==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 16-OCT-07 2RJX . COMPND 2 MOLECULE: VILLIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR J.MENG,C.J.MCKNIGHT . 131 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7676.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 78 59.5 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 . 0 0.0 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 . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 22.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 29.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 2 1 1 0 2 0 2 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 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 . 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 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 10 A P 0 0 87 0, 0.0 2,-0.7 0, 0.0 46,-0.1 0.000 360.0 360.0 360.0 7.1 14.8 37.4 13.4 2 11 A T - 0 0 101 44,-0.1 2,-0.2 45,-0.1 29,-0.0 -0.879 360.0-131.9-102.2 114.1 17.2 36.7 10.5 3 12 A K - 0 0 69 -2,-0.7 29,-0.2 1,-0.1 28,-0.1 -0.440 28.7-174.1 -65.4 131.5 17.9 39.6 8.2 4 13 A L - 0 0 89 27,-2.9 -1,-0.1 1,-0.3 20,-0.1 -0.192 48.8 -27.6-108.3-159.5 17.5 38.7 4.5 5 14 A E S S- 0 0 122 18,-0.1 -1,-0.3 -2,-0.1 2,-0.2 -0.355 74.6-121.1 -58.2 133.2 18.2 40.7 1.4 6 15 A T + 0 0 63 -3,-0.1 27,-0.2 -2,-0.0 -1,-0.1 -0.539 34.2 174.0 -81.7 139.9 17.8 44.4 2.2 7 16 A F - 0 0 33 25,-2.6 27,-0.3 -2,-0.2 5,-0.1 -0.981 39.6 -92.9-141.1 146.6 15.4 46.6 0.4 8 17 A P >> - 0 0 67 0, 0.0 4,-1.7 0, 0.0 3,-0.6 -0.250 34.8-117.0 -58.8 149.2 14.5 50.3 1.1 9 18 A L H 3> S+ 0 0 61 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.892 114.0 57.3 -54.2 -43.3 11.5 50.9 3.4 10 19 A D H 3> S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.864 103.5 52.7 -60.2 -35.7 9.6 52.6 0.6 11 20 A V H <> S+ 0 0 39 -3,-0.6 4,-0.9 1,-0.2 -1,-0.2 0.935 112.6 45.3 -64.6 -43.8 9.9 49.6 -1.7 12 21 A L H < S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.855 119.1 40.2 -69.3 -34.3 8.4 47.4 1.1 13 22 A V H < S+ 0 0 26 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.816 121.1 38.8 -84.6 -30.8 5.6 49.7 2.0 14 23 A N H < S+ 0 0 69 -4,-2.3 2,-0.5 -5,-0.2 -2,-0.2 0.353 94.0 91.8-105.6 4.9 4.5 50.9 -1.5 15 24 A T S < S- 0 0 33 -4,-0.9 5,-0.1 -5,-0.1 75,-0.1 -0.878 75.4-118.1-108.9 131.7 4.8 47.8 -3.6 16 25 A A > - 0 0 7 -2,-0.5 3,-1.8 1,-0.1 4,-0.4 -0.303 32.9-112.0 -60.1 146.7 1.9 45.3 -4.2 17 26 A A G > S+ 0 0 27 65,-0.4 3,-1.3 1,-0.3 -1,-0.1 0.851 116.2 50.0 -48.9 -48.1 2.7 41.8 -3.0 18 27 A E G 3 S+ 0 0 94 1,-0.2 -1,-0.3 8,-0.0 -2,-0.1 0.624 109.3 54.6 -70.1 -12.9 2.9 40.2 -6.4 19 28 A D G < S+ 0 0 113 -3,-1.8 -1,-0.2 2,-0.0 -2,-0.2 0.360 82.2 116.2-100.5 2.3 5.3 43.0 -7.5 20 29 A L S < S- 0 0 20 -3,-1.3 3,-0.1 -4,-0.4 -8,-0.0 -0.310 76.0 -83.5 -71.9 157.4 7.9 42.6 -4.7 21 30 A P > - 0 0 37 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.126 57.2 -81.6 -57.3 155.5 11.5 41.5 -5.4 22 31 A R T 3 S+ 0 0 242 1,-0.3 3,-0.1 -3,-0.1 -3,-0.0 -0.293 119.0 22.3 -56.6 137.2 12.4 37.8 -5.8 23 32 A G T 3 S+ 0 0 65 1,-0.2 2,-0.7 -3,-0.1 -1,-0.3 0.332 90.4 123.9 86.9 -10.6 12.8 36.3 -2.3 24 33 A V < - 0 0 14 -3,-2.1 -1,-0.2 -7,-0.1 -4,-0.1 -0.795 47.7-156.0 -92.1 117.5 10.7 38.8 -0.5 25 34 A D > - 0 0 71 -2,-0.7 3,-2.2 3,-0.2 6,-0.2 -0.819 10.6-145.8 -90.0 119.9 7.8 37.3 1.5 26 35 A P G > S+ 0 0 18 0, 0.0 3,-0.5 0, 0.0 56,-0.2 0.686 98.8 57.8 -60.9 -17.7 5.1 40.0 2.0 27 36 A S G 3 S+ 0 0 31 1,-0.2 3,-0.1 40,-0.1 39,-0.0 0.473 110.0 43.2 -92.4 0.7 4.3 38.6 5.4 28 37 A R G X + 0 0 83 -3,-2.2 3,-1.6 1,-0.1 4,-0.3 -0.174 66.4 140.9-135.3 40.6 7.9 39.0 6.6 29 38 A K G X + 0 0 0 -3,-0.5 3,-1.9 37,-0.4 4,-0.2 0.804 65.0 67.0 -56.5 -31.6 8.8 42.5 5.3 30 39 A E G > S+ 0 0 5 1,-0.3 3,-1.3 36,-0.2 -1,-0.3 0.793 90.7 63.8 -62.9 -25.9 10.7 43.4 8.5 31 40 A N G < S+ 0 0 19 -3,-1.6 -27,-2.9 1,-0.2 -1,-0.3 0.676 100.3 54.0 -72.5 -12.0 13.3 40.8 7.7 32 41 A H G < S+ 0 0 2 -3,-1.9 -25,-2.6 -4,-0.3 -1,-0.2 0.355 84.9 104.9-102.2 5.2 14.1 42.8 4.6 33 42 A L S < S- 0 0 0 -3,-1.3 -29,-0.1 -27,-0.2 2,-0.0 -0.603 79.0-110.9 -83.3 146.7 14.7 46.1 6.4 34 43 A S > - 0 0 29 -27,-0.3 4,-3.0 -2,-0.2 5,-0.2 -0.348 33.6-106.4 -68.7 160.0 18.3 47.2 6.8 35 44 A D H > S+ 0 0 102 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.902 123.1 51.1 -55.9 -40.4 19.5 47.1 10.4 36 45 A E H > S+ 0 0 144 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.920 112.1 45.1 -63.2 -45.9 19.3 50.9 10.6 37 46 A D H > S+ 0 0 43 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.893 111.1 53.5 -66.1 -39.8 15.8 50.9 9.2 38 47 A F H X>S+ 0 0 5 -4,-3.0 4,-3.1 1,-0.2 5,-0.6 0.949 111.9 45.1 -59.7 -49.2 14.7 48.1 11.6 39 48 A K H X5S+ 0 0 135 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.888 115.4 47.7 -61.6 -40.6 16.0 50.0 14.6 40 49 A A H <5S+ 0 0 70 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.895 