==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 24-MAY-13 3WC5 . COMPND 2 MOLECULE: CARBOXYPEPTIDASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR N.YOSHIMOTO,T.ITOH,Y.INABA,K.YAMAMOTO . 304 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12033.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 5.3 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 . 20 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 31.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 1 0 0 1 0 2 0 0 1 0 1 0 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 2 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 PARALLEL BRIDGES PER LADDER . 0 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 G 0 0 111 0, 0.0 2,-0.2 0, 0.0 11,-0.1 0.000 360.0 360.0 360.0 -45.6 28.0 -35.2 12.9 2 7 A H + 0 0 58 10,-0.1 2,-0.3 6,-0.1 5,-0.1 -0.534 360.0 169.2 -85.8 142.1 27.0 -33.4 9.7 3 8 A S > - 0 0 30 -2,-0.2 3,-1.3 3,-0.2 5,-0.0 -0.976 33.4-144.5-141.7 141.2 25.4 -35.2 6.7 4 9 A Y T 3 S+ 0 0 48 -2,-0.3 72,-0.1 1,-0.2 -1,-0.1 0.717 102.6 57.4 -73.9 -10.8 23.8 -33.6 3.6 5 10 A E T 3 S+ 0 0 92 277,-0.1 2,-0.3 2,-0.1 277,-0.3 0.293 104.9 53.6-104.6 12.0 21.3 -36.5 3.5 6 11 A K S < S- 0 0 63 -3,-1.3 2,-0.4 276,-0.1 -3,-0.2 -0.894 93.2 -96.3-131.0 166.9 19.9 -36.0 7.1 7 12 A Y - 0 0 16 -2,-0.3 2,-0.4 -5,-0.1 -2,-0.1 -0.751 42.9-151.6 -83.1 134.9 18.4 -33.1 8.9 8 13 A N - 0 0 6 -2,-0.4 -6,-0.1 60,-0.1 63,-0.0 -0.838 9.9-123.0-113.5 136.0 21.1 -31.4 11.0 9 14 A N > - 0 0 53 -2,-0.4 4,-3.1 1,-0.1 3,-0.3 -0.186 35.4 -98.8 -72.8 173.3 20.6 -29.5 14.2 10 15 A W H > S+ 0 0 12 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.906 122.7 54.5 -64.6 -40.5 21.7 -25.8 14.5 11 16 A E H > S+ 0 0 149 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.915 112.9 45.0 -54.1 -38.9 24.9 -26.6 16.4 12 17 A T H > S+ 0 0 32 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.910 114.3 46.9 -74.8 -45.8 25.8 -29.0 13.5 13 18 A I H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.936 112.0 51.0 -65.9 -36.7 24.8 -26.5 10.7 14 19 A E H X S+ 0 0 61 -4,-3.2 4,-1.5 -5,-0.3 -2,-0.2 0.940 111.6 46.7 -63.7 -46.6 26.6 -23.7 12.4 15 20 A A H X S+ 0 0 59 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.845 110.8 54.9 -61.4 -38.1 29.8 -25.9 12.7 16 21 A W H X S+ 0 0 16 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.889 101.5 56.3 -62.6 -43.6 29.3 -26.8 9.0 17 22 A T H X S+ 0 0 0 