==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-APR-05 1ZG8 . COMPND 2 MOLECULE: PROCARBOXYPEPTIDASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR M.ADLER,J.BRYANT,B.BUCKMAN,I.ISLAM,B.LARSEN,S.FINSTER, . 914 3 9 9 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34158.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 621 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 82 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 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 . 56 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 286 31.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 3 0 1 2 1 5 0 0 3 0 3 0 0 3 0 3 2 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 0 4 5 1 2 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 6 0 0 3 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 3 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 5 A T 0 0 109 0, 0.0 12,-0.1 0, 0.0 11,-0.1 0.000 360.0 360.0 360.0-158.4 8.0 7.7 61.0 2 6 A G - 0 0 58 11,-0.1 2,-0.1 7,-0.0 11,-0.1 0.757 360.0-145.9 110.8 73.0 7.3 10.5 58.4 3 7 A H + 0 0 48 10,-0.1 2,-0.3 6,-0.1 5,-0.1 -0.380 23.5 168.3 -74.7 141.3 10.1 10.6 55.8 4 8 A S - 0 0 42 3,-0.2 3,-0.4 -2,-0.1 5,-0.1 -0.977 33.1-146.4-145.9 147.8 11.3 13.8 54.1 5 9 A Y S S+ 0 0 43 -2,-0.3 72,-0.1 1,-0.2 -1,-0.1 0.602 103.4 52.1 -90.6 -11.8 14.3 14.4 51.9 6 10 A E S S+ 0 0 93 277,-0.1 2,-0.3 2,-0.1 277,-0.2 0.015 107.9 58.7-110.1 25.6 14.8 17.9 53.3 7 11 A K S S- 0 0 94 -3,-0.4 2,-0.5 276,-0.1 -3,-0.2 -0.938 90.0-103.3-146.7 157.6 14.7 16.8 57.0 8 12 A Y - 0 0 12 -2,-0.3 2,-0.4 -5,-0.1 -3,-0.1 -0.834 39.7-152.0 -88.2 129.4 16.8 14.4 59.1 9 13 A N - 0 0 7 -2,-0.5 -6,-0.1 -5,-0.1 -7,-0.0 -0.842 9.7-124.0-106.9 137.8 14.9 11.2 59.6 10 14 A N > - 0 0 47 -2,-0.4 4,-2.4 1,-0.1 3,-0.2 -0.200 37.7 -97.6 -69.4 171.9 15.3 8.8 62.6 11 15 A W H > S+ 0 0 13 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.863 122.0 58.5 -63.3 -36.7 16.2 5.2 62.0 12 16 A E H > S+ 0 0 113 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.939 112.1 42.7 -57.6 -43.9 12.6 3.9 62.2 13 17 A T H > S+ 0 0 4 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.910 112.6 51.9 -69.1 -43.5 11.8 6.3 59.4 14 18 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.908 110.0 48.9 -62.2 -42.9 14.9 5.5 57.3 15 19 A E H X S+ 0 0 60 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.870 111.7 49.6 -63.5 -37.8 14.3 1.7 57.5 16 20 A A H X S+ 0 0 39 -4,-1.5 4,-2.8 -5,-0.3 -2,-0.2 0.916 110.7 50.1 -65.2 -44.8 10.7 