==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA-BINDING 24-NOV-94 1PES . COMPND 2 MOLECULE: TUMOR SUPPRESSOR P53; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.LEE,T.S.HARVEY,Y.YIN,P.YAU,D.LITCHFIELD,C.H.ARROWSMITH . 124 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9193.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 112 90.3 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 12.9 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 . 20 16.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 51.6 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 4 0 0 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 4 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 . 4 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 1 325 A G 0 0 104 0, 0.0 2,-0.2 0, 0.0 42,-0.2 0.000 360.0 360.0 360.0 167.0 12.1 1.5 -14.4 2 326 A E E -A 42 0A 131 40,-2.1 40,-2.3 38,-0.1 2,-0.6 -0.606 360.0 -82.4-126.5-171.0 10.5 -1.5 -16.2 3 327 A Y E -A 41 0A 150 38,-0.2 2,-0.3 -2,-0.2 38,-0.2 -0.854 45.9-177.4-101.1 118.2 6.9 -2.9 -16.6 4 328 A F E -A 40 0A 50 36,-1.8 36,-1.6 -2,-0.6 2,-0.4 -0.815 15.3-142.6-112.3 154.2 5.8 -5.1 -13.7 5 329 A T - 0 0 69 -2,-0.3 2,-0.7 34,-0.2 34,-0.2 -0.950 5.1-162.0-118.4 133.0 2.5 -7.0 -13.3 6 330 A L - 0 0 4 -2,-0.4 2,-0.8 32,-0.4 32,-0.4 -0.793 10.9-171.3-113.1 91.3 0.6 -7.4 -10.0 7 331 A Q - 0 0 118 -2,-0.7 2,-0.5 30,-0.2 30,-0.2 -0.705 7.1-176.3 -84.7 111.7 -1.8 -10.3 -10.5 8 332 A I E -B 36 0B 5 28,-1.3 28,-1.4 -2,-0.8 2,-0.8 -0.922 21.3-139.5-112.2 127.3 -4.1 -10.5 -7.5 9 333 A R E S+B 35 0B 136 -2,-0.5 2,-0.3 26,-0.2 26,-0.2 -0.714 74.1 40.3 -85.5 110.1 -6.7 -13.2 -7.2 10 334 A G E S-B 34 0B 17 24,-1.8 24,-1.8 -2,-0.8 -2,-0.1 -0.961 76.6-117.2 156.9-136.2 -9.9 -11.6 -5.8 11 335 A R S > S+ 0 0 163 -2,-0.3 4,-1.4 22,-0.2 5,-0.1 0.181 97.5 49.4-166.8 -52.0 -11.8 -8.4 -6.5 12 336 A E H > S+ 0 0 160 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.970 112.4 48.7 -69.4 -51.2 -11.9 -6.1 -3.4 13 337 A R H > S+ 0 0 73 1,-0.3 4,-1.9 2,-0.2 5,-0.3 0.927 108.3 55.9 -55.2 -42.1 -8.2 -6.3 -2.6 14 338 A F H > S+ 0 0 17 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.907 106.1 51.4 -58.3 -37.9 -7.5 -5.6 -6.3 15 339 A E H X S+ 0 0 121 -4,-1.4 4,-2.0 -3,-0.4 -1,-0.2 0.940 103.5 58.5 -65.7 -43.6 -9.5 -2.4 -5.9 16 340 A M H >X S+ 0 0 15 -4,-2.2 4,-1.8 1,-0.2 3,-0.8 0.965 110.9 40.7 -49.3 -57.7 -7.6 -1.3 -2.8 17 341 A F H 3X S+ 0 0 1 -4,-1.9 4,-1.8 1,-0.3 -1,-0.2 0.886 107.5 64.4 -59.9 -36.2 -4.3 -1.4 -4.7 18 342 A R H 3X S+ 0 0 140 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.3 0.884 103.4 48.3 -56.4 -36.0 -6.1 0.2 -7.6 19 343 A E H XX S+ 0 0 71 -4,-2.0 4,-1.9 -3,-0.8 3,-0.5 0.978 110.0 48.2 -70.5 -53.5 -6.7 3.3 -5.4 20 344 A L H 3X S+ 0 0 2 -4,-1.8 4,-1.5 1,-0.3 -1,-0.2 0.792 114.0 52.0 -57.2 -21.7 -3.1 3.5 -4.2 21 345 A N H 3X S+ 0 0 21 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.3 0.827 102.7 56.3 -84.0 -32.9 -2.3 3.2 -8.0 22 346 A E H X S+ 0 0 8 -4,-1.5 4,-1.5 1,-0.3 3,-0.9 0.969 114.9 46.1 -51.8 -52.7 0.8 7.4 -7.4 25 349 A E H 3X S+ 0 0 123 -4,-2.0 4,-1.4 1,-0.3 -1,-0.3 0.849 107.7 59.5 -59.7 -28.8 0.1 7.5 -11.2 26 350 A L H 3X S+ 0 0 14 -4,-0.9 4,-1.6 -5,-0.3 -1,-0.3 0.857 98.9 57.4 -69.3 -30.1 -1.6 10.9 -10.5 27 351 A K H << S+ 0 0 89 -4,-1.9 -1,-0.2 -3,-0.9 -2,-0.2 0.910 104.7 50.8 -66.6 -38.3 1.8 12.1 -9.1 28 352 A D H < S+ 0 0 101 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.855 113.2 45.7 -67.9 -31.3 3.5 11.3 -12.4 29 353 A A H < S+ 0 0 73 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.716 86.6 116.4 -83.8 -19.3 0.7 13.2 -14.2 30 354 A Q < 0 0 77 -4,-1.6 -3,-0.0 1,-0.2 93,-0.0 -0.144 360.0 360.0 -47.3 140.0 1.0 16.1 -11.8 31 355 A A 0 0 160 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.190 360.0 360.0 177.1 360.0 2.2 19.3 -13.6 32 !* 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 33 325 B G 0 0 104 0, 0.0 2,-0.2 0, 0.0 -22,-0.2 0.000 360.0 360.0 360.0 167.0 -13.3 -13.6 -7.6 34 326 B E E -B 10 0B 132 -24,-1.8 -24,-1.8 -26,-0.1 2,-0.6 -0.604 360.0 -82.3-126.6-170.7 -11.4 -13.4 -10.9 35 327 B Y E -B 9 0B 155 -2,-0.2 2,-0.3 -26,-0.2 -26,-0.2 -0.857 46.0-177.6-101.4 118.5 -7.8 -12.8 -12.0 36 328 B F E -B 8 0B 51 -28,-1.4 -28,-1.3 -2,-0.6 2,-0.4 -0.828 15.2-142.8-113.0 153.5 -6.8 -9.1 -12.2 37 329 B T - 0 0 72 -2,-0.3 2,-0.6 -30,-0.2 -30,-0.2 -0.937 5.3-162.5-117.7 137.1 -3.5 -7.6 -13.4 38 330 B L - 0 0 5 -2,-0.4 2,-0.8 -32,-0.4 -32,-0.4 -0.732 10.6-171.0-116.8 83.3 -1.8 -4.5 -11.9 39 331 B Q - 0 0 117 -2,-0.6 2,-0.5 -34,-0.2 -34,-0.2 -0.620 7.7-175.8 -77.1 112.2 0.8 -3.4 -14.4 40 332 B I E -A 4 0A 4 -36,-1.6 -36,-1.8 -2,-0.8 2,-0.8 -0.925 20.9-139.2-112.3 127.4 2.8 -0.6 -12.7 41 333 B R E S+A 3 0A 136 -2,-0.5 2,-0.3 -38,-0.2 -38,-0.2 -0.714 73.9 39.5 -85.8 110.3 5.5 1.3 -14.6 42 334 B G E S-A 2 0A 17 -40,-2.3 -40,-2.1 -2,-0.8 -2,-0.1 -0.962 76.7-116.6 156.2-135.7 8.5 1.7 -12.3 43 335 B R S > S+ 0 0 159 -2,-0.3 4,-1.4 -42,-0.2 5,-0.1 0.183 97.6 49.8-166.8 -52.2 10.2 -0.6 -9.7 44 336 B E H > S+ 0 0 160 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.970 112.3 48.7 -69.0 -51.1 10.1 0.8 -6.2 45 337 B R H > S+ 0 0 77 1,-0.3 4,-1.9 2,-0.2 5,-0.3 0.929 108.2 55.9 -55.4 -42.8 6.3 1.5 -6.2 46 338 B F H > S+ 0 0 16 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.907 106.2 51.5 -57.8 -38.1 5.8 -2.1 -7.6 47 339 B E H X S+ 0 0 121 -4,-1.4 4,-2.0 -3,-0.4 -1,-0.2 0.944 103.5 58.1 -65.5 -44.2 7.7 -3.4 -4.6 48 340 B M H >X S+ 0 0 16 -4,-2.2 4,-1.8 1,-0.3 3,-0.9 0.967 110.9 41.1 -49.5 -58.0 5.4 -1.4 -2.2 49 341 B F H 3X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.3 -1,-0.3 0.873 107.7 64.5 -60.0 -33.1 2.3 -3.1 -3.5 50 342 B R H 3X S+ 0 0 140 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.3 0.889 103.4 47.8 -58.9 -35.3 4.3 -6.4 -3.6 51 343 B E H XX S+ 0 0 72 -4,-2.0 4,-2.0 -3,-0.9 3,-0.5 0.979 110.3 47.9 -70.6 -54.1 4.6 -6.1 0.2 52 344 B L H 3X S+ 0 0 2 -4,-1.8 4,-1.5 1,-0.3 -1,-0.2 0.784 114.2 52.2 -57.3 -20.7 0.8 -5.4 0.8 53 345 B N H 3X S+ 0 0 22 -4,-1.7 4,-2.1 -5,-0.3 5,-0.3 0.831 103.3 55.1 -84.2 -33.6 0.4 -8.4 -1.6 54 346 B E H X S+ 0 0 6 -4,-1.5 4,-1.3 1,-0.3 3,-0.9 0.961 114.9 46.2 -50.1 -54.1 -2.8 -10.3 2.0 57 349 B E H 3X S+ 0 0 121 -4,-2.1 4,-1.4 1,-0.3 -1,-0.3 0.856 107.5 59.8 -58.9 -30.4 -1.9 -13.5 0.2 58 350 B L H 3X S+ 0 0 13 -4,-1.0 4,-1.6 -5,-0.3 -1,-0.3 0.866 98.3 58.0 -67.2 -31.9 -0.5 -14.7 3.5 59 351 B K H << S+ 0 0 85 -4,-1.9 -1,-0.2 -3,-0.9 -2,-0.2 0.904 104.5 50.8 -65.2 -37.3 -3.9 -14.3 5.1 60 352 B D H < S+ 0 0 100 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.847 113.1 45.8 -69.2 -30.4 -5.3 -16.8 2.4 61 353 B A H < S+ 0 0 72 -4,-1.4 -1,-0.2 2,-0.0 -2,-0.2 0.706 86.9 116.0 -84.4 -18.7 -2.6 -19.2 3.3 62 354 B Q < 0 0 78 -4,-1.6 -3,-0.0 1,-0.2 29,-0.0 -0.159 360.0 360.0 -48.7 141.1 -3.1 -18.7 7.0 63 355 B A 0 0 159 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.184 360.0 360.0 176.8 360.0 -4.3 -22.0 8.6 64 !* 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 65 325 C G 0 0 104 0, 0.0 2,-0.2 0, 0.0 42,-0.2 0.000 360.0 360.0 360.0 166.9 11.2 -0.6 15.3 66 326 C E E -C 106 0C 129 40,-2.0 40,-2.1 38,-0.1 2,-0.6 -0.603 360.0 -82.2-126.5-170.6 9.3 2.2 16.9 67 327 C Y E -C 105 0C 155 38,-0.2 2,-0.3 -2,-0.2 38,-0.2 -0.856 46.0-177.3-101.5 118.4 5.6 3.4 17.1 68 328 C F E -C 104 0C 50 36,-1.6 36,-1.5 -2,-0.6 2,-0.4 -0.815 15.3-142.4-112.4 154.3 4.6 5.6 14.1 69 329 C T - 0 0 72 -2,-0.3 2,-0.7 34,-0.2 34,-0.2 -0.946 5.5-162.7-118.6 134.5 1.2 7.3 13.5 70 330 C L - 0 0 3 -2,-0.4 2,-0.8 32,-0.3 32,-0.3 -0.739 10.8-171.6-114.8 84.6 -0.5 7.6 10.1 71 331 C Q - 0 0 118 -2,-0.7 2,-0.5 30,-0.2 30,-0.2 -0.639 7.2-176.0 -78.6 112.7 -3.2 10.3 10.5 72 332 C I E -D 100 0D 4 28,-1.4 28,-1.6 -2,-0.8 2,-0.8 -0.928 21.1-139.0-112.9 127.4 -5.3 10.3 7.3 73 333 C R E S+D 99 0D 133 -2,-0.5 2,-0.3 26,-0.2 26,-0.2 -0.713 74.0 39.5 -85.7 110.2 -8.0 12.9 6.8 74 334 C G E S-D 98 0D 16 24,-2.1 24,-2.0 -2,-0.8 -2,-0.1 -0.961 76.7-116.5 156.3-135.7 -11.0 11.1 5.3 75 335 C R S > S+ 0 0 162 -2,-0.3 4,-1.4 22,-0.2 5,-0.1 0.183 97.6 49.8-166.8 -52.3 -12.7 7.7 5.8 76 336 C E H > S+ 0 0 161 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.970 112.4 48.6 -68.9 -51.3 -12.5 5.4 2.8 77 337 C R H > S+ 0 0 74 1,-0.3 4,-1.9 2,-0.2 5,-0.3 0.928 108.2 56.0 -55.3 -42.4 -8.8 5.9 2.2 78 338 C F H > S+ 0 0 15 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.909 106.2 51.3 -57.9 -38.3 -8.2 5.2 5.9 79 339 C E H X S+ 0 0 123 -4,-1.4 4,-2.0 -3,-0.4 -1,-0.2 0.944 103.5 58.3 -65.4 -44.5 -10.0 1.9 5.4 80 340 C M H >X S+ 0 0 15 -4,-2.2 4,-1.8 1,-0.3 3,-0.9 0.966 110.8 41.1 -49.2 -58.1 -7.8 1.0 2.4 81 341 C F H 3X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.3 -1,-0.3 0.874 107.6 64.6 -59.8 -33.2 -4.7 1.2 4.6 82 342 C R H 3X S+ 0 0 137 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.3 0.890 103.4 47.6 -58.8 -35.4 -6.6 -0.5 7.3 83 343 C E H XX S+ 0 0 70 -4,-2.0 4,-2.0 -3,-0.9 3,-0.6 0.980 110.3 48.2 -70.6 -54.3 -6.8 -3.6 5.1 84 344 C L H 3X S+ 0 0 2 -4,-1.8 4,-1.5 1,-0.3 -1,-0.2 0.784 114.2 51.8 -56.6 -21.1 -3.1 -3.6 4.1 85 345 C N H 3X S+ 0 0 19 -4,-1.7 4,-2.1 -5,-0.3 -1,-0.3 0.825 103.4 55.3 -84.9 -32.8 -2.6 -3.2 7.9 86 346 C E H X S+ 0 0 6 -4,-1.5 4,-1.3 1,-0.3 3,-0.9 0.962 114.8 46.2 -50.6 -54.2 0.7 -7.2 7.5 89 349 C E H 3X S+ 0 0 123 -4,-2.1 4,-1.4 1,-0.3 -1,-0.3 0.853 107.5 59.8 -58.8 -30.1 -0.2 -7.4 11.2 90 350 C L H 3X S+ 0 0 14 -4,-1.0 4,-1.5 -5,-0.3 -1,-0.3 0.866 98.2 58.0 -67.5 -31.9 -1.5 -10.9 10.5 91 351 C K H << S+ 0 0 86 -4,-1.9 -1,-0.2 -3,-0.9 -2,-0.2 0.905 104.5 50.8 -65.1 -37.4 1.9 -11.9 9.3 92 352 C D H < S+ 0 0 101 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.848 113.0 45.9 -69.2 -30.4 3.4 -11.0 12.7 93 353 C A H < S+ 0 0 73 -4,-1.4 -1,-0.2 2,-0.0 -2,-0.2 0.703 86.9 116.0 -84.4 -18.5 0.7 -13.1 14.4 94 354 C Q < 0 0 76 -4,-1.5 -3,-0.0 1,-0.2 -35,-0.0 -0.161 360.0 360.0 -48.9 141.3 1.2 -16.0 11.9 95 355 C A 0 0 163 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.185 360.0 360.0 176.8 360.0 2.5 -19.0 13.8 96 !* 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 97 325 D G 0 0 103 0, 0.0 2,-0.2 0, 0.0 -22,-0.2 0.000 360.0 360.0 360.0 166.9 -14.7 12.7 6.7 98 326 D E E -D 74 0D 130 -24,-2.0 -24,-2.1 -26,-0.1 2,-0.6 -0.602 360.0 -82.2-126.5-170.6 -13.0 12.6 10.1 99 327 D Y E -D 73 0D 151 -26,-0.2 2,-0.3 -2,-0.2 -26,-0.2 -0.857 46.0-177.3-101.5 118.4 -9.5 12.3 11.5 100 328 D F E -D 72 0D 52 -28,-1.6 -28,-1.4 -2,-0.6 2,-0.4 -0.815 15.3-142.4-112.4 154.3 -8.3 8.6 