==== 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 HYDROLASE 26-MAR-01 1IOO . COMPND 2 MOLECULE: SF11-RNASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NICOTIANA ALATA; . AUTHOR K.IDA,M.SATO,F.SAKIYAMA,S.NORIOKA,M.YAMAMOTO,T.KUMASAKA,E.YA . 392 2 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18435.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 251 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 15.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 29 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.0 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 0 0 0 6 0 2 2 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 2 0 2 2 2 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 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 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 D 0 0 135 0, 0.0 94,-0.1 0, 0.0 93,-0.0 0.000 360.0 360.0 360.0 131.7 6.2 -32.5 23.6 2 2 A F - 0 0 10 92,-0.3 36,-0.2 1,-0.1 3,-0.1 -0.179 360.0-125.6 -70.3 169.0 6.7 -34.3 27.0 3 3 A E S S- 0 0 80 34,-1.6 2,-0.3 1,-0.2 35,-0.2 0.845 75.2 -10.8 -88.3 -37.7 4.1 -36.5 28.6 4 4 A Y E -A 37 0A 1 33,-2.1 33,-3.1 167,-0.2 2,-0.4 -0.978 55.0-118.0-157.8 167.7 3.7 -34.9 32.0 5 5 A L E -AB 36 170A 1 165,-2.7 165,-2.5 -2,-0.3 2,-0.6 -0.952 23.3-156.2-111.8 130.8 5.0 -32.5 34.7 6 6 A Q E -AB 35 169A 12 29,-2.2 29,-2.7 -2,-0.4 2,-0.7 -0.928 2.7-155.6-112.4 113.1 6.1 -33.8 38.0 7 7 A L E -AB 34 168A 0 161,-3.2 161,-2.3 -2,-0.6 2,-0.6 -0.784 14.6-157.9 -82.1 117.7 6.1 -31.4 41.0 8 8 A V E -AB 33 167A 0 25,-3.0 24,-3.3 -2,-0.7 25,-1.6 -0.897 6.4-166.7-104.1 116.7 8.6 -32.7 43.4 9 9 A L E -AB 31 166A 4 157,-2.9 157,-2.6 -2,-0.6 2,-0.3 -0.891 8.7-147.0-106.1 128.5 8.1 -31.6 47.0 10 10 A T E -AB 30 165A 4 20,-3.2 20,-2.2 -2,-0.5 155,-0.2 -0.680 10.3-138.5 -93.0 140.3 10.9 -32.2 49.6 11 11 A W >> - 0 0 0 153,-2.2 4,-2.4 -2,-0.3 3,-1.0 -0.893 20.1-152.8 -94.0 101.2 10.4 -32.9 53.3 12 12 A P H 3> S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.825 88.8 57.3 -41.9 -48.8 13.1 -30.6 54.8 13 13 A A H 34 S+ 0 0 19 13,-0.3 4,-0.4 1,-0.2 183,-0.1 0.897 114.0 40.5 -55.4 -40.8 13.6 -32.6 58.0 14 14 A S H X> S+ 0 0 0 -3,-1.0 4,-1.7 181,-0.2 3,-1.0 0.922 113.6 52.7 -73.7 -44.6 14.5 -35.7 55.8 15 15 A F H 3X S+ 0 0 16 -4,-2.4 4,-1.4 1,-0.3 -2,-0.2 0.909 110.8 47.3 -57.8 -42.5 16.5 -33.7 53.2 16 16 A a H 3< S+ 0 0 37 -4,-3.0 5,-0.3 1,-0.2 -1,-0.3 0.582 109.8 54.4 -78.9 -8.8 18.7 -32.2 55.9 17 17 A Y H <4 S+ 0 0 127 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.765 