==== 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 18-AUG-04 1W6I . COMPND 2 MOLECULE: PLASMEPSIN 2 PRECURSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR J.LINDBERG,P.-O.JOHANSSON,A.ROSENQUIST,I.KVARNSTROEM,L.VRANG . 668 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29443.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 490 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 217 32.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 86 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 51 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 4 0 2 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 4 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 9 6 9 3 6 1 1 0 0 2 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 2 0 0 0 2 0 0 0 0 0 1 1 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 S 0 0 135 0, 0.0 4,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -42.9 35.3 51.6 3.5 2 2 A S + 0 0 112 2,-0.1 2,-0.3 0, 0.0 0, 0.0 0.683 360.0 49.1 -86.9 -20.4 33.5 55.0 3.5 3 3 A N S S- 0 0 33 146,-0.1 2,-0.3 169,-0.1 168,-0.2 -0.759 100.5 -80.9-119.0 166.1 36.3 56.5 5.6 4 4 A D E -A 170 0A 4 166,-1.2 166,-3.2 -2,-0.3 2,-0.5 -0.462 44.7-169.1 -67.1 124.3 40.1 56.7 5.6 5 5 A N E -A 169 0A 38 -2,-0.3 2,-0.6 164,-0.2 164,-0.2 -0.952 8.5-167.9-123.4 118.5 41.7 53.5 7.1 6 6 A I E -A 168 0A 11 162,-2.4 162,-1.6 -2,-0.5 2,-0.1 -0.896 24.8-127.0-105.2 120.3 45.4 53.2 7.9 7 7 A E E -A 167 0A 111 -2,-0.6 12,-0.5 160,-0.2 2,-0.4 -0.372 25.1-152.2 -66.6 136.7 46.6 49.7 8.7 8 8 A L E -AB 166 18A 0 158,-2.5 158,-2.1 149,-0.2 2,-0.4 -0.873 8.8-164.4-113.9 146.4 48.5 49.4 12.0 9 9 A V E - B 0 17A 82 8,-2.3 8,-2.8 -2,-0.4 2,-0.1 -0.966 22.3-117.2-128.7 144.0 51.2 46.9 13.0 10 10 A D E - B 0 16A 28 -2,-0.4 2,-0.5 6,-0.3 6,-0.3 -0.428 15.6-146.0 -80.3 156.0 52.4 46.1 16.5 11 11 A F E >> S- B 0 15A 30 4,-2.3 4,-1.7 1,-0.1 3,-1.1 -0.962 81.5 -25.1-124.1 111.2 56.0 46.7 17.6 12 12 A Q T 34 S- 0 0 155 -2,-0.5 -1,-0.1 1,-0.2 4,-0.1 0.865 112.8 -75.3 52.2 39.2 57.3 44.2 20.1 13 13 A N T 34 S+ 0 0 61 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.824 128.5 70.4 41.4 48.5 53.7 43.5 