==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-MAY-11 2YKY . COMPND 2 MOLECULE: BETA-TRANSAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MESORHIZOBIUM SP. LUK; . AUTHOR G.G.WYBENGA,C.G.CRISMARU,D.B.JANSSEN,B.W.DIJKSTRA . 1295 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44666.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 936 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 76 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 8.5 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 . 9 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 0.2 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 . 69 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 148 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 459 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 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 3 0 6 0 0 0 3 3 3 9 3 0 3 6 0 0 0 0 0 0 3 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 3 6 3 0 3 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 3 6 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 3 3 0 0 3 0 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 14 A S 0 0 140 0, 0.0 377,-0.0 0, 0.0 375,-0.0 0.000 360.0 360.0 360.0 155.1 11.8 60.6 58.1 2 15 A D - 0 0 127 4,-0.1 2,-0.3 3,-0.0 3,-0.0 -0.268 360.0-166.6 -60.8 137.5 12.2 57.6 55.8 3 16 A T > - 0 0 54 1,-0.1 4,-2.2 0, 0.0 5,-0.1 -0.922 30.8-127.6-123.5 154.5 9.9 54.6 56.3 4 17 A A H > S+ 0 0 86 -2,-0.3 4,-2.3 2,-0.2 5,-0.2 0.867 110.9 56.8 -63.3 -39.1 10.0 51.1 55.0 5 18 A E H > S+ 0 0 133 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.913 110.1 43.3 -56.3 -49.0 6.4 51.4 53.8 6 19 A K H > S+ 0 0 12 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.890 111.6 54.4 -68.2 -38.0 7.2 54.5 51.7 7 20 A A H X S+ 0 0 47 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.892 108.7 48.9 -63.0 -38.7 10.4 52.9 50.4 8 21 A Q H X S+ 0 0 154 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.894 109.5 51.8 -66.9 -41.1 8.4 49.8 49.2 9 22 A A H X S+ 0 0 26 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.912 111.9 47.2 -60.1 -43.3 5.8 52.1 47.5 10 23 A I H X S+ 0 0 12 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.911 109.6 52.4 -65.7 -44.2 8.7 53.9 45.7 11 24 A A H X S+ 0 0 44 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.915 110.7 48.7 -58.6 -42.4 10.3 50.6 44.6 12 25 A A H X S+ 0 0 53 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.923 112.3 48.0 -61.6 -45.0 7.0 49.5 43.2 13 26 A A H X S+ 0 0 7 