==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2004 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/ELECTRON TRANSPORT 12-MAY-00 1EZV . COMPND 2 MOLECULE: UBIQUINOL-CYTOCHROME C REDUCTASE COMPLEX CORE . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR C.HUNTE,J.KOEPKE,C.LANGE,T.ROSSMANITH,H.MICHEL . 2178 11 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 98472.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1479 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 263 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 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 . 110 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 228 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 762 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 29 1.3 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 6 2 3 1 3 8 5 6 1 5 1 3 2 1 2 4 1 3 0 1 1 0 2 0 0 1 3 RESIDUES PER ALPHA HELIX . 3 1 0 0 2 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 PARALLEL BRIDGES PER LADDER . 13 6 9 7 2 9 4 3 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 . 4 3 3 2 2 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 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 27 A A 0 0 78 0, 0.0 2,-0.3 0, 0.0 16,-0.1 0.000 360.0 360.0 360.0 97.1 -18.0 109.7 49.0 2 28 A E - 0 0 76 2,-0.0 2,-0.2 14,-0.0 15,-0.0 -0.975 360.0-170.7-137.9 159.2 -21.6 110.1 49.9 3 29 A V + 0 0 57 -2,-0.3 2,-0.7 12,-0.1 12,-0.2 -0.669 16.7 167.4-148.5 85.0 -25.1 108.6 49.2 4 30 A T E +A 14 0A 56 10,-1.6 10,-2.1 -2,-0.2 2,-0.4 -0.873 6.1 164.3-105.9 106.2 -28.0 110.6 50.5 5 31 A Q E +A 13 0A 62 -2,-0.7 2,-0.3 8,-0.2 8,-0.2 -0.980 3.2 163.3-124.4 122.2 -31.4 109.4 49.1 6 32 A L E -A 12 0A 106 6,-2.2 6,-2.0 -2,-0.4 2,-0.5 -0.998 28.2-134.0-142.5 142.7 -34.7 110.4 50.8 7 33 A S E +A 11 0A 89 -2,-0.3 4,-0.2 4,-0.2 -2,-0.0 -0.843 28.8 160.5-106.0 121.3 -38.3 110.4 49.5 8 34 A N S S- 0 0 57 2,-2.4 -1,-0.2 -2,-0.5 3,-0.1 0.784 86.5 -47.8 -94.5 -95.6 -40.7 113.3 49.9 9 35 A G S S+ 0 0 62 191,-0.0 2,-0.2 1,-0.0 -2,-0.1 0.624 142.9 36.3 -99.1 -38.4 -43.5 113.0 47.5 10 36 A I S S- 0 0 56 -4,-0.1 -2,-2.4 167,-0.0 2,-0.6 -0.527 99.5-104.9 -95.7 170.9 -40.9 112.3 44.8 11 37 A V E -A 7 0A 34 168,-0.3 170,-2.3 165,-0.3 2,-0.5 -0.910 35.6-164.8-104.4 118.8 -37.6 110.3 45.4 12 38 A V E -Ab 6 181A 0 -6,-2.0 -6,-2.2 -2,-0.6 