==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 08-JUN-07 2Q82 . COMPND 2 MOLECULE: CORE PROTEIN P7; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PHAGE PHI12; . AUTHOR J.BENACH,E.ERYILMAZ,M.SU,J.SEETHARAMAN,H.WEI,P.GOTTLIEB, . 114 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6757.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 78 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 17.5 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 . 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 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 35 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 1 0 1 0 0 2 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 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 . 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 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 14 A E > 0 0 155 0, 0.0 4,-1.7 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 174.5 22.4 31.3 18.3 2 15 A L H > + 0 0 43 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.783 360.0 55.6 -69.1 -33.4 22.7 34.4 16.1 3 16 A Q H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.906 108.7 47.9 -71.0 -41.1 23.4 37.1 18.5 4 17 A N H > S+ 0 0 99 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.884 111.0 52.9 -67.2 -33.1 26.3 35.5 19.9 5 18 A R H X S+ 0 0 78 -4,-1.7 4,-2.1 1,-0.2 3,-0.3 0.954 111.3 44.8 -65.1 -47.6 27.6 34.8 16.4 6 19 A L H X S+ 0 0 14 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.825 107.1 60.4 -64.5 -31.8 27.3 38.4 15.4 7 20 A A H X S+ 0 0 44 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.892 108.4 43.9 -63.4 -38.9 28.8 39.6 18.6 8 21 A Q H < S+ 0 0 96 -4,-1.6 3,-0.4 -3,-0.3 -2,-0.2 0.870 110.2 53.2 -78.5 -37.2 32.0 37.7 17.8 9 22 A Y H >< S+ 0 0 25 -4,-2.1 3,-1.9 1,-0.2 -2,-0.2 0.957 106.1 58.5 -49.9 -52.1 32.1 38.8 14.2 10 23 A E H 3< S+ 0 0 150 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.744 112.5 35.8 -52.8 -35.0 31.9 42.3 15.5 11 24 A T T 3< S+ 0 0 101 -4,-0.8 59,-0.7 -3,-0.4 2,-0.3 0.080 106.6 79.5-109.7 20.6 35.0 42.1 17.6 12 25 A S E < S-a 70 0A 16 -3,-1.9 2,-0.6 57,-0.1 33,-0.4 -0.883 71.5-124.0-125.9 163.7 37.2 39.9 15.5 13 26 A L E -a 71 0A 14 57,-3.1 59,-2.4 -2,-0.3 2,-0.4 -0.900 26.0-138.0-104.1 123.1 39.4 40.4 12.4 14 27 A X E -ab 72 46A 2 31,-1.5 33,-3.1 -2,-0.6 2,-0.5 -0.687 16.8-158.7 -84.0 144.4 38.6 38.1 9.5 15 28 A V E -ab 73 47A 0 57,-2.9 59,-2.8 -2,-0.4 2,-0.5 -0.967 4.7-164.9-125.2 126.5 41.5 36.7 7.7 16 29 A X E -ab 74 48A 0 31,-3.0 33,-2.9 -2,-0.5 2,-0.6 -0.935 15.2-142.5-121.9 120.5 