==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 05-MAY-11 3RV4 . COMPND 2 MOLECULE: BIOTIN CARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.Y.CHOU,L.TONG . 446 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18332.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 309 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 17.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.8 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 2 1 0 3 2 0 3 0 0 2 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 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 PARALLEL BRIDGES PER LADDER . 2 1 1 4 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 1 1 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 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 0 106 0, 0.0 2,-0.3 0, 0.0 313,-0.1 0.000 360.0 360.0 360.0 142.7 5.2 -9.9 26.6 2 2 A L - 0 0 8 311,-0.2 3,-0.1 1,-0.1 25,-0.1 -0.606 360.0-149.0 -75.4 132.4 4.0 -13.3 27.6 3 3 A D S S- 0 0 101 -2,-0.3 24,-2.3 1,-0.3 2,-0.3 0.902 76.2 -0.8 -68.5 -43.4 6.9 -15.8 27.8 4 4 A K E -a 27 0A 31 22,-0.2 72,-2.6 70,-0.1 73,-1.1 -0.994 65.1-166.7-152.7 136.2 4.9 -18.9 26.8 5 5 A I E -ab 28 77A 0 22,-2.4 24,-2.0 -2,-0.3 2,-0.5 -0.954 19.7-131.2-128.0 151.6 1.3 -19.6 25.8 6 6 A V E -ab 29 78A 0 71,-2.6 73,-2.9 -2,-0.3 2,-0.9 -0.869 17.6-145.7 -90.0 128.0 -0.9 -22.7 25.4 7 7 A I E -ab 30 79A 1 22,-3.3 2,-1.7 -2,-0.5 24,-1.3 -0.838 12.4-166.1 -94.2 98.4 -2.9 -22.6 22.1 8 8 A A + 0 0 5 71,-2.3 77,-0.3 -2,-0.9 2,-0.3 -0.395 59.8 60.7 -86.7 58.4 -6.1 -24.3 23.2 9 9 A N - 0 0 6 -2,-1.7 22,-0.3 22,-0.2 2,-0.3 -0.890 65.9-134.5-160.0-170.4 -7.4 -24.9 19.7 10 10 A R >> + 0 0 11 -2,-0.3 4,-1.1 20,-0.1 3,-0.5 -0.836 57.1 22.1-141.9 176.2 -6.6 -26.6 16.4 11 11 A G H 3> S- 0 0 1 -2,-0.3 4,-2.1 1,-0.2 3,-0.2 -0.171 114.0 -9.0 68.5-147.6 -6.7 -25.9 12.6 12 12 A E H 3> S+ 0 0 6 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.870 133.9 51.0 -59.1 -44.7 -6.5 -22.4 11.0 13 13 A I H <> S+ 0 0 1 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.878 109.6 50.4 -66.3 -36.6 -6.9 -20.4 14.2 14 14 A A H X S+ 0 0 0 -4,-1.1 4,-2.7 2,-0.2 -1,-0.2 0.912 111.6 49.3 -65.9 -42.5 -4.1 -22.4 15.9 15 15 A L H X S+ 0 0 5 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.903 112.1 48.2 -57.0 -46.3 -1.8 -21.8 12.9 16 16 A E H X S+ 0 0 13 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.888 112.8 47.9 -64.2 -40.4 -2.7 -18.0 13.0 17 17 A I H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.932 111.3 50.4 -66.5 -45.7 -2.0 -17.9 16.8 18 18 A L H X S+ 0 0 