==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 24-MAY-12 4FC8 . COMPND 2 MOLECULE: TRANSCRIPTION PROTEIN RTR1; . SOURCE 2 ORGANISM_SCIENTIFIC: KLUYVEROMYCES LACTIS; . AUTHOR K.XIANG,L.TONG . 272 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15656.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 61.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.5 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 . 1 0.4 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 . 5 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 34.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.2 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 3 1 0 0 1 2 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 1 A M 0 0 145 0, 0.0 2,-0.4 0, 0.0 41,-0.2 0.000 360.0 360.0 360.0 -28.1 20.7 35.0 37.2 2 2 A A B +a 42 0A 0 39,-2.4 41,-2.3 4,-0.1 42,-0.4 -0.719 360.0 171.5 -85.9 132.8 16.9 35.1 38.1 3 3 A T > - 0 0 31 -2,-0.4 4,-2.6 39,-0.1 5,-0.2 -0.852 49.2-105.7-135.2 165.0 14.6 37.2 35.8 4 4 A I H > S+ 0 0 11 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.963 122.5 51.9 -54.2 -52.3 10.9 37.9 35.1 5 5 A E H > S+ 0 0 111 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.903 109.3 48.5 -52.6 -48.3 11.2 35.7 32.0 6 6 A E H > S+ 0 0 41 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.901 111.6 50.5 -60.9 -40.5 12.7 32.8 33.9 7 7 A I H X>S+ 0 0 0 -4,-2.6 5,-2.1 2,-0.2 4,-1.7 0.896 110.0 50.3 -62.6 -39.8 10.0 33.1 36.5 8 8 A K H <>S+ 0 0 64 -4,-2.7 5,-1.3 -5,-0.2 -2,-0.2 0.928 117.8 38.5 -65.3 -41.6 7.3 33.1 33.8 9 9 A E H <5S+ 0 0 117 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.863 126.1 32.9 -74.0 -41.9 8.8 29.9 32.1 10 10 A V H <5S+ 0 0 86 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.829 134.1 19.1 -92.1 -29.1 9.8 27.9 35.1 11 11 A V T <5S+ 0 0 3 -4,-1.7 -3,-0.2 -5,-0.4 4,-0.1 0.806 130.1 33.3-106.3 -52.0 7.1 28.9 37.8 12 12 A L T >>4> - 0 0 69 -2,-0.3 4,-2.1 1,-0.1 3,-0.6 -0.521 33.9-107.6 -73.3 159.4 -7.0 26.1 43.5 23 23 A I H 3> S+ 0 0 102 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.867 123.4 60.8 -50.9 -38.7 -5.3 26.8 46.9 24 24 A R H 3> S+ 0 0 188 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.858 104.9 42.9 -60.1 -44.6 -3.2 23.8 45.9 25 25 A E H <> S+ 0 0 46 -3,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.876 111.1 54.3 -73.8 -38.1 -1.8 25.5 42.7 26 26 A V H X S+ 0 0 10 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.943 107.7 52.8 -58.2 -46.4 -1.2 28.8 44.4 27 27 A E H X S+ 0 0 107 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.842 