==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 29-MAY-03 1UFH . COMPND 2 MOLECULE: YYCN PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS SUBSP. SUBTILIS STR. . AUTHOR B.TANEJA,S.MAAR,L.SHUVALOVA,F.R.COLLART,W.ANDERSON,A.MONDRAG . 309 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20024.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 15.2 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 15 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 33.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 2 0 0 0 0 0 3 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 2 0 1 2 1 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 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 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 2 A T 0 0 126 0, 0.0 2,-0.3 0, 0.0 107,-0.1 0.000 360.0 360.0 360.0 88.7 38.4 42.9 34.9 2 3 A I - 0 0 11 105,-0.2 2,-0.3 102,-0.1 64,-0.2 -0.668 360.0-155.8 -88.1 139.4 35.3 43.5 37.0 3 4 A M E -A 65 0A 96 62,-2.4 62,-2.4 -2,-0.3 2,-0.6 -0.883 12.9-132.1-111.9 148.6 32.2 41.6 36.1 4 5 A L E +A 64 0A 38 -2,-0.3 60,-0.2 60,-0.2 70,-0.0 -0.914 30.6 177.9 -99.4 119.1 28.6 42.8 37.0 5 6 A T E -A 63 0A 32 58,-2.0 58,-3.4 -2,-0.6 3,-0.1 -0.986 40.7 -94.1-125.9 137.0 26.6 40.0 38.6 6 7 A P E -A 62 0A 87 0, 0.0 56,-0.3 0, 0.0 54,-0.0 -0.203 50.2-110.1 -48.0 125.1 23.0 40.3 39.8 7 8 A M - 0 0 8 54,-2.5 2,-0.2 68,-0.2 54,-0.1 -0.309 34.7-133.4 -60.8 139.5 23.3 41.1 43.5 8 9 A Q > - 0 0 114 -3,-0.1 4,-3.0 1,-0.1 5,-0.2 -0.638 20.6-103.5 -96.5 159.3 22.1 38.2 45.7 9 10 A T H > S+ 0 0 67 -2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.887 115.8 47.9 -44.5 -60.0 19.8 38.3 48.7 10 11 A E H > S+ 0 0 152 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.939 115.8 44.7 -51.2 -53.3 22.3 38.0 51.5 11 12 A E H > S+ 0 0 52 1,-0.2 4,-3.4 2,-0.2 -1,-0.2 0.904 113.2 53.9 -59.9 -39.6 24.6 40.7 50.1 12 13 A F H X S+ 0 0 14 -4,-3.0 4,-3.0 2,-0.2 -1,-0.2 0.925 107.4 46.0 -62.3 -49.1 21.6 42.8 49.4 13 14 A R H X S+ 0 0 174 -4,-2.8 4,-1.0 2,-0.2 -1,-0.2 0.782 116.7 47.9 -66.0 -27.1 20.1 42.8 52.9 14 15 A S H X S+ 0 0 74 -4,-1.7 4,-1.9 -5,-0.4 -2,-0.2 0.924 113.1 47.8 -73.2 -45.1 23.7 43.5 54.1 15 16 A Y H X S+ 0 0 4 -4,-3.4 4,-3.0 1,-0.2 5,-0.2 0.916 106.5 57.6 -57.5 -45.7 24.1 46.3 51.6 16 17 A L H X S+ 0 0 45 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.902 106.3 49.3 -55.8 -45.1 20.8 47.9 52.4 17 18 A T H X S+ 