==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS/CELL CYCLE/GENE REGULATION 30-APR-99 3SAK . COMPND 2 MOLECULE: PROTEIN (TUMOR SUPPRESSOR P53); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.M.CLORE . 168 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13327.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 108 64.3 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 . 16 9.5 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 . 12 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 45.2 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 0 0 0 0 0 0 0 0 0 0 4 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 2 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 . 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 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 K 0 0 179 0, 0.0 2,-5.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -27.9 19.3 23.0 9.7 2 2 A K - 0 0 181 1,-0.0 0, 0.0 0, 0.0 0, 0.0 0.038 360.0-152.9 58.2 -39.4 20.9 20.6 12.2 3 3 A K - 0 0 126 -2,-5.2 3,-0.0 2,-0.1 -1,-0.0 0.584 13.8 -98.2 54.8 151.5 17.6 18.7 11.9 4 4 A P - 0 0 101 0, 0.0 2,-0.7 0, 0.0 0, 0.0 -0.116 64.4 -72.5 -78.0-170.6 15.9 16.5 14.5 5 5 A L - 0 0 171 3,-0.0 3,-0.1 -2,-0.0 -2,-0.1 -0.760 55.1-139.4 -88.7 116.7 16.6 12.8 13.9 6 6 A D - 0 0 50 -2,-0.7 3,-0.1 1,-0.2 -1,-0.0 -0.297 40.7 -74.6 -69.7 161.6 14.5 11.9 10.8 7 7 A G - 0 0 23 1,-0.1 -1,-0.2 95,-0.1 95,-0.0 -0.293 65.2 -91.0 -56.9 139.1 12.8 8.5 11.0 8 8 A E - 0 0 130 93,-0.2 94,-0.7 -3,-0.1 2,-0.3 -0.259 47.2-130.2 -52.8 132.0 15.4 5.8 10.5 9 9 A Y E -A 101 0A 98 92,-0.2 2,-0.4 -3,-0.1 92,-0.2 -0.667 23.9-168.8 -89.5 144.2 15.5 5.1 6.7 10 10 A F E -A 100 0A 54 90,-2.0 90,-3.5 -2,-0.3 2,-0.2 -0.983 14.4-136.1-132.3 143.1 15.3 1.6 5.4 11 11 A T E -A 99 0A 108 -2,-0.4 2,-0.4 88,-0.2 88,-0.2 -0.658 19.8-167.9 -94.5 153.5 16.0 0.3 1.9 12 12 A L E -A 98 0A 18 86,-0.9 86,-0.9 -2,-0.2 2,-0.5 -0.975 19.3-132.7-145.6 130.5 13.6 -2.3 0.3 13 13 A Q E -A 97 0A 113 -2,-0.4 2,-0.5 84,-0.2 84,-0.2 -0.675 24.4-167.2 -82.2 127.4 14.0 -4.4 -2.9 14 14 A I E -A 96 0A 0 82,-3.5 82,-2.0 -2,-0.5 2,-0.2 -0.953 10.8-143.5-120.0 120.0 10.9 -4.2 -5.0 15 15 A R E +A 95 0A 94 -2,-0.5 80,-0.2 80,-0.2 79,-0.2 -0.498 70.0 37.6 -77.4 148.4 10.5 -6.7 -7.9 16 16 A G S > S- 0 0 21 78,-0.7 4,-2.0 -2,-0.2 80,-0.1 0.683 73.9-126.7 80.9 115.6 8.8 -5.5 -11.1 17 17 A R H > S+ 0 0 152 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.913 111.9 56.3 -60.3 -39.9 9.5 -1.9 -12.4 18 18 A E H > S+ 0 0 164 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.949 106.3 49.6 -58.3 -46.5 5.7 -1.3 -12.5 19 19 A R H > S+ 0 0 27 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.910 