105.9 53.5 -56.4 -35.6 0.8 26.8 47.0 28 28 A T H X S+ 0 0 51 -4,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.874 105.1 54.2 -70.1 -35.7 2.8 25.2 44.1 29 29 A I H X S+ 0 0 6 -4,-1.9 4,-3.3 2,-0.2 5,-0.2 0.940 110.4 45.2 -61.2 -50.4 3.7 28.7 42.7 30 30 A S H X S+ 0 0 19 -4,-1.9 4,-3.4 2,-0.2 5,-0.4 0.960 114.3 48.3 -53.7 -57.8 5.1 29.9 46.1 31 31 A I H X S+ 0 0 112 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.924 117.0 43.1 -52.2 -47.1 7.1 26.7 46.7 32 32 A N H X S+ 0 0 68 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.922 117.2 45.3 -70.8 -42.5 8.5 26.8 43.2 33 33 A L H X S+ 0 0 0 -4,-3.3 4,-2.0 2,-0.2 3,-0.3 0.967 114.0 47.8 -60.0 -56.0 9.3 30.6 43.3 34 34 A I H < S+ 0 0 29 -4,-3.4 4,-0.4 1,-0.2 -2,-0.2 0.912 111.4 53.9 -52.5 -43.1 10.8 30.5 46.7 35 35 A D H >X S+ 0 0 90 -4,-2.2 4,-1.7 -5,-0.4 3,-0.9 0.877 106.4 50.1 -62.3 -37.9 12.8 27.5 45.6 36 36 A L H 3X S+ 0 0 16 -4,-2.0 4,-2.0 -3,-0.3 -1,-0.2 0.860 107.3 54.9 -66.3 -34.9 14.2 29.3 42.6 37 37 A L H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.427 105.5 52.8 -85.0 0.1 15.3 32.3 44.7 38 38 A I H <4 S+ 0 0 21 -3,-0.9 -2,-0.2 -4,-0.4 -1,-0.2 0.830 113.9 41.0 -89.2 -49.5 17.3 30.0 47.0 39 39 A T H < S+ 0 0 97 -4,-1.7 2,-0.3 2,-0.0 -2,-0.2 0.797 126.6 32.5 -64.1 -31.7 19.2 28.5 44.0 40 40 A K S < S- 0 0 54 -4,-2.0 2,-0.3 -5,-0.1 -1,-0.0 -0.873 73.5-127.8-128.2 156.2 19.6 31.9 42.3 41 41 A D - 0 0 21 -2,-0.3 -39,-2.4 36,-0.1 2,-0.4 -0.676 39.8 -98.9 -94.9 158.4 19.9 35.6 43.1 42 42 A V B -a 2 0A 3 34,-3.2 -39,-0.1 -2,-0.3 37,-0.1 -0.659 29.3-160.1 -79.6 129.2 17.6 38.2 41.6 43 43 A K + 0 0 138 -41,-2.3 2,-0.3 -2,-0.4 -1,-0.1 0.822 61.5 37.6 -70.6 -31.1 19.3 40.0 38.7 44 44 A D > - 0 0 54 -42,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.911 59.7-135.3-145.7 136.6 17.2 43.1 38.5 45 45 A A H > S+ 0 0 45 -2,-0.3 4,-2.9 2,-0.2 5,-0.3 0.937 116.0 57.0 -51.9 -46.0 15.4 45.9 40.2 46 46 A R H > S+ 0 0 148 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.868 108.6 45.4 -53.9 -39.6 12.7 45.1 37.6 47 47 A T H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.854 109.1 53.7 -80.5 -35.2 12.6 41.6 38.8 48 48 A M H X S+ 0 0 0 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.955 110.7 48.0 -57.9 -49.8 12.5 42.5 42.5 49 49 A K H < S+ 0 0 58 -4,-2.9 4,-0.4 1,-0.2 3,-0.3 0.917 113.4 49.1 -59.6 -40.8 9.5 44.7 41.8 50 50 A Y H >< S+ 0 0 16 -4,-1.8 3,-1.2 -5,-0.3 -1,-0.2 0.914 106.1 53.5 -65.7 -44.2 7.9 41.9 39.8 51 51 A I H >< S+ 0 0 0 -4,-2.6 3,-2.7 1,-0.2 4,-0.4 0.779 89.5 81.9 -66.9 -18.3 8.3 