==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 31-MAR-04 1SXY . COMPND 2 MOLECULE: NITROPHORIN 4; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODNIUS PROLIXUS; . AUTHOR E.M.MAES,A.WEICHSEL,J.F.ANDERSEN,D.SHEPLEY,W.R.MONTFORT . 184 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9747.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 65.2 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 . 74 40.2 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 . 3 1.6 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 . 13 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 8.7 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 0 1 1 2 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 1 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 A 0 0 58 0, 0.0 131,-0.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 147.5 11.3 15.5 22.6 2 2 A a + 0 0 44 129,-0.3 129,-0.1 1,-0.1 120,-0.1 -0.589 360.0 173.7 -85.2 144.6 8.9 13.3 24.6 3 3 A T + 0 0 96 -2,-0.3 2,-0.5 1,-0.0 -1,-0.1 0.461 43.8 90.8-129.8 -7.1 8.3 9.9 23.3 4 4 A K - 0 0 110 2,-0.0 2,-1.0 0, 0.0 -1,-0.0 -0.856 49.5-159.1-112.3 131.4 6.2 8.0 25.9 5 5 A N - 0 0 123 -2,-0.5 2,-0.2 -3,-0.0 0, 0.0 -0.843 32.4-151.6 -93.3 91.3 2.4 7.6 26.3 6 6 A A - 0 0 6 -2,-1.0 2,-0.5 1,-0.1 103,-0.1 -0.473 7.2-129.5 -67.8 139.1 2.5 6.8 29.9 7 7 A I - 0 0 123 -2,-0.2 3,-0.1 101,-0.1 2,-0.1 -0.758 20.6-128.2 -93.0 127.3 -0.3 4.6 31.1 8 8 A A - 0 0 19 -2,-0.5 102,-0.3 1,-0.1 72,-0.1 -0.384 38.3 -83.9 -70.2 154.3 -2.2 5.8 34.2 9 9 A Q > - 0 0 43 100,-2.6 3,-1.7 71,-0.1 2,-0.2 -0.297 44.9-111.6 -56.3 133.7 -2.7 3.5 37.1 10 10 A T T 3 S+ 0 0 139 1,-0.3 -1,-0.1 100,-0.2 70,-0.0 -0.484 105.1 10.7 -62.5 128.0 -5.7 1.1 36.8 11 11 A G T 3 S- 0 0 69 -2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.729 88.5-169.9 71.2 25.2 -8.2 2.3 39.4 12 12 A F < - 0 0 10 -3,-1.7 2,-0.9 67,-0.1 -1,-0.2 -0.174 16.9-139.5 -49.6 132.4 -6.3 5.5 40.2 13 13 A N > - 0 0 80 1,-0.2 4,-1.8 99,-0.1 3,-0.2 -0.815 21.6-177.9-102.4 93.9 -7.8 7.2 43.3 14 14 A K H > S+ 0 0 100 -2,-0.9 4,-3.0 1,-0.2 -1,-0.2 0.866 76.7 54.7 -64.5 -39.7 -7.8 10.9 42.4 15 15 A D H 4 S+ 0 0 107 1,-0.2 -1,-0.2 2,-0.2 33,-0.1 0.879 109.5 48.2 -68.0 -34.1 -9.2 12.2 45.7 16 16 A K H >4 S+ 0 0 107 -3,-0.2 3,-0.6 1,-0.1 -1,-0.2 0.909 116.3 42.7 -68.6 -42.6 -6.5 10.5 47.7 17 17 A Y H 3< S+ 0 0 3 -4,-1.8 2,-1.1 1,-0.3 3,-0.2 0.948 117.1 46.7 -67.5 -46.1 -3.7 11.8 45.4 18 18 A F T 3< S+ 0 0 11 -4,-3.0 30,-0.6 1,-0.2 -1,-0.3 -0.440 75.6 127.1 -93.9 58.2 -5.2 15.3 45.1 19 19 A N E < S-A 47 0A 88 -2,-1.1 28,-0.2 -3,-0.6 -1,-0.2 0.363 84.4-100.5 -99.2 3.4 -5.8 15.6 48.9 20 20 A G E S+ 0 0 23 26,-2.7 27,-0.2 1,-0.3 162,-0.1 0.360 84.6 119.4 93.6 -5.1 -4.0 18.9 49.5 21 21 A D E - 0 0 55 25,-0.4 25,-1.6 -4,-0.2 2,-0.3 -0.262 64.2 -95.9 -92.9 176.4 -0.8 17.3 50.9 22 22 A V E -A 45 0A 1 23,-0.2 2,-0.4 117,-0.1 23,-0.3 -0.734 24.3-163.0 -95.5 141.5 2.8 17.4 49.7 23 23 A W E -A 44 0A 1 21,-3.1 21,-2.6 -2,-0.3 2,-0.4 -0.989 11.1-151.4-118.1 134.4 4.7 14.8 47.6 24 24 A Y E -AB 43 138A 22 114,-2.8 114,-2.0 -2,-0.4 2,-0.6 -0.866 16.3-126.3-103.3 136.5 8.6 14.8 47.6 25 25 A V E + B 0 137A 18 17,-2.4 17,-0.4 -2,-0.4 112,-0.3 -0.715 32.5 170.7 -74.4 123.0 10.6 13.5 44.6 26 26 A T E + 0 0 7 110,-2.6 140,-2.4 -2,-0.6 141,-0.5 0.683 66.3 9.9-102.7 -24.0 13.0 10.9 45.9 27 27 A D E -CB 165 136A 18 109,-1.3 109,-2.7 138,-0.3 -1,-0.4 -0.989 66.1-168.9-154.4 148.2 14.3 9.5 42.6 28 28 A Y E -CB 164 135A 15 136,-2.2 136,-3.1 -2,-0.3 2,-0.4 -0.968 12.2-157.7-143.7 156.4 14.1 10.6 39.0 29 29 A L E - B 0 134A 20 105,-2.6 105,-2.6 -2,-0.3 2,-0.5 -0.941 7.1-167.6-137.1 111.7 14.8 9.3 35.5 30 30 A N E - B 0 133A 40 -2,-0.4 103,-0.2 103,-0.2 4,-0.1 -0.876 10.1-155.7 -95.4 124.3 15.2 11.6 32.5 31 31 A L S S+ 0 0 68 101,-2.6 -1,-0.1 -2,-0.5 102,-0.1 0.780 75.6 69.5 -72.1 -26.1 15.2 9.8 29.2 32 32 A E S > S- 0 0 47 100,-0.5 3,-1.6 1,-0.1 4,-0.3 -0.809 94.7-107.5 -97.7 134.7 17.2 12.5 27.3 33 33 A P T 3 S- 0 0 104 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.291 95.9 -2.2 -61.6 134.3 20.9 12.9 28.2 34 34 A D T 3 S+ 0 0 139 2,-0.2 4,-0.0 -4,-0.1 -2,-0.0 0.640 85.8 131.6 63.7 20.0 21.7 16.0 30.2 35 35 A D S < S+ 0 0 46 -3,-1.6 -1,-0.1 1,-0.1 -4,-0.0 0.841 78.8 17.3 -66.1 -34.2 18.2 17.3 30.1 36 36 A V S S- 0 0 46 -4,-0.3 -2,-0.2 -6,-0.1 -1,-0.1 -0.905 94.6 -89.8-135.0 157.0 18.5 18.0 33.9 37 37 A P - 0 0 51 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.303 30.5-124.5 -64.0 157.7 21.3 18.3 36.4 38 38 A K S S+ 0 0 165 1,-0.1 2,-0.4 -4,-0.0 127,-0.0 0.525 102.0 52.0 -80.8 -11.9 22.5 15.1 38.2 39 39 A R S S+ 0 0 134 2,-0.0 2,-0.3 130,-0.0 24,-0.3 -0.993 77.7 142.5-122.9 122.1 21.9 16.8 41.6 40 40 A Y - 0 0 36 -2,-0.4 2,-0.4 125,-0.2 21,-0.2 -0.990 36.1-148.3-157.9 162.0 18.4 18.2 42.1 41 41 A b E + D 0 60A 1 19,-1.8 19,-2.4 -2,-0.3 2,-0.3 -1.000 24.3 162.4-133.6 132.5 15.5 18.8 44.6 42 42 A A E + D 0 59A 17 -17,-0.4 -17,-2.4 -2,-0.4 2,-0.3 -0.996 4.9 163.8-153.0 