==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 02-NOV-06 2NRH . COMPND 2 MOLECULE: TRANSCRIPTIONAL ACTIVATOR, PUTATIVE, BAF FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: CAMPYLOBACTER JEJUNI; . AUTHOR J.B.BONANNO,M.DICKEY,K.T.BAIN,C.LAU,S.WASSERMAN,D.SMITH,J.M. . 391 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19353.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 288 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 32 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 3 3 2 0 0 0 3 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 3 3 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 PARALLEL BRIDGES PER LADDER . 0 0 0 2 4 1 0 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 3 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 1 A L 0 0 101 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 96.5 71.0 17.9 8.2 2 2 A L - 0 0 33 11,-0.0 30,-1.9 2,-0.0 2,-0.4 -0.799 360.0-172.2 -93.7 115.4 70.5 18.2 12.0 3 3 A L E -Ab 14 32A 0 11,-2.5 11,-2.2 -2,-0.6 2,-0.4 -0.865 4.4-164.7-109.0 141.7 72.3 15.6 14.3 4 4 A C E -Ab 13 33A 0 28,-2.8 30,-1.9 -2,-0.4 2,-0.7 -0.984 13.0-170.7-129.7 127.0 71.9 15.0 18.0 5 5 A D E -Ab 12 34A 15 7,-2.8 7,-1.7 -2,-0.4 2,-0.7 -0.944 20.9-163.4-110.6 100.5 74.1 13.1 20.4 6 6 A I E +Ab 11 35A 0 28,-2.5 30,-2.0 -2,-0.7 31,-0.5 -0.817 14.5 175.9 -95.2 117.3 72.0 13.0 23.6 7 7 A G - 0 0 12 3,-3.5 30,-0.1 -2,-0.7 -1,-0.0 -0.266 45.5 -87.5-111.5-169.4 73.9 12.2 26.7 8 8 A N S S+ 0 0 41 1,-0.1 3,-0.1 -2,-0.1 15,-0.1 0.791 123.3 11.9 -77.4 -27.3 73.4 11.9 30.4 9 9 A S S S+ 0 0 48 1,-0.2 14,-1.7 13,-0.1 2,-0.3 0.697 129.1 34.3-112.2 -34.4 74.1 15.5 31.2 10 10 A N E - C 0 22A 72 12,-0.2 -3,-3.5 13,-0.1 2,-0.6 -0.857 56.4-140.4-128.0 152.5 74.1 17.2 27.8 11 11 A A E -AC 6 21A 0 10,-3.3 10,-2.1 -2,-0.3 2,-0.4 -0.851 23.1-158.8-109.7 94.6 72.6 17.2 24.2 12 12 A N E -AC 5 20A 26 -7,-1.7 -7,-2.8 -2,-0.6 2,-0.3 -0.580 14.6-167.2 -60.9 116.6 75.3 17.9 21.7 13 13 A F E -AC 4 19A 0 6,-3.9 6,-1.5 -2,-0.4 2,-0.3 -0.827 15.7-168.3-110.1 150.4 73.8 19.2 18.4 14 14 A L E AC 3 18A 20 -11,-2.2 -11,-2.5 -2,-0.3 4,-0.2 -0.863 360.0 360.0-139.8 108.4 75.3 19.7 14.9 15 15 A D 0 0 109 2,-1.8 3,-0.1 -2,-0.3 4,-0.0 0.384 360.0 360.0-108.9 360.0 73.3 21.7 12.3 16 ! 