39.1 42.4 52 52 A S G >< S+ 0 0 15 -4,-1.3 3,-1.5 -3,-0.3 -1,-0.2 0.843 80.2 64.2 -54.6 -36.0 6.6 41.3 45.1 53 53 A R G < S+ 0 0 35 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.646 104.7 47.5 -65.7 -10.5 3.2 40.2 43.8 54 54 A F G < S+ 0 0 3 -3,-2.7 2,-0.4 -4,-0.2 -1,-0.3 0.432 100.1 75.6-106.6 -1.1 4.0 36.6 44.9 55 55 A L < - 0 0 1 -3,-1.5 54,-0.3 -4,-0.4 2,-0.2 -0.929 56.6-157.3-120.0 137.7 5.3 37.1 48.4 56 56 A T > - 0 0 18 -2,-0.4 4,-1.9 52,-0.1 54,-0.2 -0.536 44.3-100.1 -89.2 171.1 3.7 37.9 51.7 57 57 A K H > S+ 0 0 63 52,-0.9 4,-2.4 1,-0.2 3,-0.1 0.957 127.1 48.4 -59.8 -46.5 5.8 39.5 54.5 58 58 A Q H > S+ 0 0 118 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.925 107.2 54.7 -54.3 -51.1 6.2 36.1 56.1 59 59 A D H > S+ 0 0 31 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.870 110.2 48.1 -52.3 -38.7 7.1 34.4 52.8 60 60 A Y H X S+ 0 0 1 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.932 107.5 53.9 -72.1 -44.0 9.8 36.9 52.5 61 61 A A H X S+ 0 0 32 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.894 112.1 45.7 -51.0 -43.6 11.0 36.3 56.1 62 62 A D H X S+ 0 0 75 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.844 107.0 58.9 -69.9 -37.7 11.3 32.6 55.3 63 63 A L H X S+ 0 0 0 -4,-2.0 4,-1.6 -5,-0.3 -2,-0.2 0.947 106.8 47.8 -53.7 -51.8 13.1 33.4 52.0 64 64 A V H X S+ 0 0 4 -4,-2.3 4,-2.3 2,-0.2 3,-0.3 0.932 112.7 47.4 -54.6 -51.0 15.8 35.2 53.9 65 65 A Q H X S+ 0 0 96 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.906 110.9 50.9 -63.8 -41.0 16.3 32.4 56.5 66 66 A E H < S+ 0 0 88 -4,-2.8 -1,-0.2 1,-0.2 4,-0.2 0.790 110.2 51.9 -62.9 -28.8 16.4 29.7 53.7 67 67 A R H ><>S+ 0 0 0 -4,-1.6 5,-2.7 -3,-0.3 3,-0.6 0.867 107.9 50.0 -74.1 -42.0 19.1 31.9 52.0 68 68 A N H ><5S+ 0 0 12 -4,-2.3 3,-2.7 3,-0.2 -2,-0.2 0.914 104.6 58.5 -55.0 -48.5 21.2 32.1 55.2 69 69 A L T 3<5S+ 0 0 136 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.705 110.5 45.6 -52.6 -21.0 20.9 28.3 55.5 70 70 A V T < 5S- 0 0 72 -3,-0.6 -1,-0.3 -4,-0.2 -2,-0.2 0.122 122.3-106.3-115.3 17.7 22.6 28.3 52.1 71 71 A K T < 5S+ 0 0 142 -3,-2.7 2,-0.4 1,-0.2 -3,-0.2 0.852 77.9 124.9 61.6 36.4 25.3 30.9 52.9 72 72 A R < - 0 0 57 -5,-2.7 9,-0.3 9,-0.2 -1,-0.2 -0.985 69.4 -99.2-124.0 145.0 23.7 33.8 51.0 73 73 A C - 0 0 0 7,-2.1 19,-0.2 -2,-0.4 5,-0.2 -0.210 35.4-122.8 -47.3 142.0 22.8 37.3 52.1 74 74 A G S S+ 0 0 0 17,-2.3 18,-0.1 -7,-0.1 -1,-0.1 0.799 90.1 92.0 -66.8 -32.4 19.1 37.5 52.8 75 75 A Y S > S- 0 0 7 16,-0.2 3,-2.4 1,-0.1 -2,-0.1 -0.549 78.1-140.3 -66.2 118.0 18.5 40.3 50.3 76 76 A P T 3 S+ 