==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 30-APR-12 4EX8 . COMPND 2 MOLECULE: ALNA; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES SP. CM020; . AUTHOR T.OJA,L.NIIRANEN,T.SANDALOVA,K.D.KLIKA,J.NIEMI,P.MANTSALA, . 301 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14578.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 232 77.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 5.6 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 . 2 0.7 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 . 20 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 115 38.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 0 1 1 1 2 1 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 2 1 4 1 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 . 6 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 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 5 A P 0 0 193 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-169.2 89.7 105.3 115.4 2 6 A D - 0 0 58 3,-0.2 3,-0.0 1,-0.1 0, 0.0 -0.930 360.0-160.6-110.1 130.9 87.3 104.0 112.6 3 7 A Q S S+ 0 0 171 -2,-0.4 -1,-0.1 1,-0.2 3,-0.0 0.563 85.8 50.5 -94.8 -6.8 84.0 105.8 112.3 4 8 A L S S+ 0 0 68 57,-0.1 58,-3.6 59,-0.0 2,-0.4 0.672 95.9 79.6 -97.5 -21.1 82.0 103.1 110.5 5 9 A L E -a 62 0A 23 56,-0.2 2,-0.5 106,-0.1 58,-0.2 -0.733 49.6-172.9-102.6 131.2 82.7 100.2 112.8 6 10 A E E -a 63 0A 111 56,-3.4 58,-3.2 -2,-0.4 2,-0.4 -0.964 14.1-176.9-120.5 111.4 81.0 99.4 116.2 7 11 A V E -a 64 0A 46 -2,-0.5 58,-0.2 56,-0.2 56,-0.0 -0.920 25.4-120.3-111.6 128.7 82.8 96.5 117.9 8 12 A S > - 0 0 42 56,-2.5 4,-3.1 -2,-0.4 5,-0.2 -0.258 28.2-108.7 -65.2 161.4 81.5 95.1 121.3 9 13 A D H > S+ 0 0 138 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.900 116.7 52.3 -56.1 -48.3 83.8 95.1 124.4 10 14 A E H > S+ 0 0 87 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.911 114.0 41.1 -58.2 -44.3 84.3 91.4 124.4 11 15 A I H > S+ 0 0 3 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.921 113.7 52.6 -72.6 -45.1 85.3 91.2 120.7 12 16 A A H X S+ 0 0 45 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.913 112.1 47.6 -57.2 -40.5 87.5 94.4 120.9 13 17 A T H X S+ 0 0 64 -4,-2.8 4,-2.1 -5,-0.2 -2,-0.2 0.915 111.0 50.0 -65.2 -45.0 89.3 92.8 124.0 14 18 A A H <>S+ 0 0 0 -4,-2.1 5,-3.1 -5,-0.2 -1,-0.2 0.904 113.4 46.6 -60.5 -40.5 89.8 89.4 122.3 15 19 A L H ><5S+ 0 0 44 -4,-2.5 3,-2.0 3,-0.2 -2,-0.2 0.938 110.5 51.7 -68.6 -43.9 91.3 91.2 119.2 16 20 A A H 3<5S+ 0 0 78 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.862 113.4 45.9 -60.0 -36.7 93.5 93.5 121.3 17 21 A E T 3<5S- 0 0 105 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.363 112.5-120.3 -88.0 7.9 94.8 90.4 123.0 18 22 A R T < 5 + 