==== 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 31-AUG-04 1XBW . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN ISDG; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS; . AUTHOR R.ZHANG,R.WU,G.JOACHIMIAK,O.SCHNEEWIND,A.JOACHIMIAK,MIDWEST . 383 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20052.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 77.5 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 . 159 41.5 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 . 45 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 49 12.8 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+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 2 2 3 1 0 0 0 0 0 0 0 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 1 7 0 4 4 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 2 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 E 0 0 188 0, 0.0 2,-0.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -54.1 36.0 -14.4 1.0 2 0 A T + 0 0 55 1,-0.2 59,-0.2 2,-0.1 58,-0.1 -0.890 360.0 38.3-134.3 166.7 33.6 -12.0 2.7 3 1 A M S S+ 0 0 12 -2,-0.3 58,-0.2 2,-0.1 -1,-0.2 0.893 72.2 124.3 60.9 46.8 33.2 -8.3 3.4 4 2 A K + 0 0 105 56,-1.8 91,-2.7 1,-0.2 2,-0.4 0.613 65.3 41.9-106.5 -19.2 34.6 -7.2 0.0 5 3 A F E -AB 60 94A 3 55,-2.3 55,-3.8 89,-0.3 2,-0.4 -0.995 62.3-166.5-136.3 136.1 31.8 -5.0 -1.2 6 4 A M E -AB 59 93A 2 87,-2.2 87,-2.6 -2,-0.4 2,-0.4 -0.954 2.0-164.6-123.8 140.7 29.5 -2.5 0.6 7 5 A A E -AB 58 92A 1 51,-3.1 51,-3.2 -2,-0.4 2,-0.4 -0.957 4.8-162.3-123.3 144.3 26.3 -0.9 -0.6 8 6 A E E -AB 57 91A 2 83,-3.0 83,-2.4 -2,-0.4 2,-0.7 -0.985 12.3-163.8-131.9 124.4 24.6 2.2 0.8 9 7 A N E -AB 56 90A 30 47,-2.0 47,-2.5 -2,-0.4 2,-0.6 -0.936 22.0-158.7-101.5 111.1 21.0 3.4 0.5 10 8 A R E -AB 55 89A 70 79,-3.5 79,-2.4 -2,-0.7 2,-0.5 -0.857 6.3-165.6 -99.3 119.7 21.2 7.0 1.6 11 9 A L E -AB 54 88A 5 43,-3.4 43,-2.4 -2,-0.6 2,-0.7 -0.902 9.5-159.3-110.0 123.0 18.0 8.5 2.7 12 10 A T E -AB 53 87A 29 75,-1.5 74,-2.5 -2,-0.5 75,-1.7 -0.886 26.9-178.7 -98.7 116.6 17.5 12.2 3.1 13 11 A L E -AB 52 85A 0 39,-3.2 39,-2.4 -2,-0.7 72,-0.2 -0.728 36.3 -89.6-117.8 165.5 14.5 12.8 5.4 14 12 A T E > -A 51 0A 74 70,-1.1 3,-1.7 -2,-0.2 4,-0.2 -0.476 64.6 -92.2 -65.3 138.5 12.4 15.5 6.9 15 13 A K T 3 S+ 0 0 89 35,-0.6 -1,-0.1 1,-0.2 34,-0.0 -0.328 111.0 27.5 -59.3 130.7 14.1 16.4 10.2 16 14 A G T 3 S+ 0 0 59 -3,-0.1 3,-0.3 -2,-0.0 4,-0.3 0.126 95.9 89.1 107.1 -19.4 12.6 14.4 13.1 17 15 A T <> + 0 0 38 -3,-1.7 4,-1.6 1,-0.2 5,-0.2 0.446 55.4 100.2 -90.9 -0.8 11.4 11.3 11.2 18 16 A A H > S+ 0 0 2 -4,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.854 77.9 52.2 -54.0 -45.0 14.6 9.3 11.5 19 17 A K H > S+ 0 0 77 -3,-0.3 4,-2.4 1,-0.2 5,-0.2 0.944 108.8 48.6 -60.5 -50.4 13.5 7.0 14.4 20 18 A D H > S+ 0 0 92 -4,-0.3 4,-0.7 1,-0.2 -1,-0.2 0.853 113.3 48.4 -57.8 -38.6 10.3 5.8 12.8 21 19 A I H >< S+ 0 0 0 -4,-1.6 3,-0.7 2,-0.2 4,-0.3 0.935 110.8 50.6 -67.7 -47.3 12.2 5.1 9.5 22 20 A I H >< S+ 0 0 6 -4,-2.4 3,-2.5 1,-0.3 -2,-0.2 0.895 103.7 56.7 -59.1 -45.0 14.9 3.2 11.3 23 21 A E H >< S+ 0 0 17 -4,-2.4 3,-1.8 1,-0.3 4,-0.3 0.791 94.4 71.3 -58.0 -26.1 12.5 0.9 13.3 24 22 A R T << S+ 0 0 60 -4,-0.7 3,-0.4 -3,-0.7 -1,-0.3 0.676 93.2 56.5 -64.7 -16.0 11.2 -0.0 9.9 25 23 A F T < S+ 0 0 30 -3,-2.5 -1,-0.3 -4,-0.3 -2,-0.2 0.389 76.6 88.6 -99.0 5.0 14.4 -2.0 9.3 26 24 A Y S < S+ 0 0 29 -3,-1.8 2,-0.8 1,-0.2 -1,-0.2 0.720 84.6 63.3 -72.2 -17.9 14.2 -4.2 12.4 27 25 A T S S- 0 0 28 -3,-0.4 -1,-0.2 -4,-0.3 189,-0.1 -0.871 70.9-178.0-105.1 94.8 12.2 -6.6 10.1 28 26 A R > - 0 0 53 -2,-0.8 3,-0.8 1,-0.1 50,-0.1 0.495 31.3-131.9 -77.6 -2.7 14.9 -7.4 7.5 29 27 A H T 3 - 0 0 64 1,-0.2 48,-0.1 48,-0.1 49,-0.1 0.703 66.2 -56.2 62.2 22.6 12.6 -9.7 5.4 30 28 A G T > S+ 0 0 19 48,-0.0 3,-1.5 45,-0.0 -1,-0.2 0.714 87.6 141.6 85.8 23.1 15.1 -12.5 5.1 31 29 A I G X + 0 0 6 -3,-0.8 3,-1.4 1,-0.3 6,-0.2 0.811 69.7 65.4 -66.4 -25.0 18.1 -10.7 3.6 32 30 A E G 3 S+ 0 0 51 1,-0.3 -1,-0.3 4,-0.1 5,-0.1 0.609 85.4 72.1 -71.4 -11.8 20.3 -12.9 5.9 33 31 A T G < 0 0 106 -3,-1.5 -1,-0.3 3,-0.0 -2,-0.2 0.476 360.0 360.0 -81.9 -1.2 19.2 -16.0 4.0 34 32 A L < 0 0 71 -3,-1.4 3,-1.4 -4,-0.1 31,-0.0 -0.659 360.0 360.0 -85.0 360.0 21.4 -14.9 1.1 35 ! 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 36 34 A G 0 0 33 0, 0.0 25,-1.