==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-JAN-02 1KT9 . COMPND 2 MOLECULE: DIADENOSINE TETRAPHOSPHATE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS; . AUTHOR S.BAILEY,S.E.SEDELNIKOVA,G.M.BLACKBURN,H.M.ABDELGHANY, . 132 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7424.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 93 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 22.0 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 . 1 0.8 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 . 14 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 22.0 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+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 1 0 0 0 0 1 1 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 1 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 1 1 2 0 0 0 0 0 1 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 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 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 M 0 0 148 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 121.9 36.8 -0.6 9.2 2 2 A V - 0 0 66 1,-0.1 2,-0.5 81,-0.1 81,-0.2 0.172 360.0-109.3 -22.0 149.7 33.3 0.7 9.7 3 3 A V E -a 83 0A 62 79,-1.8 81,-2.3 78,-0.1 2,-0.4 -0.833 35.3-130.5 -95.8 134.4 31.2 1.6 6.7 4 4 A K E +a 84 0A 105 -2,-0.5 35,-2.7 79,-0.2 2,-0.3 -0.725 31.7 164.4 -95.4 134.0 30.7 5.3 6.2 5 5 A A E -aB 85 38A 0 79,-1.9 81,-2.3 -2,-0.4 2,-0.3 -0.911 10.1-170.3-134.5 162.0 27.4 7.1 5.6 6 6 A A E +aB 86 37A 0 31,-2.6 31,-2.2 -2,-0.3 2,-0.3 -0.982 10.6 154.5-151.7 159.1 26.3 10.7 5.8 7 7 A G E -aB 87 36A 0 79,-2.2 81,-1.4 -2,-0.3 2,-0.4 -0.956 33.4-102.3-163.8-175.1 23.3 12.9 5.8 8 8 A L E -a 88 0A 2 27,-1.4 2,-1.1 41,-0.3 81,-0.2 -0.990 16.0-137.6-126.9 134.2 21.7 16.2 6.8 9 9 A V E -a 89 0A 1 79,-2.3 81,-2.6 -2,-0.4 2,-0.4 -0.784 33.6-156.5 -79.8 100.9 19.2 16.9 9.5 10 10 A I E +a 90 0A 0 -2,-1.1 11,-2.2 11,-0.4 2,-0.3 -0.670 16.6 177.3 -80.6 132.1 16.9 19.3 7.5 11 11 A Y E -aC 91 20A 11 79,-2.4 81,-2.9 -2,-0.4 2,-0.3 -0.951 14.7-161.3-129.6 162.8 14.9 21.8 9.5 12 12 A R E - C 0 19A 44 7,-2.2 7,-2.2 -2,-0.3 2,-0.6 -0.953 15.9-138.2-132.0 159.2 12.5 24.6 8.9 13 13 A K E + C 0 18A 47 79,-0.4 2,-0.5 -2,-0.3 5,-0.2 -0.943 33.7 164.4-114.4 107.5 11.2 27.5 10.9 14 14 A L E > - C 0 17A 73 3,-2.1 3,-1.6 -2,-0.6 -2,-0.1 -0.978 67.1 -12.4-131.8 124.7 7.5 28.0 10.4 15 15 A A T 3 S- 0 0 108 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.876 128.6 -53.6 55.8 42.0 