==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE(CARBON-CARBON) 11-OCT-91 2RUS . COMPND 2 MOLECULE: RUBISCO (RIBULOSE-1,5-BISPHOSPHATE . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOSPIRILLUM RUBRUM; . AUTHOR T.LUNDQVIST,G.SCHNEIDER . 881 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31241.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 601 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 82 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 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 . 4 0.5 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 . 3 0.3 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 . 52 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 94 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 269 30.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 1.9 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 7 1 2 6 6 1 3 3 2 0 0 2 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 3 7 8 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 2 0 2 0 3 1 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 . 2 0 0 0 2 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 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 2 A D 0 0 118 0, 0.0 2,-0.3 0, 0.0 42,-0.3 0.000 360.0 360.0 360.0 -38.9 39.8 -13.4 3.1 2 3 A Q > - 0 0 71 40,-0.1 4,-1.0 41,-0.1 44,-0.1 -0.162 360.0-177.9 -63.7 123.1 40.1 -17.2 3.5 3 4 A S T >4 S+ 0 0 43 -2,-0.3 2,-4.2 2,-0.2 3,-0.6 0.115 71.6 61.2 -82.4-153.6 37.1 -18.7 5.2 4 5 A S T 34 S+ 0 0 119 1,-0.3 -1,-0.1 2,-0.1 3,-0.1 -0.135 112.9 41.7 56.9 -55.4 37.8 -22.5 5.5 5 6 A R T 34 S+ 0 0 79 -2,-4.2 -1,-0.3 1,-0.1 -2,-0.2 0.888 122.7 34.5 -84.9 -48.8 40.8 -21.7 7.8 6 7 A Y S << S+ 0 0 0 -4,-1.0 56,-1.2 -3,-0.6 2,-0.4 -0.115 106.3 71.3-102.0 26.6 39.4 -18.9 9.9 7 8 A V B +a 62 0A 27 54,-0.2 56,-0.2 -3,-0.1 54,-0.1 -0.961 39.0 163.0-145.0 128.7 35.7 -19.9 10.3 8 9 A N > + 0 0 72 54,-3.3 3,-1.7 -2,-0.4 2,-0.6 -0.584 6.9 176.3-152.6 69.6 34.5 -22.8 12.4 9 10 A L T 3 S+ 0 0 77 1,-0.3 55,-0.2 55,-0.0 3,-0.1 -0.783 74.2 63.1 -68.0 113.6 30.8 -22.1 12.9 10 11 A A T 3 + 0 0 88 53,-0.7 2,-0.5 -2,-0.6 -1,-0.3 0.112 69.7 121.0 140.2 -11.7 30.3 -25.5 14.7 11 12 A L < - 0 0 47 -3,-1.7 -1,-0.6 52,-0.4 2,-0.4 -0.787 65.6-130.5 -82.6 120.9 32.5 -24.6 17.7 12 13 A K >> - 0 0 128 -2,-0.5 4,-1.5 1,-0.1 3,-0.7 -0.650 8.7-141.9 -75.1 129.0 30.4 -24.8 20.8 13 14 A E H 3> S+ 0 0 34 -2,-0.4 4,-1.9 1,-0.2 -1,-0.1 0.776 100.9 57.9 -60.0 -32.9 31.0 -21.5 22.7 14 15 A E H 3> S+ 0 0 123 2,-0.2 4,-3.3 1,-0.2 -1,-0.2 0.769 102.0 53.1 -70.0 -31.4 30.9 -23.5 26.0 15 16 A D H <> S+ 0 0 83 -3,-0.7 4,-3.4 2,-0.2 -2,-0.2 0.892 109.1 50.9 -67.9 -43.1 33.7 -25.7 24.8 16 17 A L H <>S+ 0 0 12 -4,-1.5 5,-0.6 2,-0.2 6,-0.3 0.873 116.0 39.8 -59.6 -49.0 35.8 -22.6 24.2 17 18 A I H <5S+ 0 0 45 -4,-1.9 3,-0.3 1,-0.2 -2,-0.2 0.920 113.1 57.3 -68.2 -48.3 35.0 -21.2 27.7 18 19 A A H <5S+ 0 0 79 -4,-3.3 2,-1.4 1,-0.3 -2,-0.2 0.932 109.0 44.7 -48.5 -57.4 35.5 -24.7 29.1 19 20 A G T <5S- 0 0 41 -4,-3.4 2,-2.3 -5,-0.1 -1,-0.3 -0.695 92.7-150.1 -90.7 84.2 39.0 -25.0 27.7 20 21 A G T 5 + 0 0 35 -2,-1.4 102,-0.4 -3,-0.3 103,-0.2 -0.297 64.0 103.9 -60.2 72.7 40.2 -21.5 28.8 21 22 A E < + 0 0 126 -2,-2.3 57,-2.0 -5,-0.6 2,-0.4 0.022 64.4 73.1-136.4 17.9 42.7 -20.7 26.0 22 23 A H E -B 77 0A 29 -6,-0.3 2,-0.3 55,-0.3 -1,-0.1 -0.995 66.1-142.7-142.1 132.4 40.7 -18.3 23.8 23 24 A V E -B 76 0A 0 53,-2.7 53,-2.8 -2,-0.4 2,-0.4 -0.685 28.6-143.6 -85.3 140.2 39.8 -14.7 24.4 24 25 A L E -BC 75 118A 0 94,-2.2 94,-2.5 -2,-0.3 2,-0.4 -0.940 16.7-171.3-121.3 143.0 36.2 -14.2 23.0 25 26 A C E -BC 74 117A 0 49,-2.1 49,-2.1 -2,-0.4 2,-0.5 -0.998 7.7-161.9-136.0 136.1 35.0 -11.1 21.2 26 27 A A E +BC 73 116A 0 90,-2.0 89,-2.9 -2,-0.4 90,-1.1 -0.990 18.5 176.6-123.2 117.3 31.5 -10.2 20.1 27 28 A Y E -BC 72 114A 0 45,-3.1 45,-2.2 -2,-0.5 2,-0.7 -0.811 35.8-133.3-120.4 163.6 31.1 -7.5 17.6 28 29 A I E +BC 71 113A 17 85,-2.1 85,-1.0 -2,-0.3 2,-0.4 -0.953 45.0 172.6-112.7 95.2 28.3 -5.9 15.6 29 30 A M E - C 0 112A 0 41,-1.6 83,-0.2 -2,-0.7 263,-0.0 -0.897 22.1-161.8-114.5 142.5 29.9 -5.9 12.1 30 31 A K E - C 0 111A 49 81,-2.0 80,-2.8 -2,-0.4 81,-0.9 -0.963 22.7-126.0-124.1 118.9 28.3 -5.0 8.8 31 32 A P E - C 0 109A 19 0, 0.0 78,-0.3 0, 0.0 3,-0.1 -0.309 33.7-109.0 -59.3 141.7 30.0 -6.1 5.5 32 33 A K - 0 0 79 76,-3.5 2,-0.1 1,-0.1 77,-0.1 0.862 64.7 -69.1 -37.9 -81.4 30.6 -3.1 3.2 33 