==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-MAR-12 4AMV . COMPND 2 MOLECULE: GLUCOSAMINE--FRUCTOSE-6-PHOSPHATE AMINOTRANSFERAS . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.MOUILLERON,B.GOLINELLI-PIMPANEAU . 1824 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 64267.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1305 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 153 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 228 12.5 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 . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 15 0.8 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 . 120 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 232 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 517 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 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 3 3 3 4 6 5 2 4 4 4 1 4 0 1 1 1 5 3 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 3 3 6 12 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 . 6 5 7 10 4 5 8 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 . 3 0 0 3 3 0 6 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 C 0 0 32 0, 0.0 2,-0.4 0, 0.0 72,-0.2 0.000 360.0 360.0 360.0 175.5 17.6 4.9 90.6 2 2 A G E -A 72 0A 0 70,-2.3 70,-1.7 95,-0.1 2,-0.4 -1.000 360.0-165.3-137.1 134.2 20.9 4.9 88.7 3 3 A I E +A 71 0A 0 -2,-0.4 188,-2.2 68,-0.2 189,-0.4 -0.946 8.1 178.5-119.7 135.3 24.5 4.2 89.9 4 4 A V E +AB 70 190A 0 66,-1.8 66,-2.3 -2,-0.4 2,-0.3 -0.995 1.9 176.9-132.9 140.1 27.7 4.9 87.9 5 5 A G E -AB 69 189A 0 184,-3.7 184,-2.5 -2,-0.4 2,-0.3 -0.971 3.8-174.0-141.3 160.3 31.2 4.4 89.0 6 6 A A E -AB 68 188A 0 62,-2.3 62,-2.4 -2,-0.3 2,-0.4 -0.992 14.6-175.3-157.2 133.3 34.6 4.8 87.4 7 7 A I E +AB 67 187A 4 180,-2.7 180,-2.1 -2,-0.3 60,-0.2 -0.915 37.0 133.9-136.7 108.6 38.3 4.1 88.1 8 8 A A - 0 0 7 58,-3.4 178,-0.1 -2,-0.4 208,-0.1 -0.719 63.7-114.4-142.4 179.2 40.6 5.5 85.5 9 9 A Q S S+ 0 0 84 -2,-0.2 2,-0.1 176,-0.1 -1,-0.1 0.746 99.0 63.3 -92.1 -37.4 43.7 7.4 84.7 10 10 A R S S- 0 0 8 56,-0.1 -2,-0.2 1,-0.1 1218,-0.1 -0.430 108.4 -78.1 -80.7 164.5 41.9 10.3 83.1 11 11 A D - 0 0 55 1216,-0.2 55,-0.2 1,-0.1 4,-0.2 -0.395 42.2-165.9 -56.6 140.1 39.4 12.5 85.0 12 12 A V > + 0 0 0 53,-1.9 4,-2.4 2,-0.1 3,-0.4 0.513 59.6 98.3-109.5 -7.9 36.1 10.7 85.3 13 13 A A H > S+ 0 0 8 52,-0.4 4,-2.6 50,-0.4 5,-0.2 0.890 88.2 44.9 -51.4 -48.9 33.7 13.5 86.3 14 14 A E H > S+ 0 0 98 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.863 112.9 51.9 -65.2 -32.4 32.3 14.0 82.8 15 15 A I H > S+ 0 0 10 -3,-0.4 4,-2.4 2,-0.2 -1,-0.3 0.881 