==== 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 18-DEC-08 2W6N . COMPND 2 MOLECULE: BIOTIN CARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR I.MOCHALKIN,J.R.MILLER . 890 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33293.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 614 69.0 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 . 158 17.8 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 . 56 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 254 28.5 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 5 1 0 6 3 2 5 0 0 4 0 0 0 2 2 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 2 2 6 4 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 . 4 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 96 0, 0.0 2,-0.1 0, 0.0 313,-0.1 0.000 360.0 360.0 360.0 146.4 43.7 -27.5 25.8 2 2 A L - 0 0 13 311,-0.2 25,-0.2 1,-0.1 3,-0.1 -0.396 360.0-145.8 -59.9 129.8 42.6 -26.5 22.3 3 3 A D S S- 0 0 79 1,-0.3 24,-2.8 23,-0.2 2,-0.3 0.892 71.9 -4.1 -69.0 -41.5 45.4 -24.3 20.7 4 4 A K E -a 27 0A 29 22,-0.2 72,-2.8 70,-0.1 73,-0.8 -0.985 64.2-166.2-158.2 134.9 43.3 -21.9 18.7 5 5 A I E -ab 28 77A 0 22,-2.4 24,-2.2 -2,-0.3 2,-0.4 -0.969 20.4-128.9-132.2 149.6 39.6 -21.5 17.9 6 6 A V E -ab 29 78A 0 71,-2.6 73,-2.4 -2,-0.4 2,-0.9 -0.812 18.7-144.1 -86.2 131.6 37.4 -19.6 15.5 7 7 A I E -ab 30 79A 0 22,-2.6 2,-1.7 -2,-0.4 24,-0.8 -0.859 14.2-165.1 -96.5 98.0 34.6 -17.7 17.2 8 8 A A + 0 0 3 71,-2.3 77,-0.3 -2,-0.9 2,-0.3 -0.366 59.9 59.3 -88.3 58.8 31.9 -18.1 14.6 9 9 A N - 0 0 3 -2,-1.7 2,-0.2 22,-0.3 22,-0.1 -0.881 66.9-134.2-162.2-168.6 29.6 -15.4 15.9 10 10 A R > + 0 0 21 -2,-0.3 4,-1.3 22,-0.1 3,-0.5 -0.805 54.4 24.0-146.4 178.1 29.5 -11.6 16.7 11 11 A G H > S- 0 0 3 -2,-0.2 4,-1.7 1,-0.2 30,-0.2 -0.121 114.2 -11.2 62.0-144.6 28.4 -9.1 19.4 12 12 A E H > S+ 0 0 5 372,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.895 134.8 50.8 -64.7 -42.6 28.1 -9.9 23.0 13 13 A I H > S+ 0 0 1 -3,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.856 107.2 54.1 -67.0 -35.0 28.4 -13.7 22.8 14 14 A A H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.908 111.1 46.5 -61.7 -42.4 31.6 -13.5 20.7 15 15 A L H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.899 110.0 53.8 -64.5 -43.2 33.1 -11.3 23.4 16 16 A R H X S+ 0 0 1 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.931 112.2 44.3 -54.2 -47.8 31.9 -13.8 26.1 17 17 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.895 109.8 55.1 -67.9 -41.2 33.6 -16.6 24.2 18 18 