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.904 113.0 47.9 -63.4 -42.8 6.6 52.8 41.3 14 27 A R H X S+ 0 0 68 -4,-3.2 4,-2.5 2,-0.2 -1,-0.2 0.879 111.0 51.5 -64.9 -38.1 10.1 52.6 39.9 15 28 A N H X S+ 0 0 95 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.899 110.6 47.2 -67.8 -39.8 9.7 49.0 38.9 16 29 A T H X S+ 0 0 38 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.922 112.2 50.7 -63.9 -46.8 6.4 49.8 37.0 17 30 A F H X S+ 0 0 12 -4,-2.3 4,-1.0 2,-0.2 -2,-0.2 0.919 112.7 47.0 -55.0 -46.3 8.2 52.8 35.4 18 31 A A H >< S+ 0 0 29 -4,-2.5 3,-0.6 1,-0.2 -2,-0.2 0.929 112.2 48.6 -63.5 -47.9 11.1 50.6 34.3 19 32 A R H 3< S+ 0 0 161 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.846 113.9 47.0 -61.7 -35.9 8.8 47.8 32.9 20 33 A D H 3< S+ 0 0 85 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.642 113.9 48.1 -83.9 -14.1 6.7 50.3 30.9 21 34 A N S+ 0 0 78 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.791 73.9 54.8 -67.0 -30.2 12.2 49.5 28.1 23 36 A V H > S+ 0 0 81 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.941 110.5 45.9 -68.2 -45.6 13.3 51.6 25.1 24 37 A S H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.898 110.9 55.4 -58.4 -41.6 14.3 54.5 27.4 25 38 A A H X S+ 0 0 30 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.917 109.0 46.0 -56.6 -46.6 16.0 51.9 29.7 26 39 A G H X S+ 0 0 42 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.878 109.3 54.6 -65.3 -40.1 18.1 50.7 26.8 27 40 A H H X S+ 0 0 20 -4,-2.2 4,-3.1 1,-0.2 -1,-0.2 0.876 103.0 56.4 -63.9 -38.2 19.0 54.2 25.7 28 41 A H H X S+ 0 0 20 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.939 106.9 49.5 -58.0 -46.4 20.3 55.0 29.2 29 42 A E H < S+ 0 0 99 -4,-1.5 4,-0.3 1,-0.2 -1,-0.2 0.912 113.3 46.7 -59.9 -42.1 22.8 52.1 29.0 30 43 A R H >< S+ 0 0 64 -4,-1.9 3,-1.8 1,-0.2 4,-0.3 0.930 108.2 55.5 -62.8 -48.2 23.9 53.2 25.5 31 44 A A H >X S+ 0 0 1 -4,-3.1 4,-2.1 1,-0.3 3,-1.7 0.805 94.0 70.0 -56.8 -33.0 24.3 56.9 26.7 32 45 A R T 3< S+ 0 0 111 -4,-1.7 5,-0.3 1,-0.3 -1,-0.3 0.688 87.8 66.5 -57.6 -21.8 26.7 55.8 29.5 33 46 A R T <4 S+ 0 0 162 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.688 116.2 21.3 -76.0 -18.3 29.3 54.9 26.9 34 47 A S T <4 S+ 0 0 10 -3,-1.7 522,-2.3 -4,-0.3 -2,-0.2 0.590 124.0 43.1-126.9 -20.8 29.8 58.6 25.9 35 48 A M S >< S- 0 0 1 -4,-2.1 3,-2.8 520,-0.2 -1,-0.3 -0.979 96.1 -92.6-127.1 145.1 28.6 60.8 28.7 36 49 A P G > S- 0 0 0 0, 0.0 3,-1.4 0, 0.0 -3,-0.1 -0.351 112.7 -9.7 -59.3 122.1 29.2 60.3 32.5 37 50 A G G 3 S- 0 0 1 -5,-0.3 -5,-0.2 1,-0.2 3,-0.1 0.729 123.3 -71.3 57.7 