==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 23-SEP-09 3JZF . COMPND 2 MOLECULE: BIOTIN CARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR P.ORTH . 827 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30536.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 576 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 144 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 . 64 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 228 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 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 4 2 0 6 3 1 5 0 1 3 0 0 1 1 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 . 3 2 2 4 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 1 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 99 0, 0.0 2,-0.3 0, 0.0 245,-0.1 0.000 360.0 360.0 360.0 166.4 26.0 1.7 3.1 2 2 A L - 0 0 10 243,-0.2 25,-0.2 1,-0.1 3,-0.1 -0.556 360.0-142.9 -71.1 130.2 24.5 5.3 3.0 3 3 A D S S- 0 0 80 -2,-0.3 24,-2.6 1,-0.2 2,-0.3 0.927 74.4 -1.9 -63.6 -46.6 26.8 7.5 5.0 4 4 A K E -a 27 0A 33 22,-0.2 72,-2.7 70,-0.1 73,-1.0 -0.994 64.9-164.5-153.1 135.5 24.1 9.8 6.5 5 5 A I E -ab 28 77A 0 22,-2.6 24,-2.1 -2,-0.3 2,-0.5 -0.950 18.7-132.5-129.2 151.1 20.3 10.1 6.3 6 6 A V E -ab 29 78A 0 71,-2.4 73,-2.3 -2,-0.3 2,-1.0 -0.855 17.7-145.0 -95.6 127.5 17.7 12.6 7.2 7 7 A I E -ab 30 79A 0 22,-2.5 2,-1.8 -2,-0.5 24,-0.9 -0.826 13.3-165.6 -93.6 95.8 14.7 11.0 9.0 8 8 A A + 0 0 7 71,-2.0 77,-0.3 -2,-1.0 2,-0.3 -0.523 60.6 61.2 -85.8 67.2 11.9 13.1 7.6 9 9 A N - 0 0 3 -2,-1.8 2,-0.2 22,-0.4 22,-0.1 -0.901 65.5-138.8-168.1-171.0 9.4 12.1 10.3 10 10 A R >> + 0 0 16 -2,-0.3 4,-1.2 22,-0.1 3,-0.5 -0.837 53.4 29.7-151.7-178.5 8.7 12.1 14.0 11 11 A G H 3> S- 0 0 3 -2,-0.2 4,-1.5 1,-0.2 30,-0.2 -0.147 114.4 -14.8 58.9-143.9 7.4 10.0 17.0 12 12 A E H 3> S+ 0 0 5 304,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.856 134.8 52.9 -64.3 -40.3 7.7 6.2 17.1 13 13 A I H <> S+ 0 0 1 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.854 106.6 53.1 -65.2 -36.2 8.6 5.7 13.4 14 14 A A H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.902 111.4 46.5 -66.4 -38.2 11.4 8.2 13.5 15 15 A L H X S+ 0 0 1 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.877 110.4 53.7 -68.4 -40.6 12.8 6.3 16.6 16 16 A R H X S+ 0 0 3 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.888 111.7 45.3 -57.0 -46.3 12.3 2.9 14.7 17 17 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.897 108.9 55.3 -67.1 -45.2 14.3 4.4 11.7 18 18 