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.906 107.4 51.0 -59.6 -42.7 36.8 -14.6 23.7 19 19 A R H X S+ 0 0 8 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.936 109.7 48.8 -60.7 -47.9 37.1 -13.9 27.4 20 20 A A H X S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.909 111.9 50.4 -56.6 -45.0 36.7 -17.6 28.2 21 21 A C H X>S+ 0 0 0 -4,-2.5 5,-2.7 2,-0.2 4,-0.5 0.940 109.8 49.4 -58.3 -49.2 39.4 -18.5 25.6 22 22 A K H ><5S+ 0 0 61 -4,-2.6 3,-1.4 1,-0.3 -2,-0.2 0.918 108.1 53.8 -59.2 -45.1 41.8 -15.9 27.0 23 23 A E H 3<5S+ 0 0 26 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.841 113.6 43.7 -56.7 -34.4 41.3 -17.2 30.5 24 24 A L H 3<5S- 0 0 31 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.389 115.2-112.3 -94.7 1.8 42.2 -20.7 29.2 25 25 A G T <<5 + 0 0 63 -3,-1.4 2,-0.4 -4,-0.5 -3,-0.2 0.702 65.7 149.7 74.8 21.4 45.2 -19.7 27.1 26 26 A I < - 0 0 4 -5,-2.7 -1,-0.3 -6,-0.2 -22,-0.2 -0.739 47.9-123.0 -89.4 129.4 43.4 -20.5 23.9 27 27 A K E -a 4 0A 88 -24,-2.8 -22,-2.4 -2,-0.4 2,-0.4 -0.442 29.4-136.5 -70.2 144.9 44.3 -18.4 20.8 28 28 A T E -a 5 0A 0 -24,-0.2 19,-1.7 -2,-0.1 2,-0.5 -0.887 19.3-169.5-113.8 139.0 41.4 -16.6 19.2 29 29 A V E -ac 6 47A 0 -24,-2.2 -22,-2.6 -2,-0.4 2,-0.8 -0.984 13.2-158.0-119.6 114.5 40.4 -16.1 15.6 30 30 A A E -ac 7 48A 0 17,-2.9 19,-2.2 -2,-0.5 2,-0.4 -0.848 4.2-165.2 -96.9 108.1 37.6 -13.6 15.1 31 31 A V E + c 0 49A 0 -2,-0.8 2,-0.3 -24,-0.8 -22,-0.3 -0.778 22.6 169.5 -83.9 135.1 35.7 -14.1 11.8 32 32 A H E - c 0 50A 6 17,-2.1 19,-2.3 -2,-0.4 20,-0.7 -0.986 35.1-110.9-147.5 157.2 33.6 -11.1 11.0 33 33 A S E > - c 0 52A 0 -2,-0.3 3,-1.3 17,-0.2 21,-0.1 -0.340 42.4-104.6 -76.6 167.2 31.5 -9.4 8.3 34 34 A S G > S+ 0 0 50 18,-1.8 3,-0.6 1,-0.3 -1,-0.1 0.731 123.7 56.8 -67.0 -22.4 32.7 -6.2 6.7 35 35 A A G 3 S+ 0 0 40 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.614 103.5 55.1 -78.1 -12.2 30.1 -4.3 8.8 36 36 A D G X + 0 0 1 -3,-1.3 3,-1.4 1,-0.2 -1,-0.2 0.016 64.0 119.2-116.4 25.6 31.7 -5.7 12.0 37 37 A R T < S+ 0 0 130 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.796 80.1 46.6 -62.3 -30.0 35.3 -4.7 11.7 38 38 A D T 3 S+ 0 0 102 -3,-0.3 -1,-0.3 338,-0.1 2,-0.2 0.053 76.4 136.8-107.5 25.5 35.1 -2.6 14.9 39 39 A L <> - 0 0 0 -3,-1.4 4,-2.2 1,-0.1 5,-0.2 -0.505 63.7-120.8 -62.6 139.1 33.4 -5.1 17.2 40 40 A K H > S+ 0 0 17 330,-0.4 4,-1.3 1,-0.2 5,-0.1 0.899 113.0 46.7 -48.4 -49.3 35.1 -5.1 20.6 41 41 A H H > S+ 0 0 0 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.868 108.9 55.0 -69.6 -33.8 36.0 -8.8 