2.2 56.4 17 21 A W H X S+ 0 0 3 -4,-2.5 4,-3.6 2,-0.2 5,-0.4 0.882 106.2 55.7 -61.3 -39.7 11.9 4.4 53.5 18 22 A T H X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.925 112.7 43.0 -60.4 -40.6 14.4 1.7 52.5 19 23 A K H X S+ 0 0 129 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.917 118.7 43.7 -70.3 -44.2 11.5 -0.7 52.3 20 24 A Q H X S+ 0 0 93 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.940 110.6 52.1 -69.0 -49.7 9.2 1.7 50.5 21 25 A V H X S+ 0 0 6 -4,-3.6 4,-1.1 1,-0.2 -1,-0.2 0.880 113.2 47.6 -58.3 -33.9 11.7 3.1 48.0 22 26 A T H < S+ 0 0 23 -4,-1.3 3,-0.3 -5,-0.4 7,-0.3 0.916 110.6 49.2 -72.5 -43.5 12.5 -0.5 47.0 23 27 A S H < S+ 0 0 86 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.876 112.3 50.9 -63.2 -35.9 8.8 -1.6 46.7 24 28 A E H < S+ 0 0 121 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.743 118.8 34.8 -75.0 -22.1 8.2 1.5 44.6 25 29 A N >X + 0 0 28 -4,-1.1 4,-2.5 -3,-0.3 3,-2.0 -0.373 61.7 153.3-130.9 60.5 11.1 0.9 42.2 26 30 A P T 34 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.700 77.2 59.0 -58.7 -24.0 11.5 -3.0 41.7 27 31 A D T 34 S+ 0 0 74 1,-0.1 3,-0.1 -3,-0.1 -2,-0.0 0.653 121.6 21.7 -76.3 -24.8 13.1 -2.3 38.3 28 32 A L T <4 S+ 0 0 5 -3,-2.0 21,-2.4 1,-0.2 2,-0.4 0.507 116.5 55.9-123.0 -14.3 15.9 -0.2 39.8 29 33 A I E < +A 48 0A 6 -4,-2.5 2,-0.4 -7,-0.3 19,-0.2 -0.982 43.2 177.7-136.2 137.2 16.3 -1.2 43.4 30 34 A S E -A 47 0A 54 17,-1.4 17,-3.4 -2,-0.4 2,-0.4 -0.998 20.8-147.4-130.6 133.0 16.9 -4.3 45.4 31 35 A R E +A 46 0A 65 -2,-0.4 2,-0.3 15,-0.2 15,-0.2 -0.836 20.0 173.0-104.9 144.9 17.3 -4.1 49.2 32 36 A T E -A 45 0A 69 13,-2.6 13,-3.2 -2,-0.4 2,-0.4 -0.963 29.1-131.8-150.2 149.4 19.5 -6.4 51.3 33 37 A A E -A 44 0A 58 -2,-0.3 11,-0.2 11,-0.3 3,-0.1 -0.917 16.8-175.6-101.5 135.1 20.7 -6.8 54.9 34 38 A I E - 0 0 33 9,-2.9 2,-0.3 -2,-0.4 10,-0.1 0.392 62.6 -42.2-112.8 2.9 24.5 -7.3 55.1 35 39 A G E - 0 0 27 8,-0.4 8,-2.7 140,-0.0 2,-0.3 -0.970 63.5 -87.8 161.8-173.3 24.7 -7.9 58.9 36 40 A T E -A 42 0A 50 -2,-0.3 6,-0.2 6,-0.2 138,-0.1 -0.928 33.0-116.1-128.0 154.3 23.3 -6.6 62.1 37 41 A T > - 0 0 1 4,-2.2 3,-1.9 -2,-0.3 71,-0.1 -0.318 42.2 -94.2 -77.4 171.9 24.5 -3.9 64.5 38 42 A F T 3 S+ 0 0 90 1,-0.3 -1,-0.1 2,-0.1 90,-0.0 0.870 127.5 46.3 -55.6 -33.5 25.8 -4.6 68.0 39 43 A L T 3 S- 0 0 105 2,-0.0 -1,-0.3 88,-0.0 88,-0.0 0.133 125.3 -91.6 -98.0 13.9 22.2 -3.8 69.1 40 44 A G S < S+ 0 0 52 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.542 74.5 141.8 94.7 4.8 20.1 -5.8 66.7 41 45 A N - 0 0 34 1,-0.1 -4,-2.2 2,-0.0 2,-0.4 -0.585 54.4-114.2 -83.4 142.3 19.4 -3.3 63.9 42 46 A N E -A 36 0A 61 -2,-0.3 2,-1.2 -6,-0.2 -6,-0.2 -0.632 18.4-139.5 -78.4 126.1 19.5 -4.5 60.3 43 47 A I E - 0 0 0 -8,-2.7 -9,-2.9 -2,-0.4 -8,-0.4 -0.723 29.0-158.8 -88.9 93.5 22.3 -3.1 58.2 44 48 A Y E -A 33 0A 17 -2,-1.2 62,-0.4 -11,-0.2 2,-0.4 -0.377 13.6-169.5 -74.4 147.7 20.5 -2.4 54.9 45 49 A L E -A 32 0A 3 -13,-3.2 -13,-2.6 59,-0.2 2,-0.5 -0.996 10.1-149.6-137.3 136.5 22.2 -2.1 51.5 46 50 A L E -AB 31 103A 0 57,-2.5 57,-2.6 -2,-0.4 2,-0.8 -0.953 3.5-151.8-112.7 124.9 20.4 -0.9 48.4 47 51 A K E -AB 30 102A 75 -17,-3.4 -17,-1.4 -2,-0.5 2,-0.6 -0.868 19.8-168.0 -95.7 106.1 21.5 -2.1 45.0 48 52 A V E +AB 29 101A 0 53,-2.8 53,-3.0 -2,-0.8 2,-0.2 -0.862 38.3 71.0-101.9 118.3 20.7 0.7 42.6 49 53 A G S S- 0 0 4 -21,-2.4 48,-0.2 -2,-0.6 51,-0.1 -0.851 86.4 -67.1 157.8 165.9 20.8 0.0 38.9 50 54 A K - 0 0 55 46,-3.0 -22,-0.1 49,-0.3 -23,-0.1 -0.737 62.1-114.0 -81.7 118.8 19.1 -1.8 36.0 51 55 A P + 0 0 102 0, 0.0 -1,-0.1 0, 0.0 48,-0.0 -0.152 55.3 142.0 -52.6 139.3 19.7 -5.5 36.7 52 56 A G - 0 0 45 3,-0.0 3,-0.5 46,-0.0 2,-0.2 -0.945 52.5 -70.7-166.7 172.6 21.9 -7.2 34.1 53 57 A P S S- 0 0 107 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.524 100.6 -13.6 -82.4 147.4 24.6 -9.9 34.1 54 58 A N S S+ 0 0 163 -2,-0.2 0, 0.0 1,-0.1 0, 0.0 0.727 82.2 172.8 31.0 55.2 28.1 -9.3 35.6 55 59 A K - 0 0 25 -3,-0.5 44,-0.2 1,-0.1 2,-0.1 -0.450 30.7-120.2 -85.5 150.9 27.9 -5.5 35.9 56 60 A P - 0 0 26 0, 0.0 44,-2.1 0, 0.0 2,-0.3 -0.493 33.5-150.5 -84.6 169.9 30.6 -3.5 37.7 57 61 A A E -cd 100 186A 2 128,-3.6 130,-3.0 42,-0.3 131,-0.6 -0.921 19.9-144.7-143.4 162.9 29.7 -1.4 40.7 58 62 A I E -cd 101 188A 2 42,-2.1 44,-3.0 -2,-0.3 2,-0.5 -0.994 24.2-147.2-126.3 127.9 30.5 1.6 42.8 59 63 A F E +cd 102 189A 0 129,-2.3 131,-3.1 -2,-0.4 2,-0.4 -0.909 18.7 176.8-104.6 126.6 30.0 1.3 46.5 60 64 A M E -cd 103 190A 0 42,-3.8 44,-2.7 -2,-0.5 2,-0.3 -0.995 3.6-175.2-129.9 130.8 28.9 4.3 48.6 61 65 A D E -cd 104 191A 0 129,-1.9 131,-2.4 -2,-0.4 2,-0.3 -0.878 2.4-174.6-123.7 156.3 28.2 4.3 52.3 62 66 A a + 0 0 0 42,-2.0 45,-1.2 -2,-0.3 46,-0.1 -0.877 58.8 48.6-138.8 166.3 26.8 6.9 54.7 63 67 A G + 0 0 0 129,-0.4 45,-2.4 5,-0.3 49,-0.2 0.755 54.7 138.7 73.8 25.2 26.3 7.0 58.4 64 68 A F S S+ 0 0 0 128,-0.6 2,-0.5 43,-0.2 129,-0.1 0.949 75.3 43.5 -60.8 -48.8 29.8 5.8 59.6 65 69 A H S > S- 0 0 4 1,-0.1 3,-1.1 3,-0.1 -1,-0.2 -0.876 82.0-141.1-107.4 124.1 29.6 8.5 62.3 66 70 A A T 3 S+ 0 0 0 57,-1.4 