==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (SULFHYDRYL PROTEINASE) 14-MAY-91 1PE6 . COMPND 2 MOLECULE: PAPAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CARICA PAPAYA; . AUTHOR D.YAMAMOTO,K.MATSUMOTO,H.OHISHI,T.ISHIDA,M.INOUE,K.KITAMURA, . 212 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9642.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 59.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 17.0 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 0.5 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 . 15 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 19.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 5 1 0 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 1 A I 0 0 123 0, 0.0 4,-0.1 0, 0.0 122,-0.1 0.000 360.0 360.0 360.0 147.9 33.3 53.5 -21.1 2 2 A P - 0 0 79 0, 0.0 3,-0.0 0, 0.0 124,-0.0 -0.197 360.0-120.0 -67.0 161.3 35.8 55.7 -19.2 3 3 A E S S+ 0 0 150 1,-0.1 2,-0.4 -2,-0.0 0, 0.0 0.783 101.1 37.2 -74.7 -27.0 37.5 54.5 -16.0 4 4 A Y + 0 0 149 163,-0.1 2,-0.3 164,-0.1 163,-0.2 -0.974 66.2 177.7-127.6 138.8 35.9 57.4 -14.1 5 5 A V E +A 166 0A 10 161,-2.6 161,-2.0 -2,-0.4 2,-0.2 -0.980 6.2 167.6-141.1 139.4 32.4 58.9 -14.5 6 6 A D E > -A 165 0A 26 -2,-0.3 3,-1.0 159,-0.2 4,-0.5 -0.765 15.9-171.1-155.9 101.4 30.9 61.8 -12.5 7 7 A W T 3 >S+ 0 0 27 157,-2.7 5,-3.0 1,-0.3 6,-0.3 0.656 88.7 70.0 -69.6 -17.4 27.7 63.4 -13.8 8 8 A R T > 5S+ 0 0 98 156,-0.4 3,-0.9 1,-0.3 -1,-0.3 0.868 99.6 49.0 -64.7 -36.0 28.1 65.9 -11.1 9 9 A Q T < 5S+ 0 0 164 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.660 105.5 55.3 -75.4 -20.5 31.1 67.1 -13.2 10 10 A K T 3 5S- 0 0 96 -4,-0.5 -1,-0.3 -3,-0.2 -2,-0.2 0.375 117.7-113.8 -91.3 4.4 29.0 67.2 -16.3 11 11 A G T < 5S+ 0 0 30 -3,-0.9 -3,-0.2 -4,-0.2 -2,-0.1 0.875 83.3 124.0 68.5 38.1 26.6 69.5 -14.5 12 12 A A < + 0 0 2 -5,-3.0 2,-0.4 152,-0.1 -4,-0.2 0.267 53.5 72.3-112.9 11.8 23.9 66.8 -14.7 13 13 A V - 0 0 19 -6,-0.3 3,-0.1 -5,-0.3 -1,-0.1 -0.999 65.7-150.4-131.3 131.6 23.2 66.6 -11.0 14 14 A T - 0 0 5 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.366 44.8 -62.7 -89.8 169.9 21.4 69.2 -8.8 15 15 A P - 0 0 91 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.014 61.8 -89.9 -55.3 157.9 22.0 69.8 -5.1 16 16 A V - 0 0 23 168,-0.1 2,-0.2 -3,-0.1 163,-0.2 -0.498 43.8-154.9 -72.5 134.5 21.4 67.1 -2.5 17 17 A K - 0 0 20 158,-0.4 161,-2.3 -2,-0.2 2,-0.5 -0.631 11.9-133.4-109.9 163.1 18.0 66.9 -0.8 18 18 A N B -I 177 0B 91 159,-0.3 159,-0.2 -2,-0.2 3,-0.1 -0.971 4.5-162.2-120.3 115.5 16.6 65.7 2.5 19 19 A Q - 0 0 14 157,-3.1 158,-0.1 -2,-0.5 -1,-0.1 0.722 31.8-160.2 -72.5 -18.6 13.5 63.5 2.3 20 20 A G - 0 0 44 156,-0.4 2,-1.1 1,-0.2 -1,-0.2 -0.336 54.2 -26.0 73.0-153.8 12.9 