==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTI-ONCOGENE 12-MAR-95 1SAL . COMPND 2 MOLECULE: TUMOR SUPPRESSOR P53; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.M.CLORE,J.G.OMICHINSKI,A.M.GRONENBORN . 168 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13811.0 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 1 319 A K 0 0 207 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 27.5 18.8 22.5 6.4 2 320 A K - 0 0 164 2,-0.1 3,-0.3 3,-0.0 0, 0.0 0.493 360.0-101.1 70.6 0.1 16.8 21.3 9.5 3 321 A K - 0 0 143 1,-0.2 0, 0.0 2,-0.1 0, 0.0 0.632 19.3-112.9 57.1 134.6 19.1 18.2 9.5 4 322 A P S S+ 0 0 89 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.065 80.5 121.4 -82.2 23.1 17.9 14.9 8.0 5 323 A L + 0 0 142 -3,-0.3 3,-0.1 3,-0.0 -2,-0.1 -0.061 38.4 119.8 -81.8 41.0 18.0 13.4 11.6 6 324 A D S S- 0 0 85 -2,-0.9 3,-0.1 1,-0.2 -3,-0.0 0.372 78.3 -23.9 -78.1-139.4 14.3 12.5 11.5 7 325 A G S S- 0 0 20 1,-0.1 -1,-0.2 95,-0.0 95,-0.1 -0.321 90.4 -81.1 -68.0 156.3 13.2 8.9 11.9 8 326 A E - 0 0 130 93,-0.1 94,-1.7 -3,-0.1 2,-0.2 -0.260 50.5-124.9 -56.4 143.3 15.9 6.3 11.0 9 327 A Y E +A 101 0A 86 92,-0.2 2,-0.2 -3,-0.1 92,-0.2 -0.621 33.5 175.9 -91.3 152.5 16.0 5.7 7.2 10 328 A F E -A 100 0A 51 90,-0.7 90,-0.8 -2,-0.2 2,-0.3 -0.711 16.5-137.4-138.9-169.0 15.6 2.3 5.7 11 329 A T E -A 99 0A 89 88,-0.3 2,-0.3 -2,-0.2 88,-0.2 -0.990 6.4-161.3-153.3 159.0 15.4 0.6 2.3 12 330 A L E -A 98 0A 17 86,-1.1 86,-1.1 -2,-0.3 2,-0.4 -0.973 18.0-132.9-148.4 131.2 13.4 -2.2 0.5 13 331 A Q E -A 97 0A 114 -2,-0.3 2,-0.5 84,-0.2 84,-0.3 -0.687 22.1-169.2 -84.9 130.2 14.1 -4.2 -2.6 14 332 A I E -A 96 0A 0 82,-0.8 82,-0.7 -2,-0.4 6,-0.2 -0.930 12.1-145.0-123.5 112.1 11.1 -4.4 -5.0 15 333 A R E +A 95 0A 85 -2,-0.5 80,-0.2 80,-0.2 79,-0.1 -0.435 67.1 47.3 -71.8 146.4 11.3 -6.8 -7.9 16 334 A G S > S- 0 0 14 78,-1.7 4,-1.0 3,-0.1 5,-0.1 0.246 72.5-126.2 97.2 135.6 9.6 -5.6 -11.2 17 335 A R H > S+ 0 0 166 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.950 108.1 42.9 -81.4 -53.2 10.0 -2.2 -12.8 18 336 A E H > S+ 0 0 171 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.939 116.2 49.7 -58.9 -45.6 6.3 -1.2 -13.1 19 337 A R H > S+ 0 0 49 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 105.2 58.6 -61.4 -41.4 5.6 -2.5 -9.5 20 338 A F H X S+ 0 0 32 -4,-1.0 4,-2.4 1,-0.2 5,-0.3 0.969 103.1 50.9 -53.6 -55.2 8.6 -0.5 -8.2 21 339 A E H X S+ 0 0 98 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.880 107.4 56.7 -51.4 -36.7 7.2 2.8 -9.4 22 340 A M H X S+ 0 0 36 -4,-1.4 4,-1.7 -5,-0.2 -1,-0.2 0.959 108.0 45.0 -62.7 -49.1 3.9 1.8 -7.7 23 341 A F H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 