2,-0.4 -0.907 7.2-177.2-109.5 127.4 -34.5 112.6 45.6 13 39 A A E +Ab 5 182A 1 168,-2.9 170,-2.1 -2,-0.5 2,-0.3 -0.970 6.7 169.8-129.1 130.6 -31.0 111.2 45.4 14 40 A T E -Ab 4 183A 2 -10,-2.1 -10,-1.6 -2,-0.4 2,-0.3 -0.912 20.7-172.6-137.0 160.0 -27.7 113.2 45.7 15 41 A E E - b 0 184A 23 168,-1.6 170,-0.8 -2,-0.3 2,-0.4 -0.833 21.3-167.1-152.9 105.9 -24.0 112.7 46.0 16 42 A H E + b 0 185A 47 -2,-0.3 170,-0.2 168,-0.2 172,-0.1 -0.808 18.5 160.0-109.6 140.2 -21.9 115.8 46.7 17 43 A N - 0 0 55 168,-1.4 2,-0.4 -2,-0.4 3,-0.2 -0.876 49.9-104.3-151.3 122.3 -18.2 116.5 46.6 18 44 A P S S+ 0 0 119 0, 0.0 168,-0.1 0, 0.0 -2,-0.0 -0.302 71.3 127.5 -49.0 99.8 -16.5 119.9 46.3 19 45 A A S S- 0 0 55 -2,-0.4 3,-0.1 2,-0.2 167,-0.1 0.498 71.2 -87.7-119.7 -84.8 -15.5 119.9 42.6 20 46 A H S S+ 0 0 68 1,-0.6 2,-0.2 -3,-0.2 166,-0.1 0.250 91.5 33.2-161.8 -60.5 -16.6 122.8 40.4 21 47 A T - 0 0 3 61,-0.2 -1,-0.6 720,-0.1 2,-0.4 -0.610 64.1-133.6-111.3 169.4 -20.0 122.4 38.7 22 48 A A E -C 81 0A 0 59,-1.5 59,-3.7 163,-0.2 2,-0.5 -0.978 10.1-154.2-127.4 142.3 -23.3 120.8 39.7 23 49 A S E -CD 80 184A 0 161,-3.9 161,-2.7 -2,-0.4 2,-0.4 -0.967 10.5-176.1-121.5 126.7 -25.6 118.6 37.6 24 50 A V E +CD 79 183A 1 55,-3.3 55,-3.8 -2,-0.5 2,-0.3 -0.962 17.7 141.9-120.6 139.9 -29.3 118.2 38.2 25 51 A G E -CD 78 182A 2 157,-2.4 157,-3.7 -2,-0.4 2,-0.4 -0.991 44.3-115.4-168.2 160.2 -31.6 115.8 36.3 26 52 A V E -CD 77 181A 18 51,-1.8 51,-2.8 -2,-0.3 2,-0.5 -0.886 24.9-162.1-103.7 135.8 -34.6 113.5 36.4 27 53 A V E -CD 76 180A 0 153,-3.3 153,-0.9 -2,-0.4 2,-0.3 -0.981 8.4-152.1-122.5 112.9 -34.0 109.8 35.6 28 54 A F E -CD 75 179A 9 47,-2.8 47,-1.9 -2,-0.5 2,-1.0 -0.701 18.0-129.1 -89.5 143.3 -37.0 107.7 34.7 29 55 A G S S+ 0 0 15 149,-1.8 2,-0.3 -2,-0.3 45,-0.1 -0.084 84.4 77.5 -83.4 38.7 -37.2 104.0 35.3 30 56 A S + 0 0 2 -2,-1.0 44,-0.2 148,-0.2 2,-0.2 -0.972 50.0 150.8-150.9 128.2 -38.1 103.1 31.8 31 57 A G > - 0 0 0 41,-0.6 3,-2.3 -2,-0.3 4,-0.4 -0.435 66.7 -43.8-130.2-148.8 -36.0 102.9 28.6 32 58 A A G > S+ 0 0 0 39,-2.2 3,-0.7 42,-0.3 40,-0.2 0.713 125.8 69.6 -64.2 -18.8 -35.9 101.1 25.3 33 59 A A G 3 S+ 0 0 13 39,-2.3 -1,-0.3 1,-0.2 40,-0.1 0.495 97.9 52.3 -73.0 -5.2 -36.8 97.9 27.1 34 60 A N G < S+ 0 0 51 -3,-2.3 -1,-0.2 38,-0.2 -2,-0.2 0.537 94.0 90.0-109.1 -9.2 -40.2 99.4 27.7 35 61 A E S < S- 0 0 11 -3,-0.7 114,-0.1 -4,-0.4 5,-0.1 -0.013 72.7-119.4 -76.6 176.0 -41.0 100.3 24.0 36 62 A N > - 0 0 95 1,-0.0 4,-0.6 0, 0.0 -1,-0.1 -0.752 29.1-104.5-103.2 172.4 -42.6 98.1 21.4 37 63 A P T 4 S+ 0 0 54 0, 0.0 117,-0.2 0, 0.0 120,-0.1 0.824 122.8 45.3 -58.3 -26.8 -41.3 96.8 18.1 38 64 A Y T 4 S+ 0 0 165 1,-0.2 122,-0.1 119,-0.0 -3,-0.0 0.731 117.5 36.3-103.7 -22.3 -43.5 99.5 16.5 39 65 A N T >4 S+ 0 0 26 122,-0.1 3,-1.5 126,-0.0 -1,-0.2 0.247 83.4 144.7-109.0 19.4 -42.8 102.6 18.6 40 66 A N T 3< + 0 0 0 -4,-0.6 114,-0.5 1,-0.3 117,-0.1 -0.277 62.3 36.2 -59.3 116.9 -39.2 101.6 19.0 41 67 A G T 3> S+ 0 0 0 112,-0.2 4,-1.5 -2,-0.1 -1,-0.3 0.403 77.1 116.1 114.8 3.5 -37.2 104.8 19.0 42 68 A V H <> S+ 0 0 0 -3,-1.5 4,-2.5 2,-0.2 -2,-0.1 0.889 77.8 49.8 -70.7 -37.8 -39.6 107.1 20.9 43 69 A S H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.910 109.7 50.4 -66.4 -42.2 -37.3 107.5 23.8 44 70 A N H > S+ 0 0 7 107,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.861 110.9 50.6 -64.5 -33.0 -34.4 108.5 21.6 45 71 A L H X S+ 0 0 1 -4,-1.5 4,-1.5 2,-0.2 5,-0.2 0.926 107.5 52.4 -72.7 -41.5 -36.7 111.0 19.9 46 72 A W H >X S+ 0 0 2 -4,-2.5 4,-2.2 1,-0.2 3,-0.7 0.947 108.6 51.8 -53.3 -51.2 -37.7 112.5 23.2 47 73 A K H 3X S+ 0 0 51 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.881 107.7 53.7 -51.5 -40.5 -34.0 112.9 24.1 48 74 A N H 3< S+ 0 0 28 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.726 108.6 44.5 -80.5 -24.7 -33.4 114.7 20.8 49 75 A I H X< S+ 0 0 0 -4,-1.5 3,-2.3 -3,-0.7 6,-0.4 0.854 106.3 61.8 -81.5 -34.4 -36.1 117.4 21.1 50 76 A F H 3< S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.779 113.0 38.6 -56.4 -25.4 -35.1 118.0 24.7 51 77 A L T 3< S+ 0 0 56 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.202 92.0 134.0-109.8 13.2 -31.7 118.9 23.2 52 78 A S S <> S- 0 0 16 -3,-2.3 4,-3.0 1,-0.1 5,-0.3 -0.244 72.7-105.8 -65.3 157.0 -33.2 120.8 20.2 53 79 A K H > S+ 0 0 102 1,-0.2 4,-1.3 2,-0.2 5,-0.2 0.802 119.7 53.1 -54.3 -33.5 -31.9 124.2 19.1 54 80 A E H > S+ 0 0 107 2,-0.2 4,-1.2 1,-0.2 3,-0.2 0.961 116.5 34.6 -66.6 -54.9 -35.1 125.8 20.6 55 81 A N H > S+ 0 0 0 -6,-0.4 4,-0.9 1,-0.2 -2,-0.2 0.795 117.3 56.2 -71.4 -26.7 -34.9 124.3 24.1 56 82 A S H X S+ 0 0 31 -4,-3.0 4,-1.2 1,-0.2 622,-0.3 0.736 104.6 50.7 -81.8 -25.4 -31.1 124.4 24.0 57 83 A A H X S+ 0 0 21 -4,-1.3 4,-1.7 -5,-0.3 -1,-0.2 0.835 105.2 56.8 -77.5 -35.1 -30.9 128.2 23.3 58 84 A V H X S+ 0 0 63 -4,-1.2 4,-0.8 1,-0.2 -2,-0.2 0.819 112.1 43.6 -64.9 -28.9 -33.3 128.9 26.2 59 85 A A H <>S+ 0 0 0 -4,-0.9 5,-3.4 2,-0.2 -1,-0.2 0.804 109.7 54.8 -84.0 -32.0 -30.8 127.1 28.5 60 86 A A H <5S+ 0 0 3 -4,-1.2 675,-0.3 3,-0.2 674,-0.2 0.736 102.3 57.2 -77.7 -25.5 -27.7 128.6 27.0 61 87 A K H <5S+ 0 0 133 -4,-1.7 673,-0.2 1,-0.2 -1,-0.2 0.949 109.4 46.0 -61.7 -47.5 -29.0 132.2 27.7 62 88 A E T <5S- 0 0 106 -4,-0.8 -2,-0.2 -5,-0.2 -1,-0.2 0.512 123.2-109.5 -74.7 -4.9 -29.3 131.2 31.4 63 89 A G T 5S+ 0 0 4 1,-0.3 2,-0.3 -4,-0.2 -3,-0.2 0.853 72.7 138.9 76.7 35.3 -25.8 129.7 31.2 64 90 A L < - 0 0 3 -5,-3.4 2,-0.4 -8,-0.1 -1,-0.3 -0.852 42.3-144.8-112.8 147.9 -27.1 126.1 31.5 65 91 A A E -E 80 0A 25 15,-2.1 15,-2.9 -2,-0.3 2,-0.3 -0.946 13.8-140.2-117.3 138.9 -25.8 123.0 29.6 66 92 A L E +E 79 0A 27 -2,-0.4 2,-0.3 13,-0.2 13,-0.2 -0.751 22.3 168.7-106.7 142.5 -28.0 120.1 28.5 67 93 A S E +E 78 0A 46 11,-2.8 11,-3.1 -2,-0.3 2,-0.3 -0.992 3.5 176.5-150.3 137.2 -27.4 116.4 28.5 68 94 A S E -E 77 0A 16 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.986 7.4-167.7-143.3 153.2 -29.5 113.3 27.9 69 95 A N E -E 76 0A 61 7,-1.8 7,-1.8 -2,-0.3 2,-0.5 -0.966 7.6-157.6-145.1 122.9 -29.0 109.5 27.7 70 96 A I E +E 75 0A 14 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.885 24.9 164.1 -99.5 125.1 -31.3 106.7 26.6 71 97 A S - 0 0 30 3,-1.9 -39,-2.2 -2,-0.5 -38,-0.2 -0.461 47.1 -98.8-121.3-164.6 -30.5 103.2 27.9 72 98 A R S S+ 0 0 11 -41,-0.2 -39,-2.3 -40,-0.2 -41,-0.6 0.934 115.9 26.2 -87.3 -50.7 -32.3 99.9 28.1 73 99 A D S S+ 0 0 29 -43,-0.2 2,-0.3 -41,-0.1 -42,-0.1 0.637 128.6 16.3 -85.4 -21.3 -33.7 99.9 31.7 74 100 A F - 0 0 26 -44,-0.2 -3,-1.9 -45,-0.1 -42,-0.3 -0.875 56.2-143.0-148.1-176.8 -33.8 103.7 32.2 75 101 A Q E -CE 28 70A 0 -47,-1.9 -47,-2.8 -2,-0.3 2,-0.4 -0.991 15.8-161.8-161.4 137.5 -33.8 107.2 30.7 76 102 A S E -CE 27 69A 0 -7,-1.8 -7,-1.8 -2,-0.3 2,-0.4 -0.987 14.1-168.8-141.2 137.2 -32.2 110.5 31.9 77 103 A Y E -CE 26 68A 0 -51,-2.8 -51,-1.8 -2,-0.4 2,-0.4 -0.991 25.3-176.9-125.0 121.0 -32.6 114.2 31.3 78 104 A I E -CE 25 67A 1 -11,-3.1 -11,-2.8 -2,-0.4 2,-0.4 -0.955 20.5-167.4-133.8 134.6 -29.8 116.3 32.8 79 105 A V E -CE 24 66A 0 -55,-3.8 -55,-3.3 -2,-0.4 2,-0.5 -0.986 14.2-150.6-120.7 130.2 -28.9 120.0 33.2 80 106 A S E -CE 23 65A 11 -15,-2.9 -15,-2.1 -2,-0.4 -57,-0.3 -0.887 20.4-178.2-101.7 129.7 -25.4 121.1 34.3 81 107 A S E -C 22 0A 0 -59,-3.7 -59,-1.5 -2,-0.5 -17,-0.1 -0.541 37.9 -99.5-117.3-179.4 -25.1 124.4 36.2 82 108 A L > - 0 0 39 -61,-0.2 3,-2.2 -2,-0.2 2,-1.0 -0.953 59.2-104.5-118.1 113.6 -22.5 126.6 37.8 83 109 A P G > S+ 0 0 39 0, 0.0 3,-0.7 0, 0.0 -62,-0.1 0.088 115.9 51.4 -61.5 -15.5 -22.9 125.6 41.2 84 110 A G G 3 S+ 0 0 71 -2,-1.0 3,-0.5 1,-0.2 4,-0.1 0.676 99.6 68.9 -75.1 -18.8 -24.7 128.5 42.8 85 111 A S G <> + 0 0 50 -3,-2.2 4,-0.8 1,-0.2 3,-0.3 0.057 59.8 123.0 -87.7 28.4 -27.3 128.3 39.9 86 112 A T T <4 S+ 0 0 10 -3,-0.7 4,-0.5 1,-0.2 -1,-0.2 0.629 74.7 51.1 -64.1 -13.6 -28.5 125.0 41.4 87 113 A D T > S+ 0 0 65 -3,-0.5 4,-1.2 2,-0.2 -1,-0.2 0.820 102.1 56.7 -90.9 -37.1 -32.0 126.6 41.6 88 114 A K H > S+ 0 0 86 -3,-0.3 4,-0.9 1,-0.2 -2,-0.2 0.565 102.5 58.0 -75.3 -8.6 -32.1 127.9 38.0 89 115 A S H X S+ 0 0 0 -4,-0.8 4,-1.7 2,-0.2 -1,-0.2 0.830 103.9 50.6 -82.8 -37.7 -31.5 124.3 36.8 90 116 A L H > S+ 0 0 21 -4,-0.5 4,-1.6 -3,-0.2 -2,-0.2 0.751 107.1 56.3 -69.2 -25.5 -34.7 123.2 38.6 91 117 A D H X S+ 0 0 66 -4,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.921 108.5 45.7 -67.5 -44.6 -36.5 126.0 36.9 92 118 A F H < S+ 0 0 8 -4,-0.9 4,-0.5 1,-0.2 -2,-0.2 0.798 110.2 55.1 -71.2 -29.6 -35.5 124.7 33.5 93 119 A L H X S+ 0 0 18 -4,-1.7 4,-2.7 2,-0.2 3,-0.2 0.928 116.2 35.5 -67.2 -45.6 -36.4 121.2 34.4 94 120 A N H X>S+ 0 0 87 -4,-1.6 5,-1.3 2,-0.2 4,-0.7 0.819 111.2 59.6 -80.8 -34.6 -40.0 122.1 35.4 95 121 A Q H <>S+ 0 0 81 -4,-2.6 5,-2.1 3,-0.2 -1,-0.2 0.653 117.5 36.5 -65.0 -16.5 -40.4 124.7 32.7 96 122 A S H 45S+ 0 0 0 -4,-0.5 5,-0.3 -3,-0.2 -2,-0.2 0.828 117.9 45.6 -99.2 -46.6 -39.7 121.9 30.3 97 123 A F H <5S+ 0 0 39 -4,-2.7 -2,-0.2 3,-0.2 -3,-0.1 0.208 131.8 16.4 -93.0 17.0 -41.4 118.9 32.0 98 124 A I T <5S+ 0 0 69 -4,-0.7 -3,-0.2 -5,-0.1 -1,-0.1 0.338 136.0 27.9-141.1 -52.3 -44.7 120.7 32.8 99 125 A Q T >> - 0 0 46 -2,-0.9 4,-2.7 -3,-0.4 3,-1.0 -0.672 59.7-112.6 -84.4 145.7 -44.5 121.9 17.7 107 133 A S H 3> S+ 0 0 100 -2,-0.3 4,-1.6 1,-0.3 5,-0.1 0.784 114.6 43.1 -49.8 -42.6 -44.9 120.8 14.1 108 134 A S H 3> S+ 0 0 105 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.777 115.7 49.0 -77.6 -27.7 -41.8 122.5 12.7 109 135 A N H <> S+ 0 0 13 -3,-1.0 4,-1.2 2,-0.2 -2,-0.2 0.912 111.7 48.3 -75.3 -44.3 -39.6 121.4 15.6 110 