==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER AMINOACYL-TRNA SYNTHASE 09-MAY-97 1KMM . COMPND 2 MOLECULE: HISTIDYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.G.ARNEZ,C.S.FRANCKLYN,D.MORAS . 1503 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58201.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1103 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 59 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 251 16.7 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 . 4 0.3 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 . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 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 . 93 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 124 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 475 31.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 39 2.6 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 4 6 2 0 4 1 1 11 3 0 0 4 1 5 4 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 6 9 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 . 7 0 4 8 12 3 5 0 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 . 0 4 0 4 0 0 4 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 4 A N 0 0 122 0, 0.0 2,-0.3 0, 0.0 624,-0.2 0.000 360.0 360.0 360.0 148.5 8.0 -8.3 21.5 2 5 A I - 0 0 22 622,-0.5 2,-0.1 433,-0.0 479,-0.1 -0.773 360.0-155.3-104.3 141.9 6.2 -5.2 20.1 3 6 A Q - 0 0 126 -2,-0.3 432,-0.4 1,-0.1 2,-0.2 -0.440 32.2 -85.1-103.4-178.7 5.7 -1.8 21.8 4 7 A A - 0 0 19 -2,-0.1 430,-0.1 1,-0.1 3,-0.1 -0.632 49.5 -92.4 -90.9 149.0 3.0 0.8 21.2 5 8 A I > - 0 0 15 428,-0.4 3,-1.4 -2,-0.2 2,-0.1 -0.304 56.8 -99.9 -54.5 135.1 3.2 3.4 18.4 6 9 A R T 3 S+ 0 0 161 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 -0.458 108.9 26.8 -62.1 136.4 4.8 6.4 20.1 7 10 A G T 3 S+ 0 0 12 1,-0.2 113,-3.6 -2,-0.1 114,-1.5 0.520 99.1 100.9 88.1 6.4 2.2 9.0 21.1 8 11 A M < - 0 0 8 -3,-1.4 -1,-0.2 112,-0.2 2,-0.2 -0.991 60.1-151.0-127.1 117.4 -0.7 6.5 21.4 9 12 A N - 0 0 58 112,-0.5 2,-0.4 -2,-0.4 -4,-0.1 -0.468 13.1-138.8 -93.6 164.4 -1.7 5.3 24.9 10 13 A D - 0 0 17 -2,-0.2 2,-0.6 420,-0.1 420,-0.2 -0.934 16.8-147.8-113.0 135.3 -3.1 2.3 26.7 11 14 A Y B -A 429 0A 14 418,-3.2 418,-2.7 -2,-0.4 -2,-0.0 -0.951 20.2-152.5-112.5 111.6 -5.7 3.0 29.5 12 15 A L >> - 0 0 43 -2,-0.6 4,-3.0 416,-0.2 3,-0.7 -0.387 30.9 -93.8 -80.4 163.7 -5.4 0.3 32.1 13 16 A P H 3> S+ 0 0 24 0, 0.0 4,-1.5 0, 0.0 414,-0.2 0.879 121.2 55.3 -45.6 -43.7 -8.1 -1.0 34.5 14 17 A G H 3> S+ 0 0 59 