==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 19-DEC-08 2W6Z . COMPND 2 MOLECULE: BIOTIN CARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR I.MOCHALKIN,J.R.MILLER . 891 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33722.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 618 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 155 17.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 66 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 251 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.6 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 4 1 2 5 4 1 5 0 0 4 1 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 2 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 PARALLEL BRIDGES PER LADDER . 5 3 2 4 5 2 2 2 1 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 . 5 0 2 2 0 0 0 2 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 92 0, 0.0 2,-0.1 0, 0.0 313,-0.1 0.000 360.0 360.0 360.0 149.2 44.0 -27.5 26.1 2 2 A L - 0 0 14 311,-0.2 25,-0.2 1,-0.1 3,-0.1 -0.380 360.0-147.5 -68.0 133.9 43.1 -26.3 22.6 3 3 A D S S- 0 0 81 1,-0.3 24,-2.5 23,-0.2 2,-0.3 0.902 73.6 -6.4 -68.5 -43.7 45.9 -24.3 21.0 4 4 A K E -a 27 0A 30 22,-0.2 72,-3.1 70,-0.1 73,-0.8 -0.970 64.6-166.8-159.1 133.8 43.7 -21.9 18.9 5 5 A I E -ab 28 77A 0 22,-2.4 24,-2.2 -2,-0.3 2,-0.5 -0.944 21.4-126.7-130.5 152.6 40.0 -21.6 18.1 6 6 A V E -ab 29 78A 0 71,-2.5 73,-2.7 -2,-0.3 2,-0.9 -0.836 18.8-144.9 -90.5 127.1 37.7 -19.8 15.6 7 7 A I E -ab 30 79A 0 22,-2.7 2,-1.6 -2,-0.5 24,-0.9 -0.846 14.6-164.8 -90.9 100.8 35.0 -17.8 17.3 8 8 A A + 0 0 5 71,-2.6 77,-0.3 -2,-0.9 2,-0.3 -0.452 59.1 56.1 -92.8 62.9 32.2 -18.3 14.8 9 9 A N - 0 0 3 -2,-1.6 2,-0.2 22,-0.3 22,-0.1 -0.884 65.8-134.7-167.3-166.3 29.9 -15.6 16.0 10 10 A R >> + 0 0 19 -2,-0.3 4,-1.5 22,-0.1 3,-0.6 -0.820 53.7 29.5-152.0-179.6 29.7 -11.9 16.9 11 11 A G H 3> S- 0 0 3 -2,-0.2 4,-1.7 1,-0.2 30,-0.2 -0.094 113.9 -13.6 59.8-144.7 28.5 -9.3 19.4 12 12 A E H 3> S+ 0 0 4 372,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.868 135.2 52.1 -66.5 -38.2 28.3 -10.1 23.1 13 13 A I H <> S+ 0 0 1 -3,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.864 106.1 53.8 -70.5 -34.0 28.7 -13.8 22.9 14 14 A A H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.931 111.4 46.8 -62.6 -44.2 31.8 -13.6 20.8 15 15 A L H X S+ 0 0 1 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.893 110.1 53.5 -60.9 -44.0 33.3 -11.3 23.5 16 16 A R H X S+ 0 0 3 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.912 111.8 44.6 -55.2 -48.4 32.2 -13.8 26.2 17 17 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.899 109.3 56.2 -65.8 -42.0 33.9 -16.6 24.4 18 18 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.907 106.8 49.8 -57.5 -44.3 37.1 -14.5 23.8 19 19 A R H X S+ 0 0 9 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.907 110.2 50.0 -61.7 -42.5 37.5 -13.8 27.5 20 20 A A H X S+ 0 0 0 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.919 111.2 49.5 -61.6 -43.5 37.1 -17.5 28.4 21 21 A C H >X>S+ 0 0 0 -4,-2.4 5,-2.7 2,-0.2 4,-0.7 0.935 109.7 50.7 -59.4 -48.7 39.7 -18.4 25.8 22 22 A K H ><5S+ 0 0 40 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.902 107.2 54.1 -59.6 -41.6 42.1 -15.8 27.2 23 23 A E H 3<5S+ 0 0 26 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.806 114.2 42.0 -58.6 -33.9 41.6 -17.2 30.7 24 24 A L H <<5S- 0 0 35 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.449 115.8-114.8 -93.2 -3.1 42.6 -20.6 29.4 25 25 A G T <<5 + 0 0 59 -3,-0.9 2,-0.4 -4,-0.7 -3,-0.2 0.723 62.7 152.7 74.6 23.2 45.5 -19.3 27.2 26 26 A I < - 0 0 4 -5,-2.7 -1,-0.3 -6,-0.2 -22,-0.2 -0.726 47.0-120.4 -86.4 129.5 43.7 -20.4 24.0 27 27 A K E -a 4 0A 90 -24,-2.5 -22,-2.4 -2,-0.4 2,-0.4 -0.444 30.1-136.6 -69.6 142.7 44.6 -18.3 20.9 28 28 A T E -a 5 0A 0 -24,-0.2 19,-1.9 -2,-0.1 2,-0.5 -0.858 18.5-168.9-110.9 137.7 41.7 -16.6 19.3 29 29 A V E -ac 6 47A 0 -24,-2.2 -22,-2.7 -2,-0.4 2,-0.8 -0.986 13.5-157.7-119.3 116.2 40.6 -16.2 15.7 30 30 A A E -ac 7 48A 0 17,-2.8 19,-2.2 -2,-0.5 2,-0.4 -0.847 5.1-166.5 -99.4 105.0 37.8 -13.7 15.2 31 31 A V E + c 0 49A 0 -24,-0.9 -22,-0.3 -2,-0.8 2,-0.3 -0.764 22.6 165.3 -85.6 138.3 36.0 -14.3 11.9 32 32 A H E - c 0 50A 7 17,-2.1 19,-2.4 -2,-0.4 20,-0.7 -0.993 36.4-108.5-153.8 156.6 33.8 -11.3 11.1 33 33 A S E > - c 0 52A 0 -2,-0.3 3,-1.3 17,-0.2 21,-0.1 -0.314 42.7-103.8 -77.7 168.9 31.7 -9.6 8.4 34 34 A S G > S+ 0 0 49 18,-1.8 3,-0.7 1,-0.3 -1,-0.1 0.769 123.2 57.3 -67.0 -24.2 32.8 -6.4 6.8 35 35 A A G 3 S+ 0 0 40 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.632 103.9 54.6 -77.1 -13.4 30.2 -4.5 8.9 36 36 A D G X + 0 0 1 -3,-1.3 3,-1.5 1,-0.2 -1,-0.2 0.026 63.7 117.6-113.8 26.1 31.8 -5.9 12.1 37 37 A R T < S+ 0 0 131 -3,-0.7 -1,-0.2 1,-0.3 -2,-0.1 0.805 81.2 47.7 -62.7 -30.0 35.5 -4.8 11.8 38 38 A D T 3 S+ 0 0 104 -3,-0.3 -1,-0.3 338,-0.1 2,-0.1 0.096 77.2 135.1-103.9 19.9 35.2 -2.6 14.9 39 39 A L <> - 0 0 0 -3,-1.5 4,-2.1 1,-0.1 3,-0.4 -0.470 64.2-121.6 -61.8 139.4 33.5 -5.2 17.2 40 40 A K H > S+ 0 0 16 330,-0.4 4,-1.3 1,-0.2 5,-0.1 0.900 111.9 48.3 -51.2 -47.4 35.2 -5.2 