==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 15-JUL-12 4G3W . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR NLH1; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR J.D.BATCHELOR,A.WANG,P.LEE,M.DOUCLEFF,D.E.WEMMER . 137 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8023.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 93 67.9 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 . 35 25.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.5 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 . 1 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 . 9 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 27.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 0 0 0 1 0 0 0 0 0 0 1 0 1 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 1 1 0 0 2 0 0 0 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 . 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 22 A N >> 0 0 129 0, 0.0 4,-2.1 0, 0.0 3,-1.4 0.000 360.0 360.0 360.0 20.4 -11.4 -3.1 -14.7 2 23 A L H 3> + 0 0 18 1,-0.2 4,-1.4 2,-0.2 35,-0.0 0.690 360.0 73.1 -64.0 -18.9 -13.7 -3.9 -11.7 3 24 A E H 34 S+ 0 0 83 2,-0.1 -1,-0.2 1,-0.1 36,-0.1 0.540 108.7 28.1 -69.4 -11.4 -16.1 -4.5 -14.7 4 25 A T H <4 S+ 0 0 65 -3,-1.4 4,-0.4 3,-0.1 -2,-0.2 0.719 122.5 45.4-119.1 -41.2 -14.2 -7.8 -15.4 5 26 A T H X S+ 0 0 56 -4,-2.1 4,-0.9 1,-0.2 -3,-0.2 0.739 109.8 52.6 -79.0 -26.7 -12.7 -9.0 -12.1 6 27 A V H X S+ 0 0 0 -4,-1.4 4,-2.8 -5,-0.2 3,-0.2 0.863 101.7 58.1 -79.0 -36.9 -15.8 -8.5 -9.8 7 28 A P H > S+ 0 0 11 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.733 100.7 59.6 -68.6 -10.5 -18.2 -10.4 -12.0 8 29 A Y H > S+ 0 0 136 -4,-0.4 4,-1.4 2,-0.2 -2,-0.2 0.877 108.7 43.7 -71.2 -41.3 -15.8 -13.4 -11.6 9 30 A I H X S+ 0 0 34 -4,-0.9 4,-2.5 -3,-0.2 5,-0.2 0.941 114.5 49.8 -62.5 -48.7 -16.4 -13.1 -7.8 10 31 A F H X S+ 0 0 1 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.890 107.1 54.0 -61.0 -39.7 -20.2 -12.7 -8.4 11 32 A R H X S+ 0 0 127 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.902 111.6 45.9 -62.1 -41.0 -20.4 -15.7 -10.7 12 33 A L H X S+ 0 0 102 -4,-1.4 4,-3.4 2,-0.2 5,-0.4 0.920 110.3 51.5 -70.4 -48.1 -18.8 -17.9 -8.1 13 34 A L H X S+ 0 0 15 -4,-2.5 4,-1.3 1,-0.2 6,-1.2 0.843 111.8 49.6 -57.9 -38.1 -21.0 -16.5 -5.2 14 35 A K H X S+ 0 0 101 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.943 116.5 41.1 -60.8 -49.5 -24.1 -17.3 -7.4 15 36 A K H < S+ 0 0 160 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.934 125.2 32.5 -67.1 -47.8 -22.9 -20.9 -8.2 16 37 A L H < S+ 0 0 143 -4,-3.4 -1,-0.2 1,-0.1 -3,-0.2 