64.2 6.0 21 21 A S S S+ 0 0 133 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.2 -0.389 111.5 98.5 -96.3 55.8 10.7 61.8 8.0 22 22 A a S S- 0 0 5 -2,-1.1 2,-2.7 69,-0.1 42,-0.1 -0.966 79.6-123.9-142.1 128.8 8.6 60.7 5.0 23 23 A G B +j 64 0C 25 40,-2.3 42,-1.1 -2,-0.3 3,-0.3 -0.382 68.6 128.7 -74.0 62.8 9.4 57.4 3.2 24 24 A S >> + 0 0 0 -2,-2.7 4,-2.1 1,-0.2 3,-1.4 0.169 19.6 121.2-106.2 16.4 9.7 59.2 -0.1 25 25 A C H 3> S+ 0 0 16 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.853 73.0 57.5 -45.7 -46.0 13.1 57.7 -1.1 26 26 A W H 3> S+ 0 0 0 -3,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.785 107.2 45.6 -59.1 -36.2 11.5 56.3 -4.3 27 27 A A H <> S+ 0 0 0 -3,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.919 112.3 51.5 -70.4 -45.5 10.3 59.7 -5.5 28 28 A F H X S+ 0 0 5 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.945 111.5 47.5 -53.7 -55.7 13.7 61.3 -4.7 29 29 A S H X S+ 0 0 2 -4,-2.6 4,-1.6 131,-0.2 -1,-0.2 0.894 109.6 52.0 -54.1 -50.3 15.5 58.6 -6.7 30 30 A A H X S+ 0 0 0 -4,-1.8 4,-1.5 -5,-0.2 3,-0.2 0.959 109.4 51.2 -57.0 -43.7 13.2 58.8 -9.7 31 31 A V H X S+ 0 0 0 -4,-2.5 4,-3.2 1,-0.2 5,-0.3 0.868 100.5 60.4 -62.9 -38.4 13.8 62.6 -9.9 32 32 A V H X S+ 0 0 15 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.949 109.4 46.0 -53.8 -46.6 17.6 62.3 -9.8 33 33 A T H X S+ 0 0 0 -4,-1.6 4,-2.2 -3,-0.2 -1,-0.2 0.791 112.4 47.5 -65.0 -37.2 17.2 60.3 -13.0 34 34 A I H X S+ 0 0 1 -4,-1.5 4,-2.3 2,-0.2 5,-0.2 0.893 111.1 52.1 -71.0 -40.9 14.8 62.7 -14.8 35 35 A E H X S+ 0 0 2 -4,-3.2 4,-2.2 1,-0.2 11,-0.3 0.933 112.5 47.3 -58.8 -46.9 16.9 65.7 -13.9 36 36 A G H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.3 -2,-0.2 0.927 110.4 48.0 -60.6 -56.2 19.9 63.9 -15.4 37 37 A I H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.820 110.8 52.6 -59.1 -38.3 18.3 62.8 -18.7 38 38 A I H X>S+ 0 0 9 -4,-2.3 4,-4.1 2,-0.2 5,-0.7 0.955 110.5 46.5 -63.4 -51.1 16.9 66.2 -19.4 39 39 A K H X5S+ 0 0 58 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.952 114.3 49.6 -52.1 -51.4 20.2 67.9 -18.9 40 40 A I H <5S+ 0 0 56 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.887 120.6 35.2 -56.1 -42.2 21.8 65.2 -21.1 41 41 A R H <5S+ 0 0 130 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.854 133.1 21.4 -82.8 -38.1 19.1 65.7 -23.8 42 42 A T H <5S- 0 0 74 -4,-4.1 -3,-0.2 2,-0.3 -2,-0.2 0.703 93.2-120.2-104.9 -27.3 18.4 69.4 -23.7 43 43 A G S < + 0 0 0 32,-2.5 4,-0.8 -2,-0.3 32,-0.1 -0.573 34.4 170.7 -84.6 117.8 9.0 67.6 -8.4 50 50 A E H > S+ 0 0 3 -2,-0.6 4,-3.1 2,-0.2 3,-0.2 0.847 86.5 59.0 -80.7 -35.6 9.3 64.7 -5.9 51 51 A Q H > S+ 0 0 0 35,-0.5 4,-2.9 1,-0.2 42,-0.2 0.822 98.7 58.3 -59.4 -35.3 6.2 66.0 -4.2 52 52 A E H > S+ 0 0 5 