==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 23-JAN-06 2FSQ . COMPND 2 MOLECULE: ATU0111 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS STR.; . AUTHOR Y.KIM,A.JOACHIMIAK,X.XU,H.ZHENG,A.EDWARDS,A.SAVCHENKO,MIDWES . 232 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11562.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 150 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 19.0 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 11 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 0 0 0 1 0 0 1 0 0 0 2 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 . 3 0 1 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 6 A V 0 0 83 0, 0.0 187,-0.0 0, 0.0 189,-0.0 0.000 360.0 360.0 360.0 121.2 26.7 30.3 -19.2 2 7 A S > - 0 0 42 1,-0.1 4,-1.9 187,-0.1 190,-0.0 -0.253 360.0-115.5 -70.3 157.5 26.7 32.4 -16.0 3 8 A K T 4 S+ 0 0 202 1,-0.2 4,-0.5 2,-0.2 -1,-0.1 0.899 117.4 55.6 -54.9 -41.7 29.4 32.0 -13.3 4 9 A D T >4 S+ 0 0 74 1,-0.2 3,-0.8 2,-0.2 4,-0.2 0.894 108.8 43.4 -61.3 -45.3 26.6 30.8 -11.0 5 10 A L G >4 S+ 0 0 1 1,-0.2 3,-1.6 2,-0.1 -1,-0.2 0.841 102.0 68.3 -70.5 -34.2 25.4 27.9 -13.3 6 11 A D G >< S+ 0 0 73 -4,-1.9 3,-1.5 1,-0.3 -1,-0.2 0.631 79.1 82.1 -62.4 -15.9 28.9 26.8 -14.1 7 12 A Y G < S+ 0 0 134 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.1 0.849 88.6 53.3 -54.9 -35.0 29.4 25.6 -10.5 8 13 A I G < S+ 0 0 9 -3,-1.6 175,-2.5 -4,-0.2 -1,-0.2 0.398 82.3 120.6 -89.3 4.9 27.5 22.4 -11.3 9 14 A S B X S-a 183 0A 2 -3,-1.5 3,-1.9 173,-0.2 175,-0.2 -0.410 72.4-125.6 -67.7 144.5 29.8 21.5 -14.2 10 15 A T G > S+ 0 0 50 173,-2.2 3,-1.4 1,-0.3 -1,-0.1 0.833 111.0 65.8 -55.2 -33.3 31.7 18.2 -14.1 11 16 A A G 3 S+ 0 0 88 172,-0.3 -1,-0.3 1,-0.3 -3,-0.1 0.620 94.1 58.6 -65.7 -15.2 34.8 20.3 -14.7 12 17 A N G < S+ 0 0 86 -3,-1.9 2,-0.3 -6,-0.2 -1,-0.3 0.289 102.1 62.3 -96.7 8.7 34.4 22.1 -11.3 13 18 A H < - 0 0 49 -3,-1.4 -5,-0.0 -4,-0.1 169,-0.0 -0.984 43.6-173.2-146.6 145.7 34.6 18.9 -9.2 14 19 A D S S+ 0 0 149 -2,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.142 84.7 32.9-119.4 13.6 36.9 15.9 -8.2 15 20 A Q S S- 0 0 120 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.963 92.9 -88.9-161.8 157.1 34.3 14.0 -6.1 16 21 A P - 0 0 79 0, 0.0 165,-0.1 0, 0.0 -2,-0.1 -0.189 68.5 -62.2 -66.7 168.6 30.5 13.5 -6.3 17 22 A P > - 0 0 12 0, 0.0 3,-1.6 0, 0.0 -4,-0.0 -0.246 49.4-128.1 -49.5 136.3 28.0 15.9 -4.6 18 23 A R T 3 S+ 0 0 207 1,-0.3 5,-0.1 -3,-0.1 4,-0.1 0.735 106.2 59.4 -63.6 -23.9 28.8 15.7 -0.8 19 24 A H T >>>S+ 0 0 61 160,-0.2 4,-2.1 3,-0.1 