==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-JUL-10 3NVS . COMPND 2 MOLECULE: 3-PHOSPHOSHIKIMATE 1-CARBOXYVINYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO CHOLERAE; . AUTHOR G.MINASOV,S.H.LIGHT,A.HALAVATY,G.SHUVALOVA,L.PAPAZISI,W.F.AN . 426 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15745.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 324 76.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 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-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 40 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 1 3 2 1 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 2 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 . 2 0 1 9 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 5 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 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 0 172 0, 0.0 2,-0.3 0, 0.0 404,-0.0 0.000 360.0 360.0 360.0 136.9 23.1 20.5 31.2 2 2 A E - 0 0 105 2,-0.0 404,-2.8 0, 0.0 2,-0.3 -0.735 360.0-172.4-115.8 165.0 20.4 18.4 33.0 3 3 A S E -A 405 0A 72 402,-0.3 2,-0.4 -2,-0.3 402,-0.2 -0.984 14.9-150.0-155.6 158.4 20.3 14.7 33.7 4 4 A L E -A 404 0A 56 400,-2.0 400,-3.3 -2,-0.3 2,-0.6 -0.995 9.8-156.0-130.4 126.3 17.9 11.9 35.0 5 5 A T E -A 403 0A 61 -2,-0.4 2,-0.6 398,-0.3 398,-0.2 -0.913 7.3-160.0-105.0 120.5 19.1 8.8 36.9 6 6 A L E -A 402 0A 31 396,-3.0 396,-1.8 -2,-0.6 3,-0.1 -0.892 11.6-142.8 -98.7 119.6 16.7 5.9 36.7 7 7 A Q - 0 0 125 -2,-0.6 393,-0.1 394,-0.2 389,-0.0 -0.347 45.6 -67.6 -70.0 162.1 17.3 3.3 39.4 8 8 A P - 0 0 57 0, 0.0 2,-0.5 0, 0.0 389,-0.2 -0.220 47.2-144.3 -57.5 141.6 16.8 -0.4 38.5 9 9 A I - 0 0 18 387,-2.9 3,-0.1 389,-0.5 391,-0.1 -0.932 10.1-167.1-112.6 121.1 13.2 -1.4 37.6 10 10 A E + 0 0 157 416,-0.7 2,-0.3 -2,-0.5 -1,-0.1 0.744 68.9 13.6 -84.4 -23.1 12.2 -4.9 38.7 11 11 A L - 0 0 74 415,-1.5 415,-3.0 2,-0.1 2,-0.4 -0.984 57.2-153.4-157.3 139.0 9.0 -5.4 36.7 12 12 A I B +C 425 0B 0 245,-2.1 247,-0.5 -2,-0.3 2,-0.3 -0.965 32.6 139.7-112.8 130.8 7.1 -3.7 33.9 13 13 A S + 0 0 32 411,-2.1 2,-0.3 -2,-0.4 248,-0.2 -0.943 23.9 61.9-165.0 148.2 3.3 -3.9 33.6 14 14 A G E -d 261 0C 24 246,-2.1 248,-2.2 -2,-0.3 2,-0.3 -0.968 65.4 -64.3 143.0-152.0 0.4 -1.8 32.7 15 15 A E E -d 262 0C 110 -2,-0.3 2,-0.4 246,-0.2 248,-0.2 -0.999 27.4-161.3-144.7 141.6 -1.3 0.2 30.0 16 16 A V E -d 263 0C 1 246,-2.4 248,-2.4 -2,-0.3 2,-0.8 -0.992 