==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 15-MAR-99 1QAK . COMPND 2 MOLECULE: COPPER AMINE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.M.MURRAY,C.M.WILMOT,C.G.SAYSELL,J.JAEGER,P.F.KNOWLES, . 1441 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49676.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 962 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 501 34.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 18 1.2 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 . 162 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 124 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.0 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 3 0 2 2 2 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 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 PARALLEL BRIDGES PER LADDER . 15 5 10 10 10 7 6 8 4 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 6 4 3 3 0 0 0 0 0 0 4 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 6 A H 0 0 178 0, 0.0 66,-0.8 0, 0.0 64,-0.1 0.000 360.0 360.0 360.0-175.8 29.6 105.0 9.1 2 7 A M E -A 66 0A 43 64,-0.2 64,-0.2 65,-0.1 65,-0.0 -0.179 360.0-170.4 -71.4 159.3 29.8 102.2 6.5 3 8 A V E -A 65 0A 42 62,-1.9 62,-2.3 63,-0.1 2,-0.1 -0.972 40.3 -86.3-147.1 150.9 32.7 100.6 4.4 4 9 A P E > -A 64 0A 21 0, 0.0 4,-2.3 0, 0.0 60,-0.3 -0.381 33.4-149.3 -64.2 131.3 32.6 98.2 1.5 5 10 A M H > S+ 0 0 0 58,-2.9 4,-3.2 2,-0.2 5,-0.4 0.974 91.8 48.4 -68.3 -55.0 32.6 94.6 2.8 6 11 A D H > S+ 0 0 74 57,-0.4 4,-2.5 1,-0.2 5,-0.2 0.928 117.8 43.2 -49.9 -53.7 34.5 92.8 0.0 7 12 A K H > S+ 0 0 122 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.923 117.4 44.0 -60.8 -49.8 37.2 95.4 0.1 8 13 A T H X S+ 0 0 28 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.955 117.2 45.4 -63.2 -45.5 37.5 95.6 3.9 9 14 A L H X>S+ 0 0 0 -4,-3.2 5,-2.4 -5,-0.2 4,-0.7 0.899 112.8 49.5 -64.3 -42.8 37.3 91.8 4.4 10 15 A K H ><5S+ 0 0 142 -4,-2.5 3,-0.9 -5,-0.4 -1,-0.2 0.905 108.5 52.9 -67.5 -35.9 39.8 91.1 1.7 11 16 A E H 3<5S+ 0 0 154 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.858 107.3 53.6 -64.5 -34.1 42.2 93.7 3.1 12 17 A F H 3<5S- 0 0 53 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.657 120.4-115.6 -72.5 -15.4 41.8 91.8 6.4 13 18 A G T <<5 + 0 0 35 -3,-0.9 2,-0.3 -4,-0.7 -3,-0.2 