==== 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 HYDROLASE/HYDROLASE INHIBITOR 24-JUN-93 1POP . COMPND 2 MOLECULE: PAPAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CARICA PAPAYA; . AUTHOR E.SCHRODER,C.CRAWFORD . 215 2 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9655.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 18.6 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 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.4 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 1 0 1 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 2 0 1 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 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 0 127 0, 0.0 4,-0.1 0, 0.0 122,-0.1 0.000 360.0 360.0 360.0 154.4 36.5 57.4 -2.9 2 2 A P - 0 0 76 0, 0.0 3,-0.1 0, 0.0 124,-0.0 -0.067 360.0-121.6 -67.0 169.0 39.9 56.9 -1.2 3 3 A E S S+ 0 0 135 1,-0.2 2,-0.4 165,-0.0 0, 0.0 0.855 103.8 28.5 -72.4 -41.2 40.9 54.4 1.5 4 4 A Y - 0 0 131 163,-0.1 2,-0.4 164,-0.1 -1,-0.2 -0.984 67.3-176.9-122.6 134.1 41.9 57.3 3.8 5 5 A V E +A 166 0A 8 161,-2.2 161,-2.1 -2,-0.4 2,-0.2 -0.995 8.2 166.6-126.3 136.6 40.6 60.9 3.7 6 6 A D E >> -A 165 0A 16 -2,-0.4 4,-1.0 159,-0.2 3,-0.9 -0.739 18.0-166.6-149.6 104.8 41.9 63.6 6.0 7 7 A W T 34>S+ 0 0 29 157,-2.5 5,-2.3 1,-0.3 6,-0.4 0.673 86.1 65.8 -68.3 -16.8 41.0 67.3 5.3 8 8 A R T >45S+ 0 0 99 156,-0.4 3,-1.8 4,-0.2 -1,-0.3 0.917 101.0 52.4 -67.8 -38.6 43.7 68.7 7.6 9 9 A Q T <45S+ 0 0 154 -3,-0.9 -2,-0.2 1,-0.3 -1,-0.2 0.830 106.9 52.8 -68.5 -27.4 46.3 67.3 5.2 10 10 A K T 3<5S- 0 0 103 -4,-1.0 -1,-0.3 1,-0.0 -2,-0.2 0.373 118.5-112.8 -87.5 4.5 44.5 69.0 2.3 11 11 A G T < 5S+ 0 0 30 -3,-1.8 -3,-0.2 2,-0.1 -2,-0.1 0.745 85.8 112.9 75.8 24.7 44.6 72.4 4.1 12 12 A A < + 0 0 2 -5,-2.3 2,-0.4 33,-0.1 -4,-0.2 0.299 55.8 79.5-111.4 9.3 40.9 72.8 4.7 13 13 A V - 0 0 19 -6,-0.4 3,-0.1 -5,-0.2 -2,-0.1 -0.977 63.6-152.5-121.1 130.6 40.8 72.6 8.6 14 14 A T - 0 0 7 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.397 43.0 -61.2 -85.6 172.5 41.7 75.5 10.9 15 15 A P - 0 0 89 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.097 61.7 -92.4 -53.6 156.1 43.1 75.1 14.5 16 16 A V - 0 0 29 168,-0.2 2,-0.2 -3,-0.1 163,-0.2 -0.480 44.6-155.3 -75.5 141.1 41.2 73.4 17.3 17 17 A K - 0 0 24 158,-0.3 161,-2.2 -2,-0.2 2,-0.4 -0.617 9.9-134.1-114.0 164.1 39.1 75.7 19.3 18 18 A N B -I 177 0B 93 159,-0.2 159,-0.2 -2,-0.2 158,-0.1 -0.992 5.8-164.4-126.2 122.1 37.7 75.5 22.9 19 19 A Q > - 0 0 8 157,-2.6 3,-0.7 -2,-0.4 158,-0.1 0.669 28.7-156.6 -77.3 -18.2 34.1 76.4 23.6 20 20 