109.4 48.4 -68.3 -41.9 32.0 10.3 82.3 16 16 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.908 113.2 49.0 -66.2 -41.9 30.0 9.9 85.6 17 17 A L H X S+ 0 0 1 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.851 110.6 48.5 -62.2 -42.0 27.7 12.8 84.5 18 18 A E H X S+ 0 0 48 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.906 110.2 54.2 -67.0 -40.3 27.1 11.4 81.1 19 19 A G H X S+ 0 0 0 -4,-2.4 4,-1.0 1,-0.2 3,-0.4 0.949 109.6 46.2 -55.6 -49.8 26.4 8.1 82.9 20 20 A L H >X S+ 0 0 0 -4,-2.6 4,-0.8 1,-0.2 3,-0.6 0.888 106.8 57.7 -64.3 -39.4 23.7 9.8 85.1 21 21 A R H 3< S+ 0 0 95 -4,-2.5 3,-0.3 1,-0.2 4,-0.3 0.869 108.8 48.2 -53.1 -37.4 22.2 11.6 82.0 22 22 A R H 3< S+ 0 0 55 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.676 115.6 42.0 -80.0 -20.6 21.6 8.2 80.5 23 23 A L H X< S+ 0 0 0 -4,-1.0 3,-2.1 -3,-0.6 4,-0.3 0.405 84.7 104.4-103.1 6.0 20.1 6.7 83.7 24 24 A E G >< + 0 0 31 -4,-0.8 3,-2.2 -3,-0.3 -2,-0.1 0.802 66.1 67.4 -57.5 -40.1 18.0 9.7 84.4 25 25 A Y G 3 S+ 0 0 22 -4,-0.3 578,-3.2 1,-0.3 -1,-0.3 0.681 95.1 62.0 -54.0 -22.9 14.8 8.2 83.3 26 26 A R G < S- 0 0 31 -3,-2.1 -1,-0.3 1,-0.3 48,-0.3 0.597 128.4 -13.5 -77.3 -19.3 15.2 5.9 86.4 27 27 A G < + 0 0 0 -3,-2.2 47,-0.3 -4,-0.3 -1,-0.3 -0.628 54.2 172.7 177.5 128.4 15.1 8.8 88.8 28 28 A Y + 0 0 9 573,-0.4 46,-0.2 -2,-0.2 3,-0.1 -0.082 56.7 98.1-134.8 31.2 15.3 12.6 88.3 29 29 A D S S- 0 0 32 44,-2.8 20,-2.7 1,-0.3 2,-0.3 0.773 98.9 -19.7 -89.5 -32.4 14.5 13.9 91.8 30 30 A S E -CD 48 73A 0 43,-1.1 43,-2.7 18,-0.3 -1,-0.3 -0.968 59.0-169.5-161.2 171.6 18.2 14.4 92.8 31 31 A A E +CD 47 72A 1 16,-2.2 16,-2.6 -2,-0.3 2,-0.3 -0.980 5.2 175.2-160.8 163.4 21.7 13.4 91.9 32 32 A G E -CD 46 71A 0 39,-2.2 39,-2.5 -2,-0.3 2,-0.3 -0.978 8.7-162.8-162.7 165.4 25.3 13.6 93.2 33 33 A L E -CD 45 70A 0 12,-2.5 12,-2.5 -2,-0.3 2,-0.4 -0.971 6.3-154.8-149.1 159.0 28.8 12.4 92.5 34 34 A A E -CD 44 69A 0 35,-2.4 35,-1.9 -2,-0.3 2,-0.4 -0.997 11.9-171.9-135.8 135.3 32.0 12.2 94.5 35 35 A V E -CD 43 68A 1 8,-2.8 8,-4.0 -2,-0.4 2,-0.4 -0.995 7.0-157.7-133.3 135.2 35.4 12.2 92.9 36 36 A V E -CD 42 67A 0 31,-2.7 31,-1.5 -2,-0.4 30,-0.3 -0.936 12.8-141.8-113.9 129.9 38.8 11.6 94.6 37 37 A D > - 0 0 31 4,-1.8 3,-2.9 -2,-0.4 28,-0.1 -0.415 38.2 -94.2 -82.4 166.6 42.0 12.8 93.1 38 38 A A T 3 S+ 0 0 83 1,-0.3 129,-0.1 -2,-0.2 -1,-0.0 0.854 127.1 59.7 -56.9 -33.6 45.2 10.8 93.3 39 39 A E T 3 S- 0 0 151 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.242 117.8-112.1 -70.1 9.1 46.1 12.8 96.5 40 40 A G < + 0 0 23 -3,-2.9 2,-0.8 1,-0.2 -2,-0.1 0.585 69.1 145.5 65.4 7.8 42.9 11.6 98.2 41 41 A H - 0 0 120 123,-0.1 -4,-1.8 2,-0.0 2,-0.4 -0.725 38.1-155.4 -76.5 115.7 41.3 15.0 98.2 42 42 A M E -C 36 0A 46 -2,-0.8 2,-0.5 -6,-0.2 -6,-0.3 -0.771 10.1-161.7 -97.4 129.4 37.7 13.9 97.7 43 43 A T E -C 35 0A 42 -8,-4.0 -8,-2.8 -2,-0.4 2,-0.4 -0.955 7.8-172.4-115.2 122.8 35.2 16.4 96.2 44 44 A R E +C 34 0A 78 -2,-0.5 2,-0.4 -10,-0.3 -10,-0.2 -0.967 4.3 179.6-113.3 134.0 31.4 15.6 96.7 45 45 A L E +C 33 0A 19 -12,-2.5 -12,-2.5 -2,-0.4 2,-0.3 -0.998 2.0 176.2-133.0 134.9 28.7 17.6 94.9 46 46 A R E -C 32 0A 32 -2,-0.4 2,-0.4 -14,-0.3 -14,-0.2 -0.999 2.9-177.7-142.1 133.5 24.9 16.9 95.3 47 47 A R E -C 31 0A 76 -16,-2.6 -16,-2.2 -2,-0.3 2,-0.3 -0.990 26.6-124.7-135.6 145.5 21.9 18.8 93.8 48 48 A L E S+C 30 0A 81 -2,-0.4 -18,-0.3 -18,-0.2 2,-0.2 -0.666 77.5 34.6 -76.7 138.7 18.2 18.6 94.0 49 49 A G S S- 0 0 25 -20,-2.7 -2,-0.1 -2,-0.3 5,-0.1 -0.669 102.5 -18.4 115.2-173.4 16.5 18.3 90.6 50 50 A K S >> S- 0 0 50 -2,-0.2 3,-2.0 1,-0.1 4,-0.8 -0.096 75.4 -94.6 -62.0 161.7 17.4 16.8 87.2 51 51 A V H 3> S+ 0 0 0 1,-0.3 4,-2.4 2,-0.2 3,-0.3 0.831 120.5 71.8 -51.2 -33.8 21.0 15.8 86.4 52 52 A Q H 3> S+ 0 0 124 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.784 91.5 58.7 -55.2 -25.9 21.5 19.2 84.7 53 53 A M H <> S+ 0 0 64 -3,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.941 108.9 43.3 -70.3 -47.3 21.5 20.8 88.1 54 54 A L H X S+ 0 0 0 -4,-0.8 4,-2.9 -3,-0.3 -2,-0.2 0.912 114.4 50.4 -59.6 -43.6 24.4 18.7 89.2 55 55 A A H X S+ 0 0 20 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.936 109.5 50.9 -66.2 -42.8 26.2 19.3 85.8 56 56 A Q H >X S+ 0 0 100 -4,-2.7 4,-0.8 -5,-0.2 3,-0.6 0.943 110.8 48.2 -57.0 -48.6 25.8 22.9 86.1 57 57 A A H >X S+ 0 0 3 -4,-2.1 3,-1.4 1,-0.2 4,-1.3 0.931 109.0 54.3 -57.4 -46.6 27.2 22.9 89.6 58 58 A A H 3< S+ 0 0 9 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.760 101.7 59.3 -56.7 -29.0 30.2 20.7 88.4 59 59 A E H << S+ 0 0 164 -4,-1.7 -1,-0.3 -3,-0.6 -2,-0.2 0.731 108.1 45.6 -77.3 -22.0 30.9 23.4 85.8 60 60 A E H << S+ 0 0 120 -3,-1.4 -2,-0.2 -4,-0.8 -1,-0.2 0.715 127.3 25.5 -87.9 -25.2 31.3 25.9 88.5 61 61 A H S < S- 0 0 110 -4,-1.3 -1,-0.3 2,-0.0 -2,-0.1 -0.723 87.4-151.6-140.5 81.7 33.5 23.7 90.7 62 62 A P - 0 0 86 0, 0.0 2,-0.7 0, 0.0 -3,-0.1 -0.212 5.9-136.5 -76.5 156.0 35.2 21.3 88.6 63 63 A L - 0 0 9 -5,-0.1 -50,-0.4 2,-0.1 2,-0.3 -0.937 16.0-160.5-114.3 109.7 36.2 17.9 90.1 64 64 A H + 0 0 125 -2,-0.7 -21,-0.2 -29,-0.1 2,-0.2 -0.692 38.2 79.3 -82.2 136.8 39.6 16.5 89.3 65 65 A G - 0 0 7 -2,-0.3 -53,-1.9 -28,-0.1 -52,-0.4 -0.519 65.6-112.1 143.5 162.1 40.5 12.9 89.7 66 66 A G S S+ 0 0 17 -30,-0.3 -58,-3.4 -55,-0.2 2,-0.4 0.486 