20.6 41 41 A H H > S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.839 108.6 54.1 -68.3 -31.0 36.2 -8.9 20.5 42 42 A V H >4 S+ 0 0 10 -3,-0.4 3,-0.6 1,-0.2 -1,-0.2 0.920 108.8 49.3 -64.3 -43.5 37.6 -8.4 16.9 43 43 A L H 3< S+ 0 0 106 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.770 116.1 43.4 -65.7 -27.2 39.8 -5.6 18.2 44 44 A L H 3< S+ 0 0 45 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.550 91.9 109.1 -94.3 -9.6 40.9 -7.8 21.1 45 45 A A S << S- 0 0 15 -4,-0.9 3,-0.1 -3,-0.6 -16,-0.1 -0.275 70.2-131.6 -76.2 155.1 41.5 -11.1 19.1 46 46 A D S S+ 0 0 102 -18,-0.4 2,-0.3 1,-0.2 -17,-0.2 0.894 93.0 10.7 -70.3 -43.0 44.9 -12.6 18.4 47 47 A E E S-c 29 0A 73 -19,-1.9 -17,-2.8 2,-0.0 2,-0.3 -0.976 70.6-158.5-134.4 151.1 44.1 -13.0 14.7 48 48 A T E -c 30 0A 72 -2,-0.3 2,-0.4 -19,-0.2 -17,-0.2 -0.965 6.0-172.3-131.1 145.5 41.2 -11.7 12.5 49 49 A V E -c 31 0A 36 -19,-2.2 -17,-2.1 -2,-0.3 2,-0.7 -0.975 20.5-140.7-136.8 121.0 39.7 -12.9 9.2 50 50 A C E -c 32 0A 50 -2,-0.4 -17,-0.2 -19,-0.2 -19,-0.1 -0.751 20.3-173.9 -78.8 117.7 37.0 -11.0 7.3 51 51 A I E - 0 0 14 -19,-2.4 -18,-0.2 -2,-0.7 -1,-0.1 0.505 51.1 -53.6 -97.7 -5.3 34.8 -13.8 6.1 52 52 A G E S-c 33 0A 16 -20,-0.7 -18,-1.8 13,-0.0 -1,-0.3 -0.943 72.1 -39.0 158.6-177.0 32.5 -11.8 3.9 53 53 A P - 0 0 63 0, 0.0 5,-0.1 0, 0.0 -2,-0.1 -0.057 68.8 -85.3 -69.3 176.9 30.0 -8.9 3.4 54 54 A A S S+ 0 0 10 -21,-0.1 6,-0.2 5,-0.1 5,-0.1 0.849 97.1 92.5 -56.5 -47.2 27.5 -7.7 6.0 55 55 A P S >> S- 0 0 63 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.260 78.4-130.3 -57.7 133.4 24.5 -10.0 5.3 56 56 A S G >4>S+ 0 0 25 324,-0.4 5,-2.8 1,-0.3 3,-1.2 0.820 102.9 66.2 -57.1 -35.2 24.7 -13.2 7.4 57 57 A V G 345S+ 0 0 97 1,-0.3 -1,-0.3 3,-0.2 -3,-0.1 0.819 109.6 38.5 -55.5 -30.5 24.2 -15.5 4.5 58 58 A K G <45S+ 0 0 110 -3,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.455 134.0 17.3-101.7 -2.1 27.6 -14.4 3.1 59 59 A S T X<5S+ 0 0 0 -3,-1.2 3,-1.9 -4,-0.6 7,-0.2 0.434 128.2 24.3-128.4 -88.2 29.4 -14.2 6.5 60 60 A Y T 3 5S+ 0 0 2 1,-0.3 25,-0.3 -6,-0.2 -3,-0.2 0.619 131.5 40.2 -72.3 -12.6 28.2 -15.8 9.8 61 61 A L T 3 - 0 0 29 -3,-1.9 4,-1.9 -6,-0.4 5,-0.2 -0.609 45.0-176.7 -83.6 89.2 28.9 -19.0 5.2 63 63 A I H > S+ 0 0 26 -2,-1.5 4,-2.4 1,-0.2 5,-0.2 0.902 78.5 48.1 -56.7 -52.4 30.1 -22.5 6.1 64 64 A P H > S+ 0 0 86 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.896 111.5 51.3 -55.8 -42.6 32.9 -22.7 3.5 65 65 A A H > S+ 0 0 20 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.852 111.1 47.3 -63.8 -37.2 34.3 -19.2 