0 0 219 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.855 61.7 152.6 52.9 36.0 95.3 88.4 119.7 19 23 A R < - 0 0 117 -5,-3.1 -1,-0.2 -6,-0.2 2,-0.1 -0.643 53.5 -82.6 -89.7 159.0 92.8 85.8 121.0 20 24 A P + 0 0 17 0, 0.0 31,-2.0 0, 0.0 2,-0.3 -0.350 48.6 176.8 -71.2 133.9 90.7 83.6 118.6 21 25 A V E -d 51 0B 5 29,-0.2 2,-0.4 271,-0.1 94,-0.4 -0.970 14.0-157.8-130.4 145.6 87.4 85.2 117.2 22 26 A V E -d 52 0B 0 29,-2.9 31,-2.7 -2,-0.3 95,-0.2 -0.978 14.2-141.1-127.1 122.6 85.0 83.6 114.6 23 27 A A E -de 53 117B 0 93,-3.1 95,-2.3 -2,-0.4 2,-0.3 -0.502 15.3-165.2 -80.4 150.8 82.6 85.8 112.6 24 28 A L E -d 54 0B 20 29,-2.3 31,-2.2 93,-0.2 95,-0.1 -0.963 18.7-118.8-135.6 152.1 79.0 84.8 111.8 25 29 A E - 0 0 19 93,-0.5 4,-0.2 -2,-0.3 76,-0.1 -0.342 7.0-155.2 -94.3 160.7 76.6 86.2 109.3 26 30 A S S >> S+ 0 0 0 74,-0.9 3,-1.0 29,-0.1 4,-1.0 0.711 77.6 87.4-104.3 -22.6 73.3 87.8 110.2 27 31 A S T 34 S+ 0 0 5 73,-2.1 74,-0.1 1,-0.3 72,-0.1 0.651 100.9 36.0 -56.5 -22.7 71.6 87.2 106.8 28 32 A L T >4 S+ 0 0 64 72,-0.2 3,-3.1 2,-0.1 4,-0.3 0.642 95.9 80.3-102.5 -18.8 70.5 83.8 108.1 29 33 A I G X4 S+ 0 0 29 -3,-1.0 3,-0.6 1,-0.3 -2,-0.2 0.747 93.2 59.7 -50.4 -22.9 69.9 84.8 111.9 30 34 A T G 3< S+ 0 0 45 -4,-1.0 -1,-0.3 1,-0.2 -2,-0.1 0.703 92.4 64.0 -76.4 -24.9 66.7 86.0 110.3 31 35 A T G < S+ 0 0 109 -3,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.477 105.6 45.6 -86.8 -1.0 65.9 82.5 109.1 32 36 A D < + 0 0 45 -3,-0.6 2,-1.4 -4,-0.3 3,-0.4 -0.537 62.1 179.6-140.6 73.6 65.6 81.2 112.7 33 37 A P + 0 0 88 0, 0.0 -3,-0.1 0, 0.0 3,-0.0 -0.599 65.3 72.2 -75.8 97.8 63.6 83.5 115.0 34 38 A S S S- 0 0 77 -2,-1.4 2,-0.2 0, 0.0 41,-0.0 0.635 83.3-141.0-138.1 -60.7 63.9 81.4 118.2 35 39 A S S > S+ 0 0 43 -3,-0.4 2,-6.5 -6,-0.1 3,-0.6 -0.799 70.9 109.1 -88.7 -43.8 66.8 81.8 119.0 36 40 A E T 3> S+ 0 0 125 1,-0.3 4,-1.5 -2,-0.2 5,-0.1 0.109 82.5 59.9 42.5 -42.7 68.0 78.4 120.3 37 41 A T H >> S+ 0 0 11 -2,-6.5 4,-2.8 -5,-0.2 3,-0.9 0.982 102.5 47.4 -70.1 -68.1 70.1 78.0 117.1 38 42 A A H <> S+ 0 0 45 -3,-0.6 4,-2.5 1,-0.3 5,-0.2 0.872 113.5 53.9 -39.5 -38.3 72.3 81.1 117.7 39 43 A S H 3> S+ 0 0 60 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.907 108.9 43.9 -69.8 -39.9 72.6 79.8 121.2 40 44 A L H <>S+ 0 0 0 -4,-2.3 3,-1.4 1,-0.2 5,-1.3 0.957 114.7 46.2 -67.8 -49.6 82.3 78.4 118.9 46 50 A R H ><5S+ 0 0 80 -4,-2.9 3,-2.8 1,-0.3 -2,-0.2 0.796 94.2 76.5 -64.2 -27.8 83.2 79.1 122.6 47 51 A G T 3<5S+ 0 0 74 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.776 98.7 47.6 -55.1 -25.8 83.8 75.4 123.4 48 52 A A T < 5S- 0 0 31 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.439 125.3-105.0 -91.5 -2.6 87.1 75.9 121.6 49 53 A G T < 5S+ 0 0 54 -3,-2.8 -3,-0.2 1,-0.3 