==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE (ALDEHYDE) 14-FEB-96 2FUA . COMPND 2 MOLECULE: L-FUCULOSE-1-PHOSPHATE ALDOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.K.DREYER,G.E.SCHULZ . 210 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10594.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 14.8 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 . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 34.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.4 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 0 0 0 1 2 0 0 0 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 PARALLEL BRIDGES PER LADDER . 3 0 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 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 1 A M 0 0 209 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 37.6 -29.1 57.9 8.9 2 2 A E >> - 0 0 104 1,-0.1 4,-1.9 0, 0.0 3,-0.8 -0.746 360.0-118.4 -90.6 145.7 -29.7 54.9 6.6 3 3 A R H 3> S+ 0 0 52 -2,-0.3 4,-2.8 1,-0.2 3,-0.4 0.922 112.5 52.1 -51.9 -48.4 -29.7 51.5 8.4 4 4 A N H 3> S+ 0 0 69 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.783 109.8 49.5 -62.0 -27.3 -26.7 50.1 6.5 5 5 A K H <> S+ 0 0 64 -3,-0.8 4,-1.5 2,-0.2 -1,-0.3 0.821 112.5 47.1 -80.8 -30.8 -24.7 53.2 7.3 6 6 A L H X S+ 0 0 28 -4,-1.9 4,-2.0 -3,-0.4 -2,-0.2 0.829 109.2 56.3 -75.2 -33.4 -25.6 52.9 11.0 7 7 A A H X S+ 0 0 0 -4,-2.8 4,-1.9 -5,-0.2 -2,-0.2 0.867 105.7 49.8 -64.8 -40.7 -24.7 49.2 10.8 8 8 A R H X S+ 0 0 127 -4,-1.3 4,-3.2 2,-0.2 5,-0.2 0.938 109.4 51.2 -63.2 -49.6 -21.2 49.9 9.6 9 9 A Q H X S+ 0 0 94 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.911 107.2 53.3 -54.9 -45.8 -20.5 52.5 12.4 10 10 A I H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 3,-0.3 0.954 112.3 45.8 -54.6 -47.6 -21.7 49.9 15.0 11 11 A I H X S+ 0 0 12 -4,-1.9 4,-2.1 1,-0.3 -2,-0.2 0.899 109.3 53.1 -64.8 -41.8 -19.2 47.5 13.5 12 12 A D H X S+ 0 0 99 -4,-3.2 4,-2.6 1,-0.2 -1,-0.3 0.835 107.5 53.9 -62.8 -29.8 -16.4 50.1 13.3 13 13 A T H X S+ 0 0 13 -4,-2.1 4,-3.1 -3,-0.3 -2,-0.2 0.924 106.2 51.0 -70.8 -41.7 -17.0 50.8 17.0 14 14 A C H X S+ 0 0 8 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.917 114.3 44.6 -59.4 -44.9 -16.6 47.1 17.9 15 15 A L H X S+ 0 0 50 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.919 116.6 45.0 -63.2 -51.0 -13.3 46.9 16.0 16 16 A E H X S+ 0 0 72 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.876 109.4 56.0 -65.2 -34.4 -12.0 50.2 17.4 17 17 A M H <>S+ 0 0 0 -4,-3.1 5,-2.2 1,-0.2 6,-0.9 0.879 109.8 46.9 -65.0 -37.0 -13.2 49.1 20.9 18 18 A T H ><5S+ 0 0 37 -4,-1.6 3,-1.4 -5,-0.2 -1,-0.2 0.908 107.6 56.1 -68.0 -45.2 -11.0 46.1 20.5 19 19 A R H 