34 A A S S+ 0 0 75 75,-0.1 -1,-0.1 77,-0.0 3,-0.1 -0.372 117.6 20.7 174.1 98.3 28.0 -3.6 0.4 34 35 A G S S+ 0 0 87 1,-0.6 2,-0.1 -2,-0.1 -2,-0.1 0.031 98.7 109.1 119.1 -19.5 28.2 -6.5 -2.1 35 36 A Y S S- 0 0 129 73,-0.1 -1,-0.6 1,-0.1 2,-0.4 -0.392 74.9-101.7 -82.8 161.6 30.5 -8.6 0.1 36 37 A G > - 0 0 34 1,-0.1 4,-2.7 -2,-0.1 5,-0.3 -0.765 17.9-136.9 -96.3 133.6 29.5 -11.8 1.9 37 38 A Y H > S+ 0 0 7 -2,-0.4 4,-0.9 1,-0.2 -1,-0.1 0.912 105.6 36.5 -52.3 -54.1 28.8 -11.7 5.6 38 39 A V H > S+ 0 0 62 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.761 115.4 55.6 -76.1 -22.0 30.8 -14.9 6.5 39 40 A A H > S+ 0 0 37 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.900 110.0 46.2 -70.4 -45.1 33.5 -14.1 3.9 40 41 A T H X S+ 0 0 2 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.678 109.8 53.7 -70.1 -26.4 34.1 -10.7 5.6 41 42 A A H X S+ 0 0 0 -4,-0.9 4,-1.9 -5,-0.3 -1,-0.2 0.736 107.1 51.2 -83.0 -28.3 34.1 -12.3 9.0 42 43 A A H X S+ 0 0 0 -4,-1.0 4,-1.8 -41,-0.2 -2,-0.2 0.840 113.1 47.2 -73.8 -39.6 36.8 -14.7 7.9 43 44 A H H X S+ 0 0 30 -4,-1.6 4,-2.2 -42,-0.3 -2,-0.2 0.811 110.1 49.7 -71.3 -39.5 38.7 -11.7 6.6 44 45 A F H X S+ 0 0 2 -4,-1.4 4,-1.1 2,-0.2 -2,-0.2 0.948 111.6 50.5 -70.6 -44.8 38.2 -9.7 9.8 45 46 A A H >< S+ 0 0 0 -4,-1.9 3,-0.6 1,-0.2 15,-0.3 0.931 111.5 50.4 -55.3 -45.1 39.4 -12.7 11.8 46 47 A A H ><>S+ 0 0 2 -4,-1.8 5,-2.1 1,-0.2 3,-1.1 0.893 108.3 48.9 -57.2 -48.1 42.4 -12.9 9.4 47 48 A E H 3<5S+ 0 0 47 -4,-2.2 55,-0.2 1,-0.3 -1,-0.2 0.598 112.0 50.8 -74.1 -14.4 43.4 -9.3 9.8 48 49 A S T <<5S+ 0 0 4 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.344 122.8 21.1-102.4 -1.2 43.2 -9.5 13.6 49 50 A S T < 5S- 0 0 0 -3,-1.1 -3,-0.1 -4,-0.3 3,-0.1 0.182 129.2 -18.3-128.0-111.6 45.4 -12.6 13.9 50 51 A T T 5 - 0 0 0 1,-0.2 2,-2.1 548,-0.2 548,-1.9 0.582 63.0-164.3 -84.1 -16.6 48.0 -14.2 11.5 51 52 A G < - 0 0 7 -5,-2.1 2,-0.9 -6,-0.2 -1,-0.2 -0.431 11.0-171.7 66.1 -82.2 46.9 -12.4 8.3 52 53 A T 0 0 28 -2,-2.1 -1,-0.1 1,-0.2 -5,-0.0 -0.804 360.0 360.0 99.1 -93.4 48.8 -14.8 6.0 53 54 A N 0 0 142 -2,-0.9 -1,-0.2 543,-0.1 -2,-0.1 0.401 360.0 360.0 111.2 360.0 48.6 -13.3 2.5 54 ! 