151.2 11.8 18.9 43.7 43 43 A A E -AD 24 58A 4 15,-1.9 15,-2.4 -2,-0.3 2,-0.3 -0.961 11.2-164.0-154.3 164.8 8.5 18.6 45.5 44 44 A L E -AD 23 57A 12 -21,-2.6 -21,-3.1 -2,-0.3 2,-0.4 -0.987 15.5-141.1-148.3 157.5 4.8 19.4 44.8 45 45 A A E -AD 22 56A 0 11,-2.4 11,-2.4 -2,-0.3 2,-0.4 -0.947 20.6-168.7-112.7 150.2 1.5 19.8 46.5 46 46 A A E + D 0 55A 0 -25,-1.6 -26,-2.7 -2,-0.4 -25,-0.4 -0.997 25.8 116.9-142.3 127.9 -1.7 18.5 44.7 47 47 A G E -AD 19 54A 1 7,-2.2 7,-2.9 -2,-0.4 2,-0.5 -0.984 60.0 -88.5-173.2 171.2 -5.3 19.2 45.7 48 48 A T E - D 0 53A 86 -30,-0.6 2,-0.5 -2,-0.3 5,-0.2 -0.882 37.1-171.6 -97.8 132.2 -8.6 20.7 44.8 49 49 A A E > S- D 0 52A 17 3,-2.6 3,-2.1 -2,-0.5 -2,-0.0 -0.986 71.6 -20.4-127.9 116.3 -8.9 24.4 45.8 50 50 A S T 3 S- 0 0 118 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.891 129.7 -49.2 49.4 47.8 -12.3 26.1 45.4 51 51 A G T 3 S+ 0 0 64 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.334 115.5 115.0 81.6 -5.1 -13.4 23.4 43.0 52 52 A K E < -D 49 0A 98 -3,-2.1 -3,-2.6 21,-0.0 2,-0.5 -0.818 67.8-124.8-106.9 133.4 -10.3 23.6 40.8 53 53 A L E +D 48 0A 33 -2,-0.4 21,-2.7 21,-0.3 2,-0.3 -0.675 44.0 178.7 -78.0 123.1 -7.8 20.8 40.4 54 54 A K E -DE 47 73A 17 -7,-2.9 -7,-2.2 -2,-0.5 2,-0.4 -0.904 26.8-168.5-131.9 151.6 -4.4 22.3 41.3 55 55 A E E -DE 46 72A 0 17,-2.1 17,-2.4 -2,-0.3 2,-0.4 -0.998 7.0-161.5-134.2 142.3 -0.7 21.6 41.6 56 56 A A E -DE 45 71A 0 -11,-2.4 -11,-2.4 -2,-0.4 2,-0.3 -0.977 16.9-160.3-116.7 131.2 2.0 23.7 43.2 57 57 A L E -DE 44 70A 22 13,-2.6 13,-1.8 -2,-0.4 2,-0.4 -0.858 11.7-165.9-114.9 153.0 5.6 22.8 42.3 58 58 A Y E -DE 43 69A 20 -15,-2.4 -15,-1.9 -2,-0.3 2,-0.4 -0.999 6.7-176.8-134.9 130.3 9.0 23.6 43.9 59 59 A H E +DE 42 68A 55 9,-2.4 9,-2.0 -2,-0.4 2,-0.3 -0.979 4.4 174.5-124.4 139.9 12.4 23.1 42.1 60 60 A Y E -DE 41 67A 53 -19,-2.4 -19,-1.8 -2,-0.4 7,-0.2 -0.937 22.9-151.8-148.0 124.3 15.8 23.7 43.7 61 61 A D > - 0 0 19 5,-2.6 4,-2.4 -2,-0.3 5,-0.2 -0.858 14.4-155.6 -92.0 111.0 19.2 23.1 42.3 62 62 A P T 4 S+ 0 0 26 0, 0.0 -1,-0.1 0, 0.0 -22,-0.1 0.630 88.2 43.4 -69.1 -15.0 21.3 22.4 45.4 63 63 A K T 4 S+ 0 0 151 -24,-0.3 -23,-0.1 3,-0.1 -2,-0.0 0.856 124.9 28.8 -92.5 -48.4 24.6 23.4 43.8 64 64 A T T 4 S- 0 0 94 2,-0.1 3,-0.1 1,-0.0 -1,-0.0 0.695 96.0-132.6 -83.4 -19.7 23.6 26.6 41.9 65 65 A Q < + 0 0 138 -4,-2.4 2,-0.1 1,-0.3 -1,-0.0 0.478 46.2 161.5 73.2 8.4 20.8 27.5 44.4 66 66 A D - 0 0 88 -5,-0.2 -5,-2.6 -6,-0.1 2,-0.4 -0.417 16.1-178.0 -59.0 133.3 18.4 