==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 16-DEC-05 2CA4 . COMPND 2 MOLECULE: SULFITE\:CYTOCHROME C OXIDOREDUCTASE SUBUNIT A; . SOURCE 2 ORGANISM_SCIENTIFIC: STARKEYA NOVELLA; . AUTHOR S.BAILEY,U.KAPPLER . 454 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19471.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 266 58.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 24.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 33 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 49 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 3 0 0 1 1 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 6 4 6 1 2 2 1 1 1 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 . 3 0 2 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 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 A 0 0 156 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-105.2 65.1 23.3 49.1 2 2 A D + 0 0 112 13,-0.3 13,-2.3 12,-0.0 2,-0.3 -0.488 360.0 171.4 -78.9 138.2 64.3 19.6 48.5 3 3 A T E -A 14 0A 73 11,-0.3 2,-0.3 -2,-0.2 9,-0.1 -0.956 14.3-160.1-134.4 155.7 67.0 16.9 48.1 4 4 A V E -A 13 0A 44 9,-2.8 9,-2.7 -2,-0.3 2,-0.4 -0.850 13.9-137.0-120.7 169.0 67.0 13.1 47.8 5 5 A T E -A 12 0A 103 -2,-0.3 7,-0.3 7,-0.2 6,-0.0 -0.982 13.5-144.9-126.4 120.2 69.8 10.6 48.4 6 6 A L - 0 0 15 5,-3.3 2,-2.1 -2,-0.4 5,-0.2 -0.516 33.4-104.7 -76.7 150.9 70.3 7.7 46.0 7 7 A P S S+ 0 0 102 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.312 93.1 74.3 -83.9 58.7 71.5 4.5 47.7 8 8 A F S > S- 0 0 29 -2,-2.1 3,-0.5 114,-0.0 103,-0.1 -0.922 98.3 -64.9-148.0 170.2 75.1 4.6 46.6 9 9 A A T 3 S+ 0 0 56 -2,-0.3 -3,-0.0 1,-0.2 0, 0.0 -0.308 121.5 13.1 -63.1 141.0 78.1 6.7 47.6 10 10 A N T 3 S+ 0 0 62 406,-0.1 -1,-0.2 1,-0.1 -5,-0.0 0.941 84.8 150.1 55.0 53.1 77.8 10.5 46.9 11 11 A G < + 0 0 4 -3,-0.5 -5,-3.3 -5,-0.2 2,-0.1 0.355 18.1 123.9 -99.5 4.0 74.1 9.9 46.2 12 12 A E E +A 5 0A 114 -7,-0.3 -7,-0.2 -9,-0.1 -9,-0.0 -0.439 32.8 166.7 -69.0 134.1 72.8 13.3 47.2 13 13 A R E -A 4 0A 1 -9,-2.7 -9,-2.8 -2,-0.1 2,-0.2 -0.991 34.1-113.7-143.9 150.5 70.8 15.1 44.5 14 14 A P E -A 3 0A 59 0, 0.0 12,-2.9 0, 0.0 2,-0.6 -0.502 24.5-126.8 -76.0 148.5 68.5 18.1 44.3 15 15 A L E -B 25 0B 48 -13,-2.3 2,-0.3 10,-0.2 -13,-0.3 -0.905 38.7-170.7 -90.4 124.3 64.8 17.7 43.5 16 16 A V E -B 24 0B 