==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 24-JUN-03 1PUJ . COMPND 2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN YLQF; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR R.KNIEWEL,J.BUGLINO,C.D.LIMA,S.K.BURLEY,NEW YORK SGX . 261 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14330.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 189 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 21 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 36.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.1 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 1 1 0 2 1 0 2 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 2 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 PARALLEL BRIDGES PER LADDER . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 9 A H >> 0 0 173 0, 0.0 5,-0.9 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 -89.2 9.6 20.5 63.2 2 10 A M T 45 + 0 0 132 1,-0.2 154,-0.0 3,-0.1 0, 0.0 0.701 360.0 16.3 -59.2 -18.7 6.2 20.8 61.4 3 11 A A T >5S+ 0 0 50 3,-0.1 4,-2.5 2,-0.0 5,-0.3 0.695 125.5 53.2-119.7 -49.2 4.7 19.8 64.8 4 12 A K H >5S+ 0 0 116 1,-0.2 4,-1.6 2,-0.2 3,-0.2 0.967 117.7 35.8 -54.5 -62.5 7.4 20.2 67.4 5 13 A A H X5S+ 0 0 8 -4,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.820 115.2 60.6 -62.8 -30.8 8.3 23.8 66.7 6 14 A R H >< S+ 0 0 117 -4,-2.4 3,-1.3 1,-0.2 4,-0.3 0.956 113.7 47.2 -71.5 -53.2 2.2 27.5 73.9 12 20 A K H >< S+ 0 0 49 -4,-1.9 3,-1.2 1,-0.3 4,-0.3 0.698 98.3 71.3 -64.2 -21.1 4.3 30.7 74.0 13 21 A L G >< S+ 0 0 14 -4,-1.9 3,-0.9 1,-0.3 -1,-0.3 0.815 90.1 61.4 -65.4 -28.1 1.7 32.7 72.2 14 22 A K G < S+ 0 0 133 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.662 105.7 47.6 -71.5 -16.3 -0.4 32.5 75.4 15 23 A L G < S+ 0 0 99 -3,-1.2 2,-0.3 -4,-0.3 -1,-0.2 0.385 100.7 79.3-105.7 1.4 2.3 34.4 77.3 16 24 A I < - 0 0 4 -3,-0.9 99,-0.2 -4,-0.3 3,-0.1 -0.793 55.6-157.0-116.2 157.0 2.9 37.2 74.8 17 25 A D S S+ 0 0 25 97,-3.4 2,-0.3 -2,-0.3 98,-0.2 0.750 80.9 15.1 -94.2 -32.8 1.3 40.5 73.9 18 26 A I E -a 115 0A 0 96,-1.8 98,-2.2 25,-0.1 2,-0.4 -0.994 65.7-131.1-148.1 150.9 2.6 40.9 70.4 19 27 A V E -ab 116 45A 0 25,-2.5 27,-2.4 -2,-0.3 2,-0.8 -0.857 7.2-156.1-105.2 136.6 4.4 39.0 67.7 20 28 A Y E -ab 117 46A 0 96,-3.8 98,-2.2 -2,-0.4 2,-0.8 -0.896 15.7-165.0-109.0 97.9 7.5 40.1 65.9 21 29 A E E -ab 118 47A 6 25,-2.1 27,-3.0 -2,-0.8 2,-0.4 -0.774 5.4-156.0 -89.7 108.6 7.4 38.3 62.6 22 30 A L E +ab 119 48A 1 96,-2.7 98,-0.5 -2,-0.8 2,-0.3 -0.703 16.7 174.4 -86.8 129.9 10.8 38.5 60.9 23 31 A V E - b 0 49A 0 25,-2.8 27,-2.4 -2,-0.4 2,-0.7 -0.881 39.3-101.3-128.5 161.1 10.9 38.1 57.1 24 32 A D E > - b 0 50A 6 3,-0.4 3,-2.2 -2,-0.3 7,-0.2 -0.757 24.5-147.3 -84.8 115.5 13.7 38.5 54.6 25 33 A A T 3 S+ 0 0 0 25,-2.7 -1,-0.1 -2,-0.7 31,-0.1 0.741 97.4 64.8 -55.3 -24.5 13.4 41.9 52.9 26 34 A R T 3 S+ 0 0 8 1,-0.3 232,-2.3 24,-0.2 233,-0.5 0.762 123.5 15.7 -69.9 -23.8 14.8 40.3 49.7 27 35 A I S <> S+ 0 0 0 -3,-2.2 4,-1.8 230,-0.2 -3,-0.4 -0.482 72.4 169.5-149.3 69.2 11.7 38.1 49.6 28 36 A P T 4 S+ 0 0 0 0, 0.0 -3,-0.1 0, 0.0 -2,-0.1 0.736 82.8 36.5 -54.5 -30.2 9.0 39.6 51.9 29 37 A M T >4 S+ 0 0 97 2,-0.1 3,-1.9 1,-0.1 -2,-0.1 0.908 116.4 47.6 -90.7 -53.4 6.3 37.2 50.6 30 38 A S T 34 S+ 0 0 4 1,-0.3 -1,-0.1 -6,-0.1 140,-0.1 0.678 109.8 56.6 -64.3 -17.4 8.2 34.0 49.9 31 39 A S T 3< S+ 0 0 1 -4,-1.8 89,-0.5 -7,-0.2 2,-0.5 0.316 82.2 103.9 -96.9 7.6 9.8 34.2 53.4 32 40 A R S < S- 0 0 42 -3,-1.9 -9,-0.1 -5,-0.1 87,-0.0 -0.797 70.5-136.0 -90.0 129.9 6.4 34.4 55.2 33 41 A N > - 0 0 5 -2,-0.5 4,-2.5 1,-0.2 5,-0.2 -0.757 15.6-169.0 -89.4 103.3 5.6 31.0 56.8 34 42 A P H > S+ 0 0 61 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.863 85.1 57.6 -59.0 -38.4 1.9 30.3 56.1 35 43 A M H > S+ 0 0 32 1,-0.2 4,-0.7 2,-0.2 123,-0.1 0.936 112.7 39.5 -58.5 -48.3 1.8 27.4 58.6 36 44 A I H >> S+ 0 0 2 1,-0.2 3,-1.0 2,-0.2 4,-0.9 0.900 109.8 58.1 -70.2 -42.8 2.9 29.7 61.5 37 45 A E H >< S+ 0 0 41 -4,-2.5 3,-0.6 1,-0.3 -1,-0.2 0.842 98.6 62.4 -57.6 -32.1 0.8 32.7 60.5 38 46 A D H 3< S+ 0 0 136 -4,-1.7 3,-0.5 1,-0.3 -1,-0.3 0.857 102.2 49.6 -61.9 -35.1 -2.3 30.5 60.8 39 47 A I H << S+ 0 0 38 -3,-1.0 2,-0.4 -4,-0.7 -1,-0.3 0.701 99.7 71.5 -75.2 -20.9 -1.6 30.0 64.5 40 48 A L << + 0 0 10 -4,-0.9 2,-0.4 -3,-0.6 -1,-0.2 -0.180 66.1 149.8 -89.3 41.1 -1.2 33.8 64.8 41 49 A K S S- 0 0 164 -3,-0.5 -3,-0.1 -2,-0.4 -4,-0.0 -0.626 72.9 -8.2 -82.7 131.2 -4.8 34.8 64.4 42 50 A N S S+ 0 0 145 -2,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.104 97.4 126.1 77.5 -22.3 -5.9 37.9 66.3 43 51 A K S S- 0 0 58 1,-0.1 -1,-0.2 -25,-0.0 -25,-0.1 -0.490 71.0-107.8 -68.7 131.2 -2.6 38.3 68.1 44 52 A P + 0 0 41 0, 0.0 -25,-2.5 0, 0.0 2,-0.3 -0.246 51.3 171.3 -56.6 148.7 -1.1 41.7 67.6 45 53 A R E -b 19 0A 57 -27,-0.2 28,-0.5 -3,-0.1 2,-0.4 -0.998 32.1-148.4-160.5 158.7 1.9 41.7 65.4 46 54 A I E -b 20 0A 0 -27,-2.4 -25,-2.1 -2,-0.3 2,-0.6 -0.998 21.8-135.4-130.0 132.1 4.5 43.7 63.5 47 55 A M E -bc 21 74A 