0.676 68.2 137.7 86.6 22.5 42.7 88.6 4.6 14 19 A A < - 0 0 6 -5,-2.4 2,-0.3 15,-0.1 -1,-0.3 -0.658 55.0-118.2 -97.1 152.1 39.4 86.8 5.1 15 20 A D E -C 28 0B 88 13,-3.2 13,-2.3 -2,-0.3 2,-0.5 -0.725 26.7-154.6 -89.0 139.4 37.7 84.8 2.4 16 21 A V E +C 27 0B 27 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.980 13.7 179.3-119.8 122.8 34.3 86.0 1.3 17 22 A Q E -C 26 0B 50 9,-2.7 9,-2.9 -2,-0.5 2,-0.4 -0.989 10.4-159.7-125.2 134.9 31.6 83.8 -0.2 18 23 A W E -C 25 0B 92 -2,-0.4 2,-0.7 7,-0.2 7,-0.2 -0.894 1.2-164.5-108.0 131.4 28.1 85.0 -1.3 19 24 A D E >> -C 24 0B 34 5,-2.5 5,-2.1 -2,-0.4 4,-1.1 -0.938 1.1-170.4-115.4 113.6 25.3 82.4 -1.7 20 25 A D T 45S+ 0 0 109 -2,-0.7 -1,-0.2 3,-0.2 5,-0.0 0.780 83.8 57.2 -73.5 -27.9 22.4 84.1 -3.7 21 26 A Y T 45S+ 0 0 39 1,-0.2 -1,-0.2 3,-0.1 -2,-0.1 0.939 120.7 26.9 -70.0 -45.0 20.0 81.3 -3.1 22 27 A A T 45S- 0 0 3 2,-0.2 -2,-0.2 722,-0.0 -1,-0.2 0.586 102.2-130.0 -94.2 -3.7 20.3 81.5 0.8 23 28 A Q T <5 + 0 0 86 -4,-1.1 2,-0.4 1,-0.2 -3,-0.2 0.949 62.0 142.8 52.3 52.5 21.2 85.3 0.6 24 29 A L E < -C 19 0B 6 -5,-2.1 -5,-2.5 13,-0.2 2,-0.4 -0.987 48.6-149.9-132.6 135.3 24.0 84.4 2.9 25 30 A F E -CD 18 36B 8 11,-2.8 11,-2.2 -2,-0.4 2,-0.5 -0.821 10.1-160.6 -97.6 139.1 27.6 85.5 3.2 26 31 A T E -CD 17 35B 17 -9,-2.9 -9,-2.7 -2,-0.4 2,-0.4 -0.993 12.4-171.3-118.9 117.3 30.1 82.9 4.5 27 32 A L E -CD 16 34B 0 7,-3.0 7,-3.2 -2,-0.5 2,-0.4 -0.951 4.0-175.7-114.2 126.3 33.2 84.7 5.8 28 33 A I E +CD 15 33B 35 -13,-2.3 -13,-3.2 -2,-0.4 2,-0.3 -0.982 16.9 157.4-130.6 142.4 36.3 82.8 6.8 29 34 A K E > - D 0 32B 48 3,-2.0 3,-2.3 -2,-0.4 -15,-0.1 -0.772 68.0 -57.0-160.8 110.9 39.6 83.6 8.3 30 35 A D T 3 S- 0 0 32 1,-0.3 -1,-0.2 371,-0.3 278,-0.1 -0.343 125.8 -5.6 52.6-119.5 41.8 81.1 10.2 31 36 A G T 3 S+ 0 0 2 -2,-0.1 2,-0.6 -3,-0.1 -1,-0.3 0.446 113.4 96.5 -85.4 -0.1 39.6 79.8 13.0 32 37 A A E < -D 29 0B 2 -3,-2.3 -3,-2.0 47,-0.1 2,-0.6 -0.793 46.6-178.1 -94.8 122.5 36.6 82.1 12.5 33 38 A Y E -D 28 0B 26 -2,-0.6 13,-2.8 -5,-0.2 14,-0.4 -0.946 17.2-174.1-122.3 103.5 33.8 80.7 10.4 34 39 A V E -DE 27 45B 0 -7,-3.2 -7,-3.0 -2,-0.6 2,-0.4 -0.874 17.5-170.3-111.7 140.1 31.2 83.4 10.1 35 40 A K E +DE 26 44B 38 9,-2.3 9,-2.7 -2,-0.4 2,-0.3 -0.985 14.7 166.4-125.9 129.8 27.7 83.5 8.6 36 41 A V E -DE 25 43B 0 -11,-2.2 -11,-2.8 -2,-0.4 7,-0.1 -0.988 22.4-149.6-145.8 136.8 25.7 86.7 8.1 37 42 A K > - 0 0 61 5,-0.5 3,-2.3 -2,-0.3 19,-0.4 -0.842 36.5-102.5-103.5 138.5 22.6 87.7 6.1 38 43 A P T 3 S+ 0 0 31 0, 0.0 19,-0.2 0, 0.0 3,-0.1 -0.298 108.8 11.8 -56.5 137.4 22.1 91.2 4.7 39 44 A G T 3 S+ 0 0 53 17,-2.9 2,-0.1 1,-0.2 18,-0.1 0.302 94.0 135.8 74.2 -7.5 19.8 93.1 6.9 40 45 A A < - 0 0 21 -3,-2.3 16,-0.4 1,-0.1 -1,-0.2 -0.447 54.2-142.6 -72.7 146.3 19.9 90.5 9.8 41 46 A Q S S+ 0 0 159 14,-0.1 11,-2.9 -2,-0.1 2,-0.3 0.496 84.6 40.5 -83.5 -5.1 20.2 91.8 13.3 42 47 A T E - F 0 51B 56 9,-0.2 -5,-0.5 -5,-0.1 2,-0.2 -0.907 62.3-164.4-138.6 165.8 22.4 88.9 14.2 43 48 A A E -EF 36 50B 0 7,-2.2 7,-2.1 -2,-0.3 2,-0.4 -0.778 23.8-117.8-137.1 177.9 25.2 86.8 12.7 44 49 A I E -EF 35 49B 23 -9,-2.7 -9,-2.3 -2,-0.2 2,-0.5 -0.996 20.5-170.5-125.7 135.8 26.7 83.4 13.5 45 50 A V E > S-EF 34 48B 0 3,-3.3 3,-2.5 -2,-0.4 -11,-0.2 -0.982 78.0 -24.9-126.0 115.1 30.4 83.0 14.6 46 51 A N T 3 S- 0 0 11 -13,-2.8 261,-0.1 -2,-0.5 -1,-0.1 0.888 128.7 -47.9 51.2 45.9 31.6 79.4 14.8 47 52 A G T 3 S+ 0 0 35 -14,-0.4 -1,-0.3 259,-0.2 260,-0.1 0.366 117.6 110.7 80.0 -5.9 28.0 78.2 15.4 48 53 A Q E < -F 45 0B 106 -3,-2.5 -3,-3.3 30,-0.1 -1,-0.2 -0.858 68.9-114.8-111.2 141.6 27.2 80.8 18.1 49 54 A P E -F 44 0B 88 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.394 28.4-168.2 -69.2 139.5 24.8 83.7 17.7 50 55 A L E -F 43 0B 32 -7,-2.1 -7,-2.2 -2,-0.1 2,-0.2 -0.995 18.7-132.8-135.9 127.3 26.0 87.3 17.8 51 56 A A E -F 42 0B 85 -2,-0.4 2,-0.5 -9,-0.2 -9,-0.2 -0.493 24.2-146.7 -74.0 138.1 24.0 90.5 18.1 52 57 A L - 0 0 22 -11,-2.9 17,-0.0 -2,-0.2 -1,-0.0 -0.923 12.1-153.3-109.9 137.5 25.1 93.1 15.5 53 58 A Q S S+ 0 0 145 -2,-0.5 -1,-0.2 1,-0.3 -11,-0.0 0.922 93.1 25.3 -69.6 -44.4 24.9 96.8 16.3 54 59 A V S S- 0 0 53 -3,-0.1 12,-0.4 3,-0.0 -1,-0.3 -0.942 86.1-134.1-124.2 114.5 24.6 97.5 12.6 55 60 A P - 0 0 38 0, 0.0 -14,-0.1 0, 0.0 2,-0.1 -0.261 36.3 -94.5 -62.0 151.6 23.2 94.9 10.2 56 61 A V - 0 0 0 -19,-0.4 -17,-2.9 -16,-0.4 2,-0.4 -0.509 46.2-148.4 -65.6 141.0 25.1 94.4 6.9 57 62 A V E -B 64 0A 63 7,-2.4 7,-2.2 -19,-0.2 2,-1.0 -0.946 9.4-138.2-122.0 136.8 23.5 96.6 4.2 58 63 A M E +B 63 0A 81 -2,-0.4 2,-0.6 5,-0.2 5,-0.2 -0.754 28.6 176.2 -91.9 100.1 23.2 95.9 0.5 59 64 A K E > S-B 62 0A 136 3,-2.6 