==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 19-JUL-13 4LRA . COMPND 2 MOLECULE: PHOSPHOPENTOMUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR W.A.BIRMINGHAM,C.A.STARBIRD,T.D.PANOSIAN,D.P.NANNEMANN,T.M.I . 1172 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45201.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 793 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 132 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 7.3 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 . 5 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 76 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 292 24.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 34 2.9 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 6 3 3 4 6 0 1 5 3 2 3 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 0 3 2 4 3 6 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 . 9 1 8 3 3 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 3 0 0 3 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 2 A N 0 0 113 0, 0.0 3,-0.1 0, 0.0 375,-0.1 0.000 360.0 360.0 360.0 145.9 -21.2 13.9 -2.3 2 3 A K + 0 0 93 373,-0.5 2,-0.4 1,-0.2 374,-0.1 0.950 360.0 27.5 -66.6 -51.6 -20.5 12.0 -5.5 3 4 A Y - 0 0 7 1,-0.1 -1,-0.2 372,-0.1 316,-0.2 -0.942 63.7-162.4-110.7 135.1 -18.0 9.8 -3.5 4 5 A K S S+ 0 0 59 314,-2.3 271,-1.8 -2,-0.4 2,-0.4 0.828 83.8 24.7 -77.1 -36.3 -18.4 9.2 0.2 5 6 A R E -ab 275 319A 7 313,-1.5 315,-2.1 269,-0.2 2,-0.5 -0.994 63.2-163.8-134.5 138.1 -14.7 8.1 0.4 6 7 A I E -ab 276 320A 0 269,-2.2 271,-2.8 -2,-0.4 2,-0.6 -0.990 7.2-159.1-122.2 128.8 -11.7 8.8 -1.6 7 8 A F E -ab 277 321A 1 313,-3.1 315,-3.1 -2,-0.5 2,-0.5 -0.943 11.2-168.1-107.9 110.4 -8.6 6.6 -1.2 8 9 A L E -ab 278 322A 0 269,-3.2 271,-3.1 -2,-0.6 2,-0.5 -0.909 1.9-169.7-107.6 123.0 -5.5 8.4 -2.4 9 10 A V E -ab 279 323A 2 313,-3.1 315,-2.6 -2,-0.5 2,-0.7 -0.945 7.0-163.2-116.9 116.7 -2.3 6.4 -2.9 10 11 A V E -ab 280 324A 0 269,-3.2 271,-3.2 -2,-0.5 2,-1.3 -0.893 7.4-157.7 -97.3 115.2 1.1 8.0 -3.5 11 12 A M E > -a 281 0A 0 313,-3.0 3,-2.2 -2,-0.7 315,-0.3 -0.784 35.8-125.8 -84.3 95.1 3.6 5.6 -4.9 12 13 A D T 3 S- 0 0 0 269,-1.6 273,-0.2 -2,-1.3 3,-0.1 -0.230 79.6 -6.0 -59.2 122.4 6.5 7.7 -3.7 13 14 A S T 3 S+ 0 0 0 1,-0.2 2,-2.1 271,-0.1 316,-0.8 0.460 84.5 143.9 78.9 5.9 8.9 8.5 -6.5 14 15 A V < - 0 0 1 -3,-2.2 314,-0.2 314,-0.2 -1,-0.2 -0.472 30.8-178.2 -82.2 77.0 7.2 6.3 -9.2 15 16 A G - 0 0 0 -2,-2.1 18,-2.4 328,-0.1 328,-0.2 -0.303 27.9-151.0 -78.5 158.9 7.8 8.6 -12.2 16 17 A