4.5 66 66 A I H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.902 113.1 46.9 -73.4 -42.3 34.4 -20.2 8.2 67 67 A I H X S+ 0 0 13 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.901 111.4 53.0 -65.7 -39.3 36.1 -23.6 7.6 68 68 A S H X S+ 0 0 67 -4,-2.5 4,-2.9 -5,-0.2 -2,-0.2 0.900 106.8 52.3 -60.9 -42.4 38.6 -21.8 5.3 69 69 A A H X S+ 0 0 2 -4,-1.8 4,-1.5 2,-0.2 6,-0.3 0.888 109.9 48.7 -59.7 -42.9 39.4 -19.3 8.1 70 70 A A H X>S+ 0 0 0 -4,-1.8 5,-2.0 2,-0.2 4,-0.6 0.907 114.1 46.9 -62.3 -44.2 40.0 -22.2 10.5 71 71 A E H ><5S+ 0 0 118 -4,-2.5 3,-0.9 1,-0.2 -2,-0.2 0.940 112.0 48.8 -61.5 -48.2 42.3 -23.9 7.9 72 72 A I H 3<5S+ 0 0 143 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.782 114.9 43.3 -69.4 -29.1 44.3 -20.7 7.0 73 73 A T H 3<5S- 0 0 16 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.493 108.9-117.8 -93.2 -5.8 45.0 -19.7 10.6 74 74 A G T <<5 + 0 0 45 -3,-0.9 -3,-0.2 -4,-0.6 -4,-0.1 0.814 54.4 166.8 68.4 31.5 45.9 -23.2 11.8 75 75 A A < - 0 0 5 -5,-2.0 -70,-0.2 -6,-0.3 -1,-0.2 -0.345 28.6-157.2 -69.9 158.9 43.0 -23.2 14.3 76 76 A V + 0 0 51 -72,-3.1 25,-2.4 1,-0.2 2,-0.3 0.531 67.3 21.9-115.5 -10.5 42.0 -26.6 15.8 77 77 A A E -bd 5 101A 0 -73,-0.8 -71,-2.5 23,-0.3 2,-0.4 -0.968 60.3-138.7-155.1 160.6 38.4 -26.0 16.9 78 78 A I E -bd 6 102A 0 23,-2.6 25,-2.5 -2,-0.3 -71,-0.2 -0.997 7.0-158.0-130.3 124.9 35.3 -23.8 16.2 79 79 A H E -b 7 0A 1 -73,-2.7 -71,-2.6 -2,-0.4 25,-0.1 -0.928 4.5-168.9-100.3 118.6 32.9 -22.4 18.8 80 80 A P - 0 0 5 0, 0.0 6,-0.4 0, 0.0 5,-0.3 0.493 15.9-160.6 -87.2 -2.9 29.6 -21.5 17.2 81 81 A G - 0 0 1 22,-0.2 212,-0.4 4,-0.1 2,-0.3 -0.381 46.4 -43.4 60.6-136.6 28.1 -19.6 20.2 82 82 A Y S S+ 0 0 33 210,-0.1 3,-0.2 -2,-0.1 212,-0.1 -0.831 108.0 12.3-123.0 166.8 24.3 -19.4 19.9 83 83 A G S > S+ 0 0 39 -2,-0.3 3,-2.6 1,-0.2 4,-0.2 -0.282 101.2 60.6 61.1-155.6 22.1 -18.7 16.9 84 84 A F T 3 S- 0 0 66 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 -0.166 127.9 -16.7 40.7-109.8 23.7 -18.7 13.4 85 85 A L T > S+ 0 0 9 -77,-0.3 3,-1.8 -5,-0.3 -1,-0.3 0.275 102.8 108.7-107.6 10.5 25.1 -22.2 12.8 86 86 A S T < S+ 0 0 2 -3,-2.6 -1,-0.2 -6,-0.4 -2,-0.1 0.757 90.0 33.7 -65.7 -26.5 25.1 -23.5 16.4 87 87 A E T 3 S+ 0 0 60 -3,-0.3 2,-0.9 -4,-0.2 -1,-0.3 0.073 88.8 117.4-111.7 20.7 22.2 -26.0 15.9 88 88 A N <> - 0 0 56 -3,-1.8 4,-2.0 1,-0.2 5,-0.2 -0.805 43.9-171.1 -93.2 103.6 23.2 -26.7 12.3 89 89 A A H > S+ 0 0 12 -2,-0.9 4,-2.5 1,-0.2 -1,-0.2 0.870 85.5 55.7 -65.1 -37.7 24.0 -30.5 12.2 90 90 A N H > S+ 0 0 90 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.898 