34,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.913 110.0 43.0 -64.5 -39.6 4.3 65.5 -7.4 53 53 A L H X S+ 0 0 3 -4,-0.8 4,-2.8 2,-0.2 -2,-0.2 0.948 111.7 53.9 -71.8 -48.4 5.2 61.8 -7.4 54 54 A L H < S+ 0 0 0 -4,-3.1 8,-0.2 1,-0.2 -2,-0.2 0.910 117.9 35.5 -52.9 -48.1 4.5 61.5 -3.8 55 55 A D H < S+ 0 0 0 -4,-2.9 40,-0.3 1,-0.1 -1,-0.2 0.725 126.7 34.3 -78.6 -30.5 1.0 62.9 -4.2 56 56 A b H < S+ 0 0 23 -4,-1.9 2,-1.8 -5,-0.2 -3,-0.2 0.640 86.9 90.0-100.6 -27.0 0.0 61.5 -7.6 57 57 A D >< + 0 0 3 -4,-2.8 3,-1.5 -5,-0.2 5,-0.4 -0.594 50.7 178.4 -80.1 91.6 1.6 58.0 -8.0 58 58 A R T 3 S+ 0 0 147 -2,-1.8 -1,-0.2 1,-0.3 -5,-0.0 0.772 73.0 67.9 -68.5 -20.3 -1.3 56.1 -6.6 59 59 A R T 3 S+ 0 0 181 -3,-0.1 -1,-0.3 11,-0.1 2,-0.1 0.723 97.6 64.9 -66.3 -23.7 0.5 52.8 -7.2 60 60 A S S < S- 0 0 4 -3,-1.5 6,-0.2 -7,-0.2 3,-0.1 -0.429 89.2-121.5 -93.7 176.0 3.0 53.8 -4.4 61 61 A Y > - 0 0 126 4,-2.3 3,-2.5 1,-0.3 5,-0.1 -0.269 35.0-133.0-113.7 41.4 2.2 54.4 -0.8 62 62 A G T > S+ 0 0 0 -5,-0.4 3,-1.0 1,-0.3 -1,-0.3 -0.345 86.4 1.3 54.5-119.6 3.3 58.0 -0.3 63 63 A a T 3 S+ 0 0 39 1,-0.2 -40,-2.3 -2,-0.1 -1,-0.3 0.307 126.9 72.0 -77.0 -0.7 5.4 58.4 2.9 64 64 A N B < S-j 23 0C 146 -3,-2.5 -1,-0.2 1,-0.4 -2,-0.2 0.302 115.0 -80.1 -98.1 6.2 5.1 54.7 3.4 65 65 A G < - 0 0 20 -42,-1.1 -4,-2.3 -3,-1.0 -1,-0.4 -0.470 52.8-175.8 116.9 169.9 7.4 53.6 0.5 66 66 A G - 0 0 24 -6,-0.2 -6,-0.1 -2,-0.2 3,-0.1 -0.965 27.5 -78.4 178.5-175.4 7.0 53.2 -3.2 67 67 A Y > - 0 0 76 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.971 12.1-160.0-117.7 111.7 8.4 52.2 -6.6 68 68 A P H > S+ 0 0 12 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.815 100.0 56.5 -56.8 -36.2 10.8 54.2 -8.6 69 69 A W H > S+ 0 0 97 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.910 108.7 46.1 -66.0 -39.8 9.6 52.2 -11.6 70 70 A S H > S+ 0 0 1 2,-0.2 4,-2.2 -3,-0.2 3,-0.5 0.945 113.1 48.8 -62.7 -49.7 6.1 53.2 -10.9 71 71 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.3 5,-0.2 0.945 112.2 49.7 -54.2 -49.9 7.1 56.9 -10.5 72 72 A L H X S+ 0 0 0 -4,-3.1 4,-1.1 1,-0.2 -1,-0.3 0.795 107.5 52.9 -61.5 -31.9 9.0 56.8 -13.7 73 73 A Q H X S+ 0 0 104 -4,-1.5 4,-2.2 -3,-0.5 -1,-0.2 0.846 106.8 55.3 -70.4 -38.9 6.1 55.2 -15.6 74 74 A L H X S+ 0 0 29 -4,-2.2 4,-3.4 2,-0.2 5,-0.5 0.957 106.7 48.5 -58.8 -54.8 4.0 58.1 -14.3 75 75 A V H < S+ 0 0 1 -4,-2.1 32,-1.2 1,-0.2 -1,-0.2 0.796 112.2 49.8 -58.8 -32.2 6.4 60.7 -15.8 76 76 A A H < S+ 0 0 9 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.904 117.7 38.8 -75.7 -38.8 6.4 58.9 -19.1 77 77 A Q H < S+ 0 0 143 -4,-2.2 -2,-0.2 -3,-0.2 -3,-0.2 0.896 139.9 5.5 -76.8 -47.1 2.6 58.7 -19.3 78 78 A Y S < S- 0 0 150 -4,-3.4 2,-0.3 1,-0.2 -3,-0.2 0.845 93.8-129.0-108.2 -65.9 1.8 62.2 -17.9 79 79 