0 0 78 -4,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.927 112.5 46.2 -59.9 -49.2 21.8 48.3 56.0 18 19 A Y H X S+ 0 0 78 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.940 112.4 51.7 -59.5 -49.0 25.1 49.9 55.2 19 20 A T H X S+ 0 0 5 -4,-3.0 4,-3.5 1,-0.2 5,-0.3 0.910 106.3 51.0 -56.4 -51.6 23.6 52.3 52.6 20 21 A T H X S+ 0 0 18 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.925 116.1 41.8 -54.8 -46.7 20.8 53.7 54.8 21 22 A K H X S+ 0 0 132 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.903 116.7 48.3 -67.6 -40.9 23.3 54.5 57.6 22 23 A H H X S+ 0 0 60 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.912 111.1 49.7 -66.9 -45.2 25.9 55.8 55.2 23 24 A Y H X S+ 0 0 58 -4,-3.5 4,-2.2 2,-0.2 -1,-0.2 0.899 109.5 52.5 -60.2 -42.4 23.4 58.0 53.3 24 25 A A H X S+ 0 0 11 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.926 111.0 47.4 -58.0 -47.0 22.2 59.4 56.6 25 26 A E H X S+ 0 0 121 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.881 110.3 51.5 -63.3 -42.1 25.7 60.3 57.6 26 27 A E H X S+ 0 0 13 -4,-2.4 4,-2.6 1,-0.2 6,-0.2 0.892 108.4 51.5 -65.4 -39.2 26.5 61.9 54.2 27 28 A K H X>S+ 0 0 34 -4,-2.2 6,-1.9 2,-0.2 5,-1.1 0.827 111.7 47.5 -66.5 -31.9 23.4 64.1 54.4 28 29 A V H ><5S+ 0 0 51 -4,-1.6 3,-0.9 4,-0.2 -2,-0.2 0.929 110.9 51.4 -72.4 -44.7 24.5 65.2 57.9 29 30 A K H 3<5S+ 0 0 131 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.918 110.1 50.1 -56.3 -43.9 28.0 65.9 56.6 30 31 A A H 3<5S- 0 0 45 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.667 112.3-119.5 -71.4 -17.5 26.6 68.0 53.7 31 32 A G T <<5S+ 0 0 54 -3,-0.9 -3,-0.2 -4,-0.6 -2,-0.1 0.394 85.4 111.9 94.2 -3.4 24.4 70.1 56.1 32 33 A T S > - 0 0 101 -2,-0.4 3,-2.2 1,-0.1 4,-2.0 -0.611 28.3-118.3 -79.7 144.5 20.0 67.3 60.9 35 36 A P H 3> S+ 0 0 81 0, 0.0 4,-0.6 0, 0.0 -1,-0.1 0.853 114.4 54.8 -48.7 -41.9 21.5 64.4 62.9 36 37 A E H 34 S+ 0 0 153 1,-0.2 4,-0.2 2,-0.1 -2,-0.0 0.557 115.9 37.3 -71.9 -11.8 18.2 64.0 64.8 37 38 A D H <> S+ 0 0 90 -3,-2.2 4,-1.8 2,-0.1 3,-0.3 0.631 93.4 89.2-109.9 -20.7 16.3 63.6 61.5 38 39 A A H X S+ 0 0 5 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.799 82.3 52.7 -52.2 -46.0 18.8 61.7 59.4 39 40 A Q H X S+ 0 0 157 -4,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.946 112.6 41.6 -56.2 -57.0 17.8 58.1 60.3 40 41 A L H > S+ 0 0 110 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.861 115.9 51.0 -62.5 -38.5 14.1 58.3 