==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 13-MAY-04 1VKF . COMPND 2 MOLECULE: GLYCEROL UPTAKE OPERON ANTITERMINATOR-RELATED PRO . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 690 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33152.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 526 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 156 22.6 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 . 1 0.1 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 . 63 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 193 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.3 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 4 2 1 3 1 8 5 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 16 16 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 . 4 0 0 0 0 0 0 4 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 X 0 0 158 0, 0.0 2,-1.0 0, 0.0 20,-0.1 0.000 360.0 360.0 360.0 -52.1 58.8 44.8 52.3 2 2 A F + 0 0 27 159,-0.1 2,-0.3 4,-0.0 138,-0.1 -0.821 360.0 128.2 -92.8 98.8 58.6 41.5 50.5 3 3 A K - 0 0 152 -2,-1.0 158,-0.3 2,-0.1 2,-0.2 -0.945 61.2 -14.6-153.4 134.8 54.9 41.3 49.7 4 4 A G E S+a 161 0A 24 156,-2.0 158,-2.4 -2,-0.3 2,-0.4 -0.474 112.6 1.5 73.5-143.0 53.0 40.6 46.4 5 5 A I E -a 162 0A 26 156,-0.2 2,-0.4 -2,-0.2 17,-0.4 -0.717 59.2-162.3 -90.8 130.7 54.8 40.9 43.1 6 6 A I E -a 163 0A 1 156,-3.0 158,-2.5 -2,-0.4 2,-0.7 -0.910 25.0-120.8-103.7 134.9 58.5 41.8 43.0 7 7 A A E -ab 164 23A 0 15,-2.6 17,-2.5 -2,-0.4 2,-0.4 -0.726 23.0-159.3 -86.0 117.3 59.8 43.0 39.6 8 8 A A E - b 0 24A 3 156,-2.5 2,-0.5 -2,-0.7 17,-0.2 -0.790 7.3-161.9 -92.6 130.6 62.6 40.8 38.2 9 9 A L E + b 0 25A 1 15,-2.5 17,-2.8 -2,-0.4 18,-0.6 -0.953 20.8 174.0-118.2 128.0 64.8 42.6 35.6 10 10 A W S S+ 0 0 67 -2,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.601 73.6 17.9-104.1 -22.6 67.0 40.7 33.1 11 11 A D - 0 0 88 3,-0.1 -1,-0.3 1,-0.0 17,-0.1 -0.993 53.5-151.4-151.4 164.2 68.1 43.7 31.1 12 12 A X S S+ 0 0 22 -2,-0.3 3,-0.2 -3,-0.1 -1,-0.0 0.192 78.1 81.5-118.0 7.6 68.2 47.4 31.4 13 13 A D S S+ 0 0 140 1,-0.3 2,-0.6 2,-0.1 -1,-0.1 0.961 103.2 26.2 -82.9 -56.4 68.0 48.6 27.8 14 14 A S S S+ 0 0 88 1,-0.2 -1,-0.3 0, 0.0 -3,-0.1 -0.941 75.2 144.8-111.3 113.0 64.2 48.4 27.4 15 15 A I + 0 0 19 -2,-0.6 -1,-0.2 -3,-0.2 -2,-0.1 0.782 19.9 178.3-116.6 -52.6 62.5 48.8 30.7 16 16 A G - 0 0 51 2,-0.1 2,-0.2 0, 0.0 0, 0.0 -0.254 56.2 -15.0 70.7-165.2 59.2 50.6 30.6 17 17 A E - 0 0 129 1,-0.0 2,-0.6 2,-0.0 0, 0.0 -0.488 56.8-158.4 -72.7 139.1 57.1 51.2 33.7 18 18 A I - 0 0 0 -2,-0.2 -2,-0.1 1,-0.2 -11,-0.0 -0.934 10.1-178.5-118.2 101.4 57.9 49.1 36.8 19 19 A E + 0 0 64 -2,-0.6 -1,-0.2 148,-0.1 152,-0.1 0.916 54.2 88.9 -68.2 -45.4 54.9 49.0 39.1 20 20 A P S S- 0 0 11 0, 0.0 -14,-0.1 0, 0.0 -16,-0.1 -0.228 70.4-140.7 -55.9 145.4 56.4 46.9 41.9 21 21 A D S S+ 0 0 125 -16,-0.3 25,-2.3 24,-0.1 2,-0.4 0.761 87.3 59.5 -75.1 -27.6 58.2 48.7 44.8 22 22 A V E - c 0 46A 8 -17,-0.4 -15,-2.6 23,-0.2 2,-0.4 -0.884 68.1-166.7-108.0 136.6 60.9 46.1 45.0 23 23 A V E -bc 7 47A 0 23,-3.2 25,-2.4 -2,-0.4 2,-0.6 -0.969 11.7-157.8-124.2 132.9 63.2 45.1 42.1 24 24 A F E -bc 8 48A 0 -17,-2.5 -15,-2.5 -2,-0.4 2,-0.8 -0.952 13.4-153.8-103.6 111.9 65.4 42.1 41.7 25 25 A L E -bc 9 49A 1 23,-3.1 25,-2.6 -2,-0.6 -15,-0.2 -0.797 14.6-177.7 -88.4 110.1 68.1 42.9 39.2 26 26 A L + 0 0 8 -17,-2.8 2,-0.3 -2,-0.8 -16,-0.2 0.579 60.6 25.8 -96.9 -7.3 69.0 39.5 37.9 27 27 A K + 0 0 107 -18,-0.6 2,-0.3 27,-0.0 27,-0.2 -0.973 65.4 125.8-151.7 140.9 71.8 40.3 35.5 28 28 A S E -i 54 0B 6 25,-1.3 27,-2.6 -2,-0.3 2,-0.3 -0.856 41.8-114.6-160.1-158.9 74.3 43.1 35.1 29 29 A D E >> -i 55 0B 45 25,-0.3 4,-1.6 -2,-0.3 3,-0.7 -0.974 26.5-109.2-150.9 163.3 78.1 43.6 34.8 30 30 A I T 34 S+ 0 0 62 25,-2.5 4,-0.3 -2,-0.3 26,-0.1 0.774 114.7 51.6 -68.0 -25.7 80.8 45.1 36.9 31 31 A L T 34 S+ 0 0 141 24,-0.3 -1,-0.3 1,-0.2 4,-0.1 0.746 123.1 27.6 -80.3 -31.0 81.4 48.0 34.6 32 32 A N T <> S+ 0 0 60 -3,-0.7 4,-2.3 2,-0.1 3,-0.4 0.440 86.6 99.8-116.3 0.8 77.8 49.1 34.5 33 33 A L H X S+ 0 0 0 -4,-1.6 4,-3.0 1,-0.3 5,-0.2 0.889 84.1 53.9 -61.3 -41.3 76.1 47.9 37.7 34 34 A K H > S+ 0 0 123 -4,-0.3 4,-2.2 1,-0.2 -1,-0.3 0.889 110.4 46.4 -62.7 -37.1 76.3 51.4 39.3 35 35 A F H > S+ 0 0 126 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.896 111.7 51.2 -71.6 -40.3 74.5 53.0 36.3 36 36 A H H X S+ 0 0 37 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.935 111.9 47.5 -59.3 -47.3 71.9 50.3 36.3 37 37 A L H X S+ 0 0 1 -4,-3.0 4,-3.4 1,-0.2 5,-0.3 0.885 107.0 55.7 -64.1 -40.8 71.3 50.8 40.0 38 38 A K H X S+ 0 0 124 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.908 107.0 51.2 -54.9 -45.3 71.1 54.6 39.7 39 39 A I H X S+ 0 0 69 -4,-1.9 4,-0.8 2,-0.2 -1,-0.2 0.929 116.7 39.8 -57.5 -46.6 68.3 54.2 37.1 40 40 A L H <>S+ 0 0 0 -4,-1.8 5,-1.7 2,-0.2 3,-0.5 0.899 115.4 49.2 -77.3 -39.1 66.3 51.9 39.4 41 41 A K H ><5S+ 0 0 71 -4,-3.4 3,-1.8 1,-0.2 -1,-0.2 0.870 105.8 59.0 -68.2 -34.1 67.0 53.8 42.6 42 42 A D H 3<5S+ 0 0 114 