1,-0.2 4,-0.5 2,-0.2 414,-0.0 0.898 117.7 30.0 -58.6 -45.9 -7.0 1.4 37.2 15 18 A E H X> S+ 0 0 55 -3,-0.7 4,-1.7 2,-0.2 3,-0.7 0.799 106.2 73.0 -84.3 -29.2 -7.4 4.6 35.2 16 19 A T H >X S+ 0 0 3 -4,-3.0 4,-2.1 411,-0.3 3,-0.6 0.922 93.8 59.0 -49.0 -43.1 -10.2 3.3 33.0 17 20 A A H 3X S+ 0 0 21 -4,-1.5 4,-1.7 1,-0.3 -1,-0.3 0.852 102.4 49.6 -54.2 -46.6 -12.3 3.6 36.1 18 21 A I H <>S+ 0 0 0 -4,-1.7 3,-1.6 -5,-0.2 5,-1.3 0.940 108.2 52.0 -68.4 -43.9 -25.5 16.7 28.0 31 34 A G H ><5S+ 0 0 23 -4,-2.4 3,-2.3 1,-0.3 -2,-0.2 0.893 99.4 62.1 -57.8 -41.4 -28.7 14.6 28.4 32 35 A S T 3<5S+ 0 0 17 -4,-2.1 657,-1.3 1,-0.3 -1,-0.3 0.605 104.3 51.3 -64.8 -5.1 -30.2 17.2 30.8 33 36 A Y T < 5S- 0 0 0 -3,-1.6 -1,-0.3 -4,-0.2 658,-0.2 0.448 116.7-111.8-108.2 -1.8 -30.0 19.7 27.9 34 37 A G T < 5 + 0 0 2 -3,-2.3 2,-0.3 -4,-0.3 -3,-0.2 0.630 62.7 152.3 80.9 17.3 -31.8 17.4 25.3 35 38 A Y < - 0 0 6 -5,-1.3 2,-0.3 65,-0.1 -1,-0.3 -0.615 34.7-141.0 -81.9 137.1 -28.7 16.8 23.1 36 39 A S E -b 102 0B 13 65,-2.9 67,-1.6 -2,-0.3 2,-0.2 -0.748 14.3-118.3-102.6 144.9 -28.6 13.6 21.1 37 40 A E E -b 103 0B 9 -2,-0.3 2,-0.4 65,-0.2 369,-0.3 -0.543 27.6-170.3 -79.4 141.5 -25.5 11.4 20.5 38 41 A I - 0 0 2 65,-2.4 2,-0.4 -2,-0.2 67,-0.3 -0.967 9.6-148.3-129.4 142.5 -24.4 10.9 16.9 39 42 A R B -I 401 0C 41 362,-2.6 362,-2.6 -2,-0.4 67,-0.1 -0.978 15.2-170.9-117.5 128.9 -21.7 8.4 15.8 40 43 A L - 0 0 18 -2,-0.4 360,-0.1 360,-0.2 359,-0.1 -0.908 29.3 -94.9-122.9 149.6 -19.3 9.1 12.9 41 44 A P - 0 0 2 0, 0.0 37,-0.1 0, 0.0 43,-0.1 -0.166 25.8-134.8 -55.9 144.7 -16.7 7.0 10.9 42 45 A I S S+ 0 0 5 35,-0.1 36,-2.5 66,-0.0 2,-0.4 0.756 88.3 51.1 -76.1 -25.9 -13.1 7.3 12.0 43 46 A V E +J 77 0D 1 34,-0.2 352,-0.4 352,-0.1 2,-0.3 -0.911 64.4 171.1-116.5 143.4 -11.7 7.6 8.4 44 47 A E E -J 76 0D 3 32,-2.1 32,-3.0 -2,-0.4 2,-0.1 -0.944 45.9 -75.0-142.6 161.9 -12.9 10.0 5.7 45 48 A Q E >> -J 75 0D 40 348,-0.4 3,-2.2 -2,-0.3 4,-0.7 -0.371 44.7-126.2 -57.4 131.1 -11.8 11.1 2.2 46 49 A T H 3> S+ 0 0 3 28,-1.8 4,-2.1 1,-0.3 3,-0.4 0.780 103.1 67.9 -52.4 -34.8 -8.9 13.4 2.6 47 50 A P H 3> S+ 0 0 56 0, 0.0 4,-3.1 0, 0.0 -1,-0.3 0.696 90.8 63.7 -61.6 -20.1 -10.4 16.2 0.5 48 51 A L H <> S+ 0 0 1 -3,-2.2 4,-3.5 2,-0.2 5,-0.3 0.944 107.2 40.6 -67.6 -49.9 -13.0 16.8 3.2 49 52 A F H X>S+ 0 0 0 -4,-0.7 4,-2.0 -3,-0.4 5,-0.5 0.894 117.2 49.9 -65.9 -38.4 -10.4 17.8 5.8 50 53 A K H X5S+ 0 0 80 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.963 117.8 40.0 -63.7 -49.5 -8.6 19.8 3.1 51 54 A R H <5S+ 0 0 66 -4,-3.1 -2,-0.2 -5,-0.1 -3,-0.2 0.942 124.0 37.5 -62.8 -51.4 -11.9 21.5 2.0 52 55 A A H <5S+ 0 0 3 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.2 0.938 121.3 38.1 -69.5 -54.7 -13.2 22.0 5.5 53 56 A I H <5S- 0 0 0 -4,-2.0 172,-1.8 -5,-0.3 -3,-0.2 0.713 112.5-106.7 -75.9 -20.8 -10.2 22.9 7.7 54 57 A G ><< - 0 0 12 -4,-1.2 3,-0.7 -5,-0.5 6,-0.3 0.217 14.7-108.6 101.6 138.3 -8.4 25.0 5.1 55 58 A E T 3 S+ 0 0 116 1,-0.2 2,-0.6 -4,-0.1 -1,-0.1 0.880 110.6 50.9 -68.5 -40.6 -5.3 24.3 3.0 56 59 A V T 3 S+ 0 0 111 4,-0.1 2,-0.3 5,-0.0 -1,-0.2 -0.213 87.1 111.6 -97.2 52.8 -2.8 26.6 4.8 57 60 A T S <> S- 0 0 9 -3,-0.7 4,-2.6 -2,-0.6 5,-0.2 -0.841 75.9-118.5-120.0 152.9 -3.5 25.4 8.2 58 61 A D H >>S+ 0 0 97 -2,-0.3 4,-2.3 165,-0.3 5,-0.5 0.851 110.3 55.7 -59.1 -37.0 -1.1 23.4 10.5 59 62 A V H >>S+ 0 0 8 164,-0.4 4,-2.2 2,-0.2 5,-1.4 0.977 115.4 35.0 -60.8 -56.6 -3.4 20.4 10.7 60 63 A V H 45S+ 0 0 11 -6,-0.3 4,-0.2 3,-0.2 -2,-0.2 0.926 117.5 55.2 -65.6 -42.8 -3.7 19.9 7.0 61 64 A E H <5S- 0 0 102 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.941 133.3 -9.5 -58.1 -51.8 -0.1 20.9 6.3 62 65 A K H <5S+ 0 0 101 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.401 121.1 59.9-136.7 10.9 1.6 18.5 8.7 63 66 A E T << + 0 0 22 -4,-2.2 48,-3.0 -5,-0.5 -3,-0.2 0.701 67.2 103.5-115.9 -21.5 -0.6 16.6 11.1 64 67 A M < - 0 0 6 -5,-1.4 2,-0.8 -4,-0.2 46,-0.1 -0.272 63.0-134.9 -65.3 148.8 -3.1 14.4 9.2 65 68 A Y E +K 77 0D 6 12,-0.7 12,-1.8 44,-0.3 2,-0.1 -0.784 40.2 170.1-102.9 84.5 -2.5 10.6 8.9 66 69 A T E +K 76 0D 52 -2,-0.8 2,-0.3 10,-0.2 10,-0.2 -0.444 5.1 153.0 -92.2 163.8 -3.4 10.2 5.2 67 70 A F E -K 75 0D 21 8,-1.5 8,-3.3 -2,-0.1 2,-0.3 -0.925 39.5 -89.0-177.5 167.6 -2.8 7.0 3.1 68 71 A E E -K 74 0D 91 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.708 25.9-137.2 -99.7 144.6 -4.2 5.3 0.1 69 72 A D > - 0 0 8 4,-3.4 3,-2.2 -2,-0.3 386,-0.0 -0.473 37.8 -99.6 -88.1 165.3 -7.0 2.8 -0.2 70 73 A R T 3 S+ 0 0 71 1,-0.3 1145,-0.3 -2,-0.1 -1,-0.1 0.795 123.8 54.0 -54.4 -28.3 -6.6 -0.3 -2.4 71 74 A N T 3 S- 0 0 61 1143,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.178 124.2 -98.7 -93.6 14.4 -8.7 1.5 -5.1 72 75 A G S < S+ 0 0 24 -3,-2.2 -2,-0.1 1,-0.3 1141,-0.1 0.105 77.4 139.1 94.4 -22.4 -6.5 4.6 -5.2 73 76 A D - 0 0 55 -5,-0.1 -4,-3.4 1140,-0.1 2,-0.5 -0.251 54.6-122.1 -59.2 143.4 -8.7 6.8 -3.0 74 77 A S E - K 0 68D 44 -6,-0.2 -28,-1.8 -3,-0.1 2,-0.4 -0.782 31.0-168.7 -90.3 122.8 -7.0 9.0 -0.4 75 78 A L E -JK 45 67D 0 -8,-3.3 -8,-1.5 -2,-0.5 2,-0.4 -0.925 