3,-0.4 0.977 111.3 52.3 -60.0 -53.6 5.6 1.4 -4.3 24 342 A R H X S+ 0 0 115 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.886 105.3 58.1 -50.9 -38.1 7.6 4.6 -4.6 25 343 A E H X S+ 0 0 85 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.952 105.1 48.0 -60.2 -47.3 4.3 6.4 -5.3 26 344 A L H X S+ 0 0 3 -4,-1.7 4,-2.2 -3,-0.4 5,-0.2 0.921 110.0 54.3 -60.8 -40.1 2.8 5.3 -2.0 27 345 A N H X S+ 0 0 10 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.967 109.1 46.0 -59.0 -52.1 5.9 6.4 -0.2 28 346 A E H X S+ 0 0 109 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.869 108.7 59.3 -60.8 -32.9 5.8 10.0 -1.7 29 347 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.971 107.8 42.9 -61.2 -51.8 2.0 10.0 -0.9 30 348 A L H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.924 111.9 54.9 -61.7 -41.6 2.6 9.5 2.9 31 349 A E H X S+ 0 0 93 -4,-2.3 4,-1.4 -5,-0.2 -1,-0.2 0.891 105.4 54.1 -60.2 -36.1 5.5 12.0 2.8 32 350 A L H X S+ 0 0 40 -4,-2.1 4,-1.5 -5,-0.2 3,-0.4 0.945 107.8 48.4 -64.9 -45.1 3.2 14.6 1.3 33 351 A K H X S+ 0 0 42 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.922 106.8 57.2 -61.8 -40.5 0.7 14.2 4.1 34 352 A D H X S+ 0 0 71 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.856 101.2 58.3 -59.3 -32.2 3.5 14.5 6.7 35 353 A A H < S+ 0 0 71 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.943 113.4 36.1 -65.3 -44.3 4.3 17.9 5.1 36 354 A Q H >< S+ 0 0 96 -4,-1.5 3,-0.5 1,-0.2 -1,-0.2 0.655 111.7 64.6 -82.7 -12.4 0.8 19.2 5.8 37 355 A A H 3< S+ 0 0 74 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.918 104.1 43.5 -75.2 -42.1 0.8 17.3 9.1 38 356 A G T 3< S+ 0 0 69 -4,-2.1 2,-0.7 -5,-0.2 -1,-0.2 0.287 88.2 119.3 -85.2 13.9 3.6 19.3 10.6 39 357 A K S < S- 0 0 150 -3,-0.5 -3,-0.1 -5,-0.1 -4,-0.0 -0.691 76.9-111.7 -82.9 115.6 2.0 22.5 9.2 40 358 A E - 0 0 171 -2,-0.7 -2,-0.1 2,-0.1 -1,-0.1 -0.173 33.9-126.5 -46.4 133.4 1.2 24.7 12.2 41 359 A P 0 0 108 0, 0.0 -1,-0.0 0, 0.0 -3,-0.0 0.416 360.0 360.0 -61.7-152.3 -2.6 24.9 12.7 42 360 A G 0 0 154 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.936 360.0 360.0 58.7 360.0 -4.4 28.3 12.8 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 44 319 B K 0 0 205 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 27.5 -19.2 22.8 -5.9 45 320 B K - 0 0 163 2,-0.1 3,-0.3 3,-0.0 0, 0.0 0.492 360.0-101.1 70.6 0.2 -17.2 21.7 -9.0 46 321 B K - 0 0 142 1,-0.2 0, 0.0 2,-0.1 0, 0.0 0.631 19.3-112.8 57.1 134.6 -19.6 18.7 -9.1 47 322 B P S S+ 0 0 89 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.064 80.4 121.5 -82.1 22.9 -18.4 15.3 -7.8 48 323 B L + 0 0 142 -3,-0.3 3,-0.1 3,-0.0 -2,-0.1 -0.062 38.4 119.8 -81.6 40.9 -18.5 14.0 -11.4 49 324 B D S S- 0 0 83 -2,-0.9 3,-0.1 1,-0.2 -3,-0.0 0.369 78.2 -23.9 -78.0-139.6 -14.8 13.0 -11.4 50 325 B G S S- 0 0 20 1,-0.1 -1,-0.2 95,-0.0 95,-0.1 -0.317 90.4 -81.1 -67.8 156.4 -13.7 9.4 -11.9 51 326 B E - 0 0 130 93,-0.1 94,-1.7 -3,-0.1 2,-0.2 -0.260 50.5-124.8 -56.5 143.3 -16.4 6.8 -11.1 52 327 B Y E +B 144 0B 92 92,-0.2 2,-0.2 -3,-0.1 92,-0.2 -0.621 33.5 175.9 -91.4 152.5 -16.5 6.1 -7.4 53 328 B F E -B 143 0B 52 90,-0.7 90,-0.8 -2,-0.2 2,-0.3 -0.711 16.5-137.3-138.9-168.9 -16.1 2.5 -6.0 54 329 B T E -B 142 0B 89 88,-0.3 2,-0.3 -2,-0.2 88,-0.2 -0.990 6.4-161.3-153.4 158.8 -15.9 0.7 -2.7 55 330 B L E -B 141 0B 17 86,-1.1 86,-1.1 -2,-0.3 2,-0.4 -0.973 18.0-132.9-148.3 131.3 -13.8 -2.1 -1.1 56 331 B Q E -B 140 0B 116 -2,-0.3 2,-0.5 84,-0.2 84,-0.3 -0.687 22.1-169.2 -84.9 130.3 -14.5 -4.3 2.0 57 332 B I E -B 139 0B 0 82,-0.8 82,-0.7 -2,-0.4 6,-0.2 -0.930 12.1-145.0-123.6 112.0 -11.5 -4.6 4.4 58 333 B R E +B 138 0B 85 -2,-0.5 80,-0.2 80,-0.2 79,-0.1 -0.434 67.1 47.3 -71.8 146.4 -11.7 -7.1 7.2 59 334 B G S > S- 0 0 13 78,-1.7 4,-1.0 3,-0.1 5,-0.1 0.247 72.5-126.2 97.1 135.7 -10.0 -6.1 10.4 60 335 B R H > S+ 0 0 167 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.950 108.1 42.9 -81.4 -53.3 -10.4 -2.7 12.3 61 336 B E H > S+ 0 0 175 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.939 116.1 49.7 -58.9 -45.5 -6.7 -1.8 12.6 62 337 B R H > S+ 0 0 49 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 105.2 58.6 -61.5 -41.3 -6.0 -2.9 9.0 63 338 B F H X S+ 0 0 32 -4,-1.0 4,-2.4 1,-0.2 5,-0.3 0.969 103.1 50.9 -53.6 -55.2 -9.0 -0.9 7.7 64 339 B E H X S+ 0 0 98 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.880 107.5 56.6 -51.4 -36.8 -7.6 2.4 9.1 65 340 B M H X S+ 0 0 35 -4,-1.4 4,-1.7 -5,-0.2 -1,-0.2 0.958 108.0 45.0 -62.8 -49.0 -4.3 1.5 7.3 66 341 B F H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 3,-0.4 0.977 111.3 52.3 -60.1 -53.6 -6.0 1.2 3.8 67 342 B R H X S+ 0 0 115 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.887 105.3 58.1 -50.9 -38.1 -8.0 4.4 4.3 68 343 B E H X S+ 0 0 84 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.952 105.1 48.0 -60.2 -47.3 -4.8 6.2 5.1 69 344 B L H X S+ 0 0 2 -4,-1.7 4,-2.2 -3,-0.4 5,-0.2 0.921 110.0 54.3 -60.8 -40.1 -3.2 5.2 1.8 70 345 B N H X S+ 0 0 11 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.967 109.1 46.0 -59.1 -52.0 -6.4 6.4 0.0 71 346 B E H X S+ 0 0 106 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.868 108.7 59.3 -60.9 -32.7 -6.2 9.9 1.6 72 347 B A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.971 107.7 43.0 -61.3 -51.6 -2.5 10.0 0.8 73 348 B L H