I - 0 0 1 326,-2.5 327,-0.1 1,-0.4 -1,-0.1 -0.062 66.2 -46.1-124.6 31.0 6.6 8.0 -15.7 17 18 A G S S- 0 0 9 325,-0.3 325,-2.7 2,-0.0 -1,-0.4 -0.068 80.9 -47.9 117.3 147.7 9.3 9.8 -17.8 18 19 A E B -I 341 0B 75 12,-2.3 323,-0.3 323,-0.3 10,-0.1 -0.033 56.2-127.7 -46.8 134.7 11.1 13.1 -17.9 19 20 A A > - 0 0 5 321,-2.3 3,-1.9 1,-0.1 4,-0.2 -0.313 29.5 -99.0 -78.1 166.1 9.0 16.3 -17.5 20 21 A P T 3 S+ 0 0 81 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.777 125.5 45.9 -58.5 -26.5 9.2 19.2 -20.1 21 22 A D T > S+ 0 0 33 1,-0.2 3,-0.9 2,-0.1 4,-0.5 0.158 76.1 117.0-101.7 19.9 11.5 21.1 -17.7 22 23 A A G X > + 0 0 0 -3,-1.9 5,-2.9 1,-0.2 3,-1.1 0.788 65.6 64.7 -58.7 -32.0 13.8 18.2 -16.8 23 24 A E G > 5S+ 0 0 145 -3,-0.3 3,-1.6 1,-0.3 -1,-0.2 0.855 92.1 62.8 -63.6 -37.7 16.9 19.8 -18.4 24 25 A Q G < 5S+ 0 0 154 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.775 110.8 40.3 -49.6 -33.0 16.8 22.6 -15.7 25 26 A F G < 5S- 0 0 52 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.301 117.6-107.8-104.5 3.0 17.4 19.9 -13.1 26 27 A G T < 5S+ 0 0 54 -3,-1.6 -3,-0.2 -4,-0.2 -2,-0.1 0.780 83.7 126.6 69.6 29.8 19.9 17.8 -15.0 27 28 A D > < + 0 0 3 -5,-2.9 3,-1.9 -6,-0.1 -4,-0.2 0.174 20.6 141.3-108.6 16.2 17.2 15.2 -15.5 28 29 A L T 3 S+ 0 0 97 -6,-0.3 -7,-0.0 1,-0.2 -9,-0.0 -0.330 74.1 21.9 -54.1 136.3 17.2 14.6 -19.3 29 30 A G T 3 S+ 0 0 41 1,-0.3 -1,-0.2 304,-0.0 -2,-0.0 0.254 87.5 144.5 90.3 -13.2 16.7 10.9 -20.1 30 31 A S < + 0 0 1 -3,-1.9 -12,-2.3 310,-0.1 -1,-0.3 -0.279 12.2 158.1 -67.8 145.3 15.1 10.1 -16.8 31 32 A D > - 0 0 19 -14,-0.3 4,-2.2 1,-0.1 5,-0.3 -0.595 15.5-173.9-168.5 92.0 12.3 7.5 -16.8 32 33 A T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.994 86.3 30.2 -63.6 -65.6 11.6 5.7 -13.4 33 34 A I H > S+ 0 0 3 -18,-2.4 4,-3.0 1,-0.2 5,-0.2 0.921 121.5 52.8 -60.5 -45.1 9.0 3.0 -14.4 34 35 A G H > S+ 0 0 4 1,-0.2 4,-1.9 2,-0.2 26,-0.3 0.888 110.5 45.2 -60.8 -43.8 10.4 2.7 -18.0 35 36 A H H X S+ 0 0 46 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.864 114.0 50.4 -69.6 -34.0 14.0 2.0 -17.0 36 37 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.3 -2,-0.2 0.937 108.0 53.2 -66.4 -44.2 12.8 -0.4 -14.3 37 38 A A H <>S+ 0 0 0 -4,-3.0 5,-3.0 1,-0.2 4,-0.2 0.890 110.0 47.9 -56.6 -43.4 10.7 -2.3 -16.8 38 39 A E H ><5S+ 0 0 128 -4,-1.9 3,-1.4 3,-0.2 -1,-0.2 0.930 111.1 50.6 -63.4 -43.5 13.7 -2.6 -19.1 39 40 A H H 3<5S+ 0 0 85 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.874 111.0 48.5 -61.3 -38.6 15.9 -3.9 -16.2 40 41 A M T 3<5S- 