A G T 3 - 0 0 47 156,-0.3 -1,-0.2 1,-0.2 4,-0.1 -0.450 56.3 -27.6 74.2-153.3 34.6 76.8 27.4 21 21 A S T 3 S+ 0 0 137 -2,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.590 111.7 100.7 -67.9 -22.2 31.6 76.4 29.8 22 22 A a S < S- 0 0 5 -3,-0.7 2,-2.1 1,-0.1 3,-0.1 -0.559 76.9-133.0 -70.4 130.5 29.2 77.6 27.2 23 23 A G B +j 64 0C 10 40,-2.1 42,-0.5 -2,-0.3 3,-0.2 -0.522 63.3 131.8 -82.5 67.5 27.2 74.7 25.4 24 24 A S >> + 0 0 0 -2,-2.1 4,-1.9 192,-0.2 3,-1.5 0.111 19.3 121.7-102.7 17.7 27.9 76.3 22.0 25 25 A C H 3> + 0 0 0 191,-2.2 4,-3.0 1,-0.3 5,-0.2 0.826 69.2 62.1 -56.5 -31.6 29.1 73.1 20.2 26 26 A W H 3> S+ 0 0 0 189,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.863 106.5 43.8 -60.1 -38.2 26.4 73.4 17.6 27 27 A A H <> S+ 0 0 0 -3,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.943 113.5 50.5 -74.8 -46.5 27.9 76.8 16.5 28 28 A F H X S+ 0 0 11 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.927 111.3 50.0 -56.9 -41.7 31.5 75.4 16.6 29 29 A S H X S+ 0 0 2 -4,-3.0 4,-1.3 131,-0.2 -1,-0.2 0.916 110.4 48.2 -63.6 -50.1 30.4 72.4 14.5 30 30 A A H >X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 3,-0.6 0.953 108.7 55.9 -57.5 -47.0 28.6 74.5 11.8 31 31 A V H 3X S+ 0 0 1 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.876 101.4 54.4 -56.2 -44.9 31.7 76.8 11.5 32 32 A V H 3X S+ 0 0 11 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.892 109.6 49.1 -66.0 -27.5 34.2 74.0 10.7 33 33 A T H S+ 0 0 9 -4,-2.5 4,-2.8 -5,-0.2 5,-0.7 0.953 109.2 48.4 -61.5 -44.6 34.9 77.8 1.4 39 39 A K H X5S+ 0 0 63 -4,-1.6 4,-1.9 -5,-0.3 -2,-0.2 0.938 112.8 48.6 -58.5 -45.5 38.5 76.3 1.0 40 40 A I H <5S+ 0 0 51 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.907 119.7 36.0 -65.0 -41.3 37.2 73.7 -1.4 41 41 A R H <5S+ 0 0 125 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.805 134.8 17.3 -83.2 -31.9 35.3 76.1 -3.7 42 42 A T H <5S- 0 0 76 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.529 92.4-122.1-118.0 -14.1 37.5 79.2 -3.6 43 43 A G S < + 0 0 0 32,-1.9 4,-1.0 -2,-0.2 32,-0.2 -0.669 29.3 174.6 -90.3 114.5 32.6 83.4 13.8 50 50 A E H > S+ 0 0 5 -2,-0.7 4,-2.6 2,-0.2 3,-0.2 0.876 86.3 61.6 -71.9 -39.5 31.0 81.0 16.2 51 51 A Q H > S+ 0 0 0 35,-0.4 4,-2.6 1,-0.2 5,-0.3 0.883 98.9 55.6 -54.1 -41.0 30.0 84.0 18.4 52 52 A E H > S+ 0 0 5 34,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.920 110.9 44.0 -63.4 -38.5 27.9 85.5 15.6 53 53 A L H X S+ 0 0 2 -4,-1.0 4,-2.2 -3,-0.2 -2,-0.2 0.919 110.6 55.1 -70.9 -39.1 25.9 82.2 15.4 54 54 A L H < S+ 0 0 1 -4,-2.6 8,-0.2 1,-0.2 -2,-0.2 0.887 