==== 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 1SAK . 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) . 13953.0 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 0 222 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 17.7 16.7 21.8 5.9 2 320 A K + 0 0 148 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.645 360.0 12.1 -88.7 145.5 18.6 21.2 9.2 3 321 A K - 0 0 153 -2,-0.3 -1,-0.2 1,-0.1 0, 0.0 0.976 51.2-162.2 58.9 89.9 19.2 17.7 10.6 4 322 A P + 0 0 91 0, 0.0 2,-1.6 0, 0.0 -1,-0.1 0.346 67.5 110.3 -77.1 8.6 18.4 15.0 8.1 5 323 A L + 0 0 143 3,-0.0 3,-0.1 1,-0.0 -2,-0.0 -0.185 41.2 126.7 -79.3 47.9 18.4 13.0 11.4 6 324 A D S S- 0 0 83 -2,-1.6 3,-0.1 1,-0.3 2,-0.0 0.476 74.5 -15.3 -76.8-131.5 14.6 12.5 11.3 7 325 A G S S- 0 0 20 1,-0.1 -1,-0.3 95,-0.0 95,-0.1 -0.384 93.3 -85.8 -68.8 150.9 13.3 8.9 11.6 8 326 A E - 0 0 134 93,-0.1 94,-1.2 -3,-0.1 2,-0.2 -0.278 49.8-126.8 -56.1 139.8 16.0 6.2 11.0 9 327 A Y E +A 101 0A 86 92,-0.2 2,-0.2 -3,-0.1 92,-0.2 -0.603 30.5 179.2 -90.9 153.6 16.3 5.6 7.2 10 328 A F E -A 100 0A 54 90,-0.9 90,-1.6 -2,-0.2 2,-0.3 -0.831 17.5-134.1-140.6 179.0 16.1 2.1 5.7 11 329 A T E -A 99 0A 104 -2,-0.2 2,-0.4 88,-0.2 88,-0.2 -0.985 12.5-167.4-140.3 149.7 16.2 0.4 2.2 12 330 A L E -A 98 0A 22 86,-1.4 86,-1.4 -2,-0.3 2,-0.4 -0.988 19.3-132.5-141.9 132.1 14.0 -2.2 0.5 13 331 A Q E -A 97 0A 117 -2,-0.4 2,-0.5 84,-0.2 84,-0.2 -0.678 22.9-166.8 -83.8 130.9 14.6 -4.2 -2.7 14 332 A I E -A 96 0A 0 82,-1.6 82,-0.9 -2,-0.4 6,-0.1 -0.939 9.6-146.4-123.2 113.5 11.5 -4.2 -5.0 15 333 A R E +A 95 0A 98 -2,-0.5 80,-0.2 80,-0.2 79,-0.1 -0.422 65.9 39.8 -73.4 151.2 11.4 -6.7 -7.9 16 334 A G S > S- 0 0 17 78,-1.2 4,-0.9 3,-0.1 80,-0.1 0.325 72.3-124.7 86.3 139.7 9.6 -5.5 -11.1 17 335 A R H > S+ 0 0 162 2,-0.2 4,-2.1 3,-0.1 5,-0.2 0.913 109.0 49.6 -85.1 -47.4 9.8 -2.0 -12.6 18 336 A E H > S+ 0 0 170 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.927 111.8 50.6 -58.2 -42.0 6.1 -1.3 -12.8 19 337 A R H > S+ 0 0 47 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.920 105.9 56.8 -63.2 -41.0 5.8 -2.4 -9.1 20 338 A F H X S+ 0 0 36 -4,-0.9 4,-2.9 1,-0.2 5,-0.3 0.975 105.0 49.3 -55.3 -57.0 8.7 -0.0 -8.2 21 339 A E H X S+ 0 0 97 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.890 110.4 54.1 -51.6 -38.3 7.0 3.1 -9.6 22 340 A M H X S+ 0 0 35 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.968 110.2 43.5 -63.5 -51.5 3.8 2.0 -7.6 23 341 A F H X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.953 110.1 56.7 -61.0 -46.2 5.6 1.8 -4.3 24 342 A R H X S+ 0 0 110 -4,-2.9 4,-2.8 -5,-0.2 5,-0.3 0.919 105.7 53.0 -51.7 -42.6 7.5 5.0 -4.9 25 343 A E H X S+ 0 0 80 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.2 0.971 109.8 45.0 -60.0 -53.0 4.1 6.8 -5.4 26 344 A L H X S+ 0 0 3 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.915 112.5 54.4 -59.6 -37.7 2.7 5.6 -2.1 27 345 A N H X S+ 0 0 6 -4,-2.9 4,-2.5 -5,-0.2 5,-0.2 0.983 111.4 42.1 -60.0 -55.1 6.0 6.5 -0.4 28 346 A E H X S+ 0 0 99 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.879 110.6 60.6 -60.5 -33.7 5.9 10.1 -1.7 29 347 A A H X S+ 0 0 1 -4,-2.7 4,-2.1 -5,-0.3 5,-0.2 0.975 108.6 40.5 -58.9 -53.8 2.2 10.1 -0.9 30 348 A L H X S+ 0 0 2 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.946 114.5 52.8 -61.8 -45.1 2.8 9.5 2.9 31 349 A E H X S+ 0 0 92 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.884 107.1 55.0 -58.6 -34.3 5.8 11.9 2.8 32 350 A L H X S+ 0 0 43 -4,-2.4 4,-1.5 -5,-0.2 3,-0.2 0.964 110.9 42.2 -64.8 -49.8 3.4 14.5 1.3 33 351 A K H X S+ 0 0 48 -4,-2.1 4,-2.2 1,-0.2 3,-0.2 0.936 110.2 57.9 -63.2 -43.1 0.9 14.2 4.1 34 352 A D H X S+ 0 0 68 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.868 102.8 55.9 -55.9 -33.5 3.7 14.2 6.7 35 353 A A H < S+ 0 0 74 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.931 113.9 37.6 -67.0 -42.4 4.8 17.5 5.2 36 354 A Q H >< S+ 0 0 89 -4,-1.5 3,-1.0 -3,-0.2 -2,-0.2 0.679 109.2 66.1 -82.7 -14.3 1.4 19.1 5.9 37 355 A A H 3< S+ 0 0 73 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.927 97.4 52.2 -71.8 -41.5 1.1 17.1 9.1 38 356 A G T 3< S+ 0 0 67 -4,-1.8 2,-0.7 -5,-0.2 -1,-0.3 0.229 83.4 125.1 -78.3 20.1 4.0 19.1 10.7 39 357 A K S < S- 0 0 150 -3,-1.0 3,-0.1 -5,-0.1 -3,-0.1 -0.694 70.0-117.0 -83.1 117.0 2.1 22.2 9.7 40 358 A E - 0 0 166 -2,-0.7 2,-0.3 1,-0.2 -1,-0.1 -0.167 42.2 -88.2 -49.1 147.6 1.6 24.4 12.8 41 359 A P 0 0 124 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.413 360.0 360.0 -60.9 119.2 -2.1 24.9 13.6 42 360 A G 0 0 145 -2,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.874 360.0 360.0 -46.6 360.0 -3.2 27.9 11.6 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 0 222 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 17.7 -17.1 22.1 -5.4 45 320 B K + 0 0 147 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.645 360.0 12.0 -88.6 145.5 -19.0 21.6 -8.7 46 321 B K - 0 0 153 -2,-0.3 -1,-0.2 1,-0.1 0, 0.0 0.976 51.2-162.2 58.9 90.0 -19.6 18.2 -10.4 47 322 B P + 0 0 92 0, 0.0 2,-1.6 0, 0.0 -1,-0.1 0.346 67.5 110.3 -77.1 8.7 -18.8 15.4 -8.0 48 323 B L + 0 0 143 3,-0.0 3,-0.1 1,-0.0 -2,-0.0 -0.185 41.2 126.7 -79.4 47.8 -18.8 13.5 -11.3 49 324 B D S S- 0 0 83 -2,-1.6 3,-0.1 1,-0.3 2,-0.0 0.475 74.5 -15.3 -76.8-131.5 -15.0 13.0 -11.2 50 325 