106.9 56.7 -60.1 -39.8 5.4 -2.2 -8.8 20 20 A F H X S+ 0 0 39 -4,-2.0 4,-3.4 2,-0.2 5,-0.2 0.956 106.5 47.7 -59.2 -48.7 8.3 0.2 -8.0 21 21 A E H X S+ 0 0 80 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.935 114.4 48.6 -59.3 -41.0 6.5 3.1 -9.6 22 22 A M H X S+ 0 0 29 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.964 113.4 45.1 -63.5 -50.1 3.4 2.1 -7.6 23 23 A F H X S+ 0 0 0 -4,-3.6 4,-3.0 1,-0.2 -2,-0.2 0.920 110.4 55.9 -61.8 -40.0 5.4 1.8 -4.3 24 24 A R H X S+ 0 0 107 -4,-3.4 4,-3.6 -5,-0.3 5,-0.4 0.938 105.7 51.3 -59.1 -43.7 7.1 5.1 -5.0 25 25 A E H X S+ 0 0 71 -4,-2.2 4,-3.1 -5,-0.2 5,-0.2 0.959 112.2 45.4 -60.1 -46.8 3.8 6.9 -5.3 26 26 A L H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.929 114.8 50.3 -62.2 -40.2 2.6 5.4 -2.0 27 27 A N H X S+ 0 0 9 -4,-3.0 4,-2.5 -5,-0.2 -2,-0.2 0.983 115.2 40.2 -61.6 -56.4 6.0 6.4 -0.6 28 28 A E H X S+ 0 0 83 -4,-3.6 4,-2.8 1,-0.2 5,-0.2 0.910 112.9 57.4 -60.5 -40.0 5.9 10.0 -1.8 29 29 A A H X S+ 0 0 0 -4,-3.1 4,-2.0 -5,-0.4 -1,-0.2 0.957 109.6 43.4 -58.2 -48.1 2.2 10.2 -0.9 30 30 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.932 112.4 53.4 -64.2 -42.0 3.0 9.3 2.7 31 31 A E H X S+ 0 0 81 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.918 106.1 53.8 -60.2 -39.8 6.0 11.7 2.8 32 32 A L H X S+ 0 0 41 -4,-2.8 4,-1.8 1,-0.2 5,-0.2 0.961 109.9 46.2 -60.8 -48.0 3.8 14.5 1.5 33 33 A K H X S+ 0 0 50 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.922 110.0 55.5 -60.6 -40.6 1.3 14.0 4.3 34 34 A D H X S+ 0 0 48 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.907 102.9 55.0 -59.8 -39.8 4.2 13.8 6.8 35 35 A A H < S+ 0 0 76 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.932 114.6 39.7 -61.9 -40.6 5.4 17.2 5.6 36 36 A Q H >< S+ 0 0 105 -4,-1.8 3,-1.9 1,-0.2 -2,-0.2 0.843 110.0 59.3 -77.4 -30.0 2.0 18.6 6.4 37 37 A A H 3< S+ 0 0 73 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.872 93.5 66.8 -65.5 -29.8 1.8 16.5 9.6 38 38 A G T 3< S+ 0 0 67 -4,-2.1 -1,-0.3 -5,-0.2 2,-0.3 0.456 79.6 115.4 -69.0 6.0 4.9 18.4 10.6 39 39 A K S < S- 0 0 141 -3,-1.9 3,-0.1 -5,-0.1 -3,-0.1 -0.585 78.6-105.9 -78.9 136.8 2.6 21.4 10.7 40 40 A E - 0 0 164 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 -0.247 44.3 -91.5 -57.5 150.8 2.2 22.9 14.2 41 41 A P 0 0 130 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.142 360.0 360.0 -56.6 159.0 -1.1 22.2 15.9 42 42 A G 0 0 125 -3,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.731 360.0 360.0 82.6 360.0 -3.7 24.9 15.2 43 !* 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 44 1 B K 0 0 179 0, 0.0 2,-5.