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.899 112.3 43.6 -57.1 -37.6 29.2 -23.2 7.9 18 23 A K H X S+ 0 0 122 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.944 117.1 44.3 -70.9 -46.4 32.6 -22.7 9.5 19 24 A Q H X S+ 0 0 94 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.874 111.9 51.1 -68.2 -40.7 34.1 -26.0 8.1 20 25 A V H X S+ 0 0 3 -4,-3.2 4,-0.7 1,-0.2 -1,-0.2 0.856 111.8 48.3 -67.8 -33.8 32.8 -25.7 4.6 21 26 A T H >< S+ 0 0 24 -4,-1.1 3,-0.7 -5,-0.3 7,-0.3 0.925 113.4 47.8 -68.8 -48.4 34.2 -22.1 4.4 22 27 A S H 3< S+ 0 0 81 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.815 112.0 49.2 -59.0 -38.0 37.6 -23.4 5.8 23 28 A E H 3< S+ 0 0 121 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.658 121.3 34.8 -76.1 -19.5 37.7 -26.4 3.3 24 29 A N XX + 0 0 40 -4,-0.7 4,-2.2 -3,-0.7 3,-2.1 -0.366 64.6 154.5-134.9 55.2 36.9 -24.1 0.3 25 30 A P T 34 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.745 73.0 57.6 -63.2 -21.8 38.5 -20.8 0.8 26 31 A D T 34 S+ 0 0 135 1,-0.1 3,-0.1 -3,-0.1 -5,-0.0 0.571 120.8 26.2 -83.3 -7.8 38.7 -20.0 -2.9 27 32 A L T <4 S+ 0 0 18 -3,-2.1 21,-3.3 1,-0.2 2,-0.4 0.533 118.4 51.5-124.2 -19.5 34.9 -20.3 -3.4 28 33 A I E < +A 47 0A 5 -4,-2.2 2,-0.3 -7,-0.3 -1,-0.2 -0.978 46.2 173.0-133.6 132.6 33.4 -19.5 0.0 29 34 A S E -A 46 0A 58 17,-2.0 17,-3.0 -2,-0.4 2,-0.4 -0.973 19.5-144.9-127.4 159.7 33.5 -16.8 2.6 30 35 A R E +A 45 0A 70 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.921 21.1 163.7-125.7 137.4 31.4 -16.5 5.7 31 36 A T E -A 44 0A 75 13,-2.4 13,-2.8 -2,-0.4 2,-0.4 -0.890 33.1-123.7-135.1 170.2 30.0 -13.4 7.6 32 37 A A E -A 43 0A 50 -2,-0.3 11,-0.2 11,-0.2 3,-0.1 -0.980 14.9-166.6-110.6 132.7 27.3 -12.8 10.2 33 38 A I E - 0 0 33 9,-2.4 2,-0.3 -2,-0.4 10,-0.1 0.482 63.8 -45.1 -99.7 3.2 24.7 -10.3 9.2 34 39 A G E - 0 0 27 8,-0.4 8,-2.9 5,-0.0 2,-0.3 -0.967 63.3 -87.5 159.5-173.6 23.1 -9.8 12.6 35 40 A T E -A 41 0A 51 -2,-0.3 6,-0.2 6,-0.2 138,-0.1 -0.934 34.9-118.7-129.0 156.2 21.9 -11.7 15.6 36 41 A T > - 0 0 0 4,-2.1 3,-1.8 -2,-0.3 71,-0.1 -0.217 41.8 -86.7 -82.2 174.9 18.6 -13.3 16.4 37 42 A F T 3 S+ 0 0 84 1,-0.3 -1,-0.1 2,-0.1 90,-0.0 0.898 132.8 44.8 -42.1 -50.8 16.2 -12.5 19.2 38 43 A L T 3 S- 0 0 109 1,-0.0 -1,-0.3 2,-0.0 88,-0.0 0.430 124.9-103.6 -81.6 -4.1 18.1 -15.0 21.5 39 44 A G < + 0 0 43 -3,-1.8 2,-0.2 1,-0.3 -2,-0.1 0.532 68.4 149.4 97.0 11.0 21.5 -13.7 20.3 40 45 A N - 0 0 46 1,-0.1 -4,-2.1 -5,-0.0 -1,-0.3 -0.516 53.4-107.5 -73.6 140.3 22.5 -16.4 17.8 41 46 A N E -A 35 0A 64 -2,-0.2 2,-1.0 -6,-0.2 -6,-0.2 -0.563 22.6-139.2 -69.4 131.8 24.7 -15.3 14.9 42 47 A I E - 0 0 0 -8,-2.9 -9,-2.4 -2,-0.2 -8,-0.4 -0.790 27.6-154.4 -93.1 98.4 22.9 -15.2 11.5 43 48 A Y E -A 32 0A 25 -2,-1.0 62,-0.4 -11,-0.2 2,-0.4 -0.466 13.9-169.0 -81.9 149.3 25.5 -16.6 9.2 44 49 A L E -A 31 0A 1 -13,-2.8 -13,-2.4 -2,-0.2 2,-0.4 -0.998 9.2-150.8-134.1 134.2 25.6 -15.9 5.5 45 50 A L E -AB 30 102A 0 57,-3.0 57,-2.9 -2,-0.4 2,-0.7 -0.873 4.1-152.9-107.0 133.6 27.9 -17.8 3.0 46 51 A K E -AB 29 101A 76 -17,-3.0 -17,-2.0 -2,-0.4 2,-0.5 -0.936 17.9-167.2-104.4 117.6 29.1 -15.9 -0.1 47 52 A V E +AB 28 100A 0 53,-3.5 53,-2.8 -2,-0.7 -19,-0.2 -0.894 38.0 81.5-112.7 122.5 29.7 -18.7 -2.8 48 53 A G S S- 0 0 7 -21,-3.3 48,-0.2 -2,-0.5 51,-0.1 -0.751 77.4 -87.6 157.3 151.0 31.7 -17.8 -5.9 49 54 A K - 0 0 103 46,-2.2 -22,-0.1 49,-0.3 -23,-0.1 -0.716 58.8-100.2 -76.7 131.1 35.2 -17.3 -7.3 50 55 A P + 0 0 105 0, 0.0 -1,-0.1 0, 0.0 48,-0.0 -0.103 59.4 141.9 -51.7 148.2 36.4 -13.7 -6.7 51 56 A G > - 0 0 42 3,-0.1 3,-0.6 -3,-0.1 2,-0.2 -0.954 49.6 -69.2-174.2 172.4 36.2 -11.3 -9.6 52 57 A P T 3 S- 0 0 113 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.467 100.9 -14.5 -81.7 134.2 35.5 -7.7 -10.5 53 58 A N T 3 S- 0 0 162 -2,-0.2 0, 0.0 1,-0.2 0, 0.0 0.842 82.0-178.8 55.8 43.1 32.0 -6.2 -10.4 54 59 A K < - 0 0 21 -3,-0.6 -1,-0.2 44,-0.1 44,-0.2 -0.586 22.7-131.2 -81.6 134.5 30.2 -9.5 -10.1 55 60 A P - 0 0 27 0, 0.0 44,-2.0 0, 0.0 2,-0.3 -0.336 28.3-143.9 -67.9 165.7 26.4 -9.5 -10.0 56 61 A A E -cd 99 185A 2 128,-2.7 130,-3.3 42,-0.2 131,-0.9 -0.934 16.1-149.5-138.5 155.8 24.9 -11.6 -7.2 57 62 A I E -cd 100 187A 1 42,-2.2 44,-2.6 -2,-0.3 2,-0.5 -0.981 19.8-149.8-122.1 134.6 21.9 -13.9 -6.5 58 63 A F E +cd 101 188A 0 129,-2.7 131,-2.6 -2,-0.4 2,-0.4 -0.938 16.9 178.8-109.9 127.7 20.7 -14.0 -2.9 59 64 A M E -cd 102 189A 3 42,-3.4 44,-3.0 -2,-0.5 2,-0.3 -0.986 2.4-176.2-128.8 132.3 19.1 -17.2 -1.6 60 65 A D E -cd 103 190A 0 129,-2.3 131,-2.6 -2,-0.4 2,-0.3 -0.877 2.6-177.7-124.3 156.8 17.7 -17.9 1.9 61 66 A a + 0 0 0 42,-2.1 45,-1.9 -2,-0.3 46,-0.2 -0.886 57.3 47.6-135.0 169.2 16.2 -20.9 3.6 62 67 A G + 0 0 0 129,-0.5 45,-2.0 -2,-0.3 49,-0.1 0.759 52.5 139.8 71.6 24.4 14.8 -21.6 7.0 63 68 A F S S+ 0 0 0 128,-0.6 2,-0.5 43,-0.2 76,-0.1 0.901 74.4 49.4 -59.0 -42.3 12.4 -18.6 7.4 64 69 A H S > S- 0 0 3 1,-0.1 