28.2 41.4 67 67 A T E +E 60 0A 66 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.998 12.3 162.6-139.5 135.8 14.9 28.1 42.9 68 68 A F E -E 59 0A 41 -9,-2.0 -9,-2.4 -2,-0.4 2,-0.3 -0.983 18.7-154.7-157.0 149.3 11.5 28.5 41.5 69 69 A Y E -EF 58 89A 21 20,-1.0 20,-2.0 -2,-0.3 2,-0.3 -0.863 13.9-172.1-112.1 153.7 7.8 27.8 42.3 70 70 A D E -EF 57 88A 8 -13,-1.8 -13,-2.6 -2,-0.3 2,-0.4 -0.979 9.3-160.6-140.0 152.6 4.9 27.2 40.0 71 71 A V E +EF 56 87A 2 16,-2.2 16,-2.2 -2,-0.3 2,-0.3 -0.996 15.4 175.7-132.9 144.6 1.2 26.8 40.2 72 72 A S E -EF 55 86A 3 -17,-2.4 -17,-2.1 -2,-0.4 2,-0.5 -0.995 31.1-133.5-143.4 148.0 -1.2 25.3 37.7 73 73 A E E -EF 54 85A 86 12,-0.6 12,-0.9 -2,-0.3 2,-0.5 -0.861 36.3-137.6 -90.0 127.4 -4.8 24.4 37.1 74 74 A L E - F 0 84A 4 -21,-2.7 2,-0.4 -2,-0.5 -21,-0.3 -0.808 10.6-152.8 -90.3 135.1 -4.8 20.9 35.7 75 75 A Q E - F 0 83A 95 8,-2.9 8,-2.1 -2,-0.5 2,-0.5 -0.839 22.3-118.2-102.5 147.0 -7.1 19.9 32.9 76 76 A V E + F 0 82A 93 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.739 35.6 166.4 -93.7 125.5 -8.3 16.3 32.6 77 77 A E E S- 0 0 121 4,-2.7 2,-0.3 -2,-0.5 5,-0.2 0.783 77.4 -34.0 -95.7 -39.1 -7.4 14.2 29.6 78 78 A S E > S- F 0 81A 57 3,-1.6 3,-2.5 0, 0.0 -1,-0.5 -0.928 93.6 -50.4-168.2 172.7 -8.4 10.9 31.3 79 79 A L T 3 S+ 0 0 90 1,-0.3 -71,-0.1 -2,-0.3 -67,-0.1 -0.408 129.9 5.0 -62.3 123.8 -8.3 9.5 34.8 80 80 A G T 3 S+ 0 0 0 -2,-0.2 29,-2.5 1,-0.1 2,-0.4 0.471 112.1 98.7 83.1 3.8 -4.8 10.0 36.0 81 81 A K E < +FG 78 108A 43 -3,-2.5 -4,-2.7 27,-0.2 -3,-1.6 -0.983 49.0 169.8-130.7 121.2 -3.6 12.0 32.9 82 82 A Y E -FG 76 107A 6 25,-2.7 25,-2.2 -2,-0.4 2,-0.4 -0.861 30.6-144.3-132.5 156.6 -3.5 15.8 33.0 83 83 A T E -FG 75 106A 30 -8,-2.1 -8,-2.9 -2,-0.3 2,-0.5 -0.994 22.7-166.8-121.1 130.8 -2.4 18.8 31.1 84 84 A A E -FG 74 105A 0 21,-3.1 21,-2.2 -2,-0.4 2,-0.6 -0.941 15.0-158.2-128.4 109.6 -1.1 21.7 33.2 85 85 A N E -FG 73 104A 63 -12,-0.9 -12,-0.6 -2,-0.5 19,-0.2 -0.790 31.8-151.9 -84.9 117.2 -0.5 25.3 32.0 86 86 A F E -F 72 0A 17 17,-0.7 2,-0.4 -2,-0.6 14,-0.4 -0.590 18.6-159.8-100.3 150.3 1.9 26.7 34.6 87 87 A K E -F 71 0A 49 -16,-2.2 -16,-2.2 -2,-0.2 2,-0.4 -0.996 23.4-126.7-124.0 135.3 2.7 30.1 36.0 88 88 A K E +FH 70 97A 56 9,-1.5 8,-2.9 -2,-0.4 9,-1.9 -0.676 39.1 171.3 -78.8 130.2 5.9 30.9 37.8 89 89 A V E -FH 69 95A 2 -20,-2.0 -20,-1.0 -2,-0.4 6,-0.2 -0.902 34.9-110.2-133.5 159.0 5.3 32.5 41.1 90 90 A D > - 0 0 55 4,-2.2 3,-2.0 -2,-0.3 6,-0.1 -0.280 54.7 -86.7 -76.7 178.2 7.2 33.4 