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 3.1 26.8 -13.6 -0.0 37 35 A F E +C 60 0A 7 -3,-1.4 23,-0.2 23,-0.2 3,-0.1 -0.710 360.0 172.8 -85.7 130.2 25.3 -11.3 2.6 38 36 A D E - 0 0 7 21,-2.8 162,-3.7 -2,-0.4 2,-0.3 0.631 54.3 -52.8-112.2 -19.4 27.7 -10.5 5.5 39 37 A G E -CD 59 199A 0 20,-1.1 20,-2.5 160,-0.3 -1,-0.4 -0.934 42.2-126.1 163.1 173.6 25.8 -7.9 7.5 40 38 A M E -CD 58 198A 9 158,-2.9 158,-2.3 -2,-0.3 2,-0.4 -0.998 6.9-162.9-152.8 149.4 24.0 -4.5 7.7 41 39 A F E -CD 57 197A 0 16,-2.5 16,-3.5 -2,-0.3 2,-0.5 -0.996 3.4-163.8-133.4 135.6 24.1 -1.2 9.5 42 40 A V E +CD 56 196A 0 154,-2.9 154,-1.6 -2,-0.4 153,-1.6 -0.983 24.8 177.8-121.3 116.4 21.4 1.4 9.7 43 41 A T E -CD 55 194A 1 12,-2.1 12,-1.3 -2,-0.5 2,-0.4 -0.729 27.7-144.6-119.8 166.8 22.7 4.7 10.9 44 42 A Q E -CD 54 193A 42 149,-2.0 149,-2.3 -2,-0.2 2,-0.2 -0.998 29.3-121.9-129.7 124.9 21.6 8.2 11.6 45 43 A T E - D 0 192A 4 8,-2.1 3,-0.5 -2,-0.4 8,-0.3 -0.477 31.9-133.0 -67.6 131.8 24.0 11.1 10.9 46 44 A L S S+ 0 0 31 145,-3.3 145,-0.3 -2,-0.2 -1,-0.1 -0.453 77.5 27.9 -86.8 160.7 24.6 13.1 14.1 47 45 A E S S+ 0 0 160 1,-0.2 2,-0.5 -2,-0.1 -1,-0.2 0.805 77.3 150.0 62.8 33.6 24.5 16.9 14.5 48 46 A Q + 0 0 72 -3,-0.5 -1,-0.2 1,-0.2 5,-0.0 -0.850 18.1 171.9 -99.1 130.2 22.1 17.5 11.6 49 47 A E S S+ 0 0 148 -2,-0.5 -1,-0.2 -34,-0.0 3,-0.1 0.799 74.2 35.8-102.8 -40.1 19.8 20.5 12.0 50 48 A D S S+ 0 0 134 1,-0.2 -35,-0.6 -36,-0.0 2,-0.3 0.809 123.0 7.4 -89.5 -34.5 18.1 20.8 8.7 51 49 A F E -A 14 0A 105 -37,-0.2 2,-0.3 -35,-0.0 -37,-0.2 -0.951 67.0-121.7-144.2 159.7 17.4 17.3 7.5 52 50 A D E -A 13 0A 3 -39,-2.4 -39,-3.2 -2,-0.3 2,-0.4 -0.799 23.4-157.6-101.7 149.8 17.8 13.8 8.9 53 51 A E E -A 12 0A 32 -2,-0.3 -8,-2.1 -8,-0.3 2,-0.5 -0.983 9.0-175.5-131.4 121.4 20.0 11.3 7.0 54 52 A V E -AC 11 44A 0 -43,-2.4 -43,-3.4 -2,-0.4 2,-0.5 -0.966 6.9-163.5-117.3 129.9 19.6 7.6 7.4 55 53 A K E -AC 10 43A 2 -12,-1.3 -12,-2.1 -2,-0.5 2,-0.8 -0.954 9.2-157.0-115.7 130.9 22.0 5.2 5.7 56 54 A I E -AC 9 42A 6 -47,-2.5 -47,-2.0 -2,-0.5 2,-0.5 -0.906 18.8-167.8-106.2 103.8 21.3 1.6 5.1 57 55 A L E -AC 8 41A 7 -16,-3.5 -16,-2.5 -2,-0.8 2,-0.4 -0.826 5.3-172.3 -97.7 125.0 24.8 -0.1 4.7 58 56 A T E -AC 7 40A 2 -51,-3.2 -51,-3.1 -2,-0.5 2,-0.5 -0.948 8.8-154.3-118.2 135.8 25.0 -3.6 3.5 59 57 A V E +AC 6 39A 0 -20,-2.5 -21,-2.8 -2,-0.4 -20,-1.1 -0.926 19.1 174.8-110.2 132.4 28.2 -5.6 3.4 60 58 A W E -AC 5 37A 1 -55,-3.8 -55,-2.3 -2,-0.5 -56,-1.8 -0.805 42.1-120.9-130.6 171.3 28.7 -8.4 0.9 61 59 A K S S+ 0 0 103 -25,-1.8 2,-0.3 -2,-0.3 -24,-0.1 0.591 96.0 2.7 -89.4 -10.8 31.4 -10.8 -0.3 62 60 A S S > S- 0 0 39 -26,-0.4 4,-1.1 -57,-0.2 3,-0.4 -0.979 71.6-108.5-166.9 