0 0 1 0, 0.0 -34,-3.2 0, 0.0 -1,-0.1 0.646 95.3 61.6 -65.4 -16.4 17.6 38.4 47.1 77 77 A L T 3 S+ 0 0 53 -36,-0.2 2,-0.5 -34,-0.0 -36,-0.1 0.522 84.5 101.5 -79.1 -9.8 19.5 40.7 44.8 78 78 A C < - 0 0 5 -3,-2.4 -5,-0.1 -5,-0.2 -35,-0.0 -0.702 47.9-172.8 -95.5 119.9 22.8 39.9 46.5 79 79 A S + 0 0 93 -2,-0.5 -1,-0.1 -7,-0.1 2,-0.1 0.615 68.7 84.5 -79.1 -14.7 25.3 37.5 45.0 80 80 A K S S- 0 0 130 1,-0.1 -7,-2.1 -8,-0.1 2,-0.1 -0.332 79.7-115.1 -82.5 169.0 27.4 37.8 48.2 81 81 A S - 0 0 56 -9,-0.3 -9,-0.2 1,-0.2 -1,-0.1 -0.405 40.0 -79.2 -92.8 173.7 27.0 35.8 51.4 82 82 A Q - 0 0 14 -2,-0.1 11,-0.3 8,-0.1 -1,-0.2 -0.013 39.8-113.9 -58.9 171.4 26.0 37.0 54.9 83 83 A A S S- 0 0 46 9,-1.9 2,-0.3 6,-0.8 7,-0.2 0.928 94.8 -1.9 -79.0 -50.0 28.6 38.7 57.2 84 84 A R 0 0 163 5,-2.0 -1,-0.3 8,-0.3 8,-0.1 -0.912 360.0 360.0-149.0 115.5 28.7 36.0 60.0 85 85 A V 0 0 143 -2,-0.3 5,-0.1 -3,-0.2 -14,-0.0 0.270 360.0 360.0 -72.6 360.0 26.6 32.7 60.1 86 ! 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 87 105 A A > 0 0 129 0, 0.0 3,-0.7 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -51.7 22.6 41.6 65.6 88 106 A Y G >> + 0 0 70 1,-0.2 3,-1.9 2,-0.1 4,-1.2 0.415 360.0 96.7 -72.3 -4.6 21.2 41.4 62.0 89 107 A L G 34 S+ 0 0 42 1,-0.3 -5,-2.0 2,-0.2 -6,-0.8 0.490 70.9 66.0 -75.3 -2.3 24.6 40.4 60.6 90 108 A T G <4 S+ 0 0 68 -3,-0.7 -1,-0.3 -7,-0.2 -8,-0.1 0.565 110.1 38.7 -87.3 -7.2 23.7 36.7 60.6 91 109 A E T <4 S+ 0 0 53 -3,-1.9 -17,-2.3 1,-0.1 2,-0.3 0.705 118.5 36.8-109.4 -27.9 21.2 37.5 57.9 92 110 A Y < - 0 0 14 -4,-1.2 -9,-1.9 -19,-0.2 -8,-0.3 -0.846 65.8-128.3-134.4 161.1 22.9 40.1 55.7 93 111 A C S S+ 0 0 21 -11,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.874 92.7 1.7 -74.0 -39.7 26.3 41.0 54.3 94 112 A T S > S- 0 0 58 -6,-0.1 4,-1.0 1,-0.1 -11,-0.1 -0.807 76.6-102.8-138.9 170.6 26.3 44.6 55.4 95 113 A K H > S+ 0 0 97 -2,-0.3 4,-2.0 2,-0.2 5,-0.2 0.869 118.3 61.9 -62.8 -34.5 24.1 46.9 57.4 96 114 A A H > S+ 0 0 59 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.871 102.1 46.8 -66.2 -40.1 23.0 48.5 54.1 97 115 A H H > S+ 0 0 38 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.815 106.9 60.8 -71.6 -25.9 21.5 45.3 52.7 98 116 A F H X S+ 0 0 31 -4,-1.0 4,-2.5 2,-0.2 -2,-0.2 0.954 110.1 39.7 -58.5 -51.8 19.7 44.9 56.0 99 117 A R H X S+ 0 0 40 -4,-2.0 4,-3.5 2,-0.2 5,-0.2 0.932 113.9 54.1 -65.0 -45.9 17.9 48.2 55.5 100 118 A C H X S+ 0 0 4 -4,-2.3 4,-2.0 1,-0.2 33,-0.3 0.895 111.0 47.6 -53.9 -41.1 17.3 47.5 51.8 101 119 A S H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 -1,-0.2 