==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGAND BINDING PROTEIN, BLOOD CLOTTING 17-FEB-05 1YWB . COMPND 2 MOLECULE: NITROPHORIN 4; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODNIUS PROLIXUS; . AUTHOR E.M.MAES,A.WEICHSEL,S.A.ROBERTS,W.R.MONTFORT . 184 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9597.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 126 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 41.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.2 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 . 1 0.5 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 . 15 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 2 1 2 1 1 1 0 3 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 . 0 0 0 0 0 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 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 A 0 0 59 0, 0.0 131,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 139.8 11.5 15.3 22.7 2 2 A a + 0 0 45 129,-0.2 120,-0.1 1,-0.1 3,-0.0 -0.839 360.0 169.6-100.9 145.2 8.8 13.4 24.5 3 3 A T + 0 0 94 -2,-0.4 2,-0.4 1,-0.0 -1,-0.1 0.429 42.2 87.0-132.7 -7.0 8.2 9.9 23.4 4 4 A K - 0 0 113 2,-0.0 2,-1.0 3,-0.0 -1,-0.0 -0.887 51.1-156.1-115.2 135.0 6.0 8.0 25.8 5 5 A N - 0 0 122 -2,-0.4 2,-0.1 -3,-0.0 -3,-0.0 -0.853 33.2-149.6 -95.4 91.0 2.3 7.8 26.2 6 6 A A - 0 0 6 -2,-1.0 2,-0.5 1,-0.1 103,-0.1 -0.440 6.3-130.7 -68.0 141.1 2.3 7.0 29.9 7 7 A I - 0 0 124 -2,-0.1 2,-0.1 101,-0.1 3,-0.1 -0.792 19.3-128.2 -95.9 129.5 -0.6 4.8 31.1 8 8 A A - 0 0 22 -2,-0.5 102,-0.3 1,-0.1 72,-0.1 -0.389 37.8 -84.2 -72.7 154.9 -2.5 5.9 34.1 9 9 A Q > - 0 0 42 100,-2.6 3,-1.7 71,-0.2 2,-0.3 -0.292 44.6-114.3 -55.3 131.4 -3.1 3.6 37.0 10 10 A T T 3 S+ 0 0 139 1,-0.3 -1,-0.1 100,-0.2 70,-0.0 -0.501 104.2 12.2 -65.3 131.1 -6.1 1.3 36.6 11 11 A G T 3 S- 0 0 67 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.730 89.1-171.2 72.1 24.0 -8.5 2.4 39.3 12 12 A F < - 0 0 9 -3,-1.7 2,-0.9 67,-0.1 -1,-0.2 -0.160 18.4-139.0 -51.6 134.1 -6.7 5.6 40.1 13 13 A N > - 0 0 80 1,-0.2 4,-1.8 99,-0.1 3,-0.2 -0.809 21.9-177.4-101.5 94.0 -8.1 7.2 43.2 14 14 A K H > S+ 0 0 115 -2,-0.9 4,-2.9 1,-0.2 -1,-0.2 0.879 76.8 54.5 -64.3 -42.3 -8.1 10.9 42.3 15 15 A D H 4 S+ 0 0 115 1,-0.2 -1,-0.2 2,-0.2 33,-0.1 0.869 108.9 49.3 -66.2 -31.7 -9.5 12.2 45.6 16 16 A K H >4 S+ 0 0 103 -3,-0.2 3,-0.6 1,-0.2 -1,-0.2 0.910 116.2 41.8 -69.2 -42.3 -6.8 10.5 47.6 17 17 A Y H 3< S+ 0 0 3 -4,-1.8 2,-1.0 1,-0.3 3,-0.2 0.935 117.3 47.0 -68.2 -47.2 -4.0 11.8 45.4 18 18 A F T 3< S+ 0 0 11 -4,-2.9 30,-0.6 1,-0.2 -1,-0.3 -0.444 75.3 126.9 -91.9 57.6 -5.5 15.3 45.1 19 19 A N E < S-A 47 0A 87 -2,-1.0 28,-0.2 -3,-0.6 -1,-0.2 0.393 84.2-101.3-100.2 3.2 -6.1 15.6 48.9 20 20 A G E S+ 0 0 22 26,-2.8 27,-0.2 1,-0.3 162,-0.1 0.356 84.4 119.3 93.5 -5.2 -4.3 18.9 49.4 21 21 A D E - 0 0 57 25,-0.4 25,-1.7 -4,-0.2 -1,-0.3 -0.272 64.6 -95.0 -91.2 179.2 -1.2 17.3 50.8 22 22 A V E -A 45 0A 1 23,-0.2 2,-0.4 117,-0.1 23,-0.3 -0.713 24.4-162.3 -98.6 143.1 2.5 17.4 49.7 23 23 A W E -A 44 0A 1 21,-3.2 21,-2.7 -2,-0.3 2,-0.4 -0.993 11.6-150.6-119.1 132.1 4.3 14.8 47.6 24 24 A Y E -AB 43 138A 22 114,-2.8 114,-1.9 -2,-0.4 2,-0.6 -0.845 15.6-126.8-103.4 137.3 8.2 14.8 47.6 25 25 A V E + B 0 137A 18 17,-2.4 17,-0.4 -2,-0.4 112,-0.2 -0.730 32.8 169.7 -78.0 119.7 10.2 13.6 44.7 26 26 A T E + 0 0 7 110,-2.6 140,-2.4 -2,-0.6 141,-0.5 0.665 66.2 10.1-100.4 -24.4 12.6 11.0 46.0 27 27 A D E -CB 165 136A 14 109,-1.3 109,-2.8 138,-0.3 -1,-0.3 -0.985 65.2-172.4-153.6 148.3 13.9 9.6 42.7 28 28 A Y E -CB 164 135A 18 136,-2.2 136,-3.1 -2,-0.3 2,-0.3 -0.963 10.0-165.5-144.2 160.0 13.7 10.6 39.0 29 29 A L E - B 0 134A 29 105,-2.4 105,-3.0 -2,-0.3 2,-0.5 -0.929 3.7-166.3-147.0 120.2 14.6 9.4 35.5 30 30 A D E - B 0 133A 7 -2,-0.3 103,-0.2 103,-0.2 101,-0.1 -0.931 18.6-146.3-104.6 126.0 14.6 11.5 32.4 31 31 A L S S+ 0 0 67 101,-2.6 -1,-0.1 -2,-0.5 102,-0.1 0.741 107.1 48.7 -64.2 -20.5 14.8 9.5 29.2 32 32 A E S > S- 0 0 62 100,-0.3 3,-2.2 98,-0.2 4,-0.3 -0.859 84.4-174.3-107.5 84.8 16.9 12.4 27.9 33 33 A P G > S+ 0 0 86 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.799 73.9 62.0 -64.1 -26.1 19.1 12.4 31.0 34 34 A D G 3 S+ 0 0 146 1,-0.2 4,-0.1 -3,-0.1 -3,-0.0 0.601 85.3 78.4 -76.3 -4.3 21.0 15.6 30.0 35 35 A D G < S+ 0 0 51 -3,-2.2 -1,-0.2 95,-0.1 96,-0.0 0.699 100.6 34.7 -75.1 -18.7 17.8 17.7 30.1 36 36 A V S < S- 0 0 29 -3,-1.1 -6,-0.1 -4,-0.3 4,-0.1 -0.930 94.1 -93.6-134.7 154.0 17.9 17.9 33.9 37 37 A P - 0 0 50 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.109 25.4-124.2 -62.6 164.8 20.7 18.1 36.5 38 38 A K S S+ 0 0 145 1,-0.2 2,-0.4 -4,-0.1 -4,-0.0 0.643 102.2 45.1 -83.5 -17.9 22.2 15.1 38.3 39 39 A R S S+ 0 0 118 2,-0.0 2,-0.3 130,-0.0 24,-0.3 -1.000 77.0 147.6-127.1 125.9 21.4 16.6 41.7 40 40 A Y - 0 0 35 -2,-0.4 2,-0.4 125,-0.2 21,-0.2 -0.984 35.0-147.2-158.3 157.2 18.0 18.2 42.3 41 41 A b E + D 0 60A 1 19,-2.0 19,-2.4 -2,-0.3 2,-0.3 -0.989 28.3 160.9-122.5 135.4 15.2 18.8 44.8 42 42 A A E + D 0 59A 15 -17,-0.4 -17,-2.4 -2,-0.4 2,-0.3 -0.980 6.6 163.0-157.1 150.3 11.5 18.9 43.9 43 43 A A E -AD 24 58A 5 15,-2.0 15,-2.4 -2,-0.3 2,-0.3 -0.967 11.6-163.3-154.4 165.3 8.1 18.6 45.5 44 44 A L E -AD 23 57A 12 -21,-2.7 -21,-3.2 -2,-0.3 2,-0.4 -0.983 14.8-141.6-148.6 158.3 4.5 19.4 44.8 45 45 A A E -AD 22 56A 0 11,-2.4 11,-2.3 -2,-0.3 2,-0.4 -0.928 20.7-168.0-111.7 150.7 1.2 19.8 46.5 46 46 A A E + D 0 55A 0 -25,-1.7 -26,-2.8 -2,-0.4 -25,-0.4 -0.996 25.9 118.3-141.7 129.2 -1.9 18.5 44.7 47 47 A G E -AD 19 54A 1 7,-2.3 7,-2.9 -2,-0.4 2,-0.5 -0.985 59.5 -90.6-171.9 171.1 -5.5 19.2 45.6 48 48 A T E - D 0 53A 83 -30,-0.6 2,-0.5 -2,-0.3 5,-0.2 -0.903 36.0-169.3 -97.4 131.6 -8.9 20.7 44.7 49 49 A A E > S- D 0 52A 17 3,-2.5 3,-2.2 -2,-0.5 -2,-0.0 -0.986 72.1 -22.8-126.1 115.6 -9.2 24.3 45.7 50 50 A S T 3 S- 0 0 118 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.895 129.3 -48.1 46.9 48.3 -12.7 25.8 45.4 51 51 A G T 3 S+ 0 0 61 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.312 115.2 114.8 84.0 -7.0 -13.7 23.2 42.9 52 52 A K E < -D 49 0A 123 -3,-2.2 -3,-2.5 21,-0.0 2,-0.5 -0.809 67.7-124.9-103.8 132.7 -10.6 23.6 40.7 53 53 A L E +D 48 0A 34 -2,-0.4 21,-2.6 21,-0.4 2,-0.3 -0.661 43.7 178.0 -76.4 120.3 -8.0 20.8 40.3 54 54 A K E -DE 47 73A 11 -7,-2.9 -7,-2.3 -2,-0.5 2,-0.3 -0.922 27.3-169.1-131.4 151.5 -4.6 22.3 41.2 55 55 A E E -DE 46 72A 0 17,-2.0 17,-2.9 -2,-0.3 2,-0.4 -0.989 7.9-160.7-132.4 145.8 -1.0 21.5 41.6 56 56 A A E -DE 45 71A 0 -11,-2.3 -11,-2.4 -2,-0.3 2,-0.3 -0.991 17.5-159.4-121.0 130.5 1.7 23.7 43.2 57 57 A L E -DE 44 70A 23 13,-2.6 13,-1.8 -2,-0.4 2,-0.4 -0.865 12.4-166.3-115.6 151.2 5.3 22.9 42.3 58 58 A Y E -DE 43 69A 19 -15,-2.4 -15,-2.0 -2,-0.3 2,-0.4 -0.999 7.2-177.9-134.7 130.9 8.6 23.5 43.9 59 59 A H E +DE 42 68A 54 9,-2.4 9,-2.2 -2,-0.4 2,-0.3 -0.989 3.6 174.4-126.5 138.7 12.0 23.1 42.2 60 60 A Y E -DE 41 67A 53 -19,-2.4 -19,-2.0 -2,-0.4 7,-0.2 -0.954 23.0-151.5-147.7 123.2 15.4 23.7 43.8 61 61 A D > - 0 0 21 5,-2.6 4,-2.5 -2,-0.3 5,-0.3 -0.853 14.7-156.2 -88.9 112.9 18.9 23.0 42.3 62 62 A P T 4 S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 -22,-0.1 0.648 88.5 44.4 -72.4 -13.9 20.9 22.4 45.4 63 63 A K T 4 S+ 0 0 158 -24,-0.3 -23,-0.1 3,-0.1 -2,-0.0 0.867 124.9 28.6 -90.7 -50.0 24.2 23.3 43.7 64 64 A T T 4 S- 0 0 93 2,-0.1 3,-0.1 1,-0.0 -1,-0.0 0.715 95.5-133.2 -83.8 -19.1 23.2 26.5 41.9 65 65 A Q < + 0 0 138 -4,-2.5 2,-0.1 1,-0.3 -1,-0.0 0.449 46.4 160.4 72.7 13.7 20.4 27.5 44.4 66 66 A D - 0 0 88 -5,-0.3 -5,-2.6 -6,-0.1 2,-0.4 -0.445 16.9-177.5 -63.8 126.8 18.0 28.2 41.5 67 67 A T E +E 60 0A 64 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.998 11.6 163.1-136.2 133.7 14.6 28.1 43.0 68 68 A F E -E 59 0A 41 -9,-2.2 -9,-2.4 -2,-0.4 2,-0.3 -0.989 19.1-155.0-156.1 150.9 11.1 28.4 41.6 69 69 A Y E -EF 58 89A 23 20,-1.0 20,-2.1 -2,-0.3 2,-0.3 -0.872 13.2-169.2-114.0 151.3 7.5 27.8 42.4 70 70 A D E -EF 57 88A 9 -13,-1.8 -13,-2.6 -2,-0.3 2,-0.4 -0.982 11.9-152.6-139.2 152.7 4.6 27.2 40.0 71 71 A V E -EF 56 87A 2 16,-2.3 16,-2.2 -2,-0.3 2,-0.4 -0.993 19.9-173.1-123.9 135.4 0.9 27.0 40.3 72 72 A S E -E 55 0A 0 -17,-2.9 -17,-2.0 -2,-0.4 2,-0.5 -0.979 23.1-149.3-131.7 140.3 -1.1 25.0 37.8 73 73 A E E -E 54 0A 79 -2,-0.4 12,-2.2 -19,-0.2 2,-0.5 -0.909 29.6-143.3 -99.9 128.5 -4.7 24.4 37.0 74 74 A L E -G 84 0A 8 -21,-2.6 -21,-0.4 -2,-0.5 2,-0.4 -0.816 9.2-157.0 -98.2 133.7 -5.1 20.9 35.6 75 75 A Q E -G 83 0A 127 8,-2.9 8,-2.0 -2,-0.5 2,-0.5 -0.850 25.2-116.9-101.6 148.6 -7.5 19.9 32.9 76 76 A V E +G 82 0A 93 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.732 35.9 167.1 -91.9 126.1 -8.6 16.3 32.6 77 77 A E E S- 0 0 116 4,-2.7 2,-0.3 -2,-0.5 5,-0.2 0.752 77.0 -34.2 -94.8 -39.0 -7.8 14.2 29.6 78 78 A S E > S-G 81 0A 60 3,-1.7 3,-2.5 0, 0.0 -1,-0.5 -0.935 94.3 -48.7-169.4 175.2 -8.8 10.9 31.2 79 79 A L T 3 S+ 0 0 85 1,-0.3 -71,-0.1 -2,-0.3 -67,-0.1 -0.373 129.9 2.8 -64.6 125.2 -8.6 9.5 34.7 80 80 A G T 3 S+ 0 0 0 -2,-0.2 29,-2.5 1,-0.1 2,-0.4 0.530 112.4 98.9 78.4 7.1 -5.1 10.1 36.0 81 81 A K E < +GH 78 108A 43 -3,-2.5 -4,-2.7 27,-0.2 -3,-1.7 -0.990 48.9 169.5-133.5 122.7 -4.0 12.0 32.9 82 82 A Y E -GH 76 107A 5 25,-2.6 25,-2.3 -2,-0.4 2,-0.4 -0.868 32.7-142.2-132.2 157.2 -3.9 15.7 32.9 83 83 A T E -GH 75 106A 38 -8,-2.0 -8,-2.9 -2,-0.3 2,-0.5 -0.998 31.1-162.6-120.6 126.8 -2.7 18.8 31.0 84 84 A A E -GH 74 105A 0 21,-3.1 21,-2.1 -2,-0.4 -10,-0.2 -0.909 14.0-153.1-119.1 131.7 -1.5 21.6 33.2 85 85 A N E - H 0 104A 36 -12,-2.2 2,-0.3 -2,-0.5 19,-0.2 -0.366 21.0-154.7 -82.6 177.6 -0.9 25.1 32.7 86 86 A F - 0 0 17 17,-0.7 2,-0.4 14,-0.2 14,-0.4 -0.941 18.8-170.2-155.9 144.3 1.6 26.8 34.8 87 87 A K E -F 71 0A 36 -16,-2.2 -16,-2.3 -2,-0.3 2,-0.4 -0.988 29.1-126.6-122.8 136.2 2.4 30.2 36.1 88 88 A K E +FI 70 97A 65 9,-1.6 8,-3.0 -2,-0.4 9,-1.9 -0.695 39.9 172.0 -80.8 132.1 5.6 30.9 37.8 89 89 A V E -FI 69 95A 3 -20,-2.1 -20,-1.0 -2,-0.4 6,-0.2 -0.897 35.3-108.9-133.8 159.3 5.0 32.5 41.2 90 90 A D > - 0 0 55 4,-2.2 3,-2.1 -2,-0.3 6,-0.1 -0.324 