36 51 A D 0 0 152 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 1.3 -30.7 1.1 8.4 37 52 A S - 0 0 32 -5,-0.2 2,-0.3 13,-0.0 -5,-0.2 -0.976 360.0-158.3-162.6 146.2 -27.5 -0.2 10.1 38 53 A Y E -F 31 0B 81 -7,-3.0 -7,-3.1 -2,-0.3 2,-0.4 -0.929 9.3-158.1-126.5 151.7 -25.8 -3.3 11.6 39 54 A V E > -F 30 0B 11 -2,-0.3 3,-0.8 -9,-0.2 2,-0.3 -0.981 51.9 -17.7-133.3 141.3 -22.9 -3.7 14.0 40 55 A G T 3> S- 0 0 0 -11,-2.0 4,-1.6 -2,-0.4 3,-0.4 -0.506 125.8 -0.0 75.6-128.5 -20.5 -6.6 14.8 41 56 A D H 3> S+ 0 0 89 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.881 127.4 63.0 -68.1 -40.5 -21.2 -10.1 13.6 42 57 A E H <> S+ 0 0 88 -3,-0.8 4,-1.4 1,-0.2 -1,-0.2 0.862 105.8 47.6 -47.5 -43.0 -24.5 -9.0 11.9 43 58 A A H 4 S+ 0 0 0 -3,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.935 112.4 46.8 -68.1 -49.5 -22.5 -6.8 9.6 44 59 A Q H >< S+ 0 0 33 -4,-1.6 3,-1.3 1,-0.2 -2,-0.2 0.904 111.2 51.3 -60.6 -45.1 -19.9 -9.4 8.7 45 60 A S H 3< S+ 0 0 89 -4,-3.0 3,-0.3 1,-0.3 -1,-0.2 0.868 118.3 39.0 -60.5 -36.6 -22.6 -12.1 8.0 46 61 A K T 3X S+ 0 0 78 -4,-1.4 4,-0.8 -5,-0.3 3,-0.4 -0.320 78.6 130.0-107.5 47.6 -24.4 -9.6 5.7 47 62 A R T <4 + 0 0 72 -3,-1.3 5,-0.2 1,-0.2 -1,-0.2 0.752 63.1 62.9 -72.6 -27.1 -21.2 -8.1 4.2 48 63 A G T 4 S+ 0 0 50 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.790 110.5 35.5 -70.6 -31.7 -22.4 -8.5 0.6 49 64 A I T 4 S+ 0 0 114 -3,-0.4 -15,-1.3 -16,-0.0 2,-0.3 0.555 114.6 65.3 -98.3 -10.5 -25.4 -6.2 0.9 50 65 A L E < S-G 33 0B 6 -4,-0.8 2,-0.7 -17,-0.2 -19,-0.1 -0.731 74.7-127.9-114.0 159.6 -23.7 -3.7 3.3 51 66 A T E -G 32 0B 53 -19,-3.7 -19,-1.4 -2,-0.3 2,-0.1 -0.920 34.7-151.5-104.5 104.2 -20.8 -1.2 3.2 52 67 A L E +G 31 0B 44 -2,-0.7 2,-0.3 -5,-0.2 -21,-0.2 -0.459 17.7 178.2 -80.6 147.7 -18.6 -2.0 6.2 53 68 A K E -G 30 0B 108 -23,-1.3 -23,-2.4 -2,-0.1 -2,-0.0 -0.981 27.7-130.1-146.0 155.8 -16.5 0.5 8.0 54 69 A Y - 0 0 86 -2,-0.3 9,-0.2 -25,-0.2 -25,-0.1 -0.939 9.9-164.4-109.9 112.1 -14.2 0.7 11.0 55 70 A P S S+ 0 0 0 0, 0.0 7,-1.3 0, 0.0 8,-0.6 0.477 80.4 58.6 -75.1 -2.2 -14.9 3.7 13.3 56 71 A I E -H 61 0C 4 -28,-0.3 2,-0.6 -47,-0.3 5,-0.2 -0.958 66.1-172.0-129.4 113.3 -11.5 3.2 15.0 57 72 A E E > S-H 60 0C 112 3,-2.1 