3<5S+ 0 0 159 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.787 107.0 50.7 -56.0 -37.6 -8.1 48.2 19.3 20 20 A L T 3<5S- 0 0 64 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.537 118.0-111.1 -80.0 -12.0 -8.2 50.3 22.4 21 21 A G T < 5S+ 0 0 36 -3,-1.4 75,-0.4 -4,-0.4 -3,-0.2 0.659 89.1 112.0 89.2 19.0 -8.2 47.2 24.7 22 22 A L < + 0 0 2 -5,-2.2 2,-1.1 1,-0.2 72,-0.6 0.692 63.5 71.9 -92.8 -22.3 -11.7 47.5 26.0 23 23 A N > + 0 0 21 -6,-0.9 3,-0.7 70,-0.1 2,-0.4 -0.501 62.7 149.3 -95.5 62.8 -12.9 44.4 24.3 24 24 A Q G > S+ 0 0 121 -2,-1.1 3,-0.7 1,-0.2 70,-0.2 -0.812 72.0 18.1 -97.7 139.7 -11.2 41.6 26.3 25 25 A G G 3 S- 0 0 72 -2,-0.4 -1,-0.2 1,-0.2 -2,-0.0 0.663 115.5-102.5 74.0 16.9 -13.0 38.3 26.6 26 26 A T G < S+ 0 0 94 -3,-0.7 -1,-0.2 1,-0.1 -2,-0.1 0.797 83.3 136.9 29.6 56.0 -14.9 39.7 23.5 27 27 A A < + 0 0 27 -3,-0.7 -1,-0.1 2,-0.0 -2,-0.1 0.440 26.4 114.6-107.1 0.9 -17.9 40.5 25.7 28 28 A G - 0 0 21 -14,-0.1 2,-0.3 66,-0.0 65,-0.2 -0.152 39.8-168.5 -73.7 166.0 -18.9 43.9 24.5 29 29 A N E -A 92 0A 7 63,-1.7 63,-2.5 44,-0.1 2,-0.3 -0.971 2.5-165.4-150.8 143.7 -22.1 45.0 22.8 30 30 A V E +A 91 0A 0 -2,-0.3 11,-1.4 61,-0.2 2,-0.3 -0.988 9.4 172.5-135.6 145.6 -23.0 48.3 21.1 31 31 A S E -AB 90 40A 0 59,-2.3 59,-2.1 -2,-0.3 2,-0.3 -0.933 15.7-152.3-146.8 166.9 -26.3 49.8 19.9 32 32 A V E -AB 89 39A 8 7,-1.9 7,-1.7 -2,-0.3 2,-0.4 -0.928 33.9-100.7-137.3 158.0 -27.7 53.0 18.5 33 33 A R E + B 0 38A 83 55,-2.6 2,-0.3 -2,-0.3 5,-0.3 -0.688 48.3 173.2 -79.8 134.1 -31.2 54.5 18.8 34 34 A Y E > - B 0 37A 44 3,-2.1 3,-3.0 -2,-0.4 24,-0.1 -0.969 49.9 -45.4-150.9 127.9 -33.2 53.8 15.5 35 35 A Q T 3 S- 0 0 148 -2,-0.3 24,-0.0 1,-0.3 -1,-0.0 -0.226 122.7 -20.7 51.1-121.4 -36.8 54.4 14.6 36 36 A D T 3 S+ 0 0 99 -3,-0.1 -1,-0.3 2,-0.1 2,-0.1 0.193 139.8 6.4-102.7 16.6 -38.8 53.2 17.6 37 37 A G E < S-B 34 0A 7 -3,-3.0 -3,-2.1 22,-0.2 2,-0.3 -0.411 91.4 -77.7-155.6-122.7 -36.2 50.9 19.1 38 38 A M E -BC 33 58A 0 20,-2.5 20,-2.5 -5,-0.3 2,-0.4 -0.995 15.1-124.4-158.7 163.7 -32.6 50.2 18.3 39 39 A L E +BC 32 57A 0 -7,-1.7 -7,-1.9 -2,-0.3 2,-0.3 -0.911 41.4 173.0-106.6 133.5 -30.0 48.5 16.1 40 40 A I E -BC 31 56A 0 16,-2.5 16,-2.3 -2,-0.4 -9,-0.2 -0.945 36.1 -93.1-141.3 162.4 -27.6 46.3 18.2 41 41 A T - 0 0 8 -11,-1.4 30,-2.0 -2,-0.3 2,-0.1 -0.354 47.7-112.3 -70.9 152.6 -24.9 43.7 17.6 42 42 A P B -H 70 0B 17 0, 0.0 3,-0.5 0, 0.0 2,-0.2 -0.396 23.8-112.5 -84.9 166.4 -25.9 40.0 17.5 43 43 A T S S+ 0 0 61 26,-2.1 26,-0.2 1,-0.2 28,-0.1 -0.541 93.8 29.3 -88.9 160.5 -25.1 37.3 20.0 44 44 A G S S+ 0 0 72 -2,-0.2 -1,-0.2 1,-0.1 27,-0.0 0.705 90.2 104.9 66.8 24.0 -22.8 34.5 19.0 45 45 A I - 0 0 57 -3,-0.5 2,-0.2 9,-0.0 -1,-0.1 -0.969 66.4-130.0-140.8 117.3 -20.6 36.2 16.4 46 46 A P > - 0 0 64 0, 0.0 3,-2.7 0, 0.0 4,-0.4 -0.498 33.5-111.3 -62.6 135.9 -17.0 37.3 17.0 47 47 A Y G > S+ 0 0 70 1,-0.3 3,-1.5 2,-0.2 -32,-0.1 0.756 112.4 59.0 -39.2 -40.2 -16.6 40.9 15.9 48 48 A E G 3 S+ 0 0 118 1,-0.3 -1,-0.3 -34,-0.1 -37,-0.0 0.547 101.9 54.8 -74.5 -7.3 -14.3 40.2 12.9 49 49 A K G < S+ 0 0 137 -3,-2.7 -1,-0.3 2,-0.1 -2,-0.2 0.448 84.9 122.5-101.2 0.6 -16.9 38.0 11.3 50 50 A L < + 0 0 23 -3,-1.5 2,-0.3 -4,-0.4 -3,-0.0 -0.381 34.6 176.2 -72.2 132.6 -19.5 40.8 11.4 51 51 A T >> - 0 0 60 -2,-0.2 3,-2.6 1,-0.0 4,-0.5 -0.893 47.4-102.1-126.0 158.5 -21.2 42.1 8.3 52 52 A E G >4 S+ 0 0 73 -2,-0.3 3,-0.8 1,-0.3 -2,-0.0 0.762 119.0 64.6 -51.7 -28.8 -24.0 44.8 8.2 53 53 A S G 34 S+ 0 0 85 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.603 91.7 63.3 -73.4 -13.7 -26.6 42.0 7.7 54 54 A H G <4 S+ 0 0 67 -3,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.729 77.3 106.9 -83.4 -18.8 -25.8 40.6 11.2 55 55 A I << - 0 0 0 -3,-0.8 2,-0.4 -4,-0.5 -14,-0.2 -0.362 63.8-142.2 -66.4 131.6 -27.0 43.8 12.9 56 56 A V E -C 40 0A 0 -16,-2.3 -16,-2.5 -2,-0.1 2,-0.4 -0.802 5.5-145.6-105.6 135.6 -30.3 43.3 14.6 57 57 A F E -C 39 0A 33 -2,-0.4 8,-2.0 -18,-0.2 2,-0.4 -0.782 13.9-173.0 -96.7 134.2 -33.3 45.6 14.9 58 58 A I E -CD 38 64A 1 -20,-2.5 -20,-2.5 -2,-0.4 6,-0.2 -0.998 15.9-142.6-127.0 122.4 -35.3 45.5 18.2 59 59 A D > - 0 0 30 4,-2.4 3,-1.2 -2,-0.4 -22,-0.2 -0.069 35.6 -88.3 -74.5-176.8 -38.5 47.6 18.3 60 60 A G T 3 S+ 0 0 30 1,-0.2 -23,-0.1 2,-0.1 -1,-0.1 0.584 122.9 60.5 -70.2 -12.3 -39.9 49.5 21.3 61 61 A N T 3 S- 0 0 149 2,-0.2 -1,-0.2 0, 0.0 3,-0.1 0.472 118.6-104.2 -92.0 -4.9 -41.8 46.4 22.6 62 62 A G S < S+ 0 0 25 -3,-1.2 2,-0.5 1,-0.3 -2,-0.1 0.554 78.1 135.2 92.3 9.2 -38.7 44.2 23.0 63 63 A K - 0 0 137 3,-0.0 -4,-2.4 1,-0.0 -1,-0.3 -0.805 38.7-155.6 -94.6 127.4 -39.5 42.2 19.8 64 64 A H B -D 58 0A 73 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.556 28.8 -74.3-103.8 166.8 -36.5 41.5 17.4 65 65 A E > - 0 0 50 -8,-2.0 3,-1.6 -2,-0.2 -1,-0.1 -0.264 58.3-102.5 -56.0 137.0 -36.0 40.8 13.7 66 66 A E T 3 S+ 0 0 180 1,-0.3 -1,-0.1 -3,-0.1 3,-0.1 -0.263 103.1 17.6 -63.5 138.7 -37.0 37.3 12.8 67 67 A G T 3 S+ 0 0 68 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.529 106.0 99.5 80.7 3.8 -34.1 34.9 12.3 68 68 A K < - 0 0 53 -3,-1.6 -1,-0.2 -11,-0.1 -4,-0.1 -0.986 59.7-149.0-128.7 134.5 -31.7 37.0 14.2 69 69 A L - 0 0 109 -2,-0.4 -26,-2.1 -26,-0.2 3,-0.1 -0.875 18.1-149.7-103.1 117.8 -30.4 36.7 17.8 70 70 A P B -H 42 0B 13 0, 0.0 -27,-0.1 0, 0.0 -29,-0.1 -0.333 42.8 -62.9 -79.0 166.6 -29.6 40.1 19.4 71 71 A S > - 0 0 5 -30,-2.0 3,-1.8 1,-0.2 