==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 17-AUG-11 3TGB . COMPND 2 MOLECULE: NITROPHORIN-4; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODNIUS PROLIXUS; . AUTHOR H.OGATA,C.HE,M.KNIPP . 184 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9411.0 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 . 72 39.1 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 1 0 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 64 0, 0.0 131,-0.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 162.8 -12.9 -1.0 4.0 2 2 A a + 0 0 41 129,-0.2 129,-0.1 1,-0.1 120,-0.1 -0.526 360.0 179.1 -78.0 149.6 -10.8 -3.3 1.9 3 3 A T + 0 0 98 -2,-0.2 2,-0.5 1,-0.0 -1,-0.1 0.435 46.1 88.8-130.0 -6.6 -10.2 -6.8 3.1 4 4 A K - 0 0 107 2,-0.0 2,-0.9 0, 0.0 -1,-0.0 -0.867 50.2-159.0-112.9 133.3 -8.1 -8.6 0.6 5 5 A N - 0 0 124 -2,-0.5 2,-0.1 -3,-0.0 0, 0.0 -0.865 31.9-151.2 -95.4 93.9 -4.3 -9.0 0.2 6 6 A A - 0 0 6 -2,-0.9 2,-0.5 1,-0.1 103,-0.1 -0.439 6.7-130.6 -69.5 140.3 -4.3 -9.9 -3.5 7 7 A I - 0 0 123 -2,-0.1 3,-0.1 101,-0.1 -1,-0.1 -0.798 20.4-127.7 -95.2 127.5 -1.5 -12.1 -4.6 8 8 A A - 0 0 21 -2,-0.5 102,-0.3 1,-0.1 72,-0.1 -0.364 36.6 -85.6 -70.7 153.0 0.4 -10.9 -7.7 9 9 A Q > - 0 0 44 100,-2.7 3,-1.7 71,-0.1 2,-0.3 -0.334 44.3-114.3 -55.9 129.7 1.0 -13.2 -10.6 10 10 A T T 3 S+ 0 0 142 1,-0.3 -1,-0.1 100,-0.2 70,-0.0 -0.527 104.7 13.6 -63.1 128.6 4.1 -15.4 -10.3 11 11 A G T 3 S- 0 0 67 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.731 88.7-172.5 73.3 21.9 6.5 -14.3 -13.0 12 12 A F < - 0 0 9 -3,-1.7 2,-0.9 67,-0.1 -1,-0.2 -0.215 18.7-138.5 -46.5 131.2 4.5 -11.1 -13.7 13 13 A N > - 0 0 75 1,-0.2 4,-1.9 99,-0.1 3,-0.2 -0.808 22.3-178.8-101.0 96.2 5.9 -9.4 -16.8 14 14 A K H > S+ 0 0 106 -2,-0.9 4,-2.9 1,-0.2 -1,-0.2 0.854 78.0 56.1 -67.6 -35.7 6.0 -5.7 -15.9 15 15 A D H 4 S+ 0 0 120 1,-0.2 -1,-0.2 2,-0.2 33,-0.1 0.864 110.0 47.0 -67.6 -32.5 7.4 -4.5 -19.3 16 16 A K H >4 S+ 0 0 129 -3,-0.2 3,-0.6 1,-0.1 -1,-0.2 0.893 117.0 42.1 -72.8 -41.1 4.6 -6.2 -21.1 17 17 A Y H 3< S+ 0 0 3 -4,-1.9 2,-1.1 1,-0.3 29,-0.3 0.939 117.0 46.7 -70.7 -46.5 1.8 -4.9 -18.9 18 18 A F T 3< S+ 0 0 6 -4,-2.9 -1,-0.3 1,-0.2 30,-0.2 -0.418 76.1 125.2 -94.5 56.2 3.3 -1.3 -18.6 19 19 A N S < S- 0 0 84 -2,-1.1 28,-0.2 -3,-0.6 -1,-0.2 0.365 84.2-102.8-100.8 3.4 3.8 -1.0 -22.3 20 20 A G S S+ 0 0 23 26,-2.8 27,-0.2 1,-0.3 162,-0.1 0.326 83.4 119.7 95.0 -8.3 1.9 2.2 -22.9 21 21 A D - 0 0 57 25,-0.3 25,-1.4 -4,-0.2 2,-0.3 -0.240 65.1 -96.9 -87.0 174.8 -1.1 0.5 -24.5 22 22 A V E -A 45 0A 2 23,-0.2 2,-0.4 117,-0.1 23,-0.3 -0.726 23.9-159.6 -97.6 144.9 -4.8 0.6 -23.2 23 23 A W E -A 44 0A 1 21,-3.3 21,-2.7 -2,-0.3 2,-0.4 -0.990 10.9-151.3-118.1 129.9 -6.6 -2.0 -21.1 24 24 A Y E -AB 43 138A 26 114,-3.0 114,-2.1 -2,-0.4 2,-0.5 -0.854 15.7-128.1 -99.1 133.8 -10.4 -2.1 -21.1 25 25 A V E + B 0 137A 18 17,-2.4 17,-0.4 -2,-0.4 112,-0.2 -0.698 32.7 170.0 -74.0 128.4 -12.4 -3.3 -18.1 26 26 A T E + 0 0 0 110,-2.9 140,-2.3 -2,-0.5 141,-0.7 0.618 65.4 11.3-109.7 -25.8 -14.8 -5.9 -19.4 27 27 A D E -CB 165 136A 7 109,-1.3 109,-2.9 138,-0.3 -1,-0.4 -0.984 66.1-170.8-152.0 147.0 -16.1 -7.3 -16.1 28 28 A Y E -CB 164 135A 14 136,-2.2 136,-3.3 -2,-0.3 2,-0.4 -0.965 12.6-157.0-142.6 157.3 -15.8 -6.3 -12.5 29 29 A L E - B 0 134A 21 105,-2.5 105,-2.6 -2,-0.3 2,-0.5 -0.951 6.9-166.4-136.4 114.0 -16.6 -7.5 -9.0 30 30 A D E - B 0 133A 37 -2,-0.4 103,-0.2 103,-0.2 4,-0.1 -0.882 8.9-157.6 -98.5 127.3 -17.1 -5.2 -6.0 31 31 A L S S+ 0 0 67 101,-2.4 -1,-0.1 -2,-0.5 102,-0.1 0.796 76.2 71.6 -74.7 -27.7 -17.0 -6.9 -2.7 32 32 A E S > S- 0 0 42 100,-0.5 3,-1.6 1,-0.1 4,-0.3 -0.780 93.7-111.6 -92.3 130.5 -19.0 -4.2 -0.9 33 33 A P T 3 S- 0 0 110 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.322 95.7 -0.5 -60.9 134.3 -22.7 -3.9 -1.8 34 34 A D T 3 S+ 0 0 157 2,-0.1 4,-0.0 -4,-0.1 -2,-0.0 0.679 88.1 133.7 63.3 20.1 -23.7 -0.8 -3.7 35 35 A D S < S+ 0 0 43 -3,-1.6 -1,-0.1 1,-0.1 -4,-0.0 0.814 75.9 14.3 -69.1 -31.9 -20.1 0.4 -3.7 36 36 A V S S- 0 0 51 -4,-0.3 -2,-0.1 -6,-0.1 -1,-0.1 -0.937 97.1 -84.4-139.0 159.2 -20.3 1.2 -7.4 37 37 A P - 0 0 56 0, 0.0 -2,-0.0 0, 0.0 3,-0.0 -0.320 33.5-127.1 -63.4 151.8 -23.1 1.6 -9.9 38 38 A K S S+ 0 0 137 1,-0.1 2,-0.5 -4,-0.0 0, 0.0 0.708 101.1 52.0 -74.2 -21.2 -24.3 -1.6 -11.6 39 39 A R S S+ 0 0 122 2,-0.0 2,-0.3 129,-0.0 24,-0.3 -0.974 79.2 136.8-115.9 119.7 -23.8 -0.1 -15.0 40 40 A Y - 0 0 33 -2,-0.5 2,-0.3 125,-0.2 21,-0.2 -0.990 37.3-145.7-158.6 160.2 -20.4 1.4 -15.5 41 41 A b E + D 0 60A 1 19,-1.9 19,-2.1 -2,-0.3 2,-0.3 -0.967 22.2 163.2-128.6 145.6 -17.4 1.8 -17.9 42 42 A A E + D 0 59A 18 -17,-0.4 -17,-2.4 -2,-0.3 2,-0.3 -0.970 6.3 168.3-159.1 153.1 -13.7 2.0 -17.3 43 43 A A E -AD 24 58A 4 15,-1.9 15,-2.4 -2,-0.3 2,-0.3 -0.963 10.4-164.1-154.0 165.0 -10.4 1.7 -19.0 44 44 A L E -AD 23 57A 12 -21,-2.7 -21,-3.3 -2,-0.3 2,-0.4 -0.984 15.0-142.4-149.5 156.4 -6.7 2.5 -18.3 45 45 A A E -AD 22 56A 0 11,-2.4 11,-2.6 -2,-0.3 2,-0.4 -0.974 19.1-167.4-116.3 