159.9 31.1 -9.5 -3.8 63 61 A K H > S+ 0 0 119 -2,-0.3 4,-2.8 1,-0.2 3,-0.3 0.871 117.8 58.2 -62.4 -37.1 29.4 -7.0 -6.0 64 62 A Q H > S+ 0 0 132 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.825 97.6 59.5 -63.1 -33.0 27.4 -9.8 -7.7 65 63 A A H > S+ 0 0 16 -3,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.898 111.6 42.3 -60.5 -39.5 26.0 -10.8 -4.3 66 64 A F H X S+ 0 0 13 -4,-1.1 4,-2.1 -3,-0.3 -2,-0.2 0.929 113.1 50.0 -72.4 -49.6 24.6 -7.3 -4.1 67 65 A T H X S+ 0 0 45 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.864 110.9 50.6 -61.4 -34.9 23.4 -7.1 -7.7 68 66 A D H >< S+ 0 0 79 -4,-2.7 3,-0.7 1,-0.2 -1,-0.2 0.895 107.9 54.0 -67.9 -38.3 21.6 -10.5 -7.3 69 67 A W H >< S+ 0 0 17 -4,-1.4 3,-2.2 1,-0.3 6,-0.4 0.890 99.7 60.3 -60.9 -41.0 20.0 -9.2 -4.2 70 68 A L H 3< S+ 0 0 69 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.815 108.3 47.1 -55.7 -29.5 18.7 -6.2 -6.2 71 69 A K T << S+ 0 0 150 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.348 96.4 103.8 -94.7 5.5 16.9 -8.8 -8.2 72 70 A S S <> S- 0 0 24 -3,-2.2 4,-1.4 -4,-0.1 -3,-0.1 -0.362 75.8-124.1 -90.5 168.3 15.5 -10.8 -5.3 73 71 A D H > S+ 0 0 128 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.787 112.5 59.2 -75.9 -29.8 12.0 -11.1 -3.7 74 72 A V H > S+ 0 0 29 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.822 102.6 53.5 -69.1 -29.8 13.4 -10.2 -0.4 75 73 A F H > S+ 0 0 48 -6,-0.4 4,-2.4 2,-0.2 5,-0.2 0.945 108.7 49.5 -67.1 -47.2 14.6 -6.9 -1.9 76 74 A K H X S+ 0 0 135 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.909 110.7 49.0 -57.3 -46.5 11.1 -6.2 -3.1 77 75 A A H X S+ 0 0 32 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.850 114.0 45.7 -63.4 -37.0 9.5 -6.9 0.3 78 76 A A H X S+ 0 0 24 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.843 113.6 48.9 -75.4 -33.6 12.0 -4.7 2.1 79 77 A H H < S+ 0 0 122 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.807 114.9 45.5 -74.5 -30.3 11.6 -1.9 -0.5 80 78 A K H < S+ 0 0 170 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.748 107.2 58.0 -83.3 -26.8 7.8 -2.2 -0.2 81 79 A H H < 0 0 80 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.881 360.0 360.0 -70.1 -38.7 7.8 -2.3 3.6 82 80 A V < 0 0 50 -4,-1.3 -61,-0.0 -5,-0.1 -57,-0.0 -0.487 360.0 360.0 -97.3 360.0 9.6 1.1 3.8 83 ! 