16 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.921 109.3 52.0 -56.0 -47.0 1.3 -19.7 16.4 19 19 A R H X S+ 0 0 114 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.938 110.9 47.1 -55.4 -48.9 2.3 -17.3 13.6 20 20 A A H X S+ 0 0 2 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.894 111.2 51.7 -60.7 -42.7 1.5 -14.3 15.8 21 21 A C H X>S+ 0 0 0 -4,-2.7 5,-2.9 2,-0.2 4,-0.8 0.939 107.2 53.2 -59.9 -47.5 3.5 -15.8 18.7 22 22 A K H ><5S+ 0 0 170 -4,-2.7 3,-1.0 1,-0.2 -2,-0.2 0.921 108.3 49.3 -52.2 -50.4 6.5 -16.4 16.5 23 23 A E H 3<5S+ 0 0 108 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.805 115.8 43.6 -60.9 -32.1 6.6 -12.7 15.4 24 24 A L H 3<5S- 0 0 36 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.460 114.8-116.4 -92.5 -3.1 6.4 -11.6 19.0 25 25 A G T <<5 + 0 0 52 -3,-1.0 2,-0.5 -4,-0.8 -3,-0.2 0.826 60.4 154.0 70.2 34.1 8.9 -14.2 20.2 26 26 A I < - 0 0 5 -5,-2.9 -1,-0.2 -6,-0.1 -22,-0.2 -0.850 45.4-124.3 -95.6 122.8 6.4 -16.0 22.4 27 27 A K E -a 4 0A 106 -24,-2.3 -22,-2.4 -2,-0.5 2,-0.4 -0.354 32.2-140.3 -59.9 144.2 7.1 -19.7 23.1 28 28 A T E -a 5 0A 6 -24,-0.2 19,-1.8 16,-0.1 2,-0.4 -0.880 18.6-164.9-119.4 143.4 4.2 -21.9 22.0 29 29 A V E -ac 6 47A 0 -24,-2.0 -22,-3.3 -2,-0.4 2,-0.5 -0.979 13.2-157.1-123.7 116.7 2.5 -25.0 23.5 30 30 A A E -ac 7 48A 0 17,-2.8 19,-2.8 -2,-0.4 2,-0.4 -0.806 2.7-161.8 -92.7 126.1 0.1 -27.0 21.2 31 31 A V E + c 0 49A 0 -24,-1.3 2,-0.3 -2,-0.5 -22,-0.2 -0.846 18.1 176.4 -97.7 145.8 -2.5 -29.1 22.7 32 32 A H E - c 0 50A 12 17,-1.9 19,-2.7 -2,-0.4 20,-0.6 -0.997 33.4-118.5-145.2 150.5 -4.1 -31.8 20.5 33 33 A S E > - c 0 52A 0 -2,-0.3 3,-1.3 17,-0.2 21,-0.2 -0.409 47.7-102.5 -68.6 165.0 -6.5 -34.6 20.6 34 34 A S G > S+ 0 0 39 18,-1.8 3,-0.9 1,-0.3 -1,-0.1 0.827 124.7 58.6 -62.5 -29.3 -4.9 -37.9 19.7 35 35 A A G 3 S+ 0 0 52 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.638 103.1 51.2 -70.6 -19.6 -6.4 -37.6 16.2 36 36 A D G X S+ 0 0 1 -3,-1.3 3,-1.6 1,-0.2 6,-0.2 0.110 71.5 121.3-107.5 19.4 -4.7 -34.2 15.6 37 37 A R T < S+ 0 0 149 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.750 80.5 37.3 -54.2 -32.2 -1.1 -35.5 16.5 38 38 A D T 3 S+ 0 0 118 -3,-0.3 -1,-0.3 4,-0.1 -2,-0.1 0.237 83.2 133.7-112.4 12.7 0.3 -34.6 13.1 39 39 A L X> - 0 0 3 -3,-1.6 4,-2.0 1,-0.1 3,-1.0 -0.335 68.8-111.4 -61.0 145.4 -1.5 -31.4 12.3 40 40 A K H 3> S+ 0 0 92 330,-0.4 4,-2.1 1,-0.3 5,-0.2 0.836 117.0 53.3 -45.6 -45.0 0.7 -28.5 11.0 41 41 A H H 3> S+ 0 0 1 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.851 108.3 50.4 -66.2 -33.3 0.2 -26.4 14.2 42 42 A V