==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN FIBRIL 30-OCT-12 2M0M . COMPND 2 MOLECULE: MINOR AMPULLATE FIBROIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: NEPHILA ANTIPODIANA; . AUTHOR D.YANG,Z.GAO,Z.LIN,W.HUANG,C.LAI,J.FAN . 214 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9181.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 77.1 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 . 4 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 58.9 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+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 0 0 0 0 0 0 0 2 0 0 2 4 0 0 0 0 2 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 17 A V > 0 0 60 0, 0.0 4,-1.4 0, 0.0 213,-0.1 0.000 360.0 360.0 360.0 -12.6 29.7 16.3 13.5 2 18 A G H >> + 0 0 27 1,-0.2 4,-1.3 2,-0.2 3,-0.7 0.942 360.0 47.6 -59.3 -50.6 28.8 12.7 12.7 3 19 A T H 34 S+ 0 0 121 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.788 107.4 59.5 -61.9 -27.5 25.4 12.9 14.4 4 20 A T H >> S+ 0 0 24 1,-0.2 4,-2.0 2,-0.2 3,-0.6 0.833 101.1 53.6 -70.2 -33.1 24.8 16.2 12.6 5 21 A V H S+ 0 0 35 -3,-0.6 4,-0.8 -4,-0.3 -2,-0.2 0.843 112.5 39.6 -96.6 -45.8 20.3 14.7 11.0 8 24 A T H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 3,-0.3 0.849 113.2 56.3 -73.1 -35.2 20.5 16.9 7.9 9 25 A T H X S+ 0 0 33 -4,-1.7 4,-1.1 1,-0.2 -1,-0.2 0.814 101.9 57.6 -66.1 -30.7 20.5 13.9 5.6 10 26 A S H 4 S+ 0 0 80 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.827 114.0 37.6 -69.1 -32.3 17.2 12.7 7.1 11 27 A R H >< S+ 0 0 55 -4,-0.8 3,-1.0 -3,-0.3 6,-0.6 0.696 111.1 60.0 -90.6 -23.1 15.5 16.0 6.2 12 28 A L H 3< S+ 0 0 10 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.2 0.708 94.6 64.5 -76.7 -20.5 17.4 16.2 2.8 13 29 A S T 3< S+ 0 0 109 -4,-1.1 -1,-0.2 -5,-0.2 2,-0.2 0.367 88.9 96.2 -83.2 5.6 15.8 13.0 1.7 14 30 A T S X> S- 0 0 63 -3,-1.0 4,-1.5 1,-0.1 3,-0.6 -0.561 93.0-107.7 -95.0 160.6 12.4 14.6 1.9 15 31 A A H 3> S+ 0 0 82 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.787 116.3 68.1 -55.0 -28.2 10.5 16.2 -1.0 16 32 A E H 3> S+ 0 0 106 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.950 100.9 43.9 -57.3 -53.1 11.4 19.6 0.6 17 33 A A H <> S+ 0 0 0 -3,-0.6 4,-2.7 -6,-0.6 -1,-0.2 0.871 108.6 60.3 -60.7 -38.2 15.1 19.2 -0.2 18 34 A S H X S+ 0 0 44 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.935 107.0 44.6 -55.5 -50.4 14.2 18.0 -3.7 19 35 A S H X S+ 0 0 85 -4,-2.1 4,-1.7 2,-0.2 3,-0.4 0.958 112.0 51.4 -59.7 -54.1 12.4 21.2 -4.5 20 36 A R H X S+ 0 0 18 -4,-2.0 4,-2.3 1,-0.3 3,-0.3 0.914 108.7 51.9 -49.5 -49.4 15.1 23.5 -3.1 21 37 A I H X S+ 0 0 3 -4,-2.7 4,-2.5 1,-0.2 5,-0.4 0.873 103.8 59.0 -56.5 -39.1 