0 26,-2.9 28,-2.6 -2,-0.4 2,-0.7 -0.796 20.2-160.5 -89.0 123.0 6.1 42.5 60.2 48 56 A L E -bc 22 75A 0 -27,-3.0 -25,-2.8 -2,-0.6 2,-1.4 -0.914 8.0-155.4-108.9 107.5 9.8 43.1 60.4 49 57 A L E -bc 23 76A 0 26,-2.5 28,-2.6 -2,-0.7 3,-0.4 -0.703 26.0-168.0 -82.9 94.5 11.5 43.1 57.0 50 58 A N E +b 24 0A 5 -27,-2.4 -25,-2.7 -2,-1.4 -24,-0.2 -0.284 61.5 37.2 -79.7 167.7 15.0 42.2 58.2 51 59 A K >> + 0 0 35 26,-0.2 3,-1.8 -27,-0.2 4,-0.5 0.820 67.0 154.6 57.3 33.5 18.2 42.4 56.1 52 60 A A G >4 + 0 0 13 25,-2.3 3,-0.6 -3,-0.4 26,-0.2 0.758 65.5 65.7 -61.1 -24.1 16.8 45.6 54.5 53 61 A D G 34 S+ 0 0 43 24,-0.3 -1,-0.3 1,-0.2 4,-0.1 0.726 101.9 48.3 -70.3 -20.7 20.4 46.6 53.8 54 62 A K G <4 S+ 0 0 35 -3,-1.8 202,-2.4 201,-0.1 -1,-0.2 0.526 103.8 76.9 -95.0 -10.1 20.7 43.6 51.4 55 63 A A S << S- 0 0 0 -3,-0.6 2,-0.6 -4,-0.5 202,-0.2 -0.573 96.0 -88.2-102.8 165.4 17.5 44.3 49.5 56 64 A D > - 0 0 34 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 -0.600 37.0-147.6 -72.2 115.0 16.4 46.8 46.8 57 65 A A H > S+ 0 0 60 -2,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.854 94.7 51.2 -53.7 -41.4 15.3 49.8 48.9 58 66 A A H > S+ 0 0 67 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.910 112.0 46.2 -65.3 -42.4 12.7 50.9 46.4 59 67 A V H > S+ 0 0 6 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.901 109.3 55.4 -67.4 -39.0 11.1 47.4 46.3 60 68 A T H X S+ 0 0 6 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.904 105.7 52.0 -58.8 -42.1 11.2 47.2 50.1 61 69 A Q H X S+ 0 0 84 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.894 108.0 52.5 -61.3 -38.8 9.2 50.4 50.2 62 70 A Q H X S+ 0 0 97 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.910 109.2 48.7 -64.5 -42.5 6.7 48.9 47.9 63 71 A W H X S+ 0 0 2 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.866 108.9 53.0 -65.4 -37.4 6.3 45.8 50.1 64 72 A K H X S+ 0 0 50 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.924 110.7 46.3 -65.1 -42.7 5.8 47.9 53.2 65 73 A E H X S+ 0 0 86 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.913 111.1 54.7 -63.6 -40.6 3.0 49.9 51.5 66 74 A H H < S+ 0 0 46 -4,-2.2 4,-0.2 2,-0.2 -2,-0.2 0.903 113.0 40.5 -58.4 -46.3 1.6 46.6 50.4 67 75 A F H ><>S+ 0 0 0 -4,-2.3 5,-2.4 2,-0.2 3,-1.4 0.919 114.5 51.7 -70.6 -45.0 1.5 45.1 53.9 68 76 A E H ><5S+ 0 0 78 -4,-2.7 3,-2.1 1,-0.3 -2,-0.2 0.895 104.3 57.1 -58.8 -42.0 0.3 48.3 55.6 69 77 A N T 3<5S+ 0 0 136 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.624 105.9 53.1 -65.8 -10.9 -2.6 48.7 53.1 70 78 A Q T < 5S- 0 0 103 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.312 128.8 -97.0-103.2 3.6 -3.6 45.2 54.3 71 79 A G T < 5S+ 0 0 67 -3,-2.1 2,-0.6 1,-0.2 -3,-0.2 0.663 84.1 130.4 89.2 18.3 -3.7 46.2 57.9 72 80 A I < - 0 0 14 -5,-2.4 -1,-0.2 -8,-0.1 2,-0.2 -0.898 54.2-138.5-111.5 110.0 -0.2 44.9 58.7 73 81 A R - 0 0 121 -2,-0.6 -26,-2.9 -28,-0.5 2,-0.4 -0.464 31.2-170.5 -64.1 128.6 2.2 47.3 60.5 74 82 A S E -c 47 0A 8 -28,-0.2 2,-0.4 -2,-0.2 -26,-0.2 -0.962 18.4-175.5-129.9 143.4 5.6 46.9 58.9 75 83 A L E -c 48 0A 39 -28,-2.6 -26,-2.5 -2,-0.4 2,-0.5 -0.999 17.4-144.2-137.2 132.4 9.1 48.0 59.6 76 84 A S E +c 49 0A 19 -2,-0.4 2,-0.3 -28,-0.2 -26,-0.2 -0.834 34.2 169.5 -96.6 130.4 12.2 47.5 57.5 77 85 A I - 0 0 0 -28,-2.6 -25,-2.3 -2,-0.5 2,-0.5 -0.909 39.5-140.3-140.2 166.8 15.3 47.0 59.6 78 86 A N > - 0 0 11 5,-2.1 4,-1.7 -2,-0.3 7,-0.2 -0.965 15.2-170.0-127.3 105.1 19.0 45.9 59.7 79 87 A S T 4 S+ 0 0 2 -2,-0.5 52,-0.1 1,-0.2 -1,-0.1 0.675 81.9 59.6 -72.9 -16.6 19.6 43.8 62.7 80 88 A V T 4 S+ 0 0 88 1,-0.1 -1,-0.2 3,-0.1 44,-0.0 0.935 121.9 17.8 -77.5 -47.2 23.4 43.9 62.2 81 89 A N T 4 S- 0 0 110 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.502 107.0-111.6-104.1 -5.7 23.9 47.7 62.4 82 90 A G >< + 0 0 19 -4,-1.7 3,-2.3 1,-0.2 4,-0.5 0.372 52.1 164.5 96.8 -6.6 20.7 48.7 64.1 83 91 A Q T 3 S- 0 0 110 1,-0.3 -5,-2.1 -5,-0.2 -1,-0.2 -0.240 75.7 -1.6 -49.3 118.7 18.9 50.6 61.3 84 92 A G T > S+ 0 0 7 -7,-0.2 3,-1.5 1,-0.1 4,-0.3 0.350 94.5 114.9 82.0 -5.9 15.2 50.9 62.3 85 93 A L G X> + 0 0 16 -3,-2.3 3,-1.1 1,-0.3 4,-0.5 0.768 67.3 68.5 -68.9 -20.8 15.4 49.0 65.6 86 94 A N G 34 S+ 0 0 114 -4,-0.5 -1,-0.3 1,-0.2 -3,-0.1 0.535 94.1 58.7 -73.3 -5.9 14.5 52.2 67.4 87 95 A Q G <> S+ 0 0 95 -3,-1.5 4,-2.2 2,-0.1 -1,-0.2 0.574 86.1 78.7 -98.6 -12.2 11.0 52.0 65.9 88 96 A I H <> S+ 0 0 0 -3,-1.1 4,-2.5 -4,-0.3 -2,-0.1 0.947 95.4 41.1 -62.7 -54.4 10.1 48.6 67.3 89 97 A V H X S+ 0 0 30 -4,-0.5 4,-2.3 2,-0.2 5,-0.2 0.930 115.7 50.8 -62.6 -46.3 9.2 49.6 70.9 90 98 A P H > S+ 0 0 55 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.941 113.0 46.0 -56.8 -47.3 7.4 52.7 69.9 91 99 A A H X S+ 0 0 17 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.918 110.7 53.9 -60.7 -43.4 5.3 50.8 67.3 92 100 A S H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.868 107.6 49.9 -59.9 -40.3 4.6 48.1 69.9 93 101 A K H X S+ 0 0 105 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.868 110.4 50.0 -67.7 -38.4 3.3 50.5 72.4 94 102 A E H >< S+ 0 0 124 -4,-1.8 3,-0.7 -5,-0.2 4,-0.4 0.924 111.6 48.2 -66.3 -43.8 0.9 52.1 69.9 95 103 A I H 3< S+ 0 0 44 -4,-2.3 3,-0.3 1,-0.2 4,-0.3 0.870 119.4 38.6 -63.9 -37.8 -0.4 48.8 68.8 96 104 A L H 3X S+ 0 0 3 -4,-1.9 4,-2.9 -5,-0.2 5,-0.3 0.371 86.1 104.5 -95.2 4.0 -1.0 47.7 72.4 97 105 A Q H S+ 0 0 146 -4,-0.4 4,-1.9 -3,-0.3 -1,-0.2 0.927 114.6 47.5 -61.6 -46.8 -5.9 50.1 73.8 99 107 A K H > S+ 0 0 63 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.966 116.4 43.4 -59.0 -54.2 -5.2 46.8 75.5 100 108 A F H X S+ 0 0 39 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.899 112.3 51.8 -60.4 -44.3 -2.9 48.3 78.1 101 109 A D H X S+ 0 0 78 -4,-2.9 4,-2.1 -5,-0.3 -1,-0.2 0.864 110.1 51.1 -62.1 -34.0 -5.1 51.3 78.8 102 110 A R H X S+ 0 0 125 -4,-1.9 4,-0.9 -5,-0.2 -1,-0.2 0.895 110.7 47.6 -69.2 -40.9 -8.0 48.9 79.3 103 111 A M H ><>S+ 0 0 68 -4,-2.1 5,-2.1 2,-0.2 3,-0.7 0.928 111.3 51.5 -65.7 -44.6 -6.0 46.9 81.8 104 112 A R H ><5S+ 0 0 157 -4,-2.8 3,-1.7 1,-0.3 -2,-0.2 0.916 107.0 52.4 -58.3 -45.4 -4.8 50.0 83.6 105 113 A A H 3<5S+ 0 0 92 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.721 106.8 54.7 -64.5 -21.7 -8.4 51.3 84.0 106 114 A K T <<5S- 0 0 159 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.419 125.8 -99.4 -91.6 -0.2 -9.4 47.9 85.5 107 115 A G T < 5S+ 0 0 65 -3,-1.7 2,-0.7 -4,-0.3 -3,-0.2 0.402 81.6 130.0 100.3 -3.3 -6.7 48.2 88.2 108 116 A V < - 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0 0 134 -2,-0.4 3,-1.4 1,-0.2 -2,-0.1 -0.416 25.8-141.3 -61.9 124.4 20.9 24.1 54.4 178 197 A D T 3 S+ 0 0 51 1,-0.2 3,-0.5 -2,-0.2 5,-0.3 0.477 91.6 75.5 -67.4 -0.0 22.9 23.9 51.1 179 198 A S T 3 S+ 0 0 104 1,-0.2 -1,-0.2 3,-0.1 -2,-0.1 0.742 95.1 44.6 -84.3 -24.4 23.8 20.3 52.1 180 199 A I S < S+ 0 0 127 -3,-1.4 2,-0.3 2,-0.0 -1,-0.2 0.076 108.0 67.5-107.2 23.9 20.5 18.7 51.3 181 200 A I S S- 0 0 52 -3,-0.5 2,-1.4 -5,-0.1 3,-0.1 -0.969 87.9-103.1-142.5 157.3 19.9 20.5 47.9 182 201 A N >> - 0 0 96 -2,-0.3 4,-1.1 1,-0.2 3,-0.9 -0.657 35.4-169.5 -80.8 94.0 21.2 20.7 44.4 183 202 A L H 3> S+ 0 0 38 -2,-1.4 4,-2.0 -5,-0.3 -1,-0.2 0.770 78.6 62.3 -55.6 -32.9 23.1 23.9 44.7 184 203 A Q H 3> S+ 0 0 60 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.868 99.4 54.2 -65.6 -35.1 23.8 24.2 40.9 185 204 A D H <> S+ 0 0 96 -3,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.877 109.8 48.9 -64.5 -34.8 20.0 24.4 40.2 186 205 A V H X S+ 0 0 6 -4,-1.1 4,-2.6 2,-0.2 -2,-0.2 0.873 