4,-0.2 -0.120 44.3-123.2 -45.3 143.5 -26.9 40.4 22.1 72 72 A S T 3 S+ 0 0 64 1,-0.3 3,-0.2 2,-0.1 -1,-0.2 0.656 113.1 53.4 -65.7 -14.8 -27.7 38.5 25.3 73 73 A E T >> S+ 0 0 11 1,-0.2 3,-1.2 2,-0.1 4,-0.6 0.208 70.8 116.7-106.3 19.0 -27.4 41.8 27.1 74 74 A W H X> + 0 0 42 -3,-1.8 4,-1.8 1,-0.2 3,-1.2 0.800 58.8 74.9 -56.8 -36.4 -29.8 43.9 25.0 75 75 A R H 3> S+ 0 0 74 1,-0.3 4,-1.4 -3,-0.2 -1,-0.2 0.793 96.3 46.0 -49.2 -41.5 -32.3 44.5 27.8 76 76 A F H <> S+ 0 0 2 -3,-1.2 4,-2.6 2,-0.2 -1,-0.3 0.704 104.9 61.4 -79.9 -14.2 -30.2 47.2 29.5 77 77 A H H < - 0 0 34 -4,-2.9 3,-2.2 -5,-0.2 -1,-0.3 -0.825 64.3-174.8-117.0 95.7 -31.9 58.9 29.1 85 85 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.839 85.4 59.4 -55.5 -34.9 -34.0 60.3 26.1 86 86 A D T 3 S+ 0 0 85 2,-0.0 2,-0.5 0, 0.0 -5,-0.1 0.507 82.3 104.6 -73.2 -10.2 -30.9 62.3 25.0 87 87 A A < + 0 0 1 -3,-2.2 75,-0.2 -7,-0.2 3,-0.1 -0.691 37.6 168.6 -76.3 126.7 -28.9 59.1 24.6 88 88 A N + 0 0 67 73,-2.3 -55,-2.6 -2,-0.5 2,-0.3 0.524 64.9 28.4-114.2 -10.6 -28.4 58.0 21.0 89 89 A A E -AE 32 161A 0 72,-1.6 72,-1.7 -57,-0.3 2,-0.4 -0.990 61.8-159.3-150.4 146.4 -25.8 55.3 21.3 90 90 A V E -AE 31 160A 0 -59,-2.1 -59,-2.3 -2,-0.3 2,-0.4 -0.986 2.8-169.1-132.7 137.9 -24.8 52.8 24.0 91 91 A V E -AE 30 159A 0 68,-2.5 68,-2.5 -2,-0.4 2,-0.4 -1.000 8.3-177.6-126.6 126.0 -21.4 51.0 24.5 92 92 A H E +AE 29 158A 0 -63,-2.5 -63,-1.7 -2,-0.4 2,-0.3 -0.977 11.9 153.1-126.0 142.3 -21.1 48.2 27.0 93 93 A N E - E 0 157A 1 64,-2.0 64,-2.7 -2,-0.4 -70,-0.1 -0.955 48.6-123.5-156.2 174.4 -17.9 46.2 27.8 94 94 A H + 0 0 56 -72,-0.6 62,-0.1 -2,-0.3 -71,-0.0 -0.338 41.8 176.6-117.6 42.1 -16.1 44.3 30.4 95 95 A A > - 0 0 1 1,-0.1 4,-2.4 62,-0.1 5,-0.2 -0.275 34.1-123.3 -49.5 136.5 -12.9 46.4 30.4 96 96 A V H > S+ 0 0 64 -75,-0.4 4,-2.6 1,-0.2 5,-0.2 0.881 102.3 44.0 -53.5 -53.5 -10.5 45.1 33.1 97 97 A H H > S+ 0 0 56 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.919 114.3 48.1 -64.2 -45.4 -9.9 48.2 35.2 98 98 A C H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.930 113.2 51.2 -57.3 -47.3 -13.5 49.3 35.4 99 99 A T H X S+ 0 0 24 -4,-2.4 4,-1.6 1,-0.2 55,-0.4 0.913 106.2 52.5 -59.4 -44.8 -14.4 45.7 36.3 100 100 A A H X S+ 0 0 35 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.908 110.9 47.5 -59.0 -44.2 -11.8 45.5 39.2 101 101 A V H >X>S+ 0 0 0 -4,-1.9 5,-1.2 1,-0.2 3,-0.7 0.930 111.0 52.5 -61.8 -41.9 -13.2 48.7 40.7 102 102 A S H 3<5S+ 0 0 0 -4,-2.3 52,-0.4 1,-0.3 -1,-0.2 0.738 103.2 57.9 -64.8 -25.5 -16.8 47.2 40.3 103 103 A I H 3<5S+ 0 0 90 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.803 107.3 46.5 -73.1 -29.1 -15.6 44.0 42.1 104 104 A L H <<5S- 0 0 91 -4,-1.1 -2,-0.2 -3,-0.7 -1,-0.2 0.554 109.5-135.6 -84.2 -8.5 -14.7 46.3 45.1 105 105 A N T <5 + 0 0 71 -4,-0.5 2,-0.3 1,-0.2 -3,-0.2 0.947 55.1 139.1 49.8 56.6 -18.1 47.9 44.5 106 106 A R < - 0 0 89 -5,-1.2 -1,-0.2 18,-0.1 2,-0.2 -0.894 52.3-126.0-124.3 151.6 -16.8 51.4 44.9 107 107 A S - 0 0 59 -2,-0.3 18,-0.0 -3,-0.1 43,-0.0 -0.538 32.6-108.3 -88.2 162.2 -17.7 54.4 42.9 108 108 A I B -I 123 0C 0 15,-2.7 15,-1.5 -2,-0.2 2,-0.1 -0.874 38.6-153.6 -95.1 117.7 -14.9 56.3 41.3 109 109 A P - 0 0 36 0, 0.0 2,-2.2 0, 0.0 3,-0.3 -0.284 37.7 -71.0 -83.0 178.5 -14.5 59.6 43.2 110 110 A A S S+ 0 0 5 11,-0.5 84,-2.9 84,-0.2 3,-0.1 -0.410 72.2 138.7 -74.2 74.8 -13.0 62.9 41.8 111 111 A I S S+ 0 0 35 -2,-2.2 2,-0.3 82,-0.2 -1,-0.2 0.575 74.0 27.5 -91.9 -10.1 -9.3 62.0 41.5 112 112 A H S > S- 0 0 65 -3,-0.3 3,-1.5 82,-0.1 -1,-0.2 -0.994 78.4-122.9-149.7 148.3 -9.1 63.8 38.1 113 113 A Y G > S+ 0 0 119 -2,-0.3 3,-1.7 1,-0.3 4,-0.1 0.754 103.6 72.7 -68.6 -20.2 -11.0 66.7 36.6 114 114 A M G > S+ 0 0 32 1,-0.3 3,-2.0 2,-0.2 -1,-0.3 0.590 71.6 86.9 -70.6 -8.7 -12.0 64.7 33.5 115 115 A I G X >S+ 0 0 1 -3,-1.5 3,-1.3 1,-0.3 5,-0.7 0.720 74.8 73.2 -61.0 -18.7 -14.5 62.8 35.8 116 116 A A G X 5S+ 0 0 5 -3,-1.7 3,-1.6 1,-0.3 -1,-0.3 0.669 75.5 78.7 -70.2 -16.9 -16.8 65.8 34.9 117 117 A A G < 5S+ 0 0 14 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.728 90.1 54.0 -62.2 -25.8 -17.2 64.3 31.4 118 118 A A G < 5S- 0 0 2 -3,-1.3 30,-1.9 2,-0.2 31,-0.4 0.417 128.2 -96.1 -89.1 -1.8 -19.7 61.7 32.8 119 119 A G T < 5S+ 0 0 34 -3,-1.6 2,-0.2 1,-0.3 -3,-0.2 0.343 87.0 16.4 109.8 -5.0 -21.8 64.5 34.3 120 120 A G S - 0 0 76 -2,-0.3 3,-1.3 1,-0.1 6,-0.4 -0.243 59.2 -99.1 -53.7 137.8 -28.0 38.4 37.0 131 131 A F T 3 S+ 0 0 119 1,-0.2 -1,-0.1 5,-0.1 3,-0.1 -0.193 105.3 24.1 -59.3 149.0 -27.2 39.5 33.4 132 132 A G T 3 S+ 0 0 25 1,-0.2 -1,-0.2 -3,-0.1 2,-0.2 0.487 95.6 126.3 75.4 3.6 -30.2 39.8 31.1 133 133 A T <> - 0 0 47 -3,-1.3 4,-2.1 1,-0.1 -1,-0.2 -0.637 68.7-127.1 -98.2 159.3 -32.7 40.4 33.9 134 134 A R H > S+ 0 0 171 -2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.823 111.2 58.7 -67.9 -30.9 -35.2 43.1 34.5 135 135 A E H > S+ 0 0 112 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.904 105.4 48.6 -66.5 -37.8 -33.7 43.7 38.0 136 136 A L H > S+ 0 0 4 -6,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.952 108.8 55.6 -64.4 -46.3 -30.3 44.4 36.4 137 137 A S H X S+ 0 0 11 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.862 105.7 51.6 -51.7 -40.3 -32.1 46.8 34.0 138 138 A E H X S+ 0 0 128 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.912 107.7 50.0 -64.8 -48.7 -33.6 48.7 37.0 139 139 A H H X S+ 0 0 39 