==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-MAY-04 1VZ8 . COMPND 2 MOLECULE: ORNITHINE ACETYL-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES CLAVULIGERUS; . AUTHOR J.M.ELKINS,N.J.KERSHAW,C.J.SCHOFIELD . 1503 13 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48773.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1083 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 114 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 217 14.4 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 . 8 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 . 2 0.1 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 . 98 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 152 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 422 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 0.7 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 0 0 2 3 10 6 4 1 4 2 4 0 1 0 0 3 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 11 1 1 1 0 3 5 2 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 1 3 7 3 10 6 2 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 0 1 2 7 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 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 8 A T 0 0 82 0, 0.0 2,-0.2 0, 0.0 181,-0.1 0.000 360.0 360.0 360.0 -17.9 40.5 41.0 44.0 2 9 A P > - 0 0 4 0, 0.0 3,-1.1 0, 0.0 128,-0.3 -0.484 360.0-106.1 -74.8 144.0 39.7 41.4 40.3 3 10 A R T 3 S+ 0 0 143 1,-0.2 222,-0.3 -2,-0.2 223,-0.2 -0.390 96.9 27.0 -68.6 138.7 38.3 44.8 39.1 4 11 A G T 3 S+ 0 0 0 1,-0.2 24,-3.3 -2,-0.1 2,-0.5 0.271 89.3 113.0 97.5 -11.4 34.7 45.1 38.2 5 12 A F E < +A 27 0A 1 -3,-1.1 125,-2.7 22,-0.2 2,-0.3 -0.834 37.0 175.8-102.0 132.4 33.2 42.3 40.4 6 13 A V E -Ab 26 130A 6 20,-2.2 20,-1.9 -2,-0.5 2,-0.4 -0.934 15.6-145.1-128.6 151.2 30.9 43.1 43.3 7 14 A V E -A 25 0A 1 123,-1.2 2,-0.5 -2,-0.3 18,-0.2 -0.958 8.7-167.3-125.7 140.5 29.1 40.7 45.6 8 15 A H E +A 24 0A 36 16,-2.4 16,-2.5 -2,-0.4 2,-0.4 -0.984 12.4 174.9-124.7 121.4 25.7 40.8 47.3 9 16 A T E +A 23 0A 21 -2,-0.5 14,-0.2 14,-0.2 11,-0.1 -0.993 7.2 159.1-130.2 130.8 24.9 38.3 50.0 10 17 A A E -A 22 0A 9 12,-2.5 12,-1.7 -2,-0.4 