==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 27-FEB-11 3QWA . COMPND 2 MOLECULE: PROBABLE QUINONE OXIDOREDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR P.C.GUO,X.X.MA,Z.Z.BAO,Y.X.CHEN,C.Z.ZHOU . 663 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28541.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 468 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 94 14.2 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 . 0 0.0 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 . 44 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 21.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.6 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 0 0 1 3 4 2 0 0 2 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 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 PARALLEL BRIDGES PER LADDER . 3 2 3 2 4 0 4 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 2 0 0 2 0 0 0 0 1 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 4 A T 0 0 194 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 161.8 6.9 2.1 50.8 2 5 A I - 0 0 60 1,-0.1 25,-0.0 71,-0.0 72,-0.0 -0.792 360.0-126.6 -96.8 128.8 4.4 3.7 48.4 3 6 A P - 0 0 60 0, 0.0 24,-0.1 0, 0.0 -1,-0.1 -0.183 8.7-130.5 -68.8 164.4 1.8 6.2 49.7 4 7 A E S S+ 0 0 162 22,-0.1 23,-2.6 1,-0.0 2,-0.3 0.812 87.7 41.9 -84.9 -35.3 -2.0 5.8 49.1 5 8 A Q E +A 26 0A 117 21,-0.2 2,-0.3 19,-0.0 19,-0.1 -0.814 64.7 179.7-117.8 156.3 -2.6 9.4 47.9 6 9 A Q E -A 25 0A 8 19,-2.8 19,-2.5 -2,-0.3 2,-0.5 -0.906 32.0 -99.7-145.6 169.3 -0.7 11.7 45.5 7 10 A K E +A 24 0A 61 -2,-0.3 91,-1.0 17,-0.2 2,-0.3 -0.861 46.4 167.0 -98.8 128.6 -0.7 15.2 44.0 8 11 A V E -AB 23 97A 0 15,-2.5 15,-1.7 -2,-0.5 2,-0.5 -0.870 37.1-121.2-133.0 165.3 -2.0 15.5 40.4 9 12 A I E +A 22 0A 2 87,-2.6 55,-1.7 -2,-0.3 2,-0.3 -0.968 46.8 156.0-108.2 121.7 -3.1 18.0 37.8 10 13 A L E -AC 21 63A 1 11,-2.4 11,-3.1 -2,-0.5 2,-0.4 -0.931 37.9-131.8-140.8 161.9 -6.6 17.4 36.6 11 14 A I E -AC 20 62A 0 51,-1.9 51,-2.3 -2,-0.3 9,-0.2 -0.983 9.2-172.8-118.2 128.1 -9.7 19.1 35.0 12 15 A D S S+ 0 0 72 7,-0.8 2,-0.3 -2,-0.4 48,-0.1 0.670 75.1 2.5 -86.6 -20.8 -13.2 18.5 36.5 13 16 A E S S- 0 0 113 6,-0.3 2,-0.3 49,-0.1 -1,-0.2 -0.964 84.8 -82.0-157.1 167.4 -14.9 20.4 33.6 14 17 A I S S+ 0 0 94 -2,-0.3 2,-0.3 -3,-0.1 39,-0.2 -0.613 75.8 82.7 -76.5 134.2 -14.3 22.2 30.2 15 18 A G S S- 0 0 27 37,-2.2 39,-0.1 -2,-0.3 -4,-0.0 -0.988 71.9 -38.4 168.8-157.5 -13.3 25.8 30.5 16 19 A G S > S- 0 0 31 -2,-0.3 3,-1.5 37,-0.1 4,-0.3 0.156 81.7 -63.1 -80.4-159.4 -10.4 28.3 31.0 17 20 A Y G > S+ 0 0 86 1,-0.3 3,-0.7 2,-0.2 296,-0.1 0.628 124.8 73.7 -67.8 -12.9 -7.4 28.1 