==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-JUN-93 1TYT . COMPND 2 MOLECULE: TRYPANOTHIONE REDUCTASE, OXIDIZED FORM; . SOURCE 2 ORGANISM_SCIENTIFIC: CRITHIDIA FASCICULATA; . AUTHOR S.BAILEY,W.N.HUNTER . 973 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36432.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 722 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 83 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 154 15.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 12 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 81 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 117 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 239 24.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.4 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 5 1 1 0 0 0 0 0 5 3 0 1 1 0 0 2 0 0 0 1 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 3 5 6 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 3 5 4 8 1 1 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 . 4 2 2 2 2 1 1 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 M 0 0 166 0, 0.0 3,-0.3 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0-142.8 97.6 71.8 -13.6 2 2 A S + 0 0 118 1,-0.4 2,-0.2 2,-0.1 3,-0.0 0.057 360.0 16.6 -90.5 6.3 100.7 71.9 -11.5 3 3 A R S S- 0 0 80 149,-0.1 -1,-0.4 1,-0.0 150,-0.1 -0.520 84.1-140.9-174.5 109.5 100.4 68.2 -12.2 4 4 A A S S+ 0 0 26 -3,-0.3 2,-0.3 -2,-0.2 149,-0.2 0.866 83.7 27.4 -45.5 -40.3 98.1 67.1 -15.1 5 5 A Y E -a 153 0A 24 147,-2.1 149,-1.4 1,-0.1 26,-0.2 -0.901 61.2-146.0-128.1 155.7 96.7 64.1 -13.3 6 6 A D E S+ 0 0 27 24,-2.1 149,-2.0 1,-0.4 2,-0.3 0.878 88.1 3.6 -79.9 -37.9 96.2 63.1 -9.7 7 7 A L E -ab 155 31A 0 23,-1.5 25,-2.0 147,-0.2 2,-0.5 -0.990 56.1-159.8-153.4 137.2 96.8 59.4 -10.2 8 8 A V E -ab 156 32A 0 147,-1.6 149,-2.5 -2,-0.3 2,-0.5 -0.995 17.6-156.5-115.8 123.6 97.9 57.3 -13.1 9 9 A V E -ab 157 33A 0 23,-3.2 25,-2.8 -2,-0.5 2,-0.7 -0.927 4.0-157.6 -99.9 127.3 97.0 53.7 -12.6 10 10 A I E S+ab 158 34A 7 147,-2.4 149,-2.3 -2,-0.5 25,-0.1 -0.887 73.9 37.6 -99.9 109.0 99.1 51.1 -14.6 11 11 A G - 0 0 10 23,-2.3 24,-0.2 -2,-0.7 149,-0.1 0.089 63.5-150.3 117.6 111.5 96.9 47.9 -14.7 12 12 A A + 0 0 0 4,-0.1 37,-2.4 21,-0.1 38,-0.2 -0.375 62.8 113.8-103.7 51.1 93.1 48.1 -15.2 13 13 A G S > S- 0 0 11 146,-0.4 4,-2.6 36,-0.2 5,-0.4 -0.106 85.2 -53.3-101.9-153.2 92.6 44.9 -13.3 14 14 A S H > S+ 0 0 30 1,-0.2 4,-1.0 2,-0.2 5,-0.1 0.892 136.1 24.4 -55.5 -54.4 91.0 44.0 -9.9 15 15 A G H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.1 5,-0.2 0.942 121.8 56.4 -77.4 -44.7 92.8 46.4 -7.7 16 16 A G H > S+ 0 0 1 143,-0.3 4,-2.8 1,-0.2 -2,-0.2 0.838 109.4 44.2 -55.5 -42.8 93.7 48.9 -10.4 17 17 A L H X S+ 0 0 13 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.852 113.0 51.7 -77.5 -35.3 90.1 49.5 -11.5 18 18 A E H X S+ 0 0 64 -4,-1.0 4,-2.1 -5,-0.4 5,-0.2 0.894 115.6 42.8 -59.1 -47.8 88.8 49.7 -7.9 19 19 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.971 115.9 48.2 -64.5 -51.6 91.4 52.3 -7.1 20 20 A G H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 5,-0.2 0.902 114.7 43.6 -57.2 -50.7 90.9 54.2 -10.3 21 21 A W H X S+ 0 0 83 -4,-2.6 4,-3.1 2,-0.2 5,-0.5 0.924 114.1 47.3 -72.2 -44.4 87.2 54.4 -10.1 22 22 A N H X>S+ 0 0 22 -4,-2.1 4,-2.1 -5,-0.2 5,-0.8 0.954 110.7 52.4 -64.4 -42.4 86.8 55.3 -6.4 23 23 A A H X5S+ 0 0 0 -4,-2.6 6,-1.0 -5,-0.2 4,-0.8 0.946 121.7 33.8 -58.5 -41.7 89.5 58.0 -6.6 24 24 A A H X5S+ 0 0 1 -4,-2.0 4,-1.8 -5,-0.2 -2,-0.2 0.965 125.1 38.9 -75.3 -54.8 87.6 59.5 -9.6 25 25 A S H <5S+ 0 0 38 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.952 128.3 28.8 -64.2 -51.5 84.0 58.8 -8.7 26 26 A L H <5S+ 0 0 91 -4,-2.1 -1,-0.2 -5,-0.5 -3,-0.2 0.621 133.5 28.6 -85.8 -24.8 84.1 59.4 -5.0 27 27 A H H < S+F 45 0B 1 4,-1.9 4,-3.0 2,-0.1 3,-0.4 -0.436 72.4 18.4 96.0 177.0 92.1 37.3 -25.7 42 42 A P T 4 S+ 0 0 76 0, 0.0 138,-0.0 0, 0.0 0, 0.0 -0.329 102.1 28.7 -68.1 152.1 95.4 37.1 -27.7 43 43 A P T 4 S+ 0 0 93 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.972 141.4 11.9 -82.7 -24.4 97.9 38.7 -28.0 44 44 A H T 4 S- 0 0 52 -3,-0.4 2,-2.0 1,-0.2 -4,-0.1 0.740 77.5-160.3 -88.8 -22.4 97.8 40.0 -24.4 45 45 A Y B < S+F 41 0B 33 -4,-3.0 -4,-1.9 -6,-0.1 -1,-0.2 -0.504 71.5 67.5 76.7 -70.3 95.0 37.8 -22.9 46 46 A A + 0 0 10 -2,-2.0 2,-0.2 -6,-0.2 -7,-0.1 -0.421 64.5 155.3 -72.4 162.3 94.2 40.1 -20.0 47 47 A A > - 0 0 0 3,-0.3 3,-2.8 1,-0.1 -9,-0.2 -0.777 53.1 -14.9-165.0-172.7 92.7 43.4 -21.0 48 48 A L T 3 S+ 0 0 1 -11,-1.5 -35,-0.2 1,-0.3 -1,-0.1 -0.181 131.1 35.8 -38.9 130.9 90.4 46.1 -19.3 49 49 A G T 3> S- 0 0 2 -37,-2.4 4,-0.9 -36,-0.1 -1,-0.3 0.258 112.4-120.1 97.9 -19.6 89.0 44.4 -16.2 50 50 A G H <> - 0 0 5 -3,-2.8 4,-2.1 -38,-0.2 -3,-0.3 -0.077 44.7 -43.5 88.8-174.3 92.2 42.4 -15.5 51 51 A T H > S+ 0 0 39 2,-0.2 4,-2.7 3,-0.2 -1,-0.2 0.899 129.6 54.0 -63.1 -45.8 93.2 38.8 -15.3 52 52 A a H > S+ 0 0 9 4,-0.2 