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -27.9 -19.0 24.4 -8.1 45 2 B K - 0 0 181 1,-0.0 0, 0.0 0, 0.0 0, 0.0 0.039 360.0-152.8 58.3 -39.5 -20.7 22.2 -10.9 46 3 B K - 0 0 126 -2,-5.2 3,-0.0 2,-0.1 -1,-0.0 0.585 13.8 -98.2 54.9 151.5 -17.4 20.2 -10.7 47 4 B P - 0 0 102 0, 0.0 2,-0.7 0, 0.0 0, 0.0 -0.116 64.5 -72.5 -78.1-170.7 -15.8 18.2 -13.5 48 5 B L - 0 0 173 3,-0.0 3,-0.1 -2,-0.0 -2,-0.1 -0.761 55.2-139.3 -88.8 116.6 -16.6 14.5 -13.2 49 6 B D - 0 0 49 -2,-0.7 3,-0.1 1,-0.2 -1,-0.0 -0.315 40.7 -74.5 -69.9 160.0 -14.6 13.2 -10.3 50 7 B G - 0 0 22 1,-0.1 -1,-0.2 95,-0.1 0, 0.0 -0.265 65.3 -91.2 -54.1 138.8 -12.9 9.8 -10.7 51 8 B E - 0 0 132 93,-0.2 94,-0.7 -3,-0.1 2,-0.3 -0.263 47.3-130.1 -53.2 132.1 -15.6 7.2 -10.4 52 9 B Y E -B 144 0B 104 92,-0.2 2,-0.4 -3,-0.1 92,-0.2 -0.666 24.0-168.7 -89.5 144.2 -15.8 6.2 -6.7 53 10 B F E -B 143 0B 53 90,-2.0 90,-3.4 -2,-0.3 2,-0.2 -0.983 14.4-136.2-132.3 143.1 -15.7 2.5 -5.7 54 11 B T E -B 142 0B 107 -2,-0.4 2,-0.4 88,-0.2 88,-0.2 -0.659 19.8-167.9 -94.5 153.4 -16.3 0.9 -2.3 55 12 B L E -B 141 0B 18 86,-0.9 86,-0.9 -2,-0.2 2,-0.5 -0.976 19.3-132.7-145.6 130.6 -14.1 -1.8 -1.0 56 13 B Q E -B 140 0B 111 -2,-0.4 2,-0.5 84,-0.2 84,-0.2 -0.677 24.4-167.2 -82.3 127.5 -14.6 -4.2 2.0 57 14 B I E -B 139 0B 0 82,-3.4 82,-2.0 -2,-0.5 2,-0.2 -0.953 10.8-143.4-120.1 120.0 -11.4 -4.3 4.1 58 15 B R E +B 138 0B 94 -2,-0.5 80,-0.2 80,-0.2 79,-0.2 -0.499 69.9 37.6 -77.4 148.4 -11.1 -7.0 6.8 59 16 B G S > S- 0 0 22 78,-0.7 4,-2.0 -2,-0.2 80,-0.1 0.683 73.9-126.7 80.9 115.6 -9.4 -6.1 10.1 60 17 B R H > S+ 0 0 151 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.912 111.9 56.3 -60.2 -40.1 -9.9 -2.7 11.6 61 18 B E H > S+ 0 0 167 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.950 106.3 49.6 -58.2 -46.5 -6.2 -2.2 11.8 62 19 B R H > S+ 0 0 28 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.910 106.9 56.6 -60.1 -39.8 -5.9 -2.8 8.1 63 20 B F H X S+ 0 0 37 -4,-2.0 4,-3.4 2,-0.2 5,-0.2 0.955 106.6 47.7 -59.2 -48.7 -8.7 -0.3 7.5 64 21 B E H X S+ 0 0 80 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.936 114.4 48.6 -59.2 -41.1 -6.8 2.5 9.3 65 22 B M H X S+ 0 0 28 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.964 113.4 45.1 -63.6 -50.0 -3.8 1.6 7.2 66 23 B F H X S+ 0 0 0 -4,-3.6 4,-3.0 1,-0.2 -2,-0.2 0.920 110.4 55.9 -61.9 -39.9 -5.7 1.6 4.0 67 24 B R H X S+ 0 0 106 -4,-3.4 4,-3.6 -5,-0.3 5,-0.4 0.937 105.7 51.3 -59.1 -43.7 -7.4 4.9 4.9 68 25 B E H X S+ 0 0 71 -4,-2.2 4,-3.1 -5,-0.2 5,-0.2 0.959 112.2 45.4 -60.0 -46.9 -4.0 6.5 5.4 69 26 B L H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.929 114.8 50.2 -62.2 -40.2 -2.9 5.3 2.0 70 27 B N H X S+ 0 0 8 -4,-3.0 4,-2.5 -5,-0.2 -2,-0.2 0.983 115.2 40.2 -61.7 -56.3 -6.2 6.5 0.6 71 28 