==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 29-MAR-13 4JYD . COMPND 2 MOLECULE: FEFE-HYDROGENASE MATURASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR Y.NICOLET,R.ROHAC,L.MARTIN,J.C.FONTECILLA-CAMPS . 348 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13816.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 0 0.0 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 . 0 0.0 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 . 25 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 0 0 2 1 0 2 1 2 0 1 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 5 1 0 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 0 0 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 1 A M 0 0 83 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 148.5 62.6 -18.5 -4.6 2 2 A T > - 0 0 98 1,-0.1 4,-2.5 4,-0.0 3,-0.2 -0.329 360.0 -98.2 -76.2 169.4 64.5 -15.4 -5.9 3 3 A G H > S+ 0 0 19 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.862 125.5 54.0 -56.0 -41.0 63.0 -11.9 -5.8 4 4 A R H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.913 109.9 47.8 -59.2 -42.8 62.1 -12.2 -9.5 5 5 A E H > S+ 0 0 52 -3,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.921 109.6 51.7 -67.4 -41.8 60.3 -15.4 -8.7 6 6 A I H X S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.909 109.4 50.8 -61.5 -43.3 58.4 -14.0 -5.8 7 7 A L H X S+ 0 0 26 -4,-2.2 4,-3.4 2,-0.2 5,-0.2 0.937 109.1 50.6 -58.5 -47.8 57.2 -11.0 -7.8 8 8 A E H X S+ 0 0 68 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.896 111.9 47.7 -63.5 -37.8 55.9 -13.3 -10.6 9 9 A K H X>S+ 0 0 45 -4,-2.3 5,-2.6 2,-0.2 4,-0.6 0.930 112.8 47.9 -64.8 -47.1 54.0 -15.4 -8.0 10 10 A L H ><5S+ 0 0 2 -4,-2.9 3,-1.0 3,-0.2 -2,-0.2 0.915 112.0 50.7 -56.1 -44.0 52.6 -12.2 -6.5 11 11 A E H 3<5S+ 0 0 123 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.856 111.6 47.3 -62.2 -36.0 51.7 -11.0 -10.0 12 12 A R H 3<5S- 0 0 111 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.511 115.4-120.6 -78.4 -10.4 50.0 -14.3 -10.6 13 13 A R T <<5 + 0 0 85 -3,-1.0 2,-1.1 -4,-0.6 -3,-0.2 0.852 61.8 147.8 66.2 38.3 48.2 -14.1 -7.2 14 14 A E < - 0 0 40 -5,-2.6 2,-1.8 -6,-0.1 -1,-0.2 -0.761 25.2-177.8 -95.3 80.4 49.6 -17.3 -5.8 15 15 A F + 0 0 39 -2,-1.1 2,-0.1 -3,-0.1 -5,-0.1 -0.459 10.9 165.0 -89.1 67.8 49.6 -15.8 -2.3 16 16 A T > - 0 0 59 -2,-1.8 4,-2.1 1,-0.1 5,-0.1 -0.445 50.5-114.4 -76.1 156.3 51.2 -18.6 -0.4 17 17 A R H > S+ 0 0 98 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.807 118.7 52.9 -54.6 -33.7 52.5 -18.1 3.2 18 18 A E H > S+ 0 0 130 