==== 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 TRANSFERASE 30-AUG-07 2R3V . COMPND 2 MOLECULE: MEVALONATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.FU,N.E.VOYNOVA,H.M.MIZIORKO,J.P.KIM . 1557 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 63326.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1144 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 248 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 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 0.3 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 . 106 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 148 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 557 35.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 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 1 1 4 1 4 1 1 5 3 2 4 0 4 4 4 0 3 1 1 0 0 2 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 8 8 8 6 4 3 5 1 0 4 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 0 2 0 0 0 0 0 1 1 0 2 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 L 0 0 170 0, 0.0 2,-0.2 0, 0.0 165,-0.0 0.000 360.0 360.0 360.0 88.4 26.5 -3.5 -39.0 2 3 A S - 0 0 76 1,-0.1 162,-0.1 375,-0.0 163,-0.1 -0.715 360.0-150.8 177.1 133.1 28.7 -0.6 -40.0 3 4 A E S S+ 0 0 157 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 0.843 82.3 84.7 -76.1 -34.7 31.5 0.3 -42.5 4 5 A V S S- 0 0 31 37,-0.1 2,-0.4 1,-0.0 37,-0.2 -0.540 74.1-147.0 -71.7 130.0 33.0 2.9 -40.2 5 6 A L E -A 40 0A 5 35,-3.8 35,-3.5 -2,-0.3 2,-0.5 -0.875 18.1-174.7-109.1 130.9 35.4 1.2 -37.7 6 7 A L E +AB 39 376A 11 370,-0.5 370,-3.1 -2,-0.4 2,-0.3 -0.893 18.5 170.6-122.0 98.7 36.0 2.3 -34.1 7 8 A V E -AB 38 375A 0 31,-2.3 31,-2.5 -2,-0.5 2,-0.3 -0.859 10.6-174.2-114.2 147.1 38.8 0.3 -32.3 8 9 A S E -AB 37 374A 0 366,-1.5 366,-3.3 -2,-0.3 29,-0.2 -0.953 4.7-178.0-136.0 153.2 40.7 0.8 -29.0 9 10 A A E -A 36 0A 0 27,-1.6 27,-2.7 -2,-0.3 2,-0.2 -0.977 24.2-121.7-148.9 145.7 43.6 -0.9 -27.3 10 11 A P E - 0 0 0 0, 0.0 23,-0.2 0, 0.0 25,-0.1 -0.503 19.2-124.7 -89.6 156.0 45.2 -0.3 -23.8 11 12 A G E -A 32 0A 0 21,-1.5 21,-4.5 23,-0.2 2,-0.3 -0.295 31.9-115.2 -87.3-179.3 48.8 0.6 -23.0 12 13 A K E -A 31 0A 19 127,-2.4 2,-0.3 19,-0.3 19,-0.2 -0.885 25.6-179.1-127.3 155.1 50.9 -1.5 -20.6 13 14 A V E -A 30 0A 1 17,-2.3 17,-2.8 -2,-0.3 2,-0.6 -0.982 31.6-115.3-144.5 149.9 52.6 -1.2 -17.2 14 15 A I E -A 29 0A 35 -2,-0.3 15,-0.2 15,-0.2 3,-0.1 -0.786 22.2-174.4 -89.3 119.7 54.8 -3.6 -15.2 15 16 A L E S- 0 0 16 13,-3.2 2,-0.3 -2,-0.6 -1,-0.2 0.879 75.3 -4.9 -79.7 -39.4 53.1 -4.6 -11.9 16 17 A H E S+A 28 0A 2 12,-0.9 12,-3.2 2,-0.0 -1,-0.3 -0.972 113.7 54.6-153.2 141.3 56.1 -6.6 -10.6 17 18 A G >> + 0 0 0 -2,-0.3 3,-1.9 10,-0.3 4,-1.2 0.036 50.7 153.9 124.0 -28.6 59.4 -7.5 -12.2 18 19 A E T 34 S- 0 0 12 1,-0.3 4,-0.2 2,-0.1 9,-0.1 0.461 84.1 -0.1 0.2 -69.2 60.9 -4.2 -13.3 19 20 A H T 34 S+ 0 0 5 2,-0.1 -1,-0.3 3,-0.1 6,-0.1 0.496 118.4 76.3-117.1 -1.8 64.6 -5.1 -13.3 20 21 A A T X4>S+ 0 0 2 -3,-1.9 3,-4.4 1,-0.2 5,-0.8 0.969 86.1 61.6 -71.1 -54.3 64.6 -8.7 -12.3 21 22 A V G ><5S+ 0 0 27 -4,-1.2 3,-2.4 1,-0.3 -1,-0.2 0.803 91.3 66.9 -40.7 -41.8 63.5 -10.2 -15.6 22 23 A V G 3 5S+ 0 0 84 -5,-0.3 -1,-0.3 1,-0.3 -2,-0.2 0.671 108.3 43.9 -55.7 -12.2 66.6 -8.7 -17.2 23 24 A H G < 5S- 0 0 47 -3,-4.4 -1,-0.3 -4,-0.1 -2,-0.2 -0.056 135.8 -80.0-125.0 29.3 68.2 -11.3 -15.0 24 25 A G T < 5S+ 0 0 20 -3,-2.4 -3,-0.2 1,-0.3 190,-0.2 0.627 89.4 128.2 85.3 14.2 66.0 -14.4 -15.4 25 26 A K < - 0 0 43 -5,-0.8 2,-0.5 188,-0.1 -1,-0.3 -0.467 61.8 -95.4-100.2 173.8 63.2 -13.4 -13.1 26 27 A V - 0 0 1 -2,-0.1 2,-0.3 188,-0.1 242,-0.2 -0.771 34.5-171.0 -95.4 124.2 59.4 -13.2 -13.6 27 28 A A E - C 0 212A 7 185,-2.5 185,-2.4 -2,-0.5 2,-0.5 -0.771 14.3-144.5-108.0 154.9 57.7 -9.9 -14.5 28 29 A L E -AC 16 211A 3 -12,-3.2 -13,-3.2 -2,-0.3 -12,-0.9 -0.951 14.2-166.8-123.3 108.6 53.9 -9.3 -14.6 29 30 A A E -AC 14 210A 3 181,-1.7 181,-2.9 -2,-0.5 2,-0.3 -0.844 8.8-174.0 -97.2 125.9 52.8 -7.0 -17.3 30 31 A V E -AC 13 209A 5 -17,-2.8 -17,-2.3 -2,-0.5 2,-0.3 -0.807 28.2-105.8-117.1 158.7 49.3 -5.7 -17.0 31 32 A S E -A 12 0A 0 177,-1.4 338,-2.7 -2,-0.3 2,-0.7 -0.637 25.7-140.7 -84.5 142.5 47.2 -3.6 -19.4 32 33 A L E -AD 11 368A 0 -21,-4.5 2,-2.8 -2,-0.3 -21,-1.5 -0.911 9.2-142.2-105.6 109.3 46.7 0.1 -18.5 33 34 A N E S+ 0 0 46 334,-2.7 2,-0.9 -2,-0.7 335,-0.1 -0.016 71.0 114.2 -66.7 40.1 43.1 1.1 -19.3 34 35 A L E - 0 0 13 -2,-2.8 -23,-0.2 -23,-0.1 98,-0.2 -0.713 67.8-156.1-105.7 69.8 44.3 4.5 -20.5 35 36 A R E - 0 0 19 -2,-0.9 97,-2.3 97,-0.2 2,-0.4 0.054 18.6-140.2 -54.7 155.1 43.1 3.4 -23.9 36 37 A T E -AE 9 131A 3 -27,-2.7 -27,-1.6 95,-0.2 2,-0.3 -0.931 20.7-148.6-116.3 138.1 44.1 4.5 -27.4 37 38 A F E -AE 8 130A 2 93,-3.3 93,-1.0 -2,-0.4 2,-0.4 -0.813 12.7-167.1-116.2 153.3 41.5 4.9 -30.2 38 39 A L E -AE 7 129A 1 -31,-2.5 -31,-2.3 -2,-0.3 2,-0.6 -0.986 5.8-161.3-137.1 124.5 41.4 4.5 -34.0 39 40 A R E -AE 6 128A 44 89,-2.9 89,-1.4 -2,-0.4 2,-0.5 -0.929 15.3-175.0-106.2 112.2 38.6 5.8 -36.2 40 41 A L E +AE 5 127A 2 -35,-3.5 -35,-3.8 -2,-0.6 87,-0.2 -0.940 7.6 168.2-115.7 127.2 38.6 4.1 -39.7 41 42 A Q E - E 0 126A 59 85,-0.7 85,-2.2 -2,-0.5 2,-0.2 -0.972 29.7-129.1-143.0 126.5 36.3 5.0 -42.5 42 43 A P E - E 0 125A 52 0, 0.0 83,-0.3 0, 0.0 2,-0.2 -0.509 29.4-160.9 -73.4 131.6 36.3 4.1 -46.3 43 44 A H - 0 0 70 81,-4.1 81,-0.4 -2,-0.2 5,-0.0 -0.687 29.6-140.4-111.6 164.2 36.0 7.0 -48.7 44 45 A S S S+ 0 0 137 -2,-0.2 2,-0.4 2,-0.1 -1,-0.1 0.727 84.6 91.2 -88.8 -27.6 35.0 7.5 -52.3 45 46 A N S S- 0 0 89 1,-0.1 2,-3.8 2,-0.1 -2,-0.2 -0.563 89.6-120.7 -73.2 124.2 37.8 10.0 -52.7 46 47 A G S S+ 0 0 32 -2,-0.4 17,-1.2 16,-0.1 18,-0.5 -0.204 77.3 105.6 -64.0 60.0 41.1 8.4 -53.8 47 48 A K E -F 62 0A 78 -2,-3.8 2,-0.6 15,-0.3 15,-0.2 -0.987 53.1-159.0-147.9 133.8 42.9 9.6 -50.7 48 49 A V E -F 61 0A 0 13,-2.5 13,-2.3 -2,-0.3 2,-0.4 -0.954 25.0-179.1-109.3 119.7 44.2 7.9 -47.6 49 50 A D E -Fg 60 126A 43 76,-1.7 78,-3.5 -2,-0.6 2,-0.5 -0.985 17.3-151.0-131.0 137.4 44.8 10.4 -44.8 50 51 A L E -Fg 59 127A 6 9,-3.1 9,-2.0 -2,-0.4 2,-0.5 -0.893 9.9-171.3-108.4 125.3 46.1 10.1 -41.2 51 52 A S E +Fg 58 128A 8 76,-3.4 78,-2.3 -2,-0.5 7,-0.2 -0.951 10.6 173.1-121.3 117.9 45.1 12.4 -38.4 52 53 A L E >>> +F 57 0A 15 5,-2.4 4,-1.7 -2,-0.5 3,-1.5 -0.746 1.4 177.3-123.5 82.1 46.8 12.4 -35.0 53 54 A P T 345S+ 0 0 50 0, 0.0 -1,-0.2 0, 0.0 77,-0.1 0.878 77.0 67.2 -49.5 -45.5 45.4 15.3 -32.9 54 55 A N T 345S+ 0 0 85 75,-0.4 76,-0.1 1,-0.3 -2,-0.0 0.817 116.1 27.4 -46.7 -36.5 47.4 14.3 -29.8 55 56 A I T <45S- 0 0 79 -3,-1.5 -1,-0.3 2,-0.2 46,-0.1 0.571 107.9-125.1-102.4 -14.9 50.5 15.2 -31.8 56 57 A G T <5 + 0 0 64 -4,-1.7 2,-0.4 1,-0.3 -2,-0.1 0.843 64.6 129.4 74.1 34.5 48.9 17.8 -34.0 57 58 A I E < -F 52 0A 21 -5,-1.4 -5,-2.4 2,-0.0 2,-0.4 -0.942 32.7-177.4-124.3 144.8 50.0 16.2 -37.3 58 59 A K E +F 51 0A 140 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.963 5.2 173.5-145.4 125.0 48.0 15.3 -40.4 59 60 A R E -F 50 0A 57 -9,-2.0 -9,-3.1 -2,-0.4 2,-0.3 -0.940 6.3-169.9-130.3 150.0 49.2 13.6 -43.6 60 61 A A E -F 49 0A 50 -2,-0.3 2,-0.3 -11,-0.3 -11,-0.3 -0.942 5.2-156.4-138.8 160.4 47.4 12.3 -46.8 61 62 A W E -F 48 0A 16 -13,-2.3 -13,-2.5 -2,-0.3 2,-1.0 -0.998 26.5-116.7-141.5 142.6 48.2 10.2 -49.9 62 63 A D E >> -F 47 0A 56 -2,-0.3 4,-1.9 -15,-0.2 3,-1.2 -0.673 22.9-149.7 -77.7 102.4 46.8 9.9 -53.4 63 64 A V H 3> S+ 0 0 14 -17,-1.2 4,-3.5 -2,-1.0 5,-0.2 0.852 100.3 55.1 -40.8 -40.5 45.6 6.2 -53.4 64 65 A A H 3> S+ 0 0 62 -18,-0.5 4,-1.8 1,-0.2 -1,-0.3 0.915 