33.3 18 21 A D G 3 S+ 0 0 101 1,-0.2 -1,-0.3 3,-0.0 292,-0.0 0.720 86.4 62.1 -71.8 -23.6 -9.7 28.1 36.3 19 22 A V G < S+ 0 0 2 -3,-1.5 -7,-0.8 -8,-0.1 2,-0.5 0.625 78.2 102.4 -79.6 -14.3 -10.7 24.5 35.6 20 23 A I E < -A 11 0A 4 -3,-0.7 2,-0.4 -4,-0.3 -9,-0.2 -0.612 59.6-167.3 -71.0 119.2 -7.1 23.3 36.1 21 24 A K E -A 10 0A 65 -11,-3.1 -11,-2.4 -2,-0.5 2,-0.9 -0.946 25.5-154.8-120.6 129.3 -6.9 21.7 39.6 22 25 A Y E +A 9 0A 78 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.867 45.9 157.4 -95.7 98.9 -3.9 20.7 41.7 23 26 A E E -A 8 0A 69 -15,-1.7 -15,-2.5 -2,-0.9 2,-0.3 -0.801 49.2 -97.6-129.8 161.9 -5.6 18.1 43.8 24 27 A D E +A 7 0A 92 -2,-0.3 -17,-0.2 -17,-0.2 -19,-0.0 -0.632 49.1 170.3 -76.8 136.9 -5.1 15.0 46.0 25 28 A Y E -A 6 0A 81 -19,-2.5 -19,-2.8 -2,-0.3 2,-0.0 -0.966 37.0 -85.2-148.8 153.0 -5.8 11.8 44.0 26 29 A P E -A 5 0A 85 0, 0.0 -21,-0.2 0, 0.0 -22,-0.1 -0.345 38.3-120.2 -62.7 143.1 -5.3 8.0 44.5 27 30 A V - 0 0 25 -23,-2.6 73,-0.1 1,-0.1 -25,-0.0 -0.758 42.2-111.6 -76.7 126.6 -2.0 6.4 43.6 28 31 A P - 0 0 34 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.244 22.0-130.4 -63.9 148.0 -2.8 3.8 40.9 29 32 A S - 0 0 99 72,-0.0 2,-0.4 -3,-0.0 72,-0.0 -0.653 22.1-137.2 -89.9 156.1 -2.6 0.1 41.5 30 33 A I - 0 0 46 -2,-0.2 6,-0.1 4,-0.1 45,-0.1 -0.927 6.6-143.4-120.8 142.1 -0.7 -2.1 39.0 31 34 A S > - 0 0 69 -2,-0.4 3,-1.3 45,-0.1 45,-0.1 -0.118 46.3 -73.7 -88.2-168.7 -1.5 -5.5 37.4 32 35 A E T 3 S+ 0 0 116 1,-0.3 46,-2.0 44,-0.2 47,-0.5 0.697 129.3 34.8 -67.8 -24.4 0.9 -8.4 36.6 33 36 A E T 3 S+ 0 0 104 45,-0.2 71,-3.2 44,-0.1 72,-0.3 0.241 101.3 101.7-111.4 13.7 2.5 -6.8 33.5 34 37 A E E < -D 103 0B 43 -3,-1.3 42,-2.2 69,-0.3 2,-0.4 -0.592 56.9-142.5-104.9 158.5 2.5 -3.2 34.6 35 38 A L E -DE 102 75B 0 67,-3.0 67,-1.4 40,-0.2 2,-0.6 -0.933 7.8-146.0-114.2 139.6 5.1 -0.8 36.0 36 39 A L E -DE 101 74B 7 38,-3.4 37,-3.0 -2,-0.4 38,-1.5 -0.949 24.1-165.4-102.0 122.0 4.5 1.9 38.7 37 40 A I E -DE 100 72B 0 63,-2.9 63,-2.1 -2,-0.6 2,-0.8 -0.932 19.4-145.6-116.7 124.6 6.6 4.9 37.9 38 41 A K E -DE 99 71B 49 33,-3.2 33,-2.4 -2,-0.5 61,-0.2 -0.815 33.0-135.1 -83.8 111.5 7.4 7.8 40.3 39 42 A N E + E 0 70B 0 59,-2.0 31,-0.3 -2,-0.8 3,-0.1 -0.365 32.8 173.6 -71.9 143.6 7.7 10.7 37.9 40 43 A K E S+ 0 0 36 29,-3.0 289,-2.7 1,-0.4 2,-0.3 0.671 72.9 9.6-110.4 -43.8 10.4 13.3 38.0 41 44 A Y E -FE 328 69B 6 28,-1.7 28,-2.6 287,-0.2 -1,-0.4 -0.970 58.7-170.3-137.4 153.4 9.6 15.3 34.9 42 45 A T E -FE 327 68B 0 285,-1.7 285,-2.9 -2,-0.3 2,-0.3 -0.993 22.6-124.3-144.7 137.6 6.7 15.5 32.4 43 46 A G E -F 326 0B 0 24,-2.0 24,-0.5 81,-0.4 2,-0.5 -0.600 20.4-129.6 -83.3 138.9 6.4 17.4 