3,-2.3 -2,-1.0 -2,-0.0 -0.877 70.6 -18.7-112.2 119.8 24.0 99.1 -1.3 60 65 A D T 3 S- 0 0 110 -2,-0.6 -1,-0.2 1,-0.3 3,-0.1 0.877 124.9 -57.6 56.6 33.2 24.1 99.0 -5.1 61 66 A N T 3 S+ 0 0 148 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.541 121.3 107.2 77.5 6.2 24.5 95.2 -5.0 62 67 A K E < S- B 0 59A 114 -3,-2.3 -3,-2.6 -57,-0.0 2,-0.3 -0.883 71.4-124.9-112.3 145.7 27.6 95.7 -2.9 63 68 A A E - B 0 58A 3 -2,-0.4 -58,-2.9 -5,-0.2 -57,-0.4 -0.710 24.7-166.4 -93.9 146.3 27.5 94.8 0.8 64 69 A W E -AB 4 57A 63 -7,-2.2 -7,-2.4 -2,-0.3 2,-0.3 -0.956 4.5-173.9-127.5 145.1 28.6 97.5 3.3 65 70 A V E -A 3 0A 0 -62,-2.3 -62,-1.9 -2,-0.3 -9,-0.1 -0.890 34.7 -86.3-136.4 163.9 29.4 97.0 7.0 66 71 A S E > -A 2 0A 7 -12,-0.4 3,-0.9 -2,-0.3 4,-0.4 -0.170 39.7-111.8 -65.5 165.8 30.1 99.3 9.9 67 72 A D T 3 S+ 0 0 125 -66,-0.8 4,-0.2 1,-0.2 -1,-0.1 0.598 121.1 52.8 -74.7 -7.5 33.7 100.4 10.4 68 73 A T T 3> S+ 0 0 42 2,-0.1 4,-3.3 1,-0.1 5,-0.3 0.482 80.3 102.1-101.7 -9.3 33.6 98.3 13.6 69 74 A F H <> S+ 0 0 6 -3,-0.9 4,-3.5 1,-0.2 5,-0.3 0.895 79.4 46.9 -37.5 -69.3 32.4 95.1 11.9 70 75 A I H >>S+ 0 0 29 -4,-0.4 4,-1.7 1,-0.2 5,-0.8 0.897 117.6 43.2 -46.1 -50.4 35.7 93.2 11.7 71 76 A N H >5S+ 0 0 94 3,-0.2 4,-1.3 -4,-0.2 -1,-0.2 0.947 116.1 48.2 -63.6 -49.8 36.5 93.9 15.4 72 77 A D H <5S+ 0 0 43 -4,-3.3 -2,-0.2 2,-0.1 -1,-0.2 0.868 125.3 28.2 -59.4 -41.4 32.9 93.2 16.5 73 78 A V H ><5S+ 0 0 0 -4,-3.5 3,-1.0 -5,-0.3 5,-0.3 0.946 127.4 35.0 -87.9 -60.7 32.7 90.0 14.6 74 79 A F H 3<5S+ 0 0 12 -4,-1.7 3,-0.3 -5,-0.3 -3,-0.2 0.782 128.1 38.1 -68.5 -27.1 36.1 88.4 14.3 75 80 A Q T 3< - 0 0 2 1,-0.1 3,-1.7 2,-0.1 42,-0.1 -0.378 23.6-119.9 -66.8 147.2 55.5 79.8 29.2 90 95 A P T 3 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 41,-0.1 0.613 109.6 55.5 -65.4 -14.9 59.3 79.9 29.8 91 96 A L T 3 S+ 0 0 8 34,-0.1 32,-0.1 40,-0.1 3,-0.1 0.380 73.3 130.5-100.3 4.1 60.2 78.8 26.2 92 97 A N < - 0 0 17 -3,-1.7 3,-0.1 1,-0.1 236,-0.1 -0.307 66.3-110.9 -52.1 141.0 58.2 81.6 24.6 93 98 A A - 0 0 28 1,-0.2 -1,-0.1 29,-0.0 237,-0.1 -0.289 44.6 -73.3 -73.2 163.2 60.6 83.2 22.1 94 99 A L - 0 0 9 27,-0.1 -1,-0.2 -3,-0.1 313,-0.1 -0.307 52.6-132.7 -56.3 134.5 62.0 86.6 22.6 95 100 A T > - 0 0 71 -3,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.299 28.5 -98.9 -80.4 173.1 