B E H X S+ 0 0 85 -4,-3.6 4,-2.8 1,-0.2 5,-0.2 0.910 112.9 57.4 -60.5 -39.9 -6.0 10.0 2.2 72 29 B A H X S+ 0 0 0 -4,-3.1 4,-1.9 -5,-0.4 -1,-0.2 0.957 109.6 43.4 -58.3 -48.1 -2.4 10.2 1.3 73 30 B L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.932 112.4 53.4 -64.2 -42.0 -3.1 9.6 -2.4 74 31 B E H X S+ 0 0 81 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.917 106.2 53.7 -60.1 -40.2 -6.0 12.1 -2.3 75 32 B L H X S+ 0 0 41 -4,-2.8 4,-1.8 1,-0.2 5,-0.2 0.960 109.9 46.2 -60.5 -48.0 -3.8 14.7 -0.8 76 33 B K H X S+ 0 0 49 -4,-1.9 4,-3.1 1,-0.2 5,-0.2 0.922 110.0 55.6 -60.7 -40.4 -1.3 14.4 -3.6 77 34 B D H X S+ 0 0 46 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.908 102.9 55.1 -60.0 -40.0 -4.2 14.5 -6.1 78 35 B A H < S+ 0 0 75 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.932 114.6 39.7 -61.6 -40.6 -5.3 17.8 -4.6 79 36 B Q H >< S+ 0 0 106 -4,-1.8 3,-1.9 1,-0.2 -2,-0.2 0.843 110.0 59.3 -77.5 -29.9 -1.8 19.2 -5.3 80 37 B A H 3< S+ 0 0 73 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.872 93.5 66.9 -65.6 -29.8 -1.7 17.4 -8.6 81 38 B G T 3< S+ 0 0 67 -4,-2.1 -1,-0.3 -5,-0.2 2,-0.3 0.457 79.6 115.4 -69.1 6.1 -4.8 19.4 -9.5 82 39 B K S < S- 0 0 141 -3,-1.9 3,-0.1 -5,-0.1 -3,-0.1 -0.584 78.6-105.9 -78.9 136.8 -2.4 22.4 -9.3 83 40 B E - 0 0 162 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 -0.247 44.3 -91.5 -57.5 150.7 -2.0 24.1 -12.7 84 41 B P 0 0 129 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.142 360.0 360.0 -56.6 158.9 1.4 23.5 -14.5 85 42 B G 0 0 126 -3,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.731 360.0 360.0 82.6 360.0 4.0 26.1 -13.5 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 1 C K 0 0 180 0, 0.0 2,-5.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -27.8 17.5 -23.3 -12.3 88 2 C K - 0 0 182 1,-0.0 0, 0.0 0, 0.0 0, 0.0 0.039 360.0-152.9 58.1 -39.3 18.8 -21.0 -15.0 89 3 C K - 0 0 126 -2,-5.2 3,-0.0 2,-0.1 -1,-0.0 0.584 13.8 -98.2 54.8 151.5 15.6 -19.0 -14.3 90 4 C P - 0 0 104 0, 0.0 2,-0.7 0, 0.0 0, 0.0 -0.115 64.5 -72.5 -78.0-170.7 13.8 -16.7 -16.7 91 5 C L - 0 0 171 3,-0.0 3,-0.1 -2,-0.0 -2,-0.1 -0.761 55.1-139.3 -88.8 116.7 14.6 -13.1 -16.2 92 6 C D - 0 0 48 -2,-0.7 3,-0.1 1,-0.2 -1,-0.0 -0.307 40.7 -74.5 -69.9 160.7 12.9 -12.1 -12.9 93 7 C G - 0 0 24 1,-0.1 -1,-0.2 -77,-0.1 0, 0.0 -0.278 65.3 -91.1 -55.2 138.9 11.2 -8.6 -12.9 94 8 C E - 0 0 130 -79,-0.2 -78,-0.7 -3,-0.1 2,-0.3 -0.261 47.2-130.1 -52.8 132.0 14.0 -6.0 -12.7 95 9 C Y E -A 15 0A 99 -80,-0.2 2,-0.4 -3,-0.1 -80,-0.2 -0.665 24.0-168.8 -89.5 144.2 14.5 -5.3 -9.0 96 10 C F E -A 14 0A 55 -82,-2.0 -82,-3.5 -2,-0.3 2,-0.2 -0.983 14.4-136.1-132.3 143.1 14.5 -1.8 -7.6 97 11 C T E -A 