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 55 64 A T 0 0 134 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 134.0 50.8 -22.8 11.2 56 65 A R + 0 0 185 1,-0.1 544,-0.0 2,-0.1 0, 0.0 -0.638 360.0 89.7-144.9 48.8 47.3 -22.6 12.4 57 66 A G S S+ 0 0 57 -2,-0.2 -1,-0.1 543,-0.1 543,-0.0 0.327 93.6 55.5-119.9 -15.0 47.0 -23.2 16.2 58 67 A V S S+ 0 0 16 -3,-0.1 2,-0.3 21,-0.1 -2,-0.1 0.274 85.7 120.6 -98.7 2.1 47.5 -19.4 16.5 59 68 A D - 0 0 6 -10,-0.1 2,-0.6 -54,-0.1 -13,-0.1 -0.533 65.0-124.1 -84.1 145.1 44.5 -18.5 14.2 60 69 A A - 0 0 0 -15,-0.3 2,-0.4 -2,-0.3 16,-0.2 -0.686 31.8-157.4 -83.2 111.7 41.5 -16.3 15.1 61 70 A L E - D 0 75A 38 14,-1.9 14,-3.5 -2,-0.6 2,-0.6 -0.841 15.0-136.7-104.8 138.0 38.4 -18.5 14.3 62 71 A V E +aD 7 74A 0 -56,-1.2 -54,-3.3 -2,-0.4 12,-0.2 -0.876 30.2 172.4 -86.7 119.6 35.0 -17.0 13.7 63 72 A Y E + 0 0 7 10,-2.1 -53,-0.7 -2,-0.6 2,-0.4 0.576 58.6 30.0-111.6 -19.9 32.8 -19.3 15.7 64 73 A E E + D 0 73A 77 9,-1.3 9,-2.4 -55,-0.2 2,-0.3 -0.999 60.0 174.9-143.9 142.2 29.4 -17.6 15.5 65 74 A V E + D 0 72A 39 -2,-0.4 7,-0.2 7,-0.2 2,-0.2 -0.946 9.3 178.9-140.9 156.3 27.7 -15.5 12.9 66 75 A D E > - D 0 71A 62 5,-0.7 5,-2.3 -2,-0.3 4,-0.5 -0.631 6.4-171.0-165.8 97.6 24.3 -13.9 12.5 67 76 A E T 5S+ 0 0 131 3,-0.2 3,-0.2 2,-0.2 -1,-0.1 0.789 84.4 53.9 -63.4 -38.2 23.6 -11.8 9.5 68 77 A A T 5S+ 0 0 96 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.985 119.2 34.8 -61.5 -57.2 20.2 -10.4 10.5 69 78 A R T 5S- 0 0 139 2,-0.1 -1,-0.2 1,-0.1 -2,-0.2 0.402 106.0-126.6 -73.5 -5.7 21.5 -9.2 13.8 70 79 A E T 5 + 0 0 45 -4,-0.5 -41,-1.6 -3,-0.2 2,-0.7 0.797 54.1 159.1 58.7 34.3 25.0 -8.3 12.4 71 80 A L E < +BD 28 66A 9 -5,-2.3 -5,-0.7 -43,-0.2 2,-0.5 -0.799 16.7 176.0 -99.4 114.4 26.6 -10.4 15.1 72 81 A T E -BD 27 65A 1 -45,-2.2 -45,-3.1 -2,-0.7 2,-0.5 -0.954 8.0-167.8-117.7 125.4 30.1 -11.7 14.6 73 82 A K E -BD 26 64A 11 -9,-2.4 -10,-2.1 -2,-0.5 -9,-1.3 -0.960 4.3-168.9-117.9 126.0 32.0 -13.6 17.3 74 83 A I E -BD 25 62A 0 -49,-2.1 -49,-2.1 -2,-0.5 2,-0.5 -0.874 13.3-147.0-114.2 145.8 35.7 -14.4 17.1 75 84 A A E -BD 24 61A 0 -14,-3.5 -14,-1.9 -2,-0.3 -51,-0.2 -0.972 14.9-162.1-114.1 120.8 37.9 -16.7 19.2 76 85 A Y E -B 23 0A 0 -53,-2.8 -53,-2.7 -2,-0.5 -16,-0.1 -0.948 20.1-125.6-108.3 