5.7-165.5-115.0 139.5 -8.1 8.2 3.1 76 79 A T E -JK 44 66D 0 -32,-3.0 -32,-2.1 -2,-0.4 2,-0.3 -0.991 22.0-131.8-129.7 126.7 -7.5 10.3 6.3 77 80 A L E -JK 43 65D 1 -12,-1.8 -12,-0.7 -2,-0.4 -34,-0.2 -0.625 52.1 -97.3 -68.1 129.3 -7.9 9.3 9.9 78 81 A R - 0 0 23 -36,-2.5 31,-3.9 -2,-0.3 -1,-0.1 -0.229 32.5-167.8 -57.8 137.0 -9.9 12.3 11.3 79 82 A P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.555 80.4 2.3 -97.1 -14.7 -7.9 15.0 13.1 80 83 A E - 0 0 0 27,-0.1 4,-0.3 1,-0.0 29,-0.1 -0.916 69.2-125.1-155.4-179.2 -11.1 16.5 14.4 81 84 A G S > S+ 0 0 4 -2,-0.3 4,-2.4 1427,-0.2 5,-0.1 0.704 83.5 81.2-116.6 -17.6 -14.9 15.8 14.2 82 85 A T H > S+ 0 0 4 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.809 93.0 52.8 -58.3 -37.0 -16.8 18.7 12.9 83 86 A A H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.947 111.0 45.3 -66.0 -47.7 -16.1 18.0 9.3 84 87 A G H > S+ 0 0 5 -4,-0.3 4,-2.8 1,-0.2 5,-0.2 0.884 113.7 52.8 -63.9 -37.2 -17.3 14.4 9.5 85 88 A C H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.961 110.4 43.7 -63.4 -54.0 -20.3 15.6 11.4 86 89 A V H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.915 115.0 52.2 -58.1 -41.4 -21.3 18.3 8.8 87 90 A R H X S+ 0 0 5 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.912 109.6 46.3 -60.4 -49.6 -20.6 15.7 6.1 88 91 A A H X S+ 0 0 0 -4,-2.8 4,-1.1 1,-0.2 -1,-0.2 0.846 112.2 54.0 -63.2 -32.1 -22.8 13.0 7.6 89 92 A G H <>S+ 0 0 4 -4,-2.1 5,-2.7 -5,-0.2 6,-0.7 0.886 111.2 42.0 -70.5 -43.4 -25.5 15.7 8.2 90 93 A I H ><5S+ 0 0 31 -4,-2.3 3,-1.7 3,-0.2 -2,-0.2 0.962 112.8 57.1 -67.3 -45.2 -25.7 16.8 4.6 91 94 A E H 3<5S+ 0 0 59 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.694 115.1 34.1 -58.1 -27.4 -25.4 13.2 3.4 92 95 A H T 3<5S- 0 0 81 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.241 111.2-114.0-112.8 9.1 -28.5 12.1 5.3 93 96 A G T < 5S+ 0 0 43 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.900 70.8 137.1 60.2 46.1 -30.5 15.3 5.0 94 97 A L < + 0 0 29 -5,-2.7 -4,-0.2 -6,-0.2 -5,-0.1 0.517 66.0 46.8 -97.1 -6.0 -30.5 16.1 8.7 95 98 A L S > S+ 0 0 6 -6,-0.7 3,-1.8 -5,-0.1 2,-0.3 0.765 72.8 107.0-110.8 -28.0 -29.7 19.8 8.3 96 99 A Y T 3 S- 0 0 125 1,-0.3 3,-0.1 -7,-0.2 167,-0.1 -0.393 109.8 -20.9 -60.0 117.7 -31.9 21.4 5.6 97 100 A N T 3 S+ 0 0 150 -2,-0.3 -1,-0.3 1,-0.2 2,-0.3 0.836 120.0 112.5 52.9 33.1 -34.5 23.6 7.4 98 101 A Q < - 0 0 85 -3,-1.8 2,-0.4 2,-0.0 -1,-0.2 -0.879 60.8-134.9-134.2 163.5 -33.9 21.5 10.5 99 102 A E + 0 0 34 -2,-0.3 2,-0.3 -3,-0.1 32,-0.2 -0.936 