17.8 21.7 -5.1 22 38 A S H X S+ 0 0 36 -4,-1.7 4,-3.0 -3,-0.4 -1,-0.2 0.921 110.8 40.1 -56.8 -47.0 15.7 22.2 -8.2 23 39 A T H X S+ 0 0 71 -4,-1.7 4,-1.4 -3,-0.3 5,-0.3 0.822 112.1 57.6 -72.2 -32.0 15.8 26.0 -7.8 24 40 A A H X S+ 0 0 1 -4,-2.3 4,-1.1 -5,-0.2 -2,-0.2 0.887 119.2 29.6 -65.5 -40.2 19.4 25.9 -6.6 25 41 A A H X S+ 0 0 2 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.861 115.2 59.2 -86.6 -41.4 20.5 24.2 -9.9 26 42 A S H < S+ 0 0 79 -4,-3.0 -3,-0.2 -5,-0.4 -2,-0.2 0.805 118.7 33.4 -57.8 -29.6 17.9 25.7 -12.1 27 43 A T H >< S+ 0 0 64 -4,-1.4 3,-0.9 -5,-0.2 4,-0.4 0.759 108.7 65.5 -95.9 -31.7 19.2 29.1 -11.1 28 44 A L H 3< S+ 0 0 14 -4,-1.1 7,-0.8 1,-0.3 -2,-0.2 0.823 123.6 19.2 -60.1 -31.8 22.9 28.1 -10.8 29 45 A V T 3< S+ 0 0 22 -4,-1.9 -1,-0.3 5,-0.2 -2,-0.2 0.047 92.2 117.3-126.2 23.3 22.9 27.4 -14.5 30 46 A S S < S+ 0 0 86 -3,-0.9 -2,-0.1 1,-0.2 -3,-0.1 0.979 79.8 43.7 -54.6 -64.9 19.9 29.4 -15.6 31 47 A G S S- 0 0 73 -4,-0.4 -1,-0.2 2,-0.3 3,-0.1 0.760 135.8 -87.1 -53.8 -25.0 21.7 31.9 -17.8 32 48 A G S S+ 0 0 24 1,-0.5 2,-0.3 -4,-0.0 -2,-0.1 0.239 99.9 28.2 135.0 -10.8 23.6 28.9 -19.1 33 49 A Y S S- 0 0 144 -5,-0.1 -1,-0.5 0, 0.0 2,-0.4 -0.894 101.0 -48.2-158.0-174.6 26.5 28.6 -16.7 34 50 A L - 0 0 28 -2,-0.3 2,-0.6 152,-0.2 -5,-0.2 -0.545 48.9-161.6 -71.7 122.8 27.7 29.2 -13.2 35 51 A N >> - 0 0 70 -7,-0.8 3,-2.3 -2,-0.4 4,-1.3 -0.911 14.1-164.4-112.0 109.6 26.9 32.8 -12.0 36 52 A T T 34 S+ 0 0 79 -2,-0.6 5,-0.1 1,-0.3 -1,-0.1 0.725 89.7 70.2 -61.2 -21.0 28.8 34.0 -9.0 37 53 A A T 34 S+ 0 0 70 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.594 108.8 34.2 -72.5 -10.1 26.2 36.8 -8.8 38 54 A A T X> S+ 0 0 14 -3,-2.3 4,-3.2 2,-0.1 3,-0.6 0.567 94.8 86.6-116.0 -20.2 23.7 34.1 -7.7 39 55 A L H 3X S+ 0 0 9 -4,-1.3 4,-2.0 1,-0.3 5,-0.2 0.926 98.3 39.6 -45.8 -54.8 26.1 31.8 -5.7 40 56 A P H 3> S+ 0 0 33 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.705 115.1 56.0 -69.9 -20.2 25.6 33.9 -2.6 41 57 A S H <> S+ 0 0 73 -3,-0.6 4,-1.4 2,-0.2 -2,-0.2 0.902 109.0 43.3 -78.7 -44.2 21.9 34.2 -3.4 42 58 A V H X S+ 0 0 10 -4,-3.2 4,-2.4 2,-0.2 5,-0.2 0.905 114.6 50.2 -68.0 -42.7 21.2 30.5 -3.6 43 59 A I H X S+ 0 0 5 -4,-2.0 4,-1.8 -5,-0.3 -1,-0.2 0.883 110.9 49.5 -63.3 -39.6 23.2 29.7 -0.5 44 60 A A H X S+ 0 0 35 -4,-1.2 4,-0.8 -5,-0.2 -1,-0.2 0.816 110.8 51.7 -69.2 -31.0 21.4 32.4 1.5 45 61 A D H >X S+ 0 0 69 -4,-1.4 4,-2.9 2,-0.2 3,-0.8 0.971 108.9 46.7 -69.7 -56.4 18.0 31.1 0.3 46 62 A L H 3X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.3 5,-0.4 0.911 111.8 52.1 -52.2 -47.1 18.6 27.4 1.3 47 63 A F H 3X S+ 0 0 33 -4,-1.8 4,-1.1 -5,-0.2 -1,-0.3 0.792 112.8 47.4 -61.2 -27.9 19.9 28.5 4.7 48 