29.0 44 47 A V - 0 0 1 281,-2.9 281,-0.5 -2,-0.3 2,-0.3 -0.759 27.8-170.4 -86.8 127.8 3.6 19.8 28.3 45 48 A N > - 0 0 25 -2,-0.5 3,-1.5 279,-0.1 4,-0.4 -0.905 33.5-123.3-120.2 150.8 1.8 19.2 25.1 46 49 A Y T >> S+ 0 0 57 -2,-0.3 4,-1.0 1,-0.3 3,-0.9 0.686 103.1 78.6 -64.5 -17.6 -0.8 21.3 23.3 47 50 A I H 3> S+ 0 0 37 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.803 84.3 61.4 -60.1 -31.3 -3.2 18.4 23.4 48 51 A E H <> S+ 0 0 0 -3,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.792 100.5 54.3 -66.6 -29.2 -4.0 19.1 27.0 49 52 A S H <> S+ 0 0 0 -3,-0.9 4,-2.0 -4,-0.4 -1,-0.2 0.811 105.0 54.2 -70.4 -32.4 -5.3 22.5 25.9 50 53 A Y H X>S+ 0 0 43 -4,-1.0 5,-1.8 2,-0.2 6,-1.8 0.809 109.2 47.2 -72.1 -31.9 -7.6 20.7 23.4 51 54 A F H <5S+ 0 0 23 -4,-1.4 -2,-0.2 4,-0.2 -1,-0.2 0.868 113.2 48.7 -73.1 -39.1 -9.0 18.6 26.3 52 55 A R H <5S+ 0 0 9 -4,-1.7 -37,-2.2 1,-0.2 -2,-0.2 0.870 113.1 46.2 -69.0 -39.6 -9.5 21.6 28.5 53 56 A K H <5S- 0 0 96 -4,-2.0 -1,-0.2 -39,-0.2 -2,-0.2 0.659 115.4-114.3 -77.8 -17.8 -11.3 23.6 25.8 54 57 A G T <5S+ 0 0 33 -4,-0.7 -3,-0.2 2,-0.3 -4,-0.1 0.613 80.5 125.3 91.6 15.6 -13.5 20.7 24.8 55 58 A I S - 0 0 7 -42,-2.2 3,-1.6 -2,-0.3 -44,-0.2 -0.331 39.5-107.1 -71.0 159.6 3.8 -6.7 38.5 77 80 A K T 3 S+ 0 0 177 1,-0.3 -44,-0.1 -2,-0.1 -45,-0.1 0.658 118.5 54.8 -64.6 -17.9 4.9 -10.3 39.2 78 81 A G T 3 S+ 0 0 36 -46,-2.0 2,-0.4 -47,-0.1 -1,-0.3 0.513 80.5 111.0 -92.1 -7.5 5.1 -11.1 35.4 79 82 A V < + 0 0 7 -3,-1.6 -46,-0.1 -47,-0.5 -45,-0.1 -0.572 24.8 150.9 -75.4 122.1 7.5 -8.2 34.6 80 83 A T + 0 0 128 -2,-0.4 -1,-0.2 -47,-0.1 -47,-0.0 0.499 62.9 66.4-124.0 -16.2 11.0 -9.4 33.7 81 84 A N S S+ 0 0 55 2,-0.0 2,-0.3 1,-0.0 29,-0.1 0.458 104.3 42.8 -90.7 -2.8 12.2 -6.6 31.3 82 85 A F - 0 0 9 28,-0.0 2,-0.3 4,-0.0 22,-0.0 -0.977 65.9-154.3-139.9 154.1 12.4 -4.0 34.1 83 86 A E > - 0 0 122 -2,-0.3 3,-2.0 -9,-0.0 -11,-0.3 -0.928 35.9 -91.5-126.6 152.6 13.5 -3.8 37.7 84 87 A V T 3 S+ 0 0 87 -2,-0.3 -11,-0.2 1,-0.2 3,-0.1 -0.442 115.4 33.2 -59.1 126.2 12.6 -1.6 40.7 85 88 A G T 3 S+ 0 0 46 -13,-2.7 -1,-0.2 1,-0.4 2,-0.2 0.206 84.1 136.9 107.7 -13.4 14.9 1.4 40.6 86 89 A D < - 0 0 35 -3,-2.0 -14,-2.6 -14,-0.1 2,-0.4 -0.454 52.8-130.1 -68.1 134.1 15.3 1.6 36.8 87 90 A Q E -GH 71 111B 33 24,-0.5 24,-2.9 -16,-0.2 2,-0.3 -0.720 36.1-176.3 -84.6 135.7 15.1 5.1 35.3 88 91 A V E -GH 70 110B 0 -18,-3.2 -18,-2.2 -2,-0.4 2,-0.4 -0.920 30.7-152.4-136.4 154.4 12.6 5.3 32.4 89 92 A A E +GH 69 109B 0 20,-1.7 20,-2.6 -2,-0.3 2,-0.3 -0.995 38.0 158.1-122.1 135.9 11.2 7.5 29.7 90 93 A Y E -GH 68 108B 0 -22,-2.6 -22,-2.2 -2,-0.4 2,-0.5 -0.968 41.7-129.2-156.0 162.8 7.6 6.7 28.6 91 