X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.925 111.9 54.9 -61.8 -41.6 -3.1 9.7 -2.9 74 349 B E H X S+ 0 0 93 -4,-2.3 4,-1.4 -5,-0.2 -1,-0.2 0.891 105.4 54.1 -60.1 -36.1 -6.0 12.1 -2.8 75 350 B L H X S+ 0 0 40 -4,-2.1 4,-1.5 -5,-0.2 3,-0.4 0.944 107.8 48.4 -65.0 -45.0 -3.6 14.7 -1.2 76 351 B K H X S+ 0 0 41 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.923 106.8 57.2 -61.8 -40.6 -1.1 14.4 -4.0 77 352 B D H X S+ 0 0 68 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.856 101.2 58.3 -59.2 -32.2 -3.9 14.8 -6.5 78 353 B A H < S+ 0 0 73 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.942 113.5 36.1 -65.3 -44.3 -4.7 18.1 -4.8 79 354 B Q H >< S+ 0 0 96 -4,-1.5 3,-0.5 1,-0.2 -1,-0.2 0.655 111.7 64.6 -82.6 -12.5 -1.2 19.5 -5.5 80 355 B A H 3< S+ 0 0 75 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.918 104.2 43.5 -75.2 -42.1 -1.2 17.7 -8.8 81 356 B G T 3< S+ 0 0 70 -4,-2.1 2,-0.7 -5,-0.2 -1,-0.2 0.287 88.2 119.3 -85.2 13.9 -4.1 19.7 -10.2 82 357 B K S < S- 0 0 152 -3,-0.5 -3,-0.1 -5,-0.1 -4,-0.0 -0.690 76.9-111.7 -82.9 115.6 -2.4 22.8 -8.7 83 358 B E - 0 0 171 -2,-0.7 -2,-0.1 2,-0.1 -1,-0.1 -0.174 33.9-126.5 -46.4 133.4 -1.6 25.2 -11.6 84 359 B P 0 0 108 0, 0.0 -1,-0.0 0, 0.0 -3,-0.0 0.418 360.0 360.0 -61.8-152.3 2.2 25.4 -12.1 85 360 B G 0 0 153 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.936 360.0 360.0 58.7 360.0 3.9 28.8 -12.1 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 87 319 C K 0 0 207 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 27.5 18.1 -22.3 -8.7 88 320 C K - 0 0 161 2,-0.1 3,-0.3 3,-0.0 0, 0.0 0.493 360.0-101.1 70.6 0.1 15.8 -21.1 -11.5 89 321 C K - 0 0 145 1,-0.2 0, 0.0 2,-0.1 0, 0.0 0.631 19.3-112.9 57.2 134.6 18.1 -18.0 -11.7 90 322 C P S S+ 0 0 86 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.064 80.4 121.5 -82.2 23.0 17.1 -14.7 -10.2 91 323 C L + 0 0 142 -3,-0.3 3,-0.1 3,-0.0 -2,-0.1 -0.062 38.4 119.8 -81.6 41.0 16.8 -13.2 -13.7 92 324 C D S S- 0 0 87 -2,-0.9 3,-0.1 1,-0.2 -3,-0.0 0.370 78.2 -24.0 -78.0-139.4 13.1 -12.3 -13.3 93 325 C G S S- 0 0 21 1,-0.1 -1,-0.2 -77,-0.0 -77,-0.1 -0.320 90.4 -81.1 -68.0 156.4 12.0 -8.7 -13.6 94 326 C E - 0 0 136 -79,-0.1 -78,-1.7 -3,-0.1 2,-0.2 -0.260 50.5-124.8 -56.5 143.3 14.8 -6.1 -12.9 95 327 C Y E +A 15 0A 86 -80,-0.2 2,-0.2 -3,-0.1 -80,-0.2 -0.621 33.5 175.8 -91.3 152.5 15.3 -5.5 -9.2 96 328 C F E -A 14 0A 53 -82,-0.7 -82,-0.8 -2,-0.2 2,-0.3 -0.710 16.5-137.4-138.9-168.9 15.0 -2.1 -7.6 97 329 C T E -A 13 0A 88 -84,-0.3 2,-0.3 -2,-0.2 -84,-0.2 -0.990 6.4-161.3-153.4 158.9 15.1 -0.4 -4.2 98 330 C L E -A 12 0A 17 -86,-1.1 -86,-1.1 -2,-0.3 2,-0.4 -0.973 18.0-132.8-148.3 131.3 13.2 2.4 -2.3 99 331 C Q E -A 11 0A 115 -2,-0.3 2,-0.5 -88,-0.2 -88,-0.3 -0.686 22.1-169.2 -85.0 130.3 14.2 4.4 0.8 100 332 C I E -A 10 0A 0 -90,-0.8 -90,-0.7 -2,-0.4 6,-0.2 -0.929 12.1-145.0-123.5 112.1 11.5 4.6 3.5 101 333 C R E +A 9 0A 82 -2,-0.5 -92,-0.2 -92,-0.2 -93,-0.1 -0.435 67.1 47.4 -71.9 146.5 11.9 7.0 6.3 102 334 C G S > S- 0 0 14 -94,-1.7 4,-1.0 3,-0.1 5,-0.1 0.247 72.5-126.2 97.1 135.7 10.6 5.8 9.7 103 335 C R H > S+ 0 0 166 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.950 108.1 42.9 -81.3 -53.3 11.1 2.4 11.3 104 336 C E H > S+ 0 0 171 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.939 116.1 49.7 -58.8 -45.6 7.5 1.4 11.9 105 337 C R H > S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 105.2 58.6 -61.5 -41.4 6.4 2.7 8.5 106 338 C F H X S+ 0 0 31 -4,-1.0 4,-2.4 1,-0.2 5,-0.3 0.969 103.1 50.9 -53.5 -55.3 9.3 0.7 6.8 107 339 C E H X S+ 0 0 95 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.881 107.5 56.7 -51.4 -36.7 8.0 -2.6 8.2 108 340 C M H X S+ 0 0 34 -4,-1.4 4,-1.7 -5,-0.2 -1,-0.2 0.959 108.0 45.0 -62.8 -49.0 4.6 -1.6 6.8 109 341 C F H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 3,-0.4 0.976 111.2 52.3 -60.2 -53.5 5.9 -1.2 3.2 110 342 C R H X S+ 0 0 118 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.886 105.4 58.1 -51.0 -38.0 8.0 -4.4 3.3 111 343 C E H X S+ 0 0 85 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.952 105.1 48.0 -60.2 -47.3 4.8 -6.2 4.4 112 344 C L H X S+ 0 0 2 -4,-1.7 4,-2.2 -3,-0.4 5,-0.2 0.921 110.0 54.3 -60.9 -40.0 2.9 -5.1 1.3 113 345 C N H X S+ 0 0 12 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.967 109.0 45.9 -59.1 -52.1 5.9 -6.2 -0.9 114 346 C E H X S+ 0 0 107 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.869 108.7 59.3 -60.9 -32.7 5.9 -9.8 0.6 115 347 C A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.971 107.7 43.0 -61.3 -51.7 2.1 -9.8 0.2 116 348 C L H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.924 111.9 54.9 -61.7 -41.7 2.3 -9.3 -3.6 117 349 C E H X S+ 0 0 94 -4,-2.3 4,-1.4 -5,-0.2 -1,-0.2 0.891 105.4 54.1 -60.1 -36.2 5.2 -11.8 -3.8 118 350 C L H X S+ 0 0 38 -4,-2.1 4,-1.5 -5,-0.2 3,-0.4 0.944 107.8 48.4 -64.8 -45.2 3.0 -14.4 -2.1 119 351 C K H X S+ 0 0 40 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.923 106.8 57.3 -61.8 -40.5 0.2 -14.0 -4.7 120 352 C D H X S+ 0 0 72 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.856 101.2 58.3 -59.3 -32.2 2.8 -14.3 -7.5 121 353 C A H < S+ 0 0 71 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.943 113.5 36.1 -65.3 -44.3 3.8 -17.7 -6.0 122 354 C Q H >< S+ 0 0 96 -4,-1.5 3,-0.5 1,-0.2 -1,-0.2 0.655 111.7 64.6 -82.8 -12.4 