64 A A H < + 0 0 29 -4,-2.0 3,-1.2 1,-0.1 -1,-0.2 -0.632 64.1 155.3-128.3 73.7 14.2 24.4 12.3 55 71 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.737 77.5 56.2 -69.7 -23.5 14.8 27.7 14.2 56 72 A G T 3 S+ 0 0 80 -3,-0.1 -5,-0.0 2,-0.1 -2,-0.0 0.432 88.3 106.5 -88.7 0.5 15.9 25.7 17.3 57 73 A V S < S- 0 0 34 -3,-1.2 2,-0.3 -6,-0.1 -3,-0.0 -0.259 77.6 -99.3 -75.3 166.0 18.6 23.9 15.3 58 74 A S > - 0 0 67 1,-0.1 4,-2.6 -2,-0.0 5,-0.3 -0.619 23.6-120.0 -88.7 146.6 22.3 24.6 15.6 59 75 A D H > S+ 0 0 97 -2,-0.3 4,-1.1 1,-0.2 -1,-0.1 0.794 115.3 53.0 -52.4 -29.1 24.2 26.9 13.2 60 76 A S H > S+ 0 0 29 2,-0.2 4,-2.2 3,-0.1 3,-0.3 0.981 109.3 43.2 -71.5 -60.0 26.3 23.8 12.4 61 77 A E H > S+ 0 0 28 1,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.922 115.5 50.2 -51.7 -49.8 23.6 21.3 11.6 62 78 A V H X S+ 0 0 6 -4,-2.6 4,-1.4 1,-0.2 3,-0.3 0.841 108.6 54.3 -58.9 -34.4 21.7 23.9 9.5 63 79 A L H X S+ 0 0 3 -4,-1.1 4,-1.7 -3,-0.3 5,-0.2 0.913 101.5 56.4 -66.8 -43.8 25.0 24.7 7.7 64 80 A I H X S+ 0 0 1 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.761 107.6 51.7 -59.6 -24.6 25.5 21.0 6.8 65 81 A Q H X S+ 0 0 0 -4,-1.0 4,-1.9 -3,-0.3 -1,-0.2 0.852 103.6 55.5 -80.2 -37.6 22.1 21.2 5.1 66 82 A V H X S+ 0 0 3 -4,-1.4 4,-1.4 1,-0.2 -2,-0.2 0.862 112.9 42.5 -63.1 -36.5 22.9 24.3 3.1 67 83 A L H X S+ 0 0 27 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.771 108.5 60.2 -80.5 -27.7 25.9 22.6 1.5 68 84 A L H X S+ 0 0 0 -4,-0.9 4,-1.7 -5,-0.2 -2,-0.2 0.887 110.2 40.7 -66.9 -39.8 24.0 19.3 1.1 69 85 A E H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.878 113.4 54.0 -75.8 -39.8 21.4 20.9 -1.2 70 86 A I H X S+ 0 0 27 -4,-1.4 4,-2.2 -5,-0.2 5,-0.3 0.935 113.3 41.8 -59.9 -48.8 24.0 23.1 -3.0 71 87 A V H X S+ 0 0 18 -4,-2.3 4,-3.2 1,-0.2 5,-0.3 0.911 109.6 58.1 -65.6 -43.7 26.1 20.0 -3.9 72 88 A S H X S+ 0 0 0 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.2 0.848 112.0 43.3 -55.2 -35.7 23.1 17.9 -4.8 73 89 A S H X S+ 0 0 0 -4,-1.7 4,-1.2 2,-0.2 -2,-0.2 0.986 117.1 40.8 -74.1 -64.9 22.2 20.5 -7.4 74 90 A L H X S+ 0 0 13 -4,-2.2 4,-1.8 1,-0.2 3,-0.5 0.877 116.2 53.8 -51.4 -41.2 25.5 21.3 -9.0 75 91 A I H X S+ 0 0 17 -4,-3.2 4,-1.8 -5,-0.3 -1,-0.2 0.930 102.8 54.9 -60.5 -47.6 26.3 17.6 -8.9 76 92 A H H < S+ 0 0 6 -4,-1.5 4,-0.3 -5,-0.3 119,-0.3 0.760 107.4 54.2 -58.0 -24.6 23.1 16.7 -10.7 77 93 A I H >X S+ 0 0 4 -4,-1.2 3,-1.8 -3,-0.5 4,-1.5 0.934 103.0 51.9 -75.5 -49.1 24.3 19.1 -13.4 78 94 A L H 3< S+ 0 0 10 -4,-1.8 64,-0.2 1,-0.3 -2,-0.2 0.849 94.0 74.5 -56.0 -35.6 27.7 17.5 -14.0 79 95 A S T 3< S+ 0 0 71 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.813 108.2 32.9 -47.6 -32.6 25.9 14.1 -14.4 80 