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.784 99.7 58.3 -62.3 -30.9 66.0 57.0 40.8 43 43 A R T 3<5S- 0 0 100 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.351 123.0-108.9 -78.7 2.5 62.6 55.3 40.2 44 44 A G T < 5 + 0 0 62 -3,-1.8 2,-0.2 1,-0.2 -3,-0.2 0.673 69.6 147.2 81.1 17.0 62.2 55.0 44.0 45 45 A K < - 0 0 19 -5,-1.7 2,-0.5 -23,-0.1 -1,-0.2 -0.562 52.0-128.4 -86.8 150.6 62.7 51.2 44.0 46 46 A T E -c 22 0A 34 -25,-2.3 -23,-3.2 -2,-0.2 2,-0.5 -0.873 36.8-156.5 -87.1 128.5 64.3 49.0 46.6 47 47 A V E -c 23 0A 0 -2,-0.5 26,-2.6 -25,-0.2 27,-1.1 -0.945 20.4-173.3-124.6 120.5 66.8 47.0 44.6 48 48 A F E -cd 24 74A 5 -25,-2.4 -23,-3.1 -2,-0.5 2,-0.5 -0.872 18.9-148.5-102.9 137.0 68.4 43.6 45.4 49 49 A V E -cd 25 75A 1 25,-2.2 27,-2.4 -2,-0.4 2,-1.3 -0.944 14.3-131.9-110.3 130.5 71.1 42.4 43.0 50 50 A D E > - d 0 76A 3 -25,-2.6 3,-1.8 -2,-0.5 27,-0.2 -0.686 24.6-169.7 -78.1 95.7 71.8 38.8 42.2 51 51 A X G > S+ 0 0 3 25,-1.5 3,-1.2 -2,-1.3 -1,-0.2 0.774 77.3 68.4 -65.9 -21.5 75.5 39.0 42.7 52 52 A D G 3 S+ 0 0 49 24,-0.7 -1,-0.3 1,-0.2 25,-0.1 0.671 103.7 43.6 -72.8 -14.0 76.0 35.6 41.2 53 53 A F G < S+ 0 0 96 -3,-1.8 -25,-1.3 2,-0.1 2,-0.9 0.155 76.6 115.1-119.9 19.4 75.1 37.0 37.7 54 54 A V E X S-i 28 0B 5 -3,-1.2 3,-2.3 -27,-0.2 -25,-0.3 -0.812 72.9-126.5 -87.2 103.1 77.0 40.3 37.7 55 55 A N E 3 S+i 29 0B 95 -27,-2.6 -25,-2.5 -2,-0.9 -24,-0.3 -0.372 91.6 20.0 -56.1 130.6 79.4 39.5 34.8 56 56 A G T 3 S+ 0 0 69 1,-0.3 2,-0.3 -27,-0.2 -1,-0.3 0.243 98.6 115.2 92.6 -16.3 82.9 40.1 35.9 57 57 A L < - 0 0 31 -3,-2.3 -1,-0.3 -6,-0.2 -3,-0.1 -0.709 47.3-159.0 -89.9 145.6 82.2 39.9 39.7 58 58 A G - 0 0 51 -2,-0.3 2,-0.3 1,-0.1 -4,-0.1 -0.021 25.5 -84.7-101.0-155.5 83.6 37.2 41.9 59 59 A E S S+ 0 0 136 4,-0.1 4,-0.3 -2,-0.1 3,-0.2 -0.752 70.9 38.3-116.1 162.1 82.5 35.9 45.3 60 60 A G S > S- 0 0 19 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 -0.405 96.2 -32.9 99.5-173.2 83.0 37.0 48.8 61 61 A E H > S+ 0 0 85 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.857 129.0 47.9 -57.3 -48.5 83.4 40.0 51.0 62 62 A E H > S+ 0 0 149 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 112.8 50.2 -61.5 -40.4 85.0 42.4 48.6 63 63 A A H > S+ 0 0 9 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.921 111.4 48.3 -61.1 -43.9 82.4 41.5 45.9 64 64 A I H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.937 111.3 49.8 -65.1 -43.1 79.5 42.1 48.3 65 65 A L H X S+ 0 0 75 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.846 108.6 54.6 -63.7 -33.2 81.0 45.5 49.4 