91.6 61.6 -95.1 -6.8 40.4 9.4 88.4 67 67 A T E +AD 7 36A 9 -31,-1.5 -31,-2.7 -60,-0.2 2,-0.3 -0.983 62.6 132.3-125.5 128.2 38.2 7.6 90.9 68 68 A G E -AD 6 35A 0 -62,-2.4 -62,-2.3 -2,-0.4 2,-0.3 -0.998 33.6-147.9-164.6 168.7 34.5 8.4 91.5 69 69 A I E -AD 5 34A 0 -35,-1.9 -35,-2.4 -2,-0.3 2,-0.3 -0.959 17.5-174.2-140.8 159.0 30.9 7.3 92.0 70 70 A A E -AD 4 33A 0 -66,-2.3 -66,-1.8 -2,-0.3 2,-0.3 -0.958 4.2-166.4-154.8 160.5 27.6 9.0 91.2 71 71 A H E -AD 3 32A 2 -39,-2.5 -39,-2.2 -2,-0.3 2,-0.3 -0.990 9.5-165.7-154.5 149.3 23.8 8.5 91.6 72 72 A T E -AD 2 31A 0 -70,-1.7 -70,-2.3 -2,-0.3 2,-0.4 -0.994 27.8-160.9-138.2 139.5 20.5 9.8 90.3 73 73 A R E - D 0 30A 24 -43,-2.7 -44,-2.8 -2,-0.3 -43,-1.1 -0.898 34.1-140.2-141.7 150.2 17.4 9.0 92.2 74 74 A W - 0 0 50 -2,-0.4 2,-0.7 -47,-0.3 528,-0.1 -0.933 37.3-142.4 -93.5 111.7 13.6 8.7 92.4 75 75 A A + 0 0 10 -2,-0.7 3,-0.1 1,-0.2 -47,-0.1 -0.745 31.5 164.5 -84.2 120.0 12.8 10.0 95.9 76 76 A T + 0 0 103 -2,-0.7 2,-0.2 1,-0.1 -1,-0.2 0.921 55.7 56.0 -92.3 -67.5 10.0 8.0 97.4 77 77 A H S S- 0 0 155 2,-0.1 -1,-0.1 0, 0.0 0, 0.0 -0.450 111.4 -13.6 -69.7 135.7 9.9 8.7 101.1 78 78 A G S S- 0 0 56 -2,-0.2 3,-0.1 2,-0.1 0, 0.0 0.388 104.6 -48.2 58.2 158.8 9.6 12.3 102.2 79 79 A E S S- 0 0 172 1,-0.1 -3,-0.1 0, 0.0 -2,-0.1 -0.449 76.4 -96.3 -53.3 132.8 10.0 15.4 100.0 80 80 A P - 0 0 50 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.213 52.3-176.0 -47.8 145.3 13.3 15.0 98.0 81 81 A S >> - 0 0 35 1,-0.1 3,-0.6 -3,-0.1 4,-0.6 -0.986 38.6-128.3-152.4 148.6 16.1 16.8 99.8 82 82 A E G >4 S+ 0 0 88 -2,-0.3 3,-0.6 1,-0.2 -1,-0.1 0.807 109.6 64.4 -67.1 -32.8 19.8 17.5 99.1 83 83 A V G 34 S+ 0 0 75 1,-0.2 -1,-0.2 -3,-0.1 36,-0.1 0.784 108.0 41.9 -56.3 -32.8 20.7 16.1 102.6 84 84 A N G <4 S+ 0 0 22 -3,-0.6 -1,-0.2 36,-0.1 -2,-0.2 0.540 89.0 114.1 -93.5 -13.6 19.4 12.8 101.4 85 85 A A << - 0 0 0 -4,-0.6 -37,-0.1 -3,-0.6 37,-0.1 -0.313 69.1 -83.3 -56.9 143.9 21.0 12.9 97.9 86 86 A H S S+ 0 0 5 -54,-0.1 -15,-0.3 2,-0.1 10,-0.1 -0.518 93.7 66.2 -83.1 164.5 23.7 10.3 97.3 87 87 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 9,-0.2 0.560 66.5-165.1 -68.5 153.0 26.6 9.7 97.7 88 88 A H E -H 95 0B 1 7,-2.1 7,-2.6 -2,-0.1 2,-0.3 -0.741 5.8-151.6-104.3 157.7 26.7 9.4 101.5 89 89 A V E -H 94 0B 35 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.779 28.4-168.1-130.7 158.4 29.8 9.4 103.6 90 90 A S E > S-H 93 0B 4 3,-2.1 3,-2.1 -2,-0.3 2,-0.3 -0.667 75.0 -73.6-141.7 88.1 31.3 8.2 106.8 91 91 A E T 3 S+ 0 0 129 1,-0.3 -1,-0.3 -2,-0.1 72,-0.1 -0.455 123.7 1.7 58.6-111.8 34.5 10.3 107.0 92 92 A H T 3 S+ 0 0 28 -2,-0.3 71,-2.8 -3,-0.1 