41.4 35.4 4.2 17 30 A S E + b 0 49A 1 57,-0.5 2,-0.3 -2,-0.5 33,-0.2 -0.648 48.1 135.8 -75.8 119.6 43.9 33.1 2.5 18 31 A H - 0 0 5 31,-2.9 2,-0.4 -2,-0.6 -2,-0.1 -0.886 41.0-158.4-172.6 133.2 44.2 34.4 -1.1 19 32 A N + 0 0 54 62,-2.5 2,-0.2 -2,-0.3 62,-0.1 -0.934 65.7 35.6-111.6 137.2 46.6 35.2 -3.9 20 33 A G S S- 0 0 40 -2,-0.4 2,-0.0 60,-0.1 -2,-0.0 -0.737 104.1 -11.7 118.7-171.4 45.5 37.6 -6.6 21 34 A D S S- 0 0 150 -2,-0.2 -2,-0.0 1,-0.1 0, 0.0 -0.366 76.0-109.2 -66.6 146.1 43.2 40.6 -6.8 22 35 A V - 0 0 62 1,-0.1 -1,-0.1 8,-0.1 8,-0.1 -0.472 31.3-123.2 -78.9 146.9 41.2 41.2 -3.7 23 36 A P - 0 0 26 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.238 14.3-118.0 -80.3 167.8 37.4 40.7 -3.7 24 37 A V - 0 0 144 5,-0.0 2,-0.4 -2,-0.0 5,-0.1 -0.905 32.0-171.4-105.0 138.0 34.6 43.0 -2.9 25 38 A I > - 0 0 12 3,-0.5 3,-2.3 -2,-0.4 21,-0.1 -0.977 29.5-107.6-136.3 120.1 32.6 41.8 0.1 26 39 A T T 3 S+ 0 0 121 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 -0.151 98.5 0.2 -49.7 126.7 29.4 43.4 1.1 27 40 A G T 3 S+ 0 0 62 1,-0.2 2,-0.4 78,-0.0 -1,-0.3 0.562 111.1 104.8 72.7 7.2 29.7 45.5 4.2 28 41 A F < - 0 0 25 -3,-2.3 2,-0.5 17,-0.0 -3,-0.5 -0.960 68.7-132.0-125.0 141.7 33.4 44.8 4.7 29 42 A N E -c 45 0A 99 15,-3.0 17,-2.8 -2,-0.4 2,-0.4 -0.764 33.3-159.1 -84.2 129.8 36.5 46.7 4.2 30 43 A V E +c 46 0A 18 -2,-0.5 2,-0.3 15,-0.2 17,-0.2 -0.920 18.3 162.3-115.3 138.2 38.8 44.4 2.3 31 44 A X E -c 47 0A 106 15,-2.3 17,-2.6 -2,-0.4 2,-0.3 -0.918 36.9-127.0-162.3 130.3 42.5 44.8 2.1 32 45 A R E +c 48 0A 70 -2,-0.3 2,-0.3 15,-0.2 17,-0.2 -0.561 41.9 170.2 -74.6 134.0 45.6 42.9 1.2 33 46 A V - 0 0 5 15,-2.3 17,-0.4 -2,-0.3 3,-0.1 -0.951 35.5-175.9-141.7 162.5 48.2 43.0 4.1 34 47 A T S S+ 0 0 56 -2,-0.3 2,-0.3 1,-0.1 22,-0.3 0.335 74.1 53.2-135.6 -3.7 51.4 41.5 5.2 35 48 A T S > S- 0 0 56 1,-0.1 4,-2.0 21,-0.1 -1,-0.1 -0.938 77.8-121.6-133.4 160.9 51.9 43.1 8.6 36 49 A X H > S+ 0 0 46 -2,-0.3 4,-4.8 2,-0.2 5,-0.2 0.860 110.2 58.7 -69.7 -32.9 49.8 43.5 11.7 37 50 A L H 4 S+ 0 0 106 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.924 109.6 44.4 -61.6 -43.6 49.8 47.2 11.7 38 51 A D H >4 S+ 0 0 67 2,-0.2 3,-0.7 1,-0.2 4,-0.4 0.905 117.1 45.7 -67.5 -37.2 48.3 47.2 8.3 39 52 A A H >< S+ 0 0 2 -4,-2.0 3,-1.6 1,-0.2 -2,-0.2 0.945 112.1 49.7 -64.1 -50.1 45.8 44.5 9.5 40 53 A L T 3< S+ 0 0 93 -4,-4.8 -1,-0.2 1,-0.3 -2,-0.2 0.461 108.3 61.4 -67.5 2.3 45.1 46.4 12.7 41 54 A K T < 0 0 137 -3,-0.7 -1,-0.3 -5,-0.2 -2,-0.2 0.609 360.0 360.0-103.8 -18.4 44.6 49.3 10.4 42 55 A V < 0 0 56 -3,-1.6 3,-0.1 -4,-0.4 5,-0.1 -0.043 360.0 360.0 -83.6 360.0 41.7 48.1 8.2 43 ! 