66 66 A F H X S+ 0 0 79 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.915 107.6 48.3 -64.1 -42.5 81.3 46.4 45.7 67 67 A V H X>S+ 0 0 0 -4,-2.1 5,-1.8 2,-0.2 4,-0.5 0.894 112.1 49.9 -67.3 -39.2 77.7 45.7 45.1 68 68 A K H ><5S+ 0 0 98 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.951 110.4 50.4 -61.4 -45.8 76.8 47.8 48.2 69 69 A K H 3<5S+ 0 0 177 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.829 102.3 61.0 -59.5 -33.9 79.0 50.7 46.9 70 70 A A H 3<5S- 0 0 9 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.663 128.5 -97.3 -70.4 -18.0 77.3 50.5 43.6 71 71 A G T <<5 + 0 0 32 -3,-1.6 -24,-0.2 -4,-0.5 -3,-0.2 0.477 68.5 152.1 118.5 14.4 74.1 51.4 45.4 72 72 A A < - 0 0 1 -5,-1.8 -1,-0.2 1,-0.1 -24,-0.2 -0.389 40.4-148.2 -73.1 146.8 72.2 48.1 46.0 73 73 A D S S- 0 0 46 -26,-2.6 2,-0.3 1,-0.2 -25,-0.2 0.699 76.3 -25.7 -81.2 -24.4 69.9 47.7 48.9 74 74 A G E -d 48 0A 1 -27,-1.1 -25,-2.2 17,-0.1 2,-0.3 -0.981 64.0-104.7-171.2-179.9 70.8 44.1 49.2 75 75 A I E -de 49 93A 2 17,-2.3 19,-2.3 -2,-0.3 2,-0.4 -0.890 9.9-154.9-123.0 156.8 72.0 40.9 47.5 76 76 A I E +de 50 94A 0 -27,-2.4 -25,-1.5 -2,-0.3 -24,-0.7 -0.955 29.3 154.6-122.0 140.2 70.6 37.7 46.3 77 77 A T E - e 0 95A 0 17,-1.9 19,-2.5 -2,-0.4 -27,-0.0 -0.978 46.7-144.3-161.3 156.1 72.8 34.6 46.0 78 78 A I S S+ 0 0 49 -2,-0.3 20,-0.1 17,-0.2 17,-0.1 0.420 79.7 95.6 -95.1 -9.1 72.8 30.8 46.0 79 79 A K >> - 0 0 102 1,-0.2 4,-1.9 2,-0.0 3,-0.9 -0.792 62.9-156.1 -92.7 110.0 76.2 30.7 47.8 80 80 A P H 3> S+ 0 0 36 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.810 94.5 58.1 -50.7 -36.4 75.9 30.3 51.6 81 81 A K H 3> S+ 0 0 93 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.875 106.0 48.1 -63.8 -39.5 79.3 31.9 52.1 82 82 A N H <> S+ 0 0 4 -3,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.911 112.2 51.4 -64.3 -41.6 78.1 35.1 50.3 83 83 A Y H X S+ 0 0 6 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.956 111.0 45.6 -60.4 -49.2 75.0 35.1 52.5 84 84 A V H X S+ 0 0 55 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.899 114.5 48.5 -63.3 -40.8 76.9 34.7 55.8 85 85 A V H X S+ 0 0 36 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.895 110.4 50.9 -69.5 -40.1 79.4 37.4 54.8 86 86 A A H ><>S+ 0 0 0 -4,-2.5 5,-2.4 2,-0.2 3,-0.8 0.970 112.5 47.0 -58.4 -51.8 76.6 39.8 53.7 87 87 A K H ><5S+ 0 0 93 -4,-2.5 3,-1.8 1,-0.3 -2,-0.2 0.888 107.8 55.3 -56.9 -46.0 74.8 39.3 57.0 88 88 A K H 3<5S+ 0 0 102 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.771 110.4 47.5 -56.8 -30.9 78.1 39.8 59.0 89 89 A N T <<5S- 0 0 65 -4,-1.3 -1,-0.3 -3,-0.8 -2,-0.2 0.276 119.9-108.9 -97.0 7.5 78.5 43.2 57.3 90 90 A G T < 5S+ 0 0 67 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.695 71.0 142.5 74.6 24.9 74.9 44.2 57.9 91 91 A I < - 0 0 12 -5,-2.4 -1,-0.2 -6,-0.2 -2,-0.1 -0.846 55.9-115.6-102.4 118.8 73.8 43.9 54.3 92 92 A P - 0 0 66 0, 0.0 -17,-2.3 0, 0.0 2,-0.3 -0.236 42.3-175.0 -49.0 137.6 70.3 42.5 53.6 93 93 A A E -e 75 0A 12 -19,-0.2 2,-0.4 -45,-0.1 26,-0.3 -0.998 24.2-155.5-146.2 143.1 70.5 39.2 51.8 94 94 A V E -e 76 0A 0 -19,-2.3 -17,-1.9 -2,-0.3 2,-0.5 -0.991 16.1-147.4-117.7 130.0 68.2 36.7 50.1 95 95 A L E -ef 77 120A 5 24,-1.9 26,-2.1 -2,-0.4 -17,-0.2 -0.847 14.7-134.7 -98.9 124.0 69.4 33.1 49.8 96 96 A R E - f 0 121A 25 -19,-2.5 2,-0.4 -2,-0.5 26,-0.2 -0.490 17.5-164.0 -74.1 149.5 68.1 31.1 46.8 97 97 A F E - f 0 122A 12 24,-2.4 26,-2.5 -2,-0.2 2,-0.9 -0.978 11.3-151.5-142.8 112.8 66.8 27.6 47.3 98 98 A F E - f 0 123A 69 -2,-0.4 2,-1.7 24,-0.2 3,-0.3 -0.804 11.5-161.1 -93.0 103.2 66.4 25.2 44.4 99 99 A A + 0 0 0 24,-2.6 3,-0.1 -2,-0.9 28,-0.1 -0.574 35.5 144.1 -91.0 77.1 63.5 22.9 45.6 100 100 A L - 0 0 16 -2,-1.7 2,-0.3 1,-0.2 198,-0.2 0.808 64.1 -16.9 -91.3 -35.0 64.1 20.0 43.3 101 101 A D S > S- 0 0 15 -3,-0.3 4,-2.1 216,-0.2 -1,-0.2 -0.926 78.2 -81.0-162.4 176.6 63.2 17.0 45.4 102 102 A S H > S+ 0 0 27 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.859 125.2 48.8 -60.1 -39.8 62.7 15.9 49.0 103 103 A K H > S+ 0 0 64 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.887 109.9 52.0 -70.3 -36.2 66.4 15.5 49.8 104 104 A A H > S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.910 112.2 47.2 -64.3 -39.9 67.2 19.0 48.3 105 105 A V H X S+ 0 0 11 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.922 110.5 51.0 -67.9 -44.4 64.5 20.4 50.5 106 106 A E H X S+ 0 0 113 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.944 114.5 44.3 -56.4 -49.1 65.7 18.6 53.6 107 107 A R H X S+ 0 0 166 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.889 113.0 51.2 -64.1 -41.5 69.2 19.8 53.1 108 108 A G H X S+ 0 0 15 -4,-2.2 4,-2.7 -5,-0.2 -1,-0.2 0.898 109.6 49.4 -63.7 -41.3 68.1 23.4 52.3 109 109 A I H X S+ 0 0 25 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.918 110.4 51.1 -67.3 -40.1 66.0 23.5 55.4 110 110 A E H X S+ 0 0 71 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.937 112.0 47.4 -59.0 -47.9 68.9 22.3 57.5 111 111 A Q H X S+ 0 0 81 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.914 