==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 06-AUG-12 4GGO . COMPND 2 MOLECULE: TRANS-2-ENOYL-COA REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TREPONEMA DENTICOLA ATCC 35405; . AUTHOR B.B.BOND-WATTS,A.M.WEEKS,M.C.Y.CHANG . 1588 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 69097.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1098 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 139 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.4 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 . 143 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 555 34.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 39 2.5 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 11 0 0 0 0 1 5 8 4 3 8 5 2 0 5 3 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 0 4 12 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 PARALLEL BRIDGES PER LADDER . 1 4 4 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 12 0 0 0 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 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 M 0 0 108 0, 0.0 390,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 156.7 -3.3 3.5 -42.2 2 2 A I - 0 0 83 388,-0.3 2,-0.7 386,-0.1 388,-0.2 -0.582 360.0-142.8 -69.2 120.0 -4.0 5.2 -45.5 3 3 A V + 0 0 0 -2,-0.5 386,-0.1 386,-0.4 -1,-0.1 -0.785 28.1 166.2 -96.8 115.1 -0.9 7.2 -46.3 4 4 A K - 0 0 85 -2,-0.7 10,-0.1 376,-0.1 2,-0.1 -0.816 46.1 -81.2-118.8 159.9 -1.4 10.6 -48.0 5 5 A P - 0 0 60 0, 0.0 2,-0.5 0, 0.0 10,-0.1 -0.381 37.1-162.3 -64.5 137.3 1.2 13.5 -48.4 6 6 A M - 0 0 68 -2,-0.1 7,-3.0 8,-0.1 2,-0.6 -0.880 10.1-175.8-121.9 98.4 1.7 15.7 -45.4 7 7 A V E +A 12 0A 56 -2,-0.5 2,-0.4 5,-0.3 5,-0.3 -0.843 7.2 169.7-102.2 117.4 3.3 19.0 -46.4 8 8 A R E > S-A 11 0A 93 3,-2.5 3,-1.1 -2,-0.6 1051,-0.1 -0.993 70.2 -2.8-125.9 133.2 4.2 21.5 -43.7 9 9 A N T 3 S- 0 0 67 -2,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.893 130.9 -55.9 54.9 44.6 6.4 24.6 -44.2 10 10 A N T 3 S+ 0 0 75 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.646 118.3 109.0 64.7 18.7 6.9 23.7 -47.9 11 11 A I E < -A 8 0A 42 -3,-1.1 -3,-2.5 271,-0.1 2,-0.7 -0.989 69.9-130.6-129.1 130.2 8.3 20.3 -46.9 12 12 A C E -A 7 0A 8 -2,-0.4 -5,-0.3 -5,-0.3 -3,-0.0 -0.694 23.7-169.4 -77.0 114.0 6.7 16.8 -47.3 13 13 A L + 0 0 74 -7,-3.0 -1,-0.2 -2,-0.7 -6,-0.1 0.878 60.1 41.1 -77.1 -40.4 7.1 15.3 -43.8 14 14 A N - 0 0 6 -8,-0.4 2,-0.3 -10,-0.1 -8,-0.1 -0.284 67.1-143.7-102.3-174.1 6.1 11.7 -44.5 15 15 A A - 0 0 0 -2,-0.1 364,-0.2 75,-0.1 74,-0.1 -0.996 15.1-125.6-153.2 148.1 6.8 9.1 -47.2 16 16 A H > - 0 0 4 362,-2.5 4,-2.5 -2,-0.3 5,-0.2 -0.872 17.5-155.7 -99.3 115.0 5.0 6.2 -49.0 17 