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.912 106.2 50.4 -75.7 -41.5 56.0 -18.8 1.8 19 19 A V H > S+ 0 0 10 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.921 112.6 49.2 -59.0 -40.5 55.7 -16.2 -0.9 20 20 A L H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.900 111.6 46.7 -70.4 -42.0 54.6 -13.7 1.7 21 21 A K H X S+ 0 0 80 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.907 113.6 48.8 -62.4 -44.6 57.4 -14.5 4.2 22 22 A E H X S+ 0 0 83 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.939 109.1 53.2 -62.6 -45.2 60.0 -14.3 1.5 23 23 A A H < S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.914 114.6 41.7 -52.6 -44.9 58.6 -11.0 0.2 24 24 A L H < S+ 0 0 2 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.786 116.5 49.8 -76.3 -28.3 58.9 -9.5 3.8 25 25 A S H < S+ 0 0 50 -4,-2.2 2,-0.3 -5,-0.1 -2,-0.2 0.773 86.8 89.9 -84.8 -30.2 62.3 -11.1 4.4 26 26 A I < - 0 0 34 -4,-2.6 -24,-0.0 1,-0.1 -4,-0.0 -0.540 49.0-176.9 -70.2 128.9 64.2 -10.0 1.2 27 27 A N + 0 0 135 -2,-0.3 -1,-0.1 4,-0.0 -4,-0.0 0.360 32.9 136.0-108.1 0.3 65.9 -6.7 1.8 28 28 A D > - 0 0 96 1,-0.1 4,-2.7 2,-0.1 5,-0.2 -0.290 53.8-140.5 -51.0 124.6 67.2 -6.2 -1.8 29 29 A R H > S+ 0 0 129 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.891 101.7 51.9 -55.1 -44.0 66.6 -2.6 -3.0 30 30 A G H > S+ 0 0 45 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.916 111.4 46.8 -63.1 -41.5 65.7 -3.8 -6.5 31 31 A F H > S+ 0 0 6 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.948 111.5 50.0 -63.7 -52.7 63.2 -6.3 -5.1 32 32 A N H X S+ 0 0 16 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.912 110.6 50.5 -53.9 -43.7 61.6 -3.8 -2.7 33 33 A E H X S+ 0 0 119 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.886 110.6 48.3 -65.9 -35.9 61.2 -1.2 -5.5 34 34 A A H X S+ 0 0 36 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.866 110.5 51.7 -71.6 -35.0 59.6 -3.6 -7.8 35 35 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.921 110.6 48.7 -68.5 -43.3 57.2 -4.7 -5.1 36 36 A F H X S+ 0 0 29 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.898 110.5 51.1 -63.1 -39.9 56.3 -1.1 -4.5 37 37 A K H X S+ 0 0 88 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.936 109.1 51.1 -63.2 -44.8 55.8 -0.5 -8.2 38 38 A L H X S+ 0 0 20 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.931 112.1 45.7 -50.7 -49.5 53.5 -3.5 -8.4 39 39 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.893 111.8 51.7 -70.9 -37.3 51.4 -2.3 -5.5 40 40 A D H X S+ 0 0 31 -4,-2.3 4,-2.4 244,-0.2 -1,-0.2 0.914 112.9 47.1 -61.2 -41.2 51.2 