21.0 14 14 A I T <4 S+ 0 0 35 -3,-1.1 -2,-0.2 1,-0.6 -1,-0.2 0.330 96.6 29.0-146.9 -57.7 53.3 46.7 23.0 15 15 A M E < S-B 11 0A 12 -4,-1.7 -4,-2.3 288,-0.0 -1,-0.6 -0.274 70.3-145.2-100.1-171.7 53.4 49.7 20.8 16 16 A F E -B 10 0A 4 -6,-0.3 17,-0.4 199,-0.2 2,-0.3 -0.989 3.5-149.7-158.7 150.5 52.2 50.1 17.2 17 17 A Y E -B 9 0A 17 -8,-2.8 -8,-2.3 -2,-0.3 2,-0.3 -0.821 6.2-170.5-121.3 162.5 53.1 51.9 13.9 18 18 A G E -BC 8 31A 2 13,-2.1 13,-3.4 -2,-0.3 2,-0.2 -0.947 21.3-122.4-144.0 157.0 51.2 53.2 10.9 19 19 A D E + C 0 30A 76 -12,-0.5 75,-0.5 -2,-0.3 2,-0.3 -0.699 31.8 156.2-107.2 159.9 52.5 54.6 7.6 20 20 A A E - C 0 29A 2 9,-1.6 9,-1.1 -2,-0.2 2,-0.2 -0.933 27.2-125.0-170.2 154.5 52.0 57.9 5.8 21 21 A E E -DC 92 28A 27 71,-2.1 71,-2.2 -2,-0.3 2,-0.4 -0.694 6.3-150.2-115.8 167.0 53.8 60.0 3.2 22 22 A V E +D 91 0A 0 5,-1.6 69,-0.2 4,-0.8 3,-0.1 -0.996 57.4 26.1-133.8 136.3 55.3 63.4 2.6 23 23 A G S S- 0 0 1 67,-2.0 69,-0.1 -2,-0.4 66,-0.1 0.033 92.3 -76.8 97.4 155.2 55.7 65.3 -0.7 24 24 A D S S+ 0 0 41 67,-0.0 2,-0.4 -2,-0.0 -1,-0.1 0.802 124.2 61.7 -57.9 -28.8 54.0 65.3 -4.1 25 25 A N S S- 0 0 48 37,-0.1 -3,-0.1 1,-0.1 65,-0.1 -0.807 108.1-106.5 -94.5 143.0 55.9 62.1 -4.7 26 26 A Q + 0 0 127 -2,-0.4 -4,-0.8 -5,-0.1 66,-0.2 0.851 43.5 174.3 -33.7 -85.8 55.0 59.4 -2.2 27 27 A Q - 0 0 25 -6,-0.2 -5,-1.6 -3,-0.1 2,-0.1 0.981 26.5-144.2 66.6 79.6 58.0 59.2 0.2 28 28 A P E -C 21 0A 44 0, 0.0 2,-0.3 0, 0.0 -7,-0.2 -0.364 21.1-177.9 -76.4 155.4 56.8 56.7 2.8 29 29 A F E -C 20 0A 1 -9,-1.1 -9,-1.6 -2,-0.1 2,-0.6 -0.984 27.1-124.9-150.6 146.2 57.6 56.9 6.5 30 30 A T E -C 19 0A 27 -2,-0.3 91,-3.2 -11,-0.2 92,-1.8 -0.861 37.8-169.3 -95.9 121.7 56.7 54.7 9.5 31 31 A F E -Ce 18 122A 2 -13,-3.4 -13,-2.1 -2,-0.6 2,-0.7 -0.738 30.9-132.5-113.3 161.5 55.1 56.8 12.2 32 32 A I E - e 0 123A 3 90,-1.3 92,-2.5 -2,-0.3 2,-1.4 -0.973 31.8-138.1-105.1 114.3 54.1 56.4 15.8 33 33 A L E - e 0 124A 2 -2,-0.7 2,-0.8 -17,-0.4 92,-0.2 -0.688 28.0-168.5 -81.1 92.0 50.5 57.8 15.7 34 34 A D E > + e 0 125A 0 -2,-1.4 92,-2.3 90,-0.9 3,-1.7 -0.748 28.4 179.5 -97.7 100.6 50.6 59.8 18.9 35 35 A T T 3 S+ 0 0 0 -2,-0.8 158,-0.5 1,-0.3 93,-0.1 0.511 