96 A S T <4 S+ 0 0 39 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.738 109.0 83.2 -95.3 -29.1 24.9 15.5 -17.8 81 97 A S < - 0 0 14 -4,-1.5 61,-0.2 1,-0.1 -3,-0.0 -0.075 63.5-152.1 -68.2 174.0 28.0 17.6 -18.5 82 98 A S - 0 0 97 59,-0.1 -1,-0.1 0, 0.0 -4,-0.1 0.327 34.0-124.1-129.1 -0.4 31.2 16.2 -19.9 83 99 A V - 0 0 17 -5,-0.1 3,-0.1 2,-0.1 103,-0.1 0.955 31.2-163.5 50.9 89.6 33.7 18.6 -18.4 84 100 A G - 0 0 63 1,-0.2 2,-0.7 101,-0.1 105,-0.1 0.726 52.2 -26.5 -69.3-121.1 35.6 20.1 -21.3 85 101 A Q - 0 0 173 103,-0.2 2,-0.3 100,-0.0 -1,-0.2 -0.880 65.8-172.3-105.3 109.3 38.9 21.9 -20.8 86 102 A V - 0 0 41 -2,-0.7 2,-0.5 -3,-0.1 99,-0.1 -0.785 15.5-137.9-102.1 143.7 39.3 23.4 -17.4 87 103 A D > - 0 0 81 97,-0.3 3,-1.7 -2,-0.3 4,-0.2 -0.872 6.0-147.5-103.9 127.8 42.1 25.7 -16.3 88 104 A F G > S+ 0 0 93 -2,-0.5 3,-1.0 1,-0.3 4,-0.4 0.642 95.4 76.7 -64.2 -13.1 43.7 25.3 -12.9 89 105 A S G 3 S+ 0 0 120 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.370 86.3 62.4 -78.9 6.1 44.2 29.1 -13.0 90 106 A S G <> S+ 0 0 18 -3,-1.7 4,-2.0 2,-0.1 3,-0.3 0.564 77.3 84.4-104.5 -15.0 40.5 29.4 -12.2 91 107 A V H <> S+ 0 0 13 -3,-1.0 4,-3.1 -4,-0.2 5,-0.3 0.877 83.3 62.4 -55.0 -40.2 40.7 27.7 -8.8 92 108 A G H > S+ 0 0 49 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.934 109.2 38.1 -51.6 -53.3 41.7 31.0 -7.2 93 109 A S H > S+ 0 0 95 -3,-0.3 4,-2.7 -4,-0.2 -1,-0.2 0.813 114.6 57.8 -69.0 -30.6 38.5 32.7 -8.2 94 110 A S H X S+ 0 0 4 -4,-2.0 4,-1.9 2,-0.2 5,-0.2 0.945 109.7 41.5 -64.8 -49.8 36.5 29.5 -7.4 95 111 A A H X S+ 0 0 13 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.834 116.8 50.6 -67.1 -33.1 37.7 29.3 -3.8 96 112 A A H X S+ 0 0 53 -4,-1.7 4,-1.3 -5,-0.3 -2,-0.2 0.903 107.2 52.8 -71.4 -42.8 37.3 33.1 -3.4 97 113 A A H X S+ 0 0 19 -4,-2.7 4,-1.6 2,-0.2 3,-0.3 0.934 115.6 39.9 -58.4 -49.2 33.7 33.1 -4.7 98 114 A V H X S+ 0 0 10 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.901 113.1 54.7 -67.9 -42.2 32.6 30.4 -2.3 99 115 A G H < S+ 0 0 6 -4,-2.1 -1,-0.2 1,-0.2 4,-0.2 0.723 111.7 46.3 -64.6 -20.5 34.6 31.8 0.6 100 116 A Q H >< S+ 0 0 128 -4,-1.3 3,-0.8 -3,-0.3 4,-0.4 0.766 103.7 60.7 -91.0 -30.5 32.8 35.1 -0.0 101 117 A S H >X S+ 0 0 3 -4,-1.6 3,-2.2 1,-0.2 4,-0.8 0.858 91.7 68.0 -64.8 -35.9 29.3 33.6 -0.3 102 118 A M H >X S+ 0 0 9 -4,-1.5 4,-1.3 1,-0.3 3,-0.7 0.815 90.7 63.6 -53.3 -31.7 29.6 32.2 3.2 103 119 A Q H <4 S+ 0 0 69 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.768 99.2 53.8 -64.9 -25.4 29.5 35.8 4.4 104 120 A V H <4 S+ 0 0 52 -3,-2.2 -1,-0.2 -4,-0.4 -2,-0.2 0.709 104.3 55.0 -81.2 -21.7 26.0 36.1 3.0 105 121 A V H << S+ 0 0 16 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.788 122.3 26.9 -80.6 -29.6 24.9 33.1 4.9 106 122 A M < 0 0 64 -4,-1.3 -2,-0.2 3,-0.1 -1,-0.2 0.154 360.0 360.0-116.7 15.1 25.9 34.6 8.3 107 123 A G 0 0 95 -5,-0.1 -3,-0.3 -4,-0.0 -4,-0.1 -0.071 360.0 360.0 166.7 360.0 25.6 38.2 7.2 108 !