B G S S- 0 0 19 1,-0.1 -1,-0.3 95,-0.0 95,-0.1 -0.384 93.3 -85.8 -68.8 151.0 -13.7 9.4 -11.7 51 326 B E - 0 0 137 93,-0.1 94,-1.2 -3,-0.1 2,-0.2 -0.277 49.8-126.8 -56.2 139.9 -16.4 6.7 -11.2 52 327 B Y E +B 144 0B 85 92,-0.2 2,-0.3 -3,-0.1 92,-0.2 -0.603 30.5 179.2 -90.9 153.6 -16.7 5.9 -7.5 53 328 B F E -B 143 0B 53 90,-0.9 90,-1.6 -2,-0.2 2,-0.3 -0.832 17.5-134.1-140.5 179.0 -16.5 2.3 -6.1 54 329 B T E -B 142 0B 102 -2,-0.3 2,-0.4 88,-0.2 88,-0.2 -0.985 12.5-167.4-140.4 149.7 -16.6 0.6 -2.7 55 330 B L E -B 141 0B 22 86,-1.4 86,-1.4 -2,-0.3 2,-0.4 -0.989 19.3-132.6-141.9 132.1 -14.5 -2.1 -1.1 56 331 B Q E -B 140 0B 117 -2,-0.4 2,-0.5 84,-0.2 84,-0.2 -0.679 22.9-166.8 -83.9 130.9 -15.1 -4.3 2.0 57 332 B I E -B 139 0B 0 82,-1.6 82,-0.9 -2,-0.4 6,-0.1 -0.939 9.6-146.4-123.2 113.5 -12.0 -4.4 4.3 58 333 B R E +B 138 0B 98 -2,-0.5 80,-0.2 80,-0.2 79,-0.1 -0.423 65.9 39.8 -73.3 151.1 -11.9 -7.0 7.1 59 334 B G S > S- 0 0 18 78,-1.2 4,-0.9 3,-0.1 80,-0.1 0.324 72.3-124.7 86.3 139.6 -10.1 -6.0 10.4 60 335 B R H > S+ 0 0 160 2,-0.2 4,-2.1 3,-0.1 5,-0.2 0.913 109.0 49.6 -85.0 -47.4 -10.3 -2.6 12.1 61 336 B E H > S+ 0 0 170 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.927 111.8 50.6 -58.1 -42.1 -6.6 -1.9 12.2 62 337 B R H > S+ 0 0 47 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.919 105.9 56.8 -63.2 -41.1 -6.3 -2.8 8.5 63 338 B F H X S+ 0 0 38 -4,-0.9 4,-2.9 1,-0.2 5,-0.3 0.975 105.0 49.3 -55.3 -57.0 -9.2 -0.4 7.7 64 339 B E H X S+ 0 0 97 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.890 110.4 54.1 -51.5 -38.4 -7.4 2.7 9.3 65 340 B M H X S+ 0 0 35 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.968 110.2 43.5 -63.5 -51.5 -4.3 1.7 7.3 66 341 B F H X S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.953 110.1 56.7 -61.0 -46.1 -6.1 1.6 3.9 67 342 B R H X S+ 0 0 114 -4,-2.9 4,-2.8 -5,-0.2 5,-0.3 0.920 105.7 53.0 -51.7 -42.6 -8.0 4.8 4.7 68 343 B E H X S+ 0 0 81 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.2 0.971 109.8 45.0 -60.0 -53.0 -4.6 6.5 5.2 69 344 B L H X S+ 0 0 4 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.915 112.5 54.4 -59.6 -37.7 -3.2 5.5 1.8 70 345 B N H X S+ 0 0 7 -4,-2.9 4,-2.5 -5,-0.2 5,-0.2 0.983 111.4 42.1 -59.9 -55.1 -6.5 6.5 0.3 71 346 B E H X S+ 0 0 101 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.880 110.6 60.6 -60.5 -33.8 -6.3 10.0 1.7 72 347 B A H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.3 5,-0.2 0.975 108.6 40.5 -58.8 -53.8 -2.6 10.1 0.9 73 348 B L H X S+ 0 0 2 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.946 114.5 52.7 -61.8 -44.9 -3.3 9.7 -2.9 74 349 B E H X S+ 0 0 93 