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.870 112.9 48.8 -58.1 -38.4 -30.3 49.2 38.7 140 140 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 3,-0.4 0.963 109.3 50.4 -67.1 -48.9 -28.8 50.5 35.4 141 141 A A H < S+ 0 0 25 -4,-2.5 4,-0.5 1,-0.3 -2,-0.2 0.857 111.6 49.8 -57.6 -40.4 -31.7 53.0 34.7 142 142 A L H < S+ 0 0 119 -4,-2.2 3,-0.3 1,-0.2 4,-0.3 0.825 110.6 48.3 -69.0 -35.9 -31.4 54.4 38.2 143 143 A A H < S+ 0 0 14 -4,-1.4 3,-0.5 -3,-0.4 -2,-0.2 0.797 110.4 52.2 -75.4 -30.5 -27.6 54.9 38.0 144 144 A L S < S+ 0 0 0 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.542 81.7 92.6 -83.5 -5.0 -27.9 56.6 34.6 145 145 A K S S+ 0 0 156 -4,-0.5 -1,-0.2 -3,-0.3 -2,-0.1 0.904 108.3 12.9 -55.0 -41.1 -30.5 59.1 35.7 146 146 A N S S+ 0 0 103 -3,-0.5 2,-0.3 -4,-0.3 -1,-0.2 0.216 127.3 53.7-122.0 16.1 -27.7 61.6 36.6 147 147 A R - 0 0 28 -3,-0.4 -28,-0.2 -4,-0.2 -24,-0.1 -0.970 63.9-141.8-145.9 154.0 -24.6 60.2 34.9 148 148 A K S S+ 0 0 54 -30,-1.9 12,-2.9 -2,-0.3 2,-0.3 0.434 88.8 35.8 -95.5 -7.4 -23.7 59.0 31.4 149 149 A A E + G 0 159A 0 -31,-0.4 2,-0.3 10,-0.2 10,-0.2 -0.981 62.1 179.4-144.7 148.9 -21.6 56.0 32.6 150 150 A T E - G 0 158A 0 8,-1.8 8,-2.1 -2,-0.3 2,-0.2 -0.980 25.6-127.9-148.1 148.8 -21.9 53.5 35.4 151 151 A L E -fG 125 157A 0 -27,-3.0 -25,-2.5 -2,-0.3 2,-0.5 -0.590 24.2-141.0 -86.6 159.7 -19.8 50.5 36.6 152 152 A L E >> -fG 126 156A 2 4,-2.5 3,-1.8 -27,-0.2 4,-1.7 -0.995 28.3-105.5-127.8 119.5 -21.9 47.4 37.2 153 153 A Q T 34 S- 0 0 40 -27,-2.8 -24,-0.2 -2,-0.5 -50,-0.2 -0.246 97.5 -5.8 -50.0 126.5 -20.9 45.3 40.2 154 154 A H T 34 S+ 0 0 107 -52,-0.4 -1,-0.3 -55,-0.4 -51,-0.1 0.736 133.7 65.2 58.7 32.2 -18.9 42.1 39.4 155 155 A H T <4 S- 0 0 23 -3,-1.8 2,-0.3 1,-0.2 -2,-0.2 0.573 90.2-107.2-145.5 -64.8 -19.6 42.8 35.7 156 156 A G E < - G 0 152A 0 -4,-1.7 -4,-2.5 -58,-0.2 2,-0.3 -0.945 43.9 -39.0 162.5-134.4 -18.2 45.8 33.8 157 157 A L E -EG 93 151A 0 -64,-2.7 -64,-2.0 -2,-0.3 2,-0.4 -0.950 22.6-166.6-143.6 147.2 -19.3 49.2 32.3 158 158 A I E +EG 92 150A 0 -8,-2.1 -8,-1.8 -2,-0.3 2,-0.4 -0.998 16.2 176.5-128.9 124.5 -22.1 51.0 30.4 159 159 A A E -EG 91 149A 0 -68,-2.5 -68,-2.5 -2,-0.4 2,-0.3 -0.993 5.8-169.7-131.6 136.2 -21.5 54.4 28.8 160 160 A C E +E 90 0A 2 -12,-2.9 2,-0.3 -2,-0.4 -70,-0.2 -0.943 12.5 155.2-126.3 152.5 -24.0 56.3 26.7 161 161 A E E -E 89 0A 28 -72,-1.7 -73,-2.3 -2,-0.3 -72,-1.6 -0.893 55.5 -82.9-155.8-176.4 -23.7 59.5 24.6 162 162 A V S S+ 0 0 72 -2,-0.3 2,-0.3 -75,-0.2 -72,-0.1 0.589 108.6 5.4 -77.0 -13.4 -25.2 61.4 21.6 163 163 A N S > S- 0 0 63 -74,-0.1 4,-2.0 1,-0.1 -74,-0.2 -0.954 82.6 -98.1-160.7 167.0 -23.4 59.3 19.0 164 164 A L H > S+ 0 0 6 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.832 