2,-0.2 0.489 79.6 132.8 87.4 4.6 87.9 79.1 123.5 50 54 A A < - 0 0 2 -5,-1.3 -1,-0.3 -31,-0.1 -29,-0.2 -0.527 56.9-124.6 -82.5 153.8 87.0 81.3 120.4 51 55 A V E -d 21 0B 10 -31,-2.0 -29,-2.9 -2,-0.2 2,-0.3 -0.878 21.3-135.2 -95.9 121.6 84.7 84.4 120.7 52 56 A P E -d 22 0B 16 0, 0.0 2,-0.5 0, 0.0 -29,-0.2 -0.635 18.4-166.7 -71.6 134.5 81.6 84.4 118.3 53 57 A A E -d 23 0B 0 -31,-2.7 -29,-2.3 -2,-0.3 2,-0.3 -0.865 3.3-161.2-127.2 97.9 81.1 87.7 116.5 54 58 A T E -d 24 0B 33 -2,-0.5 11,-2.7 -31,-0.2 12,-0.7 -0.586 17.6-156.7 -74.7 135.0 77.7 88.1 114.8 55 59 A I E +B 64 0A 0 -31,-2.2 45,-0.4 -2,-0.3 2,-0.3 -0.895 25.8 131.9-123.5 146.4 77.8 90.9 112.2 56 60 A G E -B 63 0A 0 7,-1.9 7,-2.6 -2,-0.4 2,-0.4 -0.923 46.8 -93.4-165.4-171.5 75.3 93.1 110.6 57 61 A I E +BC 62 98A 0 41,-2.6 41,-2.4 -2,-0.3 2,-0.3 -0.960 43.2 154.9-120.6 134.5 74.5 96.7 109.6 58 62 A A E > -B 61 0A 12 3,-2.1 3,-1.7 -2,-0.4 39,-0.2 -0.922 59.9 -2.1-155.2 138.3 72.5 99.1 111.6 59 63 A G T 3 S- 0 0 59 36,-0.7 37,-0.1 37,-0.3 38,-0.1 0.761 126.9 -51.3 63.7 28.1 72.1 102.9 112.1 60 64 A G T 3 S+ 0 0 23 36,-0.5 2,-0.4 31,-0.3 -1,-0.3 0.635 117.5 109.8 81.9 13.0 74.8 103.8 109.6 61 65 A K E < S- B 0 58A 69 -3,-1.7 -3,-2.1 34,-0.1 2,-0.7 -0.938 72.0-129.4-125.9 148.3 77.3 101.5 111.3 62 66 A L E -aB 5 57A 8 -58,-3.6 -56,-3.4 -2,-0.4 2,-0.5 -0.846 38.4-152.3 -84.8 113.6 79.1 98.1 110.6 63 67 A V E -aB 6 56A 15 -7,-2.6 -7,-1.9 -2,-0.7 2,-0.6 -0.840 15.8-170.3 -99.5 120.1 78.2 96.3 113.9 64 68 A V E S+aB 7 55A 0 -58,-3.2 -56,-2.5 -2,-0.5 -9,-0.2 -0.960 77.5 19.0-112.3 105.2 80.6 93.5 115.1 65 69 A G S S- 0 0 16 -11,-2.7 -1,-0.3 -2,-0.6 -10,-0.2 0.831 89.7-129.2 94.7 83.1 78.8 91.7 118.0 66 70 A L - 0 0 18 -12,-0.7 -12,-0.1 -3,-0.2 -11,-0.0 -0.431 18.9-126.7 -61.8 135.1 75.1 92.4 117.7 67 71 A T > - 0 0 79 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.231 27.4-106.6 -67.1 165.5 73.5 93.7 121.1 68 72 A D H > S+ 0 0 138 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.914 124.6 55.6 -64.1 -42.0 70.4 91.8 122.4 69 73 A S H > S+ 0 0 76 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.929 111.0 44.0 -49.3 -52.1 68.3 94.8 121.3 70 74 A L H > S+ 0 0 29 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.878 110.2 52.7 -64.1 -45.1 69.7 94.4 117.7 71 75 A I H X S+ 0 0 41 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.945 108.6 54.5 -58.7 -42.0 69.3 90.5 117.6 72 76 A E H X S+ 0 0 130 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.902 108.6 46.2 -54.9 -49.7 65.7 91.2 118.6 73 77 A R H X S+ 0 0 145 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.960 112.9 49.5 -57.4 -50.8 65.2 93.6 115.6 74 78 A F H < S+ 0 0 3 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.777 115.3 46.2 -59.9 -28.3 66.9 91.2 113.2 75 79 A A H < S+ 0 0 33 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.849 125.2 28.1 -78.1 -38.0 64.6 88.4 114.6 76 80 A S H < S+ 0 0 86 -4,-2.2 2,-0.4 -5,-0.2 -2,-0.2 0.451 90.9 97.8-114.3 -2.6 61.4 90.4 114.5 77 81 A T >< - 0 0 66 -4,-2.6 3,-0.5 1,-0.1 -4,-0.0 -0.767 53.8-153.5 -94.6 135.9 61.5 93.1 111.7 78 82 A K T 3 S+ 0 0 208 -2,-0.4 -1,-0.1 1,-0.2 2,-0.1 0.956 81.2 52.4 -71.1 -53.0 59.8 92.2 108.4 79 83 A G T 3 + 0 0 54 2,-0.0 -1,-0.2 1,-0.0 -2,-0.0 0.257 67.1 147.6 -76.7 15.2 61.6 94.4 105.8 80 84 A I < - 0 0 30 -3,-0.5 18,-0.1 1,-0.1 2,-0.0 -0.248 38.9-140.3 -68.9 115.2 65.3 93.5 106.3 81 85 A P - 0 0 67 0, 0.0 18,-2.4 0, 0.0 2,-0.4 -0.343 13.5-123.3 -68.4 145.0 67.4 93.6 103.1 82 86 A K E -j 99 0C 143 16,-0.2 2,-0.6 18,-0.0 18,-0.2 -0.774 30.8-151.8 -85.5 131.1 70.1 91.0 102.5 83 87 A I E -j 100 0C 9 16,-2.6 18,-2.1 -2,-0.4 21,-0.2 -0.897 15.5-174.8-118.5 110.5 73.4 92.8 102.0 84 88 A S > - 0 0 12 -2,-0.6 3,-1.4 16,-0.2 4,-0.4 -0.297 51.5 -87.3 -83.4 176.8 76.3 91.5 99.9 85 89 A A G > S+ 0 0 23 1,-0.3 3,-1.4 2,-0.2 4,-0.5 0.900 129.4 55.2 -54.8 -42.1 79.6 93.5 99.8 86 90 A R G 3 S+ 0 0 234 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.683 107.0 51.6 -68.1 -12.7 78.4 95.7 96.9 87 91 A D G <> S+ 0 0 60 -3,-1.4 4,-2.3 1,-0.1 -1,-0.3 0.437 83.3 90.4 -98.8 -7.0 75.3 96.7 98.9 88 92 A I H <> S+ 0 0 20 -3,-1.4 4,-2.8 -4,-0.4 5,-0.2 0.931 83.5 53.8 -57.2 -46.2 77.2 97.8 102.0 89 93 A G H > S+ 0 0 50 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.908 112.2 41.8 -58.4 -48.1 77.5 101.4 100.8 90 94 A G H > S+ 0 0 54 -4,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.885 112.2 55.7 -68.7 -34.3 73.8 101.9 100.2 91 95 A A H X S+ 0 0 16 -4,-2.3 4,-1.0 2,-0.2 5,-0.4 0.950 110.8 45.5 -64.5 -43.9 72.9 100.1 103.5 92 96 A L H >< S+ 0 0 28 -4,-2.8 3,-1.1 1,-0.2 -2,-0.2 0.964 113.1 49.2 -59.7 -54.3 75.1 102.4 105.5 93 97 A A H 3< S+ 0 0 91 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.804 108.2 55.1 -51.9 -37.9 73.8 105.6 103.6 94 98 A G H 3< S- 0 0 65 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.722 94.9-145.4 -72.8 -22.1 70.2 104.4 104.2 95 99 A G << + 0 0 36 -3,-1.1 -36,-0.7 -4,-1.0 -3,-0.1 0.462 60.1 108.1 72.1 0.3 70.7 104.2 108.0 96 100 A G S S- 0 0 42 -5,-0.4 -36,-0.5 -38,-0.2 -37,-0.3 -0.006 77.5 -66.2 -90.1-159.2 68.3 101.1 108.4 97 101 A L - 0 0 37 -39,-0.2 2,-0.4 -38,-0.1 -39,-0.2 -0.707 43.3-173.8 -93.9 151.0 69.1 97.5 109.2 98 102 A G B -C 57 0A 0 -41,-2.4 -41,-2.6 -2,-0.3 2,-0.7 -0.992 17.8-147.9-144.1 129.9 71.0 95.2 106.8 99 103 A A E -j 82 0C 1 -18,-2.4 -16,-2.6 -2,-0.4 -43,-0.1 -0.878 29.1-139.8 -99.5 110.4 71.6 91.4 107.3 100 104 A T E -j 83 0C 0 -2,-0.7 -73,-2.1 -45,-0.4 -74,-0.9 -0.422 9.7-144.4 -80.6 147.5 75.0 90.7 105.6 101 105 A T > - 0 0 28 -18,-2.1 4,-3.0 -76,-0.1 5,-0.3 -0.140 43.6 -77.1 -89.4-165.1 75.7 87.6 103.5 102 106 A V H > S+ 0 0 3 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.977 134.1 41.8 -61.2 -55.7 78.9 85.7 103.2 103 107 A A H > S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.925 118.2 46.7 -60.2 -47.1 80.6 88.3 100.9 104 108 A G H > S+ 0 0 0 -21,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.921 113.8 47.9 -60.0 -45.1 79.2 91.2 103.0 105 109 A T H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.907 106.7 53.6 -68.7 -39.4 80.1 89.8 106.3 106 110 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.870 105.5 54.5 -70.1 -27.2 83.7 88.8 105.6 107 111 A V H X S+ 0 0 40 -4,-1.4 4,-2.1 -5,-0.2 -1,-0.2 0.928 113.1 42.5 -66.8 -42.4 84.6 92.3 104.3 108 112 A I H X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.917 113.9 51.9 -68.4 -41.6 83.3 93.7 107.6 109 113 A A H X>S+ 0 0 0 -4,-2.8 5,-2.6 1,-0.2 4,-0.6 0.934 110.9 48.6 -59.5 -47.9 85.1 90.9 109.7 110 114 A E H ><5S+ 0 0 71 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.913 106.3 56.3 -58.3 -45.0 88.4 91.6 107.9 111 115 A R H 3<5S+ 0 0 121 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.856 108.8 47.9 -57.6 -35.3 88.0 95.4 108.5 112 116 A A H 3<5S- 0 0 19 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.573 123.2-104.4 -80.0 -11.3 87.8 94.7 112.3 113 117 A G T <<5S+ 0 0 43 -3,-1.4 2,-0.3 -4,-0.6 -3,-0.2 0.560 72.7 143.3 97.5 4.9 90.8 92.3 112.3 114 118 A I < - 0 0 4 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.1 -0.648 27.3-174.7 -77.6 141.8 88.8 89.0 112.5 115 119 A Q + 0 0 43 -94,-0.4 33,-1.5 -2,-0.3 2,-0.4 0.373 58.7 60.5-120.6 -2.1 90.4 86.2 110.4 116 120 A V E + f 0 148B 0 -95,-0.3 -93,-3.1 31,-0.2 2,-0.3 -0.999 53.1 175.7-132.4 140.4 87.9 83.3 110.6 117 121 A F E -ef 23 149B 0 31,-2.5 33,-2.5 -2,-0.4 2,-0.4 -0.976 9.3-164.3-137.5 145.2 84.3 83.2 109.5 118 122 A T E + f 0 150B 5 -95,-2.3 -93,-0.5 -2,-0.3 2,-0.3 -0.992 17.6 150.8-134.3 149.7 81.9 80.2 109.5 119 123 A T - 0 0 5 31,-2.2 33,-0.4 -2,-0.4 3,-0.1 -0.958 51.4-107.2-160.2 163.2 78.5 79.3 107.9 120 124 A A S S- 0 0 10 -2,-0.3 32,-2.6 1,-0.2 2,-0.3 0.902 98.6 -0.3 -63.6 -41.7 76.9 76.0 106.8 121 125 A G - 0 0 2 30,-0.2 33,-0.2 31,-0.1 -1,-0.2 -0.999 64.9-138.5-149.4 144.8 77.3 76.7 103.1 122 126 A I B -k 154 0D 1 31,-2.1 33,-2.2 -2,-0.3 2,-0.1 -0.472 32.6-102.0 -91.2 169.8 78.8 79.4 100.8 123 127 A G + 0 0 9 31,-0.2 2,-0.3 -2,-0.1 -1,-0.1 -0.295 51.8 154.0 -73.3 173.7 77.2 80.7 97.5 124 128 A G - 0 0 0 -2,-0.1 12,-2.1 30,-0.1 2,-0.4 -0.895 50.1 -27.9-171.5-156.0 78.7 79.4 94.2 125 129 A V B -L 135 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