5.2 30.1 12.6 16 16 A G T 3 S+ 0 0 85 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.375 114.9 114.4 81.2 -5.3 7.9 30.3 15.3 17 17 A K E < -C 14 0A 22 -3,-1.6 -3,-2.1 92,-0.0 2,-0.5 -0.753 61.0-137.8-105.1 146.2 8.4 26.6 15.5 18 18 A I E -C 13 0A 59 -2,-0.3 92,-0.5 -5,-0.2 2,-0.4 -0.891 27.7-176.9 -96.9 126.2 11.4 24.5 14.5 19 19 A E E -C 12 0A 35 -7,-2.2 -7,-2.2 -2,-0.5 2,-0.4 -0.987 15.9-142.4-126.7 138.7 10.4 21.3 12.7 20 20 A F E -CD 11 108A 2 88,-3.2 88,-2.0 -2,-0.4 2,-0.6 -0.813 17.7-125.1-104.4 135.9 12.6 18.4 11.5 21 21 A L E - D 0 107A 1 -11,-2.2 2,-0.4 -2,-0.4 -11,-0.4 -0.673 31.0-175.1 -79.3 119.1 12.1 16.6 8.2 22 22 A L E - D 0 106A 0 84,-3.1 84,-2.1 -2,-0.6 2,-0.4 -0.947 7.9-159.8-117.3 139.7 11.8 12.8 8.6 23 23 A L E -ED 33 105A 16 10,-3.0 10,-2.3 -2,-0.4 2,-0.7 -0.950 20.0-126.6-118.4 139.6 11.5 10.2 5.9 24 24 A Q E E 32 0A 89 80,-2.1 8,-0.2 -2,-0.4 7,-0.1 -0.700 360.0 360.0 -83.7 111.4 10.2 6.6 6.2 25 25 A A 0 0 35 6,-2.8 -1,-0.1 -2,-0.7 7,-0.1 0.428 360.0 360.0 -79.4 360.0 12.9 4.4 4.8 26 ! 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 27 27 A Y > 0 0 148 0, 0.0 3,-2.8 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 142.6 14.3 -0.7 3.1 28 28 A P T 3 + 0 0 103 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.316 360.0 27.5 -50.9 137.9 13.0 -3.1 5.8 29 29 A P T 3 S- 0 0 87 0, 0.0 -4,-0.0 0, 0.0 0, 0.0 -0.963 89.3-148.6 -91.8 16.3 12.3 -2.2 8.6 30 30 A H < - 0 0 89 -3,-2.8 2,-0.0 1,-0.1 0, 0.0 0.955 22.4-177.2 60.4 52.9 11.5 1.3 7.2 31 31 A H - 0 0 116 -4,-0.3 -6,-2.8 -7,-0.1 2,-0.5 -0.340 30.6-108.9 -72.5 162.8 12.5 3.4 10.3 32 32 A W E +E 24 0A 43 84,-0.6 -8,-0.2 -8,-0.2 -1,-0.1 -0.875 54.2 146.4 -95.6 129.2 12.0 7.2 10.0 33 33 A T E -E 23 0A 15 -10,-2.3 -10,-3.0 -2,-0.5 3,-0.1 -0.963 51.6 -86.8-151.7 165.9 15.2 9.2 9.8 34 34 A P S S- 0 0 1 0, 0.0 -25,-0.2 0, 0.0 -12,-0.1 -0.296 70.7 -71.1 -66.8 164.5 16.5 12.4 8.2 35 35 A P S S+ 0 0 1 0, 0.0 -27,-1.4 0, 0.0 2,-0.3 -0.415 76.2 137.0 -61.2 131.8 17.9 11.9 4.6 36 36 A K E +B 7 0A 22 16,-0.2 2,-0.3 -29,-0.2 -29,-0.3 -0.974 18.3 160.1-165.1 169.6 21.1 9.9 4.5 37 37 A G E -B 6 0A 13 -31,-2.2 -31,-2.6 -2,-0.3 15,-0.1 -0.980 44.1 -43.7 179.6-179.7 23.1 7.2 2.7 38 38 A H E -B 5 0A 104 -2,-0.3 2,-0.4 -33,-0.3 -33,-0.3 -0.257 53.2-116.7 -65.0 138.1 26.5 5.5 1.9 39 39 A V - 0 0 36 -35,-2.7 -35,-0.2 1,-0.1 -1,-0.1 -0.638 33.0-138.7 -74.9 130.4 29.6 7.6 1.1 40 40 A D > - 0 0 72 -2,-0.4 3,-1.7 4,-0.2 8,-0.1 -0.405 31.0 -76.9 -86.0 162.1 30.8 7.0 -2.5 41 41 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.263 117.5 17.7 -54.2 136.1 34.4 6.6 -3.7 42 42 A G T 3 S+ 0 0 84 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.602 105.3 103.2 77.0 7.6 36.2 9.9 -4.1 43 43 A E < - 0 0 45 -3,-1.7 -1,-0.2 4,-0.0 2,-0.2 -0.893 59.3-141.6-114.8 153.7 33.7 11.8 -1.8 44 44 A D > - 0 0 80 -2,-0.3 4,-2.4 -3,-0.1 5,-0.2 -0.541 40.2 -92.1-100.3 178.9 34.1 13.0 1.8 45 45 A E H > S+ 0 0 40 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.874 124.1 53.7 -56.7 -39.8 31.2 12.9 4.3 46 46 A W H > S+ 0 0 90 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.938 110.1 45.3 -61.3 -52.2 30.2 16.5 3.5 47 47 A Q H > S+ 0 0 97 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.898 113.7 51.4 -58.4 -42.2 29.8 15.9 -0.2 48 48 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.877 105.6 54.0 -64.9 -38.4 28.0 12.7 0.5 49 49 A A H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -41,-0.3 0.909 111.7 46.1 -62.1 -43.3 25.4 14.3 2.9 50 50 A I H X S+ 0 0 48 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.951 114.1 46.8 -64.9 -49.0 24.6 16.8 0.2 51 51 A R H X S+ 0 0 47 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.897 112.4 49.7 -61.9 -40.6 24.2 14.2 -2.6 52 52 A E H X S+ 0 0 15 -4,-2.7 4,-2.8 2,-0.2 5,-0.4 0.841 106.0 56.8 -70.4 -29.1 22.1 11.9 -0.4 53 53 A T H X>S+ 0 0 1 -4,-1.6 4,-1.9 -5,-0.2 6,-1.2 0.915 109.4 47.1 -68.9 -40.1 19.8 14.8 0.5 54 54 A K H X5S+ 0 0 119 -4,-1.9 4,-1.1 4,-0.2 -2,-0.2 0.945 116.6 42.5 -61.4 -50.5 19.2 15.3 -3.2 55 55 A E H <5S+ 0 0 100 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.868 125.6 31.2 -64.7 -41.9 18.6 11.6 -3.9 56 56 A E H <5S+ 0 0 106 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.819 134.3 22.8 -92.2 -36.2 16.4 10.8 -0.9 57 57 A A H <5S- 0 0 7 -4,-1.9 -3,-0.2 -5,-0.4 -2,-0.1 0.518 91.2-127.0-109.8 -8.5 14.5 14.1 -0.2 58 58 A N << + 0 0 98 -4,-1.1 2,-0.4 -5,-0.6 41,-0.4 0.827 65.5 133.5 62.5 31.8 14.7 15.9 -3.6 59 59 A I - 0 0 1 -6,-1.2 -1,-0.2 -9,-0.1 2,-0.2 -0.962 43.6-148.7-112.9 130.1 16.2 19.0 -1.9 60 60 A T > - 0 0 58 -2,-0.4 3,-2.2 -3,-0.1 4,-0.2 -0.649 24.5-105.9-103.0 163.2 19.2 20.6 -3.6 61 61 A K G > S+ 0 0 52 1,-0.3 3,-2.2 -2,-0.2 5,-0.1 0.822 112.8 60.5 -58.0 -41.7 22.1 22.5 -2.1 62 62 A E G 3 S+ 0 0 145 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.634 98.4 61.4 -64.3 -12.4 21.1 26.0 -3.2 63 63 A Q G < S+ 0 0 23 -3,-2.2 30,-1.9 30,-0.1 31,-0.4 0.488 102.0 67.1 -86.6 -3.9 17.9 25.7 -1.1 