32 8,-2.8 8,-2.6 -2,-0.6 2,-0.6 -0.907 19.4-141.6-125.6 144.7 64.2 20.1 40.6 17 17 A M E -B 23 0B 133 -2,-0.3 5,-0.1 6,-0.2 3,-0.0 -0.921 17.8-175.9-113.8 120.5 61.1 21.4 38.8 18 18 A Y > - 0 0 12 -2,-0.6 3,-2.7 4,-0.5 363,-0.1 -0.789 44.3 -80.8-108.0 150.9 61.2 21.9 35.0 19 19 A P T 3 S+ 0 0 58 0, 0.0 176,-0.1 0, 0.0 3,-0.1 -0.264 119.3 9.4 -55.0 134.4 58.3 23.4 33.0 20 20 A G T 3 S+ 0 0 75 1,-0.2 2,-0.3 174,-0.1 -3,-0.0 0.428 114.1 100.6 73.6 -0.5 55.7 20.6 32.3 21 21 A K < - 0 0 14 -3,-2.7 -1,-0.2 30,-0.1 30,-0.2 -0.863 69.5-129.2-113.7 146.9 57.5 18.2 34.7 22 22 A R - 0 0 69 28,-2.4 -4,-0.5 -2,-0.3 2,-0.1 -0.271 62.3 -62.6 -70.0 174.3 56.8 17.2 38.3 23 23 A P E -B 17 0B 64 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.471 69.5-178.3 -63.0 136.0 59.8 17.5 40.7 24 24 A L E -B 16 0B 0 -8,-2.6 -8,-2.8 -2,-0.1 2,-0.6 -0.807 37.1 -85.3-131.3 171.1 62.5 15.1 39.5 25 25 A I E -BC 15 35B 7 10,-2.3 10,-2.4 -2,-0.3 2,-0.6 -0.698 45.0-141.2 -80.6 113.7 66.0 14.0 40.5 26 26 A G E + C 0 34B 8 -12,-2.9 8,-0.2 -2,-0.6 3,-0.1 -0.704 31.7 165.1 -81.5 116.4 68.4 16.6 39.0 27 27 A L E S- 0 0 3 6,-3.2 2,-0.3 -2,-0.6 -1,-0.2 0.875 71.8 -3.0 -88.6 -55.8 71.6 15.0 37.7 28 28 A T E > - C 0 33B 5 5,-1.3 5,-2.5 1,-0.1 -1,-0.4 -0.988 49.7-157.5-138.2 149.7 72.9 17.9 35.6 29 29 A A T 5S+ 0 0 20 -2,-0.3 -1,-0.1 3,-0.2 5,-0.0 0.760 79.3 67.3 -93.6 -31.2 71.5 21.4 34.8 30 30 A R T 5S+ 0 0 64 1,-0.5 378,-1.8 2,-0.1 -1,-0.2 -0.877 120.8 13.2-139.4 100.1 73.5 22.1 31.6 31 31 A P T 5S- 0 0 2 0, 0.0 -1,-0.5 0, 0.0 25,-0.1 0.676 114.4-113.0 -70.2 161.6 72.4 20.1 29.6 32 32 A P T 5 + 0 0 1 0, 0.0 2,-0.4 0, 0.0 -3,-0.2 -0.397 38.5 177.6 -68.3 133.5 69.4 19.0 31.6 33 33 A Q E < +C 28 0B 9 -5,-2.5 -6,-3.2 22,-0.1 -5,-1.3 -0.942 2.7 179.1-141.2 121.0 69.5 15.5 32.9 34 34 A L E -CD 26 54B 3 20,-1.6 20,-2.6 -2,-0.4 2,-0.3 -0.965 12.5-156.7-129.9 133.5 66.7 14.3 35.1 35 35 A E E -C 25 0B 4 -10,-2.4 -10,-2.3 -2,-0.4 90,-0.2 -0.822 23.8-116.4-108.1 148.9 66.1 10.9 36.7 36 36 A T - 0 0 1 88,-1.9 -12,-0.1 -2,-0.3 5,-0.1 -0.715 29.0-113.7 -84.8 130.5 62.7 9.5 37.8 37 37 A P > - 0 0 29 0, 0.0 3,-2.0 0, 0.0 4,-0.4 -0.398 26.7-123.7 -59.8 135.9 62.2 8.7 41.5 38 38 A F G > S+ 0 0 42 1,-0.3 3,-1.7 2,-0.2 4,-0.4 0.806 105.9 70.8 -51.5 -33.9 61.7 5.0 41.9 39 39 A S G > S+ 0 0 64 