1.2 -7.0 41 41 A E H X S+ 0 0 101 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.913 111.7 48.1 -69.6 -43.6 50.1 -0.3 -10.3 42 42 A I H X S+ 0 0 6 -4,-3.0 4,-2.9 2,-0.2 5,-0.4 0.898 111.5 52.2 -62.9 -40.3 47.4 -2.5 -8.7 43 43 A R H X>S+ 0 0 13 -4,-2.4 4,-2.8 -5,-0.2 5,-1.0 0.954 111.9 45.6 -56.8 -53.4 46.2 0.4 -6.7 44 44 A R H X5S+ 0 0 144 -4,-2.4 4,-1.1 3,-0.2 -2,-0.2 0.939 114.8 48.2 -57.8 -46.3 45.9 2.5 -9.9 45 45 A K H <5S+ 0 0 140 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.912 124.4 26.9 -63.7 -43.6 44.2 -0.3 -11.7 46 46 A Y H <5S+ 0 0 49 -4,-2.9 -2,-0.2 215,-0.2 -3,-0.2 0.862 136.6 20.3 -93.5 -38.0 41.6 -1.2 -9.1 47 47 A V H <5S- 0 0 32 -4,-2.8 3,-0.4 -5,-0.4 -3,-0.2 0.465 95.6-148.1-115.4 -0.7 41.0 2.0 -7.0 48 48 A G << - 0 0 25 -4,-1.1 -1,-0.2 -5,-1.0 -2,-0.1 -0.172 39.3 -50.6 73.1-160.2 42.2 4.6 -9.4 49 49 A D S S+ 0 0 41 -5,-0.1 284,-2.1 -4,-0.1 2,-0.2 0.519 92.9 113.6-101.2 -4.4 43.8 7.9 -8.8 50 50 A E E -a 333 0A 59 -3,-0.4 2,-0.6 282,-0.2 285,-0.1 -0.480 52.6-153.8 -71.7 127.4 41.4 9.4 -6.3 51 51 A V E -a 334 0A 0 282,-2.9 284,-1.3 -2,-0.2 2,-0.4 -0.949 15.8-138.9-102.3 114.6 42.8 9.9 -2.8 52 52 A H E -b 289 0B 11 236,-2.3 238,-2.8 -2,-0.6 2,-0.6 -0.603 9.8-147.7 -77.5 128.1 39.9 9.7 -0.3 53 53 A I E -b 290 0B 23 -2,-0.4 49,-0.7 236,-0.2 50,-0.7 -0.866 12.2-172.4-102.1 119.6 40.1 12.2 2.5 54 54 A R E -d 103 0C 13 236,-2.6 2,-0.6 -2,-0.6 50,-0.2 -0.939 18.9-142.7-110.6 107.6 38.7 11.1 5.9 55 55 A A E -d 104 0C 0 48,-2.2 50,-2.9 -2,-0.6 2,-0.6 -0.582 18.6-151.3 -75.0 115.4 38.6 14.1 8.3 56 56 A I E -de 105 293C 9 236,-2.4 238,-3.5 -2,-0.6 2,-0.6 -0.784 14.3-170.8 -98.5 122.7 39.5 12.7 11.7 57 57 A I E -d 106 0C 0 48,-3.3 50,-2.3 -2,-0.6 2,-1.3 -0.943 9.4-159.2-106.1 112.9 38.2 14.3 14.9 58 58 A E E +d 107 0C 22 -2,-0.6 50,-0.2 48,-0.2 48,-0.1 -0.713 18.7 177.3 -92.4 91.8 39.8 12.8 17.9 59 59 A F E + 0 0 1 48,-1.5 25,-2.8 -2,-1.3 2,-0.3 0.587 57.1 15.5 -84.0 -15.5 37.1 13.8 20.3 60 60 A S E -dF 108 83C 0 47,-0.6 49,-1.5 23,-0.2 23,-0.2 -0.951 45.4-163.9-152.5 141.0 38.3 12.4 23.7 61 61 A N + 0 0 0 21,-1.5 2,-0.3 -2,-0.3 22,-0.1 0.238 57.0 120.4-109.3 14.4 41.6 11.0 24.9 62 62 A V + 0 0 29 20,-0.7 2,-0.4 47,-0.2 47,-0.2 -0.560 40.5 178.3 -71.5 137.2 40.0 9.3 27.9 63 63 A C - 0 0 20 -2,-0.3 48,-0.2 9,-0.2 -2,-0.0 -0.990 33.5-165.1-147.4 135.3 40.5 5.5 27.9 64 64 A R S S+ 0 0 97 46,-1.7 2,-0.1 -2,-0.4 47,-0.1 0.524 73.1 83.4 -86.1 -10.2 39.5 2.7 30.2 65 65 A K - 0 0 17 45,-0.1 9,-2.9 7,-0.1 10,-0.1 -0.457 65.5-148.7 -98.4 170.0 42.0 0.2 28.5 66 66 A N + 0 0 10 7,-0.3 7,-0.1 