6,-1.2 1,-0.2 4,-1.0 0.964 112.9 42.4 -61.2 -54.0 90.2 37.7 -13.2 53 53 A V H < S+ 0 0 14 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.921 128.7 28.0 -54.2 -46.3 87.6 39.1 -15.7 54 54 A N H < S+ 0 0 0 -4,-2.1 -2,-0.2 -7,-0.2 -3,-0.2 0.814 139.9 1.2 -93.7 -38.8 89.4 37.9 -18.8 55 55 A V H < S+ 0 0 4 -4,-2.7 -3,-0.2 -5,-0.2 -1,-0.2 -0.184 123.1 45.3-146.0 44.8 91.5 34.8 -18.2 56 56 A G S X S+ 0 0 15 -4,-1.0 4,-2.4 -6,-0.1 5,-0.3 -0.433 104.0 2.4-155.8-136.2 90.9 34.0 -14.6 57 57 A a H > S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 -4,-0.1 0.769 123.7 45.3 -34.0 -56.0 88.1 33.7 -11.9 58 58 A V H > S+ 0 0 24 -6,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.977 118.0 38.1 -67.8 -57.1 85.1 34.4 -14.1 59 59 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 -2,-0.2 0.921 116.2 53.4 -61.9 -38.7 85.9 32.2 -17.2 60 60 A K H X S+ 0 0 21 -4,-2.4 4,-2.7 -8,-0.2 5,-0.2 0.933 107.7 51.7 -65.2 -35.5 87.3 29.4 -15.1 61 61 A K H X S+ 0 0 48 -4,-2.1 4,-2.9 -5,-0.3 -1,-0.2 0.916 110.9 46.0 -68.0 -39.7 84.2 29.3 -13.0 62 62 A L H X S+ 0 0 6 -4,-1.9 4,-3.0 1,-0.2 -1,-0.2 0.941 114.1 49.4 -65.6 -43.3 81.9 29.0 -16.0 63 63 A M H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.884 112.6 46.6 -62.9 -35.6 84.2 26.4 -17.4 64 64 A V H X S+ 0 0 7 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.885 110.6 53.5 -72.3 -41.5 84.1 24.5 -14.1 65 65 A T H X S+ 0 0 26 -4,-2.9 4,-0.7 -5,-0.2 -2,-0.2 0.961 110.4 47.6 -54.1 -47.6 80.3 24.9 -14.0 66 66 A G H >< S+ 0 0 0 -4,-3.0 3,-1.2 1,-0.2 -2,-0.2 0.933 110.5 51.7 -59.6 -46.5 80.2 23.3 -17.4 67 67 A A H >X S+ 0 0 1 -4,-2.1 3,-2.0 1,-0.2 4,-0.6 0.846 97.4 67.0 -59.4 -32.6 82.5 20.5 -16.3 68 68 A N H >X S+ 0 0 43 -4,-2.3 4,-1.9 1,-0.3 3,-0.6 0.807 85.3 73.4 -64.4 -23.0 80.3 19.7 -13.3 69 69 A Y H S+ 0 0 45 -3,-2.0 4,-1.8 -4,-0.2 -1,-0.2 0.973 108.4 37.7 -68.1 -44.8 79.5 15.4 -16.5 71 71 A D H X S+ 0 0 6 -4,-1.8 3,-0.8 2,-0.2 4,-0.5 0.982 115.3 45.1 -65.1 -49.5 74.0 14.0 -15.8 74 74 A R H >< S+ 0 0 89 -4,-1.8 3,-0.9 -5,-0.3 4,-0.3 0.898 113.7 52.0 -46.6 -44.6 75.6 10.6 -14.6 75 75 A E H >X S+ 0 0 7 -4,-2.5 3,-1.0 1,-0.2 4,-0.6 0.730 90.9 73.6 -72.6 -23.8 74.1 11.1 -11.1 76 76 A S H X<>S+ 0 0 0 -4,-1.8 5,-2.2 -3,-0.8 3,-0.6 0.772 82.0 73.9 -64.7 -20.9 70.5 11.8 -12.3 77 77 A A G X<5S+ 0 0 53 -3,-0.9 3,-1.6 -4,-0.5 -1,-0.2 0.914 90.2 54.9 -62.5 -34.2 70.2 8.1 -13.1 78 78 A G G <45S+ 0 0 25 -3,-1.0 -1,-0.2 -4,-0.3 -2,-0.2 0.794 107.0 51.5 -75.1 -25.5 