0.2 -19.0 -6.4 123 355 C A H 3< S+ 0 0 75 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.918 104.2 43.5 -75.3 -42.0 -0.1 -17.1 -9.6 124 356 C G T 3< S+ 0 0 72 -4,-2.1 2,-0.7 -5,-0.2 -1,-0.2 0.287 88.2 119.3 -85.3 13.8 2.6 -19.1 -11.4 125 357 C K S < S- 0 0 149 -3,-0.5 -3,-0.1 -5,-0.1 -4,-0.0 -0.690 76.9-111.7 -82.9 115.5 1.1 -22.3 -9.9 126 358 C E - 0 0 170 -2,-0.7 -2,-0.1 2,-0.1 -1,-0.1 -0.175 33.9-126.5 -46.3 133.5 -0.0 -24.5 -12.8 127 359 C P 0 0 107 0, 0.0 -1,-0.0 0, 0.0 -3,-0.0 0.417 360.0 360.0 -61.9-152.3 -3.8 -24.7 -12.9 128 360 C G 0 0 150 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.936 360.0 360.0 58.7 360.0 -5.6 -28.1 -12.9 129 !* 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 0.0 130 319 D K 0 0 205 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 27.4 -18.6 -22.6 7.3 131 320 D K - 0 0 159 2,-0.1 3,-0.3 3,-0.0 0, 0.0 0.493 360.0-101.1 70.7 0.1 -16.3 -21.5 10.1 132 321 D K - 0 0 145 1,-0.2 0, 0.0 2,-0.1 0, 0.0 0.630 19.3-112.9 57.1 134.5 -18.6 -18.5 10.5 133 322 D P S S+ 0 0 89 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.063 80.4 121.5 -82.1 23.0 -17.5 -15.1 9.1 134 323 D L + 0 0 143 -3,-0.3 3,-0.1 3,-0.0 -2,-0.1 -0.063 38.4 119.8 -81.6 40.9 -17.3 -13.8 12.7 135 324 D D S S- 0 0 86 -2,-0.9 3,-0.1 1,-0.2 -3,-0.0 0.370 78.2 -24.0 -77.9-139.4 -13.6 -12.9 12.3 136 325 D G S S- 0 0 20 1,-0.1 -1,-0.2 -77,-0.0 -77,-0.1 -0.320 90.4 -81.1 -68.1 156.4 -12.5 -9.2 12.7 137 326 D E - 0 0 133 -79,-0.1 -78,-1.7 -3,-0.1 2,-0.2 -0.259 50.5-124.8 -56.5 143.3 -15.2 -6.6 12.2 138 327 D Y E +B 58 0B 88 -80,-0.2 2,-0.2 -3,-0.1 -80,-0.2 -0.620 33.5 175.8 -91.3 152.5 -15.7 -5.9 8.5 139 328 D F E -B 57 0B 52 -82,-0.7 -82,-0.8 -2,-0.2 2,-0.3 -0.710 16.5-137.4-138.9-169.0 -15.5 -2.3 7.1 140 329 D T E -B 56 0B 88 -84,-0.3 2,-0.3 -2,-0.2 -84,-0.2 -0.990 6.4-161.3-153.4 159.0 -15.6 -0.5 3.7 141 330 D L E -B 55 0B 18 -86,-1.1 -86,-1.1 -2,-0.3 2,-0.4 -0.973 18.0-132.8-148.4 131.4 -13.7 2.3 1.9 142 331 D Q E -B 54 0B 113 -2,-0.3 2,-0.5 -88,-0.2 -88,-0.3 -0.686 22.1-169.2 -85.1 130.3 -14.7 4.4 -1.1 143 332 D I E -B 53 0B 0 -90,-0.8 -90,-0.7 -2,-0.4 6,-0.2 -0.930 12.1-145.0-123.6 112.1 -12.0 4.7 -3.7 144 333 D R E +B 52 0B 84 -2,-0.5 -92,-0.2 -92,-0.2 -93,-0.1 -0.435 67.1 47.3 -71.8 146.5 -12.4 7.3 -6.5 145 334 D G S > S- 0 0 13 -94,-1.7 4,-1.0 3,-0.1 5,-0.1 0.245 72.5-126.2 97.1 135.7 -11.0 6.3 -9.9 146 335 D R H > S+ 0 0 167 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.950 108.1 42.9 -81.3 -53.2 -11.6 2.9 -11.7 147 336 D E H > S+ 0 0 172 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.940 116.2 49.7 -58.9 -45.5 -7.9 2.0 -12.3 148 337 D R H > S+ 0 0 49 