141.0 -3.4 2.9 -20.0 46 46 A A E + D 0 55A 0 -25,-1.4 -26,-2.8 -2,-0.4 -25,-0.3 -0.998 27.5 121.0-129.3 130.1 -0.3 1.7 -18.1 47 47 A G E - D 0 54A 0 7,-2.4 7,-3.0 -2,-0.4 2,-0.4 -0.903 55.0 -88.0-163.2-172.4 3.2 2.6 -19.2 48 48 A T E - D 0 53A 86 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.967 27.2-171.7-117.0 141.2 6.5 4.2 -18.3 49 49 A A E > S- D 0 52A 18 3,-2.3 3,-1.8 -2,-0.4 -2,-0.0 -0.968 77.7 -21.2-131.5 115.0 7.3 7.8 -18.8 50 50 A S T 3 S- 0 0 129 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.873 128.9 -49.6 51.8 42.0 10.9 8.9 -18.2 51 51 A G T 3 S+ 0 0 74 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.288 113.8 116.3 88.0 -10.4 11.5 5.8 -16.1 52 52 A K E < -D 49 0A 98 -3,-1.8 -3,-2.3 23,-0.0 2,-0.4 -0.753 68.7-121.5 -95.3 136.7 8.4 6.2 -13.9 53 53 A L E -D 48 0A 29 21,-0.5 21,-2.9 -2,-0.4 2,-0.3 -0.633 42.1-178.3 -69.6 128.0 5.6 3.7 -13.8 54 54 A K E -DE 47 73A 18 -7,-3.0 -7,-2.4 -2,-0.4 2,-0.4 -0.953 19.4-167.6-131.2 148.3 2.4 5.6 -14.8 55 55 A E E -DE 46 72A 0 17,-2.1 17,-2.7 -2,-0.3 2,-0.4 -0.993 5.4-161.1-129.4 145.7 -1.3 4.8 -15.2 56 56 A A E -DE 45 71A 0 -11,-2.6 -11,-2.4 -2,-0.4 2,-0.3 -0.994 17.4-158.5-118.6 132.5 -4.0 6.9 -16.8 57 57 A L E -DE 44 70A 21 13,-2.6 13,-1.8 -2,-0.4 2,-0.4 -0.833 11.1-165.4-114.0 151.9 -7.6 6.1 -15.9 58 58 A Y E -DE 43 69A 16 -15,-2.4 -15,-1.9 -2,-0.3 2,-0.4 -0.998 6.0-176.4-135.1 128.5 -10.9 6.7 -17.5 59 59 A H E +DE 42 68A 54 9,-2.4 9,-2.1 -2,-0.4 2,-0.4 -0.982 3.5 177.7-121.6 137.9 -14.3 6.3 -15.8 60 60 A Y E -DE 41 67A 36 -19,-2.1 -19,-1.9 -2,-0.4 7,-0.2 -0.963 20.6-153.1-143.6 121.2 -17.6 6.8 -17.5 61 61 A D > - 0 0 18 5,-2.7 4,-2.2 -2,-0.4 -21,-0.1 -0.856 12.3-156.5 -90.0 111.2 -21.1 6.3 -16.0 62 62 A P T 4 S+ 0 0 24 0, 0.0 -1,-0.1 0, 0.0 -22,-0.1 0.623 88.5 40.1 -69.7 -11.5 -23.2 5.4 -19.1 63 63 A K T 4 S+ 0 0 137 -24,-0.3 -23,-0.1 3,-0.1 -2,-0.0 0.872 125.1 29.5 -96.8 -55.6 -26.4 6.6 -17.4 64 64 A T T 4 S- 0 0 94 2,-0.1 3,-0.1 1,-0.1 -1,-0.0 0.679 95.4-133.6 -81.0 -19.9 -25.5 9.8 -15.5 65 65 A Q < + 0 0 103 -4,-2.2 -1,-0.1 1,-0.3 2,-0.0 0.427 46.9 159.4 79.2 -0.2 -22.8 10.7 -18.0 66 66 A D - 0 0 89 -5,-0.1 -5,-2.7 -6,-0.1 2,-0.4 -0.357 16.9-179.7 -55.3 130.7 -20.4 11.5 -15.2 67 67 A T E +E 60 0A 66 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.998 9.3 164.6-140.5 136.6 -16.9 11.2 -16.7 68 68 A F E -E 59 0A 40 -9,-2.1 -9,-2.4 -2,-0.4 2,-0.3 -0.994 19.6-151.5-156.2 154.0 -13.4 11.6 -15.3 69 69 A Y E -EF 58 89A 16 20,-1.0 20,-2.2 -2,-0.3 2,-0.3 -0.890 12.6-171.0-119.0 150.4 -9.8 11.0 -16.0 70 70 A D E -EF 57 88A 8 -13,-1.8 -13,-2.6 -2,-0.3 2,-0.4 -0.974 9.3-157.4-137.8 152.9 -6.9 10.4 -13.6 71 71 A V E -EF 56 87A 2 16,-2.2 16,-2.4 -2,-0.3 2,-0.3 -0.992 17.2-179.3-126.3 140.8 -3.1 10.2 -13.9 72 72 A S E -EF 55 86A 2 -17,-2.7 -17,-2.1 -2,-0.4 2,-0.5 -0.997 27.3-141.1-138.4 144.7 -0.9 8.4 -11.3 73 73 A E E -EF 54 85A 85 12,-0.7 12,-1.1 -2,-0.3 2,-0.4 -0.885 34.1-137.8 -92.6 133.6 2.7 7.7 -10.7 74 74 A L E - F 0 84A 7 -21,-2.9 -21,-0.5 -2,-0.5 2,-0.4 -0.778 10.4-153.8 -97.4 138.3 3.0 4.2 -9.3 75 75 A Q E - F 0 83A 101 8,-3.0 8,-2.4 -2,-0.4 2,-0.4 -0.895 23.6-117.7-108.1 142.1 5.2 3.3 -6.4 76 76 A V E + F 0 82A 93 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.633 35.9 166.1 -86.4 124.9 6.4 -0.3 -6.2 77 77 A E E S- 0 0 113 4,-2.8 2,-0.3 1,-0.6 5,-0.2 0.756 77.5 -37.6 -95.0 -39.9 5.5 -2.5 -3.1 78 78 A S E > S- F 0 81A 58 3,-1.7 3,-2.5 0, 0.0 -1,-0.6 -0.940 92.2 -48.7-168.4 175.3 6.6 -5.7 -4.8 79 79 A L T 3 S+ 0 0 87 1,-0.3 -67,-0.1 -2,-0.3 -71,-0.1 -0.376 129.9 5.1 -62.1 121.2 6.5 -7.2 -8.3 80 80 A G T 3 S+ 0 0 0 -2,-0.2 29,-2.6 1,-0.1 2,-0.4 0.474 112.3 96.5 85.7 3.4 2.9 -6.7 -9.5 81 81 A K E < +FG 78 108A 42 -3,-2.5 -4,-2.8 27,-0.2 -3,-1.7 -0.972 50.0 169.7-134.2 118.3 1.8 -4.7 -6.5 82 82 A Y E -FG 76 107A 3 25,-2.5 25,-2.2 -2,-0.4 2,-0.4 -0.841 30.3-142.9-130.6 156.1 1.7 -0.9 -6.6 83 83 A T E -FG 75 106A 26 -8,-2.4 -8,-3.0 -2,-0.3 2,-0.5 -0.994 24.3-164.2-120.1 129.1 0.5 2.1 -4.7 84 84 A A E -FG 74 105A 0 21,-3.1 21,-2.1 -2,-0.4 2,-0.7 -0.954 15.4-155.7-124.9 117.5 -0.8 5.0 -6.9 85 85 A N E -FG 73 104A 46 -12,-1.1 -12,-0.7 -2,-0.5 2,-0.2 -0.817 29.5-150.7 -85.9 114.4 -1.4 8.7 -5.9 86 86 A F E -F 72 0A 16 -2,-0.7 2,-0.4 17,-0.6 14,-0.4 -0.581 17.1-163.6 -95.0 146.4 -3.9 10.0 -8.3 87 87 A K E -F 71 0A 51 -16,-2.4 -16,-2.2 -2,-0.2 2,-0.4 -0.991 24.4-127.1-119.3 134.5 -4.6 13.4 -9.7 88 88 A K E +FH 70 97A 53 9,-1.4 8,-3.1 -2,-0.4 9,-2.0 -0.670 39.2 170.0 -79.4 131.5 -7.9 14.2 -11.4 89 89 A V E -FH 69 95A 2 -20,-2.2 -20,-1.0 -2,-0.4 6,-0.2 -0.883 35.4-110.0-133.3 161.8 -7.3 15.7 -14.9 90 90 A D > - 0 0 49 4,-2.2 3,-2.0 -2,-0.3 6,-0.1 -0.342 53.7 -88.1 -80.1 179.5 -9.3 16.6 -17.9 91 91 A K T 3 S+ 0 0 80 1,-0.3 89,-0.1 2,-0.1 -1,-0.1 0.725 129.6 56.6 -65.5 -18.3 -8.7 14.4 -21.0 92 92 A N T 3 S- 0 0 99 2,-0.1 -1,-0.3 89,-0.0 3,-0.1 0.481 121.7-103.3 -89.1 -4.8 -5.9 16.8 -22.0 93 93 A G < + 0 0 10 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.474 