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 84 90 A P 0 0 89 0, 0.0 -70,-1.1 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 -48.4 9.3 11.4 5.0 85 91 A I E +B 13 0A 60 -72,-0.2 -72,-0.2 1,-0.2 3,-0.1 -0.477 360.0 170.4 -67.0 105.0 11.9 10.3 2.4 86 92 A I E + 0 0 79 -74,-2.5 2,-0.3 -2,-0.7 -73,-0.2 0.899 69.5 15.4 -79.1 -48.3 12.8 13.4 0.4 87 93 A N E -B 12 0A 95 -75,-1.7 -75,-1.5 2,-0.0 2,-0.3 -0.883 58.5-168.8-128.1 160.6 15.7 11.8 -1.4 88 94 A N E +B 11 0A 92 -2,-0.3 2,-0.3 -77,-0.2 -77,-0.2 -0.876 15.2 170.6-152.9 111.4 17.0 8.3 -2.0 89 95 A K E -B 10 0A 109 -79,-2.4 -79,-3.5 -2,-0.3 2,-0.4 -0.936 20.4-146.0-126.5 147.2 20.4 7.6 -3.5 90 96 A V E +B 9 0A 72 -2,-0.3 2,-0.3 -81,-0.2 -81,-0.2 -0.943 17.9 177.3-116.5 135.0 22.4 4.4 -3.8 91 97 A I E -B 8 0A 21 -83,-2.4 -83,-3.0 -2,-0.4 2,-0.3 -0.966 9.9-157.7-132.6 147.9 26.2 4.3 -3.6 92 98 A T E -B 7 0A 17 54,-0.4 54,-2.4 -2,-0.3 2,-0.3 -0.911 8.6-171.8-128.2 157.4 28.6 1.3 -3.8 93 99 A Y E -BE 6 145A 5 -87,-2.6 -87,-2.2 -2,-0.3 2,-0.5 -0.983 27.4-125.0-147.5 157.8 32.1 0.6 -2.6 94 100 A D E -BE 5 144A 77 50,-2.4 50,-1.5 -2,-0.3 2,-0.9 -0.896 30.2-138.4 -98.4 124.3 35.0 -1.8 -2.6 95 101 A I E + E 0 143A 8 -91,-2.7 48,-0.2 -2,-0.5 3,-0.1 -0.786 24.6 178.9 -86.1 111.3 35.9 -2.7 0.9 96 102 A G E + 0 0 35 46,-2.1 2,-0.3 -2,-0.9 -1,-0.2 0.560 67.8 12.3 -88.7 -8.4 39.7 -2.6 0.8 97 103 A Y E + E 0 142A 58 45,-1.1 45,-2.7 -94,-0.1 2,-0.3 -0.872 61.7 175.5-169.7 132.6 40.1 -3.4 4.4 98 104 A S E - E 0 141A 43 -2,-0.3 2,-0.3 43,-0.2 43,-0.2 -0.996 7.3-174.5-142.3 144.1 37.9 -4.6 7.3 99 105 A Y E - E 0 140A 73 41,-2.3 41,-1.5 -2,-0.3 2,-0.6 -0.831 5.5-179.3-142.0 97.9 38.7 -5.6 10.9 100 106 A M E E 0 139A 65 -2,-0.3 39,-0.2 39,-0.2 -2,-0.0 -0.900 360.0 360.0-100.8 117.2 35.8 -7.0 12.9 101 107 A K 0 0 128 37,-1.9 -2,-0.0 -2,-0.6 37,-0.0 -0.330 360.0 360.0 -92.5 360.0 36.9 -7.8 16.5 102 !* 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 0.0 103 0 B T 0 0 95 0, 0.0 57,-0.1 0, 0.0 58,-0.1 0.000 360.0 360.0 360.0 160.7 28.1 -3.5 20.9 104 1 B M + 0 0 20 1,-0.1 57,-0.3 55,-0.1 3,-0.1 0.664 360.0 132.8 14.0 85.9 28.2 -1.5 17.6 105 2 B K + 0 0 69 55,-3.2 89,-2.2 1,-0.3 2,-0.3 0.358 61.5 47.9-132.2 -1.5 26.0 1.6 18.5 106 3 B F E -FG 160 193A 1 54,-1.9 54,-3.6 87,-0.3 2,-0.4 -1.000 60.0-165.6-144.7 139.8 28.2 4.4 17.2 107 4 B M E -FG 159 