118.6 34.7 -56.6 -43.9 25.6 82.0 19.2 55 55 A D H < S+ 0 0 0 -4,-2.6 40,-0.3 -5,-0.2 -2,-0.2 0.832 124.6 38.6 -83.3 -36.6 24.1 85.6 19.3 56 56 A b H < S+ 0 0 21 -4,-2.5 2,-1.3 -5,-0.3 -3,-0.2 0.672 87.9 88.1 -97.6 -17.8 22.1 85.7 16.1 57 57 A D >< + 0 0 2 -4,-2.2 3,-0.8 -5,-0.2 5,-0.4 -0.657 49.9 179.1 -79.7 97.9 20.5 82.2 15.7 58 58 A R T 3 S+ 0 0 163 -2,-1.3 -1,-0.2 1,-0.2 -4,-0.0 0.311 73.6 67.6 -85.9 10.5 17.3 82.7 17.7 59 59 A R T 3 S+ 0 0 98 8,-0.1 -1,-0.2 -3,-0.0 2,-0.1 0.689 97.5 67.0 -91.0 -26.4 16.0 79.1 17.0 60 60 A S S < S- 0 0 9 -3,-0.8 6,-0.3 7,-0.1 3,-0.1 -0.436 86.1-126.9 -83.7 168.9 18.9 77.9 19.3 61 61 A Y > - 0 0 133 4,-2.5 3,-2.7 1,-0.3 5,-0.1 -0.252 36.3-128.2-113.6 42.7 19.2 78.6 23.0 62 62 A G T > S- 0 0 0 -5,-0.4 3,-1.6 1,-0.3 -1,-0.3 -0.183 84.9 -2.4 55.4-132.4 22.7 80.2 23.3 63 63 A a T 3 S+ 0 0 39 1,-0.3 -40,-2.1 -3,-0.1 -1,-0.3 0.487 127.4 70.8 -67.9 -5.7 24.9 78.6 25.8 64 64 A N B < S-j 23 0C 126 -3,-2.7 -1,-0.3 1,-0.4 -2,-0.2 0.428 117.1 -81.9 -91.4 -1.5 22.0 76.2 26.8 65 65 A G < - 0 0 0 -3,-1.6 -4,-2.5 -42,-0.5 -1,-0.4 -0.468 52.6-178.3 123.5 165.9 22.3 74.3 23.5 66 66 A G B -L 215 0E 0 149,-2.7 149,-2.2 -6,-0.3 -6,-0.1 -0.930 30.6 -67.4-173.9-162.0 21.1 74.6 19.9 67 67 A Y > - 0 0 65 -2,-0.3 4,-1.8 147,-0.1 3,-0.3 -0.953 15.4-155.9-122.9 121.0 20.9 73.2 16.4 68 68 A P H > S+ 0 0 6 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.887 99.6 53.7 -54.9 -45.1 23.7 72.7 13.8 69 69 A W H > S+ 0 0 93 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.861 106.4 50.6 -64.5 -37.2 21.2 72.8 10.9 70 70 A S H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.905 109.9 50.7 -68.5 -37.6 19.7 76.2 12.0 71 71 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.911 112.6 47.0 -64.7 -38.1 23.2 77.7 12.2 72 72 A L H X S+ 0 0 0 -4,-2.1 4,-1.0 2,-0.2 -2,-0.2 0.891 111.8 49.5 -70.4 -37.5 23.9 76.4 8.7 73 73 A Q H >X S+ 0 0 60 -4,-2.4 4,-2.6 1,-0.2 3,-0.8 0.924 107.2 55.9 -66.2 -41.4 20.6 77.8 7.4 74 74 A L H 3X>S+ 0 0 26 -4,-2.6 4,-2.7 1,-0.3 5,-1.1 0.930 105.2 52.1 -55.1 -44.7 21.3 81.2 8.9 75 75 A V H 3<5S+ 0 0 0 -4,-1.8 32,-1.1 1,-0.2 -1,-0.3 0.778 111.9 46.8 -68.5 -22.3 24.6 81.3 7.0 76 76 A A H <<5S+ 0 0 22 -4,-1.0 -1,-0.2 -3,-0.8 -2,-0.2 0.792 115.8 43.8 -85.2 -34.0 22.7 80.6 3.8 77 77 A Q H <5S- 0 0 94 -4,-2.6 -2,-0.2 -5,-0.1 -3,-0.2 0.827 140.5 -2.0 -77.4 -34.3 20.0 83.2 4.4 78 78 A Y T <5S- 0 0 128 -4,-2.7 2,-0.3 -5,-0.3 -3,-0.2 0.718 92.5-125.6-126.3 -56.8 22.4 85.9 5.6 79 79 A G < - 0 0 5 -5,-1.1 2,-0.3 25,-0.1 27,-0.2 -0.795 18.8 -97.0 134.5-168.9 26.0 85.0 5.8 80 80 A I B -M 