20.4 42 42 A V H >4 S+ 0 0 9 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.917 109.3 48.3 -58.0 -43.3 37.4 -8.4 16.9 43 43 A L H 3< S+ 0 0 106 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.748 116.1 43.7 -70.8 -24.2 39.6 -5.6 18.2 44 44 A L H 3< S+ 0 0 42 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.510 91.5 109.4 -95.4 -10.4 40.7 -7.9 21.1 45 45 A A S << S- 0 0 16 -4,-1.0 3,-0.1 -3,-0.5 -16,-0.1 -0.303 70.7-131.1 -74.1 155.0 41.2 -11.1 19.1 46 46 A D S S+ 0 0 99 -18,-0.3 2,-0.3 1,-0.2 -17,-0.2 0.877 93.7 10.8 -71.2 -40.1 44.7 -12.6 18.3 47 47 A E E -c 29 0A 72 -19,-1.7 -17,-2.9 2,-0.0 2,-0.3 -0.986 69.9-158.4-136.6 151.6 43.8 -12.9 14.6 48 48 A T E -c 30 0A 73 -2,-0.3 2,-0.4 -19,-0.2 -17,-0.2 -0.954 5.6-173.2-130.2 147.6 40.9 -11.6 12.5 49 49 A V E -c 31 0A 35 -19,-2.2 -17,-2.1 -2,-0.3 2,-0.7 -0.967 20.9-140.0-140.3 119.2 39.5 -12.7 9.1 50 50 A C E -c 32 0A 53 -2,-0.4 -17,-0.2 -19,-0.2 -19,-0.1 -0.736 21.5-176.4 -77.3 118.2 36.8 -10.8 7.2 51 51 A I E - 0 0 15 -19,-2.3 -18,-0.2 -2,-0.7 -1,-0.1 0.482 52.5 -43.6-101.2 -3.1 34.6 -13.6 5.9 52 52 A G E S-c 33 0A 16 -20,-0.7 -18,-1.8 13,-0.1 -1,-0.2 -0.957 71.5 -52.1 163.6 179.3 32.1 -11.6 3.8 53 53 A P - 0 0 65 0, 0.0 5,-0.1 0, 0.0 -2,-0.1 -0.114 68.7 -81.1 -72.7-179.5 29.9 -8.5 3.4 54 54 A A S S+ 0 0 11 -21,-0.1 6,-0.2 5,-0.1 5,-0.1 0.852 97.7 92.3 -57.9 -49.2 27.3 -7.5 6.0 55 55 A P S >> S- 0 0 66 0, 0.0 3,-1.8 0, 0.0 4,-0.5 -0.262 78.2-130.1 -58.0 132.1 24.3 -9.7 5.2 56 56 A S G >4>S+ 0 0 25 324,-0.4 5,-2.8 1,-0.3 3,-1.3 0.793 102.0 68.3 -50.7 -35.5 24.5 -12.8 7.4 57 57 A V G 345S+ 0 0 97 1,-0.3 -1,-0.3 3,-0.2 -3,-0.1 0.837 109.1 36.2 -57.4 -32.8 24.0 -15.2 4.4 58 58 A K G <45S+ 0 0 113 -3,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.382 134.1 20.8-102.7 2.1 27.4 -14.2 3.0 59 59 A S T X<5S+ 0 0 0 -3,-1.3 3,-2.1 -4,-0.5 7,-0.2 0.378 128.0 22.7-128.3 -89.9 29.1 -13.9 6.4 60 60 A Y T 3 5S+ 0 0 2 1,-0.3 25,-0.3 -6,-0.2 -3,-0.2 0.623 132.4 40.4 -70.4 -11.3 27.9 -15.5 9.7 61 61 A L T 3 - 0 0 25 -3,-2.1 4,-2.4 -6,-0.4 5,-0.2 -0.641 44.3-176.6 -86.0 90.4 28.6 -18.7 5.1 63 63 A I H > S+ 0 0 25 -2,-1.3 4,-2.6 1,-0.2 5,-0.3 0.906 79.0 48.3 -58.5 -51.7 29.8 -22.2 5.9 64 64 A P H > S+ 0 0 86 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.890 113.5 48.5 -55.1 -42.8 32.7 -22.4 3.3 65 65 A A H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.888 112.0 47.8 -65.9 -42.4 34.0 -19.0 4.4 66 66 A I H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.904 114.9 45.8 -66.0 -42.6 33.9 -19.9 