118.6 39.8 -68.6 -39.9 14.4 53.2 13.4 41 50 A V H <5S+ 0 0 22 -4,-3.1 -2,-0.2 -5,-0.1 -3,-0.2 0.922 133.5 18.1 -77.1 -44.6 11.1 51.6 12.7 42 51 A F H <5S- 0 0 20 -4,-3.1 -3,-0.2 -5,-0.3 -2,-0.2 0.611 83.0-141.5-104.0 -18.5 10.8 49.3 15.7 43 52 A G S < - 0 0 92 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.336 39.0-115.5 -74.0 161.4 16.6 44.2 18.2 46 55 A R H > S+ 0 0 31 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.859 119.2 51.5 -64.5 -36.5 15.3 41.7 15.7 47 56 A S H > S+ 0 0 68 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.899 108.6 50.5 -67.2 -41.1 15.5 39.0 18.3 48 57 A A H >4 S+ 0 0 38 1,-0.2 3,-0.7 2,-0.2 4,-0.4 0.943 112.3 47.8 -60.6 -47.9 13.5 41.2 20.7 49 58 A F H >< S+ 0 0 4 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.916 109.2 52.4 -59.9 -45.4 10.9 41.7 18.0 50 59 A A H 3< S+ 0 0 32 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.710 105.7 56.0 -64.8 -21.0 10.7 38.0 17.1 51 60 A N T << S+ 0 0 130 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.491 85.7 102.4 -89.8 -6.3 10.1 37.1 20.8 52 61 A L S < S- 0 0 48 -3,-1.5 5,-0.0 -4,-0.4 -3,-0.0 -0.388 89.8 -89.4 -73.6 155.1 7.0 39.4 21.1 53 62 A P >> - 0 0 73 0, 0.0 4,-2.1 0, 0.0 3,-0.8 -0.351 40.4-112.8 -62.2 150.5 3.6 37.8 21.0 54 63 A L H 3> S+ 0 0 108 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.884 115.5 57.8 -53.1 -43.3 2.3 37.5 17.5 55 64 A W H 3> S+ 0 0 153 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.885 109.2 46.0 -58.0 -34.6 -0.5 39.9 18.0 56 65 A K H <> S+ 0 0 78 -3,-0.8 4,-2.7 2,-0.2 5,-0.2 0.894 110.1 51.9 -75.6 -41.4 2.0 42.6 19.1 57 66 A Q H X S+ 0 0 25 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.941 113.8 45.7 -58.3 -46.1 4.4 41.9 16.2 58 67 A Q H X S+ 0 0 59 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.921 111.7 50.4 -65.1 -42.2 1.4 42.3 13.8 59 68 A N H X S+ 0 0 63 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.914 110.7 49.5 -64.3 -40.5 0.1 45.4 15.5 60 69 A L H X S+ 0 0 43 -4,-2.7 4,-0.6 1,-0.2 -1,-0.2 0.901 113.7 46.2 -64.1 -40.6 3.5 47.1 15.3 61 70 A K H ><>S+ 0 0 6 -4,-2.1 5,-2.7 -5,-0.2 3,-0.9 0.903 109.3 54.8 -68.7 -40.5 3.9 46.2 11.7 62 71 A K H ><5S+ 0 0 73 -4,-2.9 3,-1.4 1,-0.3 -2,-0.2 0.905 104.0 54.6 -59.6 -40.3 0.3 47.4 10.9 63 72 A E H 3<5S+ 0 0 93 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.702 113.2 43.8 -68.0 -17.0 1.1 50.8 12.4 64 73 A K T <<5S- 0 0 108 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.320 114.6-112.5-109.8 7.0 4.0 51.1 10.1 65 74 A G T < 5S+ 0 0 7 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.700 86.9 115.6 70.2 21.3 2.3 49.8 6.9 66 75 A L < 0 0 0 -5,-2.7 -37,-0.4 -6,-0.2 -4,-0.2 0.281 360.0 360.0-105.1 9.8 4.5 46.7 6.9 67 76 A F 0 0 42 -6,-0.5 -40,-0.1 -5,-0.1 13,-0.1 -0.697 360.0 360.0-100.2 360.0 1.7 44.1 7.5 68 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 69 13 B L 0 0 159 0, 0.0 2,-0.3 0, 0.0 20,-0.1 0.000 360.0 360.0 360.0 113.7 -7.5 50.9 -11.2 70 14 B E - 0 0 134 18,-0.1 2,-0.3 29,-0.0 0, 0.0 -0.790 360.0-141.7-109.4 152.3 -10.2 48.7 -9.7 71 15 B T - 0 0 76 -2,-0.3 27,-0.2 27,-0.0 26,-0.1 -0.863 16.5-170.0-113.9 149.4 -12.4 49.4 -6.6 72 16 B F - 0 0 47 25,-3.0 27,-0.3 -2,-0.3 5,-0.1 -0.915 31.3 -90.9-134.8 159.7 -13.5 46.9 -4.0 73 17 B P >> - 0 0 74 0, 0.0 3,-1.6 0, 0.0 4,-0.8 -0.295 44.3-108.2 -65.5 155.1 -16.0 46.8 -1.1 74 18 B L H >> S+ 0 0 60 1,-0.3 4,-3.0 2,-0.2 3,-1.3 0.882 117.6 67.0 -51.2 -40.6 -14.6 47.8 2.3 75 19 B D H 34 S+ 0 0 137 1,-0.3 -1,-0.3 2,-0.2 0, 0.0 0.798 98.2 52.0 -51.6 -33.5 -14.7 44.1 3.3 76 20 B V H <4 S+ 0 0 46 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.747 120.1 31.0 -77.3 -25.4 -12.0 43.2 0.7 77 21 B L H X< S+ 0 0 0 -3,-1.3 3,-0.8 -4,-0.8 -2,-0.2 0.732 93.4 97.9-106.9 -29.9 -9.5 45.9 1.9 78 22 B V T 3< S- 0 0 32 -4,-3.0 53,-0.2 1,-0.2 52,-0.1 -0.397 99.9 -7.1 -69.4 138.9 -10.1 46.3 5.6 79 23 B N T 3 S+ 0 0 125 51,-2.0 2,-0.4 1,-0.2 -1,-0.2 0.882 96.2 151.1 44.7 50.1 -7.8 44.6 8.1 80 24 B T < - 0 0 24 -3,-0.8 -1,-0.2 50,-0.4 5,-0.1 -0.944 46.1-122.6-118.5 131.6 -6.2 42.6 5.3 81 25 B A > - 0 0 17 -2,-0.4 3,-2.0 1,-0.1 4,-0.4 -0.305 30.3-110.6 -65.9 150.0 -2.6 41.3 5.2 82 26 B A G > S+ 0 0 3 1,-0.3 3,-1.0 -56,-0.2 -65,-0.4 0.857 118.1 52.1 -50.1 -41.1 -0.4 42.4 2.4 83 27 B E G 3 S+ 0 0 103 1,-0.2 -1,-0.3 -66,-0.1 -56,-0.1 0.605 107.7 53.0 -75.8 -8.7 -0.4 38.9 0.8 84 28 B D G < S+ 0 0 108 -3,-2.0 -1,-0.2 -7,-0.1 -2,-0.2 0.308 81.7 110.2-107.3 4.1 -4.2 38.7 0.8 85 29 B L S < S- 0 0 24 -3,-1.0 3,-0.1 -4,-0.4 -8,-0.1 -0.394 79.8 -87.5 -76.3 160.3 -5.0 42.0 -1.0 86 30 B P > - 0 0 24 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.262 55.5 -85.8 -63.7 154.2 -6.5 41.9 -4.5 87 31 B R T 3 S+ 0 0 216 1,-0.2 -3,-0.0 -3,-0.1 -71,-0.0 -0.317 114.2 23.7 -58.5 142.8 -4.1 41.9 -7.4 88 32 B G T 3 S+ 0 0 49 1,-0.2 2,-0.4 -3,-0.1 -1,-0.2 0.509 85.7 137.6 80.5 6.8 -2.9 45.4 -8.3 89 33 B V < - 0 0 3 -3,-1.5 -72,-0.2 -20,-0.1 -1,-0.2 -0.730 50.9-138.6 -92.1 132.7 -3.6 47.1 -5.0 90 34 B D > - 0 0 52 -2,-0.4 3,-2.1 3,-0.2 6,-0.2 -0.781 13.9-151.4 -83.6 113.6 -1.0 49.6 -3.6 91 35 B P G > S+ 0 0 6 0, 0.0 3,-0.6 0, 0.0 -1,-0.2 0.753 93.9 56.7 -61.7 -20.5 -1.0 48.6 0.1 92 36 B S G 3 S+ 0 0 9 1,-0.2 -78,-0.1 -79,-0.1 3,-0.1 0.478 113.5 40.4 -86.7 -2.9 -0.0 52.2 1.0 93 37 B R G X + 0 0 117 -3,-2.1 3,-1.9 39,-0.1 4,-0.4 -0.226 63.7 143.6-138.0 45.2 -3.1 53.6 -0.7 94 38 B K G X S+ 0 0 13 -3,-0.6 3,-2.0 37,-0.4 38,-0.1 0.854 71.8 63.8 -55.9 -33.4 -5.9 51.1 0.0 95 39 B E G > S+ 0 0 12 36,-0.4 3,-1.3 1,-0.3 -1,-0.3 0.744 89.5 68.1 -64.3 -20.5 -8.4 54.0 0.2 96 40 B N G < S+ 0 0 70 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.666 93.5 60.3 -71.3 -15.3 -7.7 54.7 -3.5 97 41 B H G < S+ 0 0 7 -3,-2.0 -25,-3.0 -4,-0.4 2,-0.4 0.064 85.4 96.9-101.7 24.4 -9.5 51.4 -4.2 98 42 B L S < S- 0 0 0 -3,-1.3 -27,-0.0 -27,-0.2 -3,-0.0 -0.899 78.4-116.0-110.0 141.9 -12.8 52.5 -2.6 99 43 B S > - 0 0 21 -2,-0.4 4,-2.4 -27,-0.3 5,-0.2 -0.291 34.4-105.9 -67.3 163.4 -15.7 53.8 -4.8 100 44 B D H > S+ 0 0 106 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.901 122.6 51.5 -57.7 -39.5 -16.6 57.4 -4.0 101 45 B E H > S+ 0 0 131 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.933 112.0 42.9 -62.5 -50.5 -19.7 56.1 -2.2 102 46 B D H > S+ 0 0 61 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.829 111.9 56.4 -66.9 -31.8 -17.8 53.7 0.0 103 47 B F H X S+ 0 0 2 -4,-2.4 4,-3.1 2,-0.2 5,-0.4 0.948 110.4 42.7 -64.6 -49.2 -15.1 56.3 0.7 104 48 B K H X S+ 0 0 101 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.875 111.7 56.5 -64.5 -37.5 -17.6 58.8 2.0 105 49 B A H < S+ 0 0 85 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.791 117.0 34.4 -66.0 -27.8 -19.4 56.1 3.9 106 50 B V H < S+ 0 0 27 -4,-1.4 -2,-0.2 -3,-0.4 -1,-0.2 0.874 128.9 31.4 -94.7 -42.9 -16.2 55.2 5.7 107 51 B F H < S- 0 0 14 -4,-3.1 -3,-0.2 2,-0.3 -2,-0.2 0.620 92.9-130.2 -93.2 -13.7 -14.4 58.5 6.1 108 52 B G S < S+ 0 0 68 -4,-2.2 2,-0.3 -5,-0.4 -4,-0.2 0.750 81.8 68.2 71.0 21.7 -17.4 60.9 6.4 109 53 B M S S- 0 0 42 -6,-0.3 -2,-0.3 -5,-0.1 -1,-0.2 -0.969 87.1 -93.1-160.7 166.1 -16.0 63.1 3.8 110 54 B T > - 0 0 51 -2,-0.3 4,-2.6 -3,-0.1 5,-0.2 -0.309 38.8-107.0 -81.3 170.0 -15.2 63.2 0.1 111 55 B R H > S+ 0 0 76 