107.7 49.7 -61.0 -40.8 25.3 -30.3 8.7 91 91 A F H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.936 111.3 48.0 -61.8 -49.0 27.8 -27.6 9.8 92 92 A A H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.888 111.7 51.0 -57.7 -42.7 29.0 -29.6 12.8 93 93 A E H X S+ 0 0 76 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.912 111.4 46.8 -63.6 -44.4 29.4 -32.7 10.5 94 94 A Q H X S+ 0 0 64 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.843 109.5 54.9 -66.6 -37.4 31.4 -30.7 8.0 95 95 A V H <>S+ 0 0 0 -4,-2.4 5,-2.3 2,-0.2 4,-0.3 0.962 114.1 39.2 -59.3 -52.9 33.6 -29.2 10.8 96 96 A E H ><5S+ 0 0 76 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.873 114.2 54.6 -68.5 -37.1 34.6 -32.6 12.1 97 97 A R H 3<5S+ 0 0 161 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.828 106.2 53.3 -60.4 -35.3 34.9 -34.1 8.6 98 98 A S T 3<5S- 0 0 49 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.516 126.5-104.7 -80.2 -8.0 37.3 -31.3 7.8 99 99 A G T < 5S+ 0 0 64 -3,-1.0 2,-0.3 1,-0.4 -3,-0.2 0.480 80.2 121.2 102.6 7.3 39.3 -32.3 10.9 100 100 A F < - 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0 0 13 -4,-1.4 2,-0.5 -5,-0.1 -50,-0.2 -0.489 53.0-171.0 -67.0 122.4 40.3 -1.1 30.7 857 410 B I E +K 805 0M 47 -52,-2.3 -52,-2.0 -2,-0.3 2,-0.3 -0.981 17.0 161.2-117.2 124.2 40.7 2.1 28.7 858 411 B I E +K 804 0M 15 -2,-0.5 2,-0.3 -54,-0.2 -54,-0.2 -0.866 16.3 176.9-138.7 102.7 41.4 5.5 30.4 859 412 B D E +K 803 0M 59 -56,-2.4 -57,-1.5 -2,-0.3 -56,-0.8 -0.758 53.6 45.2-107.1 154.0 42.7 8.1 27.9 860 413 B G S S+ 0 0 55 -2,-0.3 2,-0.3 -59,-0.2 -60,-0.2 0.100 109.0 51.0 105.9 -23.4 43.6 11.7 28.5 861 414 B I S S- 0 0 15 -3,-0.2 2,-0.3 -62,-0.1 -1,-0.2 -0.932 87.7-106.2-135.0 159.9 45.4 11.2 31.8 862 415 B K - 0 0 112 -2,-0.3 2,-0.3 -64,-0.1 -65,-0.2 -0.630 39.5-177.1 -81.5 147.5 48.2 8.9 32.8 863 416 B T - 0 0 20 -75,-0.3 3,-0.4 -2,-0.3 -75,-0.2 -0.901 38.3-115.8-134.8 171.9 47.3 5.9 35.1 864 417 B N S > S+ 0 0 1 -77,-1.4 4,-2.3 -2,-0.3 3,-0.4 0.180 79.4 112.1 -90.8 17.1 49.1 3.1 36.8 865 418 B V H > S+ 0 0 13 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.900 75.6 53.9 -59.3 -40.2 47.4 0.4 34.7 866 419 B D H > S+ 0 0 99 -3,-0.4 4,-1.7 2,-0.2 -1,-0.3 0.838 107.9 50.7 -64.2 -32.5 50.7 -0.5 33.0 867 420 B L H > S+ 0 0 2 -3,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.945 109.2 50.4 -66.3 -48.1 52.3 -1.0 36.5 868 421 B Q H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.850 107.7 53.8 -58.1 -36.4 49.4 -3.3 37.5 869 422 B I H X S+ 0 0 43 