116.4 57.6 -61.1 -37.4 -21.1 56.3 18.8 165 165 A E H > S+ 0 0 145 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.921 112.0 39.7 -62.8 -46.2 -17.9 58.3 18.6 166 166 A K H > S+ 0 0 100 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.845 114.4 53.8 -71.7 -36.6 -18.5 60.1 21.9 167 167 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.926 111.5 45.6 -64.7 -42.4 -19.9 57.0 23.6 168 168 A L H X S+ 0 0 22 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.917 112.5 51.5 -64.2 -44.6 -16.8 55.1 22.7 169 169 A W H X S+ 0 0 101 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.898 110.1 48.5 -60.0 -42.7 -14.6 58.0 23.8 170 170 A L H X S+ 0 0 2 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.897 109.9 51.4 -62.7 -48.3 -16.4 58.2 27.2 171 171 A A H X S+ 0 0 1 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.906 110.8 49.1 -55.0 -42.9 -16.0 54.5 27.8 172 172 A H H X S+ 0 0 64 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.931 110.2 51.4 -66.0 -41.6 -12.3 54.7 27.1 173 173 A E H X S+ 0 0 31 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.829 107.6 51.3 -65.4 -34.6 -12.0 57.7 29.5 174 174 A V H X S+ 0 0 1 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.867 106.5 55.3 -72.5 -31.4 -13.7 55.8 32.3 175 175 A E H X S+ 0 0 16 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.946 108.7 47.8 -64.9 -44.6 -11.4 52.9 31.8 176 176 A V H X S+ 0 0 48 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.898 112.4 48.3 -61.3 -44.5 -8.4 55.4 32.3 177 177 A L H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.876 110.5 53.3 -60.6 -39.7 -10.0 56.9 35.4 178 178 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.938 109.5 46.3 -61.8 -47.4 -10.5 53.3 36.6 179 179 A Q H X S+ 0 0 91 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.896 110.8 53.9 -64.2 -37.2 -6.9 52.4 36.2 180 180 A L H X S+ 0 0 70 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.883 109.8 47.9 -63.2 -41.6 -5.8 55.7 37.9 181 181 A Y H X S+ 0 0 13 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.908 112.3 46.9 -67.8 -42.9 -7.9 54.9 40.9 182 182 A L H X S+ 0 0 38 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.907 111.3 52.9 -66.2 -42.7 -6.7 51.3 41.3 183 183 A T H < S+ 0 0 85 -4,-2.2 4,-0.5 -5,-0.2 3,-0.4 0.957 115.1 38.9 -57.2 -50.2 -3.1 52.3 40.9 184 184 A T H >X S+ 0 0 51 -4,-1.8 4,-3.1 1,-0.2 3,-1.5 0.903 109.7 61.0 -72.1 -34.6 -3.2 55.0 43.6 185 185 A L H 3< S+ 0 0 24 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.777 97.7 58.5 -61.6 -32.7 -5.5 52.9 46.0 186 186 A A T 3< S+ 0 0 89 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.724 115.4 37.0 -69.6 -21.6 -2.8 