3,-0.9 -2,-0.4 86,-0.0 -0.924 77.6 -18.7-105.7 112.1 -8.4 3.5 12.8 58 73 A H T 3 S- 0 0 75 -2,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.798 128.0 -51.3 64.0 33.6 -5.2 2.6 14.7 59 74 A G T 3 S+ 0 0 14 1,-0.2 34,-0.5 -3,-0.1 2,-0.4 0.579 117.3 108.8 81.4 11.8 -6.8 3.0 18.2 60 75 A I E < S-H 57 0C 32 -3,-0.9 -3,-2.1 32,-0.1 2,-0.7 -0.981 75.3-117.4-122.9 130.9 -8.1 6.5 17.4 61 76 A I E +H 56 0C 17 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.542 43.5 160.5 -71.7 109.0 -11.8 7.3 16.9 62 77 A T + 0 0 70 -7,-1.3 2,-0.8 -2,-0.7 -1,-0.2 0.890 63.2 49.0 -93.2 -53.0 -12.1 8.5 13.2 63 78 A N > + 0 0 41 -8,-0.6 4,-1.8 -9,-0.2 -1,-0.2 -0.814 58.9 175.5 -98.0 102.4 -15.8 8.0 12.4 64 79 A W H > S+ 0 0 46 -2,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.868 78.6 57.0 -75.4 -38.8 -17.9 9.6 15.2 65 80 A D H > S+ 0 0 112 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.930 114.5 40.2 -56.4 -47.0 -21.3 9.0 13.6 66 81 A D H > S+ 0 0 5 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.850 108.4 61.2 -69.8 -37.7 -20.5 5.2 13.4 67 82 A M H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.838 99.9 56.1 -60.5 -33.3 -18.9 5.2 16.8 68 83 A E H X S+ 0 0 63 -4,-1.9 4,-3.2 2,-0.2 -1,-0.2 0.919 105.6 51.4 -62.1 -42.5 -22.3 6.3 18.3 69 84 A K H X S+ 0 0 67 -4,-1.0 4,-2.7 2,-0.2 5,-0.2 0.898 106.2 55.1 -59.8 -43.5 -23.8 3.2 16.6 70 85 A I H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.935 112.8 41.9 -53.2 -50.9 -21.1 1.1 18.2 71 86 A W H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.930 110.8 54.4 -67.1 -46.6 -22.1 2.4 21.6 72 87 A H H X>S+ 0 0 92 -4,-3.2 4,-2.8 1,-0.2 5,-0.6 0.958 111.9 46.3 -48.9 -54.6 -25.9 2.2 21.0 73 88 A H H X>S+ 0 0 19 -4,-2.7 5,-3.0 1,-0.2 4,-0.6 0.852 110.4 54.4 -55.4 -39.9 -25.4 -1.5 20.1 74 89 A T H <>S+ 0 0 3 -4,-1.8 5,-2.3 -5,-0.2 6,-0.2 0.896 116.7 36.1 -62.5 -41.9 -23.2 -1.9 23.2 75 90 A F H <>S+ 0 0 6 -4,-2.6 6,-2.0 -3,-0.3 5,-0.7 0.964 131.5 21.9 -77.5 -57.1 -25.9 -0.6 25.6 76 91 A Y H <5S+ 0 0 108 -4,-2.8 -3,-0.2 4,-0.2 -2,-0.1 0.876 131.0 33.3 -85.0 -43.6 -29.2 -1.8 24.1 77 92 A N T < - 0 0 30 -2,-0.3 3,-3.0 1,-0.2 4,-0.4 -0.824 27.1-154.2 -91.4 105.7 -30.3 2.0 30.5 83 98 A P G > S+ 0 0 0 