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 17 18 A K 0 0 167 0, 0.0 -2,-1.8 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 85.3 77.2 24.7 13.7 18 19 A Y E +C 14 0A 64 -4,-0.2 2,-0.2 -3,-0.1 -4,-0.2 -0.409 360.0 150.5 -71.6 153.3 78.1 22.7 16.9 19 20 A F E -C 13 0A 51 -6,-1.5 -6,-3.9 -2,-0.1 2,-0.4 -0.838 28.5-142.6 178.6 151.7 76.2 23.6 20.1 20 21 A T E -C 12 0A 51 -8,-0.2 2,-0.3 -2,-0.2 -8,-0.3 -0.976 5.8-165.1-132.0 135.8 75.1 21.9 23.3 21 22 A L E -C 11 0A 27 -10,-2.1 -10,-3.3 -2,-0.4 2,-0.2 -0.803 25.6-122.4-104.8 156.0 72.1 22.1 25.5 22 23 A N E > -C 10 0A 65 -2,-0.3 4,-2.8 -12,-0.2 3,-0.3 -0.531 38.2-102.4 -83.2 167.6 71.9 20.7 29.0 23 24 A I H > S+ 0 0 20 -14,-1.7 4,-2.5 1,-0.2 5,-0.2 0.922 122.1 53.8 -60.7 -46.5 69.0 18.2 29.5 24 25 A D H > S+ 0 0 131 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.818 114.9 44.1 -60.8 -30.7 66.6 20.6 31.3 25 26 A Q H >> S+ 0 0 102 -3,-0.3 3,-1.2 2,-0.2 4,-0.7 0.904 108.5 55.9 -72.0 -49.9 67.2 22.9 28.3 26 27 A F H >< S+ 0 0 5 -4,-2.8 3,-1.0 1,-0.3 -2,-0.2 0.862 100.4 61.4 -53.2 -39.1 66.8 20.1 25.7 27 28 A L H 3< S+ 0 0 91 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.828 110.6 38.2 -58.0 -36.6 63.4 19.3 27.2 28 29 A E H << 0 0 187 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.385 360.0 360.0 -95.3 2.7 62.2 22.8 26.3 29 30 A F << 0 0 122 -3,-1.0 -3,-0.0 -4,-0.7 -8,-0.0 -0.463 360.0 360.0 -73.5 360.0 64.0 22.9 22.9 30 ! 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 31 36 A I 0 0 39 0, 0.0 20,-2.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 105.7 66.8 15.3 13.6 32 37 A F E -bd 3 51A 19 -30,-1.9 -28,-2.8 18,-0.2 2,-0.3 -0.686 360.0-179.9 -78.1 133.7 68.8 12.1 13.5 33 38 A Y E -bd 4 52A 15 18,-2.3 20,-2.4 -2,-0.4 21,-0.5 -0.944 35.6-159.0-141.0 152.5 69.9 11.0 17.0 34 39 A I E -b 5 0A 1 -30,-1.9 -28,-2.5 -2,-0.3 2,-0.4 -0.948 26.0-168.2-117.9 149.1 71.7 8.6 19.3 35 40 A N E +b 6 0A 13 -2,-0.3 33,-0.2 -30,-0.2 -28,-0.2 -0.992 31.1 169.5-140.9 129.2 70.7 8.6 22.9 36 41 A V + 0 0 9 -30,-2.0 2,-1.2 -2,-0.4 286,-0.2 0.352 53.5 111.6-107.5 1.6 72.1 7.0 26.1 37 42 A N > - 0 0 12 -31,-0.5 3,-2.1 1,-0.2 4,-0.4 -0.629 49.0-166.8 -81.0 96.0 69.8 8.9 28.5 38 43 A E G > S+ 0 0 71 -2,-1.2 3,-1.9 1,-0.3 4,-0.4 0.871 87.6 53.5 -38.5 -51.9 67.4 6.3 30.0 39 44 A H G 3 S+ 0 0 141 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.518 106.8 55.6 -77.2 -1.5 65.0 8.9 31.4 40 45 A L G <> S+ 0 0 7 -3,-2.1 4,-1.6 2,-0.1 -1,-0.3 0.401 77.6 93.7-103.3 -3.3 64.8 10.3 27.9 41 46 A K H <> S+ 0 0 110 -3,-1.9 4,-1.7 -4,-0.4 3,-0.4 0.960 87.8 46.2 -52.9 -56.0 63.7 7.2 26.0 42 47 A E H >> S+ 0 0 153 -4,-0.4 4,-2.0 1,-0.2 3,-0.6 0.930 110.6 50.7 -49.3 -61.3 59.9 7.9 26.3 43 48 A H H 3> S+ 0 0 47 -4,-0.3 4,-0.8 1,-0.3 -1,-0.2 0.781 108.1 53.7 -52.0 -36.5 60.1 11.6 25.3 44 49 A L H >< S+ 0 0 2 -4,-1.6 3,-0.7 -3,-0.4 -1,-0.3 0.880 104.6 52.2 -73.4 -40.1 62.1 10.8 22.2 45 50 A K H << S+ 0 0 175 -4,-1.7 -2,-0.2 -3,-0.6 -1,-0.2 0.933 104.6 59.6 -60.5 -44.4 59.6 8.2 20.8 46 51 A N H 3< S+ 0 0 124 -4,-2.0 2,-0.6 1,-0.1 -1,-0.2 0.817 92.1 80.5 -41.6 -39.4 57.0 10.9 21.3 47 52 A Q << - 0 0 62 -4,-0.8 3,-0.3 -3,-0.7 -1,-0.1 -0.673 59.1-170.8 -91.2 118.5 58.9 13.2 18.9 48 53 A K S S+ 0 0 179 -2,-0.6 -1,-0.1 1,-0.2 -2,-0.0 0.703 81.8 61.0 -87.2 -20.8 58.3 12.4 15.3 49 54 A N S S+ 0 0 83 2,-0.0 2,-0.4 -17,-0.0 -1,-0.2 0.736 90.6 87.3 -70.2 -24.9 61.0 14.7 13.7 50 55 A F - 0 0 20 -3,-0.3 2,-0.5 -6,-0.2 -18,-0.2 -0.637 62.1-167.1 -80.2 130.5 63.6 12.6 15.7 51 56 A I E -d 32 0A 61 -20,-2.5 -18,-2.3 -2,-0.4 2,-0.2 -0.982 18.5-131.8-121.1 118.1 64.9 9.5 13.9 52 57 A N E -d 33 0A 55 -2,-0.5 -18,-0.2 -20,-0.2 -20,-0.1 -0.504 19.2-173.9 -70.1 135.3 66.9 7.0 16.0 53 58 A L >> + 0 0 0 -20,-2.4 3,-1.8 -2,-0.2 4,-0.7 0.536 59.4 95.6-104.3 -15.9 70.1 6.0 14.3 54 59 A E G >4 S+ 0 0 71 -21,-0.5 3,-1.1 1,-0.3 -1,-0.1 0.843 78.6 54.8 -45.8 -50.3 71.2 3.3 16.7 55 60 A P G 34 S+ 0 0 97 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.674 101.1 62.4 -66.3 -9.8 69.7 0.2 14.9 56 61 A Y G <4 S+ 0 0 86 -3,-1.8 -2,-0.2 2,-0.0 2,-0.1 0.743 81.3 95.2 -83.6 -22.5 71.7 1.2 11.7 57 62 A F << - 0 0 17 -3,-1.1 2,-0.4 -4,-0.7 15,-0.0 -0.446 50.8-175.6 -70.2 137.4 75.1 0.8 13.3 58 63 A L + 0 0 148 -2,-0.1 2,-0.4 13,-0.1 -2,-0.0 -0.972 15.6 164.0-133.5 122.0 76.7 -2.6 12.7 59 64 A F - 0 0 46 -2,-0.4 2,-0.5 2,-0.1 12,-0.0 -0.990 34.1-128.4-148.5 117.7 79.9 -2.8 14.6 60 65 A D + 0 0 154 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.636 42.9 146.6 -82.3 128.2 82.0 -5.8 15.5 61 66 A T - 0 0 36 -2,-0.5 36,-0.1 2,-0.1 -2,-0.1 -0.990 50.3-142.2-152.3 143.9 82.9 -6.1 19.1 62 67 A I S S+ 0 0 117 34,-1.2 2,-0.5 -2,-0.3 35,-0.1 0.276 78.8 103.1 -89.7 16.2 83.5 -8.9 21.5 63 68 A Y > - 0 0 8 33,-0.2 3,-0.6 35,-0.1 2,-0.4 -0.832 69.2-136.4-103.8 127.6 81.8 -6.6 24.1 64 69 A Q B 3 S+e 337 0B 136 272,-2.6 274,-0.6 -2,-0.5 -2,-0.1 -0.697 81.1 3.9 -88.1 131.4 78.2 -7.2 25.1 65 70 A G T 3 S- 0 0 68 -2,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.879 78.2-176.7 66.8 39.5 75.8 -4.2 25.4 66 71 A L < - 0 0 14 -3,-0.6 -1,-0.2 1,-0.1 -5,-0.0 -0.543 30.5-111.5 -62.7 127.0 78.3 -1.5 24.2 67 72 A G > - 0 0 6 -2,-0.3 4,-2.3 1,-0.1 3,-0.2 -0.232 16.9-122.1 -63.2 154.0 76.6 1.9 24.5 68 73 A I H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.770 110.3 58.9 -76.8 -25.5 75.8 3.7 21.3 69 74 A D H > S+ 0 0 30 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.899 109.5 45.1 -66.1 -37.8 77.8 6.8 22.2 70 75 A R H > S+ 0 0 7 -3,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.968 