14.8-146.7-128.8 126.9 -0.4 3.4 28.1 17 17 A N E -d 264 0C 102 -2,-0.4 248,-0.1 246,-0.2 246,-0.1 -0.817 41.4-125.3 -84.4 109.8 -2.8 5.6 26.1 18 18 A L - 0 0 3 246,-2.0 3,-0.1 -2,-0.8 226,-0.1 -0.236 10.4-115.9 -66.1 145.8 -0.4 6.7 23.3 19 19 A P - 0 0 26 0, 0.0 224,-3.0 0, 0.0 26,-0.2 -0.368 53.0 -81.1 -63.9 157.6 0.4 10.2 22.4 20 20 A G B -G 242 0D 2 24,-0.3 2,-0.3 222,-0.3 222,-0.3 -0.193 52.3 -89.7 -61.4 155.0 -0.7 11.1 18.9 21 21 A S > - 0 0 0 220,-2.8 4,-2.6 22,-0.2 24,-0.4 -0.478 25.5-154.0 -65.4 124.5 1.3 10.2 15.8 22 22 A K H > S+ 0 0 14 -2,-0.3 4,-2.3 2,-0.2 5,-0.3 0.931 95.8 50.8 -61.2 -46.3 3.8 12.8 14.8 23 23 A S H > S+ 0 0 8 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.908 115.4 40.5 -59.7 -47.0 3.8 11.7 11.2 24 24 A V H > S+ 0 0 2 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.929 112.9 56.1 -68.8 -44.1 0.0 11.7 10.9 25 25 A S H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.922 108.8 43.9 -56.6 -50.9 -0.3 15.0 12.9 26 26 A N H X S+ 0 0 2 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.866 114.9 48.9 -69.7 -33.6 1.9 17.1 10.7 27 27 A R H X S+ 0 0 14 -4,-1.4 4,-2.6 -5,-0.3 5,-0.3 0.941 113.1 47.7 -64.0 -47.6 0.5 15.7 7.4 28 28 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.867 110.4 52.0 -64.6 -38.0 -3.1 16.3 8.6 29 29 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.926 112.6 44.4 -64.1 -45.6 -2.4 19.8 9.8 30 30 A L H X S+ 0 0 2 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.942 115.8 45.9 -67.3 -44.5 -0.8 20.9 6.5 31 31 A L H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.901 110.3 55.1 -65.6 -36.9 -3.6 19.2 4.4 32 32 A A H < S+ 0 0 0 -4,-2.4 -1,-0.2 -5,-0.3 47,-0.2 0.880 107.2 51.0 -61.5 -36.9 -6.2 20.8 6.7 33 33 A A H < S+ 0 0 0 -4,-1.8 45,-3.0 44,-0.2 47,-0.3 0.879 115.4 40.9 -65.6 -40.9 -4.7 24.2 6.0 34 34 A L H < S+ 0 0 5 -4,-1.8 -2,-0.2 43,-0.2 -1,-0.2 0.749 103.2 87.8 -79.1 -26.6 -4.8 23.7 2.2 35 35 A A S < S- 0 0 0 -4,-2.2 44,-1.9 -5,-0.2 2,-0.3 -0.158 81.2-107.7 -72.7 165.6 -8.2 22.1 2.1 36 36 A S B S+h 233 0E 56 196,-1.9 198,-3.0 43,-0.2 42,-0.1 -0.702 83.4 25.2 -84.9 143.0 -11.7 23.5 1.8 37 37 A G S S- 0 0 44 40,-0.4 40,-2.0 -2,-0.3 2,-0.5 -0.087 96.1 -65.3 91.9 167.6 -13.7 23.2 5.0 38 38 A T E -I 76 0F 67 38,-0.2 2,-0.5 196,-0.1 38,-0.2 -0.837 42.1-148.8 -95.5 127.7 -12.9 23.0 8.6 39 39 A T E -I 75 0F 0 36,-2.5 36,-2.6 -2,-0.5 2,-0.8 -0.852 1.8-153.9 -97.3 129.8 -11.1 19.9 9.9 40 