3,-2.0 0.637 77.6 114.3 -78.6 -15.0 25.1 15.0 -0.0 20 25 A L B <45S+b 24 0B 57 -3,-1.6 5,-0.2 1,-0.3 6,-0.1 -0.404 85.1 14.2 -64.0 126.3 25.1 11.8 -2.2 21 26 A G T 345S+ 0 0 54 3,-3.1 -1,-0.3 -2,-0.2 4,-0.1 0.174 130.5 53.2 94.6 -17.7 24.5 8.8 0.0 22 27 A S T <45S+ 0 0 64 -3,-2.0 -2,-0.2 2,-0.3 9,-0.1 0.744 120.0 20.5-108.1 -62.8 23.4 10.9 3.0 23 28 A R T <5S+ 0 0 35 -4,-2.1 8,-2.4 1,-0.2 2,-0.3 0.819 134.9 0.8 -81.2 -34.4 20.6 13.2 1.9 24 29 A F B - 0 0 23 4,-2.6 3,-2.2 -2,-0.3 -3,-0.1 -0.299 44.1 -94.6 -80.4 172.9 20.4 8.0 -3.1 26 31 A A T 3 S+ 0 0 63 1,-0.3 -1,-0.1 2,-0.1 154,-0.1 0.696 127.5 56.4 -61.2 -20.7 21.9 7.8 -6.6 27 32 A E T 3 S- 0 0 159 2,-0.1 -1,-0.3 153,-0.0 41,-0.1 0.286 122.9-106.6 -94.6 7.9 18.4 7.5 -7.9 28 33 A G S < S+ 0 0 9 -3,-2.2 2,-0.4 1,-0.3 -2,-0.1 0.716 70.4 144.1 76.3 21.9 17.4 10.8 -6.3 29 34 A E - 0 0 133 40,-0.1 -4,-2.6 1,-0.0 -1,-0.3 -0.816 52.7-115.0 -93.5 133.2 15.3 9.3 -3.5 30 35 A F B -C 24 0B 21 -2,-0.4 -6,-0.3 -6,-0.2 -7,-0.1 -0.441 30.4-149.3 -72.3 138.7 15.6 11.2 -0.1 31 36 A L - 0 0 52 -8,-2.4 191,-0.3 -9,-0.1 2,-0.2 -0.637 31.9 -78.1-108.5 160.3 17.1 9.3 2.8 32 37 A P + 0 0 98 0, 0.0 189,-0.2 0, 0.0 -1,-0.1 -0.407 61.3 146.7 -60.9 124.8 16.5 9.5 6.6 33 38 A E - 0 0 6 187,-3.2 54,-0.1 -2,-0.2 186,-0.0 -0.478 31.2-160.7-157.9 68.0 18.4 12.6 7.9 34 39 A P + 0 0 44 0, 0.0 52,-2.9 0, 0.0 2,-0.3 -0.259 27.6 123.2 -72.2 150.4 16.3 14.0 10.8 35 40 A G E -DE 85 219C 0 184,-2.2 184,-2.3 50,-0.3 2,-0.3 -0.910 45.9-107.6-169.4-166.1 16.6 17.5 12.2 36 41 A N E + E 0 218C 2 48,-2.4 47,-1.0 -2,-0.3 2,-0.3 -0.905 32.5 161.3-143.1 168.2 14.8 20.7 13.0 37 42 A T E -DE 82 217C 8 180,-2.1 180,-3.5 -2,-0.3 2,-0.5 -0.977 39.3-107.7-174.0 161.8 14.8 24.1 11.4 38 43 A V E +DE 81 216C 0 43,-2.5 42,-3.1 -2,-0.3 43,-1.8 -0.974 50.6 158.3-110.6 121.4 12.9 27.5 11.1 39 44 A V E -DE 79 215C 0 176,-2.4 176,-2.1 -2,-0.5 2,-0.5 -0.924 41.1-132.1-138.3 161.9 11.3 27.8 7.6 40 45 A C E -D 78 0C 2 38,-2.5 38,-2.6 -2,-0.3 2,-0.1 -0.975 27.6-154.5-111.4 113.3 8.6 29.7 5.7 41 46 A H E -D 77 0C 5 -2,-0.5 171,-3.1 172,-0.4 36,-0.2 -0.386 24.4-102.6 -74.7 162.2 6.5 27.3 3.6 42 47 A L B -J 211 0D 5 34,-1.4 2,-0.7 169,-0.2 169,-0.2 -0.391 39.2-102.3 -70.9 162.3 4.6 28.6 0.5 43 48 A V > - 0 0 45 167,-0.6 3,-2.1 -2,-0.1 6,-0.4 -0.838 41.6-119.6 -89.1 113.9 0.9 29.2 0.8 44 49 A E T 3 S+ 0 0 145 -2,-0.7 3,-0.1 1,-0.3 4,-0.0 -0.307 94.2 11.6 -59.4 134.1 -0.8 26.2 -0.9 45 50 A G T 3 S+ 0 0 62 1,-0.3 -1,-0.3 2,-0.1 2,-0.0 0.327 95.7 134.2 82.8 -6.2 -3.0 27.2 -3.8 46 51 A S S <> S- 0 0 16 -3,-2.1 