59.3 89.2 21.9 96 101 A A H > S+ 0 0 36 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.894 126.5 52.1 -59.5 -40.2 60.1 92.3 19.7 97 102 A D H > S+ 0 0 114 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.932 108.7 49.8 -65.9 -40.0 60.6 94.3 22.9 98 103 A E H > S+ 0 0 27 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.860 109.7 50.3 -67.1 -34.6 63.1 91.8 24.3 99 104 A I H X S+ 0 0 3 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.932 112.2 47.1 -68.6 -43.5 65.1 91.7 21.1 100 105 A K H X S+ 0 0 103 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.908 114.3 49.6 -61.9 -37.9 65.2 95.5 21.1 101 106 A Q H X S+ 0 0 47 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.914 109.1 49.2 -67.4 -44.0 66.2 95.3 24.7 102 107 A A H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 5,-0.2 0.897 111.2 50.9 -63.1 -41.0 69.0 92.7 24.2 103 108 A V H X S+ 0 0 11 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.921 108.6 51.6 -63.2 -42.9 70.5 94.8 21.4 104 109 A E H X S+ 0 0 129 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.907 108.8 51.9 -62.7 -38.3 70.5 97.9 23.6 105 110 A I H < S+ 0 0 14 -4,-2.1 3,-0.5 1,-0.2 4,-0.4 0.925 112.8 42.5 -65.6 -43.1 72.3 96.0 26.3 106 111 A V H >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.2 6,-0.3 0.899 112.4 55.1 -70.6 -34.6 75.1 94.8 24.0 107 112 A K H 3< S+ 0 0 112 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.691 99.9 61.4 -68.9 -17.9 75.3 98.2 22.3 108 113 A A T 3< S+ 0 0 88 -4,-1.1 -1,-0.2 -3,-0.5 2,-0.2 0.569 84.5 99.0 -83.8 -5.9 75.9 99.8 25.7 109 114 A S S X S- 0 0 25 -3,-1.2 3,-1.4 -4,-0.4 -3,-0.0 -0.573 78.6-131.3 -78.9 142.0 79.1 97.8 26.3 110 115 A A T 3 S+ 0 0 104 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.665 106.1 64.3 -67.0 -15.2 82.4 99.5 25.5 111 116 A D T 3 S+ 0 0 96 -5,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.635 74.3 110.6 -83.8 -10.2 83.3 96.5 23.5 112 117 A F < - 0 0 36 -3,-1.4 -5,-0.0 -6,-0.3 41,-0.0 -0.467 58.3-149.1 -66.4 123.7 80.6 96.9 20.9 113 118 A K > - 0 0 122 -2,-0.3 3,-2.0 1,-0.1 -2,-0.1 -0.747 22.8-101.6 -99.3 137.6 82.0 97.9 17.5 114 119 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.109 107.6 22.7 -48.8 147.0 80.3 100.1 14.9 115 120 A N T 3 S+ 0 0 148 1,-0.2 39,-0.4 38,-0.1 37,-0.0 0.529 82.2 156.1 70.6 