23.0 179.1-119.4 141.1 -32.5 22.0 14.0 100 103 A Q E - C 0 130B 24 30,-1.4 30,-0.9 -2,-0.4 2,-0.3 -0.981 19.8-167.4-142.7 147.9 -30.1 19.5 15.7 101 104 A R E + C 0 129B 2 -2,-0.3 -65,-2.9 28,-0.2 28,-0.2 -0.803 33.2 166.8-139.3 88.8 -28.4 19.5 19.0 102 105 A L E -bC 36 128B 3 26,-2.6 26,-1.7 -2,-0.3 2,-0.3 -0.649 20.5-174.5-107.8 163.2 -25.8 16.7 18.7 103 106 A W E -bC 37 127B 9 -67,-1.6 -65,-2.4 24,-0.2 2,-0.3 -0.940 4.5-174.0-149.4 159.2 -22.8 15.5 20.6 104 107 A Y E - C 0 126B 8 22,-2.0 22,-2.8 -2,-0.3 2,-0.3 -0.979 9.8-157.3-155.6 155.3 -20.2 12.8 19.9 105 108 A I E + C 0 125B 48 -2,-0.3 20,-0.2 -67,-0.3 -2,-0.0 -0.987 38.1 99.6-136.7 139.1 -17.2 11.2 21.7 106 109 A G E - C 0 124B 12 18,-2.1 18,-2.3 -2,-0.3 2,-0.2 -0.992 62.2 -49.3 172.5-169.8 -14.3 9.4 20.1 107 110 A P E - C 0 123B 20 0, 0.0 2,-0.4 0, 0.0 16,-0.2 -0.539 35.3-167.4 -91.6 155.8 -10.6 9.4 18.9 108 111 A M E - C 0 122B 1 14,-2.4 14,-2.4 -2,-0.2 2,-0.5 -0.973 15.1-139.4-138.8 141.6 -9.0 12.0 16.7 109 112 A F E + C 0 121B 0 -31,-3.9 2,-0.4 -2,-0.4 -44,-0.3 -0.941 25.5 164.6-116.1 126.1 -5.6 11.4 15.1 110 113 A R - 0 0 9 10,-2.4 2,-1.4 -2,-0.5 -46,-0.2 -0.998 34.1-136.7-139.3 133.4 -2.8 14.0 14.8 111 114 A H + 0 0 28 -48,-3.0 2,-0.3 -2,-0.4 9,-0.1 -0.690 54.7 136.2 -87.9 85.0 0.8 13.6 13.9 112 115 A E - 0 0 31 -2,-1.4 -2,-0.1 -105,-0.1 -49,-0.0 -0.814 65.7 -87.8-125.3 167.1 2.4 15.9 16.5 113 116 A R - 0 0 172 -2,-0.3 5,-0.1 1,-0.1 -106,-0.0 -0.654 52.9-113.7 -77.0 120.4 5.3 15.6 18.8 114 117 A P + 0 0 28 0, 0.0 2,-0.2 0, 0.0 5,-0.2 -0.355 49.7 159.7 -59.2 132.0 4.0 14.0 22.0 115 118 A Q B > -L 118 0E 85 3,-1.6 3,-0.6 -108,-0.1 127,-0.1 -0.741 59.3 -68.6-134.2-174.0 4.2 16.4 25.0 116 119 A K T 3 S+ 0 0 141 1,-0.3 126,-0.1 -2,-0.2 124,-0.0 0.877 135.0 17.6 -49.8 -48.2 2.4 16.5 28.4 117 120 A G T 3 S+ 0 0 2 124,-0.1 2,-0.5 2,-0.0 125,-0.3 0.314 112.4 83.2-110.3 7.2 -0.9 17.3 26.8 118 121 A R B < +L 115 0E 59 -3,-0.6 -3,-1.6 123,-0.1 2,-0.3 -0.957 47.7 163.8-113.7 130.4 -0.4 16.3 23.1 119 122 A Y - 0 0 38 -2,-0.5 3,-0.2 -5,-0.2 -111,-0.2 -0.817 42.8-125.1-134.7 171.8 -0.7 12.7 21.9 120 123 A R S S+ 0 0 31 -113,-3.6 -10,-2.4 1,-0.3 2,-0.5 0.725 107.4 39.2 -89.2 -32.7 -1.1 11.3 18.4 121 124 A Q E S+C 109 0B 5 -114,-1.5 -112,-0.5 -12,-0.2 -1,-0.3 -0.989 82.6 160.4-117.1 108.2 -4.3 9.4 19.3 122 125 A F E -C 108 0B 0 -14,-2.4 -14,-2.4 -2,-0.5 2,-0.4 -0.748 32.1-123.2-123.7 169.3 -6.4 11.7 21.5 123 126 A H E -C 107 0B 33 -2,-0.3 149,-1.9 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