136 A F H X S+ 0 0 5 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.890 111.4 49.3 -64.3 -42.4 -40.7 117.8 15.5 111 137 A E H X S+ 0 0 96 -4,-1.6 4,-1.3 -5,-0.3 -1,-0.2 0.798 112.3 47.6 -70.7 -30.3 -40.2 117.4 11.7 112 138 A A H < S+ 0 0 56 -4,-0.9 -1,-0.2 2,-0.2 4,-0.2 0.663 115.6 45.9 -83.6 -20.0 -36.7 119.0 11.9 113 139 A T H >X S+ 0 0 10 -4,-1.2 4,-1.8 2,-0.2 3,-0.6 0.860 111.2 50.3 -85.4 -43.8 -35.8 116.7 14.8 114 140 A K H 3X S+ 0 0 25 -4,-2.9 4,-0.9 1,-0.3 -2,-0.2 0.877 109.2 53.5 -60.2 -36.9 -37.2 113.5 13.3 115 141 A K H 3X S+ 0 0 136 -4,-1.3 4,-1.1 -5,-0.2 -1,-0.3 0.757 110.3 48.8 -68.4 -23.0 -35.2 114.4 10.1 116 142 A S H <> S+ 0 0 72 -3,-0.6 4,-0.6 -4,-0.2 -2,-0.2 0.735 108.8 48.3 -92.5 -28.3 -32.1 114.6 12.3 117 143 A V H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.573 109.4 57.2 -83.0 -12.5 -32.4 111.3 14.2 118 144 A L H X S+ 0 0 37 -4,-0.9 4,-1.8 -5,-0.2 -2,-0.2 0.889 109.4 41.8 -81.2 -42.4 -33.1 109.7 10.9 119 145 A K H X S+ 0 0 123 -4,-1.1 4,-1.4 2,-0.2 -2,-0.2 0.777 118.0 53.4 -67.8 -23.0 -29.7 110.9 9.5 120 146 A Q H X S+ 0 0 79 -4,-0.6 4,-1.4 2,-0.2 -2,-0.2 0.948 111.5 38.5 -79.6 -52.0 -28.4 109.9 12.9 121 147 A V H X S+ 0 0 4 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.831 116.3 53.9 -73.2 -28.5 -29.6 106.3 13.2 122 148 A Q H X S+ 0 0 102 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.911 106.3 51.7 -68.2 -43.3 -28.8 105.7 9.5 123 149 A D H X S+ 0 0 76 -4,-1.4 4,-1.5 1,-0.2 5,-0.4 0.842 108.3 53.8 -60.9 -35.9 -25.3 107.0 9.9 124 150 A F H X S+ 0 0 13 -4,-1.4 4,-2.2 2,-0.2 3,-0.3 0.950 110.5 44.0 -62.5 -51.7 -24.9 104.5 12.8 125 151 A E H < S+ 0 0 42 -4,-1.9 -2,-0.2 1,-0.2 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770I 0 50,-2.5 50,-2.8 -2,-0.4 2,-0.4 -0.966 19.1-175.6-110.6 132.0 -12.7 124.2 4.8 655 240 B A E -WX 703 769I 0 114,-2.5 114,-2.4 -2,-0.4 2,-0.4 -0.981 16.9-157.6-132.8 141.2 -11.0 125.7 7.9 656 241 B I E -WX 702 768I 1 46,-1.7 46,-2.1 -2,-0.4 2,-0.4 -0.922 10.0-166.3-113.1 146.5 -10.1 129.1 9.2 657 242 B G E -WX 701 767I 0 110,-2.7 110,-1.5 -2,-0.4 44,-0.2 -0.979 0.6-165.9-136.6 126.0 -7.4 129.9 11.8 658 243 B I E -W 700 0I 7 42,-2.3 42,-2.6 -2,-0.4 2,-0.1 -0.938 18.5-132.9-117.1 119.8 -6.8 133.1 13.7 659 244 B P E -W 699 0I 14 0, 0.0 2,-0.3 0, 0.0 40,-0.2 -0.437 30.4-156.3 -52.4 130.9 -3.7 134.0 15.8 660 245 B V E -W 698 0I 2 