59.6 41 42 A L H X S+ 0 0 49 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.973 110.3 48.0 -63.4 -53.1 14.7 60.3 56.4 42 43 A S H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.875 113.0 48.9 -53.9 -45.3 17.3 57.8 55.1 43 44 A K H X S+ 0 0 113 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.900 111.3 49.6 -63.9 -40.9 15.0 54.9 55.8 44 45 A Q H X S+ 0 0 95 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.920 110.3 51.4 -63.6 -42.9 12.1 56.7 54.1 45 46 A V H X S+ 0 0 45 -4,-2.8 4,-1.3 1,-0.2 -2,-0.2 0.884 113.4 42.1 -62.5 -41.6 14.2 57.4 51.0 46 47 A F H X S+ 0 0 13 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.761 112.1 55.1 -79.3 -25.6 15.4 53.8 50.5 47 48 A T H < S+ 0 0 68 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.828 110.2 45.8 -73.6 -35.1 11.9 52.4 51.3 48 49 A D H < S+ 0 0 128 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.810 115.9 46.9 -77.1 -29.0 10.4 54.6 48.5 49 50 A L H < S+ 0 0 39 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.2 0.875 127.9 21.8 -79.2 -39.6 13.2 53.7 46.1 50 51 A L >< + 0 0 13 -4,-2.1 3,-1.4 1,-0.1 -1,-0.2 -0.498 66.2 151.3-130.0 67.5 13.2 50.0 46.6 51 52 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.746 86.1 38.4 -69.4 -22.8 9.9 48.9 48.1 52 53 A R T > S- 0 0 156 1,-0.4 3,-2.1 -3,-0.1 4,-0.1 0.158 103.0-143.9-110.9 17.1 10.2 45.5 46.5 53 54 A G G X S- 0 0 16 -3,-1.4 3,-2.2 1,-0.3 -1,-0.4 -0.353 76.5 -2.8 59.8-134.4 13.9 45.3 47.2 54 55 A L G 3 S+ 0 0 47 1,-0.3 -1,-0.3 -3,-0.1 7,-0.2 0.653 135.3 61.3 -61.8 -18.2 15.8 43.5 44.4 55 56 A E G < S+ 0 0 138 -3,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.376 71.8 125.2 -91.6 1.5 12.4 42.9 42.7 56 57 A T S X S- 0 0 12 -3,-2.2 3,-1.5 1,-0.1 2,-0.0 -0.506 71.3-108.7 -65.4 124.8 11.8 46.6 42.4 57 58 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.273 93.1 9.1 -63.9 132.9 11.1 47.2 38.7 58 59 A H T 3 S+ 0 0 88 1,-0.3 21,-2.5 20,-0.1 2,-0.4 0.428 97.8 116.0 81.3 1.8 13.7 49.0 36.6 59 60 A H E < - B 0 78A 23 -3,-1.5 2,-0.6 19,-0.2 -1,-0.3 -0.872 48.5-160.1-101.6 135.1 16.3 49.0 39.3 60 61 A H E - B 0 77A 65 17,-3.1 17,-2.2 -2,-0.4 2,-0.5 -0.941 8.5-177.0-119.0 111.3 19.5 47.1 38.7 61 62 A L E + B 0 76A 11 -2,-0.6 -54,-2.5 15,-0.2 2,-0.4 -0.933 11.4 179.6-108.9 124.4 21.6 46.1 41.7 62 63 A W E -AB 6 75A 29 13,-3.1 13,-1.9 -2,-0.5 2,-0.4 -0.954 28.1-133.0-127.4 145.4 24.8 44.3 40.9 63 64 A S E -AB 5 74A 0 -58,-3.4 -58,-2.0 -2,-0.4 2,-0.7 -0.757 27.8-130.7 -87.4 137.1 27.7 42.9 42.9 64 65 A L E -AB 4 73A 0 9,-3.0 8,-1.8 -2,-0.4 9,-1.3 -0.858 33.4-169.1 -89.5 119.7 31.1 44.0 41.5 65 66 A K E -AB 3 71A 42 -62,-2.4 -62,-2.4 -2,-0.7 6,-0.2 -0.956 32.9-175.9-124.2 133.0 33.1 40.8 41.2 66 67 A L S S- 0 0 42 4,-2.1 2,-0.3 -2,-0.4 -1,-0.1 0.823 80.6 -30.2 -83.2 -40.2 36.8 40.2 40.5 67 68 A N S S- 0 0 49 3,-0.9 -1,-0.3 -64,-0.1 -64,-0.1 -0.909 85.4 -65.5-161.3-173.6 36.3 36.4 40.4 68 69 A E S S+ 0 0 180 -2,-0.3 3,-0.0 1,-0.2 -1,-0.0 0.854 132.3 38.6 -54.1 -36.1 34.2 33.7 42.0 69 70 A K S S+ 0 0 181 1,-0.1 2,-0.7 -4,-0.0 -1,-0.2 0.882 104.2 68.7 -86.2 -40.1 35.6 34.5 45.4 70 71 A D - 0 0 43 2,-0.0 -4,-2.1 1,-0.0 -3,-0.9 -0.728 47.4-177.2 -95.3 115.1 36.0 38.3 45.5 71 72 A I E -B 65 0A 31 -2,-0.7 -6,-0.3 -6,-0.2 25,-0.1 -0.911 10.8-179.8 -97.8 107.0 33.0 40.6 45.6 72 73 A V E - 0 0 0 -8,-1.8 24,-2.2 -2,-0.8 2,-0.3 0.656 51.3 -44.9 -86.5 -14.2 34.8 43.9 45.5 73 74 A G E -BC 64 95A 0 -9,-1.3 -9,-3.0 22,-0.3 2,-0.3 -0.966 56.6 -82.4 177.6-161.8 31.8 46.3 45.7 74 75 A W E -BC 63 94A 6 20,-2.1 20,-1.8 -2,-0.3 2,-0.3 -0.914 18.3-168.8-136.1 158.9 28.3 47.3 44.6 75 76 A L E -BC 62 93A 0 -13,-1.9 -13,-3.1 -2,-0.3 2,-0.4 -0.957 4.6-177.1-151.1 130.3 26.6 49.1 41.8 76 77 A W E +BC 61 92A 2 16,-2.5 15,-1.9 -2,-0.3 16,-1.6 -0.991 9.0 170.6-134.4 120.0 23.0 50.3 41.6 77 78 A I E -BC 60 90A 0 -17,-2.2 -17,-3.1 -2,-0.4 2,-0.5 -0.941 22.8-143.9-128.4 156.6 21.4 52.0 38.6 78 79 A H E +BC 59 89A 53 11,-2.5 11,-2.5 -2,-0.3 2,-0.4 -0.978 22.3 173.7-121.3 120.5 17.9 53.0 37.7 79 80 A A E - C 0 88A 10 -21,-2.5 9,-0.2 -2,-0.5 -2,-0.0 -0.925 15.9-172.1-134.9 115.1 16.9 52.7 34.0 80 81 A E > - 0 0 89 7,-0.6 3,-2.2 -2,-0.4 7,-0.2 -0.917 17.8-150.4-101.3 116.3 13.4 53.3 32.7 81 82 A P T 3 S+ 0 0 24 0, 0.0 -1,-0.1 0, 0.0 7,-0.0 0.548 92.9 67.4 -64.6 -7.8 13.5 52.3 29.0 82 83 A E T 3 S+ 0 0 141 172,-0.0 -3,-0.0 3,-0.0 -2,-0.0 0.396 72.0 122.0 -92.1 2.9 10.7 54.8 28.3 83 84 A H X - 0 0 46 -3,-2.2 3,-1.1 4,-0.1 5,-0.0 -0.452 67.9-132.2 -66.8 132.8 13.1 57.7 29.1 84 85 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.719 107.8 36.7 -58.2 -25.4 13.4 60.1 26.2 85 86 A Q T 3 S- 0 0 95 2,-0.1 37,-0.4 38,-0.0 3,-0.1 0.374 106.9-122.6-109.1 3.0 17.2 60.2 26.5 86 87 A Q < + 0 0 13 -3,-1.1 36,-2.3 1,-0.2 37,-1.0 0.922 54.9 169.2 57.3 42.7 17.5 56.5 27.4 87 88 A E E - d 0 123A 44 34,-0.2 -7,-0.6 35,-0.2 2,-0.4 -0.643 25.6-159.9 -93.7 145.1 19.3 57.7 30.5 88 89 A A E -Cd 79 124A 1 35,-2.4 37,-2.2 -2,-0.3 2,-0.5 -0.962 11.3-141.5-121.3 142.4 20.2 55.6 33.5 89 90 A F E -Cd 78 125A 59 -11,-2.5 -11,-2.5 -2,-0.4 2,-0.9 -0.880 8.4-137.7-108.8 131.0 20.9 57.0 37.0 90 91 A I E +Cd 77 126A 6 35,-3.3 37,-0.6 -2,-0.5 -13,-0.3 -0.784 22.2 178.8 -84.1 110.4 23.6 55.6 39.2 91 92 A Y E - 0 0 87 -15,-1.9 2,-0.3 -2,-0.9 -14,-0.2 0.764 67.7 -3.8 -81.7 -26.4 22.0 55.6 42.7 92 93 A D E +C 76 0A 28 -16,-1.6 -16,-2.5 -3,-0.1 -1,-0.3 -0.982 58.8 169.7-165.2 151.6 25.1 54.1 44.4 93 94 A F E +C 75 0A 24 -2,-0.3 2,-0.3 -18,-0.2 -18,-0.2 -0.885 21.2 125.0-167.0 130.8 28.5 52.7 43.6 94 95 A G E -C 74 0A 14 -20,-1.8 -20,-2.1 -2,-0.3 2,-0.4 -0.987 43.9-105.9-175.9 177.2 31.4 51.8 45.8 95 96 A L E -C 73 0A 18 -2,-0.3 -22,-0.3 -22,-0.2 5,-0.1 -0.927 35.3-109.4-121.1 140.5 34.0 49.3 46.9 96 97 A Y > - 0 0 67 -24,-2.2 3,-2.2 -2,-0.4 4,-0.3 -0.428 45.1-105.5 -64.1 146.1 34.2 47.3 50.2 97 98 A E G > S+ 0 0 153 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.770 115.7 56.0 -50.0 -40.0 37.1 48.7 52.3 98 99 A P G 3 S+ 0 0 96 0, 0.0 -1,-0.3 0, 0.0 -26,-0.1 0.666 107.7 51.4 -70.5 -12.8 39.6 45.9 51.7 99 100 A Y G < S+ 0 0 54 -3,-2.2 3,-0.4 -27,-0.2 5,-0.4 0.402 87.3 106.5-105.8 5.5 39.4 46.3 47.9 100 101 A R < + 0 0 120 -3,-1.2 -4,-0.0 -4,-0.3 -3,-0.0 -0.443 65.5 35.9 -82.1 157.1 40.0 50.1 47.8 101 102 A G S S+ 0 0 80 -2,-0.1 -1,-0.2 1,-0.0 -4,-0.0 0.756 89.9 90.3 77.9 27.2 43.1 51.7 46.6 102 103 A K S S- 0 0 117 -3,-0.4 -2,-0.1 0, 0.0 -1,-0.0 0.293 101.3-104.7-130.3 1.1 44.0 49.3 43.8 103 104 A G S > S+ 0 0 45 -4,-0.1 4,-1.0 3,-0.0 3,-0.5 0.569 78.2 131.4 87.6 11.7 42.2 51.0 41.0 104 105 A Y H > + 0 0 43 -5,-0.4 4,-2.6 1,-0.2 5,-0.2 0.802 62.0 72.4 -64.1 -27.4 39.2 48.7 40.7 105 106 A A H > S+ 0 0 23 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.909 98.4 44.1 -57.4 -46.2 36.8 51.6 40.7 106 107 A K H > S+ 0 0 99 -3,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.874 113.7 51.9 -64.1 -38.6 37.7 52.8 37.1 107 108 A Q H X S+ 0 0 86 -4,-1.0 4,-2.0 1,-0.2 -105,-0.2 0.858 107.8 52.0 -67.2 -36.3 37.6 49.2 35.9 108 109 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.872 108.1 51.2 -68.1 -35.5 34.1 48.9 37.4 109 110 A L H X S+ 0 0 8 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.772 108.1 52.3 -73.2 -26.1 32.9 52.0 35.6 110 111 A A H X S+ 0 0 50 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.903 108.9 