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 44 58 A P 0 0 108 0, 0.0 -15,-3.0 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 130.2 34.4 45.3 9.8 45 59 A A E - c 0 29A 12 -33,-0.4 -31,-1.5 -17,-0.2 2,-0.5 -0.922 360.0-155.8-137.9 152.4 37.3 44.1 7.9 46 60 A V E -bc 14 30A 0 -17,-2.8 -15,-2.3 -2,-0.3 2,-0.6 -0.990 18.1-155.5-123.9 116.0 38.7 41.3 5.9 47 61 A A E -bc 15 31A 0 -33,-3.1 -31,-3.0 -2,-0.5 2,-0.6 -0.850 13.1-146.0 -93.1 125.4 42.5 41.1 5.9 48 62 A V E -bc 16 32A 0 -17,-2.6 -15,-2.3 -2,-0.6 2,-0.5 -0.838 14.9-168.9 -98.9 122.3 43.7 39.3 2.8 49 63 A L E +b 17 0A 0 -33,-2.9 -31,-2.9 -2,-0.6 34,-0.3 -0.935 11.3 165.4-116.2 126.0 46.8 37.2 3.1 50 64 A G > - 0 0 0 -2,-0.5 3,-2.9 -17,-0.4 7,-0.2 -0.501 59.7 -64.7-118.2-167.5 48.8 35.6 0.3 51 65 A D G > S+ 0 0 81 1,-0.3 3,-1.0 -2,-0.2 -32,-0.1 0.784 128.1 64.0 -51.5 -30.3 52.2 34.1 -0.1 52 66 A D G 3 S+ 0 0 102 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.544 93.9 62.8 -76.0 -2.1 53.8 37.4 0.6 53 67 A A G <> + 0 0 1 -3,-2.9 4,-2.9 1,-0.2 5,-0.3 -0.032 62.4 132.3-110.4 29.7 52.3 37.3 4.1 54 68 A Q H <> S+ 0 0 101 -3,-1.0 4,-1.9 1,-0.2 -1,-0.2 0.885 73.8 43.9 -45.3 -50.9 54.2 34.2 5.2 55 69 A D H > S+ 0 0 121 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.892 113.7 47.8 -69.9 -39.0 55.4 35.8 8.5 56 70 A L H > S+ 0 0 12 -22,-0.3 4,-2.4 2,-0.2 5,-0.2 0.904 111.0 52.2 -68.0 -39.4 52.1 37.3 9.5 57 71 A A H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.903 107.6 53.2 -61.4 -41.7 50.2 34.1 8.7 58 72 A Y H X>S+ 0 0 110 -4,-1.9 4,-2.9 -5,-0.3 5,-0.5 0.937 108.5 49.4 -59.7 -45.9 52.6 32.2 10.9 59 73 A V H X5S+ 0 0 50 -4,-2.0 4,-2.7 1,-0.2 7,-0.2 0.941 111.2 48.1 -59.4 -49.3 52.0 34.6 13.8 60 74 A F H <5S+ 0 0 2 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.889 119.6 40.5 -57.9 -39.7 48.2 34.3 13.5 61 75 A G H <5S+ 0 0 14 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.798 130.9 21.2 -82.7 -28.5 48.5 30.6 13.3 62 76 A A H <5S+ 0 0 45 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.634 128.9 37.3-114.9 -21.9 51.2 29.9 15.9 63 77 A R ><< + 0 0 168 -4,-2.7 3,-2.1 -5,-0.5 4,-0.4 -0.346 62.6 153.9-130.5 55.9 51.3 32.9 18.2 64 78 A P G >> + 0 0 68 0, 0.0 3,-1.4 0, 0.0 4,-0.7 0.825 69.3 61.6 -50.8 -40.1 47.6 33.9 18.6 65 79 A L G 34 S+ 0 0 171 1,-0.3 -5,-0.1 2,-0.2 -2,-0.0 0.619 94.8 62.7 -67.9 -10.8 48.1 35.5 21.9 66 80 A A G <4 S+ 0 0 80 -3,-2.1 -1,-0.3 -7,-0.2 -6,-0.1 0.606 93.3 66.5 -87.1 -12.9 50.6 38.1 20.5 67 81 A V T <4 S- 0 0 19 -3,-1.4 -2,-0.2 -4,-0.4 -1,-0.1 0.970 83.7-146.9 -74.3 -57.7 48.0 39.6 18.3 68 82 A G S < S+ 0 0 76 -4,-0.7 2,-0.3 1,-0.2 -3,-0.1 0.477 70.1 71.6 101.8 2.9 45.5 41.1 20.7 69 83 A V S S- 0 0 42 -5,-0.3 -1,-0.2 -56,-0.0 2,-0.1 -0.992 88.2 -99.7-149.9 145.8 42.4 40.5 18.7 70 84 A N E -a 12 0A 89 -59,-0.7 -57,-3.1 -2,-0.3 2,-0.4 -0.444 35.8-149.0 -67.8 138.4 40.4 37.5 17.8 71 85 A I E -a 13 0A 22 -59,-0.2 2,-0.5 -2,-0.1 -57,-0.2 -0.918 9.8-167.0-114.1 133.9 41.1 36.1 14.3 72 86 A I E -a 14 0A 9 -59,-2.4 -57,-2.9 -2,-0.4 2,-0.6 -0.975 15.1-142.4-121.0 121.0 38.6 34.3 12.3 73 87 A R E -ad 15 95A 18 21,-0.6 23,-2.9 -2,-0.5 2,-0.4 -0.705 22.8-156.3 -84.6 121.9 39.8 32.4 9.2 74 88 A V E +ad 16 96A 1 -59,-2.8 -57,-0.5 -2,-0.6 2,-0.2 -0.806 17.4 169.1-109.8 144.5 37.4 32.7 6.4 75 89 A V E + d 0 97A 21 21,-2.7 23,-3.3 -2,-0.4 24,-0.4 -0.771 51.6 55.1-133.3 177.8 36.7 30.5 3.4 76 90 A D + 0 0 103 1,-0.3 -1,-0.1 -2,-0.2 23,-0.1 0.766 62.1 156.8 65.6 27.7 34.2 30.1 0.6 77 91 A V > - 0 0 7 -3,-0.1 3,-2.6 21,-0.1 -1,-0.3 -0.724 55.4-102.2 -80.4 130.7 34.6 33.7 -0.5 78 92 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.325 106.9 13.2 -57.2 125.9 33.5 33.8 -4.1 79 93 A G T 3 S+ 0 0 67 1,-0.3 2,-0.0 -56,-0.1 -2,-0.0 0.401 88.7 159.0 90.3 -2.0 36.6 33.9 -6.3 80 94 A Q < - 0 0 32 -3,-2.6 -1,-0.3 1,-0.1 -62,-0.1 -0.318 23.7-170.4 -60.4 132.6 39.0 33.0 -3.5 81 95 A Q - 0 0 120 -62,-0.1 -62,-2.5 -64,-0.1 -1,-0.1 -0.786 22.7-143.0-125.9 83.7 42.3 31.5 -4.6 82 96 A P - 0 0 69 0, 0.0 2,-0.6 0, 0.0 -64,-0.2 -0.073 5.7-128.5 -51.8 141.9 43.9 30.2 -1.4 83 97 A S > - 0 0 1 -34,-0.3 4,-2.9 1,-0.2 5,-0.2 -0.816 10.8-149.7 -91.7 122.6 47.6 30.3 -0.7 84 98 A A H > S+ 0 0 80 -2,-0.6 4,-1.9 1,-0.2 5,-0.2 0.845 97.6 53.4 -61.7 -34.5 48.8 26.9 0.3 85 99 A L H > S+ 0 0 59 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.960 111.5 43.2 -65.8 -51.7 51.4 28.5 2.5 86 100 A V H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.936 112.4 53.9 -60.7 -45.8 49.0 30.7 4.3 87 101 A D H < S+ 0 0 45 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.897 111.1 46.0 -55.6 -41.5 46.5 27.9 4.7 88 102 A A H >< S+ 0 0 75 -4,-1.9 3,-1.6 1,-0.2 -1,-0.2 0.925 111.7 51.5 -66.4 -45.0 49.2 25.7 6.2 89 103 A E H 3< S+ 0 0 43 -4,-2.6 3,-0.3 1,-0.3 -2,-0.2 0.833 114.3 43.6 -60.2 -36.1 50.3 28.5 8.5 90 104 A L T >< S+ 0 0 0 -4,-2.5 3,-2.5 1,-0.2 -1,-0.3 0.181 77.2 122.3 -95.5 16.0 46.8 29.0 9.7 91 105 A G T < + 0 0 49 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.760 66.3 59.9 -51.4 -30.3 46.0 25.3 10.1 92 106 A A T 3 S+ 0 0 90 -3,-0.3 2,-0.5 -4,-0.2 -1,-0.3 0.598 89.4 90.5 -77.2 -7.2 45.1 25.6 13.8 