69.9 7.1 -9.4 79 79 A F G <<5S- 0 0 0 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.289 129.0 -92.2 -91.8 9.8 67.0 9.5 -8.8 80 80 A G T < 5S+ 0 0 3 -3,-1.6 498,-1.9 -4,-0.2 2,-0.8 0.531 73.3 145.8 103.0 6.9 65.0 8.1 -11.8 81 81 A W E < -G 577 0C 10 -5,-2.2 2,-0.4 496,-0.2 -1,-0.2 -0.711 28.7-166.5 -86.2 106.3 66.0 10.3 -14.8 82 82 A E E +G 576 0C 95 494,-3.3 494,-3.0 -2,-0.8 2,-0.3 -0.776 22.4 145.5 -90.5 132.8 66.0 8.1 -17.8 83 83 A L - 0 0 19 -2,-0.4 2,-1.5 492,-0.3 492,-0.1 -0.938 63.2 -82.0-159.5 158.8 67.6 9.4 -21.0 84 84 A D >> - 0 0 67 487,-0.4 3,-1.8 -2,-0.3 4,-0.6 -0.575 44.2-167.8 -72.3 93.0 69.6 7.9 -23.9 85 85 A R G >4 S+ 0 0 86 -2,-1.5 3,-0.9 1,-0.3 -1,-0.2 0.805 79.8 63.2 -58.4 -22.5 73.0 7.8 -22.1 86 86 A E G 34 S+ 0 0 104 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.796 95.7 59.3 -74.2 -24.9 74.8 7.0 -25.2 87 87 A S G <4 S+ 0 0 20 -3,-1.8 -1,-0.2 484,-0.1 -2,-0.2 0.705 76.0 112.9 -78.1 -16.0 73.9 10.2 -26.8 88 88 A V << + 0 0 26 -3,-0.9 482,-0.2 -4,-0.6 480,-0.0 -0.304 38.5 158.4 -57.6 129.1 75.5 12.4 -24.2 89 89 A R E -H 569 0D 93 480,-2.8 480,-3.4 -2,-0.1 2,-0.3 -0.982 35.0-130.3-149.6 140.4 78.5 14.4 -25.6 90 90 A P E -H 568 0D 38 0, 0.0 2,-0.5 0, 0.0 478,-0.2 -0.643 14.0-152.6 -81.0 153.5 80.3 17.6 -24.5 91 91 A N > - 0 0 56 476,-2.2 4,-1.8 -2,-0.3 3,-0.2 -0.878 8.6-172.1-129.9 96.3 81.0 20.3 -27.0 92 92 A W H > S+ 0 0 11 -2,-0.5 4,-2.6 118,-0.3 5,-0.3 0.922 86.0 56.3 -56.3 -42.2 84.0 22.4 -26.2 93 93 A K H > S+ 0 0 120 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.886 104.6 52.6 -63.6 -37.0 83.4 24.9 -28.9 94 94 A A H > S+ 0 0 35 -3,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.913 110.8 48.6 -60.6 -43.0 79.9 25.6 -27.5 95 95 A L H X S+ 0 0 1 -4,-1.8 4,-2.8 471,-0.3 5,-0.3 0.985 111.2 47.6 -57.8 -59.9 81.5 26.2 -24.1 96 96 A I H X S+ 0 0 13 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.875 110.4 53.4 -56.4 -34.9 84.2 28.6 -25.3 97 97 A A H X S+ 0 0 57 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.963 112.5 42.5 -66.3 -48.9 81.7 30.6 -27.4 98 98 A A H X S+ 0 0 14 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.931 115.6 49.4 -61.3 -44.9 79.3 31.2 -24.4 99 99 A K H X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 5,-0.2 0.952 110.3 53.2 -56.7 -48.3 82.3 32.0 -22.1 100 100 A N H X S+ 0 0 45 -4,-3.0 4,-2.3 -5,-0.3 -2,-0.2 0.852 110.4 45.0 -57.8 -38.9 83.5 34.4 -24.8 101 101 A K H X S+ 0 0 97 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.899 