8.1 67 67 A I H X S+ 0 0 12 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.893 110.8 53.2 -68.8 -39.0 35.7 -23.3 7.5 68 68 A S H X S+ 0 0 64 -4,-2.6 4,-3.2 -5,-0.3 -2,-0.2 0.881 106.2 53.7 -59.6 -39.6 38.3 -21.6 5.2 69 69 A A H X S+ 0 0 2 -4,-1.9 4,-1.5 2,-0.2 6,-0.3 0.873 109.0 48.8 -62.9 -40.0 39.1 -19.2 8.0 70 70 A A H X>S+ 0 0 0 -4,-1.5 5,-1.9 2,-0.2 4,-0.8 0.912 114.0 46.6 -63.8 -44.7 39.7 -22.1 10.3 71 71 A E H ><5S+ 0 0 109 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.953 112.3 48.9 -61.4 -50.6 41.9 -23.8 7.7 72 72 A I H 3<5S+ 0 0 141 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.785 115.6 42.7 -66.0 -29.1 43.9 -20.6 6.9 73 73 A T H 3<5S- 0 0 16 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.543 108.4-118.1 -93.6 -9.5 44.7 -19.7 10.5 74 74 A G T <<5 + 0 0 45 -4,-0.8 -3,-0.2 -3,-0.8 -4,-0.1 0.800 55.1 164.7 73.9 27.2 45.5 -23.2 11.7 75 75 A A < - 0 0 5 -5,-1.9 -70,-0.2 -6,-0.3 -1,-0.2 -0.405 29.8-157.2 -72.0 156.3 42.5 -23.2 14.2 76 76 A V + 0 0 50 -72,-2.8 25,-2.7 1,-0.2 2,-0.3 0.524 67.2 24.7-112.5 -12.2 41.4 -26.6 15.6 77 77 A A E -bd 5 101A 0 -73,-0.8 -71,-2.6 23,-0.3 2,-0.4 -0.961 59.2-141.4-153.0 161.6 37.8 -25.8 16.6 78 78 A I E -bd 6 102A 0 23,-2.5 25,-2.5 -2,-0.3 -71,-0.2 -0.997 7.1-157.9-133.3 121.9 34.8 -23.6 15.9 79 79 A H E -b 7 0A 1 -73,-2.4 -71,-2.3 -2,-0.4 25,-0.1 -0.944 4.2-167.4 -97.3 118.7 32.5 -22.2 18.6 80 80 A P - 0 0 6 0, 0.0 6,-0.4 0, 0.0 5,-0.3 0.464 16.7-159.9 -83.2 -5.6 29.1 -21.3 17.0 81 81 A G - 0 0 1 22,-0.1 212,-0.5 4,-0.1 2,-0.3 -0.376 46.2 -46.2 60.5-136.1 27.8 -19.4 19.9 82 82 A Y S S+ 0 0 33 210,-0.1 3,-0.2 -2,-0.1 212,-0.1 -0.816 108.9 18.0-121.4 167.9 24.0 -19.1 19.7 83 83 A G S > S+ 0 0 38 -2,-0.3 3,-2.5 1,-0.2 4,-0.3 -0.356 101.5 55.9 67.5-157.5 21.8 -18.2 16.7 84 84 A F T 3 S- 0 0 65 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 -0.037 128.7 -15.0 37.8-109.5 23.4 -18.4 13.2 85 85 A L T > S+ 0 0 9 -77,-0.3 3,-1.7 -5,-0.3 -1,-0.3 0.273 101.8 108.8-108.4 10.9 24.7 -22.0 12.7 86 86 A S T < S+ 0 0 3 -3,-2.5 -1,-0.2 -6,-0.4 -2,-0.1 0.771 90.1 33.1 -64.2 -28.8 24.7 -23.2 16.3 87 87 A E T 3 S+ 0 0 61 -4,-0.3 2,-0.9 -3,-0.3 -1,-0.3 0.106 89.6 115.7-110.7 20.3 21.7 -25.6 15.7 88 88 A N <> - 0 0 58 -3,-1.7 4,-2.0 1,-0.2 3,-0.2 -0.797 44.3-171.8 -95.3 101.7 22.7 -26.5 12.1 89 89 A A H > S+ 0 0 11 -2,-0.9 4,-2.6 1,-0.2 -1,-0.2 0.854 84.2 56.2 -65.3 -37.1 23.5 -30.2 12.1 90 90 A N H > S+ 0 0 93 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.896 107.6 49.8 -62.3 -39.8 24.8 -30.1 8.5 