93 107 A L S < S- 0 0 28 -3,-2.5 2,-0.3 1,-0.0 -21,-0.1 -0.780 83.4-119.9 -94.1 133.5 42.3 28.0 12.9 94 108 A H - 0 0 162 -2,-0.5 -21,-0.6 1,-0.1 2,-0.3 -0.523 29.2-119.4 -71.3 125.4 38.9 26.7 12.2 95 109 A E E -d 73 0A 103 -2,-0.3 2,-0.4 -4,-0.1 -21,-0.2 -0.500 29.5-163.9 -68.4 128.8 37.7 27.6 8.7 96 110 A V E -d 74 0A 43 -23,-2.9 -21,-2.7 -2,-0.3 2,-0.5 -0.944 21.2-118.1-118.2 136.9 34.5 29.6 8.8 97 111 A S E > -d 75 0A 33 -2,-0.4 4,-1.9 -23,-0.2 3,-0.4 -0.593 10.5-153.0 -78.5 124.2 32.4 30.1 5.8 98 112 A X H > S+ 0 0 0 -23,-3.3 4,-2.8 -2,-0.5 5,-0.2 0.793 95.8 62.6 -62.5 -28.1 32.1 33.7 4.7 99 113 A V H > S+ 0 0 67 -24,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.912 104.1 46.7 -63.7 -42.7 28.7 32.9 3.2 100 114 A R H > S+ 0 0 100 -3,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.921 111.8 51.8 -66.0 -41.5 27.4 32.0 6.6 101 115 A V H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.944 112.3 44.5 -59.2 -49.5 28.9 35.2 8.0 102 116 A L H X S+ 0 0 48 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.884 110.5 55.7 -62.7 -39.6 27.3 37.3 5.4 103 117 A N H X S+ 0 0 67 -4,-2.3 4,-3.1 -5,-0.2 5,-0.2 0.944 107.8 48.9 -56.7 -51.5 24.0 35.5 5.8 104 118 A D H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.911 113.0 45.9 -56.8 -46.9 23.9 36.2 9.5 105 119 A I H X S+ 0 0 67 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.893 114.9 47.1 -66.1 -39.3 24.6 39.9 9.1 106 120 A A H X S+ 0 0 54 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.920 112.4 50.1 -68.2 -43.1 22.1 40.3 6.3 107 121 A D H X S+ 0 0 80 -4,-3.1 4,-1.4 1,-0.2 -2,-0.2 0.895 109.6 50.3 -63.1 -39.8 19.4 38.4 8.2 108 122 A E H X S+ 0 0 30 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.826 105.7 57.5 -69.6 -26.5 20.0 40.6 11.3 109 123 A Q H X S+ 0 0 106 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.856 102.1 54.1 -71.3 -33.5 19.7 43.6 9.2 110 124 A L H X S+ 0 0 119 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.882 108.7 50.6 -64.3 -38.5 16.2 42.5 8.1 111 125 A V H < S+ 0 0 71 -4,-1.4 4,-0.5 2,-0.2 -2,-0.2 0.923 111.7 46.5 -62.6 -48.3 15.3 42.3 11.7 112 126 A K H >< S+ 0 0 120 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.858 111.7 50.8 -63.7 -38.8 16.6 45.7 12.4 113 127 A A H 3< S+ 0 0 78 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.770 106.2 57.7 -72.4 -24.4 14.8 47.1 9.4 114 128 A N T 3< 0 0 140 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.573 360.0 360.0 -82.8 -7.7 11.6 45.5 10.5 115 129 A X < 0 0 199 -3,-0.8 -3,-0.1 -4,-0.5 -2,-0.0 0.459 360.0 360.0 -66.5 360.0 11.4 47.2 13.9