69.2 149.8 93.9 2.7 -4.0 16.3 -18.8 94 94 A N - 0 0 95 1,-0.1 -4,-2.2 2,-0.0 2,-0.3 -0.560 51.9-113.7 -69.8 130.3 -5.0 19.7 -17.2 95 95 A V E +H 89 0A 80 -2,-0.3 -6,-0.3 -6,-0.2 3,-0.2 -0.493 43.0 164.3 -75.6 126.7 -5.1 19.2 -13.5 96 96 A K E S+ 0 0 145 -8,-3.1 2,-0.4 1,-0.3 -7,-0.2 0.708 77.4 20.1-106.9 -34.6 -8.4 19.5 -11.8 97 97 A V E S-H 88 0A 70 -9,-2.0 -9,-1.4 3,-0.0 -1,-0.3 -0.956 83.8-134.4-138.0 118.4 -7.6 18.0 -8.4 98 98 A A - 0 0 66 -2,-0.4 -10,-0.1 -11,-0.2 -12,-0.1 -0.188 35.4 -83.7 -65.4 159.2 -4.0 17.8 -7.3 99 99 A V - 0 0 74 -14,-0.1 2,-0.3 -12,-0.1 -1,-0.1 -0.385 52.3-175.6 -55.2 136.5 -2.3 14.8 -5.7 100 100 A T > - 0 0 74 -14,-0.4 3,-1.8 3,-0.4 -14,-0.2 -0.997 34.3-115.1-143.6 145.4 -3.0 14.6 -2.0 101 101 A A T 3 S+ 0 0 90 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.764 111.1 50.3 -49.5 -41.5 -1.8 12.2 0.7 102 102 A G T 3 S+ 0 0 47 1,-0.1 24,-0.8 -3,-0.0 2,-0.4 0.053 95.7 82.9 -89.6 27.3 -5.1 10.6 1.6 103 103 A N E < + I 0 125A 24 -3,-1.8 -17,-0.6 22,-0.2 -3,-0.4 -0.883 60.0 113.1-134.5 96.8 -6.0 9.9 -2.1 104 104 A Y E -GI 85 124A 68 20,-2.0 20,-3.0 -2,-0.4 2,-0.4 -0.983 43.2-145.9-156.9 161.1 -4.5 6.7 -3.5 105 105 A Y E -GI 84 123A 9 -21,-2.1 -21,-3.1 -2,-0.3 2,-0.3 -0.979 14.9-136.0-127.3 150.0 -5.3 3.3 -4.8 106 106 A T E -GI 83 122A 33 16,-2.1 16,-1.1 -2,-0.4 2,-0.3 -0.756 19.8-161.8 -94.7 160.3 -3.4 0.1 -4.6 107 107 A F E -GI 82 121A 5 -25,-2.2 -25,-2.5 -2,-0.3 2,-0.5 -0.963 9.1-176.9-148.2 114.5 -3.2 -2.1 -7.7 108 108 A T E -GI 81 120A 0 12,-2.7 12,-2.1 -2,-0.3 2,-0.9 -0.972 18.8-146.6-121.8 125.5 -2.3 -5.8 -7.9 109 109 A V E + I 0 119A 0 -29,-2.6 -100,-2.7 -2,-0.5 10,-0.2 -0.815 20.8 175.2 -90.3 105.1 -1.9 -7.7 -11.1 110 110 A M E + 0 0 31 8,-2.0 2,-0.3 -2,-0.9 -100,-0.2 0.751 69.5 2.2 -81.5 -28.6 -3.1 -11.2 -10.2 111 111 A Y E + I 0 118A 43 7,-1.6 7,-2.4 -102,-0.1 2,-0.3 -0.961 68.1 168.1-156.1 139.4 -2.9 -12.6 -13.8 112 112 A A E + I 0 117A 16 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.972 3.9 161.1-152.4 146.2 -1.8 -11.1 -17.1 113 113 A D - 0 0 37 3,-2.6 -2,-0.0 -2,-0.3 -101,-0.0 -0.708 61.6 -66.0-137.2-162.9 -0.9 -12.2 -20.6 114 114 A D S S+ 0 0 106 -2,-0.2 3,-0.0 1,-0.2 0, 0.0 0.892 129.7 14.3 -52.7 -43.0 -0.7 -10.6 -24.0 115 115 A S S S+ 0 0 43 23,-0.1 24,-2.4 24,-0.1 25,-0.4 0.528 122.0 41.2-116.2 -12.0 -4.4 -9.8 -24.2 116 116 A S E + J 0 138A 10 22,-0.2 -3,-2.6 23,-0.1 2,-0.3 -0.917 49.4 179.3-143.6 160.8 -6.0 -10.1 -20.8 117 117 A A E -IJ 112 