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.894 106.7 51.0 -56.3 -44.5 17.1 5.8 14.0 19 19 A R H X S+ 0 0 8 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.912 110.2 49.0 -60.7 -43.6 17.7 2.3 15.6 20 20 A A H X S+ 0 0 0 -4,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.926 112.4 48.8 -61.9 -43.1 18.0 0.7 12.1 21 21 A C H X>S+ 0 0 0 -4,-2.4 5,-3.0 1,-0.2 4,-0.6 0.921 110.6 50.0 -59.6 -49.5 20.5 3.4 11.0 22 22 A K H ><5S+ 0 0 42 -4,-2.6 3,-0.7 1,-0.2 -1,-0.2 0.861 108.2 53.6 -58.7 -40.9 22.6 3.0 14.2 23 23 A E H 3<5S+ 0 0 27 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.808 114.3 41.6 -62.3 -35.2 22.7 -0.9 13.7 24 24 A L H 3<5S- 0 0 34 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.438 116.6-113.7 -92.0 -2.8 24.1 -0.3 10.1 25 25 A G T <<5 + 0 0 62 -3,-0.7 2,-0.4 -4,-0.6 -3,-0.2 0.698 63.8 152.4 74.8 22.8 26.4 2.5 11.2 26 26 A I < - 0 0 3 -5,-3.0 -1,-0.3 -6,-0.2 -22,-0.2 -0.717 46.3-121.7 -85.3 131.9 24.5 5.1 9.2 27 27 A K E -a 4 0A 91 -24,-2.6 -22,-2.6 -2,-0.4 2,-0.4 -0.453 28.7-137.7 -71.3 143.0 24.7 8.7 10.6 28 28 A T E -a 5 0A 0 -24,-0.2 19,-1.7 -2,-0.1 2,-0.5 -0.859 17.6-167.4-112.5 142.5 21.4 10.3 11.5 29 29 A V E -ac 6 47A 0 -24,-2.1 -22,-2.5 -2,-0.4 2,-0.8 -0.987 13.8-156.4-121.1 113.1 20.0 13.8 11.0 30 30 A A E -ac 7 48A 0 17,-2.7 19,-2.2 -2,-0.5 2,-0.4 -0.850 6.1-165.8 -94.7 109.7 16.8 14.4 12.9 31 31 A V E + c 0 49A 0 -24,-0.9 -22,-0.4 -2,-0.8 2,-0.3 -0.803 22.4 168.3 -90.2 132.0 14.7 17.2 11.3 32 32 A H E - c 0 50A 6 17,-2.3 19,-2.6 -2,-0.4 20,-0.6 -0.988 36.9-111.7-147.1 158.9 12.1 18.4 13.7 33 33 A S E > - c 0 52A 0 -2,-0.3 3,-1.3 17,-0.2 21,-0.1 -0.346 44.1-104.1 -78.0 167.2 9.5 21.1 14.4 34 34 A S G > S+ 0 0 47 18,-1.9 3,-0.6 1,-0.2 -1,-0.1 0.718 123.4 57.9 -65.8 -21.2 10.0 23.5 17.3 35 35 A A G 3 S+ 0 0 37 1,-0.2 3,-0.3 2,-0.1 -1,-0.2 0.588 102.5 55.4 -82.3 -13.0 7.4 21.5 19.3 36 36 A D G X + 0 0 1 -3,-1.3 3,-1.5 1,-0.2 -1,-0.2 0.027 63.1 116.0-113.0 25.0 9.4 18.2 18.9 37 37 A R T < S+ 0 0 129 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.780 80.8 51.1 -62.2 -27.6 12.8 19.2 20.4 38 38 A D T 3 S+ 0 0 101 -3,-0.3 -1,-0.3 270,-0.1 -2,-0.1 0.222 75.8 131.6 -98.9 11.8 12.2 16.6 23.2 39 39 A L <> - 0 0 0 -3,-1.5 4,-2.0 1,-0.1 3,-0.2 -0.399 65.5-124.1 -62.7 138.3 11.4 13.6 20.9 40 40 A K H > S+ 0 0 16 262,-0.4 4,-1.2 1,-0.2 -1,-0.1 0.887 111.0 49.9 -52.1 -46.3 13.4 10.6 22.0 41 41 A H H > S+ 0 0 0 -30,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.848 107.9 54.1 -65.3 -34.2 14.9 10.1 18.5 42 42 A V H 