3,-1.6 3,-0.1 59,-0.2 -0.922 82.9-141.3-111.1 128.6 10.0 -21.0 9.0 65 70 A A T 3 S+ 0 0 0 57,-1.8 57,-0.2 -2,-0.5 -1,-0.1 0.838 95.5 46.6 -63.1 -40.6 11.2 -23.3 11.7 66 71 A R T 3 S+ 0 0 44 55,-1.1 2,-1.9 1,-0.2 -1,-0.3 0.522 84.3 93.1 -76.0 -7.3 9.4 -26.5 10.9 67 72 A E X> + 0 0 4 -3,-1.6 3,-1.9 1,-0.2 4,-0.9 -0.429 49.6 165.2 -87.6 66.3 10.1 -26.5 7.1 68 73 A W H 3> + 0 0 27 -2,-1.9 4,-2.0 207,-0.5 -1,-0.2 0.759 66.1 63.9 -60.5 -26.0 13.3 -28.7 7.6 69 74 A I H 3> S+ 0 0 1 206,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.830 97.5 59.2 -70.6 -26.6 13.7 -29.5 3.9 70 75 A S H <> S+ 0 0 0 -3,-1.9 4,-1.9 2,-0.2 3,-0.3 0.965 107.0 45.6 -61.3 -52.5 14.3 -25.8 3.2 71 76 A H H X S+ 0 0 0 -4,-0.9 4,-1.6 1,-0.2 -2,-0.2 0.912 112.7 51.3 -60.8 -39.1 17.3 -25.7 5.6 72 77 A A H X S+ 0 0 6 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.854 105.5 56.7 -66.3 -32.1 18.6 -29.0 4.0 73 78 A F H X S+ 0 0 0 -4,-1.8 4,-2.4 -3,-0.3 -1,-0.2 0.917 103.2 51.6 -71.1 -39.7 18.3 -27.5 0.5 74 79 A a H X S+ 0 0 0 -4,-1.9 4,-1.6 30,-0.2 -1,-0.2 0.918 111.7 48.3 -64.3 -37.0 20.5 -24.5 1.2 75 80 A Q H X S+ 0 0 3 -4,-1.6 4,-2.6 -5,-0.2 -1,-0.2 0.932 110.3 51.6 -61.3 -45.2 23.1 -26.9 2.5 76 81 A W H X S+ 0 0 5 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.860 105.4 56.7 -61.3 -36.0 22.7 -29.1 -0.7 77 82 A F H X S+ 0 0 4 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.950 110.1 43.5 -63.3 -43.5 23.2 -26.1 -2.9 78 83 A V H X S+ 0 0 0 -4,-1.6 4,-2.5 2,-0.2 5,-0.3 0.927 110.4 56.0 -67.5 -42.3 26.6 -25.4 -1.3 79 84 A R H X S+ 0 0 56 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.930 110.8 45.4 -49.4 -49.6 27.4 -29.1 -1.5 80 85 A E H X S+ 0 0 17 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.915 109.7 54.5 -64.3 -44.1 26.8 -29.0 -5.3 81 86 A A H X S+ 0 0 0 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.932 115.1 37.7 -57.1 -48.1 28.7 -25.8 -5.8 82 87 A V H < S+ 0 0 34 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.870 118.8 48.9 -78.5 -32.7 31.9 -27.2 -4.2 83 88 A L H < S+ 0 0 93 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.909 120.4 32.3 -71.2 -38.5 31.6 -30.7 -5.5 84 89 A T H >X S+ 0 0 25 -4,-2.7 4,-2.2 -5,-0.2 3,-1.3 0.467 82.1 119.3-103.2 -6.3 30.9 -29.8 -9.2 85 90 A Y T 3< S+ 0 0 55 -4,-1.2 4,-0.1 1,-0.3 5,-0.0 -0.427 86.5 19.0 -59.6 131.3 33.0 -26.6 -9.6 86 91 A G T 34 S+ 0 0 59 2,-0.4 -1,-0.3 -2,-0.1 -2,-0.1 -0.076 124.7 59.2 98.1 -33.5 35.5 -27.3 -12.3 87 92 A Y T <4 S+ 0 0 200 -3,-1.3 2,-0.7 1,-0.2 -2,-0.2 0.737 95.1 55.7 -99.9 -29.2 33.6 -30.4 -13.7 88 93 A E S X S- 0 0 49 -4,-2.2 4,-2.3 1,-0.1 -2,-0.4 -0.921 73.0-145.1-115.3 119.0 30.3 -29.2 -14.7 89 94 A S H > S+ 0 0 83 -2,-0.7 4,-2.0 1,-0.2 -1,-0.1 0.809 93.1 46.3 -49.8 -39.1 30.4 -26.4 -17.3 90 95 A H H > S+ 0 0 87 2,-0.2 4,-3.4 1,-0.2 -1,-0.2 0.964 113.2 44.4 -77.3 -48.5 27.3 -24.5 -16.0 91 96 A M H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.904 115.0 51.7 -65.3 -33.6 27.9 -24.4 -12.3 92 97 A T H X S+ 0 0 23 -4,-2.3 4,-2.1 -8,-0.2 -1,-0.2 0.939 111.6 46.0 -69.9 -44.8 31.5 -23.5 -13.0 93 98 A E H X S+ 0 0 67 -4,-2.0 4,-2.0 -5,-0.3 5,-0.3 0.937 111.8 53.0 -58.3 -46.8 30.4 -20.6 -15.2 94 99 A F H X S+ 0 0 4 -4,-3.4 4,-2.4 1,-0.2 -2,-0.2 0.926 112.5 43.0 -52.3 -50.1 27.8 -19.5 -12.6 95 100 A L H < S+ 0 0 0 -4,-2.5 -46,-2.2 1,-0.2 -1,-0.2 0.789 113.4 51.9 -73.6 -26.7 30.4 -19.4 -9.8 96 101 A N H < S+ 0 0 64 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.842 121.6 30.8 -74.2 -32.0 33.1 -17.6 -12.0 97 102 A K H < S+ 0 0 109 -4,-2.0 2,-0.3 -5,-0.2 -2,-0.2 0.675 123.4 29.9-105.0 -22.8 30.7 -14.8 -13.1 98 103 A L < - 0 0 4 -4,-2.4 2,-0.4 -5,-0.3 -49,-0.3 -0.895 67.4-131.5-130.0 162.0 28.3 -14.3 -10.2 99 104 A D E - c 0 56A 14 -44,-2.0 -42,-2.2 -2,-0.3 2,-0.5 -0.926 15.2-148.4-107.4 147.6 28.3 -14.7 -6.5 100 105 A F E -Bc 47 57A 5 -53,-2.8 -53,-3.5 -2,-0.4 2,-0.6 -0.979 1.9-154.8-111.1 121.4 25.6 -16.5 -4.5 101 106 A Y E -Bc 46 58A 23 -44,-2.6 -42,-3.4 -2,-0.5 2,-0.6 -0.878 16.7-169.1 -91.1 120.9 24.8 -15.3 -1.0 102 107 A V E -Bc 45 59A 0 -57,-2.9 -57,-3.0 -2,-0.6 -42,-0.2 -0.964 12.8-170.4-117.4 114.7 23.3 -18.4 0.7 103 108 A L E - c 0 60A 0 -44,-3.0 -42,-2.1 -2,-0.6 3,-0.3 -0.884 7.1-169.4-104.5 96.5 21.7 -17.8 4.1 104 109 A P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 -30,-0.2 0.821 71.3 12.7 -66.7 -32.6 21.2 -21.4 5.3 105 110 A V + 0 0 1 -62,-0.4 3,-0.3 1,-0.1 -43,-0.2 -0.876 54.8 172.9-144.0 114.0 18.9 -20.6 8.3 106 111 A L S S+ 0 0 0 -45,-1.9 2,-1.7 -2,-0.3 3,-0.3 0.955 82.5 46.9 -77.8 -50.5 17.2 -17.2 8.9 107 112 A N > + 0 0 0 -45,-2.0 4,-1.9 1,-0.2 -1,-0.2 -0.546 65.5 157.5 -95.5 73.9 15.0 -18.2 11.9 108 113 A I H > + 0 0 0 -2,-1.7 4,-2.8 -3,-0.3 -1,-0.2 0.893 69.3 57.4 -69.7 -30.7 17.6 -20.0 14.0 109 114 A D H > S+ 0 0 2 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.929 110.2 43.5 -67.8 -41.7 15.8 -19.5 17.3 110 