55.5 -87.1 -76.5 179.8 6.9 33.5 44.3 91 91 A K T 3 S+ 0 0 101 1,-0.3 90,-0.1 2,-0.1 89,-0.1 0.697 129.9 54.5 -66.7 -17.8 6.3 31.3 47.4 92 92 A N T 3 S- 0 0 88 2,-0.1 -1,-0.3 88,-0.0 85,-0.0 0.342 122.2-102.3 -96.9 5.4 3.3 33.5 48.3 93 93 A G < + 0 0 10 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.533 68.8 149.0 91.4 3.4 1.6 33.1 45.0 94 94 A N - 0 0 95 1,-0.1 -4,-2.2 90,-0.1 -1,-0.3 -0.596 53.1-110.2 -72.9 132.8 2.5 36.4 43.4 95 95 A V E +I 89 0A 79 -2,-0.3 -6,-0.3 -6,-0.2 3,-0.2 -0.467 43.9 164.0 -74.3 126.4 2.8 36.0 39.6 96 96 A K E S+ 0 0 145 -8,-3.0 2,-0.4 1,-0.3 -7,-0.2 0.716 81.3 17.9-101.0 -36.3 6.2 36.2 38.0 97 97 A V E S-I 88 0A 68 -9,-1.9 -9,-1.6 3,-0.0 -1,-0.3 -0.954 86.3-137.0-139.4 114.4 5.4 34.7 34.7 98 98 A A - 0 0 60 -2,-0.4 -10,-0.1 -11,-0.2 -12,-0.1 -0.149 34.8 -80.6 -66.6 161.4 1.7 34.5 33.8 99 99 A V + 0 0 60 -12,-0.1 2,-0.3 -14,-0.1 -1,-0.2 -0.394 55.7 179.5 -52.3 143.1 0.0 31.5 32.2 100 100 A T > - 0 0 80 -14,-0.4 3,-1.9 3,-0.4 -14,-0.2 -0.976 37.3-105.1-149.4 153.4 0.6 31.3 28.4 101 101 A A T 3 S+ 0 0 103 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.750 114.8 40.7 -24.3 -69.4 -0.4 28.9 25.5 102 102 A G T 3 S+ 0 0 28 1,-0.1 24,-1.9 -3,-0.0 2,-0.8 0.279 94.4 87.5 -83.1 -5.8 2.7 27.2 25.0 103 103 A N E < + J 0 125A 27 -3,-1.9 -17,-0.7 22,-0.2 -3,-0.4 -0.889 61.3 116.3-103.2 101.3 3.7 26.7 28.6 104 104 A Y E -HJ 85 124A 75 20,-1.8 20,-3.0 -2,-0.8 2,-0.4 -0.980 44.2-149.0-153.6 163.2 2.1 23.5 29.8 105 105 A Y E -HJ 84 123A 8 -21,-2.1 -21,-3.1 -2,-0.3 2,-0.3 -0.989 15.2-132.9-132.2 149.6 3.0 20.0 31.1 106 106 A T E -HJ 83 122A 35 16,-2.4 16,-0.9 -2,-0.4 2,-0.4 -0.693 23.9-164.6 -89.3 154.5 1.3 16.7 30.8 107 107 A F E -HJ 82 121A 5 -25,-2.3 -25,-2.6 -2,-0.3 2,-0.4 -0.950 8.8-178.4-147.7 117.9 1.0 14.8 34.0 108 108 A T E -HJ 81 120A 0 12,-2.6 12,-2.2 -2,-0.4 2,-0.9 -0.987 20.0-147.1-123.5 126.1 0.1 11.1 34.3 109 109 A V E + J 0 119A 0 -29,-2.5 -100,-2.6 -2,-0.4 10,-0.2 -0.814 21.4 174.8 -92.9 104.2 -0.2 9.2 37.6 110 110 A M E + 0 0 28 8,-1.9 2,-0.3 -2,-0.9 -100,-0.2 0.750 68.5 2.7 -79.2 -31.8 1.0 5.7 36.7 111 111 A Y E + J 0 118A 41 7,-1.5 7,-2.5 -102,-0.1 -1,-0.3 -0.942 69.3 167.4-152.6 140.3 0.8 4.3 40.2 112 112 A A E + J 0 117A 15 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.973 7.1 163.0-154.4 149.0 -0.4 5.7 43.5 113 113 A D - 0 0 43 3,-2.6 -2,-0.0 -2,-0.3 -101,-0.0 -0.678 61.6 -73.6-139.5-166.0 -1.2 4.6 47.0 114 114 A D S S+ 0 0 95 -2,-0.2 3,-0.1 1,-0.2 24,-0.0 0.792 128.3 21.3 -66.7 -24.7 -1.6 6.5 50.3 115 115 A S S S+ 0 0 65 1,-0.1 24,-2.4 23,-0.1 25,-0.4 0.547 121.8 36.2-118.3 -14.3 2.1 7.0 50.7 116 116 A S E + K 0 138A 10 22,-0.2 -3,-2.6 23,-0.1 2,-0.3 -0.940 52.5 178.4-143.7 160.4 3.8 6.6 47.3 117 117 A A E -JK 112 137A 0 20,-1.8 20,-3.0 -2,-0.3 2,-0.4 -0.988 20.4-144.4-160.1 159.5 3.4 7.3 43.6 118 118 A L E +JK 111 136A 0 -7,-2.5 -8,-1.9 -2,-0.3 -7,-1.5 -0.998 29.4 177.3-126.3 123.6 5.0 7.0 40.2 119 119 A I E -JK 109 135A 6 16,-2.5 16,-2.4 -2,-0.4 2,-0.4 -0.886 20.5-150.3-125.2 160.6 4.3 9.8 37.7 120 120 A H E -JK 108 134A 4 -12,-2.2 -12,-2.6 -2,-0.3 2,-0.3 -0.979 17.2-178.6-121.8 139.5 5.3 10.8 34.2 121 121 A T E -JK 107 133A 20 12,-2.5 12,-2.5 -2,-0.4 2,-0.5 -0.997 18.1-163.4-136.3 145.6 5.5 14.4 33.0 122 122 A a E -JK 106 132A 7 -16,-0.9 -16,-2.4 -2,-0.3 2,-0.5 -0.988 20.7-154.9-119.0 114.7 6.3 16.0 29.6 123 123 A L E -J 105 0A 43 8,-0.5 7,-1.5 -2,-0.5 2,-0.5 -0.802 8.7-169.2 -93.1 130.4 7.1 19.7 30.1 124 124 A H E +JK 104 129A 41 -20,-3.0 -20,-1.8 -2,-0.5 2,-0.5 -0.977 12.1 176.8-118.3 123.4 6.7 22.1 27.2 125 125 A K E > S-JK 103 128A 103 3,-2.9 3,-1.5 -2,-0.5 2,-0.3 -0.861 73.4 -58.4-124.2 93.4 8.0 25.6 27.5 126 126 A G T 3 S- 0 0 35 -24,-1.9 -22,-0.1 -2,-0.5 -1,-0.1 -0.487 120.2 -17.4 58.8-121.4 7.1 26.9 24.0 127 127 A N T 3 S+ 0 0 181 -2,-0.3 2,-0.3 -3,-0.1 -1,-0.2 0.412 123.5 89.8 -96.6 9.2 8.8 24.7 21.5 128 128 A K E < - K 0 125A 113 -3,-1.5 -3,-2.9 -127,-0.0 2,-0.3 -0.810 54.2-173.6 -98.4 145.7 11.2 23.3 24.1 129 129 A D E - K 0 124A 37 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.907 27.3-136.5-128.2 167.1 10.5 20.2 26.1 130 130 A L E - 0 0 43 -7,-1.5 -98,-0.2 1,-0.3 -6,-0.1 0.061 51.4-113.1-109.2 22.6 12.3 18.6 29.0 131 131 A G E - 0 0 1 -8,-0.3 2,-0.7 -100,-0.1 -8,-0.5 0.077 56.6 -37.9 75.2 174.5 12.0 15.0 27.8 132 132 A D E - K 0 122A 2 -131,-0.5 -101,-2.6 -10,-0.1 2,-0.5 -0.656 67.2-168.2 -73.1 116.3 10.0 12.1 29.3 133 133 A L E -BK 30 121A 38 -12,-2.5 -12,-2.5 -2,-0.7 2,-0.4 -0.943 7.1-169.0-116.1 116.5 10.5 12.7 33.1 134 134 A Y E -BK 29 120A 10 -105,-3.0 -105,-2.4 -2,-0.5 2,-0.4 -0.841 6.9-170.4-101.0 142.9 9.5 9.9 35.5 135 135 A A E -BK 28 119A 8 -16,-2.4 -16,-2.5 -2,-0.4 2,-0.5 -0.996 18.8-146.7-139.1 132.6 9.3 10.6 39.3 136 136 A V E -BK 27 118A 1 -109,-2.8 -110,-2.6 -2,-0.4 -109,-1.3 -0.839 28.3-164.9 -90.3 127.1 8.9 8.5 42.3 137 137 A L E -BK 25 117A 1 -20,-3.0 -20,-1.8 -2,-0.5 2,-0.3 -0.837 12.2-176.5-113.1 153.8 7.0 10.3 45.0 138 138 A N E -BK 24 116A 19 -114,-1.9 -114,-2.8 -2,-0.3 -22,-0.2 -0.991 32.4-134.9-144.2 152.8 6.5 9.8 48.7 139 139 A R S S+ 0 0 43 -24,-2.4 2,-0.6 -2,-0.3 -117,-0.1 0.707 100.1 62.5 -70.5 -23.0 4.5 11.5 51.4 140 140 A N S > S- 0 0 93 -25,-0.4 3,-1.8 1,-0.1 -1,-0.1 -0.932 80.2-146.6-109.0 120.5 7.6 11.2 53.6 141 141 A K T 3 S+ 0 0 85 -2,-0.6 -1,-0.1 1,-0.3 30,-0.1 0.724 96.4 45.8 -62.9 -19.3 10.5 13.1 52.3 142 142 A D T 3 S+ 0 0 119 2,-0.1 2,-0.3 -3,-0.0 -1,-0.3 0.371 82.1 127.1-103.7 5.0 13.0 10.6 53.6 143 143 A A < - 0 0 27 -3,-1.8 2,-0.2 1,-0.1 3,-0.1 -0.429 55.4-134.4 -73.6 129.9 11.3 7.4 52.6 144 144 A A - 0 0 89 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 -0.502 42.8 -90.7 -68.7 145.8 13.3 4.8 50.6 145 145 A A - 0 0 20 -2,-0.2 -1,-0.1 -119,-0.1 2,-0.1 -0.387 49.1-147.0 -65.1 128.3 11.2 3.5 47.7 146 146 A G > - 0 0 38 -2,-0.2 4,-2.4 -3,-0.1 5,-0.2 -0.259 28.3 -91.3 -88.3-179.7 9.2 0.5 48.7 147 147 A D H > S+ 0 0 129 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.811 117.6 59.4 -69.0 -30.5 8.2 -2.6 46.9 148 148 A K H > S+ 0 0 144 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.968 114.5 36.0 -63.7 -50.0 4.8 -1.3 45.6 149 149 A V H > S+ 0 0 1 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.882 116.4 52.6 -74.3 -34.8 6.3 1.7 43.8 150 150 A K H X S+ 0 0 88 -4,-2.4 4,-2.3 1,-0.2 10,-0.2 0.901 109.1 51.1 -65.0 -36.9 9.4 -0.2 42.7 151 151 A S H X S+ 0 0 68 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.922 107.8 53.2 -63.6 -38.5 7.2 -2.9 41.2 152 152 A A H X S+ 0 0 17 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.872 105.6 53.8 -63.0 -37.4 5.2 -0.2 39.4 153 153 A V H ><>S+ 0 0 0 -4,-2.1 5,-2.0 1,-0.2 3,-0.6 0.947 110.9 46.4 -59.9 -47.2 8.5 1.1 37.9 154 154 A S H ><5S+ 0 0 78 -4,-2.3 3,-2.4 1,-0.2 -2,-0.2 0.899 107.6 56.5 -59.8 -40.9 9.2 -2.4 36.6 155 155 A A H 3<5S+ 0 0 85 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.762 101.3 57.4 -65.9 -23.4 5.6 -2.7 35.3 156 156 A A T <<5S- 0 0 34 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.325 122.9-110.2 -83.4 4.4 6.3 0.4 33.3 157 157 A T T < 5S+ 0 0 131 -3,-2.4 2,-0.2 1,-0.3 -3,-0.2 0.798 82.3 122.0 63.6 35.9 9.2 -1.5 31.7 158 158 A L < - 0 0 24 -5,-2.0 2,-0.5 -6,-0.1 -1,-0.3 -0.722 61.4-125.8-114.2 170.4 11.7 0.8 33.6 159 159 A E > - 0 0 106 -2,-0.2 3,-2.0 1,-0.1 4,-0.4 -0.978 3.5-153.7-124.2 117.5 14.4 -0.1 36.1 160 160 A F G > S+ 0 0 41 -2,-0.5 3,-1.7 1,-0.3 -1,-0.1 0.826 93.3 69.9 -59.7 -32.3 14.4 1.6 39.4 161 161 A S G 3 S+ 0 0 95 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.721 