13 0A 110 -2,-0.4 2,-0.4 -84,-0.2 -84,-0.2 -0.658 19.8-168.0 -94.4 153.5 15.6 -0.5 -4.2 98 12 C L E -A 12 0A 18 -86,-0.9 -86,-0.9 -2,-0.2 2,-0.5 -0.976 19.3-132.7-145.7 130.5 13.5 2.1 -2.4 99 13 C Q E -A 11 0A 111 -2,-0.4 2,-0.5 -88,-0.2 -88,-0.2 -0.675 24.4-167.2 -82.3 127.4 14.3 4.2 0.7 100 14 C I E -A 10 0A 0 -90,-3.5 -90,-2.0 -2,-0.5 2,-0.2 -0.953 10.8-143.4-120.0 120.1 11.4 4.1 3.2 101 15 C R E +A 9 0A 93 -2,-0.5 -92,-0.2 -92,-0.2 -93,-0.2 -0.498 70.0 37.6 -77.4 148.3 11.4 6.6 6.1 102 16 C G S > S- 0 0 22 -94,-0.7 4,-2.0 -2,-0.2 -92,-0.1 0.684 73.9-126.7 81.0 115.6 10.1 5.4 9.5 103 17 C R H > S+ 0 0 151 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.913 111.9 56.3 -60.4 -39.8 10.8 1.8 10.7 104 18 C E H > S+ 0 0 168 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.949 106.3 49.6 -58.3 -46.5 7.1 1.3 11.2 105 19 C R H > S+ 0 0 26 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.910 106.9 56.6 -59.9 -40.0 6.4 2.2 7.6 106 20 C F H X S+ 0 0 39 -4,-2.0 4,-3.4 2,-0.2 5,-0.2 0.955 106.6 47.7 -59.1 -48.6 9.1 -0.2 6.5 107 21 C E H X S+ 0 0 79 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.936 114.4 48.6 -59.3 -41.0 7.4 -3.2 8.2 108 22 C M H X S+ 0 0 29 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.964 113.4 45.1 -63.6 -50.0 4.2 -2.1 6.6 109 23 C F H X S+ 0 0 0 -4,-3.6 4,-3.0 1,-0.2 -2,-0.2 0.920 110.4 55.9 -61.9 -39.9 5.7 -1.7 3.2 110 24 C R H X S+ 0 0 105 -4,-3.4 4,-3.6 -5,-0.3 5,-0.4 0.937 105.7 51.3 -59.1 -43.7 7.5 -5.1 3.7 111 25 C E H X S+ 0 0 72 -4,-2.2 4,-3.1 -5,-0.2 5,-0.2 0.959 112.2 45.4 -60.0 -46.9 4.2 -6.8 4.4 112 26 C L H X S+ 0 0 3 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.929 114.8 50.3 -62.2 -40.2 2.7 -5.3 1.2 113 27 C N H X S+ 0 0 7 -4,-3.0 4,-2.5 -5,-0.2 -2,-0.2 0.983 115.2 40.2 -61.6 -56.4 5.9 -6.4 -0.7 114 28 C E H X S+ 0 0 84 -4,-3.6 4,-2.8 1,-0.2 5,-0.2 0.911 112.9 57.5 -60.7 -39.8 5.8 -9.9 0.6 115 29 C A H X S+ 0 0 0 -4,-3.1 4,-2.0 -5,-0.4 -1,-0.2 0.957 109.6 43.4 -58.2 -48.1 2.1 -10.1 0.2 116 30 C L H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.932 112.4 53.4 -64.4 -41.8 2.4 -9.2 -3.5 117 31 C E H X S+ 0 0 80 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.917 106.2 53.8 -60.4 -39.8 5.3 -11.6 -3.9 118 32 C L H X S+ 0 0 40 -4,-2.8 4,-1.8 1,-0.2 5,-0.2 0.961 109.9 46.2 -60.7 -47.9 3.2 -14.4 -2.4 119 33 C K H X S+ 0 0 51 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.922 110.0 55.6 -60.6 -40.5 0.4 -13.8 -5.0 120 34 C D H X S+ 0 0 46 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.907 102.9 55.0 -59.8 -39.9 3.0 -13.7 -7.7 121 35 C A H < S+ 0 0 75 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.932 114.6 39.7 -61.9 -40.5 