4,-2.2 1,-0.1 -1,-0.3 -0.287 70.5-114.7 -73.6 161.4 -1.6 30.8 -4.0 47 52 A Q H > S+ 0 0 165 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.822 118.0 58.5 -65.8 -29.2 -0.5 32.4 -7.3 48 53 A T H > S+ 0 0 10 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.949 106.6 46.8 -61.8 -48.2 3.0 32.4 -5.9 49 54 A E H > S+ 0 0 23 -6,-0.4 4,-2.7 1,-0.2 -2,-0.2 0.937 111.7 50.2 -62.3 -45.5 3.0 28.6 -5.5 50 55 A S H X S+ 0 0 66 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.895 110.2 50.9 -59.0 -40.2 1.5 28.1 -9.0 51 56 A A H X S+ 0 0 11 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.928 112.2 46.2 -62.1 -44.0 4.2 30.3 -10.5 52 57 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.901 109.5 54.5 -68.5 -37.6 7.0 28.4 -8.7 53 58 A V H X S+ 0 0 48 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.874 106.6 52.5 -64.5 -36.5 5.4 25.1 -9.7 54 59 A S H X S+ 0 0 62 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.906 109.8 47.8 -63.2 -42.3 5.5 26.2 -13.4 55 60 A T H X S+ 0 0 3 -4,-1.9 4,-1.6 2,-0.2 3,-0.2 0.947 109.4 53.8 -60.4 -48.9 9.2 27.1 -13.1 56 61 A R H X S+ 0 0 37 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.881 106.5 53.4 -55.7 -36.1 9.8 23.7 -11.4 57 62 A Q H X S+ 0 0 96 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.883 102.5 55.8 -67.4 -39.1 8.1 22.0 -14.5 58 63 A R H < S+ 0 0 80 -4,-1.8 4,-0.4 -3,-0.2 -1,-0.2 0.856 109.6 48.8 -59.5 -34.3 10.4 23.8 -16.9 59 64 A F H >< S+ 0 0 0 -4,-1.6 3,-1.5 1,-0.2 -2,-0.2 0.929 109.0 50.7 -70.7 -45.5 13.2 22.2 -15.0 60 65 A L H 3< S+ 0 0 62 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.822 100.7 66.2 -60.3 -29.0 11.6 18.7 -15.1 61 66 A D T 3< S+ 0 0 97 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.731 84.8 92.0 -63.4 -23.7 11.2 19.2 -18.9 62 67 A X S X S- 0 0 12 -3,-1.5 3,-1.8 -4,-0.4 4,-0.2 -0.486 81.3-130.9 -77.6 143.3 15.0 19.1 -19.3 63 68 A P G > S+ 0 0 86 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.872 107.6 63.1 -58.7 -34.0 16.7 15.7 -19.9 64 69 A E G > S+ 0 0 22 1,-0.3 3,-2.3 2,-0.2 -4,-0.1 0.514 74.2 91.6 -73.2 -1.6 19.2 16.6 -17.1 65 70 A A G X S+ 0 0 12 -3,-1.8 3,-1.8 1,-0.3 -1,-0.3 0.804 74.4 70.5 -56.6 -26.3 16.3 16.5 -14.6 66 71 A S G < S+ 0 0 105 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.658 94.9 52.8 -64.1 -16.2 17.3 12.9 -14.3 67 72 A Q G < S+ 0 0 41 -3,-2.3 113,-2.9 -4,-0.1 114,-1.4 0.216 101.0 77.6-101.6 9.5 20.4 14.1 -12.5 68 73 A L E < S-K 179 0E 11 -3,-1.8 2,-0.7 111,-0.2 111,-0.2 -0.905 70.3-141.2-122.5 145.8 18.4 16.2 -10.0 69 74 A A E -K 178 0E 2 109,-2.6 