0 0 34 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.410 111.2-120.5 -79.3 -0.2 13.2 -6.5 -15.2 41 42 A N T < 5S- 0 0 126 -3,-1.4 -3,-0.2 -4,-0.2 -2,-0.1 0.855 91.8 -7.7 53.3 38.8 12.9 -7.7 -18.9 42 43 A G S + 0 0 4 -2,-1.0 4,-2.4 16,-0.4 5,-0.2 -0.437 13.1 159.6-127.0 59.9 2.0 -5.3 -13.0 46 47 A P H > S+ 0 0 72 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.788 73.4 51.5 -54.4 -31.9 -1.2 -6.9 -14.4 47 48 A N H > S+ 0 0 20 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.923 110.0 45.4 -77.0 -43.9 -3.4 -4.9 -12.0 48 49 A M H >>S+ 0 0 1 2,-0.2 5,-2.5 1,-0.2 4,-1.3 0.872 112.6 54.6 -59.8 -39.4 -2.0 -1.4 -12.8 49 50 A V H <5S+ 0 0 22 -4,-2.4 3,-0.5 3,-0.2 6,-0.2 0.914 104.9 52.8 -58.0 -45.2 -2.3 -2.5 -16.5 50 51 A K H <5S+ 0 0 119 -4,-1.9 19,-2.8 1,-0.2 -1,-0.2 0.838 107.2 53.0 -60.3 -34.1 -6.0 -3.3 -16.0 51 52 A L H <5S- 0 0 2 -4,-1.5 19,-1.0 17,-0.2 -1,-0.2 0.780 130.4 -94.8 -70.5 -30.0 -6.4 0.2 -14.5 52 53 A G T X5S+ 0 0 0 -4,-1.3 4,-1.2 -3,-0.5 3,-0.5 0.524 76.5 140.9 124.7 17.9 -4.8 1.7 -17.6 53 54 A L H >> -J 62 0C 18 3,-2.2 3,-2.5 -2,-0.4 2,-0.2 -0.848 51.6 -56.4-141.5 169.9 6.7 0.2 -21.4 60 61 A K T 3 S- 0 0 103 1,-0.3 -17,-2.2 -26,-0.3 -18,-0.2 -0.338 127.6 -0.5 -61.4 119.4 8.3 -3.2 -21.3 61 62 A G T 3 S+ 0 0 51 -19,-0.3 2,-0.6 -2,-0.2 -16,-0.4 0.333 115.6 97.7 82.3 -6.0 5.7 -5.7 -20.0 62 63 A I B < +J 59 0C 0 -3,-2.5 -3,-2.2 -18,-0.1 2,-0.3 -0.908 51.9 169.5-121.0 101.2 3.2 -2.8 -19.6 63 64 A S - 0 0 68 -2,-0.6 -9,-0.6 -5,-0.2 -8,-0.3 -0.722 35.7 -98.6-113.0 160.1 0.7 -2.6 -22.5 64 65 A K - 0 0 130 -10,-0.5 2,-0.3 -2,-0.3 -1,-0.1 -0.272 33.1-144.0 -68.8 160.1 -2.5 -0.7 -23.2 65 66 A V - 0 0 41 -16,-0.1 -1,-0.0 1,-0.1 -15,-0.0 -0.960 15.5-129.8-125.0 149.0 -5.9 -2.4 -22.7 66 67 A E S S+ 0 0 208 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.891 103.5 27.7 -60.4 -40.9 -9.0 -1.9 -24.8 67 68 A K S S- 0 0 130 -3,-0.1 -1,-0.3 288,-0.0 290,-0.1 -0.739 78.5-161.3-130.5 81.3 -11.2 -1.2 -21.7 68 69 A P - 0 0 5 0, 0.0 288,-2.7 0, 0.0 -17,-0.2 -0.344 24.5-126.3 -63.3 143.4 -9.3 0.2 -18.7 69 70 A L S S+ 0 0 56 -19,-2.8 280,-0.3 286,-0.2 286,-0.2 0.844 86.4 2.1 -57.5 -37.3 -11.1 -0.2 -15.3 70 71 A G S S- 0 0 1 -19,-1.0 286,-0.5 -20,-0.2 278,-0.2 -0.637 94.3 -64.4-137.8-168.6 -10.9 3.6 -14.6 71 72 A Y E -C 347 0A 43 276,-2.8 276,-2.7 285,-0.2 2,-0.3 -0.510 49.0-167.3 -90.3 156.9 -9.7 6.9 -16.1 72 73 A Y E +Cd 346 358A 26 285,-1.7 287,-2.7 274,-0.2 2,-0.3 -0.986 23.2 122.5-149.0 149.7 -6.0 7.6 -16.8 73 74 A T E -C 345 0A 6 272,-1.9 272,-2.3 -2,-0.3 2,-0.3 -0.937 45.9 -99.6-174.6-168.7 -3.5 10.3 -17.6 74 75 A K E -C 344 0A 49 -2,-0.3 288,-2.6 270,-0.2 2,-0.4 -0.903 25.3-132.4-128.4 166.5 -0.3 11.8 -16.3 75 76 A M E -Ce 343 362A 0 268,-2.8 268,-1.9 -2,-0.3 2,-0.4 -0.942 6.2-146.1-121.5 141.9 0.4 15.0 -14.3 76 77 A Q - 0 0 51 286,-3.0 2,-0.4 -2,-0.4 289,-0.2 -0.860 22.0-124.6-102.6 137.7 3.0 17.7 -14.7 77 78 A E - 0 0 3 -2,-0.4 287,-0.1 264,-0.2 10,-0.0 -0.694 23.1-177.3 -81.4 129.5 4.6 19.4 -11.6 78 79 A K + 0 0 108 -2,-0.4 -1,-0.1 0, 0.0 286,-0.1 0.802 54.2 91.8 -93.6 -35.9 4.3 23.2 -11.6 79 80 A S S S- 0 0 0 15,-0.1 18,-0.2 7,-0.1 -2,-0.0 -0.121 83.6-114.9 -61.5 160.7 6.2 24.0 -8.4 80 81 A T S S+ 0 0 53 16,-1.9 17,-0.1 2,-0.0 -1,-0.1 0.876 88.3 62.5 -65.3 -45.0 9.9 24.8 -8.5 81 82 A G - 0 0 3 15,-0.5 15,-0.1 17,-0.1 20,-0.1 -0.315 60.9-149.6 -89.2 166.9 11.3 21.8 -6.6 82 83 A K + 0 0 23 18,-0.2 257,-0.1 -2,-0.1 246,-0.1 0.078 59.8 118.7-116.6 20.1 11.3 18.0 -7.1 83 84 A D S > S- 0 0 15 17,-0.1 4,-2.2 255,-0.1 5,-0.2 -0.300 76.8-104.9 -84.7 169.5 11.3 17.0 -3.4 84 85 A X H > S+ 0 0 22 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.903 117.6 48.8 -61.6 -45.4 8.7 15.1 -1.4 85 86 A M H > S+ 0 0 16 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.955 111.0 49.3 -63.2 -51.1 7.2 18.0 0.4 86 87 A T H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.927 113.8 47.0 -49.9 -52.9 6.8 20.2 -2.8 87 88 A G H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.902 115.7 43.2 -60.6 -47.0 5.1 17.3 -4.6 88 89 A H H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.903 113.5 50.9 -68.1 -42.8 2.7 16.4 -1.7 89 90 A W H <>S+ 0 0 0 -4,-3.3 5,-2.0 -5,-0.2 -2,-0.2 0.886 112.0 48.5 -62.5 -37.5 1.9 20.1 -1.0 90 91 A E H ><5S+ 0 0 0 -4,-2.5 3,-2.2 -5,-0.3 279,-0.3 0.938 106.5 56.1 -64.9 -46.3 1.1 20.6 -4.6 91 92 A I H 3<5S+ 0 0 0 -4,-2.4 278,-1.7 1,-0.3 -2,-0.2 0.858 107.3 51.2 -52.5 -39.4 -1.1 17.5 -4.7 92 93 A M T 3<5S- 0 0 0 -4,-1.8 131,-2.4 276,-0.1 -1,-0.3 0.100 134.2 -81.1 -93.7 23.1 -3.1 19.0 -1.9 93 94 A G T < 5S+ 0 0 3 -3,-2.2 290,-0.9 1,-0.3 289,-0.4 0.540 88.4 114.0 104.3 10.9 -3.7 22.4 -3.6 94 95 A L < - 0 0 11 -5,-2.0 2,-0.4 -8,-0.1 -1,-0.3 -0.505 51.1-141.4-105.3 173.3 -0.7 24.6 -3.2 95 96 A Y - 0 0 90 124,-0.3 2,-0.6 -2,-0.2 -9,-0.0 -0.983 17.8-157.9-130.2 127.4 2.0 26.1 -5.4 96 97 A I + 0 0 1 -2,-0.4 -16,-1.9 1,-0.1 -15,-0.5 -0.896 17.0 175.7-116.9 108.3 5.6 26.1 -4.0 97 98 A D + 0 0 95 -2,-0.6 -1,-0.1 -18,-0.2 -11,-0.0 0.799 66.9 68.1 -77.5 -32.6 8.0 28.7 -5.4 98 99 A T S S- 0 0 33 -18,-0.1 2,-0.2 -17,-0.0 -17,-0.1 -0.816 77.6-143.2 -99.9 117.7 10.9 27.9 -3.0 99 100 A P - 0 0 35 0, 0.0 2,-0.2 0, 0.0 90,-0.2 -0.492 14.7-118.8 -79.7 148.0 12.6 24.5 -3.4 100 101 A F - 0 0 14 -2,-0.2 2,-0.3 88,-0.1 -18,-0.2 -0.608 35.4-128.4 -75.4 146.3 13.9 22.5 -0.5 101 102 A Q - 0 0 73 88,-3.0 2,-0.3 -2,-0.2 90,-0.3 -0.752 13.3-152.9-103.2 145.1 17.6 21.9 -0.8 102 103 A V - 0 0 41 -2,-0.3 54,-0.1 54,-0.1 52,-0.1 -0.883 7.6-151.3-112.5 151.8 19.6 18.6 -0.6 103 104 A F > + 0 0 22 52,-0.4 3,-2.1 50,-0.4 49,-0.1 -0.574 25.2 163.8-129.3 69.5 23.2 18.5 0.6 104 105 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.747 87.0 42.5 -60.3 -24.1 25.3 15.7 -0.9 105 106 A E T 3 S- 0 0 147 1,-0.4 2,-0.1 22,-0.1 -2,-0.0 0.285 122.3-102.5-102.1 10.6 28.5 17.5 0.1 106 107 A G < - 0 0 10 -3,-2.1 -1,-0.4 47,-0.1 45,-0.1 -0.367 54.2 -44.3 92.8-179.1 27.3 18.5 3.6 107 108 A F - 0 0 8 1,-0.1 81,-0.1 -2,-0.1 43,-0.0 -0.522 62.2 -92.7 -93.9 152.1 26.1 21.8 4.9 108 109 A P >> - 0 0 39 0, 0.0 4,-1.5 0, 0.0 3,-0.6 -0.318 31.0-124.1 -60.9 142.7 27.5 25.3 4.3 109 110 A K H 3> S+ 0 0 136 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.868 108.5 64.6 -51.9 -42.1 30.0 26.5 7.0 110 111 A E H 3> S+ 0 0 118 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.884 103.2 45.5 -51.6 -48.1 27.8 29.6 7.6 111 112 A L H <> S+ 0 0 4 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.916 115.7 45.4 -62.7 -46.3 24.8 27.6 8.8 112 113 A L H X S+ 0 0 12 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.885 110.1 54.8 -70.3 -38.0 26.9 25.4 11.1 113 114 A D H X S+ 0 0 66 -4,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.926 109.1 48.0 -57.0 -48.3 28.8 28.4 12.5 114 115 A E H X S+ 0 0 90 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.892 110.0 52.8 -61.1 -40.2 25.6 30.1 13.4 115 116 A L H X S+ 0 0 3 -4,-2.0 4,-1.3 1,-0.2 6,-0.3 0.920 110.1 47.7 -61.0 -43.4 24.4 26.8 15.1 116 117 A E H X>S+ 0 0 70 -4,-2.5 4,-2.8 1,-0.2 5,-0.7 0.918 111.9 50.6 -59.6 -43.5 27.6 26.6 17.2 117 118 A E H <5S+ 0 0 151 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.822 111.8 45.7 -70.9 -32.2 27.2 30.3 18.2 118 119 A K H <5S+ 0 0 129 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.719 123.9 34.1 -80.6 -19.7 23.6 30.0 19.3 119 120 A T H <5S- 0 0 31 -4,-1.3 -2,-0.2 -3,-0.3 -3,-0.2 0.679 93.0-130.6-108.4 -23.4 24.2 26.7 21.2 120 121 A G T <5S+ 0 0 74 -4,-2.8 2,-0.3 1,-0.3 -3,-0.2 0.693 70.6 118.5 72.5 21.8 27.8 27.1 22.6 121 122 A R < - 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