137A 0 20,-1.8 20,-2.9 -2,-0.3 2,-0.4 -0.988 20.4-143.8-158.7 157.7 -5.5 -9.5 -17.1 118 118 A L E +IJ 111 136A 1 -7,-2.4 -8,-2.0 -2,-0.3 -7,-1.6 -0.999 30.7 178.3-123.3 124.2 -7.1 -9.9 -13.7 119 119 A I E -IJ 109 135A 6 16,-2.6 16,-2.4 -2,-0.4 2,-0.4 -0.876 21.3-151.1-124.3 158.5 -6.5 -7.1 -11.2 120 120 A H E -IJ 108 134A 4 -12,-2.1 -12,-2.7 -2,-0.3 2,-0.4 -0.973 17.6-176.3-119.6 142.3 -7.4 -6.1 -7.7 121 121 A T E -IJ 107 133A 20 12,-2.7 12,-1.9 -2,-0.4 2,-0.5 -1.000 16.8-160.7-138.2 142.6 -7.6 -2.5 -6.5 122 122 A a E -I 106 0A 7 -16,-1.1 -16,-2.1 -2,-0.4 2,-0.4 -0.973 19.1-152.9-116.7 115.8 -8.3 -0.9 -3.2 123 123 A L E -I 105 0A 58 -2,-0.5 2,-0.5 8,-0.5 7,-0.2 -0.749 11.4-172.8 -93.0 130.2 -9.4 2.8 -3.5 124 124 A H E +I 104 0A 70 -20,-3.0 -20,-2.0 -2,-0.4 2,-0.3 -0.981 19.7 154.8-118.8 118.4 -8.8 5.3 -0.7 125 125 A K E > -I 103 0A 74 -2,-0.5 3,-1.4 3,-0.5 -22,-0.2 -0.895 54.0 -61.5-151.5 115.0 -10.4 8.7 -1.3 126 126 A G T 3 S- 0 0 47 -24,-0.8 -1,-0.2 -2,-0.3 0, 0.0 -0.120 104.8 -23.2 51.4-135.0 -11.5 11.3 1.3 127 127 A N T 3 S+ 0 0 162 -3,-0.1 2,-0.4 2,-0.1 -1,-0.2 -0.096 100.6 114.4-105.1 34.8 -14.1 10.3 3.8 128 128 A K < - 0 0 113 -3,-1.4 2,-0.8 2,-0.0 -3,-0.5 -0.874 62.4-133.0-108.5 136.6 -15.8 7.4 1.9 129 129 A D + 0 0 114 -2,-0.4 2,-0.3 -5,-0.1 -5,-0.1 -0.795 36.0 180.0 -88.9 112.2 -15.7 3.8 3.0 130 130 A R - 0 0 60 -2,-0.8 2,-0.2 -7,-0.2 -95,-0.0 -0.829 13.6-148.0-119.7 153.9 -14.8 1.7 -0.0 131 131 A G - 0 0 5 -2,-0.3 -8,-0.5 1,-0.2 -129,-0.2 -0.560 36.2 -65.1-114.5 176.1 -14.3 -2.0 -0.6 132 132 A D - 0 0 2 -131,-0.4 -101,-2.4 -2,-0.2 -100,-0.5 -0.257 43.7-162.1 -60.0 144.3 -12.2 -4.2 -2.8 133 133 A L E -BJ 30 121A 48 -12,-1.9 -12,-2.7 -103,-0.2 2,-0.4 -0.999 4.3-166.3-129.4 128.9 -12.7 -4.2 -6.5 134 134 A Y E -BJ 29 120A 15 -105,-2.6 -105,-2.5 -2,-0.4 2,-0.4 -0.901 10.8-170.1-106.4 146.2 -11.6 -6.9 -8.9 135 135 A A E -BJ 28 119A 4 -16,-2.4 -16,-2.6 -2,-0.4 2,-0.5 -0.996 20.0-145.3-139.6 135.6 -11.5 -6.3 -12.7 136 136 A V E -BJ 27 118A 1 -109,-2.9 -110,-2.9 -2,-0.4 -109,-1.3 -0.864 28.5-163.8 -90.5 129.4 -11.1 -8.4 -15.8 137 137 A L E -BJ 25 117A 2 -20,-2.9 -20,-1.8 -2,-0.5 2,-0.3 -0.830 11.4-173.7-113.6 151.7 -9.2 -6.5 -18.4 138 138 A N E -BJ 24 116A 14 -114,-2.1 -114,-3.0 -2,-0.3 -22,-0.2 -0.991 31.9-133.8-140.1 150.2 -8.7 -7.0 -22.2 139 139 A R S S+ 0 0 31 -24,-2.4 2,-0.5 -2,-0.3 -117,-0.1 0.702 96.9 67.1 -69.0 -20.5 -6.7 -5.3 -24.8 140 140 A N S > S- 0 0 106 -25,-0.4 3,-1.9 -116,-0.1 -116,-0.1 -0.907 