11,-1.3 -0.998 40.8-110.4-152.8 146.0 21.8 38.2 52.1 11 18 A P + 0 0 65 0, 0.0 9,-0.2 0, 0.0 108,-0.1 -0.575 35.5 164.1 -75.3 131.5 19.6 35.9 54.2 12 19 A V - 0 0 2 7,-0.4 103,-0.1 -2,-0.3 104,-0.1 0.314 55.4-108.7-128.6 2.4 16.3 35.1 52.6 13 20 A G + 0 0 37 6,-0.5 102,-0.1 1,-0.1 3,-0.1 0.922 57.5 156.8 71.7 46.9 15.4 32.1 54.7 14 21 A L S S+ 0 0 16 52,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.296 89.2 19.0 -80.4 10.3 15.8 29.2 52.2 15 22 A A S > S- 0 0 34 4,-0.1 2,-1.6 53,-0.0 3,-0.6 -0.895 101.1 -99.6-169.4 152.4 16.2 27.6 55.6 16 23 A D T 3 S+ 0 0 114 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 -0.573 95.6 82.7 -87.3 79.9 15.1 28.8 59.1 17 24 A D T 3 S- 0 0 90 -2,-1.6 -1,-0.2 2,-0.2 3,-0.1 0.436 87.6-120.2-154.4 -9.8 18.4 30.1 60.4 18 25 A G < + 0 0 58 -3,-0.6 2,-0.2 1,-0.2 -2,-0.1 0.644 63.5 139.3 72.7 12.4 19.2 33.6 59.2 19 26 A R - 0 0 60 -4,-0.1 -6,-0.5 1,-0.1 -7,-0.4 -0.544 66.0 -89.8 -85.4 155.7 22.4 32.6 57.5 20 27 A D + 0 0 49 -9,-0.2 -1,-0.1 -2,-0.2 3,-0.1 -0.479 60.4 148.6 -66.1 134.4 23.2 34.2 54.1 21 28 A D + 0 0 0 -11,-1.3 45,-2.4 1,-0.2 2,-0.6 0.345 48.8 78.7-146.5 -3.8 21.8 32.0 51.3 22 29 A F E +AC 10 65A 0 -12,-1.7 -12,-2.5 43,-0.2 2,-0.4 -0.965 59.5 176.9-114.6 118.6 21.0 34.5 48.5 23 30 A T E -AC 9 64A 3 41,-2.9 41,-4.1 -2,-0.6 2,-0.4 -0.973 17.3-173.3-129.4 139.9 24.0 35.5 46.5 24 31 A V E -AC 8 63A 5 -16,-2.5 -16,-2.4 -2,-0.4 2,-0.5 -0.980 4.2-175.0-132.6 118.0 24.4 37.8 43.5 25 32 A L E +AC 7 62A 5 37,-2.6 37,-1.8 -2,-0.4 2,-0.3 -0.965 18.0 167.9-113.3 121.9 27.8 38.0 41.8 26 33 A A E -AC 6 61A 3 -20,-1.9 -20,-2.2 -2,-0.5 2,-0.5 -0.978 31.6-131.0-140.6 153.5 28.0 40.6 39.0 27 34 A S E -A 5 0A 1 33,-2.0 -22,-0.2 -2,-0.3 -23,-0.1 -0.895 18.9-134.7-105.8 128.7 30.5 42.4 36.8 28 35 A T E S+ 0 0 67 -24,-3.3 -23,-0.1 -2,-0.5 -1,-0.1 0.387 88.9 27.4 -59.5 4.2 30.2 46.2 36.3 29 36 A A E S- 0 0 23 -25,-0.2 -2,-0.1 31,-0.1 196,-0.0 -0.984 104.7 -61.1-159.1 167.9 30.7 45.7 32.6 30 37 A P E - 0 0 78 0, 0.0 194,-0.5 0, 0.0 2,-0.3 -0.232 54.7-171.5 -54.3 145.1 30.2 43.2 29.7 31 38 A A E - C 0 59A 2 28,-0.7 28,-1.9 192,-0.2 2,-0.4 -0.999 26.9-118.6-142.1 141.8 32.1 