2,-0.3 0.656 116.6 89.8 -75.4 -22.8 36.7 8.6 104.3 93 93 A I E < -HI 90 162B 0 -3,-2.1 -3,-2.1 69,-0.2 2,-0.4 -0.646 55.9-173.8 -77.6 135.3 34.0 6.0 103.2 94 94 A V E -HI 89 161B 0 67,-2.7 67,-2.2 -2,-0.3 2,-0.3 -0.996 6.7-177.7-133.0 136.2 31.7 7.2 100.3 95 95 A V E -HI 88 160B 0 -7,-2.6 -7,-2.1 -2,-0.4 2,-0.3 -0.970 19.9-175.6-140.6 143.1 28.8 5.1 99.1 96 96 A V E + I 0 159B 0 63,-1.7 63,-2.0 -2,-0.3 2,-0.3 -0.948 21.5 178.7-127.4 151.1 25.9 5.0 96.5 97 97 A H E - I 0 158B 13 -2,-0.3 2,-0.3 61,-0.2 61,-0.2 -0.995 21.3-154.9-151.7 157.7 23.3 2.3 96.5 98 98 A N E + I 0 157B 9 59,-2.5 59,-2.3 -2,-0.3 2,-0.2 -0.891 63.6 21.1-122.1 153.6 20.1 1.0 94.7 99 99 A G E S- I 0 156B 19 -2,-0.3 2,-0.4 57,-0.2 57,-0.3 -0.570 92.5 -49.9 93.8-149.0 17.4 -1.1 96.2 100 100 A I - 0 0 39 55,-3.0 2,-0.9 -2,-0.2 55,-0.5 -0.979 19.7-147.2-142.7 136.0 16.6 -1.6 99.8 101 101 A I > - 0 0 1 -2,-0.4 3,-1.8 1,-0.2 53,-0.2 -0.839 20.8-168.2 -97.0 97.9 18.2 -2.4 103.2 102 102 A E T 3 S+ 0 0 130 51,-1.4 3,-0.4 -2,-0.9 52,-0.2 0.804 84.4 47.9 -61.4 -33.1 15.4 -4.3 104.8 103 103 A N T 3> S+ 0 0 40 50,-1.1 4,-1.7 1,-0.2 -1,-0.3 -0.054 71.0 130.4-102.6 35.2 17.0 -4.3 108.2 104 104 A H H <> + 0 0 21 -3,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.911 68.0 55.6 -43.0 -49.4 17.8 -0.6 108.1 105 105 A E H > S+ 0 0 94 -3,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.886 107.2 40.3 -69.3 -49.2 16.4 -0.1 111.5 106 106 A P H > S+ 0 0 85 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.918 116.5 51.7 -63.5 -39.0 18.2 -2.5 113.8 107 107 A L H X S+ 0 0 9 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.922 108.8 52.3 -62.0 -41.9 21.6 -1.8 112.1 108 108 A R H X S+ 0 0 35 -4,-2.4 4,-2.8 -5,-0.3 -1,-0.2 0.919 108.4 48.5 -58.1 -49.4 21.0 1.9 112.5 109 109 A E H X S+ 0 0 99 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.929 111.7 51.3 -59.2 -44.0 20.3 1.6 116.3 110 110 A E H X S+ 0 0 87 -4,-2.2 4,-0.5 2,-0.2 -1,-0.2 0.815 112.1 45.0 -63.6 -33.6 23.5 -0.5 116.6 111 111 A L H >X>S+ 0 0 0 -4,-1.9 5,-2.0 2,-0.2 3,-1.1 0.943 110.5 54.1 -77.8 -44.1 25.6 2.1 114.8 112 112 A K H ><5S+ 0 0 87 -4,-2.8 3,-1.5 1,-0.3 -2,-0.2 0.927 108.8 50.1 -42.7 -55.0 24.1 5.0 116.8 113 113 A A H 3<5S+ 0 0 93 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.615 105.3 56.4 -67.5 -17.5 25.0 3.1 120.0 114 114 A R H <<5S- 0 0 93 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.537 130.9 -93.9 -87.0 -11.8 28.6 2.6 118.7 115 115 A G T <<5S+ 0 0 59 -3,-1.5 -3,-0.2 -4,-0.9 -2,-0.2 0.492 75.1 142.4 118.4 8.5 28.8 6.4 118.3 116 116 A Y < - 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