0.942 113.6 45.2 -67.7 -49.2 15.7 44.2 52.8 102 120 A Q H X S+ 0 0 25 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.884 109.9 55.8 -57.1 -42.5 13.5 45.8 55.5 103 121 A F H < S+ 0 0 0 -4,-3.5 4,-0.4 2,-0.2 -1,-0.2 0.918 112.8 43.3 -59.4 -42.2 12.6 48.6 53.1 104 122 A Y H >X S+ 0 0 1 -4,-2.0 3,-2.5 -5,-0.2 4,-0.6 0.986 113.1 49.4 -66.7 -55.9 11.4 46.0 50.6 105 123 A Q H >< S+ 0 0 37 -4,-3.0 3,-1.7 1,-0.3 -2,-0.2 0.814 99.8 65.2 -56.5 -35.8 9.6 43.8 53.1 106 124 A F T 3< S+ 0 0 33 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.655 101.8 51.8 -69.4 -12.6 7.7 46.6 54.6 107 125 A Q T <4 S+ 0 0 38 -3,-2.5 -1,-0.3 -4,-0.4 -2,-0.2 0.637 84.5 106.5 -90.3 -16.6 5.9 47.1 51.3 108 126 A L S << S- 0 0 3 -3,-1.7 -51,-0.2 -4,-0.6 -52,-0.1 -0.407 71.4-122.2 -70.9 136.7 4.8 43.5 50.9 109 127 A S - 0 0 55 -54,-0.3 -52,-0.9 -57,-0.2 -1,-0.1 -0.259 4.6-147.6 -66.0 159.6 1.1 42.8 51.5 110 128 A D + 0 0 106 -54,-0.2 -1,-0.1 -53,-0.1 -54,-0.1 0.455 61.6 122.1-103.8 -4.2 -0.1 40.3 54.1 111 129 A E S S- 0 0 106 1,-0.1 5,-0.1 2,-0.1 -2,-0.1 -0.362 77.5-102.4 -58.3 126.3 -3.0 39.4 51.9 112 130 A A > - 0 0 59 1,-0.1 3,-1.4 3,-0.1 4,-0.2 -0.217 24.3-121.9 -52.0 142.3 -2.9 35.7 51.3 113 131 A L G > S+ 0 0 12 1,-0.3 3,-2.2 2,-0.2 6,-0.2 0.899 110.1 60.8 -52.2 -45.7 -1.6 34.8 47.9 114 132 A F G 3 S+ 0 0 108 1,-0.3 -1,-0.3 -91,-0.1 -93,-0.1 0.675 101.2 55.1 -55.3 -22.8 -4.7 32.9 47.1 115 133 A A G < S+ 0 0 48 -3,-1.4 2,-1.3 1,-0.1 -1,-0.3 0.342 78.0 99.6 -98.9 -0.6 -6.8 36.0 47.5 116 134 A R S X S- 0 0 15 -3,-2.2 3,-2.4 -4,-0.2 4,-0.2 -0.693 78.5-136.3 -90.9 82.9 -4.8 38.1 45.0 117 135 A V T 3 S- 0 0 140 -2,-1.3 -2,-0.1 1,-0.3 -97,-0.1 -0.099 78.7 -2.9 -46.7 117.3 -7.2 37.8 42.1 118 136 A G T > S+ 0 0 17 -99,-0.1 3,-2.0 6,-0.1 6,-0.3 0.664 81.7 142.7 75.8 17.8 -5.4 37.1 38.9 119 137 A V T < S+ 0 0 8 -3,-2.4 -2,-0.1 1,-0.3 -1,-0.1 0.748 70.1 57.8 -61.7 -22.2 -1.9 37.3 40.4 120 138 A H T 3 S+ 0 0 7 -4,-0.2 2,-0.3 -105,-0.1 -1,-0.3 0.529 88.1 104.6 -84.4 -3.7 -0.8 34.4 38.1 121 139 A L S X S- 0 0 52 -3,-2.0 3,-1.9 1,-0.1 -104,-0.1 -0.598 73.6-134.5 -91.2 141.1 -1.7 36.4 34.9 122 140 A D T 3 S+ 0 0 116 -106,-0.3 -1,-0.1 1,-0.3 -3,-0.1 0.587 109.9 52.5 -54.5 -5.8 0.7 38.1 32.5 123 141 A D T 3 S+ 0 0 125 -5,-0.2 -1,-0.3 2,-0.1 -4,-0.1 0.364 77.2 131.2-127.8 -13.1 -1.8 40.9 32.7 124 142 A Y < - 0 0 44 -3,-1.9 -6,-0.1 -6,-0.3 -5,-0.1 -0.087 44.9-144.3 -52.5 146.8 -2.2 41.5 36.5 125 143 A E - 0 0 162 2,-0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.946 12.6-136.5-120.4 112.1 -1.9 45.0 37.9 126 144 A P - 0 0 57 0, 