23.0 26.2 58.3 33.7 38 51 A G G < S+ 0 0 2 -3,-2.8 2,-0.3 -7,-0.4 -1,-0.2 0.781 109.1 121.5 66.2 30.7 24.6 58.9 30.3 39 52 A N < + 0 0 0 -3,-1.4 -1,-0.2 -8,-0.1 3,-0.1 -0.949 40.5 168.1-135.9 139.9 24.1 62.5 31.3 40 53 A T S S+ 0 0 0 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.255 86.7 42.3-127.6 6.4 25.1 66.0 30.3 41 54 A R S > S- 0 0 0 1,-0.1 3,-2.3 692,-0.1 4,-0.4 -0.789 76.4-149.4-155.3 104.0 22.8 68.0 32.5 42 55 A S G > S+ 0 0 18 686,-2.0 3,-1.8 1,-0.3 687,-0.2 0.778 90.3 60.0 -55.2 -38.2 22.6 66.6 36.1 43 56 A I G 3 S+ 0 0 22 1,-0.3 -1,-0.3 685,-0.0 686,-0.1 0.619 93.5 66.4 -72.1 -11.2 19.1 67.5 36.9 44 57 A L G < S+ 0 0 9 -3,-2.3 2,-0.3 353,-0.1 -1,-0.3 0.678 86.1 92.0 -77.9 -19.6 17.7 65.5 34.0 45 58 A F < + 0 0 28 -3,-1.8 2,-0.3 -4,-0.4 -7,-0.0 -0.610 45.6 151.8 -79.7 134.4 18.9 62.3 35.8 46 59 A H - 0 0 19 -2,-0.3 675,-0.1 352,-0.0 -2,-0.0 -0.967 42.0 -62.4-146.7 154.9 16.6 60.3 38.1 47 60 A R S S+ 0 0 117 -2,-0.3 2,-0.0 1,-0.2 0, 0.0 -0.472 112.2 17.7 -73.4 152.7 16.5 56.7 39.1 48 61 A P S S- 0 0 45 0, 0.0 -1,-0.2 0, 0.0 -34,-0.0 -0.952 131.2 -56.3 -74.3 -24.3 16.0 54.1 37.7 49 62 A F - 0 0 15 -2,-0.0 2,-0.1 -21,-0.0 -24,-0.1 -0.917 56.6 -98.2-168.4 157.1 16.7 56.0 34.5 50 63 A P - 0 0 4 0, 0.0 2,-0.2 0, 0.0 -22,-0.1 -0.481 41.2 -98.1 -82.7 158.7 15.3 59.2 32.9 51 64 A L - 0 0 2 -7,-0.1 484,-0.8 -2,-0.1 2,-0.5 -0.513 29.2-144.3 -66.0 137.1 12.6 59.3 30.1 52 65 A V B -a 535 0A 3 -2,-0.2 12,-2.3 482,-0.1 2,-0.3 -0.954 17.9-145.3-101.1 125.5 14.0 59.7 26.6 53 66 A I E -B 63 0B 3 482,-3.1 484,-0.5 -2,-0.5 10,-0.3 -0.718 15.5-168.4 -95.9 140.8 11.6 61.9 24.5 54 67 A A E - 0 0 50 8,-3.0 2,-0.3 1,-0.4 9,-0.2 0.857 65.3 -20.6 -91.4 -44.2 11.1 61.3 20.8 55 68 A Q E -B 62 0B 58 7,-1.3 7,-2.5 477,-0.1 -1,-0.4 -0.982 54.0-164.2-164.4 153.0 9.2 64.4 19.7 56 69 A G E -B 61 0B 1 472,-2.4 2,-0.3 -2,-0.3 5,-0.2 -0.987 4.7-174.4-151.1 147.2 7.0 67.2 21.0 57 70 A T E > -B 60 0B 78 3,-1.4 3,-2.2 -2,-0.3 25,-0.1 -0.993 64.4 -29.3-134.6 139.1 4.6 69.9 19.7 58 71 A G T 3 S- 0 0 16 -2,-0.3 25,-2.7 1,-0.3 27,-0.1 -0.323 127.9 -18.9 59.2-126.5 2.9 72.7 21.7 59 72 A S T 3 S+ 0 0 28 348,-0.3 12,-3.6 23,-0.2 2,-0.3 0.417 123.4 81.4 -91.6 0.2 2.5 71.6 25.4 60 73 A R E < +BC 57 70B 112 -3,-2.2 -3,-1.4 10,-0.2 2,-0.3 -0.780 48.6 177.5-114.2 149.6 2.8 67.9 24.7 61 74 A F E -BC 56 69B 0 8,-2.0 8,-2.5 -2,-0.3 2,-0.4 -0.951 16.9-142.0-141.0 166.1 5.6 65.4 24.1 62 75 A Q E -BC 55 68B 60 -7,-2.5 -8,-3.0 -2,-0.3 -7,-1.3 -0.994 16.3-136.5-129.4 132.7 5.9 61.6 23.5 63 76 A D E > -B 53 0B 4 4,-2.6 3,-1.7 -2,-0.4 -10,-0.3 -0.268 33.7 -99.3 -81.4 175.0 8.6 59.3 24.9 64 77 A V T 3 S+ 0 0 45 -12,-2.3 -11,-0.1 1,-0.3 -1,-0.1 0.557 123.0 58.7 -74.1 -8.9 10.5 56.6 22.9 65 78 A D T 3 S- 0 0 37 -13,-0.3 -1,-0.3 2,-0.1 -12,-0.1 0.250 122.5-104.4-100.2 9.3 8.1 54.0 24.4 66 79 A G S < S+ 0 0 64 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.511 72.4 140.2 86.3 7.3 5.1 55.8 22.9 67 80 A H - 0 0 66 1,-0.0 -4,-2.6 2,-0.0 2,-0.3 -0.653 40.3-143.5 -84.0 141.2 3.6 57.4 26.0 68 81 A A E +C 62 0B 41 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.808 20.3 179.2-104.5 145.4 2.2 61.0 25.7 69 82 A Y E -C 61 0B 8 -8,-2.5 -8,-2.0 -2,-0.3 2,-0.5 -0.970 31.8-123.5-139.2 153.4 2.5 63.7 28.4 70 83 A V E -Cd 60 394B 8 323,-2.3 325,-2.8 -2,-0.3 2,-1.1 -0.877 37.0-127.5 -90.9 130.8 1.5 67.3 29.0 71 84 A N E + d 0 395B 6 -12,-3.6 334,-0.3 -2,-0.5 325,-0.2 -0.701 41.2 161.1 -89.5 96.7 4.7 69.2 29.8 72 85 A F + 0 0 0 323,-2.6 331,-2.8 -2,-1.1 324,-0.2 0.529 69.0 70.7 -86.1 -9.2 4.3 71.1 33.1 73 86 A L S >> S- 0 0 1 322,-0.8 4,-0.9 329,-0.2 3,-0.6 0.882 75.6-166.6 -75.3 -39.6 8.0 71.4 33.6 74 87 A G G >4> - 0 0 2 1,-0.2 5,-2.3 2,-0.2 3,-0.9 0.896 67.3 -61.3 52.2 46.2 8.4 73.9 30.8 75 88 A E G >45S- 0 0 10 1,-0.3 3,-2.0 3,-0.2 -1,-0.2 0.836 95.7 -59.6 52.1 44.8 12.2 73.6 30.7 76 89 A Y G <45S- 0 0 2 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.2 0.895 109.9 -44.3 48.8 46.3 12.7 74.8 34.3 77 90 A T G <<5S+ 0 0 0 -4,-0.9 191,-0.5 -3,-0.9 3,-0.3 0.179 130.4 90.8 86.5 -11.7 11.0 78.1 33.3 78 91 A A T < 5S+ 0 0 0 -3,-2.0 2,-1.1 189,-0.2 3,-0.3 0.783 72.7 71.1 -75.3 -28.4 12.9 78.6 30.0 79 92 A G > < + 0 0 3 -5,-2.3 3,-1.4 1,-0.2 -1,-0.2 -0.220 55.5 137.8 -90.9 46.1 10.3 76.7 27.9 80 93 A L T 3 + 0 0 0 -2,-1.1 326,-3.1 -3,-0.3 327,-0.2 0.663 68.3 51.3 -64.2 -20.2 7.6 79.4 28.1 81 94 A F T 3 S- 0 0 2 1,-0.3 3,-0.4 -3,-0.3 -1,-0.3 0.338 105.1-123.9-105.6 6.2 6.6 79.0 24.5 82 95 A G < - 0 0 5 -3,-1.4 3,-0.4 1,-0.2 -1,-0.3 -0.262 46.1 -56.4 71.2-167.1 6.0 75.3 24.4 83 96 A H S S+ 0 0 3 -25,-2.7 447,-2.8 1,-0.2 -1,-0.2 0.577 128.2 20.5 -87.6 -12.1 7.8 73.0 21.9 84 97 A S + 0 0 52 -3,-0.4 -1,-0.2 445,-0.2 -2,-0.1 -0.179 69.5 175.8-156.8 48.1 6.8 74.5 18.6 85 98 A H > - 0 0 26 -3,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.427 25.4-145.0 -68.3 126.9 5.7 78.2 18.9 86 99 A P H > S+ 0 0 96 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.822 98.8 51.4 -64.8 -29.5 5.0 79.7 15.5 87 100 A V H > S+ 0 0 42 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.900 111.4 47.5 -74.2 -39.8 6.3 83.1 16.4 88 101 A