94 A I E +G 67 0B 9 16,-2.2 2,-0.2 -2,-0.3 -24,-0.2 -0.987 52.8 114.1-117.5 122.3 4.3 7.6 27.0 92 95 A S - 0 0 16 -26,-2.1 3,-0.3 -2,-0.5 2,-0.2 -0.791 58.6 -58.6-159.7-157.7 1.2 6.8 28.9 93 96 A N S S+ 0 0 120 8,-0.5 8,-0.3 -2,-0.2 -27,-0.1 -0.653 99.7 11.4 -99.3 157.9 -1.9 8.3 30.7 94 97 A S + 0 0 49 -31,-0.7 -29,-0.2 -29,-0.3 -1,-0.2 0.832 65.9 153.8 52.2 49.6 -2.1 10.7 33.7 95 98 A T + 0 0 0 -30,-1.2 2,-2.3 -3,-0.3 -30,-0.3 0.578 50.3 89.3 -89.0 -10.8 1.5 11.8 33.8 96 99 A F S S+ 0 0 0 -32,-2.4 -87,-2.6 -87,-0.2 2,-0.3 -0.458 84.7 83.3 -76.1 63.7 0.8 15.2 35.4 97 100 A A B S-B 8 0A 1 -2,-2.3 -58,-0.2 -89,-0.2 -89,-0.2 -0.973 91.2-112.4-161.9 160.1 1.2 13.2 38.6 98 101 A Q S S+ 0 0 29 -91,-1.0 -59,-2.0 -2,-0.3 2,-0.4 0.837 107.0 31.3 -68.4 -35.0 3.7 11.9 41.2 99 102 A Y E +D 38 0B 19 -61,-0.2 2,-0.3 -92,-0.1 -1,-0.2 -0.992 66.6 163.3-132.6 131.2 2.8 8.3 40.1 100 103 A S E -D 37 0B 2 -63,-2.1 -63,-2.9 -2,-0.4 2,-0.3 -0.885 21.0-138.3-134.6 168.7 1.7 6.9 36.8 101 104 A K E +D 36 0B 75 -8,-0.3 -8,-0.5 -2,-0.3 2,-0.3 -0.909 18.2 170.9-130.1 158.3 1.5 3.4 35.3 102 105 A I E -D 35 0B 11 -67,-1.4 -67,-3.0 -2,-0.3 2,-0.2 -0.972 40.3 -96.9-157.3 150.9 2.2 1.6 32.0 103 106 A S E > -D 34 0B 42 -2,-0.3 3,-1.8 -69,-0.2 -69,-0.3 -0.522 30.4-130.5 -64.7 137.9 2.4 -1.9 30.6 104 107 A S T 3 S+ 0 0 4 -71,-3.2 4,-0.2 1,-0.3 -1,-0.1 0.625 112.2 53.6 -65.2 -13.0 6.0 -3.1 30.5 105 108 A Q T 3 S+ 0 0 105 -72,-0.3 -1,-0.3 2,-0.1 -71,-0.1 0.368 99.1 83.8-100.0 -0.2 5.3 -4.1 26.9 106 109 A G S < S- 0 0 19 -3,-1.8 2,-2.4 1,-0.1 -14,-0.1 -0.081 106.0 -52.1 -89.5-168.2 4.1 -0.6 26.0 107 110 A P S S+ 0 0 35 0, 0.0 -16,-2.2 0, 0.0 2,-0.4 -0.428 90.8 122.8 -71.8 75.0 6.0 2.6 25.0 108 111 A V E -H 90 0B 8 -2,-2.4 2,-0.4 -18,-0.2 -18,-0.2 -0.997 40.3-164.0-134.1 138.1 8.5 2.6 27.9 109 112 A M E -H 89 0B 13 -20,-2.6 -20,-1.7 -2,-0.4 2,-0.2 -0.976 18.7-123.5-128.1 140.2 12.3 2.6 27.6 110 113 A K E -H 88 0B 101 -2,-0.4 -22,-0.2 -22,-0.2 3,-0.0 -0.536 24.7-155.8 -75.5 140.8 15.0 1.8 30.1 111 114 A L E -H 87 0B 8 -24,-2.9 -24,-0.5 -2,-0.2 -1,-0.0 -0.829 30.4 -89.6-112.3 155.6 17.7 4.5 30.7 112 115 A P > - 0 0 65 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.304 32.3-122.0 -61.2 149.4 21.2 3.9 32.0 113 116 A K T 3 S+ 0 0 202 1,-0.3 -2,-0.0 -27,-0.0 -3,-0.0 0.727 111.6 65.4 -66.3 -20.6 21.6 4.1 35.8 114 117 A G T 3 S+ 0 0 67 2,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.419 72.9 131.9 -79.7 0.2 24.2 6.9 35.3 115 118 A T < - 0 0 11 -3,-1.8 2,-0.1 1,-0.1 -4,-0.0 -0.340 50.5-140.6 -57.2 125.3 21.4 9.1 33.9 116 119 A S > - 0 0 41 -2,-0.1 4,-1.7 1,-0.1 5,-0.1 -0.300 21.3-109.6 -81.5 170.3 21.5 12.6 