84.5 69.7 -70.3 -3.8 47.4 61.2 20.3 36 36 A G T 3 S+ 0 0 0 156,-0.1 628,-2.5 91,-0.1 2,-0.3 0.269 101.0 42.2 -98.0 5.9 49.6 62.6 23.0 37 37 A S < - 0 0 0 -3,-1.7 90,-1.8 626,-0.2 89,-1.0 -0.924 63.0-149.5-143.0 167.1 51.4 65.2 20.8 38 38 A A + 0 0 6 93,-0.4 2,-0.3 -2,-0.3 94,-0.2 0.122 66.1 86.4-129.5 21.0 50.2 67.6 18.2 39 39 A N - 0 0 5 -5,-0.1 86,-2.5 93,-0.1 2,-0.5 -0.879 59.4-143.5-123.1 156.6 53.1 67.9 15.9 40 40 A L E +F 124 0A 2 -2,-0.3 63,-3.1 61,-0.3 2,-0.3 -0.976 24.3 171.6-121.2 125.9 54.3 66.0 12.9 41 41 A W E -Fg 123 103A 0 82,-2.1 82,-0.7 -2,-0.5 63,-0.2 -0.969 11.3-171.8-136.3 153.8 58.0 65.4 12.2 42 42 A V E - g 0 104A 0 61,-2.4 63,-2.8 -2,-0.3 2,-0.2 -0.976 35.5 -98.1-141.9 149.4 60.1 63.4 9.8 43 43 A P E - g 0 105A 0 0, 0.0 15,-2.8 0, 0.0 2,-0.2 -0.503 44.5-136.8 -68.0 134.4 63.8 62.6 9.5 44 44 A S B > -n 58 0B 0 61,-2.8 3,-2.2 13,-0.2 15,-0.2 -0.609 19.0-125.6 -95.9 155.7 65.5 64.8 7.0 45 45 A V T 3 S+ 0 0 68 13,-2.2 -1,-0.1 1,-0.3 14,-0.1 0.814 116.9 63.3 -61.0 -27.2 68.0 64.0 4.3 46 46 A K T 3 S+ 0 0 104 12,-0.3 -1,-0.3 59,-0.1 60,-0.1 0.406 76.9 122.0 -77.5 -0.4 69.8 66.8 6.1 47 47 A a < + 0 0 20 -3,-2.2 60,-0.2 58,-0.2 59,-0.1 -0.347 34.5 176.6 -64.0 146.3 70.0 64.7 9.3 48 48 A T + 0 0 126 58,-2.1 2,-0.1 -2,-0.0 -1,-0.1 0.455 42.5 111.1-126.7 -12.2 73.5 64.1 10.5 49 49 A T S > S- 0 0 8 57,-1.0 3,-2.3 1,-0.1 4,-0.2 -0.425 73.8-123.0 -70.7 139.5 72.8 62.2 13.8 50 50 A A G > S+ 0 0 82 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.814 106.4 69.1 -50.2 -38.3 73.7 58.5 14.0 51 51 A G G 3 S+ 0 0 2 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.661 90.6 63.2 -58.8 -16.1 70.1 57.6 14.9 52 52 A a G X S+ 0 0 9 -3,-2.3 3,-0.8 1,-0.2 -1,-0.3 0.508 75.5 91.5 -87.0 -6.4 69.1 58.5 11.3 53 53 A L T < S+ 0 0 151 -3,-2.1 -1,-0.2 1,-0.2 -2,-0.1 0.859 93.3 37.3 -57.3 -38.0 71.2 55.8 9.7 54 54 A T T 3 S+ 0 0 111 -3,-0.4 -1,-0.2 -4,-0.3 2,-0.1 0.498 103.1 95.5 -94.6 -2.6 68.4 53.2 9.7 55 55 A K S < S- 0 0 17 -3,-0.8 2,-0.3 -4,-0.1 66,-0.1 -0.436 78.0-110.7 -93.3 160.1 65.5 55.5 8.9 56 56 A H - 0 0 103 -2,-0.1 2,-0.3 -26,-0.1 -1,-0.1 -0.658 42.9-147.0 -79.7 142.4 63.7 56.6 5.8 57 57 A L - 0 