I H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.941 111.5 51.8 -60.5 -45.5 9.6 81.6 17.7 89 102 A R H X S+ 0 0 98 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.908 108.0 51.6 -58.6 -42.4 9.8 79.6 14.5 90 103 A A H X S+ 0 0 33 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.879 108.5 51.1 -61.7 -39.2 9.4 82.7 12.5 91 104 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.867 108.6 51.5 -65.4 -38.5 12.2 84.4 14.4 92 105 A V H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.929 110.2 49.5 -61.5 -45.7 14.5 81.4 13.8 93 106 A E H X S+ 0 0 89 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.909 111.0 49.2 -60.0 -43.3 13.7 81.7 10.0 94 107 A R H X S+ 0 0 107 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.887 109.4 52.7 -62.8 -40.6 14.4 85.5 10.1 95 108 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.916 108.1 49.8 -62.1 -43.1 17.7 84.8 11.9 96 109 A L H < S+ 0 0 19 -4,-2.3 4,-0.2 1,-0.2 -1,-0.2 0.867 108.8 53.9 -62.7 -36.9 18.8 82.3 9.2 97 110 A A H < S+ 0 0 65 -4,-1.8 389,-0.3 1,-0.2 -1,-0.2 0.836 108.5 48.1 -66.2 -37.1 17.9 84.9 6.6 98 111 A V H < S- 0 0 26 -4,-1.8 388,-2.4 387,-0.1 -2,-0.2 0.928 122.7-107.9 -65.8 -46.7 20.2 87.4 8.2 99 112 A G < - 0 0 0 -4,-2.5 3,-0.4 386,-0.2 2,-0.2 -0.156 22.2-101.3 123.8 142.4 22.9 84.8 8.4 100 113 A L S S+ 0 0 11 413,-2.6 603,-0.1 -4,-0.2 205,-0.0 -0.619 93.5 6.7 -91.0 150.1 24.7 82.7 11.1 101 114 A N + 0 0 13 -2,-0.2 -1,-0.2 601,-0.2 404,-0.2 0.844 68.7 168.1 53.4 44.0 28.1 83.3 12.6 102 115 A L - 0 0 7 -3,-0.4 -1,-0.1 2,-0.2 402,-0.1 0.534 37.6-138.0 -71.2 -8.3 28.5 86.8 10.9 103 116 A S S S+ 0 0 0 1,-0.2 2,-0.3 198,-0.1 -1,-0.1 0.654 73.2 71.0 67.1 19.4 31.5 87.6 13.2 104 117 A T S S- 0 0 6 200,-0.1 -1,-0.2 376,-0.0 2,-0.2 -0.914 91.1 -78.0-155.1 167.4 30.2 91.1 13.7 105 118 A Q B -e 482 0C 12 376,-0.7 378,-3.1 -2,-0.3 2,-0.3 -0.492 39.8-165.9 -72.7 146.6 27.5 93.1 15.4 106 119 A T >> - 0 0 11 376,-0.2 3,-1.1 -2,-0.2 4,-0.6 -0.884 35.4-110.3-123.9 165.6 24.0 93.3 13.9 107 120 A E H 3> S+ 0 0 48 376,-0.5 4,-2.3 -2,-0.3 3,-0.3 0.752 110.0 76.2 -62.2 -24.8 21.1 95.6 14.7 108 121 A N H 3> S+ 0 0 43 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.833 89.0 57.6 -59.6 -34.0 19.3 92.7 16.2 109 122 A E H <> S+ 0 0 2 -3,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.931 108.9 44.2 -55.5 -52.1 21.6 92.9 19.3 110 123 A A H X S+ 0 0 13 -4,-0.6 4,-2.5 -3,-0.3 -2,-0.2 0.875 112.0 52.0 -66.8 -40.8 20.6 96.5 20.0 111 124 A L H X S+ 0 0 34 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.911 112.3 46.2 -62.9 -43.5 16.9 95.9 19.4 112 125 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.921 111.9 51.2 -63.1 -45.0 16.9 93.0 21.9 113 126 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 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8.9-168.6-116.5 154.4 41.9 85.0 10.2 833 416 B A E -B 788 0L 0 -331,-2.8 -326,-0.2 -2,-0.3 -45,-0.2 -0.859 26.8-132.4-139.7 102.0 40.2 81.6 10.6 834 417 B L - 0 0 1 -47,-2.5 2,-0.1 -2,-0.3 -47,-0.1 -0.336 17.9-152.5 -65.1 128.8 39.4 80.1 7.3 835 418 B S > - 0 0 3 -334,-0.3 3,-1.0 -2,-0.1 -324,-0.2 -0.436 31.3-106.8 -86.4 169.8 35.8 78.7 6.9 836 419 B L T 3 S+ 0 0 52 -326,-3.2 -325,-0.1 1,-0.2 -326,-0.1 0.589 118.6 62.9 -69.9 -11.8 34.9 75.9 4.5 837 420 B E T 3 S+ 0 0 73 -327,-0.2 2,-0.3 -349,-0.1 -348,-0.3 0.549 73.8 107.3 -93.3 -10.4 33.3 78.6 2.3 838 421 B I < + 0 0 11 -3,-1.0 2,-0.2 -350,-0.1 -350,-0.0 -0.558 51.2 174.7 -67.8 128.6 36.6 80.4 1.5 839 422 B A > - 0 0 56 -2,-0.3 4,-2.4 -350,-0.0 5,-0.3 -0.587 46.9 -73.8-127.1-173.3 37.6 79.7 -2.1 840 423 B D H > S+ 0 0 106 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.897 125.6 54.0 -52.2 -47.9 40.2 80.6 -4.7 841 424 B A H > S+ 0 0 79 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.907 111.7 44.3 -56.7 -46.7 38.6 84.1 -5.3 842 425 B G H > S+ 0 0 8 2,-0.2 4,-2.3 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1,-0.2 5,-0.2 0.877 108.4 52.0 -60.7 -42.9 49.0 96.3 -2.1 853 436 B F H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.908 108.9 50.7 -59.2 -44.9 49.4 97.1 1.6 854 437 B I H < S+ 0 0 11 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.929 116.5 40.6 -61.5 -44.9 53.1 96.4 1.4 855 438 B G H >< S+ 0 0 54 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.928 117.9 45.8 -68.5 -47.6 53.5 98.7 -1.6 856 439 B E H 3< S+ 0 0 105 -4,-3.1 3,-0.3 1,-0.2 -2,-0.2 0.792 118.7 41.9 -67.8 -29.9 51.2 101.5 -0.4 857 440 B Q T >X S+ 0 0 37 -4,-2.2 3,-1.5 -5,-0.2 4,-0.7 0.110 75.0 122.9-106.3 21.3 52.7 101.5 3.1 858 441 B R G X4 + 0 0 181 -3,-1.1 3,-1.0 1,-0.3 -1,-0.2 0.833 68.9 59.6 -51.5 -40.6 56.4 101.2 2.0 859 442 B A G 34 S+ 0 0 91 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.784 109.3 43.5 -61.6 -29.1 57.3 104.5 3.8 860 443 B L G <4 0 0 33 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.478 360.0 360.0 -95.4 -5.3 56.2 103.1 7.2 861 444 B L << 0 0 58 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.2 0.446 360.0 360.0-108.0 360.0 57.7 99.6 6.6 862 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 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