109,-1.7 -2,-0.3 2,-0.3 -0.925 23.9-155.5-108.5 104.6 16.4 15.1 -6.9 70 75 A F E -K 177 0E 35 -2,-0.7 107,-0.2 107,-0.2 3,-0.1 -0.651 6.7-137.7 -84.4 137.6 13.3 17.2 -6.8 71 76 A T - 0 0 7 105,-1.3 152,-0.1 -2,-0.3 5,-0.1 -0.495 37.2 -83.3 -85.6 159.9 11.6 17.7 -3.4 72 77 A P > - 0 0 40 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.303 31.9-122.9 -63.9 147.9 7.7 17.5 -3.1 73 78 A V G > S+ 0 0 44 1,-0.3 3,-1.7 2,-0.2 -2,-0.1 0.910 113.3 57.7 -55.0 -40.3 5.7 20.6 -4.0 74 79 A S G 3 S+ 0 0 63 1,-0.3 -1,-0.3 -33,-0.1 -30,-0.1 0.610 101.4 57.8 -69.9 -10.6 4.2 20.5 -0.5 75 80 A S G < S+ 0 0 2 -3,-1.7 -1,-0.3 149,-0.1 -2,-0.2 0.474 74.3 128.6 -91.2 -8.1 7.7 20.7 1.0 76 81 A L < + 0 0 2 -3,-1.7 -34,-1.4 -4,-0.4 2,-0.3 -0.252 31.4 141.8 -60.8 133.6 8.7 24.0 -0.7 77 82 A H E -D 41 0C 24 98,-0.3 98,-0.7 -36,-0.2 2,-0.6 -0.988 51.4-120.7-161.5 158.6 10.0 26.5 1.7 78 83 A X E -DF 40 174C 0 -38,-2.6 -38,-2.5 -2,-0.3 2,-0.2 -0.969 34.8-132.5-104.9 120.4 12.5 29.2 2.4 79 84 A T E -D 39 0C 17 94,-0.7 94,-0.3 -2,-0.6 -40,-0.3 -0.490 22.8-177.3 -68.2 134.5 14.7 28.4 5.4 80 85 A V E S- 0 0 0 -42,-3.1 2,-0.3 1,-0.3 -41,-0.2 0.777 74.9 -1.5 -97.1 -43.6 15.0 31.4 7.8 81 86 A F E S-D 38 0C 5 -43,-1.8 -43,-2.5 75,-0.1 -1,-0.3 -0.923 75.2-126.2-151.8 120.1 17.4 29.7 10.2 82 87 A Q E -D 37 0C 70 -2,-0.3 -45,-0.2 -45,-0.2 3,-0.1 -0.487 23.6-162.2 -66.3 135.3 18.8 26.2 10.1 83 88 A G E - 0 0 5 -47,-1.0 -46,-0.2 1,-0.2 2,-0.1 0.057 40.8 -57.3 -89.9-152.0 18.3 24.1 13.2 84 89 A V E - 0 0 1 20,-0.1 -48,-2.4 -2,-0.0 2,-0.3 -0.468 48.3-161.5 -90.6 164.3 20.3 20.9 14.0 85 90 A I E > -D 35 0C 15 3,-0.4 3,-2.1 8,-0.3 -50,-0.3 -0.997 28.6-122.6-148.6 147.1 20.6 17.8 11.8 86 91 A E T 3 S+ 0 0 83 -52,-2.9 3,-0.4 -2,-0.3 -51,-0.1 0.785 110.2 57.0 -55.8 -33.9 21.6 14.2 12.4 87 92 A S T 3 S+ 0 0 65 1,-0.2 -1,-0.3 -53,-0.2 -52,-0.1 0.390 106.6 49.0 -81.7 -0.3 24.3 14.4 9.8 88 93 A R < + 0 0 89 -3,-2.1 2,-1.7 5,-0.1 -3,-0.4 -0.480 57.9 161.6-142.4 68.2 26.1 17.4 11.3 89 94 A R + 0 0 60 -3,-0.4 2,-0.3 -5,-0.1 5,-0.1 -0.560 46.9 98.2 -90.0 72.5 26.7 16.7 15.0 90 95 A A S > S- 0 0 39 -2,-1.7 3,-2.0 3,-0.0 6,-0.0 -0.991 71.0 -71.5-157.0 147.0 29.5 19.3 15.4 91 96 A L T 3 S+ 0 0 84 1,-0.3 73,-0.0 -2,-0.3 71,-0.0 -0.555 110.1 30.1 -70.9 147.2 30.1 22.9 16.6 92 97 A P T 3 S+ 0 0 57 0, 0.0 -1,-0.3 0, 0.0 71,-0.2 -0.801 121.6 55.7 -93.0 31.1 29.4 25.5 15.3 93 98 A Y S < S+ 0 0 61 -3,-2.0 -8,-0.3 69,-0.1 -2,-0.2 0.171 109.2 51.3-104.0 14.8 26.3 23.8 13.9 94 99 A W S S- 0 0 1 69,-0.1 2,-0.3 67,-0.1 69,-0.1 -0.976 96.2 -96.0-149.4 