17 A P H > S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.897 93.6 40.2 -56.2 -49.8 7.0 3.0 -48.8 18 18 A Q H > S+ 0 0 54 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.848 113.8 55.2 -71.0 -35.1 5.5 1.3 -51.9 19 19 A G H > S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 360,-0.3 0.892 108.0 48.4 -63.6 -41.7 5.6 4.5 -53.8 20 20 A C H X S+ 0 0 3 -4,-2.5 4,-1.8 358,-0.3 -1,-0.2 0.896 111.6 51.0 -63.7 -41.2 9.3 5.0 -53.2 21 21 A K H X S+ 0 0 56 -4,-1.7 4,-2.5 -5,-0.2 -2,-0.2 0.935 110.3 47.8 -60.9 -48.8 9.9 1.4 -54.2 22 22 A K H X S+ 0 0 47 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.860 108.5 56.5 -61.0 -36.9 7.9 1.9 -57.5 23 23 A G H X S+ 0 0 21 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.885 109.4 44.9 -62.3 -40.8 9.9 5.1 -58.1 24 24 A V H X S+ 0 0 1 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.913 112.8 51.2 -68.4 -43.5 13.2 3.2 -57.8 25 25 A E H X S+ 0 0 66 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.868 106.6 53.9 -62.9 -39.0 11.9 0.4 -60.1 26 26 A D H X S+ 0 0 59 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.865 108.7 49.4 -63.9 -36.8 10.7 2.8 -62.8 27 27 A Q H X S+ 0 0 42 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.876 110.8 50.2 -69.4 -37.9 14.2 4.3 -62.9 28 28 A I H X S+ 0 0 14 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.918 109.7 50.7 -64.0 -44.6 15.7 0.8 -63.2 29 29 A E H X S+ 0 0 104 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.887 111.7 47.6 -62.2 -40.2 13.4 -0.0 -66.0 30 30 A Y H X S+ 0 0 75 -4,-1.9 4,-2.3 1,-0.2 3,-0.4 0.925 109.7 53.2 -64.6 -45.1 14.3 3.2 -67.9 31 31 A T H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.872 106.0 52.6 -59.8 -40.4 18.0 2.5 -67.3 32 32 A K H < S+ 0 0 90 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.822 115.8 41.5 -64.9 -31.0 17.8 -1.0 -68.8 33 33 A K H < S+ 0 0 142 -4,-1.1 3,-0.2 -3,-0.4 -2,-0.2 0.750 119.3 44.7 -85.6 -27.2 16.1 0.5 -71.9 34 34 A R H < S+ 0 0 65 -4,-2.3 2,-1.3 1,-0.2 -2,-0.2 0.914 110.1 51.5 -84.9 -47.9 18.4 3.6 -72.1 35 35 A I S < S+ 0 0 5 -4,-3.0 -1,-0.2 -5,-0.2 2,-0.1 -0.673 81.5 167.5 -92.9 82.0 21.8 1.9 -71.5 36 36 A T > - 0 0 52 -2,-1.3 4,-2.4 -3,-0.2 5,-0.2 -0.371 53.6 -99.9 -90.1 171.6 21.6 -0.8 -74.2 37 37 A A H > S+ 0 0 80 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.841 125.9 52.4 -57.6 -34.3 24.3 -3.1 -75.5 38 38 A E H 4 S+ 0 0 135 2,-0.2 -1,-0.2 1,-0.2 -3,-0.1 0.880 108.3 48.4 -71.2 -40.0 24.5 -0.8 -78.5 39 39 A V H 4 S+ 0 0 42 1,-0.2 -2,-0.2 -5,-0.1 -1,-0.2 0.905 117.0 43.3 -63.9 -41.0 24.9 2.3 -76.4 40 40 A K H >< S+ 0 0 72 -4,-2.4 3,-1.9 29,-0.1 -2,-0.2 0.705 88.0 118.8 -77.6 -21.3 27.6 0.6 -74.4 41 41 A A T 3< S+ 