116.3 36.2 -90.0 -28.8 19.2 -35.5 57.6 18 18 A A H < S+ 0 0 41 -4,-1.7 2,-0.3 -3,-0.2 -2,-0.2 0.576 125.8 35.6 -97.9 -14.0 20.4 -37.2 54.4 19 19 A N S < S- 0 0 61 -4,-1.4 2,-0.6 -5,-0.2 197,-0.0 -0.915 90.3 -95.5-136.7 162.7 22.3 -34.1 53.1 20 20 A H - 0 0 135 -2,-0.3 2,-0.4 -3,-0.0 -3,-0.1 -0.702 43.3-163.1 -81.1 122.3 24.3 -31.2 54.4 21 21 A a - 0 0 27 -2,-0.6 50,-0.3 -5,-0.3 49,-0.1 -0.870 25.7-173.9-110.6 141.3 22.1 -28.2 54.8 22 22 A E S S+ 0 0 61 48,-2.6 2,-0.3 -2,-0.4 52,-0.3 0.491 75.6 64.9-102.9 -11.1 23.2 -24.6 55.2 23 23 A R S S- 0 0 32 47,-1.6 2,-0.3 50,-0.1 50,-0.1 -0.813 95.6-100.8-110.4 152.2 19.6 -23.4 55.9 24 24 A I - 0 0 152 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.0 -0.569 46.7-109.9 -68.7 131.3 17.4 -24.3 58.8 25 25 A A - 0 0 37 -2,-0.3 -1,-0.1 -13,-0.1 -12,-0.1 -0.495 31.6-130.1 -67.6 119.2 14.9 -27.0 57.6 26 26 A P - 0 0 34 0, 0.0 2,-0.5 0, 0.0 -13,-0.3 -0.360 14.2-122.9 -66.2 152.0 11.4 -25.5 57.4 27 27 A N S S+ 0 0 94 -15,-0.1 2,-0.3 -16,-0.1 -2,-0.0 -0.181 89.8 63.7 -88.5 42.9 8.7 -27.4 59.1 28 28 A N S S- 0 0 68 -2,-0.5 -18,-0.1 -18,-0.1 -15,-0.0 -0.981 96.1 -82.0-158.0 157.4 6.8 -27.7 55.8 29 29 A F - 0 0 7 -2,-0.3 2,-0.3 -18,-0.1 -18,-0.2 -0.349 45.5-166.5 -65.0 143.7 7.2 -29.2 52.4 30 30 A T E -A 10 0A 4 -20,-2.2 -20,-3.2 -4,-0.1 2,-0.3 -0.870 28.4 -90.6-127.0 163.3 9.3 -27.2 50.0 31 31 A I E +A 9 0A 3 35,-2.9 -22,-0.2 -2,-0.3 3,-0.1 -0.595 35.2 172.4 -78.3 130.4 9.8 -27.4 46.2 32 32 A H E - 0 0 53 -24,-3.3 2,-0.3 1,-0.4 -23,-0.2 0.722 65.2 -43.0 -99.6 -36.0 12.7 -29.6 45.0 33 33 A G E -A 8 0A 0 -25,-1.6 -25,-3.0 75,-0.1 -1,-0.4 -0.988 35.2-124.1-179.1 171.2 11.8 -29.3 41.4 34 34 A L E -A 7 0A 0 -2,-0.3 -27,-0.2 -27,-0.2 74,-0.1 -0.897 35.8-167.9-132.6 100.7 9.3 -29.3 38.5 35 35 A W E -A 6 0A 41 -29,-2.7 -29,-2.2 -2,-0.4 2,-0.2 -0.817 16.7-152.0-106.8 114.8 10.3 -31.9 36.0 36 36 A P E +A 5 0A 0 0, 0.0 2,-0.3 0, 0.0 -31,-0.2 -0.608 42.4 159.4 -73.1 140.2 8.8 -32.2 32.5 37 37 A D E -A 4 0A 2 -33,-3.1 -33,-2.1 -2,-0.2 -34,-1.6 -0.936 41.8-128.3-155.9 176.7 9.1 -35.9 31.7 38 38 A N - 0 0 17 3,-0.5 5,-0.2 -2,-0.3 -36,-0.1 -0.936 24.6-129.0-128.3 151.4 8.2 -39.0 29.8 39 39 A V S S+ 0 0 73 -2,-0.3 -1,-0.1 3,-0.1 3,-0.1 0.925 102.3 51.3 -67.2 -43.9 7.2 -42.4 31.2 40 40 A K S S+ 0 0 147 1,-0.2 2,-0.3 -3,-0.1 -1,-0.0 0.965 121.3 1.9 -55.9 -91.0 9.7 -44.3 29.0 41 41 A T S S- 0 0 93 1,-0.1 -3,-0.5 -4,-0.0 -1,-0.2 -0.751 86.5 -94.6-105.3 151.9 13.1 -42.6 29.5 42 42 A R - 0 0 111 -2,-0.3 2,-0.5 -5,-0.1 -5,-0.1 -0.410 35.2-141.0 -66.7 132.1 14.0 -39.7 31.7 43 43 A L + 0 0 43 -7,-0.2 2,-0.3 -5,-0.2 51,-0.1 -0.835 39.7 135.7 -96.8 127.7 13.9 -36.3 30.0 44 44 A H + 0 0 93 -2,-0.5 47,-0.2 1,-0.1 46,-0.1 -0.986 47.1 28.6-166.2 159.9 16.6 -33.8 31.0 45 45 A N S S- 0 0 41 45,-2.3 45,-0.1 -2,-0.3 46,-0.1 0.920 73.2-171.0 48.4 54.2 19.1 -31.2 29.7 46 46 A b - 0 0 27 44,-0.4 -1,-0.1 43,-0.2 49,-0.1 -0.436 23.7 -78.2 -75.1 147.3 17.0 -30.4 26.7 47 47 A K S S+ 0 0 135 -2,-0.1 2,-0.1 2,-0.1 -1,-0.1 -0.751 103.2 39.9-101.4 149.3 18.4 -28.2 24.0 48 48 A P S S- 0 0 94 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.549 86.8-125.4 -83.4 157.0 18.9 -25.4 23.6 49 49 A K - 0 0 72 -2,-0.1 2,-0.3 -4,-0.1 -2,-0.1 -0.466 28.6-128.1 -62.3 123.3 20.1 -24.5 27.0 50 50 A P - 0 0 12 0, 0.0 2,-0.1 0, 0.0 43,-0.1 -0.588 19.0-114.9 -79.3 133.5 17.9 -21.6 28.3 51 51 A T - 0 0 125 -2,-0.3 2,-0.5 1,-0.1 50,-0.1 -0.432 28.8-138.1 -66.9 135.3 19.6 -18.5 29.6 52 52 A Y - 0 0 24 -2,-0.1 2,-0.4 49,-0.0 -1,-0.1 -0.854 13.1-161.5-101.7 128.7 19.0 -17.9 33.3 53 53 A S - 0 0 75 -2,-0.5 2,-0.3 32,-0.0 0, 0.0 -0.895 28.0-110.9-106.2 136.7 18.3 -14.5 34.7 54 54 A Y - 0 0 94 -2,-0.4 2,-0.1 1,-0.1 6,-0.1 -0.497 32.9-128.3 -72.1 128.2 18.7 -13.8 38.4 55 55 A F - 0 0 12 -2,-0.3 2,-0.3 4,-0.1 -1,-0.1 -0.359 28.8-177.5 -73.0 153.3 15.4 -13.2 40.2 56 56 A T >> + 0 0 108 -2,-0.1 4,-1.2 4,-0.0 3,-0.6 -0.870 41.3 2.3-141.7 173.2 14.8 -10.1 42.4 57 57 A G H 3> S+ 0 0 45 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 -0.132 122.1 0.4 54.1-130.4 12.1 -8.6 44.6 58 58 A K H 3> S+ 0 0 155 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.924 133.9 50.7 -60.3 -50.7 8.9 -10.5 45.2 59 59 A M H <> S+ 0 0 45 -3,-0.6 4,-2.6 1,-0.2 -1,-0.2 0.900 111.4 50.3 -56.1 -41.1 9.7 -13.5 43.1 60 60 A L H X S+ 0 0 15 -4,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.931 112.5 45.3 -63.5 -45.8 13.1 -13.8 44.9 61 61 A N H X S+ 0 0 87 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.889 113.6 50.8 -64.9 -38.8 11.4 -13.7 48.3 62 62 A D H X S+ 0 0 43 -4,-3.0 4,-2.8 1,-0.2 5,-0.4 0.925 113.3 44.4 -64.7 -44.0 8.7 -16.1 47.2 63 63 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.880 106.7 58.7 -70.4 -38.3 11.3 -18.6 45.9 64 64 A D H < S+ 0 0 12 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.833 117.4 34.9 -61.0 -30.0 13.6 -18.4 48.9 65 65 A K H >< S+ 0 0 137 -4,-1.2 3,-0.8 -3,-0.2 -2,-0.2 0.941 128.7 30.9 -86.2 -56.1 10.7 -19.5 51.0 66 66 A H H 3< S+ 0 0 39 -4,-2.8 -35,-2.9 1,-0.3 -3,-0.2 0.739 134.7 30.0 -79.1 -26.7 8.8 -22.0 48.9 67 67 A W T 3< S- 0 0 7 -4,-2.5 -1,-0.3 -5,-0.4 -2,-0.1 -0.292 86.3-179.6-124.1 44.8 11.8 -23.2 46.9 68 68 A M < - 0 0 27 -3,-0.8 2,-1.5 1,-0.1 -4,-0.1 -0.200 30.1-132.5 -52.6 128.9 14.4 -22.7 49.6 69 69 A Q > - 0 0 4 1,-0.2 3,-1.8 -5,-0.1 -47,-0.1 -0.677 27.5-175.3 -85.8 84.4 17.8 -23.8 48.5 70 70 A L T 3 S+ 0 0 8 -2,-1.5 -48,-2.6 1,-0.3 -47,-1.6 0.690 72.7 60.9 -56.6 -27.0 18.6 -25.8 51.6 71 71 A K T 3 S+ 0 0 73 -50,-0.3 2,-0.3 -49,-0.2 -1,-0.3 0.592 101.3 59.6 -82.7 -8.6 22.2 -26.6 50.7 72 72 A F S < S- 0 0 28 -3,-1.8 -50,-0.1 1,-0.1 -3,-0.1 -0.875 89.2 -97.9-125.3 153.3 23.4 -23.0 50.5 73 73 A E > - 0 0 27 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.241 41.1-112.9 -56.5 151.9 23.6 -20.1 52.8 74 74 A Q H > S+ 0 0 97 -52,-0.3 4,-2.7 2,-0.2 5,-0.2 0.907 114.7 49.3 -57.9 -45.5 20.8 -17.6 52.5 75 75 A D H > S+ 0 0 77 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.960 115.3 42.2 -61.4 -51.6 23.0 -14.8 51.1 76 76 A Y H >>S+ 0 0 8 1,-0.2 4,-2.8 2,-0.2 5,-0.8 0.910 114.9 52.4 -61.4 -42.2 24.6 -17.0 48.5 77 77 A G H X5S+ 0 0 0 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.929 113.4 42.2 -59.3 -46.0 21.3 -18.6 47.6 78 78 A R H <5S+ 0 0 65 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.823 123.3 38.6 -71.5 -32.2 19.5 -15.3 47.1 79 79 A T H <5S+ 0 0 52 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.942 130.8 21.9 -85.4 -53.4 22.4 -13.8 45.2 80 80 A E H <5S- 0 0 32 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.600 81.4-155.7 -95.6 -14.2 23.8 -16.6 43.0 81 81 A Q X< + 0 0 3 -4,-1.1 4,-2.3 -5,-0.8 5,-0.2 0.837 22.6 172.0 41.7 53.5 20.7 -18.8 43.0 82 82 A P H > S+ 0 0 20 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.866 70.7 42.2 -60.0 -43.6 22.7 -22.0 42.3 83 83 A S H > S+ 0 0 25 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.895 113.8 50.2 -75.9 -40.3 19.9 -24.5 42.7 84 84 A W H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.922 113.2 47.9 -62.1 -42.0 17.2 -22.6 40.9 85 85 A K H X S+ 0 0 12 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.936 112.5 48.0 -63.0 -47.1 19.6 -22.1 38.0 86 86 A Y H X S+ 0 0 33 -4,-2.1 4,-2.7 -5,-0.2 5,-0.3 0.932 113.1 47.7 -60.1 -46.1 20.6 -25.7 37.9 87 87 A Q H X>S+ 0 0 19 -4,-2.7 4,-2.5 1,-0.2 5,-1.7 0.865 111.7 51.0 -64.4 -36.6 17.0 -26.9 38.0 88 88 A Y H <>S+ 0 0 15 -4,-2.2 5,-1.2 3,-0.2 -1,-0.2 0.924 114.3 42.1 -67.3 -45.2 16.0 -24.4 35.2 89 89 A I H <5S+ 0 0 7 -4,-2.5 -43,-0.2 3,-0.2 -2,-0.2 0.902 121.8 