8,-0.1 -1,-0.1 -0.218 21.8 175.2-132.2 43.1 45.7 -0.1 29.3 67 67 A C > - 0 0 10 1,-0.2 3,-1.2 105,-0.1 6,-0.3 -0.286 32.3-133.8 -59.5 132.0 47.3 -1.2 26.0 68 68 A L T 3 S+ 0 0 39 103,-2.9 170,-0.9 1,-0.3 -1,-0.2 0.715 100.2 48.0 -64.2 -25.0 51.0 -1.3 26.6 69 69 A Y T 3 S+ 0 0 3 102,-0.4 2,-0.4 168,-0.1 164,-0.3 0.666 93.8 95.4 -86.4 -17.5 52.0 0.6 23.4 70 70 A C X - 0 0 13 -3,-1.2 3,-2.1 1,-0.1 236,-0.2 -0.642 60.0-153.6-100.0 124.5 49.5 3.4 23.7 71 71 A G T 3 S+ 0 0 0 234,-2.5 234,-0.2 -2,-0.4 -1,-0.1 0.663 98.7 58.9 -59.8 -17.6 50.1 6.8 25.2 72 72 A L T 3 S+ 0 0 2 233,-0.1 -1,-0.3 -10,-0.1 -9,-0.2 0.424 75.1 135.7 -91.2 -1.4 46.4 7.1 26.1 73 73 A R X - 0 0 20 -3,-2.1 3,-2.4 -6,-0.3 -7,-0.3 -0.106 68.6-116.1 -47.2 139.5 46.5 4.0 28.3 74 74 A R T 3 S+ 0 0 115 -9,-2.9 -8,-0.1 1,-0.3 -1,-0.1 0.858 111.5 63.2 -55.4 -32.2 44.7 4.5 31.5 75 75 A D T 3 S+ 0 0 94 -10,-0.1 2,-1.1 1,-0.1 -1,-0.3 0.534 77.2 101.3 -72.0 -3.7 47.9 4.1 33.6 76 76 A N < + 0 0 6 -3,-2.4 3,-0.2 1,-0.2 -1,-0.1 -0.736 39.8 167.5 -85.6 103.5 49.4 7.2 32.0 77 77 A K + 0 0 198 -2,-1.1 2,-0.6 1,-0.2 -1,-0.2 0.571 63.4 79.6 -88.2 -12.0 48.9 9.8 34.6 78 78 A N S S+ 0 0 126 157,-0.1 2,-0.4 -3,-0.1 -1,-0.2 -0.271 78.4 86.6 -90.9 43.1 51.3 12.2 32.7 79 79 A L S S- 0 0 18 -2,-0.6 2,-0.5 -3,-0.2 223,-0.1 -0.969 77.2-127.5-146.2 127.1 48.6 13.2 30.2 80 80 A K - 0 0 80 -2,-0.4 2,-0.3 1,-0.0 -2,-0.1 -0.654 33.6-142.6 -68.5 120.4 46.0 16.0 30.4 81 81 A R - 0 0 76 -2,-0.5 2,-0.3 222,-0.0 222,-0.1 -0.714 22.5-177.9 -89.6 143.3 42.7 14.2 29.6 82 82 A Y - 0 0 14 -2,-0.3 -21,-1.5 220,-0.1 -20,-0.7 -0.953 19.2-164.5-138.2 160.4 40.0 16.0 27.6 83 83 A R B -F 60 0C 117 -2,-0.3 2,-0.2 -23,-0.2 -23,-0.2 -0.972 18.5-141.4-140.8 122.6 36.5 15.4 26.3 84 84 A M - 0 0 3 -25,-2.8 -25,-0.0 -2,-0.3 -2,-0.0 -0.600 28.0-114.0 -77.7 146.4 34.9 17.5 23.6 85 85 A T > - 0 0 54 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.464 24.2-112.9 -73.3 156.2 31.3 18.3 24.1 86 86 A P H > S+ 0 0 33 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.922 120.0 53.7 -58.5 -34.2 28.8 16.8 21.6 87 87 A E H > S+ 0 0 129 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.899 109.1 46.7 -64.3 -43.9 28.2 20.4 20.3 88 88 A E H > S+ 0 0 72 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.859 113.6 49.2 -63.6 -38.5 31.9 21.1 19.7 89 89 A I H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.961 112.6 46.9 -67.5 -49.1 32.2 17.7 17.9 90 90 A V H X S+ 0 0 11 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.916 115.7 44.8 -58.8 -47.0 29.2 18.4 15.7 91 91 A E H X S+ 0 0 102 