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 105.2 58.6 -61.5 -41.3 -6.9 3.1 -8.8 149 338 D F H X S+ 0 0 30 -4,-1.0 4,-2.4 1,-0.2 5,-0.3 0.969 103.1 51.0 -53.6 -55.2 -9.8 1.1 -7.3 150 339 D E H X S+ 0 0 96 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.880 107.5 56.7 -51.4 -36.8 -8.5 -2.2 -8.8 151 340 D M H X S+ 0 0 34 -4,-1.4 4,-1.7 -5,-0.2 -1,-0.2 0.959 108.0 45.0 -62.7 -49.0 -5.1 -1.3 -7.3 152 341 D F H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 3,-0.4 0.977 111.2 52.3 -60.1 -53.5 -6.4 -1.0 -3.7 153 342 D R H X S+ 0 0 115 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.886 105.4 58.1 -50.9 -38.1 -8.5 -4.2 -4.0 154 343 D E H X S+ 0 0 86 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.952 105.1 48.0 -60.2 -47.3 -5.3 -6.0 -5.1 155 344 D L H X S+ 0 0 3 -4,-1.7 4,-2.2 -3,-0.4 5,-0.2 0.921 110.0 54.3 -60.9 -40.0 -3.4 -5.0 -2.0 156 345 D N H X S+ 0 0 12 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.967 109.0 46.0 -59.1 -52.0 -6.3 -6.2 0.1 157 346 D E H X S+ 0 0 109 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.869 108.6 59.3 -60.9 -32.7 -6.4 -9.7 -1.5 158 347 D A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.970 107.8 42.9 -61.2 -51.8 -2.6 -9.8 -1.1 159 348 D L H X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.924 111.9 54.9 -61.6 -41.7 -2.8 -9.5 2.7 160 349 D E H X S+ 0 0 93 -4,-2.3 4,-1.4 -5,-0.2 -1,-0.2 0.891 105.4 54.1 -60.1 -36.1 -5.7 -11.9 2.8 161 350 D L H X S+ 0 0 40 -4,-2.1 4,-1.5 -5,-0.2 3,-0.4 0.944 107.8 48.4 -64.9 -45.1 -3.5 -14.5 1.0 162 351 D K H X S+ 0 0 40 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.922 106.8 57.3 -61.8 -40.6 -0.7 -14.2 3.6 163 352 D D H X S+ 0 0 72 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.856 101.2 58.3 -59.2 -32.2 -3.3 -14.6 6.4 164 353 D A H < S+ 0 0 72 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.943 113.4 36.1 -65.4 -44.3 -4.3 -17.9 4.8 165 354 D Q H >< S+ 0 0 94 -4,-1.5 3,-0.5 1,-0.2 -1,-0.2 0.655 111.7 64.6 -82.7 -12.3 -0.7 -19.3 5.1 166 355 D A H 3< S+ 0 0 75 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.918 104.1 43.5 -75.2 -42.0 -0.4 -17.5 8.4 167 356 D G T 3< S+ 0 0 72 -4,-2.1 2,-0.7 -5,-0.2 -1,-0.2 0.287 88.2 119.3 -85.2 13.9 -3.1 -19.6 10.1 168 357 D K S < S- 0 0 153 -3,-0.5 -3,-0.1 -5,-0.1 -4,-0.0 -0.691 76.9-111.7 -82.9 115.6 -1.6 -22.7 8.4 169 358 D E - 0 0 171 -2,-0.7 -2,-0.1 2,-0.1 -1,-0.1 -0.174 33.9-126.5 -46.4 133.5 -0.5 -25.0 11.2 170 359 D P 0 0 107 0, 0.0 -1,-0.0 0, 0.0 -3,-0.0 0.417 360.0 360.0 -61.9-152.4 3.3 -25.2 11.3 171 360 D G 0 0 151 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.936 360.0 360.0 58.9 360.0 5.1 -28.6 11.1