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.929 109.4 48.8 -61.2 -45.9 49.9 -5.3 34.3 870 423 B R H < S+ 0 0 82 -4,-1.7 4,-0.3 1,-0.2 -2,-0.2 0.880 111.0 50.1 -60.1 -41.6 53.6 -5.7 35.3 871 424 B I H >< S+ 0 0 1 -4,-2.4 3,-1.3 1,-0.2 -2,-0.2 0.918 108.7 50.6 -66.3 -42.8 52.6 -6.8 38.8 872 425 B M H 3< S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.794 111.9 49.7 -65.9 -26.2 50.1 -9.4 37.6 873 426 B N T 3< S+ 0 0 88 -4,-1.4 2,-0.3 -5,-0.2 -1,-0.3 0.444 84.5 116.6 -87.6 -2.9 52.9 -10.8 35.3 874 427 B D <> - 0 0 9 -3,-1.3 4,-2.6 -4,-0.3 5,-0.2 -0.516 60.9-146.0 -75.2 129.0 55.5 -10.9 38.1 875 428 B E H > S+ 0 0 157 -2,-0.3 4,-1.9 1,-0.2 -1,-0.1 0.854 98.2 50.8 -65.1 -36.7 56.6 -14.5 38.8 876 429 B N H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.879 111.9 47.3 -70.4 -38.2 57.0 -14.0 42.5 877 430 B F H 4 S+ 0 0 4 2,-0.2 -2,-0.2 -6,-0.2 -1,-0.2 0.932 110.0 53.4 -64.5 -44.5 53.5 -12.5 42.8 878 431 B Q H < S+ 0 0 62 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.875 110.5 47.4 -59.5 -36.7 52.1 -15.4 40.8 879 432 B H H < S- 0 0 165 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.887 112.6-142.8 -65.6 -41.4 53.8 -17.7 43.3 880 433 B G < + 0 0 7 -4,-2.0 -2,-0.1 -5,-0.1 -1,-0.1 -0.025 65.2 79.2 96.6 159.4 52.3 -15.6 46.1 881 434 B G + 0 0 34 1,-0.2 -4,-0.1 -4,-0.1 -3,-0.0 0.682 51.1 165.6 83.9 21.5 53.5 -14.5 49.5 882 435 B T - 0 0 22 -6,-0.2 -1,-0.2 -5,-0.1 -204,-0.2 -0.355 33.8-116.9 -68.1 150.7 55.8 -11.6 48.6 883 436 B N > - 0 0 34 -228,-0.1 3,-1.4 1,-0.1 4,-0.4 -0.216 28.7 -93.2 -86.0 177.3 56.8 -9.3 51.5 884 437 B I T 3 S+ 0 0 27 -230,-2.5 -204,-0.2 1,-0.3 4,-0.2 0.570 122.4 52.2 -67.4 -10.6 56.1 -5.6 52.2 885 438 B H T 3> S+ 0 0 46 -231,-0.2 4,-1.4 1,-0.1 -1,-0.3 0.519 84.7 91.1 -99.6 -8.1 59.5 -4.5 50.5 886 439 B Y H <> S+ 0 0 34 -3,-1.4 4,-2.5 1,-0.2 3,-0.2 0.888 78.9 51.8 -63.6 -49.9 59.0 -6.4 47.3 887 440 B L H > S+ 0 0 1 -4,-0.4 4,-2.3 -209,-0.3 -1,-0.2 0.923 111.7 47.5 -56.5 -47.5 57.3 -3.9 44.9 888 441 B E H > S+ 0 0 78 -208,-0.4 4,-1.3 1,-0.2 -1,-0.2 0.819 111.6 50.0 -65.8 -31.3 59.9 -1.1 45.6 889 442 B K H < S+ 0 0 136 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.859 110.9 49.9 -75.2 -33.9 62.8 -3.5 45.1 890 443 B K H < S+ 0 0 84 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.888 114.6 45.0 -62.2 -41.5 61.2 -4.7 41.8 891 444 B L H < 0 0 61 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.698 360.0 360.0 -77.4 -22.3 60.8 -1.0 40.8 892 445 B G < 0 0 102 -4,-1.3 -2,-0.2 -5,-0.2 -3,-0.2 0.953 360.0 360.0 -76.5 360.0 64.4 -0.1 41.9