==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOTOSYNTHESIS 09-APR-08 3CS5 . COMPND 2 MOLECULE: PHYCOBILISOME DEGRADATION PROTEIN NBLA; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCOCCUS SP.; . AUTHOR M.DINES,E.SENDERSKY,R.SCHWARZ,N.ADIR . 192 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14844.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 80.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 19.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 58.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 2 0 0 0 0 2 0 1 2 3 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 12 A V >> 0 0 114 0, 0.0 3,-2.2 0, 0.0 4,-0.9 0.000 360.0 360.0 360.0 -84.2 31.6 37.4 23.4 2 13 A E H >> + 0 0 152 1,-0.3 3,-2.5 2,-0.2 4,-1.5 0.788 360.0 51.5 -34.4 -67.2 35.1 36.1 22.5 3 14 A Q H 3> S+ 0 0 76 1,-0.3 4,-3.7 2,-0.2 -1,-0.3 0.783 101.0 65.0 -43.8 -36.1 34.1 32.6 21.7 4 15 A Q H <> S+ 0 0 108 -3,-2.2 4,-2.0 2,-0.2 -1,-0.3 0.881 103.7 45.7 -61.7 -33.0 31.4 34.1 19.4 5 16 A F H X S+ 0 0 97 -4,-2.0 4,-1.2 1,-0.2 3,-0.9 0.922 113.6 52.9 -57.5 -41.5 32.5 32.8 13.3 9 20 A K H 3X S+ 0 0 122 -4,-3.4 4,-1.1 1,-0.3 -2,-0.2 0.901 105.6 52.2 -59.9 -45.0 36.2 32.2 12.9 10 21 A Y H 3< S+ 0 0 76 -4,-3.0 4,-0.4 -5,-0.2 -1,-0.3 0.639 102.8 64.6 -69.9 -7.9 35.6 28.4 12.8 11 22 A R H XX S+ 0 0 68 -3,-0.9 3,-1.9 -4,-0.8 4,-1.1 0.968 96.6 50.4 -77.4 -54.2 33.0 28.9 10.1 12 23 A Q H >< S+ 0 0 106 -4,-1.2 3,-1.0 1,-0.3 5,-0.2 0.905 106.8 55.6 -45.2 -52.6 35.2 30.3 7.3 13 24 A Q T 3< S+ 0 0 110 -4,-1.1 4,-0.3 1,-0.2 -1,-0.3 0.724 115.1 40.4 -52.0 -27.9 37.6 27.4 7.7 14 25 A V T <4 S+ 0 0 4 -3,-1.9 -1,-0.2 -4,-0.4 -2,-0.2 0.424 100.2 67.1-109.5 -11.9 34.6 25.0 7.1 15 26 A R S << S+ 0 0 159 -4,-1.1 -1,-0.2 -3,-1.0 -2,-0.1 0.121 112.9 36.4-100.0 15.7 32.7 26.8 4.4 16 27 A D S S+ 0 0 137 -3,-0.2 -2,-0.2 -4,-0.2 -1,-0.1 0.384 92.9 107.0-127.4 -29.3 35.6 26.1 2.0 17 28 A I S S- 0 0 42 -4,-0.3 5,-0.1 -5,-0.2 -3,-0.0 -0.322 70.9-118.1 -60.3 141.1 36.6 22.7 3.4 18 29 A S > - 0 0 68 3,-0.0 4,-0.7 -3,-0.0 5,-0.1 -0.063 28.4 -86.0 -76.3 174.0 35.6 19.8 1.1 19 30 A R T >4 S+ 0 0 157 2,-0.2 3,-1.6 1,-0.2 4,-0.0 0.929 121.7 23.6 -45.6 -81.5 33.3 16.8 1.5 20 31 A E G >> S+ 0 0 131 1,-0.3 3,-3.1 2,-0.2 4,-1.5 0.936 123.0 57.9 -60.1 -42.5 35.4 14.1 3.2 21 32 A D G 34 S+ 0 0 100 1,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.565 105.7 49.7 -65.8 -8.2 37.7 16.7 4.6 22 33 A L G << S+ 0 0 1 -3,-1.6 -1,-0.3 -4,-0.7 -2,-0.2 0.242 109.2 56.8-106.4 11.3 34.6 18.3 6.3 23 34 A E T X> S+ 0 0 37 -3,-3.1 3,-1.8 -5,-0.1 4,-0.7 0.749 93.4 60.4-105.1 -37.7 33.8 14.8 7.6 24 35 A D H 3X S+ 0 0 82 -4,-1.5 4,-1.1 1,-0.3 -3,-0.1 0.609 99.6 58.9 -74.4 -12.5 36.9 13.8 9.5 25 36 A L H 34 S+ 0 0 67 2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.170 104.6 51.7-100.2 20.2 36.5 16.7 11.8 26 37 A F H <> S+ 0 0 11 -3,-1.8 4,-1.1 3,-0.1 -2,-0.2 0.474 109.5 47.8-119.3 -13.0 33.1 15.3 12.7 27 38 A I H < S+ 0 0 25 -4,-0.7 4,-0.4 2,-0.2 -2,-0.2 0.787 112.5 48.0 -89.8 -35.4 34.4 11.9 13.6 28 39 A E T X S+ 0 0 103 -4,-1.1 4,-1.6 2,-0.2 -3,-0.1 0.634 112.4 55.0 -73.4 -18.6 37.2 13.2 15.7 29 40 A V H > S+ 0 0 4 2,-0.3 4,-2.0 1,-0.2 5,-0.4 0.933 100.1 50.7 -84.0 -53.2 34.7 15.4 17.4 30 41 A V H < S+ 0 0 4 -4,-1.1 4,-0.2 1,-0.3 -1,-0.2 0.603 116.1 48.4 -68.3 -10.5 32.0 13.0 18.6 31 42 A R H > S+ 0 0 81 -4,-0.4 4,-1.8 2,-0.1 -1,-0.3 0.799 111.7 51.4 -74.8 -50.2 35.1 11.4 20.0 32 43 A Q H >X S+ 0 0 85 -4,-1.6 3,-1.8 1,-0.2 4,-0.9 0.946 108.5 46.2 -44.5 -80.9 36.1 14.8 21.4 33 44 A K H >X S+ 0 0 35 -4,-2.0 4,-1.4 1,-0.3 3,-0.6 0.735 110.6 54.8 -31.3 -45.2 32.9 15.7 23.2 34 45 A M H 3> S+ 0 0 25 -5,-0.4 4,-2.0 2,-0.3 5,-0.3 0.878 97.1 62.7 -68.4 -37.7 32.7 12.2 24.8 35 46 A A H << S+ 0 0 58 -3,-1.8 -1,-0.3 -4,-1.8 -2,-0.2 0.766 109.5 43.4 -53.3 -30.7 36.2 12.6 26.2 36 47 A H H XX S+ 0 0 41 -4,-0.9 4,-4.1 -3,-0.6 3,-1.7 0.792 102.6 66.8 -80.5 -34.8 34.6 15.4 28.1 37 48 A E H 3X S+ 0 0 100 -4,-1.4 4,-2.2 1,-0.3 -2,-0.2 0.921 107.0 40.6 -51.9 -49.2 31.5 13.3 28.8 38 49 A N H 3X S+ 0 0 95 -4,-2.0 4,-0.6 3,-0.2 -1,-0.3 0.439 117.1 55.3 -67.5 -9.7 33.8 11.1 31.0 39 50 A I H <> S+ 0 0 65 -3,-1.7 4,-2.8 -5,-0.3 -2,-0.2 0.858 109.1 39.2-101.5 -48.4 35.3 14.4 32.2 40 51 A F H X S+ 0 0 84 -4,-4.1 4,-3.0 2,-0.2 5,-0.3 0.983 121.8 47.0 -60.7 -53.9 32.3 16.3 33.4 41 52 A K H X S+ 0 0 114 -4,-2.2 4,-2.5 -5,-0.3 3,-0.3 0.938 114.0 47.1 -43.1 -58.3 31.1 12.9 34.8 42 53 A G H < S+ 0 0 18 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.870 113.9 49.6 -48.4 -42.2 34.6 