111.0 51.6 -58.9 -44.7 71.1 25.0 55.9 112 112 A I H X>S+ 0 0 1 -4,-2.7 5,-2.3 1,-0.2 4,-0.9 0.921 113.3 44.4 -57.8 -43.4 68.4 27.7 56.5 113 113 A E H <5S+ 0 0 111 -4,-2.5 3,-0.3 3,-0.2 -2,-0.2 0.918 114.6 48.3 -72.4 -40.3 68.1 26.8 60.2 114 114 A T H <5S+ 0 0 110 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.874 118.1 38.5 -69.5 -39.8 71.9 26.5 60.8 115 115 A L H <5S- 0 0 49 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.514 108.7-118.9 -89.1 -8.2 72.8 29.8 59.1 116 116 A G T <5 - 0 0 22 -4,-0.9 2,-0.6 -3,-0.3 -3,-0.2 0.953 39.5-173.5 69.4 51.1 69.7 31.8 60.4 117 117 A V < + 0 0 0 -5,-2.3 -1,-0.2 1,-0.2 3,-0.1 -0.691 14.9 178.2 -84.9 117.6 68.2 32.6 57.1 118 118 A D S S+ 0 0 101 -2,-0.6 21,-2.6 1,-0.2 2,-0.4 0.809 70.2 40.2 -84.0 -35.5 65.3 35.0 57.4 119 119 A V E + g 0 139A 20 -26,-0.3 -24,-1.9 19,-0.2 2,-0.4 -0.977 66.7 177.3-127.9 118.2 64.5 35.4 53.7 120 120 A V E -fg 95 140A 0 19,-2.7 21,-2.6 -2,-0.4 2,-0.6 -0.972 21.3-147.6-124.8 137.2 64.6 32.7 51.2 121 121 A E E -fg 96 141A 0 -26,-2.1 -24,-2.4 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1,-0.2 2,-0.4 0.694 66.2 39.8 -97.1 -29.2 65.0 11.1 24.0 292 119 B V E + p 0 312C 22 -26,-0.2 -24,-2.3 19,-0.2 2,-0.4 -0.984 65.3 175.7-131.7 121.8 64.3 10.6 27.7 293 120 B V E -op 268 313C 2 19,-2.5 21,-2.6 -2,-0.4 2,-0.6 -0.961 23.4-147.2-127.6 143.8 64.4 13.4 30.4 294 121 B E E -op 269 314C 6 -26,-2.3 -24,-2.1 -2,-0.4 2,-0.5 -0.966 22.7-158.0-104.6 120.6 63.6 13.5 34.0 295 122 B V E -op 270 315C 0 19,-2.2 21,-2.4 -2,-0.6 6,-0.2 -0.888 15.9-122.1-109.2 127.0 62.3 16.9 34.9 296 123 B L E S+o 271 0C 2 -26,-2.4 -24,-2.6 -2,-0.5 21,-0.2 -0.919 83.3 28.0-122.0 148.5 62.5 18.2 38.5 297 124 B P S >> S- 0 0 0 0, 0.0 3,-1.4 0, 0.0 4,-0.5 0.690 79.8-137.9 -73.9 169.0 60.6 19.2 40.5 298 125 B G G >4 S+ 0 0 0 19,-2.3 3,-1.3 1,-0.3 20,-0.1 0.815 93.3 71.4 -64.9 -34.4 57.6 17.2 39.2 299 126 B A G 34 S+ 0 0 46 18,-0.5 -1,-0.3 1,-0.3 4,-0.2 0.751 105.8 38.9 -53.3 -30.9 55.0 20.0 39.5 300 127 B V G X> S+ 0 0 1 -3,-1.4 4,-1.4 1,-0.1 3,-0.7 0.453 86.6 97.3-102.3 -1.5 56.6 21.9 36.6 301 128 B A H S+ 0 0 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0C 46 -21,-2.5 -19,-2.5 -2,-0.3 2,-0.5 -0.727 31.7-165.6 -88.5 128.6 59.6 11.1 27.0 313 140 B V E -p 293 0C 3 -2,-0.5 20,-1.5 -21,-0.2 21,-1.3 -0.962 8.5-167.5-115.7 127.6 59.3 13.1 30.2 314 141 B I E -pq 294 334C 0 -21,-2.6 -19,-2.2 -2,-0.5 2,-0.3 -0.973 18.3-142.8-107.3 119.0 59.5 11.6 33.6 315 142 B A E +pq 295 335C 0 19,-2.6 21,-2.7 -2,-0.6 2,-0.3 -0.607 27.6 174.7 -75.0 136.1 58.4 14.0 36.4 316 143 B A E + q 0 336C 4 -21,-2.4 21,-0.2 -2,-0.3 -17,-0.1 -0.992 26.9 49.7-148.6 144.9 60.4 13.7 39.6 317 144 B G S S+ 0 0 12 19,-0.9 -19,-2.3 -2,-0.3 -18,-0.5 0.467 99.4 11.4 103.0 124.6 60.7 15.5 42.9 318 145 B L S S+ 0 0 18 1,-0.2 2,-0.9 -21,-0.2 -217,-0.1 0.620 72.3 144.4 59.3 17.9 58.2 16.5 45.6 319 146 B V + 0 0 5 17,-0.3 20,-0.4 1,-0.2 -1,-0.2 -0.812 14.6 151.7 -85.7 112.1 55.3 14.6 44.1 320 147 B E + 0 0 83 -2,-0.9 2,-0.2 -3,-0.1 22,-0.2 0.721 42.7 52.1-116.8 -34.6 53.5 13.6 47.3 321 148 B T S > S- 0 0 62 1,-0.1 4,-2.4 20,-0.1 5,-0.2 -0.727 73.1-120.7-113.4 164.3 49.8 13.1 46.8 322 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-1,-0.3 -3,-0.8 -2,-0.2 0.360 116.0-116.3 -94.1 0.1 30.1 2.8 26.6 611 90 D G T < 5 + 0 0 68 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.729 67.1 146.5 69.0 21.8 33.9 2.9 27.5 612 91 D I < - 0 0 13 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.794 56.0-110.6 -96.1 124.6 34.4 -0.3 25.3 613 92 D P + 0 0 60 0, 0.0 -17,-1.9 0, 0.0 2,-0.3 -0.269 46.7 179.1 -54.2 136.7 37.7 -0.5 23.5 614 93 D A E -f 596 0G 9 -19,-0.2 2,-0.4 -45,-0.1 -17,-0.2 -0.992 26.2-155.9-145.7 150.2 37.2 -0.1 19.8 615 94 D V E -f 597 0G 0 -19,-1.9 -17,-1.7 -2,-0.3 2,-0.6 -0.993 14.3-151.1-124.7 127.9 39.2 -0.0 16.6 616 95 D L E -fg 598 641G 7 24,-2.2 26,-2.0 -2,-0.4 -17,-0.2 -0.892 16.5-133.1-101.0 124.2 37.9 1.8 13.6 617 96 D R E - g 0 642G 57 -19,-3.0 2,-0.4 -2,-0.6 26,-0.2 -0.403 19.4-166.0 -72.4 154.8 39.0 0.4 10.2 618 97 D F E - g 0 643G 17 24,-1.9 26,-2.3 -2,-0.1 2,-0.8 -0.959 13.5-148.3-150.6 119.8 40.3 2.9 7.6 619 98 D F E - g 0 644G 91 -2,-0.4 2,-1.8 24,-0.2 3,-0.3 -0.878 10.2-164.3 -99.6 103.9 40.7 2.0 3.9 620 99 D A + 0 0 10 24,-2.6 3,-0.1 -2,-0.8 -1,-0.1 -0.482 33.4 146.8 -92.7 62.9 43.6 4.2 2.8 621 100 D L - 0 0 141 -2,-1.8 2,-0.3 1,-0.1 -1,-0.2 0.851 69.5 -27.0 -70.0 -31.3 42.9 3.6 -0.8 622 101 D D S > S- 0 0 93 -3,-0.3 4,-1.5 1,-0.0 -1,-0.1 -0.868 79.4 -73.6-164.6-175.3 44.1 7.2 -1.9 623 102 D S H > S+ 0 0 82 -2,-0.3 4,-2.6 2,-0.2 5,-0.1 0.795 121.8 51.7 -76.6 -37.3 44.5 10.8 -0.6 624 103 D K H > S+ 0 0 124 2,-0.2 4,-2.9 1,-0.2 5,-0.4 0.943 110.9 48.7 -65.7 -48.0 40.8 11.9 -0.6 625 104 D A H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.923 112.6 49.4 -56.3 -42.2 39.8 8.8 1.4 626 105 D V H X S+ 0 0 19 -4,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.916 111.9 48.1 -66.7 -41.2 42.6 9.5 3.8 627 106 D E H X S+ 0 0 127 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.935 