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.838 95.3 56.1 -47.3 -40.6 -27.2 4.2 29.7 84 99 A E G 3 S+ 0 0 86 1,-0.2 29,-0.1 30,-0.2 -2,-0.0 0.441 104.2 54.8 -72.9 -1.6 -28.7 7.0 31.9 85 100 A E G < S+ 0 0 131 -3,-3.0 -1,-0.2 1,-0.1 29,-0.1 0.393 104.8 57.2-109.3 -1.3 -29.0 4.6 34.9 86 101 A H S < S- 0 0 32 -3,-1.2 30,-0.3 -4,-0.4 2,-0.3 -0.994 79.2-121.0-139.5 131.0 -25.3 3.5 35.0 87 102 A P - 0 0 29 0, 0.0 -84,-2.3 0, 0.0 2,-0.5 -0.537 35.4-147.8 -67.8 131.1 -21.9 5.4 35.3 88 103 A T E -bd 3 117A 2 28,-2.2 30,-1.2 -2,-0.3 2,-0.5 -0.901 12.6-163.4-116.8 118.5 -19.8 4.6 32.2 89 104 A L E -bd 4 118A 0 -86,-2.6 -84,-1.5 -2,-0.5 2,-0.2 -0.838 13.7-171.1 -97.9 125.9 -16.0 4.3 32.1 90 105 A L E -bd 5 119A 0 28,-3.2 30,-1.4 -2,-0.5 2,-0.3 -0.697 10.8-137.3-111.6 165.5 -14.4 4.4 28.7 91 106 A T E - d 0 120A 3 -86,-0.9 2,-0.3 -2,-0.2 -84,-0.2 -0.873 14.3-163.7-123.9 157.8 -10.8 3.8 27.5 92 107 A E E - d 0 121A 8 28,-1.3 30,-2.2 -2,-0.3 31,-0.3 -0.885 25.8-102.0-136.0 164.4 -8.5 5.5 25.1 93 108 A A > - 0 0 3 -34,-0.5 3,-0.7 -2,-0.3 -34,-0.0 -0.580 52.8 -92.3 -81.0 148.4 -5.2 5.0 23.2 94 109 A P T 3 S+ 0 0 4 0, 0.0 -1,-0.1 0, 0.0 54,-0.0 -0.399 114.1 25.5 -60.9 142.2 -2.1 6.6 24.6 95 110 A L T 3 S+ 0 0 95 1,-0.2 -2,-0.0 -3,-0.1 3,-0.0 0.855 84.0 179.8 69.7 39.9 -1.5 10.1 23.1 96 111 A N < - 0 0 20 -3,-0.7 -1,-0.2 1,-0.1 5,-0.1 -0.589 34.5-105.5 -74.5 126.4 -5.2 10.5 22.4 97 112 A P >> - 0 0 61 0, 0.0 4,-1.7 0, 0.0 3,-0.8 -0.240 22.1-120.9 -55.2 136.5 -5.8 14.0 20.7 98 113 A K H 3> S+ 0 0 142 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.873 112.3 57.0 -39.2 -53.9 -7.4 16.6 23.0 99 114 A A H 3> S+ 0 0 66 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.876 105.7 49.6 -48.9 -48.4 -10.4 17.0 20.5 100 115 A N H <> S+ 0 0 18 -3,-0.8 4,-3.4 1,-0.2 5,-0.2 0.948 106.5 55.2 -57.7 -51.4 -11.2 13.2 20.8 101 116 A R H X S+ 0 0 17 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.859 115.4 39.4 -51.7 -42.9 -11.2 13.3 24.6 102 117 A E H X S+ 0 0 56 -4,-1.9 4,-2.6 2,-0.2 3,-0.5 0.988 115.4 48.7 -70.8 -61.1 -13.7 16.1 24.6 103 118 A K H X S+ 0 0 72 -4,-2.9 4,-2.1 1,-0.3 -2,-0.2 0.848 111.2 54.7 -47.1 -40.7 -15.9 14.9 21.7 104 119 A M H X S+ 0 0 4 -4,-3.4 4,-1.3 -5,-0.3 -1,-0.3 0.936 110.1 43.5 -59.7 -50.8 -15.9 11.5 23.5 105 120 A T H X S+ 0 0 0 -4,-1.5 4,-1.9 -3,-0.5 3,-0.4 0.946 110.2 56.8 -60.8 -51.2 -17.2 12.9 26.8 106 121 A Q H X S+ 0 0 61 -4,-2.6 4,-3.4 1,-0.2 5,-0.5 0.906 103.6 53.5 -44.7 -55.5 -19.8 15.1 25.1 107 122 A I H X>S+ 0 0 3 -4,-2.1 5,-0.7 1,-0.2 4,-0.7 0.882 107.4 50.8 -51.6 -46.3 -21.4 12.1 23.3 108 123 A M H <5S+ 0 0 0 -4,-1.3 6,-2.0 -3,-0.4 4,-0.3 0.914 119.9 34.2 -61.5 -45.5 -21.9 10.2 26.6 109 124 A F H X5S+ 0 0 0 -4,-1.9 4,-0.9 4,-0.2 -2,-0.2 0.944 129.4 30.8 -76.9 -50.1 -23.6 13.0 28.4 110 125 A E H <5S+ 0 0 104 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.1 0.978 129.8 30.5 -77.2 -59.0 -25.5 14.7 25.6 111 126 A T T <5S+ 0 0 73 -4,-0.7 -3,-0.2 -5,-0.5 -1,-0.2 0.573 138.1 25.2 -80.1 -8.7 -26.4 11.9 23.1 112 127 A F T 4 -d 92 0A 20 239,-0.4 4,-1.7 -2,-0.2 3,-0.4 -0.569 24.8-135.2 -79.2 135.7 -5.7 5.0 29.3 122 137 A Q H >> S+ 0 0 20 -30,-2.2 4,-2.1 -2,-0.3 3,-0.6 0.944 101.4 52.9 -51.3 -61.5 -5.7 1.4 28.2 123 138 A A H 3> S+ 0 0 1 -31,-0.3 4,-1.6 1,-0.3 -1,-0.2 0.798 107.3 54.1 -47.6 -37.3 -2.0 0.6 28.8 124 139 A V H 3> S+ 0 0 18 -3,-0.4 4,-2.4 2,-0.2 -1,-0.3 0.932 106.4 50.4 -66.5 -45.8 -2.2 2.0 32.4 125 140 A L H <>S+ 0 0 0 -4,-1.6 5,-1.4 1,-0.2 3,-0.6 0.919 111.2 49.5 -65.6 -45.2 -0.4 -2.4 34.4 128 143 A Y H ><5S+ 0 0 26 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.866 105.0 59.9 -59.0 -38.3 -2.8 -2.0 37.3 129 144 A A H 3<5S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.802 100.8 54.3 -60.3 -32.2 -4.3 -5.4 36.3 130 145 A S T <<5S- 0 0 15 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.457 123.2-107.6 -80.1 -2.1 -0.9 -7.0 36.9 131 146 A G T < 5S+ 0 0 0 -3,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.894 78.7 127.4 75.5 44.1 -0.9 -5.5 40.4 132 147 A R < - 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0 0 69 -4,-1.8 3,-1.9 9,-0.1 -1,-0.2 -0.737 65.2-179.4-134.7 83.1 11.7 -7.8 12.1 249 264 A P G > >S+ 0 0 5 0, 0.0 3,-1.5 0, 0.0 5,-0.8 0.652 71.8 83.0 -56.8 -21.0 9.2 -5.3 10.5 250 265 A S G > 5S+ 0 0 82 1,-0.3 3,-2.0 3,-0.2 -5,-0.1 0.753 71.3 82.1 -54.6 -25.3 11.2 -5.5 7.2 251 266 A F G < 5S+ 0 0 57 -3,-1.9 -1,-0.3 1,-0.3 -6,-0.1 