38,-1.4 38,-0.6 -2,-0.1 2,-0.1 -0.768 11.7-111.4-115.7 162.6 -4.8 135.5 19.1 661 246 B N - 0 0 88 -2,-0.3 4,-0.2 36,-0.2 36,-0.1 -0.462 28.3-112.2 -84.4 163.9 -3.1 137.8 21.7 662 247 B K S S+ 0 0 71 1,-0.2 35,-0.2 -2,-0.1 -1,-0.1 0.762 120.5 23.7 -64.0 -25.2 -1.8 136.8 25.1 663 248 B A S > S+ 0 0 72 1,-0.1 3,-0.6 2,-0.1 -1,-0.2 0.648 116.3 62.0-114.2 -25.1 -4.6 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-44.2 -70.2 160.7 -18.1 67.4 -16.0 892 108 C S T 3 S+ 0 0 71 1,-0.4 835,-0.2 2,-0.2 -1,-0.1 -0.249 124.7 28.1 -51.5 132.4 -15.4 70.0 -16.0 893 109 C P T 3 S+ 0 0 26 0, 0.0 -1,-0.4 0, 0.0 3,-0.3 -0.884 123.3 53.8 -97.0 26.5 -13.6 70.7 -13.8 894 110 C R <> + 0 0 17 -3,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.190 68.5 112.1-108.9 27.1 -13.9 67.1 -12.4 895 111 C V H > S+ 0 0 38 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.920 79.7 49.5 -65.2 -48.4 -13.0 65.2 -15.5 896 112 C T H > S+ 0 0 92 -3,-0.3 4,-2.5 2,-0.2 5,-0.3 0.935 108.8 54.3 -54.9 -43.9 -9.7 63.9 -13.9 897 113 C L H > S+ 0 0 23 1,-0.2 4,-2.0 -4,-0.2 -2,-0.2 0.941 111.4 45.0 -54.0 -48.5 -11.7 62.8 -10.9 898 114 C W H X S+ 0 0 28 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.880 111.1 52.2 -63.5 -42.5 -14.1 60.8 -13.2 899 115 C N H X S+ 0 0 59 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.895 109.0 49.2 -67.0 -39.8 -11.3 59.3 -15.2 900 116 C V H X S+ 0 0 21 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.919 108.0 56.7 -65.5 -37.0 -9.5 58.0 -12.1 901 117 C G H X S+ 0 0 22 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.870 103.5 52.5 -57.3 -39.5 -12.8 56.6 -11.0 902 118 C V H X S+ 0 0 7 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.917 108.4 51.0 -69.4 -36.6 -13.1 54.6 -14.2 903 119 C I H X S+ 0 0 85 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.926 108.3 51.4 -62.3 -44.7 -9.6 53.1 -13.6 904 120 C I H X S+ 0 0 16 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.916 108.4 53.2 -58.3 -43.9 -10.6 52.1 -10.0 905 121 C F H X S+ 0 0 6 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.911 109.4 47.0 -58.2 -46.9 -13.7 50.4 -11.4 906 122 C T H X S+ 0 0 64 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.924 114.1 48.5 -59.9 -44.5 -11.6 48.3 -13.8 907 123 C L H X S+ 0 0 40 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.874 110.4 51.1 -66.2 -32.4 -9.2 47.4 -11.0 908 