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.853 112.5 51.1 -70.7 -31.0 30.3 21.9 14.8 92 92 A R H X S+ 0 0 23 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.921 110.4 50.8 -68.6 -42.2 33.9 20.8 14.2 93 93 A A H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.934 107.4 53.1 -53.2 -48.7 32.4 18.1 12.0 94 94 A R H X S+ 0 0 81 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.892 106.0 53.6 -59.8 -38.0 30.4 20.8 10.1 95 95 A L H X S+ 0 0 54 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.897 107.3 51.4 -65.1 -39.0 33.6 22.8 9.5 96 96 A A H <>S+ 0 0 0 -4,-1.8 5,-2.7 2,-0.2 4,-0.2 0.928 110.0 48.3 -62.4 -43.5 35.2 19.7 8.0 97 97 A V H ><5S+ 0 0 37 -4,-2.2 3,-2.0 3,-0.2 -2,-0.2 0.934 109.9 52.6 -61.3 -44.7 32.2 19.2 5.6 98 98 A Q H 3<5S+ 0 0 137 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.820 106.2 54.7 -58.8 -31.9 32.4 23.0 4.7 99 99 A F T 3<5S- 0 0 74 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.497 132.0 -96.1 -81.7 -3.1 36.1 22.4 3.9 100 100 A G T < 5 + 0 0 30 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.541 69.0 155.3 106.4 8.3 35.0 19.6 1.6 101 101 A A < - 0 0 2 -5,-2.7 -1,-0.3 -6,-0.1 -47,-0.1 -0.514 21.2-174.0 -68.6 135.1 35.4 16.5 3.7 102 102 A K S S+ 0 0 81 -49,-0.7 30,-2.5 -2,-0.2 2,-0.4 0.538 72.5 43.6-108.7 -10.9 33.1 13.7 2.5 103 103 A T E -dg 54 132C 0 -50,-0.7 -48,-2.2 28,-0.2 2,-0.5 -0.996 68.0-158.8-128.1 134.0 33.8 11.3 5.4 104 104 A I E -dg 55 133C 0 28,-2.8 30,-3.2 -2,-0.4 2,-0.5 -0.967 8.0-158.9-106.6 128.2 34.0 12.3 9.1 105 105 A V E -dg 56 134C 2 -50,-2.9 -48,-3.3 -2,-0.5 2,-0.6 -0.934 1.2-162.6-106.0 120.7 35.9 9.9 11.4 106 106 A L E +dg 57 135C 1 28,-2.7 30,-2.2 -2,-0.5 2,-0.4 -0.932 20.7 171.2-102.8 116.8 35.1 10.1 15.1 107 107 A Q E +dg 58 136C 17 -50,-2.3 -48,-1.5 -2,-0.6 -47,-0.6 -0.972 4.0 150.0-132.0 147.8 37.8 8.5 17.1 108 108 A S E -d 60 0C 0 28,-1.5 -47,-0.2 -2,-0.4 2,-0.1 -0.964 48.9 -85.1-159.0 165.6 38.5 8.3 20.8 109 109 A G S S- 0 0 2 -49,-1.5 2,-2.3 -2,-0.3 -46,-0.2 -0.345 72.8 -77.2 -60.4 166.2 40.0 6.3 23.6 110 110 A E + 0 0 1 -49,-0.1 -46,-1.7 -2,-0.1 -1,-0.1 -0.510 70.0 173.3 -67.8 80.1 37.5 3.8 24.9 111 111 A D > - 0 0 0 -2,-2.3 3,-0.9 -48,-0.2 4,-0.3 -0.852 24.7-161.6-100.8 106.9 35.7 6.5 26.9 112 112 A P G > S+ 0 0 66 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.709 75.6 83.5 -53.2 -27.8 32.5 5.3 28.5 113 113 A Y G 3 S+ 0 0 134 1,-0.3 5,-0.2 3,-0.1 -2,-0.0 0.841 97.4 37.1 -53.2 -45.0 31.0 8.7 29.0 114 114 A X G <>>S+ 0 0 1 -3,-0.9 5,-1.7 4,-0.1 4,-1.1 0.525 89.4 149.6 -79.1 -10.4 29.6 9.0 25.5 115 