64 64 A L E < -F 92 0A 19 -3,-2.2 2,-0.5 -4,-0.2 28,-0.2 -0.857 60.8-150.9-124.0 151.2 19.8 25.2 2.1 65 65 A T E -F 91 0A 67 26,-1.9 26,-2.5 -2,-0.3 2,-0.4 -0.966 28.7-154.6-112.1 112.3 22.1 26.9 4.6 66 66 A I E -F 90 0A 36 -2,-0.5 2,-1.1 24,-0.2 24,-0.3 -0.748 11.0-136.0 -91.1 130.6 24.3 24.2 6.2 67 67 A H E > -F 89 0A 46 22,-3.2 3,-2.1 -2,-0.4 22,-0.5 -0.727 16.6-170.2 -85.1 95.4 25.7 24.8 9.6 68 68 A E E 3 S+ 0 0 64 -2,-1.1 -1,-0.2 1,-0.3 22,-0.0 0.824 85.1 54.3 -54.9 -34.4 29.4 23.7 9.4 69 69 A D E 3 S+ 0 0 89 1,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.358 96.6 72.5 -84.3 3.9 29.8 24.0 13.2 70 70 A C E < + 0 0 7 -3,-2.1 19,-2.0 19,-0.2 2,-0.3 -0.838 65.3 122.6-122.9 99.2 26.8 21.8 14.1 71 71 A H E -F 88 0A 74 -2,-0.5 2,-0.3 17,-0.2 17,-0.2 -0.986 27.9-178.7-150.2 161.2 27.4 18.1 13.4 72 72 A E E -F 87 0A 101 15,-2.0 15,-3.0 -2,-0.3 2,-0.5 -0.983 18.9-134.5-158.2 153.9 27.4 14.7 15.1 73 73 A T E -F 86 0A 50 -2,-0.3 2,-0.3 13,-0.2 13,-0.3 -0.946 14.6-158.9-121.3 130.1 28.1 11.1 14.2 74 74 A L E -F 85 0A 17 11,-2.9 11,-2.6 -2,-0.5 2,-0.6 -0.779 9.9-140.5-105.5 151.0 26.0 8.1 15.1 75 75 A F E -F 84 0A 156 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.944 13.9-167.0-113.4 116.9 27.1 4.5 15.2 76 76 A Y E -F 83 0A 35 7,-3.1 7,-1.9 -2,-0.6 2,-0.8 -0.907 9.4-168.3-104.8 123.1 24.7 1.8 13.9 77 77 A E + 0 0 183 -2,-0.5 2,-0.5 5,-0.2 -2,-0.0 -0.824 36.3 158.6-103.4 90.3 25.4 -1.9 14.7 78 78 A A > - 0 0 54 -2,-0.8 3,-0.8 3,-0.5 -2,-0.1 -0.841 56.5 -18.1-142.1 105.5 22.9 -3.3 12.3 79 79 A K T 3 S- 0 0 118 -2,-0.5 -1,-0.2 1,-0.2 -2,-0.0 0.659 123.4 -61.1 78.6 18.3 22.4 -6.6 10.6 80 80 A G T 3 S+ 0 0 66 1,-0.1 -1,-0.2 -3,-0.0 -3,-0.0 0.084 113.1 111.5 100.2 -22.8 26.0 -7.2 11.3 81 81 A K < - 0 0 56 -3,-0.8 -3,-0.5 -79,-0.0 -1,-0.1 -0.702 60.9-141.5 -98.3 95.6 27.5 -4.3 9.4 82 82 A P + 0 0 72 0, 0.0 -79,-1.8 0, 0.0 2,-0.3 -0.212 31.7 173.8 -51.5 133.4 29.0 -1.6 11.7 83 83 A K E -aF 3 76A 35 -7,-1.9 -7,-3.1 -81,-0.2 2,-0.4 -0.995 25.2-150.4-149.3 140.7 28.3 1.7 10.2 84 84 A S E -aF 4 75A 12 -81,-2.3 -79,-1.9 -2,-0.3 2,-0.4 -0.908 8.0-161.1-110.6 144.0 28.7 5.3 11.1 85 85 A V E -aF 5 74A 0 -11,-2.6 -11,-2.9 -2,-0.4 2,-0.6 -0.975 5.6-159.7-128.4 114.2 26.4 8.1 9.9 86 86 A K E -aF 6 73A 40 -81,-2.3 -79,-2.2 -2,-0.4 2,-0.4 -0.858 12.8-169.9 -96.6 126.2 27.7 11.7 10.1 87 87 A Y E -aF 7 72A 0 -15,-3.0 -15,-2.0 -2,-0.6 2,-0.3 -0.925 12.3-165.8-116.2 140.4 25.0 14.4 10.1 88 88 A W E -aF 8 71A 18 -81,-1.4 -79,-2.3 -2,-0.4 