105 0F 0 25,-2.0 24,-1.9 -2,-0.3 25,-1.7 -0.982 20.1-131.1-152.4 153.4 28.8 85.1 8.3 81 81 A H - 0 0 4 -2,-0.3 -32,-1.9 22,-0.2 -29,-0.1 -0.575 40.2 -84.6 -98.0 162.2 31.7 87.4 9.4 82 82 A Y B >> -K 48 0D 95 -34,-0.2 4,-1.2 -2,-0.2 3,-0.6 -0.396 34.2-121.2 -66.9 150.6 35.4 86.5 10.0 83 83 A R T 34 S+ 0 0 52 -36,-2.3 -35,-0.2 1,-0.3 -1,-0.1 0.797 113.8 59.8 -61.3 -34.9 36.2 85.2 13.4 84 84 A N T 34 S+ 0 0 152 -37,-0.4 -1,-0.3 1,-0.2 -36,-0.1 0.848 107.0 43.9 -62.1 -40.2 38.6 88.1 13.7 85 85 A T T <4 S+ 0 0 61 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.2 0.667 127.1 29.8 -84.0 -20.5 35.9 90.7 13.3 86 86 A Y S < S- 0 0 2 -4,-1.2 -35,-0.4 -5,-0.0 -34,-0.4 -0.609 88.2-167.9-137.7 71.8 33.4 88.9 15.6 87 87 A P - 0 0 72 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 -0.113 27.4 -92.7 -65.6 161.7 35.5 87.1 18.3 88 88 A Y + 0 0 50 1,-0.1 -5,-0.0 -5,-0.1 -39,-0.0 -0.647 39.0 168.7 -84.5 124.9 34.4 84.5 20.8 89 89 A E - 0 0 83 -2,-0.4 -1,-0.1 2,-0.3 3,-0.1 0.543 41.5-128.9-108.7 -23.8 33.3 85.6 24.2 90 90 A G S S+ 0 0 24 1,-0.2 2,-0.3 -70,-0.1 -2,-0.1 0.591 81.4 82.3 84.9 8.5 31.7 82.4 25.6 91 91 A V S S- 0 0 76 -69,-0.1 2,-0.4 -70,-0.0 -2,-0.3 -0.964 86.9-107.3-141.3 145.4 28.4 84.1 26.7 92 92 A Q + 0 0 68 -2,-0.3 2,-0.2 -3,-0.1 -37,-0.1 -0.723 46.3 168.1 -82.1 133.3 25.4 84.9 24.4 93 93 A R - 0 0 125 -2,-0.4 2,-0.2 -42,-0.2 -31,-0.0 -0.364 43.1 -54.3-126.6-170.3 25.1 88.7 23.7 94 94 A Y - 0 0 158 -2,-0.2 2,-0.8 1,-0.1 -1,-0.2 -0.474 62.9 -97.3 -74.3 147.6 23.1 90.8 21.3 95 95 A b + 0 0 40 -40,-0.3 3,-0.2 -2,-0.2 -1,-0.1 -0.559 46.5 177.0 -71.7 106.2 23.2 90.0 17.6 96 96 A R > + 0 0 44 -2,-0.8 4,-0.7 1,-0.2 -1,-0.2 0.064 37.7 118.3-101.3 29.3 25.8 92.5 16.4 97 97 A S T >4 S+ 0 0 6 1,-0.2 3,-1.5 2,-0.2 4,-0.2 0.916 73.7 53.1 -60.8 -43.6 26.1 91.6 12.7 98 98 A R G >4 S+ 0 0 146 1,-0.3 3,-1.3 -3,-0.2 -1,-0.2 0.866 105.8 55.7 -62.4 -35.1 24.9 95.0 11.2 99 99 A E G 34 S+ 0 0 122 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.2 0.692 101.5 58.7 -68.8 -20.5 27.6 96.8 13.3 100 100 A K G << S- 0 0 77 -3,-1.5 -1,-0.3 -4,-0.7 -2,-0.2 0.351 102.6-133.2 -95.5 5.0 30.3 94.6 11.8 101 101 A G < + 0 0 36 -3,-1.3 -1,-0.3 -4,-0.2 -2,-0.0 -0.366 58.8 9.7 82.1-159.8 29.7 95.6 8.2 102 102 A P S S- 0 0 121 0, 0.0 2,-0.0 0, 0.0 -4,-0.0 -0.193 79.8-105.2 -63.0 142.3 29.4 93.3 5.1 103 103 A Y - 0 0 95 -25,-0.1 -22,-0.2 1,-0.1 3,-0.1 -0.381 19.5-145.7 -62.4 145.2 29.3 89.6 5.5 104 104 A A S S+ 0 0 35 -24,-1.9 2,-0.3 1,-0.2 -23,-0.2 0.720 76.8 8.6 -85.7 -30.4 32.5 87.8 4.6 105 105 A A B -M 80 0F 14 -25,-1.7 -25,-2.0 -30,-0.0 2,-0.3 -0.982 57.2-171.7-147.4 159.0 30.9 84.6 3.2 106 106 A K - 0 0 105 -2,-0.3 2,-0.2 -27,-0.2 -30,-0.2 -0.979 15.1-144.0-152.2 137.0 27.4 83.3 2.2 107 107 A T - 0 0 5 -32,-1.1 104,-0.2 -2,-0.3 3,-0.1 -0.652 17.0-127.9-104.4 165.6 26.4 79.7 1.2 108 108 A D S S- 0 0 78 102,-2.4 2,-0.3 -2,-0.2 103,-0.2 0.396 73.1 -58.3 -92.6 -0.7 23.8 78.4 -1.3 109 109 A G E -B 210 0A 13 101,-0.8 101,-2.6 -37,-0.1 2,-0.3 -0.947 49.7 -93.2 154.2-167.9 22.0 76.1 1.1 110 110 A V E -B 209 0A 31 -2,-0.3 2,-0.3 99,-0.3 97,-0.0 -0.975 26.1-163.8-144.9 142.3 22.2 73.1 3.4 111 111 A R E -B 208 0A 143 97,-2.5 97,-2.2 -2,-0.3 2,-0.3 -0.978 13.2-137.2-130.7 148.7 21.7 69.3 2.9 112 112 A Q E -B 207 0A 98 -2,-0.3 95,-0.3 95,-0.2 2,-0.2 -0.804 20.2-130.7 -98.2 138.7 21.1 66.4 5.2 113 113 A V - 0 0 11 93,-2.5 93,-0.5 -2,-0.3 8,-0.1 -0.634 43.5 -85.4 -85.1 153.6 22.9 63.0 4.6 114 114 A Q > - 0 0 128 -2,-0.2 3,-0.6 91,-0.1 7,-0.2 -0.411 56.0-121.0 -57.2 114.8 20.7 59.9 4.7 115 115 A P T 3 S+ 0 0 54 0, 0.0 89,-0.2 0, 0.0 -1,-0.1 -0.190 84.2 17.8 -62.9 155.1 20.5 58.9 8.5 116 116 A Y T 3 S+ 0 0 107 87,-3.0 2,-0.4 81,-0.2 82,-0.1 0.749 94.4 112.8 56.5 38.7 21.6 55.6 9.9 117 117 A N <> - 0 0 52 -3,-0.6 4,-1.4 86,-0.2 3,-0.2 -0.926 49.5-163.9-141.2 109.7 23.7 54.7 6.9 118 118 A Q H > S+ 0 0 39 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.869 89.8 55.4 -63.0 -36.5 27.5 54.5 7.2 119 119 A G H > S+ 0 0 43 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.879 103.5 54.0 -67.3 -37.1 28.1 54.5 3.4 120 120 A A H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.936 110.3 47.5 -61.7 -43.7 26.2 57.8 2.9 121 121 A L H X S+ 0 0 2 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.908 110.7 50.4 -67.6 -45.2 28.4 59.5 5.6 122 122 A L H X S+ 0 0 17 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.915 109.8 51.2 -58.5 -43.9 31.7 58.2 4.1 123 123 A Y H < S+ 0 0 141 -4,-2.4 4,-0.5 2,-0.2 -2,-0.2 0.928 112.9 45.9 -64.3 -41.0 30.7 59.4 0.6 124 124 A S H >X S+ 0 0 12 -4,-2.2 3,-2.0 1,-0.2 4,-1.8 0.966 110.5 52.3 -67.6 -43.3 29.8 62.9 2.0 125 125 A I H 3< S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.870 102.7 58.9 -60.2 -37.4 33.1 63.1 4.1 126 126 A A T 3< S+ 0 0 21 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.686 112.5 41.7 -65.0 -15.8 35.2 62.3 1.0 127 127 A N T <4 S- 0 0 82 -3,-2.0 -2,-0.2 -4,-0.5 -1,-0.2 0.743 131.8 -27.6 -97.6 -32.1 33.6 65.5 -0.5 128 128 A Q S < S- 0 0 18 -4,-1.8 -1,-0.4 35,-0.0 37,-0.1 -0.963 76.2 -71.4-170.4 161.3 33.7 67.9 2.5 129 129 A P - 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