4.0 78.7 98.0 12.1 116 121 A T < - 0 0 14 -3,-2.0 2,-0.2 37,-0.1 37,-0.2 -0.335 28.0-152.7 -63.1 145.2 78.5 94.8 14.2 117 122 A R E -R 152 0D 29 35,-3.1 35,-3.2 37,-0.0 2,-0.6 -0.722 10.2-124.6-114.4 165.7 75.8 92.5 12.8 118 123 A F E -R 151 0D 5 293,-3.2 33,-0.3 -2,-0.2 295,-0.2 -0.909 20.3-179.2-117.5 109.4 73.7 89.9 14.7 119 124 A T E S+ 0 0 17 31,-1.2 2,-0.3 -2,-0.6 32,-0.2 0.856 78.5 2.2 -74.2 -30.6 73.8 86.3 13.3 120 125 A E E -R 150 0D 26 30,-1.5 30,-3.5 291,-0.1 2,-0.4 -0.926 51.2-178.3-161.9 132.9 71.3 85.2 16.1 121 126 A I E +R 149 0D 10 -2,-0.3 288,-0.4 28,-0.2 2,-0.3 -0.944 34.7 148.2-128.6 104.3 69.4 86.7 19.0 122 127 A S E -R 148 0D 17 26,-1.9 26,-3.5 -2,-0.4 208,-0.1 -0.963 51.6 -80.1-143.3 161.0 67.5 84.0 20.9 123 128 A L E -R 147 0D 27 -2,-0.3 24,-0.3 24,-0.2 -30,-0.0 -0.227 30.1-145.9 -57.9 134.8 66.2 83.0 24.2 124 129 A L E -R 146 0D 50 22,-2.7 22,-0.7 38,-0.1 -1,-0.1 -0.937 38.3-134.8-103.8 105.6 68.8 81.3 26.5 125 130 A P - 0 0 45 0, 0.0 3,-0.1 0, 0.0 -34,-0.1 -0.346 6.2-106.1 -72.5 151.6 66.3 78.9 28.1 126 131 A P - 0 0 19 0, 0.0 2,-0.0 0, 0.0 19,-0.0 -0.025 59.1 -69.3 -68.0 173.5 65.9 78.0 31.7 127 132 A D > - 0 0 70 1,-0.1 4,-2.0 4,-0.0 3,-0.2 -0.388 46.3-117.8 -67.8 148.2 67.0 74.6 32.8 128 133 A K H > S+ 0 0 9 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.885 110.6 56.4 -53.4 -45.7 65.0 71.8 31.5 129 134 A E H > S+ 0 0 142 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.940 108.7 47.4 -58.6 -44.7 63.8 70.5 34.9 130 135 A A H > S+ 0 0 14 -3,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.877 111.5 50.9 -66.9 -36.4 62.3 74.0 35.7 131 136 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 3,-0.5 0.979 110.6 48.6 -66.0 -48.3 60.6 74.2 32.3 132 137 A W H X S+ 0 0 3 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.902 109.1 53.7 -57.1 -41.0 59.0 70.7 32.7 133 138 A A H X S+ 0 0 5 -4,-2.1 6,-2.2 -5,-0.2 4,-2.0 0.808 108.1 50.9 -64.7 -27.7 57.8 71.7 36.3 134 139 A F H X S+ 0 0 15 -4,-1.6 4,-1.5 -3,-0.5 -1,-0.2 0.954 114.0 44.0 -73.5 -46.8 56.1 74.8 34.7 135 140 A A H < S+ 0 0 16 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.899 126.3 29.6 -64.6 -39.2 54.4 72.6 32.1 136 141 A L H < S+ 0 0 59 -4,-2.7 -1,-0.2 -5,-0.2 -3,-0.2 0.699 137.1 20.2 -96.6 -21.8 53.3 69.8 34.4 137 142 A E H < S- 0 0 124 