39.9 30.3 32 39 A T E -DC 222 58A 25 190,-1.7 190,-1.8 -2,-0.3 2,-0.4 -0.666 38.0-152.7 -79.5 133.0 32.8 36.9 28.1 33 40 A V E -D 221 0A 4 24,-2.4 2,-0.4 -2,-0.4 188,-0.2 -0.918 20.0-176.2-117.6 136.9 31.3 33.9 29.8 34 41 A S E +D 220 0A 3 186,-2.0 186,-3.3 -2,-0.4 2,-0.3 -0.997 20.6 162.1-125.6 126.8 32.2 30.2 29.7 35 42 A A E -D 219 0A 24 -2,-0.4 2,-0.3 184,-0.2 184,-0.2 -0.989 23.5-165.9-148.0 155.6 30.0 27.7 31.5 36 43 A V E -D 218 0A 15 182,-2.1 182,-1.9 -2,-0.3 2,-0.3 -0.969 16.5-165.1-135.9 148.0 29.2 24.0 31.8 37 44 A F E -D 217 0A 6 136,-2.4 136,-1.6 -2,-0.3 180,-0.2 -0.821 30.3 -80.1-132.8 172.1 26.2 22.4 33.5 38 45 A T - 0 0 0 178,-2.2 -1,-0.1 -2,-0.3 135,-0.1 -0.177 27.2-149.6 -62.9 163.5 24.9 19.1 34.7 39 46 A R + 0 0 92 174,-0.2 -1,-0.1 133,-0.1 4,-0.1 0.136 43.1 147.4-121.9 18.3 23.3 16.8 32.1 40 47 A S > - 0 0 7 173,-0.4 3,-0.9 1,-0.1 645,-0.2 -0.039 55.5-132.3 -52.6 155.0 20.8 15.2 34.5 41 48 A R T 3 S+ 0 0 18 643,-0.9 653,-0.6 1,-0.2 -1,-0.1 0.576 113.3 49.8 -84.2 -12.9 17.5 14.1 33.2 42 49 A F T 3 S+ 0 0 0 639,-0.2 -1,-0.2 651,-0.1 2,-0.1 -0.096 80.2 159.7-112.4 30.6 16.1 15.9 36.2 43 50 A A < - 0 0 12 -3,-0.9 172,-0.2 641,-0.1 29,-0.1 -0.377 42.2-117.8 -57.7 125.8 18.0 19.0 35.6 44 51 A G > - 0 0 2 170,-1.6 4,-1.1 -2,-0.1 3,-0.4 -0.035 24.2-101.2 -60.5 165.0 16.2 21.8 37.5 45 52 A P H > S+ 0 0 23 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.866 118.0 62.4 -57.9 -36.3 14.7 24.9 35.8 46 53 A S H > S+ 0 0 6 24,-0.4 4,-2.3 23,-0.3 55,-0.3 0.913 97.9 55.7 -55.5 -47.1 17.6 27.1 36.7 47 54 A V H > S+ 0 0 4 -3,-0.4 4,-2.5 1,-0.2 3,-0.3 0.947 104.7 52.3 -50.4 -56.7 20.1 25.0 34.7 48 55 A V H X S+ 0 0 63 -4,-1.1 4,-2.4 1,-0.3 -1,-0.2 0.907 108.8 50.6 -46.6 -51.8 18.1 25.4 31.5 49 56 A L H X S+ 0 0 14 -4,-1.8 4,-3.1 1,-0.2 -1,-0.3 0.891 108.7 51.7 -56.0 -42.3 18.0 29.1 32.0 50 57 A C H X S+ 0 0 1 -4,-2.3 4,-1.3 -3,-0.3 -1,-0.2 0.894 106.2 54.2 -63.9 -40.1 21.8 29.2 32.5 51 58 A R H >X S+ 0 0 60 -4,-2.5 3,-0.8 2,-0.2 4,-0.8 0.969 113.3 42.9 -57.5 -50.3 22.3 27.2 29.3 52 59 A E H >< S+ 0 0 118 -4,-2.4 3,-1.5 1,-0.2 4,-0.4 0.953 109.7 56.7 -59.1 -51.5 20.3 29.8 27.4 53 60 A A H 3< S+ 0 0 