4.3 -17.2 -6.7 122 36 C Q H >< S+ 0 0 104 -4,-1.8 3,-1.9 1,-0.2 -2,-0.2 0.843 110.0 59.3 -77.5 -29.9 0.8 -18.5 -7.1 123 37 C A H 3< S+ 0 0 75 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.872 93.5 66.8 -65.6 -29.7 0.2 -16.4 -10.2 124 38 C G T 3< S+ 0 0 67 -4,-2.1 -1,-0.3 -5,-0.2 2,-0.3 0.456 79.6 115.4 -69.2 6.1 3.2 -18.3 -11.6 125 39 C K S < S- 0 0 143 -3,-1.9 3,-0.1 -5,-0.1 -3,-0.1 -0.584 78.6-105.9 -78.9 136.8 0.8 -21.3 -11.4 126 40 C E - 0 0 161 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 -0.248 44.3 -91.5 -57.5 150.7 0.0 -22.8 -14.9 127 41 C P 0 0 130 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.142 360.0 360.0 -56.6 158.9 -3.5 -22.0 -16.2 128 42 C G 0 0 125 -3,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.731 360.0 360.0 82.6 360.0 -6.0 -24.7 -15.2 129 !* 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 0.0 130 1 D K 0 0 180 0, 0.0 2,-5.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -27.9 -18.6 -23.7 9.7 131 2 D K - 0 0 182 1,-0.0 0, 0.0 0, 0.0 0, 0.0 0.039 360.0-152.9 58.2 -39.4 -19.9 -21.6 12.7 132 3 D K - 0 0 126 -2,-5.2 3,-0.0 2,-0.1 -1,-0.0 0.584 13.8 -98.2 54.8 151.5 -16.6 -19.6 12.1 133 4 D P - 0 0 103 0, 0.0 2,-0.7 0, 0.0 0, 0.0 -0.116 64.4 -72.5 -78.1-170.6 -14.7 -17.6 14.7 134 5 D L - 0 0 175 3,-0.0 3,-0.1 -2,-0.0 -2,-0.1 -0.761 55.1-139.4 -88.8 116.6 -15.4 -13.9 14.5 135 6 D D - 0 0 48 -2,-0.7 3,-0.1 1,-0.2 -1,-0.0 -0.308 40.7 -74.5 -69.8 160.7 -13.7 -12.7 11.3 136 7 D G - 0 0 23 1,-0.1 -1,-0.2 -77,-0.1 -77,-0.0 -0.276 65.3 -91.1 -55.2 138.8 -11.9 -9.3 11.6 137 8 D E - 0 0 133 -79,-0.2 -78,-0.7 -3,-0.1 2,-0.3 -0.261 47.2-130.1 -52.8 132.0 -14.6 -6.6 11.6 138 9 D Y E -B 58 0B 99 -80,-0.2 2,-0.4 -3,-0.1 -80,-0.2 -0.666 24.0-168.8 -89.6 144.2 -15.1 -5.6 8.0 139 10 D F E -B 57 0B 53 -82,-2.0 -82,-3.4 -2,-0.3 2,-0.2 -0.983 14.4-136.2-132.3 143.1 -15.0 -2.0 6.9 140 11 D T E -B 56 0B 108 -2,-0.4 2,-0.4 -84,-0.2 -84,-0.2 -0.658 19.8-168.0 -94.6 153.5 -16.0 -0.3 3.6 141 12 D L E -B 55 0B 19 -86,-0.9 -86,-0.9 -2,-0.2 2,-0.5 -0.976 19.4-132.7-145.7 130.6 -13.9 2.3 2.0 142 13 D Q E -B 54 0B 112 -2,-0.4 2,-0.5 -88,-0.2 -88,-0.2 -0.676 24.5-167.2 -82.3 127.5 -14.6 4.7 -0.8 143 14 D I E -B 53 0B 0 -90,-3.4 -90,-2.0 -2,-0.5 2,-0.2 -0.953 10.8-143.5-120.0 119.9 -11.7 4.8 -3.4 144 15 D R E +B 52 0B 91 -2,-0.5 -92,-0.2 -92,-0.2 -93,-0.2 -0.498 69.9 37.6 -77.4 148.3 -11.6 7.5 -6.0 145 16 D G S > S- 0 0 20 -94,-0.7 4,-2.0 -2,-0.2 -92,-0.1 0.683 73.9-126.7 81.0 115.6 -10.3 6.5 -9.5 146 17 D R H > S+ 0 0 150 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.912 111.9 56.3 -60.3 -39.9 -11.1 3.1 -11.0 147 18 D E H > S+ 0 0 168 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.949 