H <4 S+ 0 0 8 -3,-1.0 3,-0.3 -6,-0.2 -2,-0.2 0.950 110.9 49.3 -66.5 -48.4 1.4 -29.4 16.4 43 43 A L H < S+ 0 0 120 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.874 114.8 44.5 -55.6 -41.8 4.5 -29.9 14.3 44 44 A L H < S+ 0 0 110 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.702 91.4 98.3 -82.4 -21.9 5.4 -26.2 14.4 45 45 A A S < S- 0 0 12 -4,-1.3 -16,-0.1 -3,-0.3 3,-0.1 -0.311 75.9-128.3 -68.4 151.3 4.8 -25.6 18.1 46 46 A D S S+ 0 0 105 -18,-0.4 2,-0.3 1,-0.1 -17,-0.2 0.906 93.3 16.2 -63.8 -44.5 7.8 -25.6 20.5 47 47 A E E S-c 29 0A 72 -19,-1.8 -17,-2.8 2,-0.0 2,-0.4 -0.933 70.5-158.0-128.7 153.6 6.1 -28.0 22.9 48 48 A T E -c 30 0A 70 -2,-0.3 2,-0.4 -19,-0.2 -17,-0.2 -0.994 5.1-171.0-133.8 140.6 3.1 -30.3 22.4 49 49 A V E -c 31 0A 23 -19,-2.8 -17,-1.9 -2,-0.4 2,-0.5 -0.994 20.8-138.3-129.2 124.5 0.7 -32.0 24.9 50 50 A C E -c 32 0A 61 -2,-0.4 -17,-0.2 -19,-0.2 -16,-0.1 -0.729 20.2-173.4 -75.7 124.4 -1.9 -34.6 23.9 51 51 A I E - 0 0 8 -19,-2.7 -18,-0.2 -2,-0.5 14,-0.1 0.317 52.5 -51.7-109.0 5.8 -5.0 -33.6 25.9 52 52 A G E S-c 33 0A 17 -20,-0.6 -18,-1.8 13,-0.1 -1,-0.3 -0.847 71.9 -45.8 150.0 179.1 -7.3 -36.6 25.2 53 53 A P S S- 0 0 64 0, 0.0 5,-0.1 0, 0.0 -2,-0.1 -0.012 71.5 -79.6 -68.0 179.7 -8.8 -38.9 22.6 54 54 A A S S+ 0 0 10 -21,-0.2 6,-0.2 5,-0.1 5,-0.1 0.829 98.4 93.2 -55.1 -45.8 -10.5 -37.6 19.4 55 55 A P S >> S- 0 0 48 0, 0.0 3,-1.2 0, 0.0 4,-0.9 -0.297 76.0-132.5 -59.6 134.5 -14.0 -36.5 20.6 56 56 A S G >4>S+ 0 0 23 324,-0.4 5,-3.2 1,-0.3 3,-0.8 0.854 105.9 59.3 -52.3 -43.5 -14.0 -32.8 21.5 57 57 A V G 345S+ 0 0 102 1,-0.2 -1,-0.3 3,-0.2 -3,-0.1 0.844 111.1 42.7 -54.3 -33.5 -15.7 -33.5 24.9 58 58 A K G <45S+ 0 0 113 -3,-1.2 -1,-0.2 4,-0.1 -2,-0.2 0.598 134.3 9.3 -89.3 -14.8 -12.7 -35.7 25.8 59 59 A S T X<5S+ 0 0 0 -4,-0.9 3,-1.8 -3,-0.8 7,-0.2 0.564 128.7 30.4-130.3 -83.8 -10.0 -33.3 24.4 60 60 A Y T 3 5S+ 0 0 2 1,-0.3 25,-0.4 -6,-0.2 -3,-0.2 0.711 128.7 42.2 -64.9 -22.0 -10.6 -29.7 23.2 61 61 A L T 3 - 0 0 49 -3,-1.8 4,-2.1 -6,-0.4 5,-0.2 -0.639 46.1-176.0 -85.8 92.8 -11.5 -31.0 28.4 63 63 A I H > S+ 0 0 25 -2,-1.3 4,-2.4 1,-0.2 5,-0.2 0.905 77.4 47.5 -60.2 -52.1 -10.9 -28.1 30.8 64 64 A P H > S+ 0 0 78 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.861 112.5 51.0 -58.3 -38.0 -8.7 -29.9 33.5 65 65 A A H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.898 109.8 49.1 -67.0 -43.2 -6.5 -31.4 30.7 66 66 A I H X S+ 0 0 1 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.921 112.4 47.9 -61.5 -46.5 -5.9 -28.1 29.0 67 67 A I H X S+ 0 0 18 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.884 