3 -4,-3.1 5,-0.2 1,-0.3 -1,-0.2 0.691 109.9 45.7 -54.2 -23.3 21.9 32.8 29.1 54 61 A V H X< S+ 0 0 22 -4,-1.3 3,-2.7 -3,-0.8 -1,-0.3 0.552 80.5 99.2-100.8 -7.5 25.4 31.7 28.0 55 62 A A T << S+ 0 0 83 -3,-1.5 -1,-0.1 -4,-0.8 -2,-0.1 0.871 86.5 46.3 -43.3 -52.8 24.7 30.9 24.4 56 63 A D T 3 S- 0 0 100 -4,-0.4 -1,-0.3 2,-0.2 -2,-0.1 0.401 111.2-121.4 -74.9 3.8 26.1 34.2 23.1 57 64 A G S < S+ 0 0 18 -3,-2.7 -24,-2.4 1,-0.2 2,-0.4 0.687 80.5 112.4 63.4 16.5 29.1 33.8 25.4 58 65 A Q E +C 32 0A 58 -26,-0.2 2,-0.3 -5,-0.2 -2,-0.2 -0.983 33.1 138.0-126.2 128.3 28.1 37.0 27.0 59 66 A A E -C 31 0A 0 -28,-1.9 -28,-0.7 -2,-0.4 40,-0.2 -0.985 33.6-157.7-160.3 162.0 26.8 37.5 30.5 60 67 A R E - 0 0 42 38,-2.8 -33,-2.0 -2,-0.3 2,-0.3 0.279 64.9 -9.4-132.9 14.5 27.2 39.8 33.5 61 68 A G E -C 26 0A 1 37,-0.4 39,-2.0 -35,-0.2 2,-0.3 -0.999 45.2-132.5 175.8-178.6 26.1 38.0 36.7 62 69 A V E -Ce 25 100A 1 -37,-1.8 -37,-2.6 -2,-0.3 2,-0.5 -0.929 10.5-148.9-161.4 133.8 24.7 35.1 38.6 63 70 A V E -Ce 24 101A 0 37,-2.1 39,-3.0 -2,-0.3 2,-0.5 -0.924 20.9-163.4-105.2 134.0 22.2 34.8 41.4 64 71 A V E -Ce 23 102A 2 -41,-4.1 -41,-2.9 -2,-0.5 2,-0.5 -0.976 9.8-168.5-126.1 126.0 22.8 31.8 43.7 65 72 A L E -Ce 22 103A 0 37,-2.2 39,-1.7 -2,-0.5 3,-0.4 -0.949 11.7-162.0-115.1 120.1 20.3 30.4 46.1 66 73 A A E + e 0 104A 0 -45,-2.4 39,-0.2 -2,-0.5 -52,-0.2 -0.835 66.3 32.6-108.4 142.0 21.6 27.8 48.6 67 74 A R E S+ e 0 105A 37 37,-1.1 39,-0.6 -2,-0.4 38,-0.3 0.407 113.9 58.3 96.7 4.0 19.6 25.3 50.7 68 75 A N E - e 0 106A 9 36,-2.0 36,-0.2 -3,-0.4 37,-0.2 -0.778 57.9-168.5-162.6 116.1 17.0 24.8 48.0 69 76 A A - 0 0 1 37,-1.1 -23,-0.3 -2,-0.2 38,-0.2 0.632 30.2-135.7 -82.1 -16.2 17.6 23.7 44.5 70 77 A N + 0 0 0 36,-0.8 -24,-0.4 39,-0.4 2,-0.4 0.972 54.7 147.7 53.6 55.1 14.2 24.5 43.0 71 78 A V + 0 0 1 35,-0.4 37,-3.1 38,-0.2 -1,-0.2 -0.989 60.1 10.3-125.2 128.8 14.3 21.1 41.3 72 79 A A S S+ 0 0 10 -2,-0.4 -1,-0.2 35,-0.2 -2,-0.1 0.806 87.0 128.3 72.2 30.4 11.2 19.0 40.7 73 80 A T > - 0 0 7 1,-0.3 4,-2.0 -3,-0.2 3,-0.2 0.238 58.2-143.5 -99.4 7.9 9.1 22.0 41.7 74 81 A G H > - 0 0 38 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 -0.106 51.9 -31.3 64.3-160.0 7.0 21.9 38.5 75 82 A L H > S+ 0 0 105 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.906 139.7 56.3 -59.9 -44.5 5.6 24.8 36.6 76 83 A E H > S+ 0 0 106 1,-0.2 4,-2.4 -3,-0.2 -1,-0.2 0.944 108.8 47.4 -53.4 -48.3 5.3 26.8 39.8 77 84 A G H X S+ 0 0 0 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.885 110.1 53.3 -60.8 -39.8 9.1 26.2 40.3 78 85 A E H >X S+ 0 0 61 -4,-2.2 4,-1.8 2,-0.2 3,-0.7 0.933 110.0 46.1 -60.6 -49.7 9.9 27.1 36.7 79 86 A E H 3X S+ 0 0 97 -4,-2.7 4,-3.3 1,-0.3 -2,-0.2 0.949 107.8 55.0 -59.0 -52.0 8.1 30.5 37.0 80 87 A N H 3X S+ 0 0 9 -4,-2.4 4,-1.8 1,-0.2 -1,-0.3 0.715 107.0 57.0 -55.6 -18.0 9.7 31.3 40.3 81 88 A A H S+ 0 0 2 -4,-1.7 5,-2.1 1,-0.2 4,-1.2 0.922 109.6 53.6 -54.4 -47.8 18.4 41.7 36.3 90 97 A R H ><5S+ 0 0 77 -4,-3.8 3,-0.6 1,-0.2 -1,-0.2 0.897 106.5 52.4 -55.6 -43.3 15.7 44.4 36.5 91 98 A A H 3<5S+ 0 0 41 -4,-2.4 34,-0.3 1,-0.2 -1,-0.2 0.894 115.6 39.8 -61.8 -40.2 17.3 45.8 39.7 92 99 A L H 3<5S- 0 0 15 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.489 107.7-118.7 -90.1 -2.7 20.8 46.0 38.1 93 100 A G T <<5 + 0 0 67 -4,-1.2 -3,-0.2 -3,-0.6 -4,-0.1 0.822 68.3 140.7 69.8 26.5 19.7 47.3 34.7 94 101 A L < - 0 0 10 -5,-2.1 -1,-0.3 -6,-0.2 2,-0.2 -0.716 62.5 -99.7 -98.3 150.9 21.1 44.2 33.2 95 102 A P > - 0 0 70 0, 0.0 3,-3.4 0, 0.0 -35,-0.2 -0.550 31.9-118.2 -73.9 138.6 19.3 42.4 30.4 96 103 A E G > S+ 0 0 105 1,-0.3 3,-1.2 -2,-0.2 -7,-0.1 0.864 112.9 56.7 -37.3 -48.4 17.4 39.4 31.6 97 104 A G G 3 S+ 0 0 37 1,-0.3 -1,-0.3 -38,-0.0 -39,-0.1 0.384 96.4 61.5 -72.1 2.5 19.5 37.2 29.4 98 105 A E G < S+ 0 0 36 -3,-3.4 -38,-2.8 -39,-0.1 2,-0.4 0.060 89.1 84.3-115.5 27.0 22.8 38.2 30.9 99 106 A X < - 0 0 0 -3,-1.2 -37,-0.2 -40,-0.2 2,-0.1 -0.946 61.5-163.9-131.4 108.2 21.9 37.0 34.3 100 107 A L E -e 62 0A 0 -39,-2.0 -37,-2.1 -2,-0.4 2,-0.4 -0.432 6.0-151.7 -85.2 167.0 22.4 33.3 35.2 101 108 A I E -e 63 0A 0 -55,-0.3 2,-0.4 -39,-0.3 -51,-0.2 -0.997 10.1-172.3-140.9 134.2 20.8 31.7 38.2 102 109 A A E -e 64 0A 0 -39,-3.0 -37,-2.2 -2,-0.4 2,-0.4 -0.994 1.4-172.6-131.6 139.1 22.2 28.8 40.1 103 110 A S E +e 65 0A 3 -2,-0.4 2,-0.3 112,-0.2 -37,-0.2 -0.956 