113.5 51.0 -73.1 -34.7 80.3 36.2 -25.0 102 102 A A H X S+ 0 0 3 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.971 114.2 43.3 -63.7 -49.1 80.0 36.4 -21.2 103 103 A V H X S+ 0 0 0 -4,-3.1 4,-1.9 1,-0.2 3,-0.3 0.957 112.9 51.4 -68.7 -38.2 83.6 37.8 -20.9 104 104 A S H X S+ 0 0 32 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.813 103.3 61.3 -70.2 -19.4 83.1 40.2 -23.7 105 105 A G H X S+ 0 0 36 -4,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.958 105.1 46.7 -66.9 -40.1 80.0 41.4 -22.0 106 106 A I H >X S+ 0 0 47 -4,-1.8 4,-2.0 -3,-0.3 3,-0.6 0.931 108.0 55.8 -66.3 -46.1 82.0 42.4 -19.0 107 107 A N H 3X S+ 0 0 0 -4,-1.9 4,-1.4 1,-0.3 -1,-0.2 0.895 106.6 51.6 -54.2 -41.5 84.6 44.2 -21.2 108 108 A D H 3X S+ 0 0 88 -4,-2.1 4,-1.5 1,-0.2 -1,-0.3 0.856 105.2 54.8 -69.1 -29.1 81.8 46.2 -22.8 109 109 A S H < S+ 0 0 24 -4,-1.4 3,-0.9 -3,-0.5 -1,-0.2 0.791 106.6 64.5 -68.9 -33.4 84.8 55.3 -18.2 115 115 A A H 3< S+ 0 0 78 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.889 114.0 28.8 -63.5 -42.1 82.2 56.9 -20.5 116 116 A D T 3< S+ 0 0 135 -4,-1.8 2,-0.4 1,-0.1 -1,-0.2 -0.155 96.3 88.3-118.7 49.8 80.2 58.2 -17.6 117 117 A T S X S- 0 0 19 -3,-0.9 3,-2.2 3,-0.2 -92,-0.1 -0.888 75.0-135.5-133.4 99.0 82.7 58.8 -14.7 118 118 A E T 3 S+ 0 0 161 -2,-0.4 -89,-0.1 1,-0.3 -90,-0.1 -0.315 89.8 21.7 -55.5 138.8 84.0 62.4 -15.1 119 119 A G T 3 S+ 0 0 33 1,-0.2 -88,-2.2 -89,-0.1 2,-0.5 0.126 97.4 111.6 86.4 -18.0 87.8 62.5 -14.6 120 120 A L E < +c 31 0A 5 -3,-2.2 2,-0.4 -6,-0.2 -3,-0.2 -0.747 43.6 176.3 -88.5 123.1 88.2 58.7 -15.4 121 121 A T E -c 32 0A 51 -90,-2.3 -88,-3.3 -2,-0.5 2,-0.5 -0.978 27.2-141.3-130.4 145.6 90.1 57.9 -18.6 122 122 A F E -c 33 0A 40 -2,-0.4 2,-0.4 -90,-0.2 -88,-0.2 -0.851 18.7-174.0 -92.0 133.5 91.4 54.7 -20.4 123 123 A H E -c 34 0A 16 -90,-2.6 -88,-1.4 -2,-0.5 2,-0.3 -0.997 14.5-148.0-123.3 120.3 94.8 55.2 -22.1 124 124 A Q E +c 35 0A 97 -2,-0.4 2,-0.3 -90,-0.2 -88,-0.2 -0.776 51.2 66.0 -97.5 141.4 95.9 52.1 -24.1 125 125 A G S S- 0 0 11 -90,-1.4 2,-0.6 -2,-0.3 14,-0.2 -0.846 91.2 -50.4 143.3-178.6 99.5 51.1 -24.6 126 126 A F E -I 138 0E 35 12,-2.8 12,-3.0 -2,-0.3 2,-0.3 -0.785 52.9-140.2 -90.0 114.4 102.3 49.8 -22.4 127 127 A G E +I 137 0E 7 -2,-0.6 2,-0.3 10,-0.2 10,-0.2 -0.655 31.0 162.6 -77.7 137.7 102.8 51.9 -19.2 128 128 A A E -I 136 0E 1 8,-1.8 8,-2.7 -2,-0.3 2,-0.3 -0.945 34.2-109.7-149.1 156.1 106.4 52.4 -18.2 129 129 A L E +I 135 0E 