40 A R E -Ij 74 237F 119 196,-2.6 198,-2.5 -2,-0.5 2,-0.3 -0.844 19.3-168.9-104.9 92.4 -11.8 18.8 13.4 41 41 A L E -Ij 73 238F 0 32,-2.9 32,-2.3 -2,-0.8 2,-0.3 -0.644 6.7-175.8 -84.9 139.5 -8.7 16.9 14.5 42 42 A T E + j 0 239F 56 196,-2.0 198,-2.8 -2,-0.3 30,-0.2 -0.940 65.5 28.7-130.9 158.2 -8.6 14.9 17.7 43 43 A N S S+ 0 0 43 -2,-0.3 29,-0.2 28,-0.3 -22,-0.2 0.725 79.1 169.1 61.7 26.6 -5.7 13.0 19.4 44 44 A L - 0 0 2 27,-2.6 2,-0.3 -3,-0.1 -24,-0.3 -0.369 38.2-109.6 -61.3 143.2 -3.3 15.5 17.8 45 45 A L - 0 0 4 -24,-0.4 2,-0.8 -26,-0.2 -1,-0.1 -0.617 19.1-150.6 -75.8 131.9 0.2 15.3 19.2 46 46 A D + 0 0 65 -2,-0.3 2,-0.3 23,-0.1 25,-0.1 -0.918 51.2 116.5 -97.3 103.4 1.5 18.0 21.5 47 47 A S S > S- 0 0 2 -2,-0.8 4,-2.7 367,-0.1 3,-0.4 -0.962 79.1 -90.0-156.4 173.1 5.3 18.0 20.8 48 48 A D H > S+ 0 0 39 363,-2.7 4,-2.5 -2,-0.3 5,-0.2 0.906 121.2 55.1 -59.1 -42.3 7.9 20.3 19.4 49 49 A D H > S+ 0 0 2 363,-1.8 4,-1.1 362,-0.2 -1,-0.2 0.859 113.2 41.8 -62.1 -37.5 7.6 19.1 15.9 50 50 A I H > S+ 0 0 1 -3,-0.4 4,-3.0 362,-0.3 5,-0.2 0.898 110.5 56.9 -74.0 -40.9 3.8 19.8 15.8 51 51 A R H X S+ 0 0 105 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.913 105.9 50.9 -57.8 -41.3 4.3 23.1 17.6 52 52 A H H X S+ 0 0 7 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.904 111.1 48.2 -64.9 -37.8 6.6 24.3 14.9 53 53 A M H X S+ 0 0 0 -4,-1.1 4,-2.7 -5,-0.2 -2,-0.2 0.945 112.4 48.6 -65.0 -48.2 4.1 23.3 12.2 54 54 A L H X S+ 0 0 9 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.906 111.1 50.6 -57.5 -42.9 1.3 25.2 14.1 55 55 A N H X S+ 0 0 79 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.892 109.9 49.9 -65.4 -38.3 3.4 28.2 14.5 56 56 A A H X S+ 0 0 3 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.944 109.6 51.2 -62.5 -48.2 4.2 28.2 10.8 57 57 A L H <>S+ 0 0 0 -4,-2.7 5,-2.5 1,-0.2 4,-0.3 0.899 107.7 53.8 -57.8 -39.9 0.5 27.9 10.0 58 58 A T H ><5S+ 0 0 79 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.953 110.7 45.3 -56.6 -51.7 -0.2 30.9 12.3 59 59 A K H 3<5S+ 0 0 109 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.843 108.3 58.4 -61.4 -32.9 2.4 33.0 10.4 60 60 A L T 3<5S- 0 0 5 -4,-2.3 23,-0.4 -5,-0.1 -1,-0.3 0.395 122.4-103.6 -79.3 -0.6 0.9 31.8 7.1 61 61 A G T < 5 + 0 0 45 -3,-1.6 2,-0.3 1,-0.3 -3,-0.2 0.577 67.3 150.4 92.6 13.7 -2.5 33.2 8.0 62 62 A V < - 0 0 7 -5,-2.5 2,-0.6 -6,-0.2 -1,-0.3 -0.618 38.4-141.1 -82.7 133.5 -4.3 30.0 8.9 63 63 