124 C T H X S+ 0 0 7 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.918 109.4 49.9 -75.4 -39.5 -12.0 46.5 -8.7 909 125 C I H X S+ 0 0 32 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.949 112.9 47.0 -62.1 -45.0 -13.5 44.2 -11.3 910 126 C A H X S+ 0 0 41 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.879 110.6 53.1 -64.7 -37.1 -10.1 42.5 -11.9 911 127 C T H X S+ 0 0 16 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.933 108.6 48.3 -64.5 -42.8 -9.6 42.2 -8.1 912 128 C A H X S+ 0 0 16 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.867 109.9 52.6 -69.6 -34.2 -12.9 40.4 -7.5 913 129 C F H X S+ 0 0 26 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.933 108.2 50.6 -64.4 -46.3 -12.3 38.0 -10.4 914 130 C L H X S+ 0 0 15 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.919 112.8 47.0 -57.9 -39.6 -8.9 37.1 -8.9 915 131 C G H >X S+ 0 0 16 -4,-2.1 3,-1.5 1,-0.2 4,-0.7 0.940 107.1 55.7 -69.3 -43.4 -10.5 36.4 -5.6 916 132 C Y H >< S+ 0 0 41 -4,-2.7 3,-0.9 1,-0.3 4,-0.5 0.878 104.6 54.8 -56.7 -37.4 -13.3 34.4 -7.0 917 133 C C H >< S+ 0 0 2 -4,-2.0 3,-0.6 1,-0.2 -1,-0.3 0.700 94.8 69.6 -66.0 -25.1 -10.7 32.1 -8.7 918 134 C C H << S+ 0 0 11 -3,-1.5 -1,-0.2 -4,-0.7 -2,-0.2 0.729 88.8 61.0 -71.8 -26.7 -9.0 31.4 -5.3 919 135 C V T << S- 0 0 24 -3,-0.9 -1,-0.2 -4,-0.7 -70,-0.2 0.826 92.2-152.3 -58.7 -34.2 -11.9 29.4 -4.0 920 136 C Y < + 0 0 17 -3,-0.6 124,-2.1 -4,-0.5 -74,-0.2 0.867 40.3 144.1 47.0 45.4 -11.3 27.0 -6.9 921 137 C G B > S-A 1043 0K 0 -5,-0.4 4,-2.0 122,-0.3 119,-0.2 -0.158 71.5 -83.1 -80.6-169.3 -14.8 25.7 -7.1 922 138 C Q H > S+ 0 0 9 117,-1.5 4,-2.0 120,-1.2 5,-0.3 0.941 133.4 48.3 -66.3 -46.1 -16.4 24.9 -10.5 923 139 C M H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.823 109.8 55.8 -61.7 -31.2 -17.3 28.6 -11.2 924 140 C S H > S+ 0 0 0 2,-0.2 4,-2.9 3,-0.2 -1,-0.2 0.955 108.0 45.6 -63.8 -52.7 -13.7 29.5 -10.2 925 141 C H H X S+ 0 0 6 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.937 119.3 39.4 -59.5 -45.5 -12.0 27.2 -12.7 926 142 C W H X S+ 0 0 34 -4,-2.0 4,-3.2 2,-0.2 5,-0.3 0.829 113.2 55.2 -82.2 -30.0 -14.2 28.1 -15.7 927 143 C G H X S+ 0 0 17 -4,-2.1 4,-2.6 -5,-0.3 5,-0.3 0.977 111.0 45.8 -58.3 -50.7 -14.3 31.8 -14.8 928 144 C A H X S+ 0 0 0 -4,-2.9 4,-1.8 -5,-0.2 -2,-0.2 0.875 115.6 48.1 -58.2 -40.5 -10.5 31.7 -14.8 929 145 C T H X S+ 0 0 22