0.0 3,-0.0 0, 0.0 -73,-0.0 -0.391 19.9-120.7 -65.1 145.7 -0.3 45.5 41.4 127 145 A P S S- 0 0 125 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 0.761 92.2 -0.2 -50.9 -36.3 -2.0 47.9 43.9 128 146 A S S S- 0 0 81 0, 0.0 2,-0.6 0, 0.0 0, 0.0 -0.973 83.0 -94.9-148.8 162.7 1.1 50.1 44.0 129 147 A E - 0 0 126 -2,-0.3 2,-0.2 -3,-0.0 -80,-0.0 -0.757 41.6-127.7 -85.1 123.0 4.6 50.2 42.6 130 148 A I - 0 0 10 -2,-0.6 2,-0.3 -81,-0.2 -81,-0.1 -0.465 22.3-141.4 -68.6 133.9 7.1 48.6 44.9 131 149 A Q - 0 0 43 -2,-0.2 2,-0.4 -28,-0.2 -24,-0.1 -0.791 6.1-150.6-106.0 140.8 10.2 50.8 45.7 132 150 A L - 0 0 23 -2,-0.3 2,-0.2 2,-0.1 -31,-0.1 -0.922 28.7-105.1-113.4 135.0 13.7 49.7 46.1 133 151 A L 0 0 34 -2,-0.4 -33,-0.1 -33,-0.3 -29,-0.0 -0.383 360.0 360.0 -65.0 128.3 16.2 51.4 48.4 134 152 A E 0 0 159 -2,-0.2 -2,-0.1 102,-0.1 106,-0.0 -0.760 360.0 360.0 130.6 360.0 18.9 53.7 46.7 135 !* 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 0.0 136 1 B M 0 0 163 0, 0.0 2,-0.3 0, 0.0 41,-0.2 0.000 360.0 360.0 360.0 -42.6 10.2 72.3 68.1 137 2 B A B +b 177 0B 1 39,-2.8 41,-2.6 34,-0.1 42,-0.3 -0.626 360.0 173.3 -78.4 140.3 7.1 69.9 68.2 138 3 B T > - 0 0 34 -2,-0.3 4,-2.1 39,-0.2 3,-0.3 -0.907 48.1-102.1-143.0 161.1 7.3 67.3 71.0 139 4 B I H > S+ 0 0 10 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.933 121.0 54.6 -51.9 -43.9 5.3 64.5 72.7 140 5 B E H > S+ 0 0 113 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.867 107.2 49.0 -67.5 -32.2 4.6 66.8 75.6 141 6 B E H > S+ 0 0 47 -3,-0.3 4,-3.6 2,-0.2 5,-0.4 0.890 109.5 51.5 -72.5 -36.3 3.2 69.6 73.3 142 7 B I H X>S+ 0 0 0 -4,-2.1 5,-2.2 2,-0.2 4,-1.9 0.924 109.6 50.4 -65.5 -41.7 0.9 67.1 71.5 143 8 B K H <>S+ 0 0 79 -4,-2.5 5,-1.1 3,-0.2 -1,-0.2 0.900 120.0 36.8 -61.2 -37.7 -0.4 65.9 74.9 144 9 B E H <5S+ 0 0 111 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.883 127.1 31.6 -82.4 -41.7 -1.1 69.5 76.0 145 10 B V H <5S+ 0 0 85 -4,-3.6 -3,-0.2 -5,-0.1 -2,-0.2 0.631 134.5 22.0 -96.9 -14.0 -2.2 71.2 72.7 146 11 B V T <5S+ 0 0 3 -4,-1.9 -3,-0.2 -5,-0.4 4,-0.1 0.744 128.1 31.8-117.5 -47.6 -4.0 68.3 71.1 147 12 B L T > - 0 0 78 -2,-0.4 4,-2.5 1,-0.1 5,-0.1 -0.388 34.6-104.0 -77.6 166.4 -16.8 60.6 68.3 158 23 B I H > S+ 0 0 89 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.887 125.1 53.0 -57.5 -38.3 -15.9 60.9 64.6 159 24 B R H > S+ 0 0 198 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.922 108.0 48.9 -65.6 -44.6 -16.0 64.7 65.1 160 25 B E H > S+ 0 0 46 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.885 112.5 50.3 -59.4 -40.7 -13.5 