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.2 0.342 94.0-118.4-128.6 4.7 52.8 71.6 37.8 138 143 A N < + 0 0 101 -4,-1.5 -4,-0.3 -5,-0.2 -3,-0.1 0.674 56.6 161.0 65.6 21.2 52.4 75.3 36.9 139 144 A K - 0 0 94 -6,-2.2 -1,-0.2 -7,-0.1 -2,-0.1 -0.618 40.8-121.5 -78.7 126.4 55.6 76.0 38.9 140 145 A P - 0 0 95 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.255 17.5-124.4 -62.3 146.3 57.1 79.4 38.0 141 146 A V - 0 0 28 1,-0.1 -10,-0.0 2,-0.1 -11,-0.0 -0.834 19.4-157.4 -88.7 116.8 60.6 79.3 36.7 142 147 A D + 0 0 149 -2,-0.7 -1,-0.1 2,-0.0 -3,-0.0 0.185 59.8 105.2 -87.2 29.3 62.3 81.7 39.1 143 148 A Q S S- 0 0 65 -16,-0.1 -2,-0.1 1,-0.0 3,-0.1 -0.899 75.7-115.5-104.1 135.1 65.2 82.4 36.6 144 149 A P - 0 0 35 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 -0.206 39.7 -87.9 -65.8 157.3 65.1 85.8 34.8 145 150 A R - 0 0 61 18,-0.1 19,-2.0 -22,-0.0 20,-1.0 -0.511 53.1-174.2 -66.6 136.0 64.7 85.9 31.0 146 151 A K E -RS 124 163D 46 -22,-0.7 -22,-2.7 17,-0.2 2,-0.4 -0.948 10.6-155.2-130.8 151.8 68.1 85.7 29.3 147 152 A A E -RS 123 162D 0 15,-2.4 15,-2.6 -2,-0.3 2,-0.5 -0.980 14.1-139.5-131.8 144.9 69.1 85.9 25.7 148 153 A D E -RS 122 161D 53 -26,-3.5 -26,-1.9 -2,-0.4 2,-0.5 -0.838 23.5-167.5 -92.3 134.4 72.1 84.6 23.7 149 154 A V E -RS 121 160D 0 11,-2.9 11,-3.1 -2,-0.5 2,-0.6 -0.979 1.1-165.3-129.0 113.0 73.2 87.4 21.3 150 155 A I E -RS 120 159D 10 -30,-3.5 -30,-1.5 -2,-0.5 -31,-1.2 -0.925 12.9-166.7-105.6 120.8 75.6 86.2 18.7 151 156 A M E -RS 118 158D 0 7,-3.0 7,-2.2 -2,-0.6 2,-0.5 -0.777 20.9-153.1-112.6 152.3 77.4 89.0 16.9 152 157 A L E -RS 117 157D 0 -35,-3.2 -35,-3.1 -2,-0.3 2,-1.0 -0.970 7.8-169.6-122.3 111.2 79.5 89.3 13.9 153 158 A D E > S- S 0 156D 42 3,-3.1 3,-2.1 -2,-0.5 2,-1.2 -0.832 76.4 -53.8-100.5 92.9 82.0 92.3 14.0 154 159 A G T 3 S- 0 0 21 -2,-1.0 -37,-0.0 -39,-0.4 111,-0.0 -0.631 125.1 -22.8 74.0-101.0 83.1 92.3 10.4 155 160 A K T 3 S+ 0 0 38 -2,-1.2 2,-0.5 24,-0.0 25,-0.4 0.328 116.6 106.7-119.6 -0.1 84.1 88.5 10.3 156 161 A H E < -S 153 0D 96 -3,-2.1 -3,-3.1 23,-0.1 2,-0.4 -0.737 59.3-144.3 -90.6 126.5 84.7 88.1 14.1 157 162 A I E +S 152 0D 4 18,-0.5 18,-3.5 -2,-0.5 2,-0.4 -0.666 19.1 177.9 -92.1 137.3 82.2 86.1 16.1 158 163 A I E -ST 151 174D 14 -7,-2.2 -7,-3.0 -2,-0.4 2,-0.6 -0.998 16.4-150.6-137.0 133.6 81.4 87.1 