115 A M T <45 - 0 0 19 -3,-1.9 2,-0.1 -4,-0.3 29,-0.0 -0.670 69.1 -32.2 -99.3 130.1 28.5 5.4 25.1 116 116 A P T >5S+ 0 0 12 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 -0.985 131.5 45.1 -97.2 -12.5 26.2 4.7 23.4 117 117 A D H >5S+ 0 0 99 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.803 110.6 49.6 -70.2 -34.8 23.6 7.5 23.4 118 118 A V H X5S+ 0 0 28 -4,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.908 112.9 48.7 -71.0 -40.1 25.8 10.6 23.0 119 119 A I H >< S+ 0 0 0 -4,-2.7 3,-1.9 1,-0.2 5,-0.5 0.881 105.2 59.8 -64.6 -38.8 26.5 14.7 11.4 127 127 A K H >< S+ 0 0 44 -4,-2.7 3,-1.9 1,-0.3 -1,-0.2 0.786 91.5 68.9 -62.8 -30.4 24.6 12.4 9.0 128 128 A K T 3< S+ 0 0 149 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.670 88.5 66.2 -56.9 -23.1 22.2 15.2 8.3 129 129 A M T < S- 0 0 37 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.376 114.1-118.3 -80.9 -2.1 25.2 16.9 6.5 130 130 A G S < S+ 0 0 45 -3,-1.9 2,-0.3 1,-0.2 -3,-0.1 0.805 72.0 119.0 68.1 37.7 25.1 14.1 3.9 131 131 A V - 0 0 7 -5,-0.5 -1,-0.2 -4,-0.1 2,-0.2 -0.782 69.0 -93.9-123.3 166.8 28.5 12.7 4.4 132 132 A A E -g 103 0C 0 -30,-2.5 -28,-2.8 -2,-0.3 2,-0.5 -0.580 34.1-148.0 -78.0 146.2 29.8 9.3 5.5 133 133 A V E -g 104 0C 0 19,-0.3 21,-2.3 -2,-0.2 22,-1.9 -0.970 11.5-170.3-117.5 130.9 30.4 8.8 9.2 134 134 A T E -gh 105 155C 3 -30,-3.2 -28,-2.7 -2,-0.5 2,-0.4 -0.967 7.4-154.1-119.6 133.7 33.1 6.4 10.3 135 135 A L E +gh 106 156C 0 20,-2.7 22,-2.6 -2,-0.5 -28,-0.2 -0.871 18.9 173.2-108.1 142.2 33.5 5.4 14.0 136 136 A S E +g 107 0C 3 -30,-2.2 -28,-1.5 -2,-0.4 22,-0.1 -0.615 32.9 131.2-143.8 71.6 36.8 4.3 15.6 137 137 A L - 0 0 0 1,-0.4 2,-0.2 -30,-0.2 -26,-0.1 0.261 60.3-122.3-114.8 2.3 35.8 4.0 19.3 138 138 A G - 0 0 0 19,-0.5 2,-0.5 211,-0.4 -1,-0.4 -0.551 58.5 -9.3 94.3-154.9 37.2 0.6 20.2 139 139 A E + 0 0 10 -2,-0.2 41,-0.1 -29,-0.0 40,-0.0 -0.761 68.4 152.6 -95.3 122.5 35.5 -2.5 21.5 140 140 A W - 0 0 17 -2,-0.5 5,-0.1 1,-0.0 -2,-0.0 -0.919 48.2 -71.5-140.8 164.7 31.9 -2.3 22.8 141 141 A P >> - 0 0 66 0, 0.0 4,-1.6 0, 0.0 3,-1.1 -0.223 44.1-112.9 -54.8 146.9 28.9 -4.5 23.1 142 142 A R H 3> S+ 0 0 91 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.870 117.7 61.7 -44.5 -43.8 27.0 -5.6 20.0 143 143 A E H 3> S+ 0 0 54 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.853 102.3 49.0 -54.7 -40.9 24.1 -3.4 21.2 144 144 A Y H <> S+ 0 0 62 -3,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.933 110.7 48.9 -63.9 -52.4 26.2 -0.3 21.0 145 145 A Y H X S+ 0 0 2 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.852 