0.808 100.5 33.1 -51.1 -38.3 9.2 -8.7 6.5 252 267 A I G < 5S- 0 0 57 -3,-1.5 -1,-0.3 -7,-0.1 -2,-0.2 0.208 129.0 -93.3-103.9 13.6 6.2 -6.7 5.2 253 268 A G T < 5S+ 0 0 70 -3,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.941 74.9 147.8 76.2 51.4 8.4 -3.9 3.7 254 269 A M < - 0 0 61 -5,-0.8 -1,-0.2 2,-0.1 -2,-0.0 -0.756 48.5-145.9-113.4 162.8 8.4 -1.4 6.6 255 270 A E + 0 0 196 -2,-0.3 -5,-0.1 -6,-0.1 -1,-0.1 0.640 66.3 108.1 -95.2 -22.6 11.0 1.1 7.9 256 271 A S - 0 0 41 -7,-0.1 -6,-0.1 1,-0.1 2,-0.1 -0.076 67.5-116.9 -61.1 156.9 10.1 0.7 11.6 257 272 A A - 0 0 34 1,-0.2 -9,-0.1 -8,-0.1 -1,-0.1 -0.426 41.6 -74.4 -90.8 168.4 12.3 -1.0 14.2 258 273 A G > - 0 0 1 -11,-0.2 4,-3.4 -2,-0.1 5,-0.2 -0.108 32.6-118.8 -64.5 156.7 11.6 -4.2 16.2 259 274 A I H > S+ 0 0 8 -13,-1.8 4,-1.9 1,-0.2 -12,-0.1 0.862 120.1 50.6 -62.3 -37.7 9.2 -4.4 19.2 260 275 A H H > S+ 0 0 13 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.864 113.8 46.6 -65.5 -36.1 12.1 -5.5 21.4 261 276 A E H > S+ 0 0 87 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.920 110.6 49.0 -71.9 -48.2 14.0 -2.5 20.0 262 277 A T H X S+ 0 0 18 -4,-3.4 4,-2.7 1,-0.2 -2,-0.2 0.895 108.8 55.7 -59.3 -39.9 11.2 0.1 20.5 263 278 A T H X S+ 0 0 4 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.916 110.2 45.0 -56.1 -47.2 10.8 -1.2 24.1 264 279 A Y H X S+ 0 0 70 -4,-1.4 4,-3.1 2,-0.2 5,-0.2 0.963 112.0 50.9 -61.1 -54.8 14.5 -0.5 24.7 265 280 A N H X S+ 0 0 72 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.874 110.6 50.8 -50.6 -44.0 14.4 3.0 23.0 266 281 A S H < S+ 0 0 0 -4,-2.7 3,-0.2 2,-0.2 -1,-0.2 0.954 112.1 44.8 -59.1 -54.4 11.4 3.8 25.2 267 282 A I H >< S+ 0 0 2 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.902 112.3 52.9 -58.1 -45.5 13.0 2.8 28.5 268 283 A M H 3< S+ 0 0 75 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.842 100.5 62.2 -57.4 -36.3 16.2 4.6 27.4 269 284 A K T 3< S+ 0 0 109 -4,-1.8 -1,-0.3 -5,-0.2 2,-0.2 0.213 95.7 80.5 -80.4 16.4 14.2 7.8 26.8 270 285 A C S < S- 0 0 9 -3,-1.5 5,-0.1 1,-0.1 -3,-0.0 -0.608 99.0 -64.5-111.9 174.6 13.2 7.9 30.5 271 286 A D - 0 0 91 -2,-0.2 3,-0.4 1,-0.1 4,-0.3 -0.335 45.3-123.9 -60.5 139.8 15.0 9.1 33.6 272 287 A I S > S+ 