147.1 25.1 22.6 17.3 95 100 A P > - 0 0 0 0, 0.0 3,-1.9 0, 0.0 67,-0.2 -0.578 27.0-140.4 -71.1 130.2 24.5 24.4 20.6 96 101 A Q T 3 S+ 0 0 162 65,-0.7 4,-0.1 -2,-0.3 66,-0.1 0.751 98.8 67.6 -62.6 -21.2 27.6 24.1 22.9 97 102 A T T 3 S+ 0 0 100 64,-0.2 -1,-0.3 2,-0.1 64,-0.0 0.630 94.7 69.1 -71.9 -12.0 25.3 23.6 25.9 98 103 A L S < S- 0 0 29 -3,-1.9 4,-0.0 4,-0.0 9,-0.0 -0.900 91.3-106.8-113.9 137.2 24.1 20.2 24.5 99 104 A P > - 0 0 76 0, 0.0 3,-1.8 0, 0.0 -2,-0.1 -0.245 29.0-124.8 -53.2 142.4 26.0 16.9 24.1 100 105 A L T 3 S+ 0 0 81 1,-0.3 -4,-0.0 -4,-0.1 -2,-0.0 0.706 110.4 54.1 -65.8 -19.7 26.8 16.2 20.5 101 106 A D T 3 S+ 0 0 130 2,-0.0 -1,-0.3 3,-0.0 3,-0.1 0.223 75.4 134.4-100.5 14.1 25.1 12.8 20.8 102 107 A T < - 0 0 19 -3,-1.8 5,-0.1 1,-0.1 -4,-0.0 -0.412 67.4-104.0 -60.6 130.9 21.8 14.2 22.1 103 108 A P >> - 0 0 87 0, 0.0 4,-1.7 0, 0.0 3,-0.8 -0.307 26.4-120.1 -55.3 140.3 18.9 12.6 20.3 104 109 A I H 3> S+ 0 0 14 1,-0.2 4,-2.4 2,-0.2 3,-0.2 0.901 112.7 56.8 -50.3 -42.6 17.4 14.9 17.7 105 110 A D H 3> S+ 0 0 108 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.845 104.6 51.5 -62.0 -35.0 14.0 14.8 19.4 106 111 A A H <> S+ 0 0 45 -3,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.847 108.6 50.9 -69.1 -33.7 15.5 16.0 22.7 107 112 A V H X S+ 0 0 0 -4,-1.7 4,-2.5 -3,-0.2 -2,-0.2 0.931 107.9 53.6 -66.2 -42.5 17.1 18.9 20.9 108 113 A T H X S+ 0 0 3 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.921 109.3 48.6 -55.6 -44.3 13.6 19.7 19.4 109 114 A D H X S+ 0 0 102 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.904 109.0 52.5 -63.1 -43.8 12.1 19.8 22.9 110 115 A Y H X S+ 0 0 66 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.926 115.6 41.6 -57.5 -44.6 14.9 22.1 24.3 111 116 A Y H X S+ 0 0 0 -4,-2.5 4,-3.4 2,-0.2 -2,-0.2 0.885 108.0 57.3 -72.9 -42.1 14.2 24.5 21.4 112 117 A R H < S+ 0 0 109 -4,-2.9 4,-0.2 -5,-0.2 -1,-0.2 0.903 113.2 44.1 -53.7 -40.3 10.4 24.3 21.6 113 118 A D H >< S+ 0 0 118 -4,-2.0 3,-1.2 -5,-0.2 4,-0.2 0.931 114.8 46.5 -68.4 -48.8 10.8 25.4 25.2 114 119 A R H >< S+ 0 0 89 -4,-2.2 3,-1.1 1,-0.3 -2,-0.2 0.877 109.4 55.5 -62.9 -37.7 13.3 28.1 24.5 115 120 A L G >< S+ 0 0 4 -4,-3.4 3,-1.4 1,-0.2 -1,-0.3 0.472 81.3 88.9 -78.1 -2.1 11.3 29.5 21.6 116 121 A S G < S+ 0 0 90 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.697 93.6 43.6 -66.1 -20.8 8.2 29.9 23.7 117 122 A T G < S+ 0 0 110 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.1 0.152 79.4 141.6-109.3 16.0 9.5 33.4 24.6 118 123 A F < - 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