115 A G H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.877 111.4 55.8 -64.7 -40.2 12.6 -21.2 15.9 111 116 A Y H X S+ 0 0 1 -4,-1.9 4,-1.1 2,-0.2 3,-0.3 0.958 107.4 48.0 -62.3 -48.6 14.8 -24.0 14.3 112 117 A I H >X S+ 0 0 55 -4,-2.8 4,-2.1 1,-0.2 3,-1.1 0.945 109.9 54.2 -53.2 -44.7 16.4 -24.8 17.7 113 118 A Y H 3X>S+ 0 0 56 -4,-1.9 4,-2.6 1,-0.3 5,-2.5 0.841 102.4 56.4 -59.5 -37.7 12.9 -24.9 19.3 114 119 A T H 3<5S+ 0 0 6 -4,-1.9 -1,-0.3 -3,-0.3 -2,-0.2 0.792 111.9 44.0 -69.8 -20.2 11.7 -27.4 16.7 115 120 A W H <<5S+ 0 0 99 -4,-1.1 -2,-0.2 -3,-1.1 -1,-0.2 0.818 124.7 31.2 -88.5 -28.7 14.6 -29.7 17.8 116 121 A T H <5S- 0 0 88 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.812 135.5 -0.7-100.2 -33.1 14.2 -29.2 21.5 117 122 A K T <5S+ 0 0 165 -4,-2.6 2,-0.3 -5,-0.2 -3,-0.2 0.677 122.9 18.8-131.1 -44.6 10.5 -28.6 22.3 118 123 A N > < - 0 0 62 -5,-2.5 3,-1.8 1,-0.1 -2,-0.1 -0.797 45.8-164.5-152.3 103.4 8.0 -28.5 19.4 119 124 A R T 3 S+ 0 0 54 -2,-0.3 -5,-0.1 1,-0.3 -1,-0.1 0.681 92.0 56.4 -59.4 -23.0 8.6 -30.0 15.9 120 125 A M T 3 S+ 0 0 77 -53,-0.0 -1,-0.3 156,-0.0 -54,-0.1 0.202 73.4 128.8-102.7 16.7 5.7 -28.0 14.4 121 126 A W < + 0 0 30 -3,-1.8 -55,-1.1 -11,-0.1 -7,-0.1 -0.468 27.0 174.3 -69.1 144.2 6.8 -24.5 15.5 122 127 A R + 0 0 18 -57,-0.2 -57,-1.8 2,-0.1 -1,-0.1 0.722 48.7 64.6-113.3 -46.0 6.7 -21.9 12.6 123 128 A K S S- 0 0 3 1,-0.2 -58,-0.2 -59,-0.2 14,-0.2 0.069 87.0 -84.6 -79.9-178.5 7.4 -18.4 13.9 124 129 A T - 0 0 0 12,-2.3 -1,-0.2 -14,-0.1 -2,-0.1 -0.096 38.4-119.6 -68.8-175.8 10.3 -16.6 15.5 125 130 A R + 0 0 52 10,-0.1 -1,-0.1 9,-0.0 2,-0.1 0.129 66.8 126.0-121.2 23.5 10.8 -17.0 19.3 126 131 A S - 0 0 5 10,-0.1 9,-3.2 1,-0.1 2,-0.1 -0.323 59.8-108.3 -76.6 161.7 10.5 -13.3 20.3 127 132 A T - 0 0 95 7,-0.2 2,-0.4 -2,-0.1 7,-0.1 -0.428 23.1-142.0 -89.4 165.3 8.0 -12.0 22.9 128 133 A N > - 0 0 17 3,-0.4 3,-1.2 5,-0.4 5,-0.0 -0.988 22.9-107.6-130.8 138.8 4.9 -9.9 22.3 129 134 A A T 3 S+ 0 0 105 -2,-0.4 3,-0.1 1,-0.2 0, 0.0 -0.359 98.7 13.2 -61.7 133.6 3.5 -7.0 24.4 130 135 A G T 3 S+ 0 0 94 1,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.517 118.5 59.5 89.6 0.9 0.4 -7.8 26.4 131 136 A T S < S- 0 0 47 -3,-1.2 -3,-0.4 2,-0.1 -1,-0.1 -0.982 72.2-129.8-151.7 165.8 0.4 -11.6 26.0 132 137 A T S S+ 0 0 132 -2,-0.3 2,-0.1 -5,-0.1 -3,-0.1 0.515 71.7 117.6 -95.2 -7.0 2.5 -14.6 26.8 133 138 A b - 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