112.0 51.4 -53.2 -39.6 27.4 -1.0 17.5 146 146 A E H X S+ 0 0 61 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.906 109.2 48.8 -66.4 -46.3 23.7 -1.7 16.6 147 147 A K H X S+ 0 0 83 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.901 111.6 49.8 -61.3 -41.4 22.6 1.6 18.0 148 148 A W H <>S+ 0 0 0 -4,-2.5 5,-2.6 2,-0.2 4,-0.4 0.852 110.8 49.9 -68.8 -33.0 25.3 3.5 16.1 149 149 A K H ><5S+ 0 0 63 -4,-1.8 3,-1.5 3,-0.2 -2,-0.2 0.940 111.9 47.3 -67.0 -48.6 24.4 1.7 12.9 150 150 A E H 3<5S+ 0 0 159 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.847 105.5 60.2 -61.6 -33.9 20.7 2.6 13.3 151 151 A A T 3<5S- 0 0 7 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.631 130.4 -95.1 -69.4 -14.9 21.9 6.2 14.1 152 152 A G T < 5 + 0 0 23 -3,-1.5 -19,-0.3 -4,-0.4 -3,-0.2 0.421 67.4 156.9 115.6 7.8 23.4 6.3 10.6 153 153 A A < - 0 0 0 -5,-2.6 -1,-0.3 1,-0.1 -19,-0.2 -0.316 19.6-170.5 -64.4 138.1 27.1 5.3 11.1 154 154 A D + 0 0 37 -21,-2.3 39,-2.2 1,-0.2 2,-0.3 0.823 58.8 17.8 -98.1 -37.3 28.6 3.9 7.8 155 155 A R E -hi 134 193C 7 -22,-1.9 -20,-2.7 37,-0.3 2,-0.4 -0.918 54.8-154.7-141.1 158.9 32.0 2.5 8.7 156 156 A Y E -hi 135 194C 0 37,-2.4 39,-2.3 -2,-0.3 2,-0.6 -0.982 6.9-153.0-142.8 126.9 34.0 1.3 11.7 157 157 A L E + i 0 195C 34 -22,-2.6 -19,-0.5 -2,-0.4 2,-0.2 -0.899 26.3 156.8 -97.3 123.7 37.8 1.2 12.1 158 158 A L - 0 0 0 37,-3.0 39,-0.2 -2,-0.6 26,-0.1 -0.660 31.1-148.5-148.0 78.5 39.0 -1.4 14.6 159 159 A R - 0 0 46 37,-0.3 39,-0.2 190,-0.3 37,-0.1 -0.204 9.8-141.9 -48.3 135.2 42.6 -2.4 13.8 160 160 A H - 0 0 0 37,-0.8 2,-2.3 1,-0.2 38,-0.2 0.751 26.2-159.5 -76.4 -21.4 43.1 -6.1 14.7 161 161 A E B +l 198 0D 1 36,-3.2 38,-1.6 2,-0.1 2,-0.3 -0.350 65.3 1.5 84.7 -57.7 46.6 -4.9 15.9 162 162 A T - 0 0 1 -2,-2.3 48,-0.1 36,-0.2 6,-0.1 -0.908 54.8-150.1-159.1 132.7 48.2 -8.2 15.8 163 163 A A S S+ 0 0 13 -2,-0.3 3,-0.1 46,-0.3 -2,-0.1 0.422 74.8 101.7 -84.2 -2.2 46.8 -11.6 14.7 164 164 A N > - 0 0 41 1,-0.2 4,-2.9 2,-0.1 5,-0.2 -0.780 62.9-159.5 -76.5 108.1 49.2 -13.4 17.2 165 165 A P H > S+ 0 0 73 0, 0.0 4,-2.1 0, 0.0 12,-0.3 0.834 88.1 50.9 -65.2 -31.7 46.7 -14.1 20.0 166 166 A V H > S+ 0 0 86 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.915 114.7 41.0 -67.3 -45.2 49.5 -14.5 22.6 167 167 A L H > S+ 0 0 19 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.902 113.2 57.1 -67.1 -36.8 51.2 -11.2 21.7 168 168 A H H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.959 107.7 46.5 -58.7 -50.5 47.8 -9.6 21.4 169 169 A R H < S+ 0 0 130 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.849 