0 0 41 -4,-1.3 3,-0.1 1,-0.3 -3,-0.0 -0.200 83.6 3.7 -55.2 127.3 29.3 -0.9 -77.5 42 42 A G T 3 S+ 0 0 77 1,-0.2 2,-0.3 281,-0.0 -1,-0.3 0.539 110.8 101.9 78.8 7.3 32.9 0.2 -78.0 43 43 A A S < S- 0 0 25 -3,-1.9 -1,-0.2 1,-0.1 279,-0.2 -0.869 73.3-108.5-121.7 156.4 33.1 2.2 -74.8 44 44 A K - 0 0 170 277,-0.5 -1,-0.1 -2,-0.3 280,-0.1 -0.133 34.2-150.2 -70.0 175.8 34.6 1.6 -71.4 45 45 A A - 0 0 54 274,-0.0 2,-0.1 26,-0.0 21,-0.0 -0.995 18.3-101.0-150.9 150.5 32.4 1.0 -68.4 46 46 A P + 0 0 5 0, 0.0 3,-0.1 0, 0.0 91,-0.0 -0.409 32.9 174.1 -69.2 151.8 32.4 1.5 -64.6 47 47 A K + 0 0 127 1,-0.3 26,-2.9 25,-0.1 2,-0.5 0.645 69.4 25.0-124.1 -51.9 33.3 -1.6 -62.4 48 48 A N E S-b 73 0B 20 24,-0.2 90,-2.3 88,-0.2 91,-1.3 -0.960 74.8-174.5-123.5 113.4 33.5 -0.4 -58.8 49 49 A V E -bc 74 139B 1 24,-3.2 26,-2.6 -2,-0.5 2,-0.5 -0.908 16.8-162.6-118.4 132.1 31.5 2.7 -57.9 50 50 A L E -bc 75 140B 0 89,-2.3 91,-3.0 -2,-0.4 2,-0.5 -0.947 12.1-168.9-105.7 125.3 31.2 4.7 -54.7 51 51 A V E -bc 76 141B 0 24,-2.6 26,-2.5 -2,-0.5 2,-0.7 -0.954 7.7-158.9-119.3 116.5 28.2 7.0 -54.5 52 52 A L E S+bc 77 142B 0 89,-3.4 91,-2.7 -2,-0.5 26,-0.2 -0.827 85.9 19.9 -97.0 110.9 28.0 9.6 -51.8 53 53 A G S S+ 0 0 7 24,-3.6 3,-0.4 -2,-0.7 -1,-0.3 0.842 79.2 163.3 91.7 59.6 24.4 10.6 -51.2 54 54 A C + 0 0 0 23,-1.3 24,-0.1 -3,-0.4 9,-0.1 0.434 49.6 76.9 -93.0 -2.3 23.0 7.5 -52.9 55 55 A S S S+ 0 0 4 22,-0.2 2,-0.3 1,-0.1 -1,-0.2 0.591 97.8 10.7 -95.5 -12.0 19.4 7.6 -51.6 56 56 A N S >> S- 0 0 94 -3,-0.4 4,-1.3 39,-0.1 3,-1.1 -0.987 99.9 -1.1-158.5 165.2 17.8 10.3 -53.7 57 57 A G H 3> S- 0 0 26 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 -0.170 120.7 -7.8 57.7-136.2 18.0 12.6 -56.8 58 58 A Y H 3> S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.795 135.6 57.0 -66.8 -30.3 21.1 12.6 -58.9 59 59 A G H <> S+ 0 0 0 -3,-1.1 4,-1.8 84,-0.3 -2,-0.2 0.949 108.5 44.8 -65.2 -50.3 22.9 10.3 -56.4 60 60 A L H X S+ 0 0 4 -4,-1.3 4,-2.5 1,-0.2 -2,-0.2 0.901 113.8 50.2 -59.4 -43.5 20.3 7.6 -56.6 61 61 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.831 108.2 54.4 -65.4 -31.9 20.2 7.9 -60.4 62 62 A S H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.873 110.7 44.4 -69.1 -39.1 24.0 7.6 -60.5 63 63 A R H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.915 114.8 48.8 -71.5 -43.2 23.9 4.4 -58.5 64 64 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.5 0.902 111.9 48.7 -62.6 -43.5 21.1 2.9 -60.5 65 65 A T H X>S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 5,-0.7 0.916 114.9 45.1 -63.7 -43.8 22.8 3.8 -63.8 66 66 A A H X5S+ 0 0 0 -4,-1.8 6,-2.4 3,-0.2 4,-0.7 0.926 122.6 35.9 -65.1 -45.6 26.1 2.3 -62.7 67 67 A A H X5S+ 0 0 2 -4,-2.7 