57,-0.2 -2,-0.5 -1,-0.1 0.869 96.6 48.1 -49.2 -43.8 26.5 9.0 64.2 67 71 A R T 3 S+ 0 0 37 55,-1.2 2,-1.9 1,-0.2 -1,-0.2 0.589 85.0 91.3 -78.7 -12.9 26.5 12.8 64.5 68 72 A E X> + 0 0 5 -3,-1.1 3,-1.6 1,-0.2 4,-0.9 -0.441 49.4 163.2 -83.3 63.5 27.3 13.4 60.8 69 73 A W H 3> + 0 0 26 -2,-1.9 4,-2.3 207,-0.4 -1,-0.2 0.762 62.9 68.0 -54.3 -31.0 23.6 13.7 59.9 70 74 A I H 3> S+ 0 0 1 206,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.843 97.7 54.3 -64.3 -28.3 24.2 15.4 56.5 71 75 A S H <> S+ 0 0 0 -3,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.898 106.3 50.2 -71.2 -39.0 25.8 12.1 55.2 72 76 A H H X S+ 0 0 0 -4,-0.9 4,-1.3 1,-0.2 3,-0.3 0.958 111.3 49.9 -63.0 -45.6 22.8 10.1 56.2 73 77 A A H X S+ 0 0 7 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.860 106.2 56.7 -60.2 -36.3 20.6 12.6 54.4 74 78 A F H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.879 101.3 54.2 -65.6 -39.7 22.8 12.4 51.3 75 79 A a H X S+ 0 0 0 -4,-1.7 4,-1.7 -3,-0.3 -1,-0.2 0.886 112.5 45.8 -60.0 -37.9 22.5 8.7 50.8 76 80 A Q H X S+ 0 0 3 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.938 111.8 50.1 -69.4 -49.0 18.7 9.1 50.8 77 81 A W H X S+ 0 0 10 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.909 109.1 53.3 -55.4 -49.9 18.8 12.1 48.4 78 82 A F H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.931 105.0 54.2 -54.0 -49.0 21.0 10.2 46.0 79 83 A V H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.907 111.3 44.6 -55.5 -45.1 18.6 7.2 45.9 80 84 A R H X S+ 0 0 71 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.914 112.3 51.4 -66.3 -43.1 15.7 9.5 44.9 81 85 A E H X S+ 0 0 48 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.898 107.8 54.4 -61.4 -38.3 17.7 11.4 42.3 82 86 A A H X S+ 0 0 0 -4,-2.7 4,-1.1 -5,-0.2 -1,-0.2 0.958 113.9 39.1 -62.2 -50.3 18.8 8.1 40.8 83 87 A V H < S+ 0 0 20 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.817 115.2 49.8 -74.8 -29.5 15.3 6.9 40.2 84 88 A L H < S+ 0 0 108 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.804 117.3 39.7 -78.2 -25.8 13.6 10.1 39.2 85 89 A T H >X S+ 0 0 28 -4,-1.7 4,-3.4 -5,-0.3 3,-2.5 0.580 83.3 114.6 -98.2 -12.4 16.2 11.0 36.5 86 90 A Y T 3< S+ 0 0 50 -4,-1.1 4,-0.1 1,-0.3 7,-0.1 -0.421 89.4 16.4 -59.3 125.9 16.7 7.5 35.2 87 91 A G T 34 S+ 0 0 49 2,-0.5 -1,-0.3 -2,-0.1 3,-0.1 0.257 128.2 57.5 92.7 -15.1 15.5 7.6 31.6 88 92 A Y T <4 S+ 0 0 208 -3,-2.5 2,-0.6 1,-0.3 -2,-0.2 0.721 97.6 54.3-114.6 -40.8 15.5 11.4 31.6 89 93 A E S X S- 0 0 55 -4,-3.4 4,-2.8 1,-0.1 -2,-0.5 -0.852 75.0-147.0 -99.7 121.5 19.1 12.4 32.4 90 94 A S H > S+ 0 0 85 -2,-0.6 4,-2.8 2,-0.2 5,-0.2 0.858 93.9 48.8 -56.8 -40.6 21.5 10.7 30.0 91 95 A H H > S+ 0 0 89 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.976 115.8 41.2 -66.3 -54.1 24.4 10.3 32.4 92 96 A M H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.894 114.7 54.4 -60.7 -37.9 22.3 8.8 35.2 93 97 A T H X S+ 0 0 29 -4,-2.8 4,-1.5 -8,-0.3 -1,-0.2 0.959 112.9 41.8 -59.0 -49.3 20.5 6.7 32.6 94 98 A E H X S+ 0 0 102 -4,-2.8 4,-2.5 2,-0.2 5,-0.3 0.879 112.2 56.3 -66.2 -38.3 23.8 5.4 31.3 95 99 A F H X S+ 0 0 3 -4,-3.0 4,-3.1 1,-0.2 -2,-0.2 0.958 111.1 41.6 -57.9 -56.0 25.2 4.9 34.9 96 100 A L H < S+ 0 0 0 -4,-2.5 -46,-3.0 1,-0.2 -1,-0.2 0.770 115.2 51.7 -65.2 -28.3 22.3 2.7 36.0 97 101 A N H < S+ 0 0 67 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.920 120.5 32.5 -71.8 -44.2 22.3 0.8 32.8 98 102 A K H < S+ 0 0 103 -4,-2.5 2,-0.3 -5,-0.1 -2,-0.2 0.787 123.0 22.7 -83.0 -38.1 26.1 0.1 33.0 99 103 A L < - 0 0 3 -4,-3.1 2,-0.4 -5,-0.3 -49,-0.3 -0.823 66.6-120.4-131.1 169.7 26.8 -0.3 36.7 100 104 A D E - c 0 57A 11 -44,-2.1 -42,-2.1 -2,-0.3 2,-0.7 -0.924 20.8-146.3-110.2 133.8 25.3 -1.1 40.1 101 105 A F E -Bc 48 58A 2 -53,-3.0 -53,-2.8 -2,-0.4 2,-0.8 -0.926 6.3-155.0-100.8 112.1 25.4 1.5 42.9 102 106 A Y E -Bc 47 59A 19 -44,-3.0 -42,-3.8 -2,-0.7 2,-0.6 -0.835 17.0-175.0 -88.1 112.7 25.7 -0.1 46.3 103 107 A V E -Bc 46 60A 0 -57,-2.6 -57,-2.5 -2,-0.8 -42,-0.2 -0.951 12.2-167.9-111.9 113.4 24.3 2.5 48.6 104 108 A L E - c 0 61A 0 -44,-2.7 -42,-2.0 -2,-0.6 3,-0.2 -0.899 6.6-162.6-103.3 105.0 24.5 1.7 52.3 105 109 A P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 -30,-0.2 0.841 72.2 2.3 -53.7 -47.6 22.2 4.4 54.0 106 110 A V + 0 0 1 -62,-0.4 3,-0.3 1,-0.1 -43,-0.3 -0.920 52.7 176.0-149.0 120.6 23.5 4.0 57.6 107 111 A L S S+ 0 0 0 -45,-1.2 2,-1.8 -2,-0.3 3,-0.3 0.932 85.1 48.9 -85.5 -55.1 26.4 1.8 58.8 108 112 A N > + 0 0 0 -45,-2.4 4,-1.8 1,-0.2 -1,-0.2 -0.499 65.6 154.4 -87.0 68.6 26.4 3.0 62.4 109 113 A I H > + 0 0 0 -2,-1.8 4,-2.7 -3,-0.3 5,-0.2 0.906 68.7 56.1 -62.2 -43.4 22.7 2.6 63.1 110 114 A D H > S+ 0 0 4 -3,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.881 110.7 42.5 -56.4 -47.7 23.2 2.1 66.9 111 115 A G H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.853 111.4 57.6 -69.7 -32.6 25.2 5.3 67.3 112 116 A Y H X S+ 0 0 1 -4,-1.8 4,-1.1 2,-0.2 3,-0.3 0.942 105.3 48.8 -62.8 -47.6 22.7 7.1 65.0 113 117 A I H >X S+ 0 0 54 -4,-2.7 4,-2.1 1,-0.2 3,-0.8 0.920 108.2 57.0 -57.8 -38.8 19.8 6.2 67.3 114 118 A Y H 3X>S+ 0 0 26 -4,-1.6 5,-2.9 1,-0.3 4,-2.7 0.851 102.0 52.7 -61.6 -38.6 21.8 7.4 70.2 115 119 A T H 3<5S+ 0 0 8 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.730 114.1 46.2 -68.0 -22.7 22.2 11.0 68.7 116 120 A W H <<5S+ 0 0 96 -4,-1.1 -2,-0.2 -3,-0.8 -1,-0.2 0.785 123.9 29.7 -86.3 -32.3 18.4 10.9 68.3 117 121 A T H <5S- 0 0 89 -4,-2.1 -2,-0.2 -5,-0.1 -3,-0.2 0.735 137.5 -9.9-103.1 -26.0 17.7 9.7 71.8 118 122 A K T <5S+ 0 0 84 -4,-2.7 2,-0.3 -5,-0.2 -3,-0.2 0.573 123.3 31.5-143.5 -41.7 20.4 10.8 74.2 119 123 A N > < - 0 0 27 -5,-2.9 3,-1.9 -8,-0.2 -3,-0.1 -0.803 45.8-172.5-140.5 98.1 23.5 12.4 72.7 120 124 A R T 3 S+ 0 0 52 -2,-0.3 -5,-0.2 1,-0.3 -1,-0.1 0.732 91.1 53.7 -53.8 -29.0 23.4 14.4 69.4 121 125 A M T 3 S+ 0 0 79 -7,-0.1 -1,-0.3 -53,-0.0 -54,-0.1 0.245 76.9 129.5 -96.8 13.3 27.2 14.6 69.4 122 126 A W < + 0 0 11 -3,-1.9 -55,-1.2 -11,-0.2 -7,-0.1 -0.347 25.1 169.6 -65.9 149.2 27.8 10.8 69.7 123 127 A R + 0 0 17 -57,-0.2 -57,-1.4 2,-0.1 -1,-0.1 0.685 47.3 65.8-128.8 -48.2 30.3 9.5 67.0 124 128 A K S S- 0 0 1 1,-0.2 -58,-0.2 -59,-0.2 14,-0.2 0.071 88.4 -84.9 -73.9-176.5 31.3 5.9 67.8 125 129 A T - 0 0 0 12,-2.2 -1,-0.2 -14,-0.1 -2,-0.1 -0.124 37.9-114.5 -78.7-175.5 29.3 2.7 67.8 126 130 A R + 0 0 42 10,-0.1 2,-0.1 2,-0.0 -1,-0.1 0.074 64.4 135.5-115.1 30.4 27.4 1.6 70.8 127 131 A S - 0 0 4 10,-0.1 9,-2.5 1,-0.1 2,-0.2 -0.389 55.1-107.6 -82.7 157.9 29.2 -1.5 71.7 128 132 A T - 0 0 92 7,-0.2 2,-0.5 -2,-0.1 7,-0.1 -0.458 24.5-149.9 -80.8 142.3 30.4 -2.7 75.1 129 133 A N > - 0 0 14 5,-0.5 3,-1.4 3,-0.4 5,-0.1 -0.976 20.5-118.5-119.3 127.8 34.1 -2.7 76.1 130 134 A A T 3 S+ 0 0 99 -2,-0.5 4,-0.1 1,-0.3 3,-0.1 -0.251 95.3 17.8 -60.9 148.1 35.5 -5.2 78.5 131 135 A G T 3 S+ 0 0 95 1,-0.1 2,-0.3 2,-0.0 -1,-0.3 0.572 118.7 68.5 66.7 12.6 37.0 -3.9 81.7 132 136 A T S < S- 0 0 43 -3,-1.4 -3,-0.4 2,-0.1 -1,-0.1 -0.981 70.5-137.0-157.6 160.3 35.2 -0.5 81.4 133 137 A T S S+ 0 0 54 206,-0.4 2,-0.2 -2,-0.3 207,-0.1 0.515 73.9 116.2 -89.5 -15.2 31.9 1.3 81.4 134 138 A b - 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0 0 11 -75,-0.1 -74,-1.8 -76,-0.1 -75,-0.3 0.437 44.7-150.0-107.3-145.2 0.9 53.6 127.7 882 274 C K S S- 0 0 109 -76,-0.1 -2,-0.1 -75,-0.1 -3,-0.0 0.364 82.3 -60.9-109.6 2.4 2.3 55.2 130.8 883 275 C G S S+ 0 0 37 3,-0.1 4,-0.1 0, 0.0 -3,-0.0 0.319 104.1 106.1 144.3 -18.3 -1.0 56.6 131.9 884 276 C R S S- 0 0 195 1,-0.2 5,-0.0 2,-0.1 0, 0.0 0.944 114.4 -0.8 -52.5 -57.1 -2.6 59.0 129.5 885 277 C Y S > S- 