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.884 107.1 55.0 -58.8 -34.1 -6.2 12.0 -2.7 75 350 B L H X S+ 0 0 43 -4,-2.4 4,-1.5 -5,-0.2 3,-0.2 0.964 110.9 42.2 -64.9 -49.8 -3.9 14.6 -1.1 76 351 B K H X S+ 0 0 48 -4,-2.1 4,-2.2 1,-0.2 3,-0.2 0.936 110.2 57.9 -63.3 -43.0 -1.3 14.4 -3.9 77 352 B D H X S+ 0 0 70 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.869 102.8 55.9 -55.9 -33.5 -4.1 14.5 -6.5 78 353 B A H < S+ 0 0 75 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.931 113.9 37.6 -67.0 -42.3 -5.2 17.8 -4.9 79 354 B Q H >< S+ 0 0 89 -4,-1.5 3,-1.0 -3,-0.2 -2,-0.2 0.678 109.2 66.1 -82.8 -14.3 -1.8 19.3 -5.5 80 355 B A H 3< S+ 0 0 74 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.926 97.4 52.2 -71.8 -41.5 -1.5 17.5 -8.8 81 356 B G T 3< S+ 0 0 67 -4,-1.8 2,-0.7 -5,-0.2 -1,-0.3 0.230 83.4 125.1 -78.3 20.0 -4.4 19.5 -10.3 82 357 B K S < S- 0 0 149 -3,-1.0 3,-0.1 -5,-0.1 -3,-0.1 -0.695 70.1-117.0 -83.1 117.0 -2.5 22.7 -9.1 83 358 B E - 0 0 167 -2,-0.7 2,-0.3 1,-0.2 -1,-0.1 -0.166 42.2 -88.2 -49.1 147.6 -2.0 24.9 -12.1 84 359 B P 0 0 121 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.414 360.0 360.0 -60.9 119.3 1.8 25.4 -13.0 85 360 B G 0 0 147 -2,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.874 360.0 360.0 -46.6 360.0 2.8 28.4 -10.8 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 0 220 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 17.7 16.0 -21.6 -8.0 88 320 C K + 0 0 150 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.645 360.0 12.1 -88.6 145.5 17.6 -21.0 -11.4 89 321 C K - 0 0 152 -2,-0.3 -1,-0.2 1,-0.1 0, 0.0 0.976 51.2-162.2 58.9 89.9 18.1 -17.5 -13.0 90 322 C P + 0 0 90 0, 0.0 2,-1.6 0, 0.0 -1,-0.1 0.346 67.5 110.3 -77.0 8.7 17.5 -14.8 -10.4 91 323 C L + 0 0 141 3,-0.0 3,-0.1 1,-0.0 -2,-0.0 -0.185 41.2 126.7 -79.3 47.8 17.1 -12.8 -13.6 92 324 C D S S- 0 0 84 -2,-1.6 3,-0.1 1,-0.3 2,-0.0 0.476 74.5 -15.3 -76.9-131.4 13.4 -12.3 -13.2 93 325 C G S S- 0 0 19 1,-0.1 -1,-0.3 -77,-0.0 -77,-0.1 -0.384 93.3 -85.8 -68.9 151.0 12.1 -8.7 -13.3 94 326 C E - 0 0 134 -79,-0.1 -78,-1.2 -3,-0.1 2,-0.2 -0.278 49.8-126.8 -56.0 139.9 14.8 -6.0 -13.0 95 327 C Y E +A 15 0A 87 -80,-0.2 2,-0.3 -3,-0.1 -80,-0.2 -0.602 30.5 179.2 -91.0 153.6 15.5 -5.4 -9.3 96 328 C F E -A 14 0A 57 -82,-0.9 -82,-1.6 -2,-0.2 2,-0.3 -0.832 17.5-134.1-140.5 179.0 15.4 -1.9 -7.7 97 329 C T E -A 13 0A 104 -2,-0.3 2,-0.4 -84,-0.2 -84,-0.2 -0.985 12.5-167.4-140.3 149.7 15.8 -0.2 -4.3 98 330 C L E -A 12 0A 21 -86,-1.4 -86,-1.4 -2,-0.3 2,-0.4 -0.989 19.3-132.5-141.9 132.1 13.9 2.4 -2.4 99 331 C Q E -A 11 0A 116 -2,-0.4 2,-0.5 -88,-0.2 -88,-0.2 -0.679 22.9-166.8 -83.9 130.9 14.8 4.4 0.7 100 332 C I E -A 10 0A 1 -90,-1.6 -90,-0.9 -2,-0.4 6,-0.1 -0.939 9.6-146.4-123.2 113.5 11.9 4.4 3.3 101 333 C R E +A 9 0A 97 -2,-0.5 -92,-0.2 -92,-0.2 -93,-0.1 -0.423 65.9 39.8 -73.3 151.1 12.1 6.9 6.2 102 334 C G S > S- 0 0 19 -94,-1.2 4,-0.9 3,-0.1 -92,-0.1 0.324 72.3-124.7 86.4 139.6 10.7 5.7 9.6 103 335 C R H > S+ 0 0 162 2,-0.2 4,-2.1 3,-0.1 5,-0.2 0.913 109.0 49.6 -85.0 -47.5 11.0 2.2 11.1 104 336 C E H > S+ 0 0 169 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.927 111.9 50.6 -58.1 -42.1 7.3 1.5 11.6 105 337 C R H > S+ 0 0 44 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.920 105.9 56.8 -63.2 -41.1 6.7 2.6 8.0 106 338 C F H X S+ 0 0 38 -4,-0.9 4,-2.9 1,-0.2 5,-0.3 0.974 105.0 49.3 -55.2 -57.0 9.4 0.3 6.8 107 339 C E H X S+ 0 0 97 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.890 110.4 54.1 -51.5 -38.4 7.9 -2.9 8.4 108 340 C M H X S+ 0 0 36 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.968 110.2 43.5 -63.5 -51.5 4.6 -1.8 6.8 109 341 C F H X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.953 110.0 56.7 -61.0 -46.2 6.0 -1.6 3.2 110 342 C R H X S+ 0 0 109 -4,-2.9 4,-2.8 -5,-0.2 5,-0.3 0.920 105.7 53.0 -51.7 -42.6 8.0 -4.8 3.7 111 343 C E H X S+ 0 0 82 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.2 0.971 109.8 45.1 -60.0 -53.1 4.6 -6.6 4.5 112 344 C L H X S+ 0 0 3 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.915 112.5 54.4 -59.6 -37.7 2.9 -5.4 1.3 113 345 C N H X S+ 0 0 6 -4,-2.9 4,-2.5 -5,-0.2 5,-0.2 0.983 111.4 42.1 -59.9 -55.1 6.0 -6.3 -0.6 114 346 C E H X S+ 0 0 97 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.879 110.6 60.6 -60.5 -33.8 6.0 -9.9 0.7 115 347 C A H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.3 5,-0.2 0.975 108.6 40.5 -58.8 -53.8 2.2 -9.9 0.2 116 348 C L H X S+ 0 0 1 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.946 114.5 52.7 -61.8 -44.9 2.5 -9.3 -3.6 117 349 C E H X S+ 0 0 92 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.885 107.1 55.0 -58.8 -34.2 5.5 -11.7 -3.8 118 350 C L H X S+ 0 0 44 -4,-2.4 4,-1.5 -5,-0.2 3,-0.2 0.964 110.9 42.2 -64.8 -49.8 3.3 -14.3 -2.1 119 351 C K H X S+ 0 0 47 -4,-2.1 4,-2.2 1,-0.2 3,-0.2 0.936 110.1 57.9 -63.3 -43.0 0.5 -14.0 -4.6 120 352 C D H X S+ 0 0 68 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.869 102.8 55.9 -55.9 -33.6 3.0 -14.0 -7.5 121 353 C A H < S+ 0 0 73 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.931 113.9 37.5 -66.9 -42.4 4.3 -17.3 -6.2 122 354 C Q H >< S+ 0 0 91 -4,-1.5 3,-1.0 -3,-0.2 -2,-0.2 0.678 109.2 66.1 -82.7 -14.3 0.8 -18.9 -6.4 123 355 C A H 3< S+ 0 0 76 