0 67 -2,-0.3 2,-0.4 -15,-0.1 -13,-0.2 -0.863 6.1-124.4-119.1 151.3 64.6 60.2 5.1 58 58 A Y B -n 44 0B 0 -15,-2.8 -13,-2.2 -2,-0.3 2,-0.6 -0.768 18.0-165.9 -94.1 133.5 62.6 63.1 3.6 59 59 A D > - 0 0 35 -2,-0.4 3,-1.0 1,-0.2 -15,-0.0 -0.868 7.5-175.7-123.6 100.1 64.0 64.9 0.6 60 60 A S G > S+ 0 0 9 -2,-0.6 3,-2.7 1,-0.2 6,-0.3 0.903 81.0 65.7 -58.4 -44.5 62.3 68.2 -0.1 61 61 A S G 3 S+ 0 0 97 1,-0.3 -1,-0.2 3,-0.0 5,-0.0 0.779 99.3 54.7 -49.9 -30.0 64.3 68.9 -3.3 62 62 A K G < S+ 0 0 136 -3,-1.0 2,-0.4 1,-0.1 -1,-0.3 0.163 96.2 82.0 -92.1 19.8 62.6 65.9 -4.9 63 63 A S X - 0 0 9 -3,-2.7 3,-1.2 1,-0.1 -40,-0.1 -0.971 58.0-163.7-129.9 117.5 59.1 67.2 -4.1 64 64 A R T 3 S+ 0 0 219 -2,-0.4 -1,-0.1 1,-0.2 -4,-0.0 0.816 92.7 56.3 -66.6 -31.2 57.4 69.8 -6.4 65 65 A T T 3 S+ 0 0 58 25,-0.1 -1,-0.2 2,-0.0 2,-0.2 0.346 79.9 125.6 -85.3 8.7 54.9 70.7 -3.6 66 66 A Y < - 0 0 59 -3,-1.2 2,-0.4 -6,-0.3 23,-0.2 -0.439 38.8-170.8 -70.3 137.1 57.6 71.6 -1.1 67 67 A E E -H 88 0A 106 21,-2.8 21,-1.5 -2,-0.2 -2,-0.0 -0.964 17.9-135.2-131.4 114.7 57.3 75.0 0.5 68 68 A K E +H 87 0A 159 -2,-0.4 19,-0.2 19,-0.2 18,-0.0 -0.227 35.1 155.5 -71.7 159.3 60.3 76.2 2.6 69 69 A D E - 0 0 68 17,-0.6 18,-0.2 2,-0.0 -1,-0.1 0.366 19.3-167.8-142.0 -66.9 60.2 77.8 6.0 70 70 A G E + 0 0 35 16,-2.4 2,-0.4 1,-0.2 17,-0.1 0.194 29.1 147.2 89.5 -17.5 63.4 77.3 7.9 71 71 A T E - 0 0 79 14,-0.1 15,-1.8 15,-0.1 -1,-0.2 -0.390 53.7-118.5 -58.9 113.2 62.3 78.4 11.4 72 72 A K E -H 85 0A 192 -2,-0.4 2,-0.3 13,-0.2 13,-0.3 -0.144 36.6-168.4 -52.2 145.4 64.3 76.2 13.8 73 73 A V E -H 84 0A 15 11,-2.4 11,-1.9 31,-0.1 2,-0.5 -0.994 20.1-157.6-142.1 148.8 62.2 74.0 16.1 74 74 A E E -H 83 0A 107 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.963 11.9-158.7-128.7 111.9 62.6 71.8 19.1 75 75 A M E -H 82 0A 1 7,-2.6 7,-2.2 -2,-0.5 2,-0.4 -0.801 12.7-159.9 -92.5 124.2 60.0 69.1 19.8 76 76 A N E +H 81 0A 43 -2,-0.5 589,-2.5 5,-0.2 2,-0.3 -0.910 14.2 172.1-112.5 132.6 60.0 68.0 23.4 77 77 A Y B -O 664 0C 6 3,-2.8 3,-0.4 -2,-0.4 587,-0.3 -0.841 46.3-110.5-128.3 165.0 58.5 64.7 24.7 78 78 A V S S+ 0 0 53 585,-3.0 585,-0.2 584,-0.3 586,-0.1 0.884 121.5 41.7 -62.6 -35.7 