117.7 41.4 -15.5 19.7 77 86 A P E > -B 22 0A 7 0, 0.0 3,-1.0 0, 0.0 4,-0.3 -0.220 20.6-127.4 -55.3 146.2 44.0 -18.0 20.9 78 87 A V G > S+ 0 0 21 -57,-2.0 3,-0.9 1,-0.2 -56,-0.1 0.696 102.1 73.8 -69.7 -22.1 45.7 -16.7 24.1 79 88 A A G 3 S+ 0 0 31 -58,-0.3 552,-0.3 1,-0.2 -1,-0.2 0.742 85.4 66.6 -68.4 -19.5 49.2 -17.2 22.5 80 89 A L G < S+ 0 0 0 -3,-1.0 -1,-0.2 549,-0.1 -2,-0.2 0.753 79.3 96.3 -68.7 -31.8 48.6 -14.1 20.3 81 90 A F S < S- 0 0 0 -3,-0.9 2,-0.2 -4,-0.3 546,-0.0 -0.476 76.6-122.8 -69.5 141.8 48.5 -11.6 23.2 82 91 A D - 0 0 5 9,-0.2 9,-0.7 547,-0.1 2,-0.3 -0.548 27.1-164.1 -81.9 146.2 51.8 -9.8 24.0 83 92 A R B -F 90 0B 46 545,-0.3 545,-0.3 -2,-0.2 7,-0.2 -0.866 29.1 -90.0-131.1 157.7 53.3 -10.0 27.5 84 93 A N > - 0 0 6 5,-2.9 4,-0.8 -2,-0.3 580,-0.0 -0.490 17.5-154.5 -71.4 137.4 56.0 -8.0 29.4 85 94 A I T 4 S+ 0 0 21 -2,-0.2 -1,-0.1 2,-0.1 584,-0.0 0.700 96.8 57.8 -76.4 -25.7 59.6 -9.3 29.0 86 95 A T T 4 S- 0 0 70 3,-0.1 -1,-0.1 1,-0.1 583,-0.0 0.989 131.8 -7.6 -67.4 -72.7 60.0 -7.5 32.4 87 96 A D T 4 S- 0 0 58 2,-0.1 -2,-0.1 0, 0.0 -1,-0.1 0.295 90.7-115.3-122.7 4.1 57.5 -9.2 34.8 88 97 A G < + 0 0 35 -4,-0.8 2,-0.1 1,-0.2 -3,-0.1 0.465 65.7 142.2 72.4 11.3 55.5 -11.4 32.4 89 98 A K - 0 0 75 1,-0.1 -5,-2.9 -6,-0.1 -1,-0.2 -0.380 51.8-108.4 -78.2 155.1 52.2 -9.6 32.8 90 99 A A B -F 83 0B 7 36,-0.7 2,-0.3 -7,-0.2 -7,-0.2 -0.119 27.5-139.4 -74.9 173.1 49.7 -8.9 30.0 91 100 A M > - 0 0 2 -9,-0.7 4,-1.1 1,-0.1 3,-0.3 -0.982 13.6-142.0-139.2 143.4 49.1 -5.5 28.5 92 101 A I H > S+ 0 0 3 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.761 100.2 69.0 -73.0 -32.1 45.9 -3.8 27.5 93 102 A A H > S+ 0 0 3 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.789 100.6 47.0 -54.1 -37.4 47.7 -2.3 24.4 94 103 A S H > S+ 0 0 3 -3,-0.3 4,-3.2 2,-0.2 5,-0.3 0.922 109.3 53.0 -71.9 -50.0 48.1 -5.8 22.9 95 104 A F H X S+ 0 0 1 -4,-1.1 4,-1.7 1,-0.2 -2,-0.2 0.937 112.9 44.4 -55.2 -45.8 44.5 -6.7 23.5 96 105 A L H X S+ 0 0 23 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.938 113.7 50.3 -63.8 -46.2 43.3 -3.5 21.7 97 106 A T H < S+ 0 0 14 -4,-1.8 4,-0.5 2,-0.2 3,-0.3 0.926 115.2 42.0 -59.5 -49.1 45.8 -3.9 18.8 98 107 A L H < S+ 0 0 3 -4,-3.2 3,-0.5 1,-0.2 