35.5 117 120 A D H > S+ 0 0 52 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.843 120.7 54.9 -67.0 -35.5 18.5 14.7 36.6 118 121 A E H > S+ 0 0 129 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.844 108.0 49.0 -66.4 -36.3 19.3 17.1 33.8 119 122 A E H > S+ 0 0 41 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.865 106.1 56.9 -69.9 -38.1 19.1 14.2 31.3 120 123 A L H X S+ 0 0 9 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.880 107.4 48.7 -58.4 -41.0 15.8 13.1 32.8 121 124 A K H X S+ 0 0 53 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.909 110.0 52.4 -64.0 -43.8 14.4 16.5 32.0 122 125 A L H X S+ 0 0 30 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.869 109.1 48.4 -59.8 -41.7 15.7 16.3 28.5 123 126 A Y H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.896 112.8 47.1 -69.4 -41.0 14.1 13.0 27.8 124 127 A A H < S+ 0 0 0 -4,-1.8 -81,-0.4 1,-0.2 4,-0.3 0.804 115.3 47.7 -67.6 -31.4 10.7 14.1 29.1 125 128 A A H < S+ 0 0 0 -4,-1.8 4,-0.3 -5,-0.2 -2,-0.2 0.799 122.5 32.0 -77.5 -31.1 10.9 17.3 27.1 126 129 A G H X S+ 0 0 0 -4,-1.7 4,-2.6 -5,-0.2 5,-0.4 0.588 89.1 95.1-106.2 -13.1 12.0 15.6 23.8 127 130 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 5,-0.2 0.906 92.7 33.3 -51.2 -62.3 10.3 12.2 23.8 128 131 A L H > S+ 0 0 16 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.909 120.3 49.1 -64.2 -45.8 7.1 12.9 21.7 129 132 A Q H > S+ 0 0 13 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.879 114.7 44.0 -64.1 -40.3 8.6 15.6 19.4 130 133 A V H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.932 113.6 49.1 -71.7 -47.3 11.7 13.5 18.5 131 134 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.4 5,-0.2 0.865 113.7 48.7 -58.7 -38.8 9.8 10.2 17.9 132 135 A T H X S+ 0 0 21 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.952 114.2 44.1 -64.3 -51.6 7.3 12.1 15.8 133 136 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.857 114.6 49.8 -65.3 -37.8 10.0 13.8 13.7 134 137 A L H X S+ 0 0 7 -4,-3.0 4,-0.7 2,-0.2 -1,-0.2 0.964 115.5 40.9 -63.5 -54.4 12.0 10.6 13.3 135 138 A S H X>S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-1.4 0.816 114.1 53.4 -66.3 -33.5 9.1 8.5 12.1 136 139 A F H <>S+ 0 0 4 -4,-2.3 5,-2.2 1,-0.2 -1,-0.2 0.822 113.6 42.0 -71.7 -32.5 7.6 11.2 9.9 137 140 A T H <5S+ 0 0 0 -4,-1.5 6,-2.0 -5,-0.2 -1,-0.2 0.476 122.0 42.1 -92.0 -4.0 10.9 11.7 8.1 138 141 A N H <5S+ 0 0 40 -4,-0.7 -2,-0.2 4,-0.2 -3,-0.2 0.773 134.3 6.1-105.1 -42.1 11.6 7.9 7.9 139 142 A E T <5S+ 0 0 63 -4,-2.7 3,-0.3 2,-0.2 -3,-0.2 0.779 124.6 53.6-116.3 -43.2 8.2 6.4 7.0 140 143 A A T - 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