44.2 91 91 A K T 3 S+ 0 0 102 1,-0.3 90,-0.1 2,-0.1 89,-0.1 0.704 130.3 54.1 -63.0 -21.3 6.6 31.4 47.4 92 92 A N T 3 S- 0 0 94 2,-0.1 -1,-0.3 88,-0.0 85,-0.0 0.347 122.1-102.9 -93.5 3.1 3.7 33.6 48.3 93 93 A G < + 0 0 11 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.518 68.5 149.0 89.9 4.8 1.9 33.2 44.9 94 94 A N - 0 0 94 1,-0.1 -4,-2.2 2,-0.0 -1,-0.3 -0.598 53.6-110.0 -73.4 132.7 2.8 36.5 43.3 95 95 A V E +H 89 0A 79 -2,-0.3 -6,-0.3 -6,-0.2 3,-0.2 -0.465 43.3 165.4 -73.3 127.7 3.1 36.0 39.6 96 96 A K E S+ 0 0 145 -8,-2.9 2,-0.4 1,-0.3 -7,-0.2 0.705 80.3 16.9-101.5 -40.9 6.6 36.2 38.0 97 97 A V E S-H 88 0A 73 -9,-1.9 -9,-1.5 3,-0.0 -1,-0.3 -0.948 86.3-134.2-137.3 116.0 5.8 34.7 34.6 98 98 A A - 0 0 64 -2,-0.4 -10,-0.1 -11,-0.2 -12,-0.1 -0.172 33.4 -83.4 -66.7 160.0 2.1 34.5 33.6 99 99 A V + 0 0 78 -14,-0.1 2,-0.3 -12,-0.1 -1,-0.1 -0.353 57.6 174.5 -54.7 138.7 0.4 31.5 32.0 100 100 A T > - 0 0 73 3,-0.4 3,-2.3 -14,-0.4 -14,-0.2 -0.985 37.4 -89.0-153.3 148.6 1.0 31.4 28.3 101 101 A A T 3 S+ 0 0 91 -2,-0.3 25,-0.1 1,-0.3 3,-0.1 -0.283 113.5 26.2 -49.0 134.8 0.2 29.1 25.4 102 102 A G T 3 S+ 0 0 37 1,-0.1 2,-0.8 23,-0.1 24,-0.7 0.324 94.3 102.9 85.5 -9.7 2.9 26.6 24.9 103 103 A N E < + I 0 125A 21 -3,-2.3 -17,-0.7 22,-0.2 -3,-0.4 -0.870 55.3 115.1-101.1 95.7 4.0 26.7 28.5 104 104 A Y E -GI 85 124A 66 20,-1.8 20,-2.7 -2,-0.8 2,-0.3 -0.987 47.1-150.1-151.8 158.3 2.5 23.5 29.8 105 105 A Y E -GI 84 123A 9 -21,-2.2 -21,-3.1 -2,-0.3 2,-0.3 -0.961 14.7-135.7-123.0 151.8 3.4 20.1 31.2 106 106 A T E -GI 83 122A 35 16,-2.2 16,-0.9 -2,-0.3 2,-0.3 -0.748 20.0-164.3 -95.9 157.1 1.6 16.8 31.0 107 107 A F E -GI 82 121A 5 -25,-2.2 -25,-2.7 -2,-0.3 2,-0.4 -0.960 8.2-177.6-149.2 119.3 1.4 14.7 34.1 108 108 A T E -GI 81 120A 2 12,-2.6 12,-2.1 -2,-0.3 2,-0.9 -0.984 19.6-145.9-125.0 125.4 0.4 11.0 34.4 109 109 A V E + I 0 119A 0 -29,-2.5 -100,-2.6 -2,-0.4 10,-0.2 -0.821 21.0 175.7 -91.8 105.0 0.1 9.1 37.6 110 110 A M E + 0 0 29 8,-2.0 2,-0.3 -2,-0.9 -100,-0.2 0.745 69.5 0.8 -79.8 -29.0 1.3 5.6 36.7 111 111 A Y E + I 0 118A 38 7,-1.5 7,-2.2 -102,-0.1 -1,-0.3 -0.962 69.2 168.9-157.3 142.1 1.1 4.2 40.3 112 112 A A E + I 0 117A 14 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.956 7.5 165.3-155.5 146.7 -0.0 5.6 43.6 113 113 A D - 0 0 42 3,-2.4 -2,-0.0 -2,-0.3 -101,-0.0 -0.702 61.1 -76.4-136.3-167.4 -0.9 4.5 47.1 114 114 A D S S+ 0 0 95 -2,-0.2 3,-0.1 1,-0.2 24,-0.0 0.799 128.1 23.6 -65.6 -27.3 -1.3 6.6 50.3 115 115 A S S S+ 0 0 67 