4,-0.9 4,-0.2 -2,-0.2 0.956 128.9 28.2 -76.2 -53.3 24.5 -0.9 -61.3 68 68 A F H <5S+ 0 0 15 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.1 0.532 127.6 42.0 -94.5 -6.1 21.6 -1.6 -63.7 69 69 A G H <5S+ 0 0 3 -4,-1.1 -3,-0.2 -5,-0.5 -1,-0.1 0.744 133.2 16.4-102.8 -35.4 23.0 -0.1 -66.8 70 70 A Y H <> - 0 0 32 -9,-1.7 3,-1.4 -2,-0.2 4,-1.2 -0.471 39.3-113.4 -70.9 151.3 13.0 9.1 -44.6 91 91 A P H 3> S+ 0 0 29 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.839 117.1 61.9 -55.3 -32.9 12.2 8.5 -48.3 92 92 A G H 3> S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.784 97.0 58.3 -63.9 -28.9 15.9 7.7 -48.9 93 93 A W H <> S+ 0 0 37 -3,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.946 109.4 42.5 -65.1 -49.2 15.6 4.8 -46.4 94 94 A Y H X S+ 0 0 0 -4,-1.2 4,-2.5 2,-0.2 -2,-0.2 0.882 112.6 55.0 -64.6 -39.4 12.9 3.1 -48.5 95 95 A N H X S+ 0 0 14 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.919 108.0 48.4 -58.2 -46.6 14.8 3.9 -51.7 96 96 A N H X S+ 0 0 8 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.869 110.8 50.9 -62.2 -38.9 17.9 2.2 -50.4 97 97 A L H X S+ 0 0 59 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.913 111.8 47.5 -64.1 -43.4 15.9 -0.8 -49.4 98 98 A A H X S+ 0 0 10 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.907 113.3 48.6 -63.8 -43.4 14.3 -1.0 -52.9 99 99 A F H X S+ 0 0 1 -4,-2.6 4,-3.1 2,-0.2 5,-0.2 0.960 112.5 45.4 -61.8 -55.1 17.7 -0.6 -54.5 100 100 A D H X S+ 0 0 43 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.852 112.9 51.9 -60.2 -36.8 19.5 -3.3 -52.5 101 101 A E H X S+ 0 0 101 -4,-1.9 4,-1.6 -5,-0.2 -1,-0.2 0.901 113.4 44.1 -65.4 -41.8 16.6 -5.7 -53.0 102 102 A A H X S+ 0 0 3 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.894 113.1 51.2 -68.9 -41.2 16.7 -5.1 -56.7 103 103 A A H X>S+ 0 0 1 -4,-3.1 5,-3.0 1,-0.2 4,-0.7 0.863 109.0 51.0 -64.6 -37.4 20.5 -5.4 -56.9 104 104 A K H ><5S+ 0 0 170 -4,-2.1 3,-0.6 -5,-0.2 -1,-0.2 0.890 107.8 53.0 -66.5 -39.8 20.4 -8.7 -54.9 105 105 A R H 3<5S+ 0 0 153 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.827 109.1 49.3 -64.8 -32.6 17.8 -10.0 -57.4 106 106 A E H 3<5S- 0 0 92 -4,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.618 117.0-113.9 -81.6 -14.0 20.1 -9.2 -60.3 107 107 A G T <<5 + 0 0 68 -4,-0.7 2,-0.3 -3,-0.6 -3,-0.2 0.769 67.6 144.8 83.6 28.6 23.0 -10.8 -58.7 108 108 A L < - 0 0 41 -5,-3.0 2,-0.4 -6,-0.1 -1,-0.3 -0.761 55.5-113.7-100.3 144.9 24.9 -7.6 -58.2 109 109 A Y + 0 0 61 -2,-0.3 -35,-1.7 -42,-0.1 2,-0.3 -0.648 46.1 164.8 -73.2 125.9 27.2 -6.6 -55.3 110 110 A S E +d 74 0B 26 -2,-0.4 2,-0.4 -37,-0.2 -35,-0.2 -0.910 13.6 175.7-150.5 118.6 25.6 -3.8 -53.4 111 111 A V E -d 75 