58.6 63.1 28.1 79 79 A S S S- 0 0 43 583,-1.6 2,-0.3 584,-0.3 -1,-0.2 0.517 127.0 -35.8 -89.9 -8.7 60.9 60.4 26.6 80 80 A G - 0 0 11 -3,-0.4 -3,-2.8 582,-0.2 2,-0.4 -0.986 51.9 -97.9 171.2-179.3 63.1 62.7 24.5 81 81 A T E -H 76 0A 42 29,-1.4 29,-0.4 -2,-0.3 2,-0.4 -0.980 21.4-169.7-132.9 140.7 63.9 65.6 22.3 82 82 A V E -H 75 0A 1 -7,-2.2 -7,-2.6 -2,-0.4 2,-0.3 -0.987 9.8-155.5-132.8 137.6 64.2 66.0 18.6 83 83 A S E +HI 74 107A 35 24,-2.7 23,-2.4 -2,-0.4 24,-1.8 -0.816 34.3 98.5-116.3 156.3 65.5 69.1 16.6 84 84 A G E -HI 73 105A 9 -11,-1.9 -11,-2.4 21,-0.3 2,-0.3 -0.887 56.4 -80.4 172.4-140.6 65.1 70.5 13.2 85 85 A F E -HI 72 104A 31 19,-1.8 19,-3.2 -13,-0.3 -13,-0.2 -0.968 40.0 -87.7-153.6 163.9 63.1 73.2 11.4 86 86 A F E + I 0 103A 9 -15,-1.8 -16,-2.4 -2,-0.3 -17,-0.6 -0.472 44.5 157.7 -81.0 148.4 59.7 73.9 9.9 87 87 A S E -HI 68 102A 0 15,-2.2 15,-2.2 -18,-0.2 2,-0.3 -0.910 26.2-137.9-154.6 171.2 58.7 73.0 6.3 88 88 A K E +HI 67 101A 78 -21,-1.5 -21,-2.8 -2,-0.3 2,-0.3 -0.998 33.6 133.7-143.9 137.9 55.4 72.4 4.5 89 89 A D E - I 0 100A 1 11,-1.9 11,-3.0 -2,-0.3 2,-0.6 -0.912 58.8 -56.3-163.2-174.0 54.5 69.9 1.9 90 90 A L E - I 0 99A 43 -2,-0.3 -67,-2.0 9,-0.2 2,-0.6 -0.685 45.8-162.2 -84.1 118.8 51.8 67.4 0.9 91 91 A V E -DI 22 98A 2 7,-2.4 7,-1.2 -2,-0.6 2,-0.7 -0.880 1.8-159.5-103.2 124.8 51.0 64.9 3.7 92 92 A T E -DI 21 97A 25 -71,-2.2 -71,-2.1 -2,-0.6 2,-0.6 -0.882 10.0-178.1-109.9 110.3 49.2 61.8 2.6 93 93 A V E > - I 0 96A 5 3,-2.0 2,-2.3 -2,-0.7 3,-2.1 -0.914 67.6 -39.0-108.2 118.2 47.4 59.9 5.3 94 94 A G T 3 S- 0 0 36 -2,-0.6 -87,-0.1 -75,-0.5 -2,-0.1 -0.439 126.5 -32.9 71.3 -79.5 45.6 56.7 4.3 95 95 A N T 3 S+ 0 0 111 -2,-2.3 2,-0.3 -89,-0.0 -1,-0.3 0.191 120.8 88.8-158.5 14.0 44.3 57.9 1.0 96 96 A L E < - I 0 93A 31 -3,-2.1 -3,-2.0 2,-0.0 2,-0.3 -0.886 55.4-163.4-116.8 148.9 43.7 61.6 1.7 97 97 A S E + I 0 92A 41 -2,-0.3 -5,-0.2 -5,-0.2 -7,-0.1 -0.901 11.5 169.0-130.8 160.6 46.3 64.4 1.2 98 98 A L E - I 0 91A 2 -7,-1.2 -7,-2.4 -2,-0.3 2,-0.4 -0.933 44.5 -96.9-168.4 144.0 46.6 67.9 2.4 99 99 A P E + I 0 90A 68 0, 0.0 2,-0.4 0, 0.0 -9,-0.2 -0.535 56.1 179.5 -64.5 120.1 49.2 70.7 2.5 100 100 A