0.698 132.2 23.8 -85.5 -19.7 -21.6 -21.9 -4.7 17 38 A M H < S- 0 0 51 -4,-1.3 -3,-0.2 -5,-0.4 -2,-0.2 0.416 92.3-115.8-135.3 -4.4 -24.0 -19.9 -2.4 18 39 A G < + 0 0 31 -4,-1.3 94,-0.6 -5,-0.2 -4,-0.2 0.632 57.4 152.0 76.2 9.8 -27.3 -19.0 -4.0 19 40 A F E -A 111 0A 3 -6,-1.2 2,-0.3 92,-0.1 -1,-0.2 -0.389 24.6-166.2 -59.6 152.0 -26.9 -15.2 -4.0 20 41 A E E +A 110 0A 49 90,-1.6 90,-2.9 1,-0.1 -1,-0.0 -0.941 56.3 17.5-137.2 160.3 -28.7 -13.5 -6.8 21 42 A R E S- 0 0 74 -2,-0.3 2,-0.1 88,-0.2 -1,-0.1 0.798 72.9-167.2 48.6 39.1 -28.7 -10.0 -8.3 22 43 A L E - 0 0 0 87,-0.1 18,-1.0 -12,-0.1 2,-0.4 -0.380 6.2-168.7 -58.7 127.6 -25.3 -9.1 -6.9 23 44 A T E -AB 108 39A 9 85,-2.3 85,-1.9 16,-0.2 2,-0.5 -0.986 16.3-168.3-130.5 128.5 -24.7 -5.3 -7.3 24 45 A L E -AB 107 38A 0 14,-2.4 13,-3.1 -2,-0.4 14,-1.1 -0.970 11.0-174.2-110.1 127.8 -21.6 -3.2 -6.8 25 46 A T E -AB 106 36A 1 81,-2.1 81,-1.6 -2,-0.5 2,-0.3 -0.987 3.0-165.9-121.3 140.8 -22.0 0.6 -6.7 26 47 A I E -AB 105 35A 3 9,-2.7 9,-3.8 -2,-0.4 79,-0.2 -0.921 30.9 -96.6-123.6 149.3 -19.1 3.0 -6.6 27 48 A Y E - B 0 34A 70 77,-2.6 7,-0.3 -2,-0.3 77,-0.0 -0.454 29.6-157.6 -65.5 131.4 -19.1 6.7 -5.8 28 49 A D E >> - B 0 33A 60 5,-3.1 4,-1.4 -2,-0.1 5,-1.1 -0.969 2.5-160.4-107.8 113.4 -19.2 9.1 -8.8 29 50 A P T 45S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.855 87.4 60.2 -62.7 -32.3 -17.9 12.6 -7.8 30 51 A S T 45S+ 0 0 109 1,-0.2 0, 0.0 3,-0.1 0, 0.0 0.858 120.1 22.8 -67.1 -37.5 -19.5 14.2 -10.8 31 52 A T T 45S- 0 0 70 -3,-0.5 -1,-0.2 2,-0.2 3,-0.1 0.418 99.6-130.5-108.3 -3.9 -23.1 13.3 -9.9 32 53 A D T <5S+ 0 0 89 -4,-1.4 19,-0.4 1,-0.2 2,-0.3 0.873 71.2 107.0 50.1 48.4 -22.4 12.8 -6.2 33 54 A Q E - 0 0 124 -2,-0.4 3,-2.5 -17,-0.2 11,-0.1 -0.578 50.0 -73.4 -83.4 158.5 -27.9 9.7 -3.4 51 72 A K T 3 S+ 0 0 116 -19,-0.4 7,-0.2 1,-0.3 -1,-0.1 -0.312 123.5 12.8 -52.3 129.2 -27.1 9.5 0.3 52 73 A G T 3 S+ 0 0 20 5,-2.4 2,-0.5 1,-0.2 -1,-0.3 0.346 92.5 134.3 82.6 -4.7 -30.1 8.3 2.2 53 74 A E S <> S- 0 0 47 -3,-2.5 4,-2.0 4,-0.2 -1,-0.2 -0.698 73.2 -35.2 -83.3 120.8 -31.9 7.2 -1.0 54 75 A G H > S- 0 0 9 -2,-0.5 4,-1.7 3,-0.2 23,-0.2 0.162 97.1 -57.1 53.5 179.6 -33.5 3.7 -0.6 55 76 A I H > S+ 0 0 5 21,-0.6 4,-2.4 2,-0.2 5,-0.2 0.909 139.8 53.5 -54.4 -45.7 -31.8 1.0 1.5 56 77 A T H > S+ 0 0 15 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.931 109.7 47.9 -59.1 -47.3 -28.7 1.2 -0.6 57 78 A G H X S+ 0 0 0 -4,-2.0 -5,-2.4 2,-0.2 4,-2.3 0.774 109.6 53.3 -65.3 -30.0 -28.4 4.9 -0.0 58 79 A K H X S+ 0 0 52 -4,-1.7 4,-3.1 -6,-0.3 6,-0.3 0.903 106.2 51.0 -74.7 -41.8 -29.0 4.4 3.7 59 80 A V