106.4 49.9 -59.4 -44.7 46.3 6.3 -57.1 65 66 A R H <> S+ 0 0 169 -3,-1.2 4,-0.7 1,-0.2 -1,-0.2 0.783 115.0 44.5 -65.0 -29.9 49.9 7.5 -56.3 66 67 A L H < S+ 0 0 6 -4,-1.9 3,-0.4 2,-0.2 5,-0.2 0.912 108.2 54.5 -82.0 -45.9 50.2 4.6 -53.9 67 68 A Q H < S+ 0 0 87 -4,-3.5 4,-0.2 -5,-0.2 -2,-0.2 0.857 100.0 66.2 -54.8 -36.6 48.7 1.9 -56.0 68 69 A S H < S+ 0 0 95 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.917 80.9 89.4 -50.1 -56.2 51.2 2.8 -58.7 69 70 A L S < S- 0 0 49 -4,-0.7 2,-2.3 -3,-0.4 -3,-0.0 -0.056 88.0-119.2 -45.7 141.2 54.3 1.6 -56.8 70 71 A D > - 0 0 84 1,-0.1 2,-3.7 2,-0.0 3,-0.6 -0.498 39.1-179.4 -84.3 68.1 55.3 -2.0 -57.2 71 72 A T T 3 + 0 0 19 -2,-2.3 -1,-0.1 -4,-0.2 3,-0.1 -0.268 43.0 117.2 -67.6 56.4 54.7 -2.5 -53.5 72 73 A S T 3 + 0 0 75 -2,-3.7 2,-1.3 1,-0.2 -1,-0.2 0.494 44.4 90.6-102.0 -9.7 55.8 -6.1 -53.9 73 74 A F < 0 0 27 -3,-0.6 -1,-0.2 9,-0.1 -2,-0.1 -0.194 360.0 360.0 -80.0 44.1 58.8 -5.7 -51.6 74 75 A L 0 0 57 -2,-1.3 40,-0.1 -3,-0.1 36,-0.0 -0.617 360.0 360.0-130.5 360.0 56.6 -6.7 -48.7 75 ! 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 76 80 A V 0 0 142 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -31.8 60.5 -13.4 -41.4 77 81 A T - 0 0 62 1,-0.1 110,-0.0 3,-0.0 0, 0.0 0.911 360.0-179.9 48.9 49.6 62.3 -10.2 -40.2 78 82 A T + 0 0 21 1,-0.1 2,-1.1 2,-0.1 5,-0.1 0.748 52.1 99.1 -51.2 -30.1 60.2 -8.2 -42.5 79 83 A P + 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.504 58.5 174.1 -66.4 103.1 61.9 -5.0 -41.3 80 84 A T > - 0 0 27 -2,-1.1 4,-2.9 1,-0.1 5,-0.3 -0.822 44.1-132.2-111.8 151.4 64.4 -4.6 -44.2 81 85 A S H > S+ 0 0 35 922,-2.1 4,-1.2 -2,-0.3 923,-0.1 0.857 115.6 48.6 -65.9 -35.0 66.9 -1.7 -44.8 82 86 A E H > S+ 0 0 62 921,-0.3 4,-2.9 2,-0.2 5,-0.2 0.923 114.9 44.7 -68.0 -47.6 65.6 -1.8 -48.4 83 87 A Q H > S+ 0 0 22 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.997 113.6 46.0 -60.8 -67.1 62.0 -1.8 -47.2 84 88 A V H X S+ 0 0 4 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.814 115.1 52.4 -45.3 -34.6 62.2 0.9 -44.6 85 89 A E H >X S+ 0 0 47 -4,-1.2 4,-1.4 -5,-0.3 3,-0.7 0.984 111.0 42.4 -66.8 -59.7 64.2 2.9 -47.2 86 90 A K H 3X S+ 0 0 24 -4,-2.9 4,-2.4 1,-0.3 3,-0.3 0.888 111.2 58.4 -53.8 -42.2 61.6 2.6 -50.0 87 91 A L H 3X S+ 0 0 1 -4,-3.1 4,-2.7 1,-0.3 -1,-0.3 0.857 102.1 53.2 -57.5 -38.2 58.9 3.2 -47.4 88 92 A K H - 0 0 61 -2,-0.4 4,-1.5 1,-0.1 3,-0.4 -0.245 31.7-134.6 -53.5 128.4 60.1 15.3 -35.7 99 103 A V H > S+ 0 0 76 1,-0.2 4,-1.2 2,-0.2 5,-0.2 0.874 99.8 58.5 -52.3 -44.8 61.2 11.9 -34.6 100 104 A T H > S+ 0 0 89 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.875 111.4 37.2 -57.1 -45.1 57.9 11.1 -33.0 101 105 A E H > S+ 0 0 20 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.685 106.9 65.6 -83.7 -18.5 55.7 11.5 -36.1 102 106 A R H X S+ 0 0 65 -4,-1.5 4,-1.4 1,-0.2 -1,-0.2 0.818 110.2 39.7 -69.7 -28.5 58.3 10.0 -38.5 103 107 A L H X S+ 0 0 22 -4,-1.2 4,-1.2 -5,-0.2 -2,-0.2 0.778 111.5 57.6 -87.3 -33.0 57.8 6.8 -36.6 104 108 A A H X S+ 0 0 17 -4,-1.2 4,-0.7 -5,-0.2 -2,-0.2 0.851 113.6 39.4 -66.1 -35.1 54.0 7.3 -36.4 105 109 A V H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 3,-0.4 0.907 111.8 52.5 -83.0 -46.4 53.8 7.6 -40.2 106 110 A L H X S+ 0 0 2 -4,-1.4 4,-1.6 1,-0.2 -2,-0.2 0.741 109.0 53.0 -64.0 -22.4 56.2 4.9 -41.2 107 111 A A H X S+ 0 0 4 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.799 111.4 46.5 -79.4 -32.3 54.4 2.4 -39.0 108 112 A F H X S+ 0 0 0 -4,-0.7 4,-4.0 -3,-0.4 -2,-0.2 0.972 114.8 44.6 -70.8 -58.2 51.1 3.3 -40.6 109 113 A L H X S+ 0 0 4 -4,-2.7 4,-2.4 1,-0.2 5,-0.3 0.929 111.6 53.4 -52.8 -52.1 52.4 3.1 -44.2 110 114 A Y H X S+ 0 0 5 -4,-1.6 4,-0.9 -5,-0.3 -1,-0.2 0.929 117.7 37.5 -50.1 -48.4 54.2 -0.1 -43.5 111 115 A L H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 5,-0.5 0.925 113.8 54.0 -72.4 -47.2 51.0 -1.6 -42.2 112 116 A Y H >X S+ 0 0 0 -4,-4.0 4,-2.8 1,-0.2 3,-0.7 0.976 115.9 40.0 -48.0 -64.0 48.6 -0.0 -44.6 113 117 A L H 3< S+ 0 0 2 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.651 112.4 57.1 -60.9 -20.0 50.6 -1.3 -47.6 114 118 A S H 3< S+ 0 0 14 -4,-0.9 4,-0.3 -3,-0.4 -1,-0.2 0.825 121.7 23.1 -83.7 -31.4 51.2 -4.7 -46.0 115 119 A I H X< S+ 0 0 5 -4,-2.0 3,-1.1 -3,-0.7 4,-0.3 0.841 121.6 51.8-100.1 -48.4 47.6 -5.7 -45.4 116 120 A C T 3< S+ 0 0 1 -4,-2.8 3,-0.3 -5,-0.5 -3,-0.2 0.475 94.9 87.3 -67.9 2.4 45.8 -3.6 -48.0 117 121 A R T 3 S+ 0 0 92 -5,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.938 83.6 47.0 -66.1 -53.1 48.4 -5.2 -50.2 118 122 A K S < S+ 0 0 167 -3,-1.1 2,-0.3 -4,-0.3 -1,-0.2 0.540 91.0 108.6 -69.6 -6.0 46.4 -8.4 -50.9 119 123 A Q S S- 0 0 54 -4,-0.3 3,-0.1 -3,-0.3 38,-0.0 -0.593 81.9-125.5 -75.7 131.3 43.4 -6.1 -51.7 120 124 A R S S+ 0 0 262 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.731 97.2 11.3 -47.4 -23.3 42.6 -6.0 -55.4 121 125 A A S S- 0 0 49 -5,-0.1 -1,-0.2 0, 0.0 -58,-0.0 -0.967 92.2 -96.2-158.0 140.2 43.0 -2.2 -55.0 122 126 A L - 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