4 S+ 0 0 8 -3,-0.2 3,-0.4 1,-0.2 -1,-0.2 0.926 108.8 49.1 -62.8 -45.1 15.9 13.8 18.3 43 43 A L H < S+ 0 0 107 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.744 116.4 43.2 -67.8 -22.5 17.8 13.4 21.7 44 44 A L H < S+ 0 0 42 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.608 91.4 108.5 -96.2 -17.8 19.5 10.2 20.3 45 45 A A S < S- 0 0 16 -4,-1.4 -16,-0.1 -3,-0.4 3,-0.1 -0.229 70.7-131.6 -63.1 151.9 20.4 11.6 16.8 46 46 A D S S+ 0 0 95 -18,-0.3 2,-0.3 1,-0.2 -17,-0.2 0.888 93.8 11.8 -69.0 -41.6 23.9 12.4 15.7 47 47 A E E S-c 29 0A 70 -19,-1.7 -17,-2.7 2,-0.0 2,-0.3 -0.963 70.4-159.7-135.9 152.5 22.8 15.8 14.3 48 48 A T E -c 30 0A 74 -2,-0.3 2,-0.4 -19,-0.2 -17,-0.2 -0.959 4.2-170.9-133.8 147.7 19.5 17.8 14.7 49 49 A V E -c 31 0A 28 -19,-2.2 -17,-2.3 -2,-0.3 2,-0.7 -0.984 21.6-137.2-138.8 125.6 17.9 20.6 12.6 50 50 A C E -c 32 0A 53 -2,-0.4 -17,-0.2 -19,-0.2 -19,-0.1 -0.780 21.2-173.8 -82.5 116.6 14.8 22.6 13.6 51 51 A I E - 0 0 15 -19,-2.6 -18,-0.2 -2,-0.7 -1,-0.1 0.417 52.3 -56.3 -93.9 -0.9 12.8 22.8 10.3 52 52 A G E S-c 33 0A 19 -20,-0.6 -18,-1.9 13,-0.1 -1,-0.2 -0.888 72.0 -39.2 152.3-179.2 10.1 25.2 11.4 53 53 A P S S- 0 0 64 0, 0.0 5,-0.1 0, 0.0 -2,-0.0 -0.086 72.0 -80.0 -68.9 174.4 7.3 25.9 13.9 54 54 A A S S+ 0 0 11 -21,-0.1 5,-0.1 5,-0.1 -21,-0.1 0.769 97.8 91.9 -45.3 -51.3 4.8 23.3 15.3 55 55 A P S >> S- 0 0 63 0, 0.0 3,-1.3 0, 0.0 4,-0.5 -0.326 76.4-132.8 -58.5 134.6 2.2 23.0 12.4 56 56 A S G >4>S+ 0 0 24 256,-0.3 5,-3.3 1,-0.3 3,-1.3 0.846 106.1 62.8 -52.7 -39.2 3.2 20.1 10.0 57 57 A V G 345S+ 0 0 105 1,-0.3 -1,-0.3 3,-0.2 -3,-0.1 0.792 108.8 42.6 -55.3 -32.5 2.5 22.4 7.0 58 58 A K G <45S+ 0 0 109 -3,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.514 136.3 6.7 -91.8 -11.2 5.4 24.6 8.3 59 59 A S T X<5S+ 0 0 0 -3,-1.3 3,-1.9 -4,-0.5 7,-0.2 0.417 128.7 31.6-133.3 -89.4 7.7 21.7 9.2 60 60 A Y T 3 5S+ 0 0 2 1,-0.3 25,-0.3 5,-0.1 -3,-0.2 0.649 128.5 40.3 -57.1 -21.6 7.1 18.0 8.4 61 61 A L T 3 - 0 0 46 -3,-1.9 4,-2.1 -6,-0.5 5,-0.2 -0.680 46.9-174.6 -86.7 89.6 7.7 21.6 4.3 63 63 A I H > S+ 0 0 27 -2,-1.3 4,-2.5 1,-0.2 5,-0.3 0.915 81.2 49.0 -52.0 -55.5 9.6 20.2 1.2 64 64 A P H > S+ 0 0 88 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.877 112.2 50.1 -56.4 -39.6 12.1 23.2 0.8 65 65 A A H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.902 112.6 46.0 -64.2 -42.0 12.9 23.1 4.6 66 66 A I H X S+ 0 0 0 -4,-2.1 4,-2.1 -7,-0.2 -1,-0.2 0.933 114.7 46.9 -65.5 -47.3 13.6 19.3 4.6 67 67 A I H X S+ 0 0 7 