50.2 46.2 187 187 A I T <4 S+ 0 0 149 -3,-1.5 2,-0.3 -4,-0.5 -2,-0.2 0.855 130.8 10.2 -95.1 -49.8 -0.5 52.9 47.5 188 188 A T < - 0 0 71 -4,-3.1 -1,-0.3 4,-0.0 -2,-0.0 -0.998 68.6-130.4-139.7 140.5 -2.8 55.0 49.7 189 189 A D S S+ 0 0 95 -2,-0.3 2,-0.1 1,-0.1 -4,-0.0 -0.956 92.4 30.3-135.1 118.3 -6.4 54.6 51.0 190 190 A P S S- 0 0 102 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 0.403 90.4-135.5 -79.2 163.2 -8.3 56.9 50.6 191 191 A V - 0 0 14 -2,-0.1 -2,-0.1 1,-0.1 -6,-0.0 -0.657 28.8-105.0 -82.9 133.2 -7.1 58.6 47.5 192 192 A P - 0 0 102 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.295 45.8-166.4 -53.5 147.0 -6.9 62.4 47.6 193 193 A V - 0 0 83 -3,-0.0 2,-0.2 -82,-0.0 -82,-0.2 -0.886 24.0-105.4-136.5 165.9 -9.7 64.0 45.7 194 194 A L - 0 0 66 -84,-2.9 -84,-0.2 -2,-0.3 -82,-0.1 -0.640 48.8-104.0 -86.5 147.6 -10.7 67.4 44.3 195 195 A S > - 0 0 57 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.175 24.2-109.3 -70.3 165.4 -13.5 69.2 46.2 196 196 A D H > S+ 0 0 110 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.875 119.6 53.3 -61.8 -35.7 -17.1 69.4 45.1 197 197 A E H > S+ 0 0 150 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.899 107.0 51.3 -66.4 -44.0 -16.7 73.2 44.4 198 198 A E H > S+ 0 0 90 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.893 110.6 47.5 -62.1 -35.4 -13.7 72.5 42.2 199 199 A I H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.839 107.0 60.1 -72.1 -30.5 -15.7 69.9 40.2 200 200 A A H X S+ 0 0 54 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.919 105.3 47.4 -63.2 -42.2 -18.5 72.5 40.1 201 201 A V H X S+ 0 0 85 -4,-2.0 4,-3.1 2,-0.2 -1,-0.2 0.923 110.8 50.2 -64.7 -44.2 -16.2 75.0 38.3 202 202 A V H X S+ 0 0 16 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.915 110.8 50.7 -62.6 -42.0 -15.0 72.4 35.7 203 203 A L H X S+ 0 0 39 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.938 111.5 46.7 -60.0 -47.3 -18.6 71.4 35.0 204 204 A E H X S+ 0 0 112 -4,-2.1 4,-2.3 1,-0.2 3,-0.3 0.959 112.4 51.9 -60.0 -44.3 -19.6 74.9 34.4 205 205 A K H X S+ 0 0 119 -4,-3.1 4,-2.4 1,-0.3 5,-0.3 0.851 108.3 49.5 -61.3 -38.0 -16.5 75.4 32.2 206 206 A F H X S+ 0 0 64 -4,-2.5 4,-1.5 2,-0.2 -1,-0.3 0.804 109.0 53.7 -69.9 -30.7 -17.3 72.3 30.1 207 207 A K H < S+ 0 0 138 -4,-1.9 -2,-0.2 -3,-0.3 -1,-0.2 0.928 111.9 46.1 -66.2 -43.6 -20.8 73.7 29.7 208 208 A T H < S+ 0 0 102 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.1 0.978 125.9 24.9 -59.8 -60.4 -19.3 77.0 28.4 209 209 A Y H < 0 0 183 -4,-2.4 -3,-0.2 1,-0.1 -2,-0.2 0.865 360.0 360.0 -78.8 -46.3 -16.7 75.5 26.0 210 210 A G < 0 0 99 -4,-1.5 -1,-0.1 -5,-0.3 -3,-0.1 -0.306 360.0 360.0 123.2 360.0 -17.8 72.1 24.8