A N E +K 76 0F 107 13,-0.5 13,-2.8 -2,-0.3 2,-0.3 -0.861 36.7 150.0 -92.3 122.6 -7.1 30.3 11.4 64 64 A Y E -K 75 0F 52 -2,-0.6 2,-0.4 11,-0.2 11,-0.2 -0.958 36.6-138.8-147.0 163.0 -7.3 27.4 13.9 65 65 A R E -K 74 0F 186 9,-2.1 9,-2.3 -2,-0.3 2,-0.5 -0.984 14.9-163.9-127.4 120.8 -8.3 26.7 17.5 66 66 A L E -K 73 0F 53 -2,-0.4 7,-0.2 7,-0.2 -2,-0.0 -0.903 21.6-122.4-106.6 129.5 -6.2 24.5 19.7 67 67 A S > - 0 0 33 5,-3.0 3,-1.5 -2,-0.5 -1,-0.0 -0.095 28.4-103.8 -62.2 161.7 -7.7 23.1 22.9 68 68 A A T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.877 124.6 49.3 -55.6 -38.3 -6.2 23.6 26.3 69 69 A D T 3 S- 0 0 101 1,-0.1 -1,-0.3 3,-0.0 -23,-0.1 0.501 107.4-130.4 -83.1 -5.7 -4.8 20.1 26.3 70 70 A K S < S+ 0 0 82 -3,-1.5 -2,-0.1 2,-0.2 3,-0.1 0.584 85.1 94.9 70.3 16.5 -3.4 20.6 22.8 71 71 A T S S+ 0 0 43 1,-0.1 -27,-2.6 -28,-0.1 2,-0.5 0.545 71.1 64.8-110.0 -12.4 -4.9 17.4 21.4 72 72 A T + 0 0 45 -30,-0.2 -5,-3.0 -29,-0.2 2,-0.4 -0.968 64.0 170.3-115.0 125.1 -8.1 18.8 19.8 73 73 A C E -IK 41 66F 0 -32,-2.3 -32,-2.9 -2,-0.5 2,-0.6 -0.991 23.4-158.4-143.9 126.5 -7.7 21.3 17.0 74 74 A E E -IK 40 65F 57 -9,-2.3 -9,-2.1 -2,-0.4 2,-0.5 -0.935 15.8-166.2-105.8 118.3 -10.1 22.9 14.5 75 75 A V E -IK 39 64F 0 -36,-2.6 -36,-2.5 -2,-0.6 2,-0.8 -0.925 13.8-145.2-110.2 120.0 -8.4 24.1 11.4 76 76 A E E -IK 38 63F 100 -13,-2.8 -13,-0.5 -2,-0.5 -38,-0.2 -0.756 28.4-131.7 -82.8 110.3 -10.2 26.5 9.0 77 77 A G - 0 0 23 -40,-2.0 -40,-0.4 -2,-0.8 -44,-0.2 -0.293 8.1-146.7 -67.6 146.2 -9.0 25.5 5.6 78 78 A L - 0 0 65 -45,-3.0 -42,-0.2 2,-0.2 -44,-0.2 0.694 24.9-141.2 -80.1 -23.4 -7.8 28.1 3.1 79 79 A G S S+ 0 0 34 -44,-1.9 2,-0.3 -46,-0.3 -43,-0.2 0.676 76.6 41.3 66.9 16.8 -9.1 26.1 0.1 80 80 A Q S S- 0 0 100 -47,-0.3 -2,-0.2 -45,-0.2 -1,-0.2 -0.948 101.5 -60.4-170.1 176.7 -6.0 27.1 -1.8 81 81 A A - 0 0 14 -2,-0.3 25,-0.1 27,-0.2 24,-0.0 -0.155 69.8 -77.0 -64.1 165.7 -2.2 27.7 -1.5 82 82 A F - 0 0 2 23,-0.3 28,-1.8 27,-0.0 2,-0.4 -0.339 41.4-166.7 -67.6 146.7 -0.8 30.2 0.9 83 83 A H B +l 110 0G 102 -23,-0.4 2,-0.3 26,-0.2 28,-0.2 -0.902 16.3 166.0-139.7 105.8 -0.9 33.9 0.0 84 84 A T - 0 0 19 26,-2.7 -24,-0.1 -2,-0.4 4,-0.0 -0.865 24.6-163.3-125.6 155.1 1.2 36.1 2.2 85 85 A T S S+ 0 0 115 -2,-0.3 26,-0.1 26,-0.1 -1,-0.1 0.431 70.6 55.3-123.2 -4.8 2.3 39.7 1.6 86 86 A Q S S- 0 0 135 26,-0.1 26,-0.3 0, 0.0 -1,-0.1 -0.970 94.2 -95.3-124.9 147.5 5.2 40.4 3.9 87 87 A P - 0 0 98 0, 0.0 2,-0.4 0, 