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.885 111.5 52.1 -60.2 -44.6 15.7 19.4 1.4 68 68 A S H X S+ 0 0 58 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.903 109.6 48.8 -61.1 -42.4 17.7 22.4 2.8 69 69 A A H X S+ 0 0 2 -4,-1.9 4,-1.8 2,-0.2 6,-0.2 0.899 111.2 50.0 -65.1 -39.8 18.4 20.5 6.1 70 70 A A H X>S+ 0 0 0 -4,-2.1 5,-1.8 2,-0.2 4,-0.5 0.903 113.0 47.8 -65.1 -38.6 19.6 17.4 4.0 71 71 A E H ><5S+ 0 0 110 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.933 112.3 46.6 -66.7 -50.4 21.9 19.7 2.0 72 72 A I H 3<5S+ 0 0 125 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.810 112.5 50.3 -64.8 -32.8 23.5 21.6 4.9 73 73 A T H 3<5S- 0 0 13 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.552 109.5-119.6 -84.5 -8.7 24.1 18.4 6.9 74 74 A G T <<5 + 0 0 46 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.704 55.4 162.7 74.9 24.0 25.8 16.6 4.0 75 75 A A < - 0 0 8 -5,-1.8 -70,-0.2 -6,-0.2 -1,-0.2 -0.243 30.1-162.3 -68.5 161.2 23.2 13.8 4.1 76 76 A V + 0 0 59 -72,-2.7 25,-2.9 1,-0.2 2,-0.3 0.469 67.6 31.1-120.5 -14.2 22.8 11.5 1.0 77 77 A A E -bd 5 101A 0 -73,-1.0 -71,-2.4 23,-0.3 2,-0.4 -0.970 59.7-145.4-147.2 158.5 19.4 10.0 1.6 78 78 A I E -bd 6 102A 0 23,-2.2 25,-2.7 -2,-0.3 -71,-0.2 -0.989 4.0-159.3-130.9 123.4 16.0 10.7 3.1 79 79 A H E -b 7 0A 1 -73,-2.3 -71,-2.0 -2,-0.4 25,-0.1 -0.908 5.1-169.9 -98.7 117.7 13.7 8.2 4.9 80 80 A P - 0 0 4 0, 0.0 6,-0.4 0, 0.0 5,-0.3 0.512 18.3-157.3 -85.7 -6.4 10.1 9.6 4.8 81 81 A G - 0 0 1 22,-0.2 144,-0.4 4,-0.1 2,-0.3 -0.385 45.0 -44.3 66.4-138.3 8.6 7.0 7.3 82 82 A Y S S+ 0 0 33 142,-0.1 3,-0.2 -2,-0.1 144,-0.1 -0.832 109.5 11.5-120.8 162.2 4.8 6.6 6.9 83 83 A G S > S+ 0 0 35 -2,-0.3 3,-2.3 1,-0.2 4,-0.2 -0.263 102.5 59.8 66.4-157.4 2.2 9.4 6.6 84 84 A F T 3 S- 0 0 63 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 -0.179 127.6 -16.6 42.4-115.8 3.5 12.9 5.9 85 85 A L T > S+ 0 0 5 -77,-0.3 3,-1.4 -25,-0.3 -1,-0.3 0.288 105.3 104.4-100.3 5.4 5.5 13.0 2.6 86 86 A S T < S+ 0 0 2 -3,-2.3 -1,-0.2 -6,-0.4 -2,-0.1 0.810 93.5 31.1 -57.2 -35.4 6.1 9.2 2.2 87 87 A E T 3 S+ 0 0 74 -3,-0.3 2,-0.9 -4,-0.2 -1,-0.3 0.089 89.4 114.3-112.2 20.1 3.4 8.9 -0.5 88 88 A N <> - 0 0 59 -3,-1.4 4,-1.9 1,-0.2 3,-0.4 -0.839 49.4-165.4 -92.6 102.2 3.9 12.4 -1.9 89 89 A A H > S+ 0 0 12 -2,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.834 86.6 56.9 -60.4 -35.3 5.2 11.7 -5.5 90 90 A N H > S+ 0 0 95 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.855 107.1 49.8 -63.9 -36.4 6.4 15.4 -6.0 91 91 A F