* 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 0.0 109 17 B V > 0 0 41 0, 0.0 4,-1.2 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 -14.1 29.6 29.3 12.7 110 18 B G H >> + 0 0 29 1,-0.2 3,-1.6 2,-0.2 4,-1.3 0.985 360.0 45.8 -60.9 -62.2 30.5 32.8 11.4 111 19 B T H 34 S+ 0 0 123 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.782 108.6 61.4 -52.6 -27.5 33.9 33.1 13.1 112 20 B T H >> S+ 0 0 27 1,-0.2 4,-1.9 2,-0.2 3,-0.6 0.837 99.0 54.3 -69.2 -33.6 34.6 29.6 11.9 113 21 B V H S+ 0 0 40 -3,-0.6 4,-0.9 -4,-0.4 -2,-0.2 0.877 112.0 40.4 -91.2 -47.6 39.2 30.7 10.1 116 24 B T H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 3,-0.2 0.826 112.5 57.4 -70.9 -32.3 38.9 28.2 7.2 117 25 B T H X S+ 0 0 30 -4,-1.8 4,-1.0 1,-0.2 -1,-0.2 0.811 101.1 57.1 -68.0 -30.3 39.0 31.0 4.6 118 26 B S H 4 S+ 0 0 83 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.827 113.1 39.3 -69.8 -32.4 42.3 32.2 6.0 119 27 B R H >< S+ 0 0 51 -4,-0.9 3,-0.9 -3,-0.2 6,-0.6 0.707 110.7 59.1 -88.6 -23.4 43.9 28.8 5.4 120 28 B L H 3< S+ 0 0 12 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.703 95.1 64.5 -77.4 -20.5 42.1 28.2 2.1 121 29 B S T 3< S+ 0 0 112 -4,-1.0 -1,-0.2 -5,-0.1 2,-0.2 0.329 89.1 96.0 -84.1 8.0 43.7 31.4 0.7 122 30 B T S X> S- 0 0 62 -3,-0.9 4,-1.1 1,-0.1 3,-0.7 -0.587 91.5-109.4 -97.5 161.0 47.1 29.6 1.0 123 31 B A H 3> S+ 0 0 82 1,-0.2 4,-1.8 -2,-0.2 3,-0.2 0.827 115.9 66.4 -55.8 -33.0 49.0 27.7 -1.6 124 32 B E H 3> S+ 0 0 104 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.928 98.2 50.4 -54.8 -49.2 48.2 24.6 0.3 125 33 B A H <> S+ 0 0 0 -3,-0.7 4,-2.4 -6,-0.6 -1,-0.2 0.838 105.9 58.4 -58.9 -34.0 44.5 24.9 -0.5 126 34 B S H X S+ 0 0 43 -4,-1.1 4,-2.0 -3,-0.2 -1,-0.2 0.926 106.2 47.0 -62.3 -46.5 45.4 25.4 -4.2 127 35 B S H X S+ 0 0 81 -4,-1.8 4,-2.0 2,-0.2 3,-0.3 0.970 112.7 47.6 -60.0 -57.0 47.2 22.0 -4.4 128 36 B R H X S+ 0 0 6 -4,-2.0 4,-2.4 1,-0.3 3,-0.2 0.919 111.5 51.5 -50.5 -49.9 44.4 20.1 -2.7 129 37 B I H X S+ 0 0 3 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.879 107.0 54.3 -56.1 -40.2 41.8 21.7 -4.9 130 38 B S H X S+ 0 0 40 -4,-2.0 4,-2.4 -3,-0.3 -1,-0.2 0.894 111.4 44.1 -61.8 -41.3 43.8 20.7 -7.9 131 39 B T H X S+ 0 0 68 -4,-2.0 4,-1.4 -3,-0.2 -1,-0.2 0.823 112.5 52.9 -73.1 -32.2 43.8 17.1 -6.9 132 40 B A H X S+ 0 0 0 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.875 118.3 35.3 -70.6 -38.7 40.1 17.2 -6.0 133 41 B A H X S+ 0 0 4 