12.6 36.1 43 54 A M H < S+ 0 0 30 -4,-2.8 3,-0.4 1,-0.2 -2,-0.3 0.777 111.3 46.9 -72.6 -30.9 34.2 16.2 37.3 44 55 A I H X S+ 0 0 83 -4,-3.0 4,-0.6 -3,-0.3 2,-0.5 0.709 108.6 54.5 -90.0 -18.1 30.8 15.5 39.0 45 56 A R T < S+ 0 0 183 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.1 -0.455 106.8 52.4-108.3 70.5 32.0 12.3 40.7 46 57 A Q T 4 S+ 0 0 156 -2,-0.5 -1,-0.2 -3,-0.4 -2,-0.2 0.124 102.8 59.1-176.4 -19.7 34.9 14.3 42.3 47 58 A G T 4 0 0 64 -3,-0.3 -2,-0.2 -4,-0.2 -3,-0.1 0.629 360.0 360.0 -97.4 -31.8 32.6 16.9 43.7 48 59 A S < 0 0 157 -4,-0.6 -3,-0.1 0, 0.0 -4,-0.0 0.408 360.0 360.0 -96.7 360.0 30.5 14.5 45.8 49 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 50 12 B V > 0 0 130 0, 0.0 4,-1.9 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -81.2 33.4 0.5 25.1 51 13 B E H > + 0 0 152 1,-0.2 4,-2.0 2,-0.2 5,-0.0 0.788 360.0 55.0 -51.0 -38.0 30.0 2.0 24.5 52 14 B Q H > S+ 0 0 53 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.947 105.2 50.8 -61.0 -55.4 31.5 5.3 23.4 53 15 B Q H > S+ 0 0 126 1,-0.3 4,-1.4 -3,-0.2 -2,-0.2 0.862 110.1 52.7 -45.7 -48.8 33.7 3.6 20.8 54 16 B F H X S+ 0 0 119 -4,-1.9 4,-1.1 2,-0.2 -1,-0.3 0.867 109.8 49.0 -50.8 -51.3 30.4 2.0 19.7 55 17 B D H >X S+ 0 0 33 -4,-2.0 3,-2.0 2,-0.2 4,-1.3 0.963 105.3 53.0 -56.8 -63.3 28.8 5.4 19.4 56 18 B L H 3X S+ 0 0 19 -4,-2.3 4,-1.2 1,-0.3 -1,-0.2 0.785 108.6 54.6 -45.4 -38.8 31.4 7.2 17.4 57 19 B Q H 3X S+ 0 0 98 -4,-1.4 4,-2.3 -5,-0.2 -1,-0.3 0.763 103.6 52.6 -64.9 -37.1 31.1 4.3 14.9 58 20 B K H < S+ 0 0 110 -4,-1.4 3,-4.0 2,-0.1 4,-0.3 0.919 110.3 63.2 -70.6 -86.9 26.1 7.8 9.7 63 25 B V H >< S+ 0 0 4 -4,-2.4 3,-5.9 1,-0.3 -3,-0.2 0.533 92.4 68.3 -19.5 -58.4 28.2 10.8 8.8 64 26 B R T 3< S+ 0 0 170 -4,-0.7 -1,-0.3 1,-0.3 -2,-0.1 0.755 102.0 49.6 -25.8 -37.2 29.4 9.1 5.6 65 27 B D T < S+ 0 0 150 -3,-4.0 -1,-0.3 -4,-0.1 -2,-0.2 0.519 97.6 95.4 -89.8 -6.4 25.8 9.5 4.5 66 28 B I < - 0 0 53 -3,-5.9 2,-0.3 -4,-0.3 -43,-0.0 0.107 66.4-113.1 -87.6-163.7 25.5 13.2 5.4 67 29 B S >> - 0 0 53 1,-0.1 4,-2.6 -44,-0.0 5,-0.6 -0.925 27.8 -97.9-146.1 147.5 26.0 16.4 3.4 68 30 B R H >5S+ 0 0 138 -2,-0.3 4,-0.8 1,-0.3 -1,-0.1 0.759 123.9 28.1 -37.9 -44.8 28.2 19.5 3.1 69 31 B E H >5S+ 0 0 130 2,-0.2 4,-2.8 3,-0.2 5,-0.3 0.759 114.6 60.3 -92.9 -28.3 25.9 21.6 5.2 70 32 B D H >5S+ 0 0 98 -3,-0.4 4,-0.8 2,-0.2 -2,-0.2 0.757 117.0 35.4 -74.3 -20.3 24.3 19.0 7.4 71 33 B L H X5S+ 0 0 4 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.714 111.2 64.3 -92.5 -29.8 27.8 18.2 8.6 72 34 B E H XX S+ 0 0 0 -4,-0.6 4,-2.1 1,-0.2 3,-2.0 0.946 109.5 31.5 -45.7 -69.1 30.6 20.7 17.3 79 41 B V H 3X S+ 0 0 22 -4,-1.3 4,-0.5 1,-0.3 -1,-0.2 0.584 109.7 70.5 -70.8 -15.2 32.7 23.7 18.5 80 42 B R H 3< S+ 0 0 135 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.605 112.8 29.4 -75.6 -9.4 29.4 25.4 19.5 81 43 B Q H X> S+ 0 0 90 -3,-2.0 4,-1.6 -4,-0.5 3,-1.2 0.766 110.3 59.3-112.3 -49.8 29.4 22.7 22.3 82 44 B K H 3< S+ 0 0 9 -4,-2.1 -3,-0.2 1,-0.3 -2,-0.1 0.577 101.8 59.8 -67.2 -7.5 32.9 21.7 23.2 83 45 B M T >X S+ 0 0 19 -4,-0.5 4,-2.5 -5,-0.2 3,-0.7 0.810 108.3 43.8 -79.6 -37.9 33.6 25.4 24.1 84 46 B A H <> S+ 0 0 44 -3,-1.2 4,-2.5 2,-0.2 -2,-0.3 0.756 107.1 60.9 -67.7 -28.3 30.8 24.9 26.6 85 47 B H H 3< S+ 0 0 45 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.436 110.7 41.4 -82.6 0.8 32.6 21.6 27.3 86 48 B E H <4 S+ 0 0 50 -3,-0.7 -2,-0.2 -5,-0.3 3,-0.2 0.665 115.5 45.5-108.9 -40.1 35.4 23.9 28.3 87 49 B N H >X S+ 0 0 57 -4,-2.5 4,-1.5 2,-0.2 3,-1.0 0.953 118.2 44.3 -68.7 -43.8 33.6 26.6 30.2 88 50 B I T 3< S+ 0 0 83 -4,-2.5 4,-0.3 1,-0.3 -1,-0.2 0.491 120.1 44.2 -74.5 -3.7 31.5 23.9 32.1 89 51 B F T 34 S+ 0 0 79 -6,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.303 109.4 56.5-113.2 -3.2 34.9 22.2 32.4 90 52 B K T <4 S+ 0 0 98 -3,-1.0 -2,-0.2 -4,-0.2 4,-0.2 0.571 107.2 48.3-102.5 -18.9 36.6 25.5 33.3 91 53 B G S X S+ 0 0 24 -4,-1.5 4,-0.7 2,-0.2 3,-0.4 0.882 106.0 56.5 -84.5 -47.5 34.2 26.0 36.2 92 54 B M T 4 S+ 0 0 38 -4,-0.3 3,-0.2 1,-0.3 -2,-0.1 0.730 112.3 42.4 -58.6 -22.7 34.7 22.5 37.6 93 55 B I T >4 S+ 0 0 85 1,-0.2 3,-1.2 -4,-0.1 -1,-0.3 0.668 95.6 81.7 -96.2 -12.4 38.4 23.2 37.8 94 56 B R T 34 S+ 0 0 192 -3,-0.4 -2,-0.2 1,-0.3 -1,-0.2 0.786 75.2 75.2 -54.2 -26.5 37.7 26.6 39.2 95 57 B Q T 3< + 0 0 147 -4,-0.7 2,-1.5 -3,-0.2 -1,-0.3 0.134 56.4 120.7 -80.4 26.9 37.2 24.9 42.6 96 58 B G < 0 0 36 -3,-1.2 -1,-0.2 1,-0.1 -2,-0.1 -0.327 360.0 360.0 -82.5 54.0 41.0 24.5 43.0 97 59 B S 0 0 98 -2,-1.5 -1,-0.1 56,-0.0 35,-0.1 -0.600 360.0 360.0-129.8 