H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.950 111.1 47.9 -66.5 -47.5 8.5 15.0 -2.8 92 92 A A H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.877 113.1 49.2 -58.6 -41.8 10.1 11.8 -4.1 93 93 A E H X S+ 0 0 98 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.916 113.2 46.4 -63.5 -48.1 10.8 13.4 -7.5 94 94 A Q H X S+ 0 0 77 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.864 107.6 56.1 -65.2 -39.4 12.3 16.5 -5.8 95 95 A V H <>S+ 0 0 0 -4,-2.5 5,-2.5 2,-0.2 -1,-0.2 0.918 114.9 40.0 -57.0 -47.4 14.5 14.4 -3.4 96 96 A E H ><5S+ 0 0 56 -4,-1.7 3,-2.0 3,-0.2 -2,-0.2 0.900 112.9 52.7 -70.2 -44.6 16.0 12.6 -6.4 97 97 A R H 3<5S+ 0 0 89 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.883 106.2 56.5 -60.7 -34.0 16.3 15.7 -8.7 98 98 A S T 3<5S- 0 0 45 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.458 125.4-108.0 -73.8 -3.2 18.2 17.3 -5.7 99 99 A G T < 5S+ 0 0 69 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.579 78.5 123.5 87.7 13.6 20.6 14.4 -6.0 100 100 A F < - 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0 0 13 -4,-1.2 2,-0.5 -5,-0.1 -50,-0.2 -0.510 50.9-173.5 -66.0 117.4 19.1 2.5 29.1 794 410 B I E +G 742 0K 46 -52,-2.6 -52,-2.4 -2,-0.4 2,-0.3 -0.980 16.4 160.4-118.0 118.5 18.7 5.3 31.8 795 411 B I E +G 741 0K 14 -2,-0.5 2,-0.2 -54,-0.2 -54,-0.2 -0.856 17.6 174.6-137.8 94.3 19.2 4.4 35.5 796 412 B D E +G 740 0K 58 -56,-2.2 -57,-1.7 -2,-0.3 -56,-0.6 -0.689 53.1 43.6-101.7 158.4 19.9 7.5 37.6 797 413 B G S S+ 0 0 56 -59,-0.3 2,-0.3 -2,-0.2 -60,-0.3 0.042 108.5 58.6 97.8 -22.1 20.2 8.0 41.4 798 414 B I S S- 0 0 20 -3,-0.2 2,-0.3 -62,-0.1 -1,-0.2 -0.904 87.5-105.0-133.2 160.4 22.5 4.9 41.8 799 415 B K + 0 0 105 -2,-0.3 -73,-0.3 -65,-0.2 2,-0.3 -0.669 43.5 179.1 -85.9 139.9 25.8 3.7 40.4 800 416 B T - 0 0 24 -2,-0.3 3,-0.4 -75,-0.3 -75,-0.2 -0.909 42.2-120.6-136.4 169.1 25.6 0.9 37.7 801 417 B N S > S+ 0 0 3 -77,-1.2 4,-2.4 -2,-0.3 5,-0.1 0.070 78.7 112.4 -94.0 16.9 27.9 -1.2 35.4 802 418 B V H > S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.935 77.8 49.4 -55.3 -48.7 26.1 0.2 32.2 803 419 B D H > S+ 0 0 115 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.874 110.6 50.1 -59.7 -38.7 29.3 2.1 31.2 804 420 B L H > S+ 0 0 7 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 108.1 53.1 -65.2 -42.2 31.4 -1.1 31.7 805 421 B Q H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.905 107.5 51.2 -60.1 -40.8 28.9 -3.1 29.5 806 422 B I H X S+ 0 0 44 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.908 109.8 51.1 -60.7 -43.3 29.3 -0.4 26.7 807 423 B R H < S+ 0 0 112 -4,-1.8 4,-0.4 2,-0.2 -2,-0.2 0.892 110.0 48.8 -60.9 -44.7 33.1 -0.9 27.0 808 424 B I H >< S+ 0 0 1 -4,-2.4 3,-1.6 1,-0.2 6,-0.2 0.941 110.3 50.4 -63.0 -47.3 32.8 -4.8 26.7 809 425 B M H 3< S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.843 112.7 48.1 -58.4 -34.5 30.5 -4.4 23.6 810 426 B N T 3< S+ 0 0 89 -4,-1.8 2,-0.3 -5,-0.2 -1,-0.3 0.474 85.8 117.4 -81.6 -8.5 33.2 -2.0 22.1 811 427 B D <> - 0 0 9 -3,-1.6 4,-2.7 -4,-0.4 5,-0.1 -0.507 59.9-148.1 -68.7 123.9 36.0 -4.5 22.9 812 428 B E H > S+ 0 0 160 -2,-0.3 4,-1.3 2,-0.2 -1,-0.1 0.794 98.7 50.5 -63.3 -31.1 37.8 -5.7 19.7 813 429 B N H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.891 111.9 46.8 -74.7 -39.1 38.6 -9.2 21.3 814 430 B F H 4 S+ 0 0 2 -6,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.908 110.2 55.2 -64.9 -42.3 34.9 -9.6 22.4 815 431 B Q H < S+ 0 0 69 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.844 110.8 43.6 -61.4 -32.1 33.9 -8.5 18.9 816 432 B H H < S- 0 0 164 -4,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.880 110.7-149.2 -76.0 -39.4 36.1 -11.3 17.4 817 433 B G < + 0 0 11 -4,-2.1 -2,-0.1 -5,-0.1 -1,-0.1 -0.085 63.1 85.0 92.7 168.1 34.7 -13.7 20.1 818 434 B G + 0 0 32 1,-0.2 2,-0.1 -4,-0.1 -4,-0.1 0.673 51.9 163.6 75.6 22.1 36.1 -16.8 22.0 819 435 B T - 0 0 24 -6,-0.2 -1,-0.2 -5,-0.1 -204,-0.2 -0.440 35.3-118.7 -69.9 144.3 37.9 -14.8 24.8 820 436 B N > - 0 0 33 -228,-0.1 3,-1.4 -2,-0.1 4,-0.3 -0.165 28.8 -90.5 -78.6 178.1 38.7 -17.0 27.8 821 437 B I T 3 S+ 0 0 31 -230,-2.6 -204,-0.4 1,-0.3 4,-0.3 0.685 123.1 53.6 -62.5 -23.8 37.6 -16.8 31.5 822 438 B H T 3> S+ 0 0 38 -231,-0.3 4,-1.9 1,-0.2 -1,-0.3 0.506 83.4 93.3 -91.6 -6.6 40.5 -14.6 32.5 823 439 B Y H <> S+ 0 0 41 -3,-1.4 4,-2.7 1,-0.2 5,-0.2 0.889 81.2 48.5 -53.7 -57.1 39.9 -11.9 29.8 824 440 B L H > S+ 0 0 0 -4,-0.3 4,-2.6 -209,-0.3 -1,-0.2 0.901 113.0 48.4 -55.3 -43.6 37.7 -9.4 31.7 825 441 B E H > S+ 0 0 69 -208,-0.5 4,-2.6 -4,-0.3 -1,-0.2 0.879 112.9 48.6 -62.8 -40.2 40.1 -9.3 34.7 826 442 B K H < S+ 0 0 135 -4,-1.9 -2,-0.2 3,-0.2 -1,-0.2 0.894 112.0 49.9 -65.3 -41.6 43.1 -8.8 32.3 827 443 B K H < S+ 0 0 83 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.913 117.4 39.4 -62.3 -47.7 41.2 -6.0 30.5 828 444 B L H < 0 0 65 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.863 360.0 360.0 -72.4 -38.0 40.3 -4.2 33.8 829 445 B G < 0 0 102 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.1 0.500 360.0 360.0 127.0 360.0 43.7 -4.8 35.5