49.7 -72.1 -41.6 34.2 50.6 32.3 111 112 A A H X S+ 0 0 13 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.895 110.2 51.5 -63.0 -36.6 32.3 47.5 33.0 112 113 A L H X S+ 0 0 1 -4,-2.0 4,-3.5 2,-0.2 5,-0.2 0.944 107.4 53.2 -60.0 -48.8 29.3 49.7 33.7 113 114 A D H X S+ 0 0 55 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.922 112.3 44.0 -49.3 -53.0 29.9 51.5 30.4 114 115 A Q H X S+ 0 0 84 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.936 115.0 47.2 -59.7 -52.2 29.8 48.2 28.5 115 116 A A H X S+ 0 0 19 -4,-2.7 4,-0.6 1,-0.2 -2,-0.2 0.923 110.7 53.2 -58.3 -45.9 26.8 46.8 30.3 116 117 A A H ><>S+ 0 0 4 -4,-3.5 5,-2.1 1,-0.2 3,-1.3 0.927 108.2 49.4 -56.9 -49.1 24.9 50.1 29.8 117 118 A R H ><5S+ 0 0 124 -4,-2.2 3,-1.0 1,-0.3 -1,-0.2 0.859 107.4 54.3 -57.6 -37.9 25.5 50.1 26.0 118 119 A S H 3<5S+ 0 0 11 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.582 108.2 50.7 -73.0 -11.9 24.3 46.5 25.7 119 120 A M T <<5S- 0 0 47 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.395 119.1-117.0-100.5 -6.7 21.2 47.6 27.5 120 121 A G T < 5 + 0 0 5 -3,-1.0 -3,-0.2 -4,-0.4 2,-0.1 0.544 61.2 150.9 83.9 7.6 20.8 50.4 25.0 121 122 A I < - 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0 0 44 -5,-2.4 2,-0.4 -6,-0.2 -1,-0.3 -0.530 33.2-159.8 -78.6 143.1 7.0 35.6 5.8 300 146 B Q - 0 0 172 -2,-0.2 2,-0.1 0, 0.0 -5,-0.0 -0.929 24.0-104.6-121.4 146.1 5.4 32.1 5.7 301 147 B E + 0 0 117 -2,-0.4 3,-0.1 1,-0.2 0, 0.0 -0.408 39.3 165.1 -65.7 140.0 6.1 29.1 7.9 302 148 B T + 0 0 122 1,-0.4 2,-0.3 -2,-0.1 -1,-0.2 0.515 63.6 18.0-125.7 -25.5 8.2 26.4 6.3 303 149 B D - 0 0 135 2,-0.0 -1,-0.4 0, 0.0 2,-0.4 -0.992 56.5-166.7-151.5 143.5 9.3 24.2 9.3 304 150 B V - 0 0 94 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.0 -0.973 8.6-154.8-129.8 147.6 8.3 23.6 12.8 305 151 B V - 0 0 136 -2,-0.4 2,-0.3 2,-0.0 -20,-0.1 -0.985 19.6-174.7-116.3 129.7 10.1 21.9 15.6 306 152 B M - 0 0 171 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.917 2.5-177.4-124.2 153.9 7.8 20.5 18.4 307 153 B S - 0 0 121 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.972 10.5-163.9-147.6 161.7 8.6 18.8 21.6 308 154 B K - 0 0 164 -2,-0.3 2,-0.5 2,-0.0 -2,-0.0 -0.991 19.3-134.6-146.4 139.6 7.1 17.2 24.6 309 155 B K 0 0 190 -2,-0.3 -2,-0.0 1,-0.0 0, 0.0 -0.809 360.0 360.0 -90.2 129.7 8.3 16.3 28.1 310 156 B L 0 0 204 -2,-0.5 -1,-0.0 0, 0.0 -2,-0.0 -0.546 360.0 360.0 -73.5 360.0 7.2 12.8 28.9