96.9-110.0-109.6 128.3 -9.8 -5.4 -27.0 141 141 A K T 3 S- 0 0 99 -2,-0.5 -115,-0.1 1,-0.3 -2,-0.1 -0.246 96.5 -5.2 -54.3 130.6 -12.8 -3.3 -26.1 142 142 A D T 3 S+ 0 0 40 -117,-0.2 -1,-0.3 1,-0.2 2,-0.1 0.669 89.3 164.3 59.5 21.3 -15.8 -5.4 -24.9 143 143 A A < - 0 0 25 -3,-1.9 -1,-0.2 1,-0.1 2,-0.1 -0.458 43.4-108.7 -70.6 139.3 -14.0 -8.8 -25.7 144 144 A A - 0 0 80 -2,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.414 43.3 -96.9 -63.5 141.5 -15.5 -11.9 -24.1 145 145 A A - 0 0 16 -2,-0.1 -1,-0.1 -119,-0.1 2,-0.1 -0.436 42.3-138.2 -65.1 127.6 -13.3 -13.3 -21.3 146 146 A G > - 0 0 37 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.267 25.2 -98.3 -81.6 172.9 -11.1 -16.1 -22.5 147 147 A D H > S+ 0 0 124 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.796 116.6 58.1 -65.2 -31.1 -10.3 -19.4 -20.7 148 148 A K H > S+ 0 0 137 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.967 111.5 38.2 -67.3 -51.4 -7.0 -18.2 -19.3 149 149 A V H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.897 115.9 53.5 -69.2 -35.3 -8.3 -15.2 -17.4 150 150 A K H X S+ 0 0 79 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.908 108.4 50.1 -64.1 -37.9 -11.4 -17.1 -16.4 151 151 A S H X S+ 0 0 75 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.904 108.4 53.5 -65.3 -37.5 -9.3 -19.9 -15.0 152 152 A A H X S+ 0 0 17 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.878 105.2 53.9 -63.8 -37.8 -7.3 -17.3 -13.1 153 153 A V H <>S+ 0 0 0 -4,-2.2 5,-2.0 1,-0.2 3,-0.4 0.955 111.4 45.8 -59.9 -47.1 -10.5 -15.9 -11.6 154 154 A S H ><5S+ 0 0 84 -4,-2.1 3,-2.2 1,-0.2 -2,-0.2 0.914 109.1 54.4 -58.2 -45.3 -11.3 -19.5 -10.4 155 155 A A H 3<5S+ 0 0 84 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.749 102.7 57.8 -66.2 -23.5 -7.7 -20.0 -9.0 156 156 A A T 3<5S- 0 0 39 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.362 121.2-112.8 -82.0 2.7 -8.1 -16.8 -7.0 157 157 A T T < 5S+ 0 0 131 -3,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.879 75.5 131.6 63.5 39.9 -11.2 -18.6 -5.4 158 158 A L < - 0 0 30 -5,-2.0 2,-0.7 -6,-0.1 -1,-0.3 -0.892 58.6-125.8-116.3 153.2 -13.6 -16.1 -7.0 159 159 A E > - 0 0 106 -2,-0.3 3,-2.0 1,-0.1 4,-0.4 -0.874 11.4-158.4-101.4 111.9 -16.8 -17.0 -8.9 160 160 A F G > S+ 0 0 50 -2,-0.7 3,-1.6 1,-0.3 -1,-0.1 0.809 88.2 70.7 -61.7 -27.8 -16.8 -15.4 -12.4 161 161 A S G 3 S+ 0 0 92 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.730 93.9 58.2 -61.2 -18.9 -20.6 -15.7 -12.6 162 162 A K G < S+ 0 