360.0 40.9 26.6 46.2 98 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 99 12 C V > 0 0 97 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -69.2 48.0 0.2 52.3 100 13 C E T 4 + 0 0 165 2,-0.2 0, 0.0 3,-0.2 0, 0.0 0.171 360.0 35.8 -85.0 14.8 51.4 1.8 51.8 101 14 C Q T >> S+ 0 0 63 3,-0.0 3,-3.0 81,-0.0 4,-1.9 0.438 117.9 48.4-105.8 -54.5 49.3 4.9 52.2 102 15 C Q H 3> S+ 0 0 111 1,-0.3 4,-1.7 2,-0.3 5,-0.2 0.804 107.2 57.5 -53.7 -30.5 46.9 3.5 54.8 103 16 C F H 3X S+ 0 0 124 -4,-3.1 4,-0.6 1,-0.2 -1,-0.3 0.790 110.4 47.1 -67.6 -24.5 49.9 2.2 56.7 104 17 C D H <> S+ 0 0 44 -3,-3.0 4,-1.3 -5,-0.2 -2,-0.3 0.908 105.9 55.2 -81.8 -45.8 50.9 5.9 56.6 105 18 C L H X S+ 0 0 23 -4,-1.9 4,-1.8 1,-0.2 3,-0.3 0.947 107.6 48.8 -51.7 -58.4 47.6 7.4 57.7 106 19 C Q H < S+ 0 0 111 -4,-1.7 4,-0.4 1,-0.2 -1,-0.2 0.848 105.4 63.9 -48.1 -40.9 47.4 5.4 60.9 107 20 C K H >X S+ 0 0 125 -4,-0.6 3,-1.4 1,-0.2 4,-0.7 0.924 106.4 37.8 -46.3 -67.7 51.0 6.5 61.6 108 21 C Y H 3X S+ 0 0 52 -4,-1.3 4,-2.0 -3,-0.3 5,-0.3 0.752 100.2 76.0 -59.2 -34.4 50.3 10.2 61.9 109 22 C R H 3< S+ 0 0 66 -4,-1.8 4,-0.3 1,-0.3 -1,-0.3 0.572 95.9 51.7 -67.4 -6.4 47.0 9.6 63.7 110 23 C Q H <> S+ 0 0 132 -3,-1.4 4,-1.3 -4,-0.4 -1,-0.3 0.833 111.1 48.0 -74.8 -54.4 49.3 8.8 66.7 111 24 C Q H >X S+ 0 0 121 -4,-0.7 4,-2.0 2,-0.2 3,-1.8 0.960 117.1 38.1 -51.7 -70.6 51.0 12.1 66.1 112 25 C V H >< S+ 0 0 1 -4,-2.0 3,-0.9 1,-0.3 -1,-0.2 0.945 113.9 57.7 -44.3 -58.6 48.0 14.4 65.8 113 26 C R H 34 S+ 0 0 162 -5,-0.3 -1,-0.3 -4,-0.3 -2,-0.2 0.729 118.1 33.4 -43.1 -31.8 46.3 12.3 68.5 114 27 C D H << S+ 0 0 138 -3,-1.8 -1,-0.3 -4,-1.3 -2,-0.3 0.551 99.3 100.2-103.5 -17.3 49.3 13.2 70.8 115 28 C I S << S- 0 0 42 -4,-2.0 5,-0.1 -3,-0.9 55,-0.1 -0.145 72.5 -94.8 -73.7 169.9 50.0 16.7 69.5 116 29 C S > - 0 0 38 1,-0.1 4,-1.2 50,-0.0 5,-0.1 0.004 22.7-104.7 -86.1-177.2 48.9 19.9 71.2 117 30 C R T 4 S+ 0 0 170 2,-0.2 -1,-0.1 1,-0.1 -2,-0.0 0.722 127.0 25.1 -71.9 -28.2 46.2 22.5 71.3 118 31 C E T > S+ 0 0 139 3,-0.1 4,-1.8 2,-0.1 -1,-0.1 0.727 118.9 60.8-103.2 -33.6 48.5 24.9 69.6 119 32 C D T 4 S+ 0 0 101 2,-0.2 -2,-0.2 1,-0.2 -4,-0.1 0.591 103.3 47.5 -78.6 -26.2 50.8 22.4 67.9 120 33 C L T X S+ 0 0 0 -4,-1.2 4,-1.1 2,-0.1 3,-0.3 0.673 109.7 62.9 -84.4 -16.1 48.2 