19.6 159 164 A E E -ST 150 173D 47 14,-2.8 14,-2.8 -2,-0.4 2,-0.3 -0.923 19.2-178.6-105.6 124.5 78.9 85.4 21.9 160 165 A A E -ST 149 172D 0 -11,-3.1 -11,-2.9 -2,-0.6 2,-0.4 -0.862 15.0-153.5-120.7 156.1 77.2 87.6 24.5 161 166 A V E -ST 148 171D 22 10,-2.0 9,-3.4 -2,-0.3 10,-1.5 -0.993 12.7-167.5-126.4 132.7 74.6 86.7 27.1 162 167 A V E -ST 147 169D 0 -15,-2.6 -15,-2.4 -2,-0.4 2,-0.7 -0.963 20.3-140.3-123.2 144.9 72.2 89.3 28.4 163 168 A D E >> -ST 146 168D 7 5,-3.2 5,-1.7 -2,-0.4 4,-0.7 -0.910 19.5-168.9 -97.5 106.4 69.9 89.1 31.5 164 169 A L T 45S+ 0 0 6 -19,-2.0 -18,-0.2 -2,-0.7 -1,-0.1 0.847 81.3 50.8 -69.9 -36.2 66.6 90.8 30.2 165 170 A Q T 45S+ 0 0 134 -20,-1.0 -1,-0.1 1,-0.2 -19,-0.1 0.999 119.9 34.8 -64.3 -64.0 64.9 91.2 33.5 166 171 A N T 45S- 0 0 88 -21,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.518 104.6-132.2 -66.0 -6.1 67.9 92.8 35.2 167 172 A N T <5 + 0 0 93 -4,-0.7 2,-0.3 1,-0.2 -3,-0.2 0.877 59.9 126.1 56.5 45.8 68.9 94.6 32.0 168 173 A K E < -T 163 0D 104 -5,-1.7 -5,-3.2 -62,-0.0 2,-0.4 -0.965 65.9-111.3-140.1 156.7 72.5 93.7 32.2 169 174 A L E -T 162 0D 56 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.682 27.9-178.3 -78.1 123.2 75.3 92.1 30.2 170 175 A L E - 0 0 76 -9,-3.4 2,-0.3 -2,-0.4 -8,-0.2 0.775 63.8 -5.2 -98.5 -31.4 76.2 88.7 31.7 171 176 A S E -T 161 0D 53 -10,-1.5 -10,-2.0 2,-0.0 -1,-0.3 -0.994 46.2-164.5-160.0 159.0 79.1 87.7 29.4 172 177 A W E +T 160 0D 46 -2,-0.3 -12,-0.2 -12,-0.2 -3,-0.0 -0.915 20.2 175.1-148.6 110.0 81.0 88.7 26.2 173 178 A Q E -T 159 0D 115 -14,-2.8 -14,-2.8 -2,-0.3 -2,-0.0 -0.897 24.9-143.5-133.5 112.2 83.1 86.1 24.5 174 179 A P E -T 158 0D 79 0, 0.0 2,-0.8 0, 0.0 -16,-0.3 -0.357 23.3-136.7 -61.0 139.7 85.0 86.3 21.2 175 180 A I > - 0 0 48 -18,-3.5 3,-1.2 3,-0.1 -18,-0.5 -0.881 18.5-135.2-108.7 103.1 84.9 82.9 19.5 176 181 A K T 3 S- 0 0 175 -2,-0.8 3,-0.1 1,-0.2 -20,-0.0 -0.226 78.1 -2.8 -55.7 139.2 88.3 82.1 18.1 177 182 A D T 3 S+ 0 0 121 1,-0.2 -1,-0.2 57,-0.0 2,-0.2 0.300 93.0 135.9 61.8 -4.6 88.5 80.7 14.6 178 183 A A < - 0 0 19 -3,-1.2 -21,-0.5 -21,-0.1 2,-0.4 -0.512 44.9-147.1 -76.8 140.6 84.8 80.6 14.1 179 184 A H - 0 0 15 472,-0.4 472,-0.5 470,-0.3 2,-0.1 -0.875 20.0-123.9-102.9 134.1 83.4 81.8 10.8 180 185 A G - 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