2,-0.4 -0.902 29.7-114.4-113.2 152.9 25.1 18.2 9.8 89 89 A L E -aF 9 67A 0 -19,-2.0 -22,-3.2 -22,-0.5 2,-0.4 -0.650 37.4-177.0 -83.7 135.2 22.3 20.5 10.6 90 90 A A E -aF 10 66A 0 -81,-2.6 -79,-2.4 -2,-0.4 2,-0.4 -0.994 19.3-136.9-141.1 133.2 20.8 22.4 7.6 91 91 A K E -aF 11 65A 76 -26,-2.5 -26,-1.9 -2,-0.4 2,-1.0 -0.738 10.9-140.3 -90.8 131.1 18.1 25.0 7.2 92 92 A L E - F 0 64A 1 -81,-2.9 -79,-0.4 -2,-0.4 -28,-0.2 -0.793 23.9-161.9 -81.9 106.2 15.5 24.9 4.4 93 93 A N S S+ 0 0 75 -30,-1.9 -1,-0.2 -2,-1.0 -29,-0.1 0.840 74.3 34.5 -65.5 -39.5 15.5 28.7 3.8 94 94 A N > - 0 0 78 -31,-0.4 3,-2.0 3,-0.2 -1,-0.2 -0.841 60.5-179.4-118.8 92.0 12.3 29.0 1.9 95 95 A P T 3 S+ 0 0 29 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.673 80.4 69.4 -65.0 -14.3 9.7 26.6 3.2 96 96 A D T 3 S+ 0 0 142 1,-0.2 2,-0.3 -3,-0.1 -3,-0.0 0.490 99.1 51.3 -79.6 -2.0 7.3 28.0 0.6 97 97 A D S < S+ 0 0 88 -3,-2.0 2,-0.4 -34,-0.1 -1,-0.2 -0.702 74.0 126.6-137.6 80.1 9.4 26.4 -2.2 98 98 A V - 0 0 34 -2,-0.3 2,-0.6 -3,-0.2 -39,-0.1 -0.999 45.2-147.2-140.8 134.3 10.0 22.7 -1.6 99 99 A Q + 0 0 96 -41,-0.4 2,-0.3 -2,-0.4 -2,-0.0 -0.655 32.9 157.8-110.2 80.3 9.3 19.7 -3.9 100 100 A L - 0 0 22 -2,-0.6 -42,-0.1 1,-0.1 -2,-0.1 -0.679 42.0 -96.2 -96.0 150.2 8.4 16.6 -1.8 101 101 A S 0 0 81 -2,-0.3 4,-0.1 1,-0.1 -1,-0.1 -0.071 360.0 360.0 -59.2 161.6 6.4 13.6 -3.0 102 102 A H 0 0 213 2,-0.1 -1,-0.1 0, 0.0 -2,-0.0 0.174 360.0 360.0-140.0 360.0 2.7 12.9 -2.7 103 ! 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 0.0 104 106 A N 0 0 110 0, 0.0 -80,-2.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 24.4 6.4 9.0 3.0 105 107 A W E -D 23 0A 61 -82,-0.2 2,-0.3 -4,-0.1 -82,-0.2 -0.977 360.0-171.0-145.6 159.1 7.6 12.1 4.9 106 108 A K E -D 22 0A 103 -84,-2.1 -84,-3.1 -2,-0.3 2,-0.5 -0.992 22.7-135.4-149.9 143.7 6.7 14.3 7.8 107 109 A W E -D 21 0A 36 -2,-0.3 2,-0.4 -86,-0.2 -86,-0.2 -0.887 38.0-175.1 -96.2 127.8 7.7 17.6 9.4 108 110 A C E -D 20 0A 6 -88,-2.0 -88,-3.2 -2,-0.5 -2,-0.0 -0.985 26.2-132.8-135.6 129.1 8.0 17.1 13.2 109 111 A E >> - 0 0 96 -2,-0.4 4,-2.6 -90,-0.3 3,-0.6 -0.302 51.2 -88.0 -64.7 162.6 8.6 19.3 16.2 110 112 A L H 3> S+ 0 0 40 -92,-0.5 4,-2.4 1,-0.2 5,-0.2 0.837 124.0 45.0 -42.5 -58.1 11.3 17.9 18.7 111 113 A E H 3> S+ 0 0 134 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.864 117.0 44.3 -59.1 -41.2 9.0 15.7 20.8 112 114 A D H <> S+ 0 0 103 -3,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.837 110.7 55.9 -74.0 -34.1 7.1 14.2 