A G - 0 0 5 -5,-0.5 2,-0.3 27,-0.1 27,-0.2 -0.819 18.8-101.8 138.7-173.6 4.9 64.3 -17.2 80 80 A I B -L 105 0E 0 25,-2.3 25,-2.1 -2,-0.3 24,-1.7 -0.953 18.9-122.8-147.3 158.2 6.2 66.3 -14.2 81 81 A H - 0 0 4 -2,-0.3 -32,-2.5 22,-0.3 -29,-0.1 -0.610 39.0 -91.0 -99.3 159.2 6.4 69.9 -12.9 82 82 A Y B > -K 48 0D 91 -34,-0.2 4,-1.8 -2,-0.2 -34,-0.3 -0.249 39.6-114.4 -63.0 153.4 9.4 71.9 -11.9 83 83 A R T 4 S+ 0 0 46 -36,-1.6 -35,-0.1 1,-0.2 -1,-0.1 0.815 115.2 54.4 -62.1 -37.1 10.3 71.6 -8.2 84 84 A N T 4 S+ 0 0 136 -37,-0.3 -1,-0.2 1,-0.2 -36,-0.1 0.878 107.4 50.9 -69.8 -37.6 9.5 75.2 -7.5 85 85 A T T 4 S+ 0 0 50 1,-0.3 -2,-0.2 15,-0.0 -1,-0.2 0.869 129.5 20.4 -59.8 -41.9 6.0 74.9 -9.0 86 86 A Y S < S- 0 0 0 -4,-1.8 -35,-0.5 14,-0.0 -34,-0.4 -0.675 91.2-169.9-129.0 73.1 5.4 71.8 -6.8 87 87 A P - 0 0 61 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.165 29.7 -92.3 -64.0 163.4 7.8 72.0 -4.0 88 88 A Y + 0 0 46 1,-0.1 -39,-0.0 2,-0.1 -5,-0.0 -0.584 39.1 170.8 -80.5 135.2 8.5 69.3 -1.4 89 89 A E - 0 0 78 -2,-0.3 -1,-0.1 2,-0.3 3,-0.1 0.432 43.5-126.8-118.3 -10.3 6.4 69.3 1.8 90 90 A G S S+ 0 0 24 1,-0.2 2,-0.3 -70,-0.1 -69,-0.1 0.751 82.6 83.4 64.1 29.4 7.5 65.9 3.2 91 91 A V S S- 0 0 78 -69,-0.1 2,-0.3 -67,-0.0 -2,-0.3 -0.942 83.6-110.1-153.3 147.2 3.9 64.8 3.6 92 92 A Q + 0 0 64 -2,-0.3 2,-0.2 -38,-0.1 -37,-0.1 -0.686 44.0 161.5 -83.3 135.4 1.4 63.3 1.1 93 93 A R - 0 0 116 -2,-0.3 3,-0.1 -42,-0.2 -4,-0.0 -0.622 49.9 -56.0-135.8-171.8 -1.5 65.6 0.0 94 94 A Y - 0 0 138 -2,-0.2 2,-0.5 1,-0.1 -1,-0.2 -0.287 65.1 -92.7 -70.3 159.3 -3.9 65.5 -3.0 95 95 A b - 0 0 58 -40,-0.3 3,-0.2 1,-0.1 4,-0.2 -0.626 42.4-178.6 -74.5 119.7 -2.4 65.4 -6.5 96 96 A R > + 0 0 12 -2,-0.5 4,-2.4 1,-0.2 -1,-0.1 0.208 41.0 118.9-109.4 17.4 -2.2 69.1 -7.7 97 97 A S T 4 S+ 0 0 8 1,-0.2 3,-0.4 2,-0.2 4,-0.2 0.901 81.1 41.4 -47.4 -61.2 -0.8 68.6 -11.2 98 98 A R T >4 S+ 0 0 252 1,-0.2 3,-1.7 2,-0.2 -1,-0.2 0.895 111.4 57.3 -58.8 -43.7 -3.8 70.1 -13.1 99 99 A E T 34 S+ 0 0 120 1,-0.3 -1,-0.2 -4,-0.2 -2,-0.2 0.887 107.5 52.3 -53.8 -36.2 -4.1 72.9 -10.5 100 100 A K T 3< S- 0 0 54 -4,-2.4 -1,-0.3 -3,-0.4 -2,-0.2 0.327 108.7-116.4 -87.2 5.0 -0.4 73.8 -11.3 101 101 A G < - 0 0 33 -3,-1.7 -1,-0.2 -4,-0.2 3,-0.1 -0.464 60.5 -11.2 95.8-173.4 -0.5 74.2 -15.1 102 102 A P S S- 0 0 122 0, 0.0 -23,-0.0 0, 0.0 -4,-0.0 -0.327 79.0 -96.5 -69.0 147.9 1.2 72.3 -17.9 103 103 A Y - 0 0 93 1,-0.1 -22,-0.3 -25,-0.1 3,-0.1 -0.345 21.1-140.8 -59.3 146.4 3.9 69.8 -17.0 104 104 A A S S+ 0 0 35 -24,-1.7 2,-0.3 1,-0.2 -23,-0.2 0.839 80.0 5.2 -77.8 -39.4 7.5 71.1 -17.3 105 105 A A B -L 80 0E 15 -25,-2.1 -25,-2.3 -23,-0.0 2,-0.4 -0.991 55.8-163.0-151.2 154.9 8.8 67.7 -18.8 106 106 A K - 0 0 93 -2,-0.3 -30,-0.2 -27,-0.2 2,-0.2 -0.993 