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.927 97.4 52.2 -71.8 -41.5 0.1 -16.9 -9.6 124 356 C G T 3< S+ 0 0 69 -4,-1.8 2,-0.7 -5,-0.2 -1,-0.3 0.230 83.4 125.1 -78.4 20.1 2.9 -18.9 -11.5 125 357 C K S < S- 0 0 152 -3,-1.0 3,-0.1 -5,-0.1 -3,-0.1 -0.695 70.1-117.0 -83.0 117.0 1.1 -22.0 -10.3 126 358 C E - 0 0 165 -2,-0.7 2,-0.3 1,-0.2 -1,-0.1 -0.167 42.2 -88.2 -49.1 147.6 0.3 -24.2 -13.3 127 359 C P 0 0 124 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.414 360.0 360.0 -60.9 119.2 -3.5 -24.7 -13.8 128 360 C G 0 0 145 -2,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.874 360.0 360.0 -46.5 360.0 -4.4 -27.7 -11.7 129 !* 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 0 220 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 17.7 -16.5 -21.9 6.6 131 320 D K + 0 0 149 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.646 360.0 12.1 -88.6 145.6 -18.1 -21.5 10.0 132 321 D K - 0 0 149 -2,-0.3 -1,-0.2 1,-0.1 0, 0.0 0.976 51.2-162.2 58.9 89.9 -18.6 -18.0 11.7 133 322 D P + 0 0 94 0, 0.0 2,-1.6 0, 0.0 -1,-0.1 0.346 67.5 110.3 -77.1 8.7 -18.0 -15.2 9.2 134 323 D L + 0 0 140 3,-0.0 3,-0.1 1,-0.0 -2,-0.0 -0.184 41.3 126.7 -79.4 47.9 -17.6 -13.3 12.6 135 324 D D S S- 0 0 84 -2,-1.6 3,-0.1 1,-0.3 2,-0.0 0.476 74.5 -15.3 -76.8-131.4 -13.9 -12.8 12.1 136 325 D G S S- 0 0 19 1,-0.1 -1,-0.3 -77,-0.0 -77,-0.1 -0.385 93.3 -85.8 -68.8 150.9 -12.6 -9.2 12.4 137 326 D E - 0 0 137 -79,-0.1 -78,-1.2 -3,-0.1 2,-0.2 -0.278 49.8-126.8 -56.2 139.9 -15.3 -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 -0.602 30.5 179.2 -90.9 153.6 -16.0 -5.7 8.5 139 328 D F E -B 57 0B 57 -82,-0.9 -82,-1.6 -2,-0.2 2,-0.3 -0.832 17.5-134.1-140.5 179.0 -15.9 -2.2 7.1 140 329 D T E -B 56 0B 102 -2,-0.2 2,-0.4 -84,-0.2 -84,-0.2 -0.985 12.5-167.4-140.3 149.7 -16.3 -0.4 3.8 141 330 D L E -B 55 0B 20 -86,-1.4 -86,-1.4 -2,-0.3 2,-0.4 -0.989 19.3-132.5-142.0 132.1 -14.3 2.3 2.0 142 331 D Q E -B 54 0B 117 -2,-0.4 2,-0.5 -88,-0.2 -88,-0.2 -0.679 22.9-166.8 -83.8 130.9 -15.2 4.5 -1.0 143 332 D I E -B 53 0B 1 -90,-1.6 -90,-0.9 -2,-0.4 6,-0.1 -0.939 9.6-146.4-123.2 113.5 -12.4 4.6 -3.6 144 333 D R E +B 52 0B 100 -2,-0.5 -92,-0.2 -92,-0.2 -93,-0.1 -0.422 65.9 39.7 -73.3 151.1 -12.5 7.2 -6.4 145 334 D G S > S- 0 0 19 -94,-1.2 4,-0.9 3,-0.1 -92,-0.1 0.324 72.3-124.7 86.4 139.7 -11.1 6.2 -9.8 146 335 D R H > S+ 0 0 163 2,-0.2 4,-2.1 3,-0.1 5,-0.2 0.913 109.0 49.6 -85.0 -47.4 -11.4 2.7 -11.5 147 336 D E H > S+ 0 0 171 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.927 111.9 50.6 -58.1 -42.1 -7.7 2.0 -12.0 148 337 D R H > S+ 0 0 45 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.920 105.9 56.8 -63.3 -41.0 -7.1 2.9 -8.4 149 338 D F H X S+ 0 0 38 -4,-0.9 4,-2.9 1,-0.2 5,-0.3 0.975 105.0 49.3 -55.3 -56.9 -9.9 0.6 -7.3 150 339 D E H X S+ 0 0 98 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.890 110.4 54.1 -51.5 -38.4 -8.3 -2.5 -9.0 151 340 D M H X S+ 0 0 36 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.968 110.2 43.5 -63.6 -51.4 -5.0 -1.5 -7.3 152 341 D F H X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.953 110.0 56.7 -61.0 -46.2 -6.5 -1.4 -3.8 153 342 D R H X S+ 0 0 112 -4,-2.9 4,-2.8 -5,-0.2 5,-0.3 0.920 105.7 53.0 -51.7 -42.6 -8.4 -4.7 -4.4 154 343 D E H X S+ 0 0 82 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.2 0.971 109.8 45.0 -60.0 -53.1 -5.1 -6.3 -5.2 155 344 D L H X S+ 0 0 4 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.915 112.5 54.4 -59.6 -37.7 -3.4 -5.3 -2.0 156 345 D N H X S+ 0 0 6 -4,-2.9 4,-2.5 -5,-0.2 5,-0.2 0.983 111.4 42.1 -60.0 -55.1 -6.5 -6.3 -0.1 157 346 D E H X S+ 0 0 99 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.880 110.6 60.6 -60.5 -33.7 -6.5 -9.9 -1.6 158 347 D A H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.3 5,-0.2 0.975 108.6 40.5 -58.8 -53.8 -2.7 -9.9 -1.1 159 348 D L H X S+ 0 0 1 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.946 114.5 52.7 -61.8 -44.9 -3.0 -9.5 2.7 160 349 D E H X S+ 0 0 94 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.884 107.2 55.0 -58.8 -34.2 -6.0 -11.9 2.9 161 350 D L H X S+ 0 0 42 -4,-2.4 4,-1.5 -5,-0.2 3,-0.2 0.964 110.9 42.2 -64.8 -49.8 -3.8 -14.4 1.0 162 351 D K H X S+ 0 0 47 -4,-2.1 4,-2.2 1,-0.2 3,-0.2 0.936 110.2 57.9 -63.3 -43.1 -1.0 -14.2 3.6 163 352 D D H X S+ 0 0 69 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.869 102.8 55.9 -55.8 -33.6 -3.5 -14.3 6.4 164 353 D A H < S+ 0 0 74 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.931 113.9 37.6 -66.9 -42.4 -4.8 -17.6 4.9 165 354 D Q H >< S+ 0 0 90 -4,-1.5 3,-1.0 -3,-0.2 -2,-0.2 0.678 109.2 66.1 -82.6 -14.4 -1.3 -19.1 5.2 166 355 D A H 3< S+ 0 0 77 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.926 97.4 52.2 -71.7 -41.5 -0.7 -17.3 8.5 167 356 D G T 3< S+ 0 0 69 -4,-1.8 2,-0.7 -5,-0.2 -1,-0.3 0.229 83.4 125.1 -78.3 20.1 -3.4 -19.4 10.2 168 357 D K S < S- 0 0 150 -3,-1.0 3,-0.1 -5,-0.1 -3,-0.1 -0.695 70.0-117.0 -83.1 117.0 -1.6 -22.5 8.9 169 358 D E - 0 0 168 -2,-0.7 2,-0.3 1,-0.2 -1,-0.1 -0.166 42.2 -88.2 -49.1 147.6 -0.8 -24.8 11.8 170 359 D P 0 0 122 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.414 360.0 360.0 -60.8 119.3 3.0 -25.2 12.3 171 360 D G 0 0 144 -2,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.873 360.0 360.0 -46.7 360.0 3.9 -28.2 10.1