64.5 68.1 161 26 B V H X S+ 0 0 11 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.944 108.3 49.6 -62.2 -48.5 -11.3 62.3 65.9 162 27 B E H X S+ 0 0 114 -4,-2.5 4,-3.4 1,-0.2 -2,-0.2 0.906 110.1 54.6 -57.2 -39.6 -11.3 64.7 62.9 163 28 B T H X S+ 0 0 55 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.890 106.8 48.1 -62.2 -47.0 -10.5 67.5 65.4 164 29 B I H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 5,-0.3 0.958 113.6 48.8 -55.4 -52.6 -7.4 65.6 66.7 165 30 B S H X S+ 0 0 21 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.962 113.4 46.6 -52.6 -54.3 -6.3 65.0 63.0 166 31 B I H X S+ 0 0 95 -4,-3.4 4,-2.7 1,-0.2 -1,-0.2 0.875 114.4 46.4 -58.2 -42.8 -6.8 68.6 62.1 167 32 B N H X S+ 0 0 60 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.836 112.9 49.1 -70.2 -33.8 -5.0 70.0 65.1 168 33 B L H X S+ 0 0 2 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.902 113.4 46.5 -72.1 -42.8 -2.1 67.6 64.8 169 34 B I H X S+ 0 0 30 -4,-2.9 4,-1.5 -5,-0.3 5,-0.3 0.947 110.8 51.9 -65.1 -46.1 -1.7 68.5 61.1 170 35 B D H >X S+ 0 0 89 -4,-2.7 3,-0.6 -5,-0.2 4,-0.5 0.940 113.2 47.9 -50.5 -49.2 -2.0 72.2 61.9 171 36 B L H >X S+ 0 0 12 -4,-2.2 4,-2.3 1,-0.2 3,-1.1 0.927 111.3 48.0 -59.0 -47.0 0.8 71.7 64.4 172 37 B L H 3< S+ 0 0 1 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.555 110.5 49.8 -81.2 -7.7 3.0 69.7 62.1 173 38 B I H << S+ 0 0 33 -4,-1.5 -1,-0.3 -3,-0.6 -2,-0.2 0.450 116.2 46.5 -92.7 -7.1 2.9 72.1 59.2 174 39 B T H << S+ 0 0 89 -3,-1.1 2,-0.3 -4,-0.5 -2,-0.2 0.760 123.1 20.8-103.5 -35.6 3.7 74.8 61.7 175 40 B K S < S- 0 0 58 -4,-2.3 2,-0.3 -5,-0.1 -1,-0.2 -0.833 77.5-117.5-127.6 164.9 6.6 73.2 63.6 176 41 B D - 0 0 21 -2,-0.3 -39,-2.8 36,-0.1 2,-0.3 -0.829 37.1-102.9-101.8 149.3 9.0 70.4 62.8 177 42 B V B -b 137 0B 4 34,-2.3 -39,-0.2 -2,-0.3 6,-0.0 -0.545 31.8-156.8 -69.1 131.3 9.1 67.2 64.9 178 43 B K + 0 0 129 -41,-2.6 2,-0.3 -2,-0.3 -1,-0.1 0.723 60.3 39.3 -83.7 -17.6 12.1 67.5 67.2 179 44 B D > - 0 0 54 -42,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.952 63.4-131.9-147.8 139.1 12.9 64.0 67.9 180 45 B A H > S+ 0 0 44 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.903 115.9 56.4 -50.6 -46.0 13.1 60.4 66.7 181 46 B R H > S+ 0 0 129 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.803 106.8 47.2 -60.3 -32.2 11.1 59.6 69.8 182 47 B T H > S+ 0 0 1 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.857 107.5 55.8 -82.3 -34.0 8.4 62.0 68.8 183 48 B M H X S+ 0 0 0 -4,-2.0 4,-0.7 2,-0.2 -2,-0.2 0.871 109.6 46.9 -59.5 -43.1 8.2 60.7 65.2 184 49 B K H >X