12.0-149.4-135.8 142.8 7.8 64.3 -20.1 107 107 A T - 0 0 1 -32,-1.2 104,-0.3 -2,-0.4 3,-0.1 -0.516 15.6-132.6-104.7 173.3 9.9 61.2 -20.7 108 108 A D S S- 0 0 66 102,-3.5 2,-0.3 1,-0.3 103,-0.2 0.667 70.2 -37.0 -99.3 -22.3 9.2 58.5 -23.4 109 109 A G E -B 210 0A 16 101,-1.5 101,-2.2 -37,-0.1 2,-0.4 -0.970 51.2-104.7-178.0-172.9 9.6 55.3 -21.3 110 110 A V E -B 209 0A 33 -2,-0.3 2,-0.4 99,-0.3 -41,-0.0 -0.996 26.5-166.5-136.5 140.8 11.3 53.4 -18.5 111 111 A R E -B 208 0A 136 97,-2.7 97,-2.0 -2,-0.4 2,-0.4 -0.959 15.1-134.0-131.7 153.0 13.8 50.6 -18.8 112 112 A Q E -B 207 0A 102 -2,-0.4 2,-0.4 95,-0.2 95,-0.2 -0.792 19.1-130.7 -98.8 140.8 15.2 48.0 -16.4 113 113 A V - 0 0 8 93,-2.7 93,-0.4 -2,-0.4 8,-0.1 -0.765 41.0 -98.1 -86.0 133.1 18.9 47.3 -16.2 114 114 A Q - 0 0 128 -2,-0.4 3,-0.3 6,-0.1 6,-0.1 -0.437 54.9-119.9 -52.1 120.9 19.6 43.5 -16.3 115 115 A P S S+ 0 0 47 0, 0.0 89,-0.2 0, 0.0 -1,-0.1 -0.002 80.4 22.5 -67.3 167.1 20.0 42.7 -12.6 116 116 A Y S S+ 0 0 102 87,-2.1 2,-0.3 81,-0.2 82,-0.1 0.836 93.2 111.9 42.8 52.0 22.9 41.2 -10.6 117 117 A N > - 0 0 51 -3,-0.3 4,-1.4 86,-0.2 3,-0.2 -0.812 49.5-166.6-152.4 104.1 25.4 42.2 -13.3 118 118 A Q H > S+ 0 0 37 -2,-0.3 4,-2.5 1,-0.2 3,-0.4 0.896 88.9 55.8 -60.4 -47.3 27.9 44.9 -12.5 119 119 A G H > S+ 0 0 47 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.852 106.0 52.3 -52.9 -44.6 29.0 45.5 -16.1 120 120 A A H > S+ 0 0 25 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.857 111.2 46.8 -61.9 -40.2 25.4 46.2 -17.1 121 121 A L H X S+ 0 0 2 -4,-1.4 4,-2.7 -3,-0.4 -2,-0.2 0.871 110.5 51.3 -67.9 -44.7 25.0 48.8 -14.4 122 122 A L H X S+ 0 0 12 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.903 108.7 53.8 -61.9 -37.9 28.3 50.5 -15.2 123 123 A Y H X S+ 0 0 141 -4,-2.1 4,-0.9 -5,-0.2 -1,-0.2 0.922 110.8 44.0 -59.0 -48.1 27.3 50.7 -18.8 124 124 A S H >X S+ 0 0 12 -4,-1.5 4,-2.4 2,-0.2 3,-1.3 0.949 111.9 52.7 -59.4 -53.9 24.0 52.4 -17.9 125 125 A I H 3< S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.899 103.2 58.0 -50.7 -47.2 25.7 54.8 -15.5 126 126 A A H 3< S+ 0 0 19 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.802 112.9 42.9 -54.3 -30.1 28.1 55.7 -18.3 127 127 A N H << S- 0 0 80 -3,-1.3 -2,-0.3 -4,-0.9 -1,-0.2 0.798 131.1 -39.0 -85.0 -36.3 24.9 56.7 -20.1 128 128 A Q S < S- 0 0 14 -4,-2.4 -1,-0.3 35,-0.0 -95,-0.1 -0.935 74.9 -61.2 179.3 164.3 23.0 58.6 -17.4 129 129 A P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 35,-0.2 -0.284 56.5-155.2 -60.3 139.3 22.1 58.6 -13.7 130 130 A V E -C 163 0A 0 33,-2.0 33,-2.7 78,-0.1 2,-0.4 -0.952 17.4-117.0-126.4 144.7 20.2 55.4 -12.8 131 131 A S E +CD 162 207A 0 76,-3.6 76,-1.8 -2,-0.4 2,-0.3 -0.649 43.6 169.8 -79.2 126.5 17.7 54.5 -10.0 132 132 A V E -C 161 