109.8 54.4 -58.6 -41.9 -5.0 -26.5 32.4 68 68 A S H X S+ 0 0 68 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.919 104.4 53.8 -57.9 -46.7 -2.7 -29.5 33.1 69 69 A A H X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.884 109.3 49.4 -55.3 -42.9 -0.9 -28.8 29.8 70 70 A A H X>S+ 0 0 0 -4,-1.6 5,-2.2 2,-0.2 4,-0.8 0.887 113.2 46.2 -62.3 -42.0 -0.3 -25.2 30.9 71 71 A E H <5S+ 0 0 119 -4,-2.1 3,-0.5 3,-0.2 -2,-0.2 0.930 111.7 48.7 -71.6 -43.1 1.0 -26.3 34.3 72 72 A I H <5S+ 0 0 129 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.780 117.8 41.5 -69.6 -24.4 3.4 -29.0 33.0 73 73 A T H <5S- 0 0 12 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.556 107.9-124.8 -95.8 -10.6 4.9 -26.7 30.4 74 74 A G T <5 + 0 0 41 -4,-0.8 -3,-0.2 -3,-0.5 -4,-0.1 0.844 46.7 171.7 67.2 36.3 5.0 -23.7 32.7 75 75 A A < - 0 0 6 -5,-2.2 -70,-0.2 -6,-0.2 -1,-0.1 -0.319 29.8-153.4 -71.1 158.0 3.0 -21.5 30.4 76 76 A V S S+ 0 0 55 -72,-2.6 25,-2.6 1,-0.2 2,-0.3 0.575 72.7 23.2-107.0 -14.8 1.7 -18.1 31.6 77 77 A A E -bd 5 101A 0 -73,-1.1 -71,-2.6 23,-0.2 2,-0.4 -0.976 59.9-143.4-150.4 159.2 -1.3 -17.7 29.3 78 78 A I E -bd 6 102A 0 23,-2.5 25,-2.5 -2,-0.3 -71,-0.2 -0.994 8.1-155.6-129.4 125.7 -3.9 -19.7 27.3 79 79 A H E -b 7 0A 0 -73,-2.9 -71,-2.3 -2,-0.4 25,-0.1 -0.905 3.2-168.0-100.5 117.3 -5.4 -18.6 24.0 80 80 A P - 0 0 6 0, 0.0 6,-0.3 0, 0.0 5,-0.2 0.551 18.2-160.7 -80.4 -8.0 -8.8 -20.3 23.4 81 81 A G - 0 0 1 22,-0.2 212,-0.5 -68,-0.1 2,-0.3 -0.414 45.4 -46.6 62.3-136.0 -9.1 -19.3 19.7 82 82 A Y S S+ 0 0 27 210,-0.1 3,-0.1 -2,-0.1 212,-0.1 -0.882 106.8 16.6-126.5 161.4 -12.7 -19.4 18.6 83 83 A G S > S+ 0 0 37 -2,-0.3 3,-2.5 1,-0.2 4,-0.2 -0.285 100.0 57.6 73.4-162.8 -15.3 -22.1 19.0 84 84 A F T 3 S- 0 0 63 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 -0.145 127.6 -16.1 47.5-130.9 -14.7 -24.7 21.7 85 85 A L T > S+ 0 0 9 -25,-0.4 3,-2.0 -77,-0.3 -1,-0.3 0.254 102.1 109.2 -88.2 8.3 -14.3 -23.1 25.1 86 86 A S T < S+ 0 0 2 -3,-2.5 -1,-0.2 -6,-0.3 -2,-0.1 0.765 91.0 32.6 -62.5 -27.8 -13.6 -19.5 23.9 87 87 A E T 3 S+ 0 0 72 -3,-0.4 2,-0.8 -4,-0.2 -1,-0.3 -0.053 91.3 115.8-116.6 30.9 -17.0 -18.3 25.2 88 88 A N <> - 0 0 55 -3,-2.0 4,-2.3 1,-0.2 3,-0.3 -0.876 47.3-166.4-100.5 103.4 -17.1 -20.7 28.2 89 89 A A H > S+ 0 0 11 -2,-0.8 4,-2.7 1,-0.2 5,-0.2 0.820 87.5 58.2 -58.3 -38.0 -17.0 -18.6 31.4 90 90 A N H > S+ 0 0 89 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.909 107.6 47.5 -57.1 -45.9 -16.2 -21.7 33.5 91 91 A F H > S+ 0 0 0 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.966 