H X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 5,-0.3 0.878 113.4 48.3 -54.8 -39.2 -26.1 1.9 4.0 60 81 A W H < S+ 0 0 9 -4,-1.7 3,-0.3 -5,-0.2 -2,-0.2 0.940 115.4 43.0 -65.9 -50.0 -24.0 4.5 2.2 61 82 A K H < S+ 0 0 124 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.917 125.3 31.7 -62.2 -48.0 -25.1 7.4 4.5 62 83 A H H < S- 0 0 127 -4,-3.1 -1,-0.2 2,-0.2 -2,-0.2 0.277 94.4-135.4 -97.9 4.0 -24.9 5.5 7.9 63 84 A G < + 0 0 23 -4,-0.8 -3,-0.1 -3,-0.3 -4,-0.1 0.705 67.1 113.2 44.3 34.1 -22.0 3.2 7.0 64 85 A V S S- 0 0 86 -5,-0.3 -2,-0.2 -6,-0.3 -1,-0.1 -0.994 71.2-108.0-134.0 136.9 -23.8 0.1 8.6 65 86 A P - 0 0 47 0, 0.0 2,-0.4 0, 0.0 30,-0.2 -0.232 29.2-154.3 -62.7 154.9 -25.1 -3.0 6.9 66 87 A I E -D 94 0A 47 28,-1.5 28,-1.4 57,-0.0 2,-0.5 -0.998 2.5-158.5-131.1 128.3 -28.9 -3.4 6.5 67 88 A V E -D 93 0A 54 -2,-0.4 26,-0.2 26,-0.2 3,-0.1 -0.918 1.6-164.5-106.6 128.4 -30.7 -6.7 6.2 68 89 A I E -D 92 0A 9 24,-3.1 24,-2.2 -2,-0.5 3,-0.3 -0.918 3.5-164.6-105.1 106.5 -34.2 -6.8 4.7 69 90 A P S S+ 0 0 89 0, 0.0 2,-0.4 0, 0.0 44,-0.2 0.896 80.7 14.1 -63.7 -35.4 -35.6 -10.2 5.7 70 91 A D > - 0 0 41 21,-0.1 3,-1.7 -3,-0.1 21,-0.2 -0.920 64.0-157.9-141.6 116.2 -38.5 -10.0 3.1 71 92 A I G > S+ 0 0 22 19,-2.7 3,-1.3 -2,-0.4 6,-0.2 0.788 92.6 63.1 -62.8 -34.6 -38.4 -7.4 0.4 72 93 A S G 3 S+ 0 0 82 18,-0.3 -1,-0.3 1,-0.2 17,-0.0 0.702 103.2 53.4 -57.1 -21.0 -42.2 -7.5 -0.2 73 94 A Q G < S+ 0 0 146 -3,-1.7 -1,-0.2 1,-0.1 -2,-0.2 0.238 95.4 71.3-109.1 10.8 -42.5 -6.2 3.4 74 95 A E X - 0 0 63 -3,-1.3 3,-1.2 1,-0.1 -1,-0.1 -0.923 52.6-172.1-130.4 109.9 -40.3 -3.1 3.3 75 96 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.567 83.1 72.1 -72.5 -11.5 -41.6 -0.0 1.4 76 97 A E T 3 S+ 0 0 100 -22,-0.1 2,-0.8 -23,-0.0 -21,-0.6 0.552 76.4 100.5 -77.0 -6.4 -38.3 1.8 1.8 77 98 A F < - 0 0 27 -3,-1.2 -3,-0.1 -6,-0.2 -23,-0.1 -0.727 57.5-169.6 -84.5 112.5 -37.0 -0.8 -0.7 78 99 A L - 0 0 85 -2,-0.8 -1,-0.2 -25,-0.0 -24,-0.0 0.782 16.2-148.5 -79.3 -31.9 -36.9 1.0 -4.1 79 100 A N > + 0 0 50 4,-0.1 4,-0.7 1,-0.1 -2,-0.1 0.898 44.4 150.5 63.3 40.3 -36.3 -1.9 -6.5 80 101 A K T 4 + 0 0 55 1,-0.1 -1,-0.1 2,-0.1 -32,-0.0 0.855 60.4 32.8 -79.7 -41.4 -34.4 0.6 -8.7 81 102 A V T 4 S+ 0 0 13 1,-0.1 -1,-0.1 -34,-0.1 -34,-0.1 0.855 128.2 28.2 -88.1 -35.7 -31.8 -1.4 -10.5 82 103 A W T 4 S- 0 0 51 -61,-0.1 -2,-0.1 2,-0.0 -1,-0.1 0.585 76.5-153.1-109.2 -12.8 -33.4 -4.8 -11.1 83 104 A K < - 0 0 131 -4,-0.7 2,-0.1 1,-0.1 -3,-0.1 0.877 28.5-169.2 29.5 75.9 -37.1 -4.1 -11.2 84 105 A R - 0 0 48 2,-0.0 2,-0.3 -5,-0.0 -1,-0.1 -0.372 7.6-153.8 -83.7 164.8 -38.0 -7.6 -10.0 85 106 A K 0 0 177 -2,-0.1 0, 0.0 1,-0.0 0, 0.0 -0.975 360.0 360.0-148.7 139.3 -41.4 -9.1 -10.0 86 107 A K 0 0 212 -2,-0.3 -2,-0.0 2,-0.0 -1,-0.0 0.303 360.0 360.0 85.5 360.0 -43.4 -11.8 -8.1 87 ! 