18.0 113 115 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 5,-0.2 0.922 107.6 48.7 -64.9 -41.7 10.3 13.6 16.1 114 116 A I H X S+ 0 0 52 -4,-2.4 4,-1.7 -5,-0.2 5,-0.4 0.924 108.5 55.6 -62.5 -45.4 11.8 11.6 19.0 115 117 A K H < S+ 0 0 66 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.877 113.8 36.1 -55.6 -47.3 8.7 9.5 19.2 116 118 A I H < S+ 0 0 51 -4,-1.8 -84,-0.6 1,-0.2 -1,-0.2 0.736 110.8 59.5 -87.4 -17.9 8.7 8.3 15.6 117 119 A A H < S- 0 0 8 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.839 82.1-172.3 -70.8 -30.0 12.4 8.0 15.2 118 120 A D < + 0 0 140 -4,-1.7 2,-0.3 -5,-0.2 -3,-0.1 0.856 41.2 116.1 38.8 51.9 12.1 5.6 18.0 119 121 A Y >> - 0 0 97 -5,-0.4 4,-2.2 1,-0.1 3,-0.8 -0.889 60.9-144.8-150.7 110.1 15.9 5.3 18.4 120 122 A A H 3> S+ 0 0 84 -2,-0.3 4,-2.1 1,-0.3 5,-0.2 0.849 98.0 48.6 -47.3 -47.4 17.7 6.5 21.5 121 123 A E H 3> S+ 0 0 36 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.846 110.4 50.4 -66.9 -36.5 20.8 7.9 19.8 122 124 A M H <> S+ 0 0 4 -3,-0.8 4,-2.7 2,-0.2 -1,-0.2 0.870 108.0 54.7 -67.4 -40.5 18.9 9.8 17.2 123 125 A G H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.925 107.8 48.8 -57.1 -43.7 16.8 11.4 20.0 124 126 A S H X S+ 0 0 62 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.920 111.2 50.7 -64.9 -39.0 20.0 12.5 21.7 125 127 A L H X S+ 0 0 5 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.920 107.9 51.3 -63.5 -45.9 21.3 14.0 18.4 126 128 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.904 109.5 50.7 -61.5 -38.5 18.1 15.9 17.7 127 129 A R H X S+ 0 0 125 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.903 109.1 52.0 -64.3 -41.4 18.2 17.4 21.3 128 130 A K H X S+ 0 0 46 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.948 111.4 46.4 -58.8 -44.8 21.8 18.5 20.7 129 131 A F H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.852 109.5 55.2 -68.6 -30.9 20.9 20.2 17.4 130 132 A S H X S+ 0 0 30 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.898 108.4 47.9 -67.1 -40.5 17.8 21.9 19.1 131 133 A A H < S+ 0 0 68 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.857 107.5 55.6 -68.0 -38.8 20.1 23.4 21.8 132 134 A F H < S+ 0 0 95 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.959 108.6 49.1 -57.2 -47.9 22.5 24.6 19.1 133 135 A L H < 0 0 51 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.773 360.0 360.0 -61.1 -26.2 19.6 26.4 17.5 134 136 A A < 0 0 120 -4,-1.2 -3,-0.0 -3,-0.1 0, 0.0 -0.308 360.0 360.0 -80.0 360.0 18.5 28.0 20.8