111.9 50.3 -62.2 -38.1 46.9 -10.5 24.9 170 170 A K H < S+ 0 0 141 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.870 117.0 40.0 -67.9 -35.2 50.3 -9.4 26.4 171 171 A L H < S+ 0 0 8 -4,-2.3 -103,-2.9 1,-0.3 -102,-0.4 0.764 124.7 37.9 -84.9 -26.8 50.0 -6.0 24.7 172 172 A R >< + 0 0 1 -4,-2.5 3,-1.7 -5,-0.3 -1,-0.3 -0.731 69.9 174.3-126.5 77.0 46.3 -5.5 25.3 173 173 A P T 3 S+ 0 0 49 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.691 73.9 60.0 -67.0 -21.0 45.8 -7.0 28.8 174 174 A D T 3 S+ 0 0 59 2,-0.0 2,-0.2 0, 0.0 -5,-0.1 0.652 117.5 9.2 -72.9 -20.6 42.2 -5.9 29.1 175 175 A T < - 0 0 1 -3,-1.7 2,-0.3 -6,-0.2 -3,-0.1 -0.482 68.6-123.6-140.0-156.7 41.1 -7.9 26.1 176 176 A S > - 0 0 28 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.984 32.6-104.3-153.1 165.3 42.1 -10.6 23.5 177 177 A F H > S+ 0 0 27 -12,-0.3 4,-3.4 -2,-0.3 5,-0.3 0.912 120.5 57.3 -52.2 -49.3 42.3 -11.3 19.8 178 178 A E H > S+ 0 0 133 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.884 110.1 43.4 -50.9 -44.0 39.2 -13.4 20.1 179 179 A N H > S+ 0 0 73 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.925 115.1 49.7 -66.1 -49.8 37.3 -10.3 21.5 180 180 A R H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.949 113.9 45.2 -56.3 -49.3 38.8 -8.0 18.8 181 181 A L H X S+ 0 0 32 -4,-3.4 4,-2.8 1,-0.2 -1,-0.2 0.919 109.6 54.6 -61.9 -45.9 37.9 -10.4 16.0 182 182 A N H X S+ 0 0 76 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.874 106.5 52.8 -57.7 -35.9 34.4 -10.9 17.4 183 183 A C H X S+ 0 0 16 -4,-2.1 4,-3.1 2,-0.2 -1,-0.2 0.933 109.8 48.0 -63.5 -44.7 33.9 -7.1 17.3 184 184 A L H X S+ 0 0 2 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.939 113.1 48.3 -61.1 -45.0 35.0 -7.0 13.6 185 185 A L H X S+ 0 0 81 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.879 113.1 47.3 -62.4 -41.1 32.7 -9.9 12.8 186 186 A T H X S+ 0 0 25 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.945 110.5 52.8 -64.7 -47.3 29.8 -8.2 14.6 187 187 A L H X>S+ 0 0 0 -4,-3.1 5,-1.8 1,-0.2 4,-0.5 0.938 110.1 47.9 -53.9 -51.5 30.5 -5.0 12.9 188 188 A K H ><5S+ 0 0 69 -4,-2.6 3,-1.7 1,-0.2 -1,-0.2 0.923 110.3 51.7 -54.0 -48.8 30.4 -6.7 9.5 189 189 A E H 3<5S+ 0 0 135 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.860 104.2 56.8 -59.5 -36.7 27.1 -8.5 10.3 190 190 A L H 3<5S- 0 0 40 -4,-2.4 -1,-0.3 -3,-0.2 -2,-0.2 0.610 123.6-106.9 -71.2 -9.8 25.5 -5.2 11.3 191 191 A G T <<5 + 0 0 48 -3,-1.7 -3,-0.2 -4,-0.5 -2,-0.1 0.580 68.7 145.5 96.5 9.0 26.4 -3.9 7.8 192 192 A Y < - 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