91 91 A F H > S+ 0 0 0 2,-0.2 4,-2.8 -3,-0.2 -2,-0.2 0.934 110.6 49.1 -60.7 -49.6 27.3 -27.4 9.5 92 92 A A H X S+ 0 0 1 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.910 111.9 49.6 -57.7 -42.3 28.5 -29.4 12.5 93 93 A E H X S+ 0 0 73 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.916 111.4 48.0 -63.3 -44.4 28.9 -32.4 10.3 94 94 A Q H X S+ 0 0 66 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.877 110.1 53.2 -64.6 -40.0 30.9 -30.4 7.7 95 95 A V H <>S+ 0 0 0 -4,-2.8 5,-2.4 2,-0.2 4,-0.4 0.953 114.7 40.3 -59.0 -51.1 33.1 -28.9 10.5 96 96 A E H ><5S+ 0 0 77 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.876 113.9 53.3 -67.5 -39.5 33.9 -32.4 11.8 97 97 A R H 3<5S+ 0 0 155 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.836 106.6 54.8 -60.1 -35.6 34.3 -33.9 8.3 98 98 A S T 3<5S- 0 0 49 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.564 125.3-105.1 -78.3 -10.2 36.7 -31.0 7.6 99 99 A G T < 5S+ 0 0 65 -3,-1.0 2,-0.2 -4,-0.4 -3,-0.2 0.533 80.4 119.2 103.1 10.3 38.8 -32.1 10.6 100 100 A F < - 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0 0 12 -4,-1.5 2,-0.5 -5,-0.1 -50,-0.2 -0.426 52.9-171.6 -66.7 122.9 23.3 2.5 32.4 410 410 A I E +S 358 0G 44 -52,-2.4 -52,-2.3 -2,-0.2 2,-0.3 -0.985 16.3 163.4-117.3 125.2 23.6 5.3 29.8 411 411 A I E +S 357 0G 14 -2,-0.5 3,-0.3 -54,-0.2 2,-0.3 -0.790 16.4 175.8-138.0 93.9 23.1 4.5 26.1 412 412 A D E +S 356 0G 58 -56,-2.4 -57,-2.2 -2,-0.3 -56,-0.7 -0.670 54.0 44.5 -98.2 155.3 22.5 7.7 24.1 413 413 A G S S+ 0 0 53 -59,-0.3 2,-0.3 -2,-0.3 -60,-0.3 0.026 107.7 55.0 104.4 -24.9 22.2 8.1 20.4 414 414 A I S S- 0 0 19 -3,-0.3 2,-0.3 -62,-0.1 -1,-0.1 -0.932 87.2-104.2-132.6 159.9 19.9 5.2 19.8 415 415 A K + 0 0 109 -2,-0.3 -73,-0.7 -65,-0.3 2,-0.3 -0.648 44.0 176.0 -82.9 139.1 16.5 4.0 21.3 416 416 A T B -P 341 0D 29 -2,-0.3 3,-0.4 -75,-0.3 -75,-0.2 -0.871 41.9-117.3-136.8 172.4 16.6 1.2 23.8 417 417 A N S > S+ 0 0 5 -77,-1.3 4,-2.3 -2,-0.3 5,-0.2 0.126 76.1 113.7 -95.9 19.2 14.4 -0.8 26.1 418 418 A V H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 78.1 51.0 -57.8 -42.8 16.1 0.3 29.3 419 419 A D H > S+ 0 0 123 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.904 109.3 50.1 -62.1 -43.4 12.9 2.2 30.4 420 420 A L H > S+ 0 0 11 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.910 109.2 51.5 -57.8 -47.3 10.7 -0.8 29.8 421 421 A Q H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.872 107.9 52.4 -59.9 -39.1 13.1 -3.0 31.9 422 422 A I H X S+ 0 0 21 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.915 