S+ 0 0 70 -4,-2.2 3,-1.1 1,-0.2 4,-0.6 0.955 111.1 53.1 -66.7 -46.5 7.6 57.2 66.6 185 50 B Y H >< S+ 0 0 18 -4,-1.7 3,-0.8 1,-0.2 -2,-0.2 0.881 106.1 51.9 -49.3 -45.6 4.9 58.6 69.0 186 51 B I H >< S+ 0 0 0 -4,-2.1 3,-2.4 1,-0.2 -1,-0.2 0.671 86.9 82.0 -77.1 -11.6 2.9 60.4 66.3 187 52 B S H X< S+ 0 0 19 -3,-1.1 3,-2.0 -4,-0.7 -1,-0.2 0.898 81.1 68.5 -58.8 -42.2 2.7 57.3 64.1 188 53 B R T << S+ 0 0 43 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.643 101.6 44.9 -32.3 -35.5 -0.2 56.3 66.4 189 54 B F T < S+ 0 0 5 -3,-2.4 2,-0.4 -4,-0.1 -1,-0.3 0.281 101.5 76.2-107.9 6.1 -2.3 59.2 65.0 190 55 B L < - 0 0 3 -3,-2.0 60,-0.4 -4,-0.2 2,-0.1 -0.982 54.7-157.5-128.2 129.2 -1.7 58.9 61.3 191 56 B T > - 0 0 17 -2,-0.4 4,-1.9 58,-0.1 60,-0.2 -0.445 46.7 -99.5 -78.5 172.3 -3.0 56.6 58.5 192 57 B K H > S+ 0 0 58 58,-0.7 4,-2.3 2,-0.2 5,-0.1 0.906 127.7 49.0 -54.3 -44.4 -0.7 56.4 55.4 193 58 B Q H > S+ 0 0 117 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.916 106.9 54.5 -68.1 -43.2 -3.1 58.8 53.7 194 59 B D H > S+ 0 0 27 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.902 109.8 47.8 -53.8 -43.1 -3.0 61.2 56.6 195 60 B Y H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.905 109.0 53.3 -68.2 -38.7 0.8 61.2 56.4 196 61 B A H X S+ 0 0 29 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.907 108.7 50.1 -58.7 -42.5 0.5 61.8 52.6 197 62 B D H X S+ 0 0 69 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.865 108.5 53.3 -64.7 -37.7 -1.8 64.8 53.3 198 63 B L H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 5,-0.3 0.951 107.9 50.5 -60.3 -48.4 0.9 66.1 55.8 199 64 B V H X S+ 0 0 5 -4,-2.4 4,-2.5 2,-0.2 3,-0.5 0.957 113.4 44.4 -55.8 -54.0 3.6 65.9 53.2 200 65 B Q H X S+ 0 0 86 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.910 113.8 50.8 -57.7 -46.6 1.5 67.9 50.7 201 66 B E H < S+ 0 0 94 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.774 112.1 46.2 -63.8 -27.3 0.5 70.4 53.3 202 67 B R H ><>S+ 0 0 0 -4,-2.2 5,-2.4 -3,-0.5 3,-1.2 0.851 109.9 54.7 -81.6 -36.0 4.2 70.9 54.4 203 68 B N H ><5S+ 0 0 14 -4,-2.5 3,-1.8 -5,-0.3 -2,-0.2 0.868 101.6 58.3 -59.4 -39.8 5.2 71.2 50.8 204 69 B L T 3<5S+ 0 0 134 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.486 108.5 45.9 -74.3 -2.6 2.6 74.0 50.3 205 70 B V T < 5S- 0 0 74 -3,-1.2 -1,-0.3 2,-0.2 -2,-0.2 -0.055 125.1-102.3-121.9 25.4 4.4 76.0 53.1 206 71 B K T < 5S+ 0 0 135 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.894 77.2 137.6 59.1 42.5 7.9 75.3 51.6 207 72 B R < - 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