1,-0.1 24,-2.3 23,-0.1 25,-0.4 0.568 121.9 33.4-113.3 -16.7 2.5 7.0 50.7 116 116 A S E + J 0 138A 10 22,-0.2 -3,-2.4 23,-0.1 2,-0.3 -0.936 53.1 178.9-144.9 160.4 4.2 6.6 47.3 117 117 A A E -IJ 112 137A 0 20,-1.8 20,-3.0 -2,-0.3 2,-0.4 -0.989 20.8-143.2-159.6 159.2 3.7 7.2 43.6 118 118 A L E +IJ 111 136A 1 -7,-2.2 -8,-2.0 -2,-0.3 -7,-1.5 -1.000 30.1 178.4-124.6 123.5 5.3 6.9 40.2 119 119 A I E -IJ 109 135A 6 16,-2.4 16,-2.5 -2,-0.4 2,-0.4 -0.892 21.0-150.2-124.6 157.1 4.6 9.7 37.7 120 120 A H E -IJ 108 134A 4 -12,-2.1 -12,-2.6 -2,-0.3 2,-0.3 -0.969 18.6-178.6-116.6 144.2 5.6 10.7 34.2 121 121 A T E -IJ 107 133A 24 12,-2.6 12,-2.0 -2,-0.4 2,-0.4 -1.000 16.1-163.3-142.8 144.7 5.8 14.3 33.0 122 122 A a E -I 106 0A 6 -16,-0.9 -16,-2.2 -2,-0.3 2,-0.4 -0.990 17.6-150.0-122.0 121.7 6.6 16.0 29.7 123 123 A L E -I 105 0A 58 -2,-0.4 2,-0.5 8,-0.4 7,-0.3 -0.769 11.7-173.2 -97.2 130.7 7.5 19.7 29.8 124 124 A H E +I 104 0A 70 -20,-2.7 -20,-1.8 -2,-0.4 2,-0.3 -0.982 15.4 161.0-119.1 121.8 6.8 22.1 27.0 125 125 A K E > -I 103 0A 68 -2,-0.5 3,-1.5 3,-0.3 -22,-0.2 -0.736 58.9 -63.6-150.1 95.4 8.2 25.6 27.4 126 126 A G T 3 S- 0 0 62 -24,-0.7 -1,-0.3 -2,-0.3 -24,-0.0 -0.387 109.8 -24.3 64.9-134.0 8.7 27.9 24.5 127 127 A N T 3 S+ 0 0 158 -3,-0.1 -1,-0.2 2,-0.1 2,-0.2 -0.027 98.8 129.4-104.2 27.6 11.2 26.5 22.0 128 128 A K < - 0 0 115 -3,-1.5 2,-0.7 1,-0.0 -3,-0.3 -0.556 56.8-134.9 -75.6 147.3 13.1 24.2 24.5 129 129 A D + 0 0 104 -2,-0.2 2,-0.3 -5,-0.1 -5,-0.1 -0.899 38.3 169.1-105.1 100.4 13.6 20.6 23.5 130 130 A L - 0 0 46 -2,-0.7 2,-0.2 -7,-0.3 -128,-0.0 -0.736 15.7-151.8-112.3 157.7 12.7 18.7 26.6 131 131 A G - 0 0 6 -2,-0.3 -8,-0.4 1,-0.1 -129,-0.3 -0.664 34.1 -56.1-129.0-178.4 12.1 14.9 27.1 132 132 A D - 0 0 2 -131,-0.5 -101,-2.6 -2,-0.2 -100,-0.5 -0.273 46.3-168.9 -61.8 140.1 10.3 12.4 29.2 133 133 A L E -BJ 30 121A 49 -12,-2.0 -12,-2.6 -103,-0.2 2,-0.4 -0.998 4.2-166.0-132.4 125.0 10.9 12.5 33.0 134 134 A Y E -BJ 29 120A 14 -105,-2.6 -105,-2.6 -2,-0.4 2,-0.4 -0.884 9.9-169.1-104.8 146.2 9.8 9.9 35.5 135 135 A A E -BJ 28 119A 6 -16,-2.5 -16,-2.4 -2,-0.4 2,-0.5 -0.994 19.1-146.1-139.4 133.5 9.7 10.5 39.2 136 136 A V E -BJ 27 118A 2 -109,-2.7 -110,-2.6 -2,-0.4 -109,-1.3 -0.844 28.7-165.6 -89.4 128.9 9.3 8.4 42.3 137 137 A L E -BJ 25 117A 1 -20,-3.0 -20,-1.8 -2,-0.5 2,-0.3 -0.820 11.8-177.0-114.5 153.1 7.4 10.3 45.0 138 138 A N E -BJ 24 116A 21 -114,-2.0 -114,-2.8 -2,-0.3 -22,-0.2 -0.994 33.6-132.9-143.7 154.1 6.9 9.7 48.7 139 139 A R