0 0 90 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.820 106.9 55.6 -55.1 -37.4 18.2 7.1 34.5 273 288 A D T > S+ 0 0 117 1,-0.2 3,-0.6 2,-0.1 4,-0.3 0.889 107.1 47.2 -67.8 -40.4 17.0 6.2 38.0 274 289 A I T 3> S+ 0 0 17 -3,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.337 87.4 91.1 -85.2 7.5 13.7 4.6 36.9 275 290 A R H <> S+ 0 0 45 -3,-0.9 4,-2.0 -4,-0.3 -1,-0.2 0.884 80.4 57.6 -68.5 -38.8 15.3 2.5 34.2 276 291 A K H <> S+ 0 0 89 -3,-0.6 4,-1.4 -4,-0.4 -1,-0.2 0.869 107.3 46.3 -60.8 -41.7 15.9 -0.5 36.5 277 292 A D H > S+ 0 0 76 -4,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.804 109.1 53.6 -74.8 -33.1 12.2 -0.8 37.4 278 293 A L H >< S+ 0 0 0 -4,-1.2 3,-0.7 2,-0.2 -142,-0.5 0.903 111.7 46.4 -66.5 -42.1 11.0 -0.6 33.8 279 294 A Y H 3< S+ 0 0 11 -4,-2.0 34,-1.6 1,-0.2 3,-0.3 0.835 113.1 50.7 -64.0 -35.2 13.4 -3.4 32.9 280 295 A A H 3< S+ 0 0 29 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.480 114.5 43.8 -84.6 -5.0 12.2 -5.4 35.9 281 296 A N << + 0 0 27 -3,-0.7 -145,-2.0 -4,-0.5 2,-1.0 -0.585 61.3 162.0-143.0 77.8 8.5 -4.9 35.0 282 297 A N E -jl 136 314D 9 31,-1.9 33,-3.4 -3,-0.3 2,-0.2 -0.760 20.5-168.6 -98.5 87.5 7.6 -5.5 31.4 283 298 A V E -jl 137 315D 1 -147,-1.0 -145,-1.8 -2,-1.0 2,-0.4 -0.548 7.9-147.4 -78.1 138.7 3.9 -6.1 31.3 284 299 A M E +j 138 0D 5 31,-1.3 2,-0.2 -2,-0.2 -145,-0.2 -0.916 23.0 167.7-110.9 136.4 2.3 -7.4 28.1 285 300 A S E +j 139 0D 0 -147,-1.7 -145,-1.2 -2,-0.4 36,-0.1 -0.747 29.7 51.1-135.1 177.6 -1.2 -6.5 27.0 286 301 A G S S- 0 0 7 34,-0.7 3,-0.4 -147,-0.2 -145,-0.2 0.075 81.4 -85.2 77.3 171.8 -3.5 -6.7 24.0 287 302 A G S > S+ 0 0 30 1,-0.2 3,-2.2 34,-0.2 -146,-0.2 0.870 114.8 65.2 -85.1 -40.7 -4.4 -9.7 21.7 288 303 A T T 3 S+ 0 0 10 -148,-1.6 -1,-0.2 1,-0.3 -147,-0.1 0.204 93.2 68.9 -72.8 19.4 -1.6 -9.8 19.2 289 304 A T T 3 + 0 0 7 -3,-0.4 -1,-0.3 -149,-0.1 -2,-0.1 0.435 69.3 97.7-108.2 -4.8 0.7 -10.6 22.1 290 305 A M < + 0 0 74 -3,-2.2 -2,-0.1 4,-0.1 -1,-0.1 0.212 48.8 128.6 -75.5 15.2 -0.8 -14.1 22.6 291 306 A Y > - 0 0 12 -3,-0.1 3,-0.9 1,-0.1 4,-0.3 -0.515 65.9-111.1 -73.6 134.6 1.9 -16.0 20.7 292 307 A P T 3 S+ 0 0 80 0, 0.0 -88,-2.1 0, 0.0 -1,-0.1 -0.458 102.5 21.3 -65.5 137.8 3.5 -19.0 22.5 293 308 A G T 3> S+ 0 0 26 -90,-0.2 4,-1.0 -2,-0.1 -90,-0.1 0.809 87.5 120.3 73.6 32.7 7.1 -18.3 23.4 294 309 A I H <> S+ 0 0 7 -3,-0.9 4,-2.0 2,-0.2 5,-0.2 0.851 72.8 48.3 -91.4 -43.4 6.7 -14.6 23.1 295 310 A A H > S+ 0 0 26 -4,-0.3 4,-1.6 1,-0.2 19,-0.2 0.752 115.7 48.7 -66.4 -24.6 7.7 -13.7 26.7 296 311 A D H > S+ 0 0 102 2,-0.2 4,-1.7 3,-0.1 -1,-0.2 0.891 110.0 47.4 -81.3 -44.4 10.7 -16.0 26.1 297 312 A R H X S+ 0 0 12 -4,-1.0 4,-1.9 2,-0.2 -2,-0.2 0.810 117.2 44.7 -70.1 -31.3 11.9 -14.5 22.8 298 313 A M H X S+ 0 0 4 -4,-2.0 4,-2.8 2,-0.2 5,-0.4 0.966 109.0 55.3 -71.8 -56.6 11.6 -11.0 24.2 299 314 A Q H X S+ 0 0 63 -4,-1.6 4,-1.0 1,-0.2 -2,-0.2 0.799 114.1 43.1 -43.8 -38.4 13.3 -12.0 27.5 300 315 A K H X S+ 0 0 91 -4,-1.7 4,-1.1 2,-0.1 -1,-0.2 0.920 113.7 49.0 -75.3 -48.5 16.2 -13.2 25.4 301 316 A E H X S+ 0 0 42 -4,-1.9 4,-0.6 1,-0.2 -2,-0.2 0.862 113.4 44.5 -64.0 -39.9 16.3 -10.3 22.9 302 317 A I H >X S+ 0 0 6 -4,-2.8 4,-3.4 2,-0.2 3,-1.3 0.910 106.0 58.5 -75.3 -41.4 16.3 -7.5 25.5 303 318 A T H 3< S+ 0 0 53 -4,-1.0 -1,-0.2 -5,-0.4 -2,-0.2 0.812 105.1 54.9 -54.8 -30.1 18.8 -9.0 27.9 304 319 A A H 3< S+ 0 0 79 -4,-1.1 -1,-0.3 1,-0.1 -2,-0.2 0.739 114.4 38.7 -73.5 -26.9 21.2 -8.9 24.8 305 320 A L H << S+ 0 0 74 -3,-1.3 -2,-0.2 -4,-0.6 -3,-0.1 0.871 109.4 66.7 -88.3 -45.9 20.5 -5.2 24.4 306 321 A A S < S- 0 0 4 -4,-3.4 4,-0.0 1,-0.2 6,-0.0 -0.415 104.6 -72.6 -76.8 153.5 20.5 -4.2 28.1 307 322 A P > - 0 0 75 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.015 41.7-116.0 -44.5 147.4 23.6 -4.4 30.3 308 323 A S T 3 S+ 0 0 123 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.820 114.7 48.1 -57.7 -38.1 24.9 -7.8 31.4 309 324 A T T 3 S+ 0 0 136 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.412 87.0 116.9 -85.7 1.6 24.3 -7.2 35.1 310 325 A M < - 0 0 42 -3,-1.6 2,-0.5 -7,-0.1 -4,-0.1 -0.557 64.5-131.2 -77.7 130.9 20.7 -5.9 34.5 311 326 A K - 0 0 130 -2,-0.3 2,-0.3 2,-0.0 -2,-0.1 -0.705 30.2-172.3 -81.0 124.0 17.8 -7.8 36.0 312 327 A I + 0 0 11 -2,-0.5 2,-0.2 -32,-0.1 -32,-0.2 -0.908 13.8 173.7-122.2 147.9 15.1 -8.4 33.4 313 328 A K - 0 0 113 -34,-1.6 -31,-1.9 -2,-0.3 2,-0.4 -0.794 13.6-158.3-158.4 110.2 11.6 -9.9 33.7 314 