0 0 102 1,-0.2 3,-1.9 5,-0.0 -1,-0.2 0.543 91.2-177.4-108.0 -19.0 -5.2 56.5 128.3 886 278 C G T 3 S- 0 0 5 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 -0.339 72.1 -1.7 57.9-120.2 -4.0 53.6 130.5 887 279 C F T 3 S+ 0 0 34 1,-0.2 2,-1.4 -2,-0.1 -207,-0.3 0.760 125.1 70.4 -73.5 -27.6 -6.1 50.6 129.7 888 280 C I S < S+ 0 0 70 -3,-1.9 -1,-0.2 -209,-0.1 -2,-0.1 -0.343 70.5 173.7 -89.1 54.7 -8.3 52.3 127.2 889 281 C L - 0 0 4 -2,-1.4 5,-0.1 -3,-0.3 -2,-0.0 -0.484 38.5-111.6 -63.3 117.1 -5.5 52.6 124.6 890 282 C P > - 0 0 32 0, 0.0 3,-2.8 0, 0.0 4,-0.3 -0.183 15.2-121.9 -55.0 143.5 -7.1 54.0 121.5 891 283 C E G > S+ 0 0 70 1,-0.3 3,-2.2 2,-0.2 4,-0.4 0.836 110.7 72.1 -52.3 -32.6 -7.3 51.6 118.5 892 284 C S G 3 S+ 0 0 111 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.638 95.5 52.3 -59.8 -13.4 -5.3 54.2 116.6 893 285 C Q G <> S+ 0 0 42 -3,-2.8 4,-2.4 2,-0.1 -1,-0.3 0.471 84.6 92.7-101.2 -3.7 -2.3 53.2 118.7 894 286 C I H <> S+ 0 0 0 -3,-2.2 4,-2.9 -4,-0.3 5,-0.2 0.943 85.3 41.4 -55.5 -62.1 -2.5 49.4 118.0 895 287 C Q H > S+ 0 0 79 -4,-0.4 4,-3.1 2,-0.2 -1,-0.2 0.924 117.5 47.2 -55.3 -50.9 -0.2 49.0 115.0 896 288 C A H > S+ 0 0 25 -4,-0.3 4,-2.2 2,-0.2 5,-0.3 0.953 114.6 47.8 -55.2 -50.8 2.5 51.3 116.3 897 289 C T H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.904 114.7 45.9 -59.1 -43.6 2.4 49.7 119.7 898 290 C C H X S+ 0 0 0 -4,-2.9 4,-2.5 -5,-0.2 -1,-0.2 0.895 109.8 54.5 -69.6 -37.8 2.5 46.2 118.2 899 291 C E H X S+ 0 0 44 -4,-3.1 4,-1.1 -5,-0.2 -2,-0.2 0.924 111.2 41.5 -63.6 -50.4 5.3 47.1 115.8 900 292 C E H >X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 3,-0.6 0.925 115.3 52.4 -63.1 -43.0 7.9 48.4 118.3 901 293 C T H 3X S+ 0 0 0 -4,-1.7 4,-2.5 -5,-0.3 -2,-0.2 0.884 101.6 59.5 -59.5 -43.3 7.0 45.6 120.7 902 294 C M H 3X S+ 0 0 8 -4,-2.5 4,-2.7 1,-0.2 -1,-0.3 0.851 102.2 56.7 -52.3 -36.6 7.6 43.0 117.9 903 295 C L H < S+ 0 0 49 -4,-3.2 3,-1.3 -5,-0.2 -2,-0.2 0.916 104.5 51.3 -49.0 -59.2 18.9 35.8 121.9 912 304 C V H >< S+ 0 0 4 -4,-2.1 3,-1.6 1,-0.2 -1,-0.2 0.944 94.6 76.3 -45.0 -56.0 17.5 32.6 123.4 913 305 C L H >< S+ 0 0 29 -4,-1.8 3,-0.8 1,-0.3 -1,-0.2 0.625 94.9 47.5 -24.2 -49.8 18.3 30.8 120.0 914 306 C G T << S+ 0 0 65 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.1 -0.107 107.6 56.1 -92.6 34.7 22.0 30.7 120.8 915 307 C H T < 0 0 89 -3,-1.6 -1,-0.2 1,-0.0 -2,-0.2 -0.142 360.0 360.0-151.7 32.7 21.4 29.4 124.3 916 308 C L < 0 0 134 -3,-0.8 -118,-0.1 -249,-0.0 -1,-0.0 -0.798 360.0 360.0 89.2 360.0 19.4 26.4 123.0