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.768 85.1 70.6 -57.6 -25.4 58.3 5.4 43.5 40 40 A V G X S+ 0 0 5 -3,-2.0 3,-1.6 1,-0.2 4,-0.4 0.809 86.8 63.3 -61.7 -30.9 56.9 6.5 40.1 41 41 A F G < S+ 0 0 7 -3,-1.7 3,-0.3 -4,-0.4 -1,-0.2 0.679 97.9 56.5 -75.0 -14.6 57.2 3.0 38.7 42 42 A D G < S+ 0 0 44 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.408 90.8 76.1 -87.2 -1.4 54.7 1.7 41.3 43 43 A E S < S- 0 0 111 -3,-1.6 2,-0.3 1,-0.3 -2,-0.2 0.685 112.7 -50.9 -83.5 -18.9 52.1 4.3 40.1 44 44 A G - 0 0 46 -4,-0.4 -1,-0.3 -3,-0.3 0, 0.0 -0.923 56.5 -83.5 161.8 176.8 51.1 2.4 36.9 45 45 A L S S+ 0 0 41 -2,-0.3 2,-0.5 -3,-0.1 276,-0.3 0.786 106.8 60.9 -81.1 -32.0 52.4 0.7 33.8 46 46 A I S S- 0 0 56 -3,-0.1 83,-0.2 274,-0.1 -1,-0.1 -0.889 86.2-128.1 -99.1 125.7 52.9 3.7 31.5 47 47 A T - 0 0 6 81,-2.7 5,-0.1 -2,-0.5 -6,-0.1 -0.602 30.3-115.8 -73.8 123.7 55.3 6.4 32.8 48 48 A P >> - 0 0 40 0, 0.0 3,-1.8 0, 0.0 4,-1.1 -0.278 15.7-122.0 -62.8 145.6 53.6 9.9 32.9 49 49 A N T 34 S+ 0 0 32 1,-0.3 3,-0.4 2,-0.2 -2,-0.0 0.829 114.0 55.2 -52.1 -37.2 55.0 12.6 30.5 50 50 A D T 34 S+ 0 0 62 1,-0.2 -28,-2.4 -29,-0.1 -1,-0.3 0.566 113.0 41.8 -79.4 -9.4 55.6 14.8 33.6 51 51 A A T <4 S+ 0 0 0 -3,-1.8 -1,-0.2 -30,-0.2 -2,-0.2 0.504 85.0 124.5-106.5 -10.1 57.7 12.1 35.2 52 52 A F < - 0 0 0 -4,-1.1 75,-0.1 -3,-0.4 73,-0.1 -0.234 63.3-113.1 -66.3 137.5 59.7 10.9 32.2 53 53 A F - 0 0 13 73,-0.2 2,-0.4 71,-0.1 -18,-0.2 -0.213 24.2-144.6 -72.0 157.5 63.5 10.9 32.5 54 54 A V B +D 34 0B 3 -20,-2.6 -20,-1.6 2,-0.0 2,-0.4 -0.987 19.8 171.3-129.2 126.1 65.7 13.2 30.5 55 55 A R + 0 0 76 -2,-0.4 2,-0.3 141,-0.3 -22,-0.1 -1.000 4.1 167.3-133.3 136.7 69.2 12.5 29.1 56 56 A Y - 0 0 7 -2,-0.4 3,-0.1 -25,-0.1 -2,-0.0 -0.993 25.7-154.5-144.1 144.7 71.3 14.8 26.8 57 57 A A S S+ 0 0 22 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.833 77.9 42.1 -86.9 -34.9 75.0 14.7 25.7 58 58 A L - 0 0 15 1,-0.1 -1,-0.1 102,-0.1 101,-0.1 -0.910 68.9-134.5-126.9 144.3 75.5 18.3 24.7 59 59 A A S S+ 0 0 21 347,-0.5 2,-2.4 -2,-0.4 -1,-0.1 0.708 86.3 88.1 -69.4 -24.2 74.5 21.7 26.3 60 60 A G B +E 159 0C 30 99,-1.1 99,-1.4 -30,-0.1 -1,-0.2 -0.272 57.9 157.2 -73.7 56.3 73.4 23.3 23.0 61 61 A I - 0 0 13 -2,-2.4 2,-0.1 97,-0.2 97,-0.1 -0.482 51.1 -98.3 -74.8 148.8 69.8 22.0 23.3 62 62 A P + 0 0 18 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.459 