20.7 65.7 121 34 C E H > S+ 0 0 21 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.940 101.5 42.4 -72.6 -53.7 47.2 24.3 64.9 122 35 C D H < S+ 0 0 69 -4,-1.8 -1,-0.2 1,-0.2 4,-0.1 0.380 108.2 67.6 -81.7 15.5 50.3 25.5 63.1 123 36 C L H > S+ 0 0 50 -3,-0.3 4,-2.0 2,-0.2 5,-0.4 0.776 96.6 48.5 -94.4 -41.5 50.4 22.1 61.4 124 37 C F H X S+ 0 0 6 -4,-1.1 4,-2.6 -3,-0.4 5,-0.3 0.966 109.4 54.5 -58.7 -47.0 47.3 22.7 59.3 125 38 C I H X S+ 0 0 13 -4,-1.4 4,-0.7 2,-0.2 -1,-0.2 0.778 109.8 51.9 -49.7 -33.8 48.9 26.0 58.5 126 39 C E H >> S+ 0 0 106 2,-0.2 3,-1.7 -3,-0.2 4,-0.7 0.996 115.4 32.9 -65.1 -81.4 51.8 23.8 57.4 127 40 C V H 3< S+ 0 0 6 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.650 107.5 70.3 -60.7 -13.6 50.2 21.3 55.0 128 41 C V H >X S+ 0 0 6 -4,-2.6 3,-2.0 -5,-0.4 4,-1.2 0.931 96.8 52.9 -68.5 -37.7 47.7 23.9 53.9 129 42 C R H << S+ 0 0 115 -3,-1.7 4,-0.4 -4,-0.7 -2,-0.3 0.807 108.2 50.8 -55.5 -26.0 50.7 25.3 52.3 130 43 C Q T 3< S+ 0 0 79 -4,-0.7 -1,-0.3 3,-0.1 -2,-0.2 -0.027 104.1 64.4 -94.3 30.1 51.0 21.8 50.8 131 44 C K T <4 S+ 0 0 41 -3,-2.0 -2,-0.2 3,-0.1 4,-0.1 0.747 111.4 23.7-119.8 -44.1 47.4 22.0 49.7 132 45 C M S < S+ 0 0 8 -4,-1.2 4,-0.3 2,-0.2 -3,-0.1 0.511 114.6 70.4 -97.5 -14.2 47.1 24.7 47.0 133 46 C A S > S+ 0 0 39 -4,-0.4 3,-1.8 -5,-0.4 -3,-0.1 0.948 99.4 46.6 -64.7 -50.1 50.8 24.3 46.3 134 47 C H T >> S+ 0 0 43 1,-0.3 3,-2.9 2,-0.2 4,-1.4 0.825 98.0 77.3 -56.1 -29.6 50.1 21.0 44.7 135 48 C E H 3> S+ 0 0 38 1,-0.3 4,-0.6 2,-0.2 -1,-0.3 0.650 96.6 42.7 -64.3 -14.7 47.3 22.9 43.0 136 49 C N H <4 S+ 0 0 70 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 -0.004 104.0 71.4-112.1 27.3 49.8 24.4 40.6 137 50 C I H <> S+ 0 0 64 -3,-2.9 4,-0.6 3,-0.1 -2,-0.2 0.795 108.8 28.4-100.6 -46.5 51.4 21.0 40.3 138 51 C F H X S+ 0 0 43 -4,-1.4 4,-4.4 3,-0.2 5,-0.2 0.902 122.8 54.9 -72.5 -47.6 48.7 19.4 38.3 139 52 C K H X S+ 0 0 73 -4,-0.6 4,-3.1 -5,-0.3 5,-0.2 0.966 114.1 36.2 -51.1 -71.0 47.6 22.7 36.7 140 53 C G H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.877 118.4 57.8 -53.9 -35.8 51.0 23.7 35.3 141 54 C M H >< S+ 0 0 47 -4,-0.6 3,-1.1 2,-0.2 4,-0.4 0.989 107.1 42.7 -53.1 -69.8 51.3 20.0 34.6 142 55 C I H >< S+ 0 0 91 -4,-4.4 3,-1.7 1,-0.3 4,-0.2 0.827 110.4 59.6 -48.6 -38.6 48.2 19.7 32.5 143 56 C R H >< S+ 0 0 171 -4,-3.1 3,-1.7 1,-0.3 -1,-0.3 0.954 105.9 47.7 -50.7 -50.0 49.3 23.0 30.9 144 57 C Q T << S+ 0 0 166 -4,-2.3 -1,-0.3 -3,-1.1 -2,-0.2 0.382 106.9 57.0 -77.1 2.8 52.5 21.1 29.9 145 58 C G T < 0 0 60 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.275 360.0 360.0-110.0 7.8 50.4 18.2 28.6 146 59 C S < 0 0 156 -3,-1.7 -1,-0.1 -4,-0.2 -2,-0.1 -0.227 360.0 360.0-124.8 360.0 48.5 20.5 26.2 147 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 148 12 D V > 0 0 113 0, 0.0 4,-3.7 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -96.9 49.2 36.1 46.2 149 13 D E H > + 0 0 141 2,-0.2 4,-2.9 1,-0.2 5,-0.1 0.887 360.0 43.2 -39.9 -71.8 46.0 34.0 46.2 150 14 D Q H > S+ 0 0 48 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.912 117.3 47.4 -44.1 -61.3 47.3 30.8 47.8 151 15 D Q H > S+ 0 0 125 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.939 111.7 50.1 -42.5 -61.4 49.4 32.8 50.3 152 16 D F H X S+ 0 0 112 -4,-3.7 4,-1.4 1,-0.2 -1,-0.3 0.855 110.2 53.2 -46.6 -39.6 46.3 34.9 51.0 153 17 D D H X S+ 0 0 19 -4,-2.9 4,-1.7 -5,-0.3 3,-0.3 0.955 101.9 57.7 -61.8 -50.3 44.5 31.6 51.4 154 18 D L H X S+ 0 0 14 -4,-2.6 4,-1.8 1,-0.3 -1,-0.2 0.812 101.4 55.0 -52.6 -39.1 47.0 30.3 53.9 155 19 D Q H X S+ 0 0 101 -4,-1.7 4,-1.1 2,-0.2 -1,-0.3 0.972 105.4 55.3 -58.0 -50.0 46.4 33.2 56.3 156 20 D K H >X S+ 0 0 110 -4,-1.4 3,-2.2 -3,-0.3 4,-1.9 0.931 109.2 43.6 -43.7 -65.7 42.7 32.3 56.2 157 21 D Y H 3X S+ 0 0 42 -4,-1.7 4,-2.7 1,-0.3 -1,-0.3 0.818 106.0 65.5 -51.8 -32.5 43.3 28.7 57.3 158 22 D R H 3< S+ 0 0 57 -4,-1.8 4,-0.4 -5,-0.3 -1,-0.3 0.809 106.8 41.8 -61.4 -27.3 45.7 30.3 59.8 159 23 D Q H << S+ 0 0 136 -3,-2.2 3,-0.4 -4,-1.1 -2,-0.2 0.916 116.4 44.4 -85.5 -50.5 42.6 31.9 61.4 160 24 D Q H >X S+ 0 0 132 -4,-1.9 3,-3.2 1,-0.2 4,-0.5 0.977 112.5 54.5 -53.0 -57.5 40.2 29.0 61.3 161 25 D V G >< S+ 0 0 4 -4,-2.7 3,-0.9 1,-0.3 -1,-0.2 0.759 97.0 65.7 -43.6 -35.6 42.9 26.7 62.5 162 26 D R G 34 S+ 0 0 143 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.2 0.532 110.2 37.0 -72.6 -4.3 43.4 29.0 65.5 163 27 D D G <4 S+ 0 0 137 -3,-3.2 -1,-0.3 -4,-0.2 -2,-0.2 0.341 85.5 129.5-124.5 0.3 40.0 28.1 66.7 164 28 D I << - 0 0 16 -3,-0.9 -44,-0.1 -4,-0.5 -43,-0.1 -0.391 55.6-132.4 -64.6 126.8 40.0 24.4 65.7 165 29 D S > - 0 0 60 -2,-0.2 4,-1.5 1,-0.1 5,-0.2 -0.216 29.5-100.8 -68.2 169.7 39.0 22.1 68.5 166 30 D R H >> S+ 0 0 134 2,-0.2 4,-3.7 1,-0.2 3,-0.9 0.991 121.5 34.5 -62.1 -58.2 41.2 19.1 69.2 167 31 D E H 3> S+ 0 0 152 1,-0.3 4,-1.8 2,-0.2 5,-0.3 0.902 113.7 59.5 -63.8 -37.2 39.1 16.5 67.5 168 32 D D H 3> S+ 0 0 93 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.833 116.3 36.3 -57.3 -28.1 38.0 19.0 64.8 169 33 D L H X S+ 0 0 14 -4,-0.9 3,-1.9 -5,-0.3 4,-1.8 0.961 113.4 49.9 -52.7 -56.7 44.2 12.9 58.8 175 39 D E H 3< S+ 0 0 103 -4,-2.3 4,-0.4 1,-0.3 -1,-0.2 0.831 109.6 54.0 -47.4 -39.7 42.0 14.1 55.9 176 40 D V H 3X S+ 0 0 20 -4,-2.3 4,-1.2 1,-0.2 -1,-0.3 0.666 106.8 48.7 -78.5 -16.1 44.8 16.4 54.8 177 41 D V H << S+ 0 0 2 -3,-1.9 4,-0.4 -4,-1.1 -1,-0.2 0.784 96.5 70.4 -89.5 -26.6 47.4 13.6 54.6 178 42 D R T X S+ 0 0 119 -4,-1.8 4,-0.7 1,-0.2 -2,-0.2 0.753 110.2 37.2 -65.2 -3.8 45.0 11.4 52.6 179 43 D Q H >>S+ 0 0 95 -4,-0.4 4,-2.1 2,-0.2 5,-0.6 0.841 97.0 66.5-111.6 -47.8 45.6 13.9 49.9 180 44 D K H <5S+ 0 0 38 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.1 0.613 115.4 46.4 -54.0 -4.9 49.2 15.0 50.1 181 45 D M H >5S+ 0 0 20 -4,-0.4 4,-1.3 2,-0.1 -2,-0.2 0.675 109.9 45.5-107.9 -42.8 49.2 11.2 49.0 182 46 D A H >X5S+ 0 0 39 -4,-0.7 4,-2.0 2,-0.2 3,-1.1 0.973 114.5 50.9 -56.8 -58.6 46.5 11.0 46.3 183 47 D H H 3X5S+ 0 0 34 -4,-2.1 4,-1.3 1,-0.3 -3,-0.2 0.825 108.7 53.2 -47.6 -38.2 48.1 14.2 44.8 184 48 D E H 34 S+ 0 0 97 -3,-0.8 4,-2.0 -4,-0.3 -2,-0.3 0.846 114.9 41.1 -83.8 -53.7 53.3 9.7 40.1 189 53 D G H < S+ 0 0 23 -4,-3.7 4,-0.3 1,-0.2 -2,-0.2 0.737 113.2 59.2 -59.9 -24.0 51.0 8.9 37.3 190 54 D M H >< S+ 0 0 36 -4,-0.8 3,-0.7 -5,-0.3 -1,-0.2 0.874 107.8 41.4 -73.6 -40.8 52.0 12.3 36.0 191 55 D I H 3< S+ 0 0 103 -4,-0.7 -2,-0.2 1,-0.2 -1,-0.2 0.785 99.2 77.7 -74.4 -26.3 55.7 11.4 35.8 192 56 D R T 3< S+ 0 0 179 -4,-2.0 2,-1.8 1,-0.3 -1,-0.2 0.631 70.7 84.4 -60.6 -17.4 54.7 8.0 34.4 193 57 D Q < + 0 0 134 -3,-0.7 -1,-0.3 -4,-0.3 -4,-0.0 -0.413 56.2 109.2 -83.0 60.1 54.1 9.8 31.1 194 58 D G 0 0 70 -2,-1.8 -1,-0.2 1,-0.1 -2,-0.1 -0.072 360.0 360.0-116.0 24.3 57.8 9.4 30.4 195 59 D S 0 0 176 -3,-0.2 -2,-0.1 0, 0.0 -1,-0.1 -0.052 360.0 360.0 -80.8 360.0 57.2 6.8 27.7