106.3 49.6 -58.3 -46.4 -7.4 2.5 -11.6 148 19 D R H > S+ 0 0 27 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.910 106.9 56.6 -60.1 -39.9 -6.7 3.1 -7.9 149 20 D F H X S+ 0 0 38 -4,-2.0 4,-3.4 2,-0.2 5,-0.2 0.956 106.5 47.7 -59.1 -48.6 -9.5 0.6 -7.0 150 21 D E H X S+ 0 0 79 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.935 114.4 48.6 -59.4 -41.0 -7.9 -2.2 -9.0 151 22 D M H X S+ 0 0 29 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.963 113.4 45.0 -63.5 -50.1 -4.6 -1.3 -7.3 152 23 D F H X S+ 0 0 0 -4,-3.6 4,-3.0 1,-0.2 -2,-0.2 0.920 110.5 55.9 -61.8 -40.0 -6.2 -1.3 -3.8 153 24 D R H X S+ 0 0 105 -4,-3.4 4,-3.6 -5,-0.3 5,-0.4 0.938 105.7 51.3 -59.0 -43.7 -8.1 -4.5 -4.6 154 25 D E H X S+ 0 0 73 -4,-2.2 4,-3.1 -5,-0.2 5,-0.2 0.959 112.2 45.4 -60.1 -46.9 -4.8 -6.2 -5.4 155 26 D L H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.928 114.8 50.3 -62.2 -40.2 -3.2 -5.1 -2.1 156 27 D N H X S+ 0 0 8 -4,-3.0 4,-2.5 -5,-0.2 -2,-0.2 0.983 115.2 40.3 -61.6 -56.4 -6.5 -6.2 -0.4 157 28 D E H X S+ 0 0 82 -4,-3.6 4,-2.8 1,-0.2 5,-0.2 0.909 112.9 57.4 -60.5 -40.0 -6.5 -9.6 -2.0 158 29 D A H X S+ 0 0 1 -4,-3.1 4,-1.9 -5,-0.4 -1,-0.2 0.957 109.6 43.5 -58.2 -48.1 -2.8 -9.9 -1.5 159 30 D L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.932 112.4 53.4 -64.2 -42.1 -3.1 -9.4 2.2 160 31 D E H X S+ 0 0 79 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.918 106.1 53.7 -60.0 -40.1 -6.1 -11.8 2.4 161 32 D L H X S+ 0 0 39 -4,-2.8 4,-1.8 1,-0.2 5,-0.2 0.960 109.9 46.2 -60.7 -48.0 -4.0 -14.5 0.7 162 33 D K H X S+ 0 0 53 -4,-1.9 4,-3.0 1,-0.2 5,-0.2 0.922 110.0 55.6 -60.5 -40.5 -1.2 -14.2 3.3 163 34 D D H X S+ 0 0 46 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.907 102.9 55.0 -59.8 -40.1 -3.9 -14.2 6.0 164 35 D A H < S+ 0 0 75 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.932 114.6 39.7 -61.7 -40.6 -5.2 -17.5 4.7 165 36 D Q H >< S+ 0 0 105 -4,-1.8 3,-1.9 1,-0.2 -2,-0.2 0.842 110.0 59.3 -77.5 -30.0 -1.7 -19.0 5.0 166 37 D A H 3< S+ 0 0 74 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.872 93.5 66.9 -65.5 -29.8 -1.2 -17.2 8.3 167 38 D G T 3< S+ 0 0 66 -4,-2.1 -1,-0.3 -5,-0.2 2,-0.3 0.457 79.7 115.3 -69.1 6.1 -4.2 -19.1 9.5 168 39 D K S < S- 0 0 146 -3,-1.9 3,-0.1 -5,-0.1 -3,-0.1 -0.582 78.6-105.8 -78.9 137.3 -1.9 -22.2 9.1 169 40 D E - 0 0 158 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 -0.253 44.3 -91.6 -58.2 150.2 -1.2 -23.9 12.4 170 41 D P 0 0 128 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.140 360.0 360.0 -56.2 158.9 2.4 -23.4 13.7 171 42 D G 0 0 126 -3,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.731 360.0 360.0 82.7 360.0 4.8 -26.0 12.5