0.0 26,-0.2 -0.376 46.3-159.2 -61.8 139.1 8.4 38.3 4.1 88 88 A L E -m 113 0H 36 24,-2.2 26,-2.2 -4,-0.0 2,-0.5 -0.932 17.2-148.4-122.2 146.5 8.3 35.7 6.8 89 89 A E E -m 114 0H 136 -2,-0.4 2,-0.7 24,-0.2 26,-0.2 -0.968 15.6-161.0-109.1 123.2 10.8 33.7 8.7 90 90 A L E -m 115 0H 3 24,-3.3 26,-2.5 -2,-0.5 2,-0.7 -0.906 2.4-158.5-109.7 110.0 9.6 30.2 9.6 91 91 A F E +m 116 0H 105 -2,-0.7 26,-0.2 24,-0.2 -35,-0.1 -0.810 13.2 178.2 -88.9 119.0 11.6 28.6 12.4 92 92 A L > - 0 0 0 24,-2.6 3,-2.5 -2,-0.7 7,-0.3 0.135 22.0-146.7-115.7 21.0 11.0 24.8 12.1 93 93 A G T 3 - 0 0 0 1,-0.3 25,-2.1 -41,-0.1 -1,-0.3 -0.307 65.6 -44.9 57.3-125.7 13.1 23.4 14.9 94 94 A N T 3 S+ 0 0 7 23,-0.2 2,-1.1 26,-0.1 -1,-0.3 -0.118 96.2 137.3-125.9 36.1 14.5 20.1 13.8 95 95 A A X> - 0 0 0 -3,-2.5 4,-2.9 1,-0.2 3,-1.7 -0.689 29.5-178.5 -91.9 96.4 11.1 18.9 12.4 96 96 A G H 3> S+ 0 0 4 -2,-1.1 4,-2.6 1,-0.3 -1,-0.2 0.879 83.9 61.8 -58.3 -35.7 11.7 17.2 9.0 97 97 A T H 34 S+ 0 0 10 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.533 113.4 35.9 -74.4 -5.2 7.9 16.7 8.7 98 98 A A H <> S+ 0 0 0 -3,-1.7 4,-2.5 -6,-0.2 5,-0.3 0.718 119.2 47.3-100.3 -51.8 7.5 20.5 8.8 99 99 A M H X S+ 0 0 0 -4,-2.9 4,-1.9 -7,-0.3 -2,-0.2 0.919 115.2 42.9 -58.5 -50.4 10.6 21.5 6.8 100 100 A R H X S+ 0 0 5 -4,-2.6 4,-1.5 -5,-0.2 5,-0.2 0.979 118.6 42.0 -65.3 -53.9 10.2 19.1 3.9 101 101 A P H > S+ 0 0 8 0, 0.0 4,-2.7 0, 0.0 -2,-0.2 0.899 116.7 48.1 -61.9 -37.8 6.5 19.4 3.3 102 102 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.840 102.6 62.5 -71.8 -32.9 6.5 23.2 3.7 103 103 A A H < S+ 0 0 0 -4,-1.9 4,-0.4 -5,-0.3 -1,-0.2 0.920 113.7 36.7 -56.2 -41.9 9.5 23.6 1.4 104 104 A A H >< S+ 0 0 0 -4,-1.5 3,-1.4 2,-0.1 4,-0.5 0.950 116.7 50.4 -72.3 -50.1 7.2 22.1 -1.3 105 105 A A H >< S+ 0 0 1 -4,-2.7 3,-1.4 1,-0.3 4,-0.4 0.844 103.0 59.7 -64.9 -33.8 3.9 23.7 -0.3 106 106 A L T 3< S+ 0 0 1 -4,-2.6 3,-0.4 1,-0.3 -1,-0.3 0.712 95.6 63.9 -69.4 -16.7 5.3 27.3 -0.1 107 107 A C T < S+ 0 0 0 -3,-1.4 50,-2.7 -4,-0.4 49,-2.5 0.724 92.2 67.6 -71.9 -23.0 6.3 27.1 -3.7 108 108 A L S < S+ 0 0 14 -3,-1.4 50,-0.2 -4,-0.5 -1,-0.2 0.727 102.8 31.4 -70.2 -28.4 2.6 26.8 -4.7 109 109 A G S S- 0 0 12 -3,-0.4 2,-0.4 -4,-0.4 -26,-0.2 0.189 93.2 -68.1-109.7-141.7 1.3 30.2 -3.7 110 110 A Q B S+l 83 0G 117 -28,-1.8 -26,-2.7 46,-0.1 2,-0.3 -0.995 74.8 65.6-128.0 129.0 2.4 33.8 -3.4 111 111 A G - 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