108.7 50.8 -62.2 -43.0 12.9 -0.5 34.7 423 423 A R H < S+ 0 0 121 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.868 109.5 50.7 -60.2 -39.8 9.1 -0.7 34.5 424 424 A I H >< S+ 0 0 0 -4,-2.1 3,-1.7 1,-0.2 -2,-0.2 0.949 108.6 50.5 -66.2 -44.7 9.3 -4.5 34.7 425 425 A M H 3< S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.820 112.8 48.1 -61.9 -30.4 11.5 -4.4 37.8 426 426 A N T 3< S+ 0 0 85 -4,-1.6 -1,-0.3 -5,-0.2 2,-0.3 0.441 85.2 116.3 -87.1 -1.9 9.0 -2.0 39.4 427 427 A D <> - 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0 0 141 -2,-0.1 -1,-0.2 1,-0.1 -41,-0.1 -0.176 45.1-120.1 -67.0 162.9 44.0 11.3 46.3 829 383 B S S S+ 0 0 30 -43,-0.1 -42,-2.9 -32,-0.0 2,-0.5 0.701 79.1 105.9 -79.9 -21.3 45.2 9.6 43.1 830 384 B M E +D 786 0I 27 -44,-0.3 -372,-0.3 1,-0.2 -44,-0.3 -0.492 35.1 165.8 -68.6 118.4 43.0 6.4 43.4 831 385 B I E - 0 0 2 -46,-2.4 -14,-0.5 -2,-0.5 -15,-0.5 0.509 59.8 -7.3-108.2 -10.8 40.2 6.7 40.8 832 386 B G E -DE 785 815I 0 -47,-1.7 -47,-3.3 -17,-0.2 2,-0.4 -0.983 52.9-130.4-172.4 169.9 39.0 3.1 40.8 833 387 B K E -DE 784 814I 0 -19,-2.3 -19,-2.7 -2,-0.3 2,-0.6 -0.997 11.9-156.3-135.3 129.5 39.3 -0.5 41.9 834 388 B L E -DE 783 813I 0 -51,-2.6 -51,-2.7 -2,-0.4 2,-0.5 -0.935 15.2-172.3-107.0 121.6 39.2 -3.6 39.7 835 389 B I E -DE 782 812I 0 -23,-3.1 -23,-3.0 -2,-0.6 2,-0.4 -0.957 3.6-171.6-121.1 121.2 38.2 -6.7 41.5 836 390 B C E -DE 781 811I 0 -55,-2.7 -55,-2.6 -2,-0.5 2,-0.3 -0.950 3.4-168.2-117.6 133.8 38.4 -10.2 40.0 837 391 B Y E +D 780 0I 45 -27,-2.8 2,-0.3 -2,-0.4 -57,-0.2 -0.864 10.5 165.0-114.1 147.1 37.0 -13.3 41.6 838 392 B G E -D 779 0I 0 -59,-2.6 -59,-2.5 -2,-0.3 6,-0.1 -0.976 52.8-100.8-151.3 169.1 37.4 -17.0 40.7 839 393 B E S S+ 0 0 77 -2,-0.3 -61,-0.4 -61,-0.2 2,-0.3 0.705 111.7 13.6 -61.9 -20.6 36.9 -20.5 42.2 840 394 B N S > S- 0 0 75 -61,-0.2 4,-2.1 -63,-0.1 -61,-0.3 -0.955 88.2 -99.6-146.0 172.2 40.6 -20.4 42.8 841 395 B R H > S+ 0 0 30 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.865 117.8 55.2 -61.0 -41.3 43.5 -17.9 42.8 842 396 B D H > S+ 0 0 113 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.893 109.2 48.3 -61.8 -38.8 44.8 -18.8 39.3 843 397 B V H > S+ 0 0 11 -3,-0.2 4,-2.5 2,-0.2 5,-0.2 0.929 110.1 51.6 -64.7 -46.2 41.3 -18.1 37.8 844 398 B A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.906 112.9 45.8 -54.4 -45.4 41.1 -14.7 39.7 845 399 B I H X S+ 0 0 6 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.899 110.8 52.2 -67.4 -43.8 44.5 -13.7 38.3 846 400 B A H X S+ 