110.8 51.9 -59.9 -52.2 -13.1 -22.3 31.4 92 92 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 -7,-0.2 -2,-0.2 0.901 112.7 43.8 -51.0 -50.0 -12.1 -18.6 31.7 93 93 A E H X S+ 0 0 46 -4,-2.7 4,-3.1 2,-0.2 -1,-0.2 0.905 112.9 51.1 -68.8 -38.6 -12.4 -18.5 35.5 94 94 A Q H X S+ 0 0 88 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.923 109.6 51.7 -60.0 -45.5 -10.6 -21.9 36.0 95 95 A V H <>S+ 0 0 0 -4,-2.8 5,-2.2 2,-0.2 3,-0.4 0.953 116.4 39.3 -53.9 -53.0 -7.7 -20.7 33.8 96 96 A E H ><5S+ 0 0 70 -4,-2.1 3,-1.3 1,-0.2 -2,-0.2 0.868 113.6 53.6 -71.6 -34.5 -7.3 -17.5 35.9 97 97 A R H 3<5S+ 0 0 190 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.717 104.9 56.5 -69.6 -21.3 -8.0 -19.2 39.2 98 98 A S T 3<5S- 0 0 49 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.378 129.2 -97.6 -89.3 1.6 -5.2 -21.7 38.4 99 99 A G T < 5S+ 0 0 65 -3,-1.3 2,-0.3 1,-0.3 -3,-0.2 0.718 83.7 122.1 91.5 25.2 -2.8 -18.8 37.9 100 100 A F < - 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0 0 13 -4,-1.6 2,-0.5 -5,-0.1 -50,-0.2 -0.399 57.5-165.6 -65.0 127.3 -7.8 -24.1 -5.7 410 410 A I E +R 358 0F 64 -52,-2.8 -52,-2.3 -2,-0.2 2,-0.3 -0.975 18.7 160.5-119.7 119.8 -7.8 -27.9 -6.1 411 411 A I E +R 357 0F 14 -2,-0.5 2,-0.3 -54,-0.2 -54,-0.2 -0.836 14.5 173.0-137.8 100.9 -9.4 -30.1 -3.4 412 412 A D E +R 356 0F 69 -56,-2.7 -57,-1.9 -2,-0.3 -56,-1.0 -0.771 51.8 41.1-108.1 151.6 -10.2 -33.7 -4.6 413 413 A G S S+ 0 0 50 -2,-0.3 -60,-0.4 -59,-0.3 2,-0.3 0.142 104.9 59.2 106.8 -17.3 -11.5 -36.7 -2.8 414 414 A I S S- 0 0 19 -3,-0.2 2,-0.3 -62,-0.1 -1,-0.2 -0.953 89.0 -99.7-140.2 155.3 -14.0 -35.0 -0.5 415 415 A K + 0 0 150 -2,-0.3 2,-0.3 -3,-0.1 -65,-0.2 -0.601 47.4 173.5 -79.7 133.9 -17.1 -32.8 -1.1 416 416 A T - 0 0 45 -2,-0.3 3,-0.3 -75,-0.2 -75,-0.2 -0.861 43.1-121.7-130.6 172.8 -16.5 -29.1 -0.7 417 417 A N S > S+ 0 0 20 -77,-1.1 4,-2.6 -2,-0.3 5,-0.2 0.077 77.2 112.7-100.0 20.8 -18.4 -25.8 -1.3 418 418 A V H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.927 77.0 49.9 -58.0 -47.5 -15.8 -24.5 -3.8 419 419 A D H > S+ 0 0 92 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.904 111.1 49.6 -59.1 -43.4 -18.3 -24.7 -6.6 420 420 A L H > S+ 0 0 42 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.924 109.1 52.4 -58.5 -46.5 -20.9 -22.8 -4.6 421 421 A Q H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.904 108.2 50.3 -58.4 -43.5 -18.3 -20.1 -3.7 422 422 A I H X S+ 0 0 25 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.910 110.7 50.3 -59.7 -44.6 -17.4 -19.6 -7.4 423 423 A R H < S+ 0 0 146 -4,-2.0 4,-0.3 2,-0.2 -2,-0.2 0.855 108.6 51.8 -62.6 -37.6 -21.1 -19.2 -8.2 424 424 A I H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.932 109.3 49.8 -63.8 -44.7 -21.5 -16.6 -5.4 425 425 A M H 3< S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.826 112.7 48.1 -62.7 -32.6 -18.6 -14.6 -6.9 426 426 A N T 3< S+ 0 0 86 -4,-1.7 2,-0.5 -5,-0.2 -1,-0.3 0.414 84.8 116.8 -86.3 -0.9 -20.2 -14.8 -10.3 427 427 A D <> - 0 0 9 -3,-1.4 4,-2.7 -4,-0.3 3,-0.2 -0.582 58.7-150.1 -74.1 116.4 -23.6 -13.7 -8.9 428 428 A E H > S+ 0 0 135 -2,-0.5 4,-2.0 1,-0.2 5,-0.2 0.851 97.3 52.5 -54.7 -39.3 -24.7 -10.4 -10.5 429 429 A N H > S+ 0 0 85 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.894 111.5 45.4 -66.2 -41.6 -26.6 -9.4 -7.4 430 430 A F H 4 S+ 0 0 3 -3,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.881 109.3 56.8 -62.7 -42.6 -23.6 -10.1 -5.1 431 431 A Q H < S+ 0 0 70 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.883 106.6 48.2 -62.2 -37.6 -21.4 -8.2 -7.6 432 432 A H H < S- 0 0 164 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.822 111.1-148.7 -67.8 -29.8 -23.6 -5.1 -7.2 433 433 A G < + 0 0 21 -4,-1.2 -2,-0.1 -5,-0.2 -1,-0.1 0.057 64.5 84.3 86.0 165.6 -23.3 -5.7 -3.5 434 434 A G + 0 0 35 1,-0.2 -4,-0.1 -4,-0.1 2,-0.1 0.637 52.6 162.1 74.4 17.8 -25.6 -5.0 -0.5 435 435 A T - 0 0 23 -6,-0.2 -1,-0.2 -5,-0.1 -204,-0.1 -0.421 36.5-118.0 -65.0 145.0 -27.6 -8.2 -0.8 436 436 A N > - 0 0 29 -228,-0.1 3,-1.2 -2,-0.1 4,-0.4 -0.079 26.3 -93.0 -82.4-179.3 -29.4 -9.1 2.5 437 437 A I T 3 S+ 0 0 27 -230,-2.2 4,-0.3 1,-0.2 -204,-0.3 0.625 121.3 55.3 -70.8 -13.4 -29.2 -12.1 4.9 438 438 A H T 3> S+ 0 0 25 -231,-0.2 4,-1.5 1,-0.1 -1,-0.2 0.511 83.5 88.6 -97.6 -6.5 -32.0 -13.9 3.1 439 439 A Y H <> S+ 0 0 46 -3,-1.2 4,-2.7 1,-0.2 5,-0.2 0.915 83.1 48.8 -63.8 -52.0 -30.5 -13.9 -0.4 440 440 A L H > S+ 0 0 1 -4,-0.4 4,-2.5 -209,-0.3 -1,-0.2 0.913 109.9 51.6 -60.4 -44.2 -28.4 -17.1 -0.5 441 441 A E H >>S+ 0 0 61 -208,-0.4 5,-2.9 -4,-0.3 4,-0.6 0.908 113.3 45.3 -59.1 -40.8 -31.1 -19.3 0.8 442 442 A K H ><5S+ 0 0 160 -4,-1.5 3,-0.7 3,-0.2 -2,-0.2 0.913 111.9 51.9 -68.5 -42.8 -33.5 -18.1 -1.8 443 443 A K H 3<5S+ 0 0 87 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.884 114.4 43.5 -54.8 -43.8 -30.9 -18.4 -4.6 444 444 A L H 3<5S- 0 0 73 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.503 113.0-119.2 -85.4 -6.9 -30.2 -22.0 -3.5 445 445 A G T <<5 0 0 70 -3,-0.7 -3,-0.2 -4,-0.6 -4,-0.1 0.889 360.0 360.0 70.6 41.4 -33.9 -22.8 -3.1 446 446 A L < 0 0 96 -5,-2.9 -4,-0.2 -6,-0.1 -5,-0.1 0.812 360.0 360.0 -98.0 360.0 -33.7 -23.7 0.5