95.7 54.5 -55.2 -21.8 18.2 1.1 39.6 162 162 A K G < S+ 0 0 124 -3,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.620 85.8 103.6 -90.6 -13.0 18.6 3.7 36.9 163 163 A F S < S- 0 0 14 -3,-1.7 2,-0.5 -4,-0.4 -134,-0.2 -0.385 72.2-126.2 -69.6 146.4 16.6 6.4 38.7 164 164 A I E -C 28 0A 69 -136,-3.1 -136,-2.2 -2,-0.1 2,-0.2 -0.830 22.9-134.2 -94.4 127.0 18.6 9.2 40.3 165 165 A S E -C 27 0A 35 -2,-0.5 -138,-0.3 -138,-0.2 3,-0.3 -0.534 11.1-158.2 -78.9 148.7 17.8 9.8 44.0 166 166 A T > + 0 0 7 -140,-2.4 3,-1.2 -2,-0.2 5,-0.4 0.396 69.8 97.9 -95.9 2.0 17.3 13.2 45.5 167 167 A K T 3 S+ 0 0 156 -141,-0.5 3,-0.4 1,-0.3 -1,-0.1 0.643 73.2 55.8 -78.4 -19.4 18.2 12.0 49.1 168 168 A E T 3 S+ 0 0 161 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.102 86.8 83.1-103.2 25.2 21.8 13.1 49.3 169 169 A N S < S- 0 0 23 -3,-1.2 -1,-0.2 -129,-0.1 3,-0.1 0.306 96.8-118.0-107.9 7.1 21.1 16.8 48.5 170 170 A N - 0 0 159 -3,-0.4 -3,-0.1 1,-0.2 -2,-0.1 0.815 45.1-169.9 58.0 35.0 20.1 18.2 52.0 171 171 A b - 0 0 19 -5,-0.4 2,-0.4 -131,-0.1 -1,-0.2 -0.288 8.9-175.5 -59.6 130.8 16.7 19.1 50.4 172 172 A A - 0 0 76 -3,-0.1 2,-0.3 2,-0.0 -131,-0.0 -1.000 7.6-159.2-130.1 135.6 14.6 21.2 52.7 173 173 A Y - 0 0 32 -2,-0.4 2,-1.2 -131,-0.0 3,-0.1 -0.875 23.1-135.4-126.2 141.9 11.0 22.1 51.7 174 174 A D > + 0 0 51 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 -0.755 27.2 175.7 -96.0 86.6 8.5 24.8 52.6 175 175 A N H > S+ 0 0 54 -2,-1.2 4,-2.3 1,-0.2 5,-0.2 0.822 75.7 59.4 -59.6 -34.6 5.4 22.6 53.0 176 176 A D H > S+ 0 0 126 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.906 105.4 48.2 -63.5 -42.9 3.3 25.6 54.1 177 177 A S H > S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.931 110.2 51.9 -63.2 -44.0 4.0 27.5 50.9 178 178 A L H X S+ 0 0 0 -4,-1.9 4,-0.8 1,-0.2 -2,-0.2 0.926 112.2 45.3 -59.3 -44.7 3.1 24.5 48.8 179 179 A K H >< S+ 0 0 102 -4,-2.3 3,-0.8 1,-0.2 4,-0.3 0.925 114.8 47.4 -63.8 -44.3 -0.2 23.9 50.5 180 180 A S H >< S+ 0 0 44 -4,-2.4 3,-1.8 1,-0.2 4,-0.2 0.863 102.2 64.3 -67.2 -34.2 -1.1 27.6 50.4 181 181 A L H >< S+ 0 0 0 -4,-2.6 3,-1.8 1,-0.3 -1,-0.2 0.752 84.3 76.0 -61.8 -22.6 -0.2 27.9 46.7 182 182 A L T << S+ 0 0 12 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.796 95.9 49.4 -56.0 -28.2 -2.9 25.5 45.8 183 183 A T T < 0 0 94 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.558 360.0 360.0 -87.5 -4.1 -5.4 28.3 46.4 184 184 A K < 0 0 94 -3,-1.8 -91,-0.1 -4,-0.2 -90,-0.1 -0.194 360.0 360.0-102.0 360.0 -3.5 30.8 44.2