Y E - I 0 89A 9 -11,-3.0 -11,-1.9 -2,-0.4 2,-0.5 -0.976 31.8-128.5-131.8 143.0 50.6 70.4 6.0 101 101 A K E + I 0 88A 67 -2,-0.4 -61,-0.3 -13,-0.2 2,-0.3 -0.759 43.0 161.7 -86.8 123.5 53.2 72.2 8.1 102 102 A F E - I 0 87A 0 -15,-2.2 -15,-2.2 -2,-0.5 2,-0.4 -0.838 37.9-100.5-136.8 173.5 55.6 69.7 9.6 103 103 A I E -gI 41 86A 2 -63,-3.1 -61,-2.4 -2,-0.3 2,-0.8 -0.841 17.8-149.8-104.1 133.8 59.1 69.5 11.2 104 104 A E E -gI 42 85A 0 -19,-3.2 -19,-1.8 -2,-0.4 2,-0.3 -0.904 22.7-151.1-100.6 106.0 62.2 68.3 9.3 105 105 A V E +gI 43 84A 0 -63,-2.8 -61,-2.8 -2,-0.8 -21,-0.3 -0.625 30.5 162.5 -83.6 137.9 64.4 66.7 12.0 106 106 A I E + 0 0 52 -23,-2.4 -58,-2.1 -2,-0.3 -57,-1.0 0.465 67.0 53.4-127.9 -13.1 68.1 66.8 11.5 107 107 A D E + I 0 83A 63 -24,-1.8 -24,-2.7 -60,-0.2 -1,-0.3 -0.971 47.4 160.0-129.9 115.9 69.3 66.1 15.1 108 108 A T > + 0 0 0 -2,-0.4 3,-1.7 -26,-0.2 7,-0.2 0.158 42.1 111.3-119.4 15.3 68.0 63.1 17.0 109 109 A N G > S+ 0 0 99 1,-0.3 3,-0.7 2,-0.1 -1,-0.1 0.774 74.6 57.6 -62.0 -27.4 70.7 62.8 19.6 110 110 A G G 3 S+ 0 0 44 -29,-0.4 -29,-1.4 1,-0.2 -1,-0.3 0.434 98.9 62.0 -84.0 3.1 68.3 63.8 22.4 111 111 A F G <> S+ 0 0 0 -3,-1.7 4,-3.0 -31,-0.3 -1,-0.2 -0.086 87.7 159.7-117.4 31.3 66.0 60.9 21.6 112 112 A E T <4 + 0 0 61 -3,-0.7 -31,-0.1 1,-0.2 -3,-0.0 -0.806 50.3 11.3-108.5 154.6 68.4 58.0 22.3 113 113 A P T > S+ 0 0 101 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 -0.994 124.1 59.7 -83.3 -0.1 68.5 55.1 22.9 114 114 A T H > S+ 0 0 31 -35,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.923 103.6 49.0 -51.1 -56.2 64.8 55.0 21.9 115 115 A Y H >< S+ 0 0 0 -4,-3.0 3,-0.8 1,-0.2 -1,-0.2 0.898 116.2 40.7 -56.3 -47.7 65.1 56.2 18.4 116 116 A T H 34 S+ 0 0 84 1,-0.2 -1,-0.2 -5,-0.2 -2,-0.2 0.825 114.4 54.6 -71.5 -29.0 67.9 53.9 17.3 117 117 A A H 3< S+ 0 0 69 -4,-2.2 2,-0.3 2,-0.0 -1,-0.2 0.507 105.1 67.1 -80.9 -5.4 66.3 51.0 19.2 118 118 A S S << S- 0 0 15 -3,-0.8 -107,-0.0 -4,-0.7 0, 0.0 -0.784 71.8-139.8-116.8 161.8 63.0 51.4 17.4 119 119 A T + 0 0 88 -2,-0.3 2,-0.2 -64,-0.0 -89,-0.1 0.191 67.6 105.4-104.1 17.7 61.9 50.9 13.8 120 120 A F - 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