0A 0 29,-2.6 29,-3.1 -2,-0.4 2,-0.3 -0.924 21.5-145.1-137.2 158.8 19.2 51.8 -7.8 133 133 A V E +C 160 0A 17 69,-0.3 71,-0.3 -2,-0.3 72,-0.3 -0.890 19.7 168.2-125.7 158.7 18.1 50.2 -4.5 134 134 A L E -C 159 0A 0 25,-1.9 24,-2.1 -2,-0.3 25,-1.9 -0.896 44.6 -87.6-158.6 171.0 20.2 48.9 -1.6 135 135 A Q + 0 0 9 65,-2.0 22,-0.2 19,-0.3 3,-0.1 -0.827 46.7 162.4 -90.5 113.7 19.9 47.8 2.0 136 136 A A + 0 0 4 -2,-0.7 6,-0.2 20,-0.3 -1,-0.1 0.432 47.7 94.0-112.1 -3.2 20.2 50.9 4.2 137 137 A A + 0 0 63 19,-0.3 -1,-0.1 4,-0.1 2,-0.1 0.727 61.1 94.7 -64.4 -29.7 18.7 49.6 7.5 138 138 A G S > S- 0 0 29 -3,-0.1 4,-1.7 1,-0.1 3,-0.2 -0.365 80.6-124.4 -67.5 150.1 22.0 48.6 9.1 139 139 A K H > S+ 0 0 152 1,-0.2 4,-3.1 2,-0.2 -1,-0.1 0.716 107.7 61.2 -64.0 -32.3 23.7 51.0 11.5 140 140 A D H 4 S+ 0 0 82 2,-0.2 -1,-0.2 12,-0.2 13,-0.1 0.909 106.5 45.4 -65.1 -46.7 26.9 50.9 9.5 141 141 A F H >4 S+ 0 0 2 11,-0.3 3,-1.4 -3,-0.2 -2,-0.2 0.876 115.7 49.4 -60.7 -44.8 25.2 52.3 6.4 142 142 A Q H 3< S+ 0 0 84 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.880 111.7 44.3 -66.4 -43.3 23.5 54.8 8.5 143 143 A L T 3< S+ 0 0 125 -4,-3.1 -1,-0.3 38,-0.1 2,-0.2 0.055 80.6 145.7 -87.5 22.6 26.5 56.1 10.4 144 144 A Y < + 0 0 15 -3,-1.4 38,-1.4 1,-0.1 3,-0.1 -0.505 21.2 176.4 -61.8 123.2 28.5 56.2 7.1 145 145 A R - 0 0 220 1,-0.5 2,-0.2 -2,-0.2 -1,-0.1 0.268 54.1 -62.7-112.9 3.4 30.9 59.3 7.4 146 146 A G S S+ 0 0 28 37,-0.1 -1,-0.5 1,-0.1 2,-0.2 -0.537 84.1 84.6 129.9 165.4 32.9 59.0 4.1 147 147 A G S S- 0 0 30 -2,-0.2 2,-0.8 -3,-0.1 41,-0.7 -0.540 91.3 -38.9 103.6-172.4 35.4 56.6 2.4 148 148 A I E -e 188 0A 53 -2,-0.2 2,-0.4 39,-0.1 41,-0.2 -0.837 64.1-140.9 -88.6 110.4 34.7 53.5 0.3 149 149 A F E +e 189 0A 14 39,-3.4 41,-3.6 -2,-0.8 50,-0.1 -0.601 32.0 165.2 -77.6 134.1 31.7 51.8 1.9 150 150 A V - 0 0 89 1,-0.6 3,-0.2 -2,-0.4 -1,-0.1 0.240 37.6-137.1-129.3 8.1 32.1 48.0 1.9 151 151 A G - 0 0 11 1,-0.3 -1,-0.6 48,-0.1 2,-0.2 -0.674 38.9-140.7 107.7-162.9 29.4 46.9 4.5 152 152 A P S S+ 0 0 90 0, 0.0 -1,-0.3 0, 0.0 2,-0.3 0.398 71.2 127.8 -63.0 146.2 28.8 45.2 6.7 153 153 A c - 0 0 42 -3,-0.2 47,-0.5 -2,-0.2 48,-0.2 -0.902 48.9-136.6-173.4 144.4 25.4 44.8 5.1 154 154 A G - 0 0 26 -2,-0.3 -19,-0.3 46,-0.1 -16,-0.1 0.014 35.5-106.4 -86.4-165.5 22.9 42.1 4.0 155 155 A N S S+ 0 0 72 -21,-0.1 2,-1.6 46,-0.1 44,-0.0 -0.085 71.9 128.3-120.8 32.9 20.9 42.3 0.7 156 156 A K - 0 0 136 2,-0.0 -19,-0.3 -21,-0.0 -20,-0.3 -0.600 53.2-150.9 -85.4 72.9 17.5 43.1 2.2 157 157 A V + 0 0 53 -2,-1.6 -22,-0.3 -22,-0.2 3,-0.1 -0.186 39.8 144.2 -56.4 137.1 16.9 46.1 -0.1 158 158 A D + 0 0 79 -24,-2.1 2,-0.4 1,-0.2 -23,-0.2 0.295 49.8 71.1-154.3 5.1 14.7 48.9 1.4 159 159 A H E -C 134 0A 13 -25,-1.9 -25,-1.9 -134,-0.1 2,-0.5 -0.999 