329 A I E -l 282 0D 23 -2,-0.2 2,-0.4 -19,-0.2 -31,-0.2 -0.720 11.5-159.6 -87.7 135.8 8.9 -10.1 31.0 315 330 A I E +l 283 0D 20 -33,-3.4 -31,-1.3 -2,-0.4 -2,-0.0 -0.970 21.6 161.1-120.2 131.2 5.2 -10.5 32.2 316 331 A A - 0 0 27 -2,-0.4 -21,-0.1 -33,-0.2 -31,-0.1 -0.687 23.8-156.7-147.1 85.2 2.4 -11.9 30.0 317 332 A P > - 0 0 20 0, 0.0 3,-1.7 0, 0.0 6,-0.1 -0.336 27.4-116.5 -66.5 149.5 -0.6 -13.0 32.0 318 333 A P T 3 S+ 0 0 113 0, 0.0 3,-0.3 0, 0.0 -28,-0.0 0.773 115.1 56.6 -56.1 -27.4 -2.9 -15.6 30.5 319 334 A E T > + 0 0 56 1,-0.2 3,-1.5 2,-0.1 4,-0.4 0.037 68.1 122.3 -92.3 26.5 -5.7 -13.0 30.5 320 335 A R T < + 0 0 24 -3,-1.7 -34,-0.7 1,-0.3 4,-0.3 0.516 61.5 69.3 -74.3 -2.8 -3.8 -10.4 28.5 321 336 A K T 3 S+ 0 0 93 -3,-0.3 -1,-0.3 1,-0.1 -34,-0.2 0.802 116.1 26.8 -74.1 -31.1 -6.5 -10.2 25.8 322 337 A Y S <> S+ 0 0 75 -3,-1.5 4,-3.1 -36,-0.1 5,-0.3 0.267 86.4 113.5-114.3 7.9 -8.7 -8.6 28.5 323 338 A S H > S+ 0 0 2 -4,-0.4 4,-2.7 1,-0.2 5,-0.2 0.910 80.2 50.5 -43.8 -54.0 -6.0 -7.0 30.7 324 339 A V H > S+ 0 0 5 -4,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.939 114.3 42.6 -51.3 -56.5 -7.1 -3.5 29.7 325 340 A W H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 3,-0.2 0.937 113.1 52.0 -57.8 -50.9 -10.8 -4.2 30.5 326 341 A I H X S+ 0 0 5 -4,-3.1 4,-2.0 1,-0.2 5,-0.2 0.893 105.0 55.7 -56.7 -44.4 -10.1 -6.0 33.7 327 342 A G H X S+ 0 0 0 -4,-2.7 4,-2.0 -5,-0.3 -1,-0.2 0.922 111.6 44.7 -53.1 -45.5 -7.9 -3.2 35.0 328 343 A G H X S+ 0 0 0 -4,-1.6 4,-3.3 -3,-0.2 5,-0.3 0.882 106.2 59.3 -66.5 -41.5 -10.9 -0.8 34.5 329 344 A S H X S+ 0 0 0 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.876 110.2 44.0 -54.1 -40.5 -13.3 -3.3 36.0 330 345 A I H X S+ 0 0 2 -4,-2.0 4,-0.7 2,-0.2 -1,-0.2 0.899 114.0 49.8 -70.5 -44.5 -11.3 -3.1 39.2 331 346 A L H >< S+ 0 0 12 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.909 109.9 49.7 -61.2 -46.9 -10.9 0.7 39.1 332 347 A A H 3< S+ 0 0 10 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.760 109.1 54.5 -64.3 -27.0 -14.6 1.2 38.6 333 348 A S H 3< S+ 0 0 27 -4,-0.9 -1,-0.2 -5,-0.3 -2,-0.2 0.611 82.1 114.1 -84.5 -14.1 -15.4 -1.0 41.5 334 349 A L << - 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