192A 1 85,-2.5 85,-2.9 -2,-0.3 2,-0.4 -0.993 2.3-164.1-130.5 135.0 30.0 5.0 13.9 108 5 B A E -FG 158 191A 4 50,-2.4 50,-2.3 -2,-0.4 2,-0.5 -0.937 10.5-161.5-114.9 138.9 32.8 7.5 13.0 109 6 B E E -FG 157 190A 5 81,-3.1 81,-2.8 -2,-0.4 2,-0.8 -0.979 13.8-164.7-127.7 127.5 33.6 8.2 9.4 110 7 B N E -FG 156 189A 41 46,-1.8 46,-2.3 -2,-0.5 2,-0.6 -0.934 20.2-163.5-107.8 105.8 36.7 9.9 8.1 111 8 B R E -FG 155 188A 48 77,-2.3 77,-2.6 -2,-0.8 2,-0.5 -0.844 4.4-167.6 -97.7 120.8 35.8 10.8 4.5 112 9 B L E -FG 154 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18,-0.2 2,-0.3 -0.979 3.9-154.0-152.9 162.0 13.5 7.1 40.1 333 39 D F E -MP 289 349B 0 16,-2.2 16,-3.0 -2,-0.3 2,-0.5 -0.980 7.7-157.4-134.2 142.7 12.2 3.8 41.6 334 40 D V E -MP 288 348B 0 -46,-2.3 -47,-2.1 -2,-0.3 -46,-1.1 -0.993 26.0-176.0-122.2 117.7 14.3 1.2 43.4 335 41 D T E -MP 286 347B 1 12,-2.6 12,-1.9 -2,-0.5 2,-0.4 -0.790 25.0-150.2-118.2 160.6 12.5 -2.2 43.3 336 42 D Q E -MP 285 346B 47 -51,-2.0 -51,-2.4 -2,-0.3 10,-0.2 -0.998 29.0-123.6-127.4 122.8 13.0 -5.7 44.6 337 43 D T E -M 284 0B 5 8,-2.1 3,-0.5 -2,-0.4 8,-0.3 -0.474 30.9-125.9 -68.6 135.2 11.5 -8.5 42.5 338 44 D L S S+ 0 0 32 -55,-2.7 -55,-0.3 1,-0.2 -1,-0.1 -0.541 78.3 19.3 -88.9 150.5 9.1 -10.7 44.5 339 45 D E S S+ 0 0 163 1,-0.2 2,-0.5 -2,-0.2 -1,-0.2 0.794 78.3 146.2 66.8 36.1 9.1 -14.4 45.1 340 46 D Q + 0 0 75 -3,-0.5 -1,-0.2 1,-0.1 5,-0.1 -0.869 18.6 172.4-101.6 132.9 12.7 -15.0 44.2 341 47 D E + 0 0 150 -2,-0.5 -1,-0.1 -34,-0.1 -34,-0.1 0.828 69.9 42.7-107.9 -47.1 14.4 -17.7 46.1 342 48 D D S S+ 0 0 136 1,-0.1 -35,-0.6 -36,-0.1 2,-0.3 0.792 125.2 4.3 -75.8 -28.2 17.9 -18.4 44.7 343 49 D F E -N 306 0B 112 -37,-0.2 2,-0.3 -36,-0.0 -37,-0.2 -0.952 69.4-120.8-149.1 164.1 18.9 -14.8 44.2 344 50 D D E -N 305 0B 4 -39,-2.3 -39,-2.6 -2,-0.3 2,-0.4 -0.761 20.9-155.1-105.4 157.1 17.6 -11.3 44.9 345 51 D E E -N 304 0B 41 -8,-0.3 -8,-2.1 -2,-0.3 2,-0.4 -0.979 10.1-176.7-136.4 120.9 17.1 -8.8 42.1 346 52 D V E -NP 303 336B 0 -43,-2.2 -43,-2.8 -2,-0.4 2,-0.5 -0.977 8.2-161.6-119.5 129.8 17.1 -5.0 42.7 347 53 D K E -NP 302 335B 6 -12,-1.9 -12,-2.6 -2,-0.4 2,-0.8 -0.935 9.8-159.0-116.1 133.1 16.4 -2.6 39.9 348 54 D I E -NP 301 334B 14 -47,-1.5 -47,-2.1 -2,-0.5 2,-0.5 -0.924 18.1-170.0-107.3 103.8 17.2 1.1 39.9 349 55 D L E -NP 300 333B 6 -16,-3.0 -16,-2.2 -2,-0.8 2,-0.5 -0.867 2.8-169.3 -99.9 126.8 14.9 2.7 37.3 350 56 D T E -NP 299 332B 4 -51,-3.0 -51,-2.8 -2,-0.5 2,-0.5 -0.966 9.8-149.1-118.7 131.3 15.6 6.2 36.3 351 57 D V E -NP 298 331B 0 -20,-3.0 -21,-3.1 -2,-0.5 -20,-0.7 -0.865 20.8-173.0-100.6 128.1 13.1 8.3 34.3 352 58 D W E -NP 297 329B 0 -55,-3.7 -56,-1.9 -2,-0.5 -55,-1.9 -0.864 38.8-125.5-126.2 158.6 14.5 10.9 32.0 353 59 D K S S- 0 0 112 -25,-3.0 2,-0.3 -2,-0.3 -24,-0.1 0.822 95.5 -19.3 -63.9 -34.0 13.4 13.7 29.7 354 60 D S S > S- 0 0 39 -26,-0.3 4,-1.3 -57,-0.1 3,-0.4 -0.975 70.8 -93.8-167.5 164.9 15.3 12.1 26.9 355 61 D K H > S+ 0 0 102 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.825 121.8 56.6 -55.6 -35.9 18.1 9.6 26.1 356 62 D Q H > S+ 0 0 135 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.911 100.0 57.9 -63.8 -43.5 20.7 12.4 26.0 357 63 D A H > S+ 0 0 11 -3,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.896 110.5 44.8 -52.7 -42.9 19.7 13.5 29.5 358 64 D F H X S+ 0 0 17 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.936 112.0 48.9 -68.6 -50.1 20.7 10.0 30.7 359 65 D T H X S+ 0 0 44 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.878 108.8 55.1 -60.4 -37.0 23.9 9.7 28.7 360 66 D D H >< S+ 0 0 81 -4,-2.9 3,-0.9 1,-0.2 4,-0.3 0.925 105.9 52.5 -59.3 -45.3 25.0 13.2 30.0 361 67 D W H >< S+ 0 0 23 -4,-1.6 3,-1.5 1,-0.2 6,-0.4 0.857 98.9 65.3 -57.7 -38.9 24.4 11.9 33.6 362 68 D L H 3< S+ 0 0 66 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.832 106.7 40.3 -55.2 -35.1 26.7 8.9 32.8 363 69 D K T << S+ 0 0 100 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.397 98.1 109.3 -96.9 4.3 29.7 11.2 32.4 364 70 D S S <> S- 0 0 27 -3,-1.5 4,-1.2 -4,-0.3 5,-0.1 -0.245 76.4-121.4 -79.5 165.5 28.8 13.5 35.3 365 71 D D H > S+ 0 0 130 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.821 112.7 58.1 -72.4 -34.4 30.5 13.9 38.7 366 72 D V H > S+ 0 0 30 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.799 101.8 54.8 -68.4 -27.5 27.2 12.9 40.5 367 73 D F H > S+ 0 0 46 -6,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.898 109.3 47.7 -70.4 -41.2 27.2 9.6 38.6 368 74 D K H < S+ 0 0 106 -4,-1.2 -2,-0.2 2,-0.2 -1,-0.2 0.928 109.1 53.7 -64.4 -45.4 30.6 8.8 39.9 369 75 D A H < S+ 0 0 42 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.919 114.6 40.7 -55.2 -48.5 29.7 9.8 43.5 370 76 D A H < S+ 0 0 36 -4,-1.9 2,-2.9 1,-0.2 -2,-0.2 0.964 103.5 67.6 -67.1 -53.3 26.7 7.5 43.5 371 77 D H < 0 0 88 -4,-2.8 -1,-0.2 -5,-0.2 -4,-0.0 -0.354 360.0 360.0 -72.2 68.8 28.4 4.6 41.7 372 78 D K 0 0 205 -2,-2.9 -3,-0.0 -3,-0.2 -4,-0.0 -0.943 360.0 360.0-158.6 360.0 30.8 3.8 44.6 373 ! 