S S+ 0 0 43 -24,-2.3 2,-0.6 -2,-0.3 -117,-0.1 0.733 101.1 62.6 -70.1 -23.4 5.0 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 -0.931 79.7-147.3-109.2 120.1 8.1 11.2 53.6 141 141 A K T 3 S+ 0 0 88 -2,-0.6 -1,-0.1 1,-0.3 30,-0.1 0.724 96.7 46.7 -63.1 -20.0 11.0 13.1 52.1 142 142 A D T 3 S+ 0 0 112 2,-0.1 -1,-0.3 -3,-0.0 2,-0.2 0.400 82.0 127.7-100.0 0.4 13.5 10.6 53.5 143 143 A A < - 0 0 27 -3,-1.8 2,-0.2 1,-0.1 3,-0.1 -0.419 54.1-136.5 -72.0 128.3 11.8 7.3 52.4 144 144 A A - 0 0 88 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 -0.503 42.8 -90.6 -66.9 145.4 13.7 4.7 50.5 145 145 A A - 0 0 22 -2,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.421 48.1-147.3 -64.9 126.7 11.6 3.4 47.6 146 146 A G > - 0 0 41 -2,-0.2 4,-2.4 -3,-0.1 5,-0.2 -0.258 28.8 -90.4 -86.3 178.7 9.6 0.3 48.7 147 147 A D H > S+ 0 0 131 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.815 118.1 58.6 -62.7 -36.1 8.5 -2.8 46.9 148 148 A K H > S+ 0 0 146 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.966 114.2 35.8 -61.1 -52.4 5.1 -1.4 45.7 149 149 A V H > S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.885 116.9 52.5 -73.0 -36.0 6.6 1.5 43.8 150 150 A K H X S+ 0 0 78 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.905 108.5 51.9 -65.7 -35.8 9.7 -0.3 42.7 151 151 A S H X S+ 0 0 74 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.919 107.5 53.1 -63.9 -38.4 7.5 -3.1 41.3 152 152 A A H X S+ 0 0 17 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.878 105.1 54.2 -63.1 -36.9 5.6 -0.3 39.4 153 153 A V H <>S+ 0 0 0 -4,-2.0 5,-1.9 1,-0.2 3,-0.5 0.948 111.0 46.2 -60.3 -46.7 8.9 0.9 37.9 154 154 A S H ><5S+ 0 0 79 -4,-2.2 3,-2.2 1,-0.2 -2,-0.2 0.910 108.3 55.1 -59.8 -43.4 9.5 -2.6 36.6 155 155 A A H 3<5S+ 0 0 83 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.764 102.5 57.2 -65.2 -23.4 5.9 -2.9 35.3 156 156 A A T 3<5S- 0 0 34 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.333 121.4-112.2 -81.2 4.0 6.5 0.3 33.3 157 157 A T T < 5S+ 0 0 130 -3,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.884 76.9 129.5 59.4 42.9 9.5 -1.6 31.7 158 158 A L < - 0 0 23 -5,-1.9 2,-0.6 -6,-0.1 -1,-0.3 -0.849 59.7-124.8-118.6 158.9 12.0 0.7 33.5 159 159 A E > - 0 0 119 -2,-0.3 3,-2.0 1,-0.1 4,-0.5 -0.925 9.4-157.3-105.9 113.2 15.1 -0.1 35.5 160 160 A F G > S+ 0 0 44 -2,-0.6 3,-1.6 1,-0.3 -1,-0.1 0.822 90.4 70.8 -60.1 -31.1 15.0 1.4 39.0 161 161 A S G 3 S+ 0 0 102 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.722 