110.5 50.0 -70.6 -37.2 19.9 27.3 42.7 187 206 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.864 109.2 51.8 -68.5 -37.0 22.9 28.9 40.9 188 207 A V H X S+ 0 0 27 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.928 111.1 47.8 -64.0 -43.4 21.1 28.5 37.6 189 208 A F H X S+ 0 0 29 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.926 111.7 51.2 -61.7 -44.3 18.0 30.2 39.0 190 209 A G H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.928 110.6 46.9 -59.4 -47.2 20.2 32.9 40.5 191 210 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.910 112.1 49.3 -63.5 -44.1 22.0 33.7 37.2 192 211 A R H X S+ 0 0 142 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.899 111.4 51.1 -62.6 -38.8 18.7 33.7 35.2 193 212 A F H X S+ 0 0 14 -4,-2.3 4,-2.5 -5,-0.2 5,-0.5 0.945 111.7 46.4 -62.0 -48.5 17.3 36.1 37.7 194 213 A L H X S+ 0 0 1 -4,-2.6 4,-2.1 1,-0.2 8,-0.2 0.900 110.6 52.9 -61.2 -41.9 20.3 38.4 37.5 195 214 A E H < S+ 0 0 57 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.833 116.1 40.4 -62.8 -33.2 20.2 38.3 33.7 196 215 A E H < S+ 0 0 148 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.797 133.1 18.2 -86.8 -30.5 16.5 39.3 33.7 197 216 A H H < S+ 0 0 100 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.718 136.6 22.4-113.8 -30.0 16.6 41.9 36.5 198 217 A Y X + 0 0 28 -4,-2.1 4,-1.6 -5,-0.5 3,-0.3 -0.326 65.3 148.3-138.4 55.8 20.2 43.0 37.0 199 218 A P H > S+ 0 0 40 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.867 72.4 57.2 -57.4 -41.5 22.1 42.3 33.8 200 219 A E H > S+ 0 0 125 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.894 107.0 48.9 -60.2 -39.8 24.5 45.2 34.2 201 220 A R H > S+ 0 0 86 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.877 109.2 52.4 -67.6 -37.8 25.6 44.0 37.6 202 221 A L H X S+ 0 0 0 -4,-1.6 4,-1.7 -8,-0.2 6,-0.2 0.921 111.8 46.8 -63.2 -44.6 26.2 40.5 36.3 203 222 A K H <>S+ 0 0 56 -4,-2.4 5,-3.1 1,-0.2 4,-0.3 0.962 115.1 43.7 -63.0 -53.3 28.4 41.9 33.5 204 223 A E H ><5S+ 0 0 152 -4,-2.5 3,-1.0 3,-0.2 -2,-0.2 0.890 109.1 58.8 -60.9 -40.3 30.5 44.2 35.7 205 224 A R H 3<5S+ 0 0 68 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.918 121.3 24.7 -56.1 -47.7 30.9 41.6 38.4 206 225 A Y T 3<5S- 0 0 3 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.122 110.6-113.3-105.8 20.4 32.5 39.1 36.0 207 226 A G T < 5 + 0 0 55 -3,-1.0 2,-0.6 -4,-0.3 -3,-0.2 0.898 55.1 169.0 50.0 47.2 33.8 41.6 33.6 208 227 A L < - 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