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 0.0 374 89 D S 0 0 146 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -45.9 30.0 -6.9 47.6 375 90 D P + 0 0 20 0, 0.0 -69,-2.0 0, 0.0 2,-1.0 0.505 360.0 104.6 -83.9 0.4 26.6 -8.7 47.5 376 91 D I E - O 0 305B 64 -71,-0.2 -71,-0.3 1,-0.2 3,-0.1 -0.693 47.8-175.8 -86.8 98.8 26.2 -7.8 43.8 377 92 D I E S- 0 0 76 -73,-1.5 2,-0.3 -2,-1.0 -72,-0.2 0.784 71.2 -28.6 -62.1 -28.0 26.9 -10.9 41.8 378 93 D N E - O 0 304B 77 -74,-1.3 -74,-2.9 -3,-0.1 2,-0.4 -0.892 55.8-140.5 176.7 153.5 26.6 -8.8 38.6 379 94 D N E - O 0 303B 84 -2,-0.3 2,-0.3 -76,-0.2 -76,-0.2 -0.976 11.5-172.3-131.3 143.6 24.9 -5.7 37.1 380 95 D K E - O 0 302B 92 -78,-1.5 -78,-2.5 -2,-0.4 2,-0.5 -0.977 15.5-141.5-132.8 144.0 23.4 -5.0 33.7 381 96 D V E + O 0 301B 89 -2,-0.3 2,-0.3 -80,-0.2 -80,-0.2 -0.941 21.8 179.5-111.0 124.2 22.2 -1.7 32.2 382 97 D I E - O 0 300B 15 -82,-2.4 -82,-2.5 -2,-0.5 2,-0.3 -0.903 9.1-156.6-121.2 148.6 19.1 -1.7 30.1 383 98 D T E - O 0 299B 29 -137,-0.4 -137,-2.9 -2,-0.3 2,-0.3 -0.925 8.8-176.0-127.8 154.4 17.4 1.2 28.3 384 99 D Y E -LO 245 298B 4 -86,-2.5 -86,-2.4 -2,-0.3 2,-0.5 -0.977 26.3-127.4-144.1 154.4 13.8 1.8 27.1 385 100 D D E -LO 244 297B 56 -141,-2.1 -141,-1.5 -2,-0.3 2,-0.9 -0.914 29.2-134.0-101.8 127.6 11.9 4.5 25.2 386 101 D I E +L 243 0B 3 -90,-1.8 -143,-0.2 -2,-0.5 3,-0.1 -0.758 26.0 178.5 -85.4 107.2 8.8 5.4 27.2 387 102 D G E + 0 0 27 -145,-1.7 2,-0.3 -2,-0.9 -1,-0.2 0.664 69.6 8.9 -81.7 -16.8 6.0 5.4 24.7 388 103 D Y E +L 242 0B 50 -146,-1.2 -146,-2.5 -3,-0.1 2,-0.3 -0.947 60.8 172.8-165.0 139.5 3.4 6.3 27.3 389 104 D S E -L 241 0B 35 -2,-0.3 2,-0.3 -148,-0.2 -148,-0.2 -0.991 7.2-174.3-149.1 146.3 3.1 7.3 31.0 390 105 D Y E -L 240 0B 77 -150,-2.2 -150,-1.6 -2,-0.3 2,-0.9 -0.859 3.3-171.7-146.4 105.0 0.3 8.5 33.2 391 106 D M 0 0 57 -2,-0.3 -152,-0.2 -152,-0.2 -153,-0.0 -0.757 360.0 360.0-103.6 86.5 1.2 9.6 36.7 392 107 D K 0 0 137 -2,-0.9 -1,-0.2 -154,-0.2 -153,-0.2 0.877 360.0 360.0 -40.9 360.0 -2.2 10.1 38.5