39.0 177.3 -67.2 140.9 67.1 23.9 21.3 63 63 A L + 0 0 71 1,-0.3 316,-2.6 -2,-0.1 2,-0.3 0.438 69.5 41.0-121.4 0.2 65.2 26.4 23.5 64 64 A E E +F 378 0D 136 314,-0.3 2,-0.4 2,-0.0 -1,-0.3 -0.968 66.0 173.7-146.9 120.9 62.9 28.0 20.8 65 65 A I E -F 377 0D 8 312,-3.1 312,-3.4 -2,-0.3 3,-0.1 -0.997 24.2-152.2-135.5 133.8 61.2 26.0 18.0 66 66 A D >> - 0 0 64 -2,-0.4 4,-1.6 310,-0.3 3,-0.9 -0.887 10.4-160.9-100.1 103.6 58.7 27.1 15.4 67 67 A P T 34 S+ 0 0 31 0, 0.0 19,-0.5 0, 0.0 -1,-0.1 0.697 89.1 56.1 -59.4 -19.7 56.8 23.8 14.6 68 68 A D T 34 S+ 0 0 129 1,-0.2 19,-0.1 17,-0.1 18,-0.1 0.843 110.1 41.6 -81.0 -36.4 55.6 25.3 11.3 69 69 A A T <4 S+ 0 0 64 -3,-0.9 -1,-0.2 16,-0.1 -4,-0.0 0.657 91.0 114.6 -81.4 -20.3 59.1 26.1 9.9 70 70 A F < - 0 0 15 -4,-1.6 16,-0.5 1,-0.0 2,-0.4 -0.275 43.8-176.8 -57.0 134.0 60.5 22.7 11.2 71 71 A R - 0 0 97 14,-0.2 2,-0.6 15,-0.1 14,-0.2 -0.998 23.7-145.6-133.6 136.2 61.5 20.3 8.5 72 72 A L E -G 84 0E 0 12,-3.1 12,-2.8 -2,-0.4 2,-0.4 -0.921 24.5-149.4 -93.2 118.7 62.8 16.8 8.6 73 73 A E E -Gh 83 219E 73 145,-3.1 147,-3.2 -2,-0.6 2,-0.5 -0.782 10.7-166.9 -92.3 131.8 65.4 16.3 5.8 74 74 A I E +Gh 82 220E 1 8,-2.6 8,-2.3 -2,-0.4 2,-0.2 -0.979 30.0 138.5-116.8 120.0 65.8 12.9 4.2 75 75 A K E + h 0 221E 67 145,-2.9 147,-2.8 -2,-0.5 2,-0.4 -0.792 17.2 61.8-150.8-175.6 69.0 12.6 2.1 76 76 A G E S+ h 0 222E 43 145,-0.2 2,-2.7 -2,-0.2 147,-0.2 -0.735 103.5 18.2 92.0-133.3 72.0 10.6 0.8 77 77 A K S S+ 0 0 76 145,-3.2 69,-2.3 -2,-0.4 2,-0.3 -0.319 98.9 112.4 -77.3 59.8 71.6 7.3 -1.0 78 78 A V B S-K 145 0F 8 -2,-2.7 67,-0.2 67,-0.2 66,-0.2 -0.931 70.7-127.9-128.0 153.6 67.9 7.9 -1.9 79 79 A G S S+ 0 0 56 65,-2.3 65,-0.2 64,-0.5 -1,-0.1 0.925 99.3 24.6 -64.0 -46.2 66.2 8.4 -5.3 80 80 A T S S- 0 0 84 63,-2.6 -1,-0.2 62,-0.1 2,-0.0 -0.964 79.4-135.6-126.5 109.8 64.3 11.6 -4.1 81 81 A P - 0 0 93 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.383 28.3-149.4 -55.7 140.9 65.6 13.9 -1.3 82 82 A L E -G 74 0E 18 -8,-2.3 -8,-2.6 2,-0.0 2,-0.4 -0.917 21.9-168.6-120.5 144.7 62.7 14.8 1.0 83 83 A S E -G 73 0E 55 -2,-0.4 2,-0.5 -10,-0.2 -10,-0.2 -0.877 24.3-172.2-128.7 102.1 61.9 17.9 3.1 84 84 A L E -G 72 0E 10 -12,-2.8 -12,-3.1 -2,-0.4 2,-0.1 -0.815 15.0-153.1-108.9 129.5 59.0 17.1 5.4 85 85 A S > - 0 0 16 -2,-0.5 4,-2.3 -14,-0.2 -14,-0.2 -0.388 36.0-107.8 -79.7 166.8 57.0 19.3 7.7 86 86 A L H > S+ 0 0 13 -19,-0.5 4,-1.9 -16,-0.5 5,-0.1 0.847 125.2 52.9 -61.5 -37.2 55.2 18.0 10.8 87 87 A Q H > S+ 0 0 132 2,-0.2 4,-1.8 1,-0.2 5,-0.3 0.880 106.4 53.2 -64.6 -42.1 51.9 18.5 8.9 88 88 A D H > S+ 0 0 45 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.944 110.8 47.6 -51.7 -52.3 53.4 16.4 6.0 89 89 A L H X S+ 0 0 0 -4,-2.3 4,-0.6 1,-0.2 -2,-0.2 0.871 114.4 45.0 -59.9 -39.9 54.2 13.6 8.5 90 90 A K H < S+ 0 0 84 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.773 125.1 30.3 -79.1 -23.6 50.8 13.7 10.1 91 91 A N H < S+ 0 0 112 -4,-1.8 -2,-0.2 -3,-0.2 -3,-0.2 0.800 117.9 46.4-105.4 -36.6 48.8 13.8 6.8 92 92 A D H < S+ 0 0 97 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.1 0.504 109.5 50.3 -92.0 -7.3 50.8 12.0 4.0 93 93 A F S < S- 0 0 18 -4,-0.6 2,-0.2 -5,-0.3 46,-0.0 -0.914 86.2-106.8-130.0 152.7 51.8 8.9 5.9 94 94 A P - 0 0 96 0, 0.0 2,-0.3 0, 0.0 44,-0.1 -0.616 37.9-124.2 -78.1 143.8 49.8 6.4 8.0 95 95 A A - 0 0 43 -2,-0.2 2,-0.3 39,-0.1 39,-0.2 -0.601 24.5-170.0 -81.7 145.1 50.4 6.5 11.8 96 96 A S E -L 133 0G 35 37,-3.1 37,-2.2 -2,-0.3 2,-0.3 -0.891 6.2-151.6-123.1 164.6 51.5 3.7 13.9 97 97 A E E +L 132 0G 98 -2,-0.3 2,-0.3 35,-0.2 35,-0.2 -0.990 12.7 176.4-131.0 149.3 51.7 3.3 17.7 98 98 A V E -L 131 0G 31 33,-2.2 33,-3.2 -2,-0.3 2,-0.7 -0.979 26.4-140.1-148.8 131.4 53.9 1.2 20.0 99 99 A V E +L 130 0G 24 217,-0.4 220,-0.4 -2,-0.3 2,-0.3 -0.874 44.2 165.0 -87.4 116.8 54.1 1.0 23.8 100 100 A A E -L 129 0G 0 29,-2.3 29,-1.8 -2,-0.7 2,-0.3 -0.999 38.7-121.6-143.4 136.9 57.9 0.8 24.3 101 101 A V E -L 128 0G 0 218,-2.3 2,-0.5 -2,-0.3 106,-0.5 -0.594 19.5-158.9 -71.6 133.3 60.4 1.2 27.1 102 102 A N E +L 127 0G 6 25,-3.2 25,-1.8 -2,-0.3 2,-0.4 -0.985 20.5 171.6-108.9 121.9 63.1 3.8 26.7 103 103 A Q E -L 126 0G 1 -2,-0.5 107,-3.0 105,-0.4 23,-0.2 -0.995 31.1-118.7-135.2 132.1 66.1 3.1 28.9 104 104 A C > - 0 0 10 21,-2.3 3,-2.1 -2,-0.4 257,-0.2 -0.407 21.5-123.3 -61.5 136.8 69.5 4.7 29.0 105 105 A S T 3 S+ 0 0 1 1,-0.3 256,-1.8 -2,-0.1 257,-0.3 0.855 114.9 45.7 -35.8 -44.7 72.6 2.6 28.3 106 106 A G T > S+ 0 0 1 254,-0.2 3,-2.3 255,-0.1 15,-0.4 0.287 76.3 141.7 -98.3 7.4 73.8 3.8 31.7 107 107 A N T < S+ 0 0 2 -3,-2.1 255,-0.5 1,-0.3 16,-0.2 -0.253 77.7 15.3 -46.0 131.3 70.7 3.2 