11.8 101 329 D T - 0 0 71 -2,-0.3 2,-0.7 -30,-0.2 -30,-0.2 -0.946 5.5-162.7-118.5 134.5 -4.9 7.4 13.2 102 330 D L - 0 0 4 -2,-0.4 2,-0.8 -32,-0.3 -32,-0.3 -0.739 10.8-171.6-114.8 84.7 -2.9 4.5 11.8 103 331 D Q - 0 0 116 -2,-0.7 2,-0.5 -34,-0.2 -34,-0.2 -0.639 7.3-176.0 -78.7 112.6 -0.5 3.4 14.4 104 332 D I E -C 68 0C 4 -36,-1.5 -36,-1.6 -2,-0.8 2,-0.8 -0.927 21.1-139.0-112.7 127.4 1.9 0.8 12.9 105 333 D R E S+C 67 0C 137 -2,-0.5 2,-0.3 -38,-0.2 -38,-0.2 -0.712 74.0 39.4 -85.7 110.2 4.5 -0.9 15.0 106 334 D G E S-C 66 0C 17 -40,-2.1 -40,-2.0 -2,-0.8 -2,-0.1 -0.961 76.8-116.4 156.3-135.7 7.7 -1.1 12.9 107 335 D R S > S+ 0 0 159 -2,-0.3 4,-1.4 -42,-0.2 5,-0.1 0.182 97.6 49.8-166.8 -52.3 9.5 1.2 10.5 108 336 D E H > S+ 0 0 156 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.970 112.3 48.6 -68.9 -51.3 9.7 -0.1 6.9 109 337 D R H > S+ 0 0 76 1,-0.3 4,-1.9 2,-0.2 5,-0.3 0.928 108.2 56.0 -55.3 -42.4 5.9 -1.0 6.7 110 338 D F H > S+ 0 0 16 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.909 106.2 51.3 -58.0 -38.2 5.1 2.5 8.0 111 339 D E H X S+ 0 0 119 -4,-1.4 4,-2.0 -3,-0.4 -1,-0.2 0.944 103.5 58.3 -65.5 -44.3 7.1 3.9 5.1 112 340 D M H >X S+ 0 0 15 -4,-2.2 4,-1.8 1,-0.3 3,-0.9 0.966 110.8 41.1 -49.3 -58.0 5.2 1.8 2.6 113 341 D F H 3X S+ 0 0 1 -4,-1.9 4,-1.7 1,-0.3 -1,-0.3 0.873 107.6 64.4 -59.9 -33.2 1.9 3.3 3.7 114 342 D R H 3X S+ 0 0 142 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.3 0.889 103.4 47.8 -58.9 -35.3 3.7 6.7 3.9 115 343 D E H XX S+ 0 0 74 -4,-2.0 4,-2.0 -3,-0.9 3,-0.5 0.980 110.4 48.0 -70.5 -54.3 4.1 6.4 0.1 116 344 D L H 3X S+ 0 0 2 -4,-1.8 4,-1.5 1,-0.3 -1,-0.2 0.783 114.2 52.0 -57.0 -20.9 0.5 5.5 -0.7 117 345 D N H 3X S+ 0 0 21 -4,-1.7 4,-2.1 -5,-0.3 5,-0.3 0.827 103.2 55.4 -84.7 -33.0 -0.3 8.4 1.6 118 346 D E H X S+ 0 0 7 -4,-1.5 4,-1.3 1,-0.3 3,-0.9 0.961 114.9 46.1 -50.2 -54.1 -3.4 10.1 -2.2 121 349 D E H 3X S+ 0 0 122 -4,-2.1 4,-1.4 1,-0.3 -1,-0.3 0.854 107.5 60.0 -58.9 -30.2 -2.8 13.4 -0.3 122 350 D L H 3X S+ 0 0 15 -4,-1.0 4,-1.6 -5,-0.3 -1,-0.3 0.866 98.2 57.9 -67.2 -31.9 -1.2 14.7 -3.5 123 351 D K H << S+ 0 0 86 -4,-1.9 -1,-0.2 -3,-0.9 -2,-0.2 0.903 104.4 50.9 -65.3 -37.3 -4.5 14.1 -5.3 124 352 D D H < S+ 0 0 97 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.846 113.1 45.8 -69.2 -30.1 -6.3 16.4 -2.8 125 353 D A H < S+ 0 0 74 -4,-1.4 -1,-0.2 2,-0.0 -2,-0.2 0.705 86.8 115.7 -84.8 -18.8 -3.6 19.1 -3.5 126 354 D Q < 0 0 76 -4,-1.6 -3,-0.0 1,-0.2 -99,-0.0 -0.161 360.0 360.0 -49.0 141.5 -3.9 18.6 -7.2 127 355 D A 0 0 161 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.186 360.0 360.0 176.8 360.0 -5.2 21.7 -8.9