0 0 20 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.905 111.8 47.0 -56.4 -44.3 43.7 -14.9 34.8 847 401 B R H X S+ 0 0 5 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.866 109.5 53.6 -67.9 -37.1 40.5 -12.8 34.9 848 402 B M H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.919 106.9 52.5 -63.8 -43.1 42.4 -9.8 36.2 849 403 B K H X S+ 0 0 61 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.922 113.7 43.1 -55.9 -46.7 44.9 -10.0 33.3 850 404 B N H X S+ 0 0 17 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.902 113.7 50.6 -66.2 -45.6 42.0 -10.0 30.8 851 405 B A H X S+ 0 0 1 -4,-2.8 4,-1.3 1,-0.2 3,-0.4 0.900 107.5 53.2 -61.1 -44.4 40.0 -7.2 32.6 852 406 B L H < S+ 0 0 2 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.843 106.6 53.5 -61.1 -35.6 43.1 -4.9 32.8 853 407 B Q H < S+ 0 0 103 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.787 110.1 47.3 -68.8 -30.7 43.6 -5.3 29.0 854 408 B E H < S+ 0 0 9 -4,-1.2 2,-0.4 -3,-0.4 -1,-0.2 0.698 88.6 103.2 -79.7 -24.0 40.0 -4.2 28.3 855 409 B L < - 0 0 13 -4,-1.3 2,-0.5 -5,-0.1 -50,-0.2 -0.514 52.7-171.1 -68.6 119.6 40.2 -1.3 30.6 856 410 B I E +K 804 0M 48 -52,-2.5 -52,-2.1 -2,-0.4 2,-0.3 -0.969 17.0 161.4-115.2 123.2 40.6 2.0 28.7 857 411 B I E +K 803 0M 14 -2,-0.5 2,-0.3 -54,-0.2 -54,-0.2 -0.865 16.4 176.2-138.0 100.2 41.4 5.3 30.5 858 412 B D E +K 802 0M 60 -56,-2.5 -57,-1.6 -2,-0.3 -56,-0.9 -0.777 53.8 44.7-107.2 152.8 42.8 7.9 28.0 859 413 B G S S+ 0 0 55 -2,-0.3 2,-0.3 -59,-0.2 -60,-0.2 0.081 108.5 52.6 105.8 -22.1 43.7 11.5 28.7 860 414 B I S S- 0 0 14 -3,-0.2 2,-0.2 -62,-0.1 -1,-0.2 -0.946 87.4-105.0-137.6 156.1 45.6 10.9 32.0 861 415 B K - 0 0 111 -2,-0.3 2,-0.3 -64,-0.1 -65,-0.2 -0.611 40.8-178.0 -77.7 143.8 48.4 8.5 33.0 862 416 B T - 0 0 20 -75,-0.3 3,-0.4 -2,-0.2 -75,-0.2 -0.899 38.9-118.8-133.6 170.2 47.4 5.5 35.1 863 417 B N S > S+ 0 0 1 -77,-1.3 4,-2.4 -2,-0.3 5,-0.2 0.191 78.8 112.3 -90.9 14.8 49.2 2.6 36.9 864 418 B V H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.900 76.3 52.4 -55.3 -44.0 47.3 -0.0 34.7 865 419 B D H > S+ 0 0 102 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.873 108.1 51.8 -62.4 -38.2 50.5 -1.0 33.0 866 420 B L H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.939 109.3 49.9 -57.2 -48.0 52.1 -1.5 36.4 867 421 B Q H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.905 108.1 52.5 -63.5 -38.6 49.2 -3.8 37.4 868 422 B I H X S+ 0 0 25 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.932 109.6 50.4 -60.2 -44.3 49.6 -5.8 34.2 