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.830 113.8 57.5 -83.3 -35.5 39.2 18.6 -9.4 134 42 B S H < S+ 0 0 76 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.830 118.1 34.0 -64.2 -32.4 41.8 16.6 -11.3 135 43 B T H >< S+ 0 0 63 -4,-1.4 3,-0.6 2,-0.2 4,-0.4 0.761 110.0 64.0 -92.4 -30.4 40.4 13.4 -9.9 136 44 B L H 3< S+ 0 0 10 -4,-1.3 7,-0.8 1,-0.2 -2,-0.2 0.870 124.1 18.5 -61.2 -37.8 36.7 14.5 -9.8 137 45 B V T 3< S+ 0 0 23 -4,-1.8 -1,-0.2 5,-0.2 -2,-0.2 0.037 93.1 116.7-121.2 23.7 36.8 14.8 -13.6 138 46 B S S < S+ 0 0 87 -3,-0.6 -2,-0.1 1,-0.2 -3,-0.1 0.980 80.1 42.9 -55.2 -64.3 39.8 12.7 -14.3 139 47 B G S S- 0 0 74 -4,-0.4 -1,-0.2 2,-0.3 3,-0.1 0.754 135.7 -87.3 -55.4 -24.1 38.0 10.0 -16.3 140 48 B G S S+ 0 0 26 1,-0.5 2,-0.3 -4,-0.0 -2,-0.1 0.250 100.0 29.3 133.8 -9.6 36.1 12.8 -18.0 141 49 B Y S S- 0 0 136 -5,-0.1 -1,-0.5 0, 0.0 2,-0.4 -0.893 101.1 -48.4-158.1-174.5 33.2 13.4 -15.7 142 50 B L - 0 0 28 -2,-0.3 2,-0.6 -64,-0.2 -5,-0.2 -0.550 48.6-161.8 -72.1 122.8 32.0 13.2 -12.1 143 51 B N >> - 0 0 68 -7,-0.8 3,-2.4 -2,-0.4 4,-1.3 -0.907 13.9-164.8-111.9 108.4 32.8 9.8 -10.6 144 52 B T T 34 S+ 0 0 82 -2,-0.6 -1,-0.1 1,-0.3 5,-0.1 0.723 89.6 70.2 -60.6 -20.6 30.8 8.9 -7.4 145 53 B A T 34 S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.592 108.7 34.3 -73.0 -10.0 33.5 6.3 -6.8 146 54 B A T X> S+ 0 0 12 -3,-2.4 4,-3.2 2,-0.1 3,-0.6 0.573 94.8 86.3-115.9 -20.7 35.9 9.1 -6.0 147 55 B L H 3X S+ 0 0 10 -4,-1.3 4,-2.0 1,-0.3 5,-0.2 0.925 98.5 39.6 -45.6 -54.9 33.5 11.6 -4.4 148 56 B P H 3> S+ 0 0 30 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.704 114.9 56.2 -69.8 -20.3 34.0 9.9 -1.0 149 57 B S H <> S+ 0 0 69 -3,-0.6 4,-1.5 2,-0.2 -2,-0.2 0.898 108.9 43.2 -78.6 -43.7 37.7 9.5 -1.7 150 58 B V H X S+ 0 0 9 -4,-3.2 4,-2.6 2,-0.2 5,-0.2 0.906 114.3 50.5 -68.5 -42.9 38.4 13.1 -2.4 151 59 B I H X S+ 0 0 7 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.891 111.7 47.9 -62.5 -40.8 36.3 14.3 0.6 152 60 B A H X S+ 0 0 34 -4,-1.2 4,-0.8 -5,-0.2 -1,-0.2 0.814 112.1 51.3 -69.9 -31.0 38.1 11.9 2.9 153 61 B D H >X S+ 0 0 74 -4,-1.5 4,-2.9 2,-0.2 3,-0.5 0.964 109.2 47.1 -70.5 -54.6 41.5 13.0 1.5 154 62 B L H 3X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.3 5,-0.4 0.930 113.3 48.8 -52.7 -50.7 41.0 16.7 2.0 155 63 B F H 3X S+ 0 0 58 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.3 0.772 113.1 51.0 -61.6 -25.7 39.7 16.2 5.5 156 64 B A H < + 0 0 30 -4,-1.5 3,-1.1 1,-0.1 -1,-0.2 -0.624 63.7 155.4-131.6 74.1 45.3 21.1 12.5 163 71 B P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.754 77.8 56.1 -69.8 -25.1 44.7 18.2 14.9 164 72 B G T 3 S+ 0 0 80 -3,-0.1 -5,-0.0 2,-0.1 -2,-0.0 0.466 88.2 