113.7 48.8 -70.1 -46.1 80.9 4.5 22.4 71 76 A I H X S+ 0 0 23 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.933 114.3 46.3 -53.6 -54.3 80.0 2.7 19.1 72 77 A A H < S+ 0 0 0 -4,-2.8 4,-0.4 2,-0.2 112,-0.3 0.856 113.4 47.8 -58.5 -42.4 79.5 6.1 17.3 73 78 A A H < S+ 0 0 1 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.928 118.6 41.1 -64.1 -46.4 82.7 7.6 18.7 74 79 A C H >< S+ 0 0 2 -4,-2.7 3,-2.0 1,-0.2 -2,-0.2 0.591 91.2 94.2 -74.0 -14.1 84.6 4.5 17.7 75 80 A Y T 3< S+ 0 0 38 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.805 89.0 37.8 -60.5 -33.6 82.9 4.0 14.4 76 81 A T T 3 S+ 0 0 44 -3,-0.5 2,-0.6 -4,-0.4 -1,-0.3 0.119 94.4 100.1-100.7 20.6 85.4 5.9 12.1 77 82 A I < - 0 0 12 -3,-2.0 3,-0.2 1,-0.2 5,-0.1 -0.937 44.2-176.0-116.7 119.1 88.6 4.8 13.9 78 83 A E S S+ 0 0 142 -2,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.922 75.5 4.5 -76.1 -48.6 90.6 2.0 12.3 79 84 A D S S+ 0 0 108 2,-0.1 -1,-0.3 15,-0.0 2,-0.2 -0.993 94.5 59.1-144.5 132.4 93.2 1.7 15.1 80 85 A G S S- 0 0 1 14,-3.0 14,-2.7 -2,-0.3 2,-0.5 -0.828 75.2 -63.2 148.6 175.1 93.7 3.5 18.5 81 86 A V E -Fg 93 157C 0 75,-2.3 77,-3.3 -2,-0.2 2,-0.6 -0.884 43.5-156.4 -94.0 128.6 92.4 4.3 22.0 82 87 A V E -Fg 92 158C 2 10,-3.1 10,-2.8 -2,-0.5 2,-0.5 -0.931 9.9-173.6-112.0 114.0 89.1 6.3 21.9 83 88 A V E -Fg 91 159C 0 75,-3.2 77,-1.7 -2,-0.6 2,-0.5 -0.904 5.8-172.5-108.1 125.0 88.4 8.4 25.0 84 89 A D E -Fg 90 160C 17 6,-2.4 6,-1.9 -2,-0.5 2,-0.7 -0.952 9.3-163.5-118.3 115.6 85.0 10.3 25.4 85 90 A A E +F 89 0C 0 75,-2.2 78,-2.2 -2,-0.5 79,-0.5 -0.841 41.6 98.0-112.1 104.3 84.9 12.6 28.4 86 91 A G S S- 0 0 26 2,-3.0 19,-0.3 -2,-0.7 20,-0.2 -0.317 95.5 -17.1-140.2-136.4 81.5 13.8 29.6 87 92 A S S S+ 0 0 19 17,-0.2 17,-3.2 -2,-0.1 2,-0.3 0.834 143.7 14.6 -42.5 -43.9 79.2 12.6 32.4 88 93 A A E S- H 0 103C 18 15,-0.3 -2,-3.0 -4,-0.1 2,-0.6 -0.826 82.6-127.5-125.1 168.8 81.3 9.5 32.2 89 94 A I E -FH 85 102C 0 13,-2.8 13,-2.4 -2,-0.3 2,-0.4 -0.954 23.4-164.7-123.5 114.1 84.6 8.9 30.6 90 95 A T E -FH 84 101C 9 -6,-1.9 -6,-2.4 -2,-0.6 2,-0.5 -0.825 3.1-164.2-101.0 133.0 84.6 5.9 28.2 91 96 A I E -FH 83 100C 0 9,-2.7 9,-2.2 -2,-0.4 2,-0.3 -0.965 15.0-175.4-120.4 110.9 87.9 4.5 27.1 92 97 A D E -FH 82 99C 2 -10,-2.8 -10,-3.1 -2,-0.5 2,-0.5 -0.866 15.8-139.5-117.3 144.9 87.7 2.2 24.1 93 98 A I E F 81 0C 2 5,-3.0 4,-3.2 -2,-0.3 5,-0.4 -0.848 360.0 360.0-113.8 122.2 90.2 -0.0 22.2 94 99 A I 0 0 32 -14,-2.7 -14,-3.0 -2,-0.5 -16,-0.1 -0.963 360.0 360.0-124.3 360.0 90.5 -0.5 18.4 95 ! 