869 423 B R H < S+ 0 0 80 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.892 110.1 49.7 -59.6 -42.5 53.3 -6.3 35.0 870 424 B I H >< S+ 0 0 1 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.919 108.5 51.0 -66.9 -43.1 52.4 -7.4 38.6 871 425 B M H 3< S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.817 111.8 49.5 -61.8 -32.4 49.8 -10.0 37.4 872 426 B N T 3< S+ 0 0 91 -4,-1.6 2,-0.3 -5,-0.2 -1,-0.3 0.459 85.3 115.4 -82.8 -4.8 52.5 -11.3 35.0 873 427 B D <> - 0 0 12 -3,-1.3 4,-3.0 -4,-0.3 5,-0.2 -0.532 60.8-146.9 -74.9 127.4 55.1 -11.6 37.8 874 428 B E H > S+ 0 0 157 -2,-0.3 4,-1.7 2,-0.2 -1,-0.1 0.803 98.4 50.3 -65.7 -33.7 56.2 -15.2 38.4 875 429 B N H > S+ 0 0 85 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.914 112.2 47.0 -71.7 -44.3 56.7 -14.6 42.2 876 430 B F H 4 S+ 0 0 3 2,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.940 110.6 53.4 -57.8 -47.9 53.3 -13.0 42.5 877 431 B Q H < S+ 0 0 62 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.854 108.7 49.2 -56.8 -38.0 51.8 -15.9 40.5 878 432 B H H < S- 0 0 165 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.917 110.8-144.2 -63.0 -45.2 53.5 -18.3 43.0 879 433 B G < + 0 0 9 -4,-2.3 -2,-0.1 -5,-0.1 -1,-0.1 -0.114 64.9 78.5 101.0 161.8 52.0 -16.2 45.8 880 434 B G + 0 0 31 1,-0.2 -4,-0.1 -4,-0.1 -3,-0.1 0.637 53.1 163.8 79.1 19.6 53.1 -15.2 49.3 881 435 B T - 0 0 27 -6,-0.2 -1,-0.2 -5,-0.1 -204,-0.1 -0.316 33.3-118.6 -66.6 151.7 55.5 -12.4 48.5 882 436 B N > - 0 0 40 -228,-0.1 3,-1.4 1,-0.1 4,-0.4 -0.199 29.0 -91.0 -89.0 179.2 56.5 -10.0 51.3 883 437 B I T 3 S+ 0 0 30 -230,-2.3 4,-0.3 1,-0.3 -204,-0.3 0.661 122.6 53.0 -66.7 -17.0 56.0 -6.3 51.9 884 438 B H T 3> S+ 0 0 42 -231,-0.2 4,-1.8 1,-0.1 -1,-0.3 0.553 82.3 92.6 -94.9 -8.6 59.4 -5.5 50.3 885 439 B Y H <> S+ 0 0 38 -3,-1.4 4,-2.5 1,-0.2 5,-0.2 0.900 84.7 45.9 -54.3 -52.1 58.8 -7.3 47.0 886 440 B L H > S+ 0 0 0 -4,-0.4 4,-2.4 -207,-0.3 -1,-0.2 0.905 110.6 52.7 -61.9 -46.1 57.4 -4.5 44.9 887 441 B E H 4 S+ 0 0 77 -208,-0.5 -1,-0.2 -4,-0.3 -2,-0.2 0.861 114.7 42.0 -60.3 -37.3 60.0 -1.9 45.9 888 442 B K H >< S+ 0 0 132 -4,-1.8 3,-0.9 2,-0.2 -1,-0.2 0.832 110.1 56.7 -81.0 -30.5 62.8 -4.3 45.0 889 443 B K H 3< S+ 0 0 76 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.925 111.8 43.7 -59.4 -45.5 61.1 -5.5 41.7 890 444 B L T 3< 0 0 61 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.370 360.0 360.0 -80.5 4.7 61.0 -1.8 40.6 891 445 B G < 0 0 100 -3,-0.9 -3,-0.1 -5,-0.1 -4,-0.0 -0.506 360.0 360.0 -69.2 360.0 64.6 -1.3 41.8