0B 38 -37,-1.8 -35,-2.2 -2,-0.3 2,-0.5 -0.988 11.6-160.3-124.7 129.0 26.4 -2.5 -49.9 112 112 A T E -d 76 0B 34 -2,-0.4 2,-0.6 -37,-0.2 -35,-0.2 -0.934 2.6-159.2-110.8 123.6 24.7 0.6 -48.4 113 113 A I E -d 77 0B 13 -37,-3.2 -35,-1.6 -2,-0.5 2,-0.6 -0.900 10.2-154.8-102.7 115.9 26.4 2.4 -45.5 114 114 A D E +d 78 0B 68 -2,-0.6 2,-0.3 -37,-0.2 -35,-0.2 -0.800 47.3 72.3 -95.9 120.5 23.9 4.5 -43.5 115 115 A G S S- 0 0 8 -37,-2.3 2,-0.8 -2,-0.6 -2,-0.1 -0.946 88.1 -38.2 162.6 179.5 25.4 7.5 -41.6 116 116 A D > - 0 0 21 -2,-0.3 3,-2.1 1,-0.2 6,-0.5 -0.559 42.0-162.5 -72.1 107.0 26.9 10.9 -41.7 117 117 A A T 3 S+ 0 0 5 -2,-0.8 -1,-0.2 1,-0.3 6,-0.0 0.626 88.3 66.1 -66.4 -13.4 29.1 10.9 -44.8 118 118 A F T 3 S+ 0 0 9 4,-0.0 -1,-0.3 33,-0.0 2,-0.2 0.579 88.7 90.9 -80.4 -10.8 30.9 14.0 -43.4 119 119 A S S <> S- 0 0 4 -3,-2.1 4,-1.4 1,-0.1 5,-0.1 -0.563 76.7-136.4 -91.0 149.6 32.2 11.8 -40.5 120 120 A D H > S+ 0 0 30 -2,-0.2 4,-1.9 1,-0.2 -1,-0.1 0.724 103.8 64.7 -72.2 -22.2 35.5 9.9 -40.5 121 121 A E H > S+ 0 0 54 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.929 103.2 45.0 -65.4 -46.7 33.6 7.0 -39.0 122 122 A I H > S+ 0 0 7 -6,-0.5 4,-1.8 1,-0.2 -2,-0.2 0.888 112.0 52.4 -65.4 -39.7 31.6 6.5 -42.1 123 123 A K H X S+ 0 0 1 -4,-1.4 4,-2.5 1,-0.2 -1,-0.2 0.880 108.1 52.7 -60.6 -38.1 34.7 6.9 -44.3 124 124 A A H X S+ 0 0 26 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.879 106.5 52.0 -65.5 -39.1 36.3 4.2 -42.2 125 125 A Q H X S+ 0 0 90 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.849 110.6 49.0 -66.1 -34.8 33.4 1.8 -42.8 126 126 A V H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.957 112.0 46.9 -67.3 -52.2 33.7 2.4 -46.5 127 127 A I H X S+ 0 0 20 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.900 112.7 51.4 -54.9 -44.3 37.5 1.8 -46.5 128 128 A E H X S+ 0 0 105 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.920 111.9 44.9 -61.0 -47.2 37.0 -1.3 -44.4 129 129 A E H X S+ 0 0 26 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.876 114.4 49.9 -65.8 -37.8 34.3 -2.8 -46.7 130 130 A A H <>S+ 0 0 0 -4,-2.7 5,-2.6 1,-0.2 4,-0.4 0.883 111.5 48.3 -67.6 -40.2 36.5 -1.9 -49.8 131 131 A K H ><5S+ 0 0 100 -4,-2.7 3,-0.6 -5,-0.2 -2,-0.2 0.867 109.2 55.0 -64.8 -37.6 39.5 -3.5 -48.2 132 132 A K H 3<5S+ 0 0 137 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.844 114.7 36.4 -66.9 -36.9 37.5 -6.6 -47.3 133 133 A K T 3<5S- 0 0 120 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.325 110.0-114.2-102.8 6.5 36.2 -7.3 -50.9 134 134 A G T < 5 + 0 0 69 -3,-0.6 2,-0.5 -4,-0.4 -3,-0.2 0.868 58.7 165.0 63.5 38.7 39.4 -6.2 -52.7 135 135 A I < - 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