107.0 -86.5 -1.6 43.6 20.6 17.7 165 73 B V S < S- 0 0 35 -3,-1.1 2,-0.3 -6,-0.2 -3,-0.0 -0.219 77.4 -99.9 -72.5 166.3 40.9 22.1 15.4 166 74 B S > - 0 0 68 1,-0.1 4,-2.6 0, 0.0 5,-0.3 -0.636 23.3-119.5 -90.3 146.8 37.2 21.4 15.8 167 75 B D H > S+ 0 0 96 -2,-0.3 4,-1.1 1,-0.2 -1,-0.1 0.787 115.6 53.2 -52.0 -28.3 35.3 18.8 13.7 168 76 B S H > S+ 0 0 26 2,-0.2 4,-2.3 3,-0.1 3,-0.4 0.983 108.8 43.4 -71.9 -60.9 33.2 21.8 12.6 169 77 B E H > S+ 0 0 29 1,-0.3 4,-1.3 2,-0.2 -2,-0.2 0.920 115.1 50.6 -50.7 -49.8 35.9 24.1 11.4 170 78 B V H X S+ 0 0 4 -4,-2.6 4,-1.5 1,-0.2 -1,-0.3 0.843 109.1 53.1 -58.4 -34.6 37.7 21.3 9.7 171 79 B L H X S+ 0 0 9 -4,-1.1 4,-1.8 -3,-0.4 5,-0.2 0.909 103.4 54.9 -67.9 -43.3 34.5 20.3 8.0 172 80 B I H X S+ 0 0 0 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.784 108.8 50.7 -60.9 -27.0 34.0 23.9 6.6 173 81 B Q H X S+ 0 0 0 -4,-1.3 4,-1.8 -5,-0.2 -1,-0.2 0.855 104.7 55.3 -78.9 -37.4 37.4 23.6 5.0 174 82 B V H X S+ 0 0 3 -4,-1.5 4,-1.5 1,-0.2 -2,-0.2 0.864 112.7 42.8 -63.3 -36.8 36.7 20.2 3.4 175 83 B L H X S+ 0 0 25 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.763 108.4 60.2 -80.1 -26.7 33.7 21.7 1.7 176 84 B L H X S+ 0 0 0 -4,-1.0 4,-1.6 -5,-0.2 -2,-0.2 0.879 110.3 40.5 -68.0 -38.9 35.5 24.9 0.8 177 85 B E H X S+ 0 0 0 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.875 113.3 54.2 -76.9 -39.6 38.1 23.0 -1.3 178 86 B I H X S+ 0 0 27 -4,-1.5 4,-2.2 -5,-0.2 5,-0.3 0.939 113.8 40.8 -59.7 -49.8 35.6 20.6 -2.8 179 87 B V H X S+ 0 0 16 -4,-2.2 4,-3.2 1,-0.2 5,-0.3 0.902 109.8 59.0 -66.0 -42.2 33.4 23.4 -4.1 180 88 B S H X S+ 0 0 0 -4,-1.6 4,-1.5 -5,-0.2 -1,-0.2 0.851 111.6 42.9 -55.6 -36.0 36.4 25.5 -5.2 181 89 B S H X S+ 0 0 0 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.986 117.1 41.3 -74.1 -64.3 37.5 22.6 -7.4 182 90 B L H X S+ 0 0 13 -4,-2.2 4,-1.8 1,-0.2 3,-0.3 0.869 115.4 54.8 -51.7 -39.8 34.1 21.6 -9.0 183 91 B I H X S+ 0 0 18 -4,-3.2 4,-1.8 -5,-0.3 -1,-0.2 0.944 102.3 54.2 -60.4 -50.4 33.3 25.3 -9.3 184 92 B H H < S+ 0 0 6 -4,-1.5 4,-0.4 -5,-0.3 -97,-0.3 0.787 106.9 55.8 -55.0 -27.9 36.5 26.1 -11.3 185 93 B I H >X S+ 0 0 3 -4,-1.3 3,-1.9 -3,-0.3 4,-1.6 0.950 102.6 51.2 -70.6 -51.0 35.4 23.3 -13.6 186 94 B L H 3< S+ 0 0 12 -4,-1.8 -152,-0.2 1,-0.3 -2,-0.2 0.845 93.8 75.6 -55.1 -35.2 32.0 24.8 -14.5 187 95 B S T 3< S+ 0 0 66 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.820 108.5 31.2 -46.5 -34.3 33.7 28.0 -15.3 188 96 B S T <4 S+ 0 0 42 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.748 109.3 84.6 -95.2 -30.3 34.8 26.3 -18.5 189 97 B S < - 0 0 14 -4,-1.6 -155,-0.1 -105,-0.1 -3,-0.0 0.066 64.4-150.2 -62.5-179.7 31.8 24.1 -18.9 190 98 B S - 0 0 94 -157,-0.1 -1,-0.1 0, 0.0 -4,-0.1 0.303 31.6-125.3-135.9 0.7 28.5 25.3 -20.5 191 99 B V - 0 0 14 -5,-0.1 3,-0.2 2,-0.1 -113,-0.1 0.952 32.6-166.0 47.2 85.4 26.0 23.2 -18.6 192 100 B G - 0 0 61 1,-0.2 2,-0.7 -115,-0.1 -111,-0.1 0.723 50.7 -27.3 -67.6-122.3 24.1 21.4 -21.5 193 101 B Q - 0 0 178 -113,-0.2 2,-0.4 2,-0.0 -1,-0.2 -0.883 65.9-176.9-105.1 111.7 20.8 19.7 -20.8 194 102 B V - 0 0 38 -2,-0.7 2,-0.5 -3,-0.2 -117,-0.1 -0.870 19.6-135.3-110.0 140.8 20.4 18.4 -17.3 195 103 B D > - 0 0 86 -2,-0.4 3,-1.5 -119,-0.3 4,-0.2 -0.817 5.1-146.7 -97.3 127.8 17.5 16.4 -15.9 196 104 B F G > S+ 0 0 81 -2,-0.5 3,-1.1 1,-0.3 4,-0.3 0.645 94.2 79.5 -64.1 -13.3 16.0 17.3 -12.6 197 105 B S G 3 S+ 0 0 115 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.355 85.1 62.3 -76.5 7.7 15.3 13.6 -12.2 198 106 B S G X> S+ 0 0 17 -3,-1.5 4,-2.2 2,-0.1 3,-0.6 0.610 75.0 86.1-104.8 -19.7 18.9 13.3 -11.2 199 107 B V H <> S+ 0 0 10 -3,-1.1 4,-2.9 -4,-0.2 5,-0.3 0.820 83.6 63.5 -50.7 -32.9 18.9 15.4 -8.1 200 108 B G H 3> S+ 0 0 49 -4,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.949 107.8 37.4 -58.4 -52.6 17.8 12.3 -6.2 201 109 B S H <> S+ 0 0 94 -3,-0.6 4,-2.6 -4,-0.2 -1,-0.2 0.812 115.5 57.1 -69.7 -30.4 21.0 10.4 -6.9 202 110 B S H X S+ 0 0 5 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.945 109.2 42.7 -65.7 -49.9 23.0 13.6 -6.5 203 111 B A H X S+ 0 0 14 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.824 116.9 49.5 -66.0 -32.0 21.7 14.4 -3.0 204 112 B A H X S+ 0 0 54 -4,-1.5 4,-1.5 -5,-0.3 -2,-0.2 0.893 107.1 53.5 -74.0 -41.6 22.1 10.7 -2.1 205 113 B A H X S+ 0 0 21 -4,-2.6 4,-1.5 1,-0.2 3,-0.2 0.922 113.2 42.9 -59.1 -46.6 25.7 10.4 -3.4 206 114 B V H X S+ 0 0 11 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.895 110.9 55.1 -67.4 -41.4 26.8 13.4 -1.3 207 115 B G H < S+ 0 0 6 -4,-1.7 4,-0.3 1,-0.2 -1,-0.2 0.771 110.0 47.7 -63.5 -25.5 24.9 12.2 1.8 208 116 B Q H >< S+ 0 0 135 -4,-1.5 3,-0.9 -3,-0.2 4,-0.4 0.802 103.8 60.0 -84.2 -32.4 26.7 8.9 1.5 209 117 B S H >X S+ 0 0 2 -4,-1.5 3,-2.5 1,-0.3 4,-0.8 0.885 93.5 65.1 -62.6 -39.9 30.2 10.5 1.1 210 118 B M H >X S+ 0 0 12 -4,-1.6 4,-1.4 1,-0.3 3,-0.5 0.792 91.3 66.0 -53.5 -28.7 29.9 12.2 4.5 211 119 B Q H <4 S+ 0 0 69 -3,-0.9 4,-0.4 -4,-0.3 -1,-0.3 0.763 98.5 52.4 -65.5 -24.8 29.9 8.7 6.0 212 120 B V H <4 S+ 0 0 51 -3,-2.5 -1,-0.2 -4,-0.4 -2,-0.2 0.717 105.2 54.6 -82.6 -22.9 33.5 8.4 4.8 213 121 B V H << S+ 0 0 20 -4,-0.8 -2,-0.2 -3,-0.5 -1,-0.2 0.794 117.6 34.5 -79.8 -30.2 34.5 11.6 6.4 214 122 B M < 0 0 70 -4,-1.4 -2,-0.2 -212,-0.1 -1,-0.2 0.452 360.0 360.0-101.4 -4.8 33.2 10.5 9.9 215 123 B G 0 0 91 -4,-0.4 -3,-0.3 -5,-0.2 -4,-0.1 -0.086 360.0 360.0 167.3 360.0 34.1 6.9 9.3