94.3 56.6 -57.0 -22.3 18.8 1.1 39.1 162 162 A K G < S+ 0 0 140 -3,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.693 84.1 102.5 -83.2 -17.9 18.9 3.9 36.5 163 163 A F S < S- 0 0 15 -3,-1.6 2,-0.5 -4,-0.5 -134,-0.2 -0.388 70.7-130.9 -69.4 144.3 17.0 6.4 38.6 164 164 A I E -C 28 0A 68 -136,-3.1 -136,-2.2 -2,-0.1 2,-0.2 -0.803 19.5-131.7 -96.5 128.4 19.0 9.2 40.3 165 165 A S E -C 27 0A 21 -2,-0.5 -138,-0.3 -138,-0.2 3,-0.2 -0.522 11.6-160.7 -76.2 147.2 18.3 9.7 44.0 166 166 A T S > S+ 0 0 7 -140,-2.4 3,-1.1 -2,-0.2 5,-0.4 0.413 70.2 96.0 -96.4 1.6 17.7 13.2 45.5 167 167 A K T 3 S+ 0 0 163 -141,-0.5 3,-0.4 1,-0.3 -1,-0.1 0.604 73.5 57.6 -75.7 -16.3 18.4 12.1 49.0 168 168 A E T 3 S+ 0 0 105 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.033 85.3 84.2-100.3 18.8 22.1 13.1 49.2 169 169 A N S < S- 0 0 16 -3,-1.1 -1,-0.2 -129,-0.1 -2,-0.1 0.334 95.8-118.6-107.9 7.6 21.6 16.8 48.5 170 170 A N - 0 0 165 -3,-0.4 2,-0.1 1,-0.2 -3,-0.1 0.752 47.1-175.1 56.9 25.8 20.6 18.3 51.9 171 171 A b - 0 0 16 -5,-0.4 2,-0.4 -131,-0.1 -1,-0.2 -0.348 9.4-174.7 -53.9 123.7 17.2 19.3 50.4 172 172 A A - 0 0 80 -2,-0.1 2,-0.3 -131,-0.0 -131,-0.0 -0.979 9.5-156.2-124.1 135.6 15.0 21.3 52.8 173 173 A Y - 0 0 40 -2,-0.4 2,-1.0 -131,-0.0 3,-0.2 -0.823 21.1-135.5-117.8 147.1 11.4 22.2 51.7 174 174 A D > + 0 0 51 -2,-0.3 4,-1.8 1,-0.2 3,-0.2 -0.761 27.2 175.1 -97.9 87.7 8.9 24.8 52.6 175 175 A N H > S+ 0 0 44 -2,-1.0 4,-2.3 1,-0.2 5,-0.2 0.809 75.4 60.2 -62.6 -33.6 5.8 22.7 52.9 176 176 A D H > S+ 0 0 129 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.914 105.3 47.5 -63.1 -44.1 3.7 25.6 54.1 177 177 A S H > S+ 0 0 8 -3,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.927 110.5 52.1 -62.8 -43.8 4.4 27.5 50.9 178 178 A L H X S+ 0 0 1 -4,-1.8 4,-0.7 1,-0.2 -2,-0.2 0.929 112.6 45.0 -60.0 -44.9 3.5 24.5 48.7 179 179 A K H >< S+ 0 0 98 -4,-2.3 3,-0.9 1,-0.2 4,-0.3 0.920 115.1 46.7 -64.0 -45.2 0.2 24.0 50.5 180 180 A S H >< S+ 0 0 52 -4,-2.3 3,-1.8 1,-0.2 4,-0.2 0.868 102.0 65.1 -69.7 -29.6 -0.8 27.6 50.4 181 181 A L H >< S+ 0 0 0 -4,-2.5 3,-1.9 1,-0.3 -1,-0.2 0.738 83.6 76.9 -63.1 -23.4 0.2 27.9 46.7 182 182 A L T << S+ 0 0 12 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.783 95.0 49.7 -55.9 -27.4 -2.6 25.5 45.9 183 183 A T T < 0 0 97 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.534 360.0 360.0 -87.1 -4.9 -5.1 28.4 46.4 184 184 A K < 0 0 112 -3,-1.9 -1,-0.2 -4,-0.2 -2,-0.2 0.435 360.0 360.0-102.0 360.0 -3.1 30.9 44.2