113.7 44.4 -63.0 -55.5 41.7 13.1 4.3 628 107 D R H X S+ 0 0 165 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.866 114.1 53.8 -57.0 -35.6 37.9 12.5 4.8 629 108 D G H X S+ 0 0 12 -4,-2.0 4,-2.3 -5,-0.4 -2,-0.2 0.887 109.1 46.2 -68.0 -39.9 39.0 9.7 7.1 630 109 D I H X S+ 0 0 22 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.907 111.4 51.1 -71.2 -41.4 41.3 12.1 9.1 631 110 D E H X S+ 0 0 134 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.923 112.2 48.8 -60.2 -43.1 38.6 14.7 9.4 632 111 D Q H X S+ 0 0 82 -4,-2.2 4,-2.4 1,-0.2 6,-0.2 0.917 110.3 50.4 -60.9 -46.2 36.2 12.0 10.6 633 112 D I H X>S+ 0 0 3 -4,-2.3 5,-2.1 1,-0.2 4,-1.1 0.894 115.0 43.0 -56.2 -44.3 38.8 10.8 13.2 634 113 D E H <5S+ 0 0 117 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.860 115.2 48.8 -77.3 -33.6 39.3 14.3 14.5 635 114 D T H <5S+ 0 0 102 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.867 120.3 35.9 -70.4 -36.8 35.6 15.1 14.5 636 115 D L H <5S- 0 0 59 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.531 107.1-119.0 -97.4 -9.5 34.6 11.9 16.3 637 116 D G T <5 - 0 0 21 -4,-1.1 2,-0.5 -5,-0.2 -3,-0.2 0.885 40.6-174.4 69.4 41.1 37.6 11.6 18.6 638 117 D V < - 0 0 0 -5,-2.1 -1,-0.2 -6,-0.2 3,-0.1 -0.583 9.0-178.1 -71.1 119.3 38.7 8.3 17.2 639 118 D D + 0 0 78 -2,-0.5 21,-1.9 1,-0.2 2,-0.4 0.729 63.4 35.0 -92.7 -27.9 41.6 7.1 19.2 640 119 D V E + h 0 660G 21 -26,-0.2 -24,-2.2 19,-0.2 2,-0.4 -0.985 63.5 177.7-137.1 124.6 42.6 3.8 17.5 641 120 D V E -gh 616 661G 2 19,-2.6 21,-2.5 -2,-0.4 2,-0.6 -0.921 23.2-143.9-121.1 152.2 42.4 3.0 13.9 642 121 D E E -gh 617 662G 6 -26,-2.0 -24,-1.9 -2,-0.4 2,-0.5 -0.963 23.7-155.6-108.4 112.4 43.4 -0.1 11.9 643 122 D V E -gh 618 663G 0 19,-2.9 21,-2.4 -2,-0.6 -24,-0.2 -0.763 14.8-130.4 -88.3 135.0 44.8 1.1 8.6 644 123 D L E S+g 619 0G 28 -26,-2.3 -24,-2.6 -2,-0.5 21,-0.2 -0.944 81.7 38.8-130.3 152.0 44.6 -1.3 5.6 645 124 D P S >> S- 0 0 47 0, 0.0 3,-2.3 0, 0.0 4,-0.6 0.684 84.1-131.7 -67.6 162.8 46.4 -2.3 3.5 646 125 D G G >4 S+ 0 0 0 19,-1.3 3,-0.9 1,-0.3 20,-0.1 0.748 98.9 68.0 -45.0 -32.6 49.4 -2.6 6.0 647 126 D A G 34 S+ 0 0 82 18,-0.3 -1,-0.3 1,-0.2 4,-0.1 0.447 101.8 43.6 -71.9 -9.6 51.8 -0.7 3.5 648 127 D V G <> S+ 0 0 40 -3,-2.3 4,-2.0 2,-0.1 -1,-0.2 0.436 86.4 95.7-119.8 3.2 50.1 2.7 3.8 649 128 D A H S+ 0 0 19 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.748 109.7 51.5 -65.6 -47.3 53.0 4.5 8.2 651 130 D K H > S+ 0 0 157 -3,-0.2 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