5,-0.2 0.990 125.1 32.5 -61.1 -65.1 44.8 -7.5 18.2 99 108 A T H < S+ 0 0 0 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.435 136.0 19.7 -78.3 2.1 41.0 -7.1 18.5 100 109 A M S < S+ 0 0 11 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 -0.138 94.5 84.7-167.6 55.1 40.7 -3.5 17.2 101 110 A G S > S+ 0 0 2 -4,-0.5 3,-2.0 -3,-0.5 619,-0.7 0.461 99.7 12.9-118.3 -99.5 43.6 -2.0 15.0 102 111 A N T 3 S+ 0 0 68 1,-0.3 3,-0.2 -5,-0.3 -54,-0.1 0.731 119.9 71.1 -54.9 -28.1 43.9 -2.6 11.2 103 112 A N T 3 S+ 0 0 4 1,-0.3 2,-0.3 -5,-0.2 -1,-0.3 0.456 85.8 69.6 -70.6 -3.8 40.3 -3.8 11.5 104 113 A Q S < S+ 0 0 13 -3,-2.0 618,-0.8 1,-0.2 -1,-0.3 -0.644 107.7 28.8-116.4 61.5 39.2 -0.2 12.2 105 114 A G S S+ 0 0 70 -2,-0.3 2,-0.7 -3,-0.2 -1,-0.2 0.371 81.2 146.4 152.0 29.3 39.8 1.2 8.7 106 115 A M > - 0 0 20 -3,-0.3 3,-1.9 3,-0.0 2,-0.2 -0.795 46.9-140.1 -90.3 115.5 39.3 -1.8 6.5 107 116 A G T 3 S+ 0 0 57 -2,-0.7 3,-0.1 1,-0.2 651,-0.0 -0.679 98.8 52.9 -66.7 133.5 37.8 -1.0 3.1 108 117 A D T 3 S+ 0 0 11 -2,-0.2 -76,-3.5 1,-0.2 2,-0.4 -0.270 99.0 70.0 129.7 -41.3 35.4 -4.1 3.1 109 118 A V E < -C 31 0A 12 -3,-1.9 -1,-0.2 -78,-0.3 3,-0.1 -0.911 58.6-165.2-109.9 134.5 33.8 -3.5 6.5 110 119 A E E S- 0 0 63 -80,-2.8 2,-0.3 1,-0.4 -1,-0.2 0.897 75.2 -18.5 -81.3 -49.9 31.4 -0.6 6.9 111 120 A Y E -C 30 0A 42 -81,-0.9 -81,-2.0 181,-0.0 -1,-0.4 -0.964 54.4-175.9-153.0 162.8 31.5 -0.7 10.7 112 121 A A E +Ce 29 292A 0 179,-0.7 181,-1.0 -2,-0.3 2,-0.4 -0.821 8.6 179.7-166.6 123.6 32.5 -3.0 13.5 113 122 A K E -Ce 28 293A 17 -85,-1.0 -85,-2.1 -2,-0.3 2,-0.4 -1.000 27.4-125.7-136.9 128.9 32.1 -2.3 17.2 114 123 A M E +Ce 27 294A 0 179,-2.4 181,-1.3 -2,-0.4 -87,-0.2 -0.588 25.6 177.6 -78.3 128.8 33.0 -4.6 20.1 115 124 A H E - 0 0 55 -89,-2.9 2,-0.3 1,-0.4 -88,-0.2 0.668 65.1 -9.4-104.6 -24.8 30.1 -5.2 22.5 116 125 A D E -C 26 0A 0 -90,-1.1 -90,-2.0 217,-0.1 -1,-0.4 -0.945 57.3-159.3-169.1 161.0 31.6 -7.6 25.0 117 126 A F E -C 25 0A 1 -2,-0.3 2,-0.4 -92,-0.2 -92,-0.2 -0.963 9.0-144.9-147.4 156.3 34.8 -9.7 25.5 118 127 A Y E -C 24 0A 24 -94,-2.5 -94,-2.2 -2,-0.3 219,-0.1 -0.999 9.3-167.0-128.2 129.5 35.7 -12.8 27.5 119 128 A V - 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