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 96 104 A H 0 0 22 0, 0.0 -34,-1.2 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 104.8 86.7 -3.2 19.3 97 105 A L - 0 0 103 -4,-3.2 2,-0.2 1,-0.3 237,-0.2 0.171 360.0 -80.4 -98.7 18.6 88.8 -5.2 21.8 98 106 A G - 0 0 0 -5,-0.4 -5,-3.0 238,-0.1 -1,-0.3 -0.595 45.4-156.2 112.4-174.8 87.1 -3.8 24.8 99 107 A G E -H 92 0C 0 236,-1.3 2,-0.3 -7,-0.2 -7,-0.2 -0.960 8.6-125.7 165.0 165.8 87.1 -0.7 27.1 100 108 A F E -H 91 0C 0 -9,-2.2 -9,-2.7 -2,-0.3 2,-0.4 -0.810 14.6-130.6-142.4 166.7 86.3 0.7 30.5 101 109 A I E +H 90 0C 5 240,-1.9 -11,-0.2 -2,-0.3 244,-0.2 -0.976 16.3 178.9-130.5 141.8 84.3 3.5 32.1 102 110 A L E -H 89 0C 4 -13,-2.4 -13,-2.8 -2,-0.4 2,-0.1 -0.912 39.1 -91.9-125.9 166.4 84.9 6.2 34.7 103 111 A P E -H 88 0C 0 0, 0.0 -15,-0.3 0, 0.0 -16,-0.1 -0.448 49.0-106.3 -69.5 151.1 82.8 9.0 36.2 104 112 A G >> - 0 0 0 -17,-3.2 4,-1.8 1,-0.1 3,-0.5 -0.293 34.1-103.2 -69.0 163.5 83.1 12.3 34.5 105 113 A I H 3> S+ 0 0 18 -19,-0.3 4,-1.6 1,-0.3 -1,-0.1 0.864 121.3 52.1 -61.9 -42.3 85.1 15.0 36.2 106 114 A A H 3> S+ 0 0 65 -20,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.778 106.9 54.7 -63.7 -28.0 82.0 16.9 37.4 107 115 A N H <> S+ 0 0 4 -3,-0.5 4,-1.8 2,-0.2 -2,-0.2 0.858 103.8 53.9 -81.9 -28.6 80.6 13.7 38.9 108 116 A Y H X S+ 0 0 10 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.899 108.5 51.7 -57.4 -42.4 83.8 13.3 40.8 109 117 A K H X S+ 0 0 71 -4,-1.6 4,-2.5 1,-0.2 5,-0.2 0.958 104.8 55.8 -56.8 -52.7 83.1 16.8 42.1 110 118 A K H X S+ 0 0 66 -4,-2.2 4,-2.0 1,-0.2 5,-0.2 0.838 104.7 51.1 -51.6 -46.1 79.6 15.9 43.1 111 119 A I H X S+ 0 0 11 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.947 116.0 42.4 -58.2 -41.9 80.7 13.0 45.4 112 120 A Y H X S+ 0 0 16 -4,-1.5 4,-2.9 1,-0.2 -2,-0.2 0.886 112.3 51.7 -73.4 -37.3 83.1 15.2 47.2 113 121 A S H < S+ 0 0 43 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.858 111.3 48.8 -68.8 -35.2 80.8 18.2 47.4 114 122 A H H < S+ 0 0 141 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.900 115.3 43.6 -70.0 -44.9 78.1 16.0 49.0 115 123 A I H < S+ 0 0 88 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.901 129.3 27.1 -62.7 -45.0 80.5 14.5 51.5 116 124 A S < 0 0 88 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.1 -0.751 360.0 360.0-126.6 82.7 82.1 17.9 52.3 117 125 A P 0 0 156 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.977 360.0 360.0 -71.3 360.0 79.8 20.8 51.7 118 ! 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 0.0 119 131 A F 0 0 60 0, 0.0 2,-1.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 147.2 89.0 21.5 41.1 120 132 A N > - 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