40.1 -69.9 -39.8 18.8 -25.5 32.9 90 90 A K H <5S+ 0 0 37 -4,-2.7 -45,-2.3 -5,-0.2 -44,-0.4 0.881 139.2 6.2 -78.7 -38.5 18.3 -29.3 33.6 91 91 A H T ><5S+ 0 0 15 -4,-2.5 3,-2.3 -5,-0.3 -3,-0.2 0.770 122.3 60.2-115.2 -43.0 14.5 -29.4 33.7 92 92 A G G > + 0 0 5 -3,-1.6 4,-1.2 -4,-0.1 -1,-0.2 -0.234 67.3 129.1-142.2 50.0 9.2 -27.2 28.6 96 96 A Q T 4 + 0 0 73 -3,-0.5 -2,-0.1 1,-0.2 -3,-0.1 0.579 64.0 66.6 -83.8 -12.1 10.2 -24.0 26.7 97 97 A K T 4 S+ 0 0 193 1,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.896 115.7 24.8 -77.0 -36.7 7.2 -24.1 24.3 98 98 A R T 4 S+ 0 0 103 -3,-0.1 2,-0.3 1,-0.1 -2,-0.2 0.674 126.3 42.1 -99.4 -20.0 4.6 -23.5 27.0 99 99 A Y < - 0 0 30 -4,-1.2 2,-0.2 -7,-0.1 -1,-0.1 -0.924 54.3-160.6-134.4 152.8 6.8 -21.7 29.6 100 100 A N > - 0 0 88 -2,-0.3 4,-2.6 -3,-0.1 5,-0.3 -0.602 51.8 -85.7-111.6-179.6 9.5 -19.1 30.0 101 101 A Q H > S+ 0 0 15 1,-0.2 4,-2.1 -2,-0.2 5,-0.3 0.934 129.2 45.7 -55.3 -45.8 11.8 -18.7 33.0 102 102 A N H > S+ 0 0 99 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.904 116.9 42.1 -65.2 -44.4 9.2 -16.5 34.8 103 103 A T H > S+ 0 0 62 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.766 111.1 57.5 -78.1 -23.2 6.2 -18.7 34.1 104 104 A Y H X S+ 0 0 2 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.963 114.6 36.1 -67.9 -51.0 8.1 -21.9 34.8 105 105 A F H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.880 116.4 55.4 -68.9 -34.8 9.0 -20.8 38.3 106 106 A G H X S+ 0 0 27 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.890 107.5 49.9 -63.5 -39.0 5.6 -19.1 38.7 107 107 A L H X S+ 0 0 12 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.923 107.1 53.9 -64.4 -44.9 3.9 -22.4 37.8 108 108 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.921 111.0 46.4 -55.2 -44.5 6.0 -24.2 40.4 109 109 A L H X S+ 0 0 26 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.905 112.5 50.3 -65.3 -41.6 4.9 -21.7 43.0 110 110 A R H X S+ 0 0 121 -4,-2.3 4,-0.7 1,-0.2 -2,-0.2 0.927 112.1 46.3 -62.7 -46.6 1.2 -22.0 41.9 111 111 A L H >< S+ 0 0 0 -4,-3.1 3,-0.7 1,-0.2 4,-0.3 0.886 111.8 51.6 -64.9 -39.2 1.3 -25.8 42.0 112 112 A K H >< S+ 0 0 30 -4,-2.2 3,-1.7 -5,-0.3 -1,-0.2 0.910 105.9 55.3 -62.3 -41.2 2.9 -25.8 45.4 113 113 A D H 3< S+ 0 0 133 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.675 94.5 70.5 -66.4 -18.2 0.3 -23.4 46.8 114 114 A K T << S+ 0 0 107 -4,-0.7 2,-0.3 -3,-0.7 -1,-0.3 0.679 99.7 55.9 -72.4 -17.0 -2.4 -25.9 45.7 115 115 A F < - 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