60.1-147.0-138.6 133.5 16.0 52.2 0.2 160 160 A A E +C 133 0A 6 -2,-0.4 -131,-0.2 -27,-0.2 -27,-0.2 -0.922 31.6 151.3-106.7 132.3 15.9 53.8 -3.2 161 161 A V E -C 132 0A 4 -29,-3.1 -29,-2.6 -2,-0.5 2,-0.4 -0.697 37.4-105.4-138.9-175.2 18.8 56.0 -4.3 162 162 A A E -CF 131 174A 0 12,-1.6 12,-2.8 -31,-0.2 2,-0.6 -0.987 12.7-138.6-131.5 140.2 20.6 57.1 -7.5 163 163 A A E +CF 130 173A 0 -33,-2.7 -33,-2.0 -2,-0.4 10,-0.2 -0.857 26.0 168.5 -98.1 119.5 23.9 56.2 -9.1 164 164 A V E - 0 0 0 8,-2.4 -157,-2.7 -2,-0.6 -156,-0.4 0.248 59.9 -17.7-117.3 3.6 25.6 59.3 -10.5 165 165 A G E -AF 6 172A 0 7,-1.0 7,-1.9 -159,-0.2 2,-0.3 -0.981 52.9-145.6 174.2-175.7 29.1 58.0 -11.3 166 166 A Y E -AF 5 171A 4 -161,-2.0 -161,-2.6 -2,-0.3 5,-0.2 -0.959 6.7-169.3-167.8 165.3 31.7 55.3 -10.7 167 167 A G - 0 0 0 3,-1.9 3,-0.4 -2,-0.3 -163,-0.1 -0.745 53.7 -62.7-144.5-168.6 35.5 54.8 -10.5 168 168 A P S S+ 0 0 58 0, 0.0 -164,-0.1 0, 0.0 3,-0.0 0.853 129.3 11.7 -56.3 -44.2 38.0 51.9 -10.4 169 169 A N S S+ 0 0 66 21,-0.0 22,-1.7 24,-0.0 2,-0.3 0.158 121.6 45.1-125.5 21.0 36.6 50.4 -7.1 170 170 A Y E - G 0 190A 33 -3,-0.4 -3,-1.9 20,-0.3 2,-0.4 -0.962 61.8-128.1-155.6 169.8 33.3 52.1 -6.3 171 171 A I E -FG 166 189A 0 18,-2.0 18,-2.9 -2,-0.3 2,-0.7 -0.989 31.3-129.5-119.9 134.9 29.9 53.3 -7.5 172 172 A L E -FG 165 188A 6 -7,-1.9 -8,-2.4 -2,-0.4 -7,-1.0 -0.825 27.8-170.8 -93.9 120.4 29.0 56.9 -6.7 173 173 A I E -FG 163 187A 0 14,-4.2 14,-2.8 -2,-0.7 2,-0.6 -0.929 18.7-148.6-114.6 138.5 25.6 57.2 -5.1 174 174 A K E -FG 162 186A 7 -12,-2.8 -12,-1.6 -2,-0.4 12,-0.2 -0.872 23.7-167.7 -98.4 116.3 23.6 60.4 -4.3 175 175 A N - 0 0 4 10,-2.0 -158,-0.4 -2,-0.6 3,-0.2 -0.377 22.2-133.8 -96.3 178.8 21.4 59.8 -1.2 176 176 A S S S+ 0 0 8 1,-0.1 -157,-3.1 -2,-0.1 -156,-0.4 -0.172 75.0 102.5-131.9 43.9 18.5 62.0 0.1 177 177 A W B S-I 18 0B 69 1,-0.4 -159,-0.3 8,-0.3 3,-0.2 0.077 93.1 -88.5-107.4 20.7 19.4 62.2 3.7 178 178 A G > - 0 0 13 -161,-2.3 3,-0.9 -3,-0.2 -1,-0.4 -0.200 43.0 -79.3 94.0 161.0 20.8 65.8 3.6 179 179 A T T 3 S+ 0 0 99 1,-0.2 6,-0.3 -163,-0.2 5,-0.2 0.567 119.9 73.1 -81.3 -11.0 24.3 67.1 3.0 180 180 A G T 3 S+ 0 0 80 -3,-0.2 2,-0.4 4,-0.2 -1,-0.2 0.395 82.9 84.1 -85.1 0.3 25.4 66.2 6.5 181 181 A W S <> S- 0 0 26 -3,-0.9 4,-2.4 2,-0.1 -36,-0.2 -0.902 99.9 -34.4-111.2 137.3 25.4 62.5 5.8 182 182 A G T 4 S- 0 0 16 -38,-1.4 2,-1.5 -2,-0.4 5,-0.2 -0.289 124.7 -2.6 60.7-137.9 28.3 60.6 4.2 183 183 A E B >4 S-H 186 0A 49 3,-3.3 3,-0.6 1,-0.2 -1,-0.2 -0.611 133.0 -49.5 -93.4 81.1 30.4 62.4 1.7 184 184 A N T 34 S- 0 0 131 -2,-1.5 -1,-0.2 1,-0.3 -4,-0.2 0.901 119.7 -41.7 60.8 37.6 28.5 65.7 1.5 185 185 A G T 3< S+ 0 0 0 -4,-2.4 -10,-2.0 1,-0.4 -8,-0.3 0.493 123.6 102.9 88.6 6.0 25.3 63.5 1.1 186 186 A Y E < -HG 183 174A 16 -3,-0.6 -3,-3.3 -12,-0.2 2,-0.4 -0.713 54.1-151.6-114.0 165.6 26.9 61.0 -1.3 187 187 A I E - G 0 173A 0 -14,-2.8 -14,-4.2 -2,-0.3 2,-0.7 -0.996 7.2-150.9-142.1 134.4 28.2 57.5 -0.8 188 188 A R E -eG 148 172A 66 -41,-0.7 -39,-3.4 -2,-0.4 2,-0.5 -0.930 23.0-160.8-103.6 108.9 31.0 55.6 -2.7 189 189 A I E -eG 149 171A 0 -18,-2.9 -18,-2.0 -2,-0.7 -39,-0.2 -0.869 25.2-103.9-101.3 131.2 30.1 51.9 -2.5 190 190 A K E - G 0 170A 71 -41,-3.6 9,-0.5 -2,-0.5 -20,-0.3 -0.155 42.7-170.2 -50.3 128.9 32.6 49.2 -3.1 191 191 A R + 0 0 56 -22,-1.7 -1,-0.0 1,-0.1 -20,-0.0 -0.738 54.1 36.8-118.0 171.0 32.3 47.7 -6.6 192 192 A G + 0 0 50 -2,-0.3 -1,-0.1 3,-0.1 -2,-0.0 0.600 62.8 129.1 61.3 28.6 33.9 44.6 -8.2 193 193 A T S S- 0 0 76 2,-0.2 3,-0.1 -3,-0.1 -1,-0.1 0.362 78.2-114.1 -87.6 0.8 34.1 42.2 -5.3 194 194 A G S S+ 0 0 75 1,-0.3 2,-0.7 2,-0.0 -3,-0.0 0.456 72.1 137.8 80.8 -0.4 32.4 39.4 -7.4 195 195 A N > - 0 0 74 1,-0.1 3,-1.0 2,-0.0 -1,-0.3 -0.698 45.3-153.8 -79.6 116.0 29.2 39.4 -5.2 196 196 A S T 3 S+ 0 0 71 -2,-0.7 -1,-0.1 1,-0.3 3,-0.1 0.690 93.7 57.6 -65.4 -22.9 26.4 39.2 -7.8 197 197 A Y T 3 S- 0 0 119 1,-0.1 6,-3.2 -81,-0.1 7,-0.4 0.708 110.5-129.6 -73.7 -30.3 23.9 40.9 -5.4 198 198 A G X - 0 0 2 -3,-1.0 3,-2.3 4,-0.3 5,-0.1 0.131 44.7 -52.6 88.1 157.4 26.3 43.8 -5.3 199 199 A V G > S+ 0 0 15 -9,-0.5 3,-1.3 1,-0.3 -45,-0.1 -0.389 136.4 5.5 -60.0 134.6 27.4 45.2 -1.8 200 200 A c G 3 S- 0 0 3 -47,-0.5 -65,-2.0 1,-0.2 -1,-0.3 0.635 133.3 -71.9 64.1 12.0 24.2 45.9 0.2 201 201 A G G X S+ 0 0 1 -3,-2.3 3,-2.0 -67,-0.2 4,-0.3 0.802 79.0 163.6 69.7 35.5 22.4 44.3 -2.8 202 202 A L T < + 0 0 1 -3,-1.3 -69,-0.3 1,-0.3 -4,-0.3 0.648 68.7 54.7 -56.8 -15.5 23.1 47.3 -5.1 203 203 A Y T 3 S+ 0 0 8 -6,-3.2 -87,-2.1 1,-0.1 -1,-0.3 0.346 77.7 95.3-106.7 9.8 22.3 45.2 -8.2 204 204 A T S < S+ 0 0 33 -3,-2.0 2,-0.2 -7,-0.4 -1,-0.1 0.899 97.9 3.2 -63.1 -45.8 18.8 43.9 -7.3 205 205 A S + 0 0 32 -4,-0.3 2,-0.4 -72,-0.3 -1,-0.2 -0.708 66.8 164.8-159.2 104.2 16.7 46.5 -9.1 206 206 A S + 0 0 5 -93,-0.4 -93,-2.7 -3,-0.3 2,-0.3 -0.931 6.7 174.1-124.7 134.3 17.8 49.4 -11.3 207 207 A F E -BD 112 131A 26 -76,-1.8 -76,-3.6 -2,-0.4 -95,-0.2 -0.926 8.1-172.7-137.1 161.8 15.9 51.6 -13.7 208 208 A Y E -B 111 0A 39 -97,-2.0 -97,-2.7 -2,-0.3 2,-0.2 -0.992 28.1-107.2-155.9 147.5 16.3 54.7 -15.8 209 209 A P E -B 110 0A 0 0, 0.0 2,-0.4 0, 0.0 -99,-0.3 -0.499 23.1-138.5 -78.4 150.8 14.1 56.9 -17.9 210 210 A V E +B 109 0A 18 -101,-2.2 -102,-3.5 -2,-0.2 -101,-1.5 -0.912 23.4 175.5-110.9 126.8 14.1 56.9 -21.7 211 211 A K 0 0 41 -2,-0.4 -104,-0.1 -104,-0.3 -135,-0.0 -0.946 360.0 360.0-139.9 111.3 13.9 60.2 -23.5 212 212 A N 0 0 164 -2,-0.4 -1,-0.1 0, 0.0 -105,-0.1 0.719 360.0 360.0 -71.4 360.0 14.1 60.6 -27.3