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.869 122.1 52.9 -64.1 -37.5 -11.9 62.2 -1.5 112 56 B S H 4 S+ 0 0 84 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.886 110.4 47.0 -66.6 -39.0 -11.2 65.9 -2.2 113 57 B A H >4 S+ 0 0 36 1,-0.2 3,-1.8 2,-0.2 4,-0.4 0.943 110.4 52.0 -66.4 -47.4 -11.8 66.8 1.4 114 58 B F H >< S+ 0 0 6 -4,-2.6 3,-1.5 1,-0.3 -2,-0.2 0.862 102.3 61.0 -57.5 -36.2 -9.6 64.0 2.7 115 59 B A T 3< S+ 0 0 63 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.687 99.4 57.3 -65.3 -18.3 -6.8 65.2 0.4 116 60 B N T < S+ 0 0 139 -3,-1.8 -1,-0.3 -4,-0.5 -2,-0.2 0.517 84.6 101.9 -92.2 -4.3 -6.9 68.5 2.3 117 61 B L S < S- 0 0 42 -3,-1.5 -3,-0.0 -4,-0.4 5,-0.0 -0.423 87.7 -96.9 -75.5 152.8 -6.2 66.8 5.7 118 62 B P >> - 0 0 67 0, 0.0 4,-2.0 0, 0.0 3,-0.7 -0.407 39.1-112.1 -65.1 151.1 -2.7 67.0 7.1 119 63 B L H 3> S+ 0 0 108 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.912 116.1 55.9 -52.2 -48.2 -0.8 63.8 6.3 120 64 B W H 3> S+ 0 0 154 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.845 109.3 47.2 -55.6 -34.4 -0.7 62.6 9.9 121 65 B K H <> S+ 0 0 74 -3,-0.7 4,-2.8 2,-0.2 -1,-0.2 0.886 110.1 52.1 -74.5 -38.1 -4.5 62.9 10.2 122 66 B Q H X S+ 0 0 40 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.939 113.5 45.6 -60.2 -46.6 -5.0 61.0 6.9 123 67 B Q H X S+ 0 0 67 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.916 112.5 49.3 -65.2 -43.6 -2.7 58.3 8.3 124 68 B N H X S+ 0 0 61 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.916 110.7 49.8 -63.6 -40.9 -4.5 58.2 11.6 125 69 B L H X S+ 0 0 20 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.927 111.2 50.0 -64.5 -40.0 -7.9 58.0 10.1 126 70 B K H <>S+ 0 0 8 -4,-2.1 5,-3.0 -5,-0.2 6,-0.6 0.937 111.3 48.2 -62.0 -45.7 -6.8 55.1 7.9 127 71 B K H ><5S+ 0 0 57 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.906 110.0 52.8 -60.4 -43.0 -5.3 53.2 10.8 128 72 B E H 3<5S+ 0 0 129 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.815 113.1 44.3 -63.1 -30.2 -8.5 53.8 12.8 129 73 B K T 3<5S- 0 0 70 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.348 115.9-111.5 -98.1 6.9 -10.5 52.3 9.9 130 74 B G T < 5S+ 0 0 15 -3,-1.2 -51,-2.0 -4,-0.3 -50,-0.4 0.709 89.3 110.2 72.6 22.5 -8.2 49.4 9.2 131 75 B L < 0 0 0 -5,-3.0 -37,-0.4 -6,-0.2 -36,-0.4 0.197 360.0 360.0-114.8 15.6 -7.1 50.8 5.9 132 76 B F 0 0 43 -6,-0.6 -39,-0.1 -5,-0.1 -40,-0.1 -0.455 360.0 360.0 -80.8 360.0 -3.4 51.8 6.6