0 140 -3,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.669 83.6 103.0 -85.5 -16.6 -20.7 -13.0 -9.9 163 163 A F S < S- 0 0 15 -3,-1.6 2,-0.5 -4,-0.4 -134,-0.2 -0.386 71.4-128.8 -66.5 144.0 -18.7 -10.5 -12.0 164 164 A I E -C 28 0A 39 -136,-3.3 -136,-2.2 -2,-0.1 2,-0.2 -0.833 19.9-131.5 -95.4 126.9 -20.7 -7.7 -13.7 165 165 A S E -C 27 0A 29 -2,-0.5 -138,-0.3 -138,-0.2 -125,-0.2 -0.536 17.6-170.6 -75.9 143.4 -20.2 -7.2 -17.4 166 166 A T > + 0 0 2 -140,-2.3 3,-1.4 -2,-0.2 5,-0.2 0.414 68.9 92.1-103.1 -2.7 -19.5 -3.7 -18.8 167 167 A K T 3 S+ 0 0 49 -141,-0.7 4,-0.2 1,-0.3 -1,-0.1 0.697 79.3 54.0 -72.3 -21.9 -19.8 -4.9 -22.4 168 168 A E T 3 S+ 0 0 139 -3,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.273 86.4 99.6 -99.7 9.2 -23.6 -4.2 -22.8 169 169 A N S < S- 0 0 28 -3,-1.4 2,-2.4 -129,-0.1 -3,-0.0 -0.717 88.7-110.9 -90.1 146.8 -23.3 -0.6 -21.8 170 170 A N + 0 0 151 -2,-0.3 2,-0.3 -108,-0.1 -2,-0.1 -0.519 61.5 163.9 -76.8 74.6 -23.3 2.0 -24.5 171 171 A b - 0 0 11 -2,-2.4 2,-0.3 -5,-0.2 -110,-0.0 -0.722 23.1-175.0 -96.1 143.8 -19.6 2.8 -23.7 172 172 A A - 0 0 66 -2,-0.3 2,-0.4 2,-0.0 -131,-0.0 -0.958 10.6-155.0-130.6 156.2 -17.1 4.7 -25.8 173 173 A Y - 0 0 23 -2,-0.3 2,-1.2 -131,-0.0 3,-0.2 -0.991 17.0-142.7-135.1 133.6 -13.5 5.2 -25.0 174 174 A D > + 0 0 44 -2,-0.4 4,-2.0 1,-0.2 3,-0.2 -0.696 27.5 171.2 -93.0 83.3 -10.9 7.8 -25.9 175 175 A N H > S+ 0 0 61 -2,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.801 74.2 58.7 -66.7 -26.3 -7.9 5.6 -26.2 176 176 A D H > S+ 0 0 116 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.920 106.7 47.2 -66.3 -42.6 -5.8 8.4 -27.7 177 177 A S H > S+ 0 0 14 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.925 110.5 52.2 -64.4 -43.4 -6.3 10.6 -24.7 178 178 A L H X S+ 0 0 1 -4,-2.0 4,-0.6 1,-0.2 -1,-0.2 0.917 111.4 47.0 -59.1 -43.7 -5.5 7.7 -22.3 179 179 A K H >< S+ 0 0 95 -4,-2.0 3,-1.0 1,-0.2 -1,-0.2 0.922 113.0 47.6 -65.2 -43.0 -2.2 7.0 -24.1 180 180 A S H >< S+ 0 0 62 -4,-2.3 3,-1.0 1,-0.2 -1,-0.2 0.746 101.7 65.9 -72.8 -21.6 -1.2 10.7 -24.2 181 181 A L H >< S+ 0 0 1 -4,-1.9 3,-2.4 1,-0.2 -1,-0.2 0.716 78.3 83.5 -68.2 -21.5 -2.0 11.1 -20.5 182 182 A L T << S+ 0 0 11 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.1 0.768 92.2 48.2 -56.0 -23.1 0.8 8.7 -19.6 183 183 A T T < 0 0 103 -3,-1.0 -1,-0.3 -4,-0.2 -2,-0.2 0.483 360.0 360.0 -93.9 -2.8 3.2 11.7 -19.8 184 184 A K < 0 0 108 -3,-2.4 -1,-0.2 -4,-0.1 -2,-0.2 0.466 360.0 360.0 -95.9 360.0 1.1 14.0 -17.7