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 88 110 A K 0 0 197 0, 0.0 2,-1.4 0, 0.0 -16,-0.2 0.000 360.0 360.0 360.0-171.3 -41.3 -15.9 -3.2 89 111 A K + 0 0 169 24,-0.1 24,-0.8 -19,-0.1 2,-0.4 -0.629 360.0 179.1 -92.0 85.9 -39.8 -14.8 0.2 90 112 A I E - E 0 112A 30 -2,-1.4 -19,-2.7 22,-0.2 -18,-0.3 -0.753 14.6-153.0-103.5 135.4 -36.7 -13.0 -0.9 91 113 A A E - E 0 111A 0 20,-2.6 20,-1.6 -2,-0.4 2,-0.4 -0.637 4.8-151.7 -99.0 157.1 -34.1 -11.3 1.4 92 114 A F E -DE 68 110A 3 -24,-2.2 -24,-3.1 -2,-0.2 2,-0.4 -0.988 9.2-174.3-135.6 137.7 -31.8 -8.4 0.7 93 115 A I E -DE 67 109A 1 16,-2.1 16,-1.7 -2,-0.4 2,-0.4 -0.998 1.1-176.9-137.2 131.8 -28.5 -7.6 2.2 94 116 A A E -DE 66 108A 0 -28,-1.4 -28,-1.5 -2,-0.4 14,-0.3 -0.992 6.3-172.2-132.3 120.7 -26.5 -4.5 1.5 95 117 A V E - E 0 107A 0 12,-3.2 12,-2.1 -2,-0.4 2,-0.1 -0.878 25.7-112.7-115.6 149.4 -23.0 -3.9 3.0 96 118 A P E - E 0 106A 12 0, 0.0 2,-0.6 0, 0.0 10,-0.2 -0.456 18.6-141.4 -71.4 146.2 -20.8 -0.8 3.0 97 119 A I E - E 0 105A 1 8,-2.7 7,-1.9 -2,-0.1 8,-1.1 -0.981 25.0-165.4-109.5 113.6 -17.4 -0.8 1.0 98 120 A K E + E 0 103A 131 -2,-0.6 2,-0.3 5,-0.2 5,-0.2 -0.894 20.0 153.4-108.7 131.5 -14.9 1.1 3.1 99 121 A S E > + E 0 102A 39 3,-2.6 3,-1.1 -2,-0.4 -2,-0.1 -0.962 69.9 19.1-154.1 139.7 -11.5 2.4 1.8 100 122 A G T 3 S- 0 0 80 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.818 131.0 -71.1 66.1 28.6 -9.4 5.3 3.0 101 123 A G T 3 S+ 0 0 77 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.768 118.0 99.2 54.6 29.0 -11.5 4.9 6.1 102 124 A K E < S- E 0 99A 163 -3,-1.1 -3,-2.6 -5,-0.0 2,-0.9 -0.934 85.5 -98.2-134.8 161.1 -14.5 6.2 4.2 103 125 A V E + E 0 98A 33 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.724 37.3 175.5 -85.2 107.4 -17.5 4.6 2.4 104 126 A I E - 0 0 42 -7,-1.9 -77,-2.6 -2,-0.9 2,-0.3 0.614 61.4 -51.4 -88.7 -13.0 -16.6 4.5 -1.3 105 127 A G E -AE 26 97A 0 -8,-1.1 -8,-2.7 -79,-0.2 2,-0.4 -0.978 61.0 -79.2 166.4-159.6 -19.7 2.6 -2.2 106 128 A V E -AE 25 96A 2 -81,-1.6 -81,-2.1 -2,-0.3 2,-0.4 -0.993 14.3-157.1-148.2 131.1 -22.0 -0.4 -1.6 107 129 A L E +AE 24 95A 0 -12,-2.1 -12,-3.2 -2,-0.4 2,-0.3 -0.856 24.5 169.1-101.7 140.6 -22.2 -4.2 -2.3 108 130 A S E +AE 23 94A 6 -85,-1.9 -85,-2.3 -2,-0.4 2,-0.3 -0.942 10.5 177.4-148.0 170.9 -25.6 -6.0 -2.2 109 131 A A E - E 0 93A 1 -16,-1.7 -16,-2.1 -2,-0.3 2,-0.2 -0.966 24.6-123.3-168.1 151.8 -27.2 -9.3 -3.1 110 132 A D E -AE 20 92A 1 -90,-2.9 -90,-1.6 -2,-0.3 2,-0.3 -0.672 26.9-175.1-100.2 163.9 -30.6 -11.1 -2.9 111 133 A K E -AE 19 91A 16 -20,-1.6 -20,-2.6 -2,-0.2 2,-0.7 -0.884 26.8-138.3-162.8 124.1 -31.0 -14.5 -1.1 112 134 A E E - E 0 90A 88 -94,-0.6 2,-0.4 -2,-0.3 -22,-0.2 -0.812 43.7-124.3 -83.5 120.9 -33.9 -16.9 -0.8 113 135 A I - 0 0 66 -24,-0.8 2,-0.3 -2,-0.7 -24,-0.1 -0.524 17.6-147.0 -86.9 125.5 -33.5 -17.8 2.8 114 136 A N > - 0 0 102 -2,-0.4 3,-2.3 1,-0.1 -1,-0.1 -0.656 21.5-125.1 -82.7 138.1 -33.1 -21.4 4.0 115 137 A E T 3 S+ 0 0 180 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.846 112.2 50.2 -48.0 -37.1 -34.5 -22.4 7.3 116 138 A K T 3 S+ 0 0 187 2,-0.0 2,-0.3 -3,-0.0 -1,-0.3 0.498 102.1 74.5 -89.0 -0.8 -31.0 -23.7 8.3 117 139 A D < - 0 0 59 -3,-2.3 2,-0.4 4,-0.0 3,-0.0 -0.764 68.4-141.5-107.8 156.0 -29.1 -20.6 7.3 118 140 A S > - 0 0 41 -2,-0.3 4,-1.7 1,-0.1 3,-0.4 -0.939 11.8-142.8-119.7 140.8 -28.9 -17.2 9.0 119 141 A L H > S+ 0 0 31 -2,-0.4 4,-2.3 1,-0.2 5,-0.1 0.711 101.7 63.7 -72.0 -19.6 -28.8 -13.8 7.4 120 142 A D H > S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.890 104.8 47.2 -64.9 -39.5 -26.3 -12.5 10.0 121 143 A E H > S+ 0 0 105 -3,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.914 112.8 47.8 -70.4 -39.9 -23.9 -15.1 8.7 122 144 A Y H X S+ 0 0 23 -4,-1.7 4,-3.1 1,-0.2 5,-0.2 0.931 111.1 51.5 -64.2 -43.5 -24.5 -14.0 5.1 123 145 A T H X S+ 0 0 11 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.898 110.0 48.3 -59.8 -44.1 -24.2 -10.4 6.0 124 146 A R H X S+ 0 0 136 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.904 111.7 51.7 -65.4 -41.5 -20.8 -11.0 7.7 125 147 A F H >X S+ 0 0 58 -4,-2.4 4,-2.4 1,-0.2 3,-0.8 0.961 108.7 48.2 -55.9 -58.0 -19.7 -13.0 4.6 126 148 A L H 3X S+ 0 0 0 -4,-3.1 4,-3.1 1,-0.3 -1,-0.2 0.868 106.9 57.6 -53.4 -37.4 -20.6 -10.3 2.2 127 149 A S H 3X S+ 0 0 42 -4,-2.0 4,-1.5 -5,-0.2 -1,-0.3 0.842 106.6 51.0 -62.6 -28.7 -18.7 -7.8 4.4 128 150 A M H X S+ 0 0 0 -4,-1.4 4,-1.4 -3,-0.4 3,-0.6 0.907 102.9 58.1 -84.4 -45.3 -13.2 -5.6 -3.4 134 156 A A H 3< S+ 0 0 5 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.715 99.7 63.4 -53.9 -20.7 -12.0 -2.5 -1.6 135 157 A N H 3< S+ 0 0 102 -4,-0.9 3,-0.4 1,-0.2 -1,-0.2 0.928 98.0 52.1 -73.6 -44.8 -8.5 -4.0 -2.1 136 158 A S H << S+ 0 0 64 -4,-0.8 2,-2.2 -3,-0.6 -2,-0.2 0.871 97.6 72.5 -45.9 -41.3 -8.9 -3.8 -5.9 137 159 A F < 0 0 76 -4,-1.4 -1,-0.3 -135,-0.0 -2,-0.1 -0.143 360.0 360.0 -76.9 46.1 -9.7 -0.1 -5.1 138 160 A S 0 0 143 -2,-2.2 -3,-0.1 -3,-0.4 -39,-0.0 -0.859 360.0 360.0 172.4 360.0 -6.1 0.6 -4.3