0 165,-2.9 6,-0.2 -2,-0.3 169,-0.1 -0.721 25.5 175.4 -97.6 141.1 108.0 55.0 -15.8 130 130 A Q E S- 0 0 96 4,-2.8 2,-0.3 1,-0.7 -1,-0.2 0.704 79.4 -28.7-100.0 -52.9 110.2 57.9 -16.7 131 131 A D E > S-I 134 0E 60 3,-1.3 3,-2.1 168,-0.1 -1,-0.7 -0.945 81.7 -77.8-148.0 174.7 110.5 59.3 -13.2 132 132 A N T 3 S+ 0 0 52 -2,-0.3 3,-0.1 1,-0.3 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-1,-0.3 -4,-0.3 -2,-0.2 0.229 118.2 44.1-116.6 11.1 104.4 25.6 15.9 385 385 A K T <4 S+ 0 0 101 -3,-1.6 2,-0.3 -4,-0.3 -2,-0.2 0.693 112.7 48.2-112.7 -42.8 102.6 28.7 17.1 386 386 A Y < - 0 0 67 -4,-2.8 95,-0.3 -5,-0.2 -1,-0.2 -0.668 66.4-141.6-108.5 155.6 100.4 27.4 19.9 387 387 A D S S+ 0 0 89 1,-0.3 93,-3.2 -2,-0.3 2,-0.4 0.770 93.8 28.0 -75.1 -49.0 101.2 25.2 22.8 388 388 A Q E S+V 479 0J 54 91,-0.2 31,-1.9 92,-0.1 32,-0.7 -0.987 74.0 178.2-123.7 115.5 98.1 23.1 23.0 389 389 A V E -VW 478 418J 0 89,-1.8 89,-1.6 -2,-0.4 2,-0.4 -0.966 11.2-158.0-121.1 135.2 96.3 22.6 19.6 390 390 A A E -VW 477 417J 0 27,-2.1 27,-3.0 -2,-0.4 2,-0.6 -0.946 2.2-155.7-115.5 141.2 93.2 20.6 19.1 391 391 A V E -VW 476 416J 0 85,-3.0 84,-2.9 -2,-0.4 85,-1.4 -0.963 7.6-169.7-115.9 116.5 92.1 19.1 15.8 392 392 A Y E - W 0 415J 14 23,-2.7 23,-2.3 -2,-0.6 2,-0.3 -0.881 13.5-177.8 -99.1 135.2 88.4 18.3 15.4 393 393 A E E + W 0 414J 71 -2,-0.4 2,-0.3 21,-0.2 21,-0.2 -0.965 14.6 180.0-138.2 155.6 87.4 16.3 12.3 394 394 A S E - W 0 413J 23 19,-1.6 19,-2.5 -2,-0.3 2,-0.3 -0.976 1.9-177.4-158.2 140.2 84.3 14.9 10.5 395 395 A S E + W 0 412J 60 -2,-0.3 2,-0.3 17,-0.2 17,-0.2 -0.983 12.1 155.8-136.5 134.1 83.8 12.9 7.4 396 396 A F E - W 0 411J 51 15,-2.4 15,-2.9 -2,-0.3 -2,-0.0 -0.997 40.1-126.7-161.3 159.4 80.6 11.7 5.7 397 397 A T - 0 0 35 -2,-0.3 13,-0.2 13,-0.3 5,-0.1 -0.963 42.9-116.8-109.4 105.6 79.1 10.6 2.3 398 398 A P > - 0 0 27 0, 0.0 3,-2.5 0, 0.0 4,-0.4 -0.250 24.5-121.3 -32.6 123.7 76.0 12.8 1.7 399 399 A L T >> S+ 0 0 56 1,-0.3 3,-2.2 2,-0.2 4,-1.0 0.809 110.5 72.3 -48.1 -33.2 73.1 10.3 1.7 400 400 A M H >> S+ 0 0 56 1,-0.3 4,-2.5 2,-0.2 3,-0.7 0.835 92.6 56.6 -44.1 -46.1 72.4 11.6 -1.8 401 401 A H H <> S+ 0 0 7 -3,-2.5 4,-0.5 1,-0.3 -1,-0.3 0.520 93.3 62.1 -76.6 -8.6 75.4 9.8 -2.9 402 402 A N H <4 S+ 0 0 100 -3,-2.2 -1,-0.3 -4,-0.4 -2,-0.2 0.768 114.1 39.0 -83.6 -19.1 74.4 6.5 -1.8 403 403 A I H << S+ 0 0 25 -4,-1.0 -2,-0.3 -3,-0.7 -3,-0.1 0.822 115.5 49.7 -87.8 -36.2 71.6 7.0 -4.3 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