33.8 108 108 A S T > S+ 0 0 0 14,-2.6 3,-1.9 253,-0.1 4,-0.4 0.560 81.3 139.0 75.8 13.1 71.7 1.9 37.2 109 109 A R G X + 0 0 16 -3,-2.3 3,-1.4 13,-0.3 7,-0.3 0.836 62.9 66.8 -56.5 -36.0 75.4 3.0 36.7 110 110 A G G 3 S+ 0 0 0 11,-2.5 -1,-0.3 1,-0.2 -101,-0.2 0.709 97.6 55.0 -57.7 -19.7 75.6 4.2 40.3 111 111 A F G < S+ 0 0 47 -3,-1.9 -1,-0.2 10,-0.4 -2,-0.2 0.611 80.5 112.5 -89.1 -13.9 75.2 0.5 41.4 112 112 A V < - 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0 0 95 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.369 28.2-102.7 -80.3 166.3 96.9 23.8 28.8 441 567 B E H > S+ 0 0 178 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.859 118.1 50.4 -57.0 -44.7 99.2 21.3 30.5 442 568 B A H > S+ 0 0 75 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.918 115.4 43.4 -64.1 -42.0 99.9 23.2 33.6 443 569 B D H > S+ 0 0 54 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.838 109.4 57.5 -69.7 -38.6 96.2 23.9 34.3 444 570 B A H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.923 110.4 43.5 -56.8 -47.3 95.3 20.3 33.4 445 571 B K H X S+ 0 0 134 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.926 114.9 49.5 -65.1 -44.8 97.6 19.1 36.2 446 572 B A H X S+ 0 0 26 -4,-2.1 4,-2.2 2,-0.2 -51,-0.4 0.914 113.6 45.5 -60.7 -46.4 96.4 21.7 38.6 447 573 B I H X S+ 0 0 2 -4,-3.2 4,-2.8 2,-0.2 -2,-0.2 0.937 113.3 49.9 -62.3 -48.3 92.7 20.9 37.9 448 574 B A H X S+ 0 0 1 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.902 112.6 46.9 -61.3 -41.6 93.3 17.2 38.2 449 575 B D H X S+ 0 0 51 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.891 111.5 51.0 -66.9 -39.5 95.2 17.5 41.5 450 576 B Y H X S+ 0 0 0 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.932 114.1 44.9 -60.7 -45.3 92.5 19.8 42.9 451 577 B L H X S+ 0 0 4 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.915 111.9 49.5 -67.6 -45.6 89.8 17.3 41.9 452 578 B A H < S+ 0 0 20 -4,-2.7 -1,-0.2 1,-0.2 -32,-0.2 0.810 117.4 43.0 -64.6 -30.3 91.7 14.2 43.2 453 579 B K H < S+ 0 0 155 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.735 123.8 34.6 -82.8 -26.4 92.3 16.0 46.5 454 580 B T H < 0 0 31 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.742 360.0 360.0-106.9 -29.2 88.8 17.5 46.9 455 581 B Y < 0 0 27 -4,-2.9 -37,-2.2 -5,-0.2 -36,-0.2 0.575 360.0 360.0-112.7 360.0 86.3 15.0 45.4