6.2 176.1-142.1 120.9 20.4 26.8 42.8 104 111 A T E +e 66 0A 1 -39,-1.7 -36,-2.0 -2,-0.4 -37,-1.1 -0.887 41.3 54.7-117.6 147.5 21.8 24.1 45.1 105 112 A G E S+e 67 0A 22 -2,-0.3 -37,-0.2 -38,-0.3 2,-0.2 -0.980 78.7 19.0 141.6-151.5 19.9 22.5 47.9 106 113 A V E -e 68 0A 87 -39,-0.6 -37,-1.1 -2,-0.3 -36,-0.8 -0.441 62.9-136.8 -69.2 130.4 16.7 20.6 48.9 107 114 A I S S+ 0 0 30 -2,-0.2 -35,-0.2 1,-0.2 570,-0.2 -0.515 77.5 21.5 -85.4 151.7 14.8 19.0 46.0 108 115 A G S S+ 0 0 21 -37,-3.1 2,-0.4 -2,-0.2 -1,-0.2 0.197 91.5 110.4 82.3 -19.0 11.0 19.1 45.7 109 116 A R - 0 0 42 -3,-0.4 -39,-0.4 -38,-0.1 -38,-0.2 -0.755 65.6-122.6 -96.8 139.8 10.4 22.2 47.9 110 117 A Q - 0 0 62 -2,-0.4 -1,-0.1 1,-0.1 -40,-0.0 -0.318 33.2 -96.6 -73.8 156.8 9.2 25.5 46.4 111 118 A Y - 0 0 8 1,-0.1 2,-1.9 -38,-0.1 3,-0.2 -0.397 32.8-115.1 -70.9 151.1 11.1 28.8 46.9 112 119 A P > + 0 0 29 0, 0.0 4,-2.1 0, 0.0 3,-0.5 -0.454 42.8 173.7 -86.1 65.6 9.8 31.0 49.7 113 120 A X H > S+ 0 0 5 -2,-1.9 4,-3.0 1,-0.2 5,-0.3 0.737 70.6 68.9 -43.4 -29.7 8.8 33.7 47.2 114 121 A E H > S+ 0 0 144 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.992 109.4 30.4 -51.9 -70.7 7.3 35.5 50.1 115 122 A S H > S+ 0 0 52 -3,-0.5 4,-1.7 1,-0.2 -2,-0.2 0.857 121.6 52.5 -58.1 -41.2 10.7 36.3 51.7 116 123 A I H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.892 105.0 54.0 -65.4 -42.8 12.6 36.5 48.3 117 124 A R H X S+ 0 0 124 -4,-3.0 4,-1.4 -5,-0.2 -1,-0.2 0.923 107.7 52.6 -58.2 -44.5 10.1 39.0 46.8 118 125 A E H >X S+ 0 0 61 -4,-1.7 3,-2.5 -5,-0.3 4,-0.6 0.982 111.0 43.3 -52.8 -72.8 10.7 41.3 49.7 119 126 A H H >X S+ 0 0 33 -4,-1.7 3,-1.4 1,-0.3 4,-0.6 0.790 108.2 60.5 -42.7 -40.5 14.5 41.4 49.6 120 127 A L H >< S+ 0 0 20 -4,-2.3 3,-0.9 1,-0.3 -1,-0.3 0.840 94.8 63.3 -60.4 -32.2 14.4 41.7 45.8 121 128 A K H << S+ 0 0 90 -3,-2.5 -1,-0.3 -4,-1.4 -2,-0.2 0.779 108.4 42.6 -63.5 -23.6 12.5 45.0 46.2 122 129 A T H << S+ 0 0 106 -3,-1.4 -1,-0.2 -4,-0.6 -2,-0.2 0.467 84.4 125.3-103.1 -2.6 15.6 46.3 48.0 123 130 A L << + 0 0 14 -3,-0.9 2,-0.3 -4,-0.6 -3,-0.0 -0.345 27.0 148.7 -64.2 133.0 18.3 45.0 45.6 124 131 A E - 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