==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 16-NOV-11 3UO0 . COMPND 2 MOLECULE: PHOSPHOPENTOMUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR T.M.IVERSON,W.R.BIRMINGHAM,T.D.PANOSIAN,D.P.NANNEMANN,B.O.BA . 1171 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46213.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 784 67.0 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 . 89 7.6 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 . 6 0.5 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 . 85 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 105 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 285 24.3 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 9 0 3 6 6 0 3 3 4 2 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 3 0 6 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 0 7 5 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 0 121 0, 0.0 375,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 141.9 -21.6 13.9 -2.6 2 3 A K + 0 0 96 373,-0.5 2,-0.4 1,-0.2 374,-0.1 0.914 360.0 29.1 -70.3 -45.9 -20.6 11.9 -5.7 3 4 A Y - 0 0 6 372,-0.2 -1,-0.2 1,-0.1 316,-0.2 -0.970 60.9-163.4-119.0 132.8 -18.2 9.7 -3.7 4 5 A K S S+ 0 0 62 314,-1.7 271,-1.4 -2,-0.4 2,-0.4 0.879 83.2 25.0 -75.9 -41.4 -18.5 8.9 -0.0 5 6 A R E -ab 275 319A 7 313,-1.3 315,-2.2 269,-0.2 2,-0.5 -0.983 63.4-163.2-129.4 136.7 -14.9 7.8 0.3 6 7 A I E -ab 276 320A 0 269,-2.4 271,-2.8 -2,-0.4 2,-0.7 -0.984 6.1-161.5-118.7 122.8 -11.7 8.7 -1.7 7 8 A F E -ab 277 321A 1 313,-3.5 315,-3.3 -2,-0.5 2,-0.5 -0.908 9.8-169.5-104.9 108.8 -8.7 6.4 -1.4 8 9 A L E -ab 278 322A 0 269,-3.0 271,-3.0 -2,-0.7 2,-0.5 -0.891 0.6-168.7-105.2 122.6 -5.5 8.2 -2.6 9 10 A V E -ab 279 323A 3 313,-3.7 315,-2.7 -2,-0.5 2,-0.7 -0.946 7.0-161.9-115.1 119.2 -2.4 6.2 -3.0 10 11 A V E -ab 280 324A 0 269,-3.2 271,-2.7 -2,-0.5 2,-1.2 -0.906 6.2-158.4 -98.4 111.1 1.0 7.8 -3.6 11 12 A M E > -a 281 0A 1 313,-3.2 3,-1.9 -2,-0.7 315,-0.3 -0.801 35.8-125.1 -81.9 96.4 3.5 5.4 -5.0 12 13 A D T 3 S- 0 0 0 -2,-1.2 3,-0.1 269,-1.1 313,-0.1 -0.235 78.1 -7.3 -60.3 123.9 6.5 7.4 -3.8 13 14 A S T 3 S+ 0 0 0 1,-0.2 2,-1.9 314,-0.1 316,-1.0 0.459 86.2 141.6 76.7 6.3 9.0 8.4 -6.6 14 15 A V < + 0 0 1 -3,-1.9 314,-0.2 314,-0.2 -1,-0.2 -0.521 30.0 177.7 -84.4 77.5 7.3 6.3 -9.3 15 16 A G - 0 0 0 -2,-1.9 18,-2.0 328,-0.1 328,-0.2 -0.359 29.4-148.7 -81.6 160.9 7.7 8.7 -12.2 16 17 A I - 0 0 1 326,-2.9 327,-0.1 1,-0.4 2,-0.1 -0.065 66.4 -40.6-123.6 32.1 6.7 8.0 -15.8 17 18 A G S S- 0 0 10 325,-0.3 325,-3.2 2,-0.0 -1,-0.4 -0.142 80.9 -51.0 120.8 147.3 9.3 9.9 -17.9 18 19 A E B -I 341 0B 80 12,-1.9 323,-0.3 323,-0.3 10,-0.1 -0.050 53.8-125.7 -48.9 137.9 11.2 13.3 -17.9 19 20 A A > - 0 0 6 321,-2.2 3,-1.7 8,-0.1 4,-0.2 -0.345 28.7-101.9 -78.2 164.2 9.2 16.5 -17.5 20 21 A P T 3 S+ 0 0 84 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.750 124.6 45.9 -58.7 -25.2 9.4 19.4 -20.0 21 22 A D T > S+ 0 0 34 1,-0.2 3,-0.9 2,-0.1 4,-0.5 0.063 76.2 117.7-105.6 24.0 11.7 21.3 -17.5 22 23 A A G X > + 0 0 1 -3,-1.7 5,-2.8 1,-0.2 3,-0.8 0.760 64.3 66.0 -63.3 -29.2 14.0 18.3 -16.7 23 24 A E G > 5S+ 0 0 146 -3,-0.3 3,-1.1 1,-0.2 -1,-0.2 0.838 93.3 59.9 -63.9 -35.3 17.1 19.9 -18.1 24 25 A Q G < 5S+ 0 0 157 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.766 110.1 42.9 -62.1 -27.9 17.1 22.6 -15.4 25 26 A F G < 5S- 0 0 52 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.392 117.3-111.0 -98.3 -1.2 17.4 19.9 -12.8 26 27 A G T < 5S+ 0 0 56 -3,-1.1 -3,-0.2 -4,-0.3 -2,-0.1 0.878 81.6 126.7 67.6 41.2 20.0 17.9 -14.7 27 28 A D > < + 0 0 1 -5,-2.8 3,-1.3 -6,-0.1 2,-0.2 -0.083 21.6 145.4-124.0 32.6 17.4 15.1 -15.3 28 29 A L T 3 S+ 0 0 97 1,-0.2 3,-0.1 -6,-0.2 -7,-0.0 -0.519 72.6 21.5 -69.9 137.4 17.5 14.6 -19.1 29 30 A G T 3 S+ 0 0 41 1,-0.3 -1,-0.2 -2,-0.2 2,-0.2 0.493 87.9 149.6 82.7 4.9 16.9 11.0 -20.0 30 31 A S < + 0 0 1 -3,-1.3 -12,-1.9 310,-0.1 -1,-0.3 -0.508 9.7 156.6 -74.9 139.6 15.2 10.2 -16.7 31 32 A D > - 0 0 28 -14,-0.2 4,-2.0 -2,-0.2 5,-0.3 -0.629 16.4-175.1-167.4 92.0 12.5 7.5 -16.8 32 33 A T H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -16,-0.2 0.987 85.9 30.0 -62.3 -67.8 11.7 5.6 -13.6 33 34 A I H > S+ 0 0 4 -18,-2.0 4,-2.9 1,-0.2 5,-0.2 0.887 120.3 55.7 -61.1 -41.3 9.2 3.0 -14.6 34 35 A G H > S+ 0 0 6 2,-0.2 4,-1.7 1,-0.2 26,-0.2 0.875 109.7 43.0 -60.6 -44.5 10.6 2.7 -18.1 35 36 A H H X S+ 0 0 39 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.845 114.4 51.4 -72.6 -35.4 14.2 1.9 -17.0 36 37 A I H X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.3 -2,-0.2 0.935 109.8 50.3 -62.0 -47.3 12.9 -0.5 -14.4 37 38 A A H <>S+ 0 0 0 -4,-2.9 5,-2.8 1,-0.2 4,-0.3 0.858 111.5 48.5 -59.6 -39.4 10.8 -2.3 -17.1 38 39 A E H ><5S+ 0 0 130 -4,-1.7 3,-0.8 3,-0.2 -1,-0.2 0.907 112.9 47.5 -65.9 -44.3 13.9 -2.5 -19.3 39 40 A H H 3<5S+ 0 0 86 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.866 111.8 49.9 -64.6 -38.4 16.1 -3.9 -16.5 40 41 A M T 3<5S- 0 0 33 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.507 109.2-123.2 -78.3 -4.9 13.4 -6.4 -15.5 41 42 A N T < 5S- 0 0 122 -3,-0.8 -3,-0.2 -4,-0.3 -2,-0.1 0.890 91.0 -3.9 58.3 43.1 13.0 -7.6 -19.1 42 43 A G S + 0 0 5 -2,-1.1 4,-1.8 16,-0.4 3,-0.3 -0.503 13.7 159.2-132.6 65.7 2.1 -5.5 -13.3 46 47 A P H > S+ 0 0 74 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.780 74.3 53.5 -62.6 -29.9 -1.1 -7.0 -14.8 47 48 A N H > S+ 0 0 22 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.867 109.2 46.4 -75.3 -38.5 -3.4 -5.1 -12.3 48 49 A M H >>S+ 0 0 1 -3,-0.3 5,-2.4 2,-0.2 4,-1.3 0.814 111.0 55.5 -68.3 -32.6 -2.0 -1.7 -13.1 49 50 A V H <5S+ 0 0 22 -4,-1.8 3,-0.3 3,-0.2 -2,-0.2 0.920 104.6 51.9 -62.8 -45.8 -2.3 -2.6 -16.8 50 51 A K H <5S+ 0 0 120 -4,-1.8 19,-2.9 1,-0.2 -1,-0.2 0.804 107.9 52.3 -61.8 -31.9 -6.0 -3.4 -16.3 51 52 A L H <5S- 0 0 2 -4,-1.2 19,-0.9 17,-0.2 -1,-0.2 0.797 128.8 -99.5 -72.3 -31.4 -6.4 0.1 -14.7 52 53 A G T X5S+ 0 0 0 -4,-1.3 4,-1.0 -3,-0.3 3,-0.3 0.659 74.0 141.9 119.5 28.1 -4.8 1.6 -17.8 53 54 A L H >> -J 62 0C 21 3,-2.1 3,-2.5 -2,-0.4 2,-0.1 -0.870 49.4 -59.2-136.7 167.4 6.6 0.3 -21.6 60 61 A K T 3 S+ 0 0 108 1,-0.3 -17,-2.3 -2,-0.3 -18,-0.2 -0.297 126.6 0.2 -58.0 117.9 8.3 -3.2 -21.6 61 62 A G T 3 S+ 0 0 49 -19,-0.3 2,-0.6 -2,-0.1 -16,-0.4 0.250 115.4 95.5 86.2 -11.4 5.8 -5.7 -20.2 62 63 A I B < +J 59 0C 0 -3,-2.5 -3,-2.1 -18,-0.1 2,-0.2 -0.919 54.8 172.8-115.5 103.0 3.2 -2.9 -19.7 63 64 A S - 0 0 69 -2,-0.6 -9,-0.6 -5,-0.2 -8,-0.3 -0.702 32.8-103.2-109.0 159.9 0.8 -2.8 -22.7 64 65 A K - 0 0 122 -10,-0.4 2,-0.3 -2,-0.2 -14,-0.1 -0.440 31.1-142.9 -77.5 155.3 -2.3 -0.8 -23.3 65 66 A V - 0 0 47 -16,-0.2 -1,-0.0 -2,-0.1 -15,-0.0 -0.881 15.5-129.6-119.0 153.9 -5.8 -2.3 -23.0 66 67 A E S S+ 0 0 206 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.895 103.6 26.6 -65.6 -42.6 -9.0 -1.7 -25.1 67 68 A K S S- 0 0 139 -3,-0.0 -1,-0.3 288,-0.0 290,-0.1 -0.796 79.2-162.0-128.3 87.2 -11.2 -1.1 -22.0 68 69 A P - 0 0 6 0, 0.0 288,-2.2 0, 0.0 -17,-0.2 -0.391 25.1-124.5 -67.4 147.0 -9.3 0.2 -18.9 69 70 A L S S+ 0 0 57 -19,-2.9 280,-0.3 286,-0.2 286,-0.2 0.880 86.6 1.8 -59.0 -42.6 -11.1 -0.2 -15.6 70 71 A G S S- 0 0 1 -19,-0.9 286,-0.5 -20,-0.2 278,-0.3 -0.600 94.1 -62.4-132.2-167.5 -10.8 3.5 -14.8 71 72 A Y E -C 347 0A 38 276,-2.8 276,-2.7 285,-0.2 2,-0.3 -0.514 48.5-162.8 -86.5 152.9 -9.6 6.9 -16.2 72 73 A Y E +Cd 346 358A 32 285,-1.7 287,-2.6 274,-0.2 2,-0.3 -0.978 24.6 119.7-142.5 146.5 -5.9 7.6 -17.0 73 74 A T E -C 345 0A 9 272,-1.9 272,-2.6 -2,-0.3 2,-0.3 -0.947 45.7-100.9-175.1-174.1 -3.5 10.4 -17.7 74 75 A K E -C 344 0A 49 -2,-0.3 288,-2.1 270,-0.2 2,-0.4 -0.904 24.9-133.5-124.2 160.4 -0.2 11.9 -16.3 75 76 A M E -Ce 343 362A 0 268,-2.9 268,-1.9 -2,-0.3 2,-0.4 -0.896 6.9-145.4-115.4 143.6 0.5 15.0 -14.2 76 77 A Q - 0 0 53 286,-3.2 2,-0.4 -2,-0.4 289,-0.2 -0.902 21.1-126.3-105.1 132.5 3.0 17.8 -14.6 77 78 A E - 0 0 3 -2,-0.4 287,-0.1 264,-0.2 10,-0.1 -0.648 23.6-177.3 -78.9 129.4 4.6 19.4 -11.6 78 79 A K + 0 0 118 -2,-0.4 -1,-0.1 0, 0.0 286,-0.1 0.753 53.0 91.2 -98.5 -30.2 4.3 23.2 -11.5 79 80 A S S S- 0 0 0 15,-0.1 18,-0.2 7,-0.1 -2,-0.0 -0.195 84.0-114.1 -66.2 160.1 6.2 24.0 -8.3 80 81 A T S S+ 0 0 55 16,-1.7 17,-0.1 2,-0.0 2,-0.1 0.845 89.4 67.2 -65.6 -38.1 10.0 24.8 -8.4 81 82 A G - 0 0 2 15,-0.5 -2,-0.1 1,-0.1 15,-0.1 -0.372 57.3-156.5 -90.8 163.2 11.1 21.7 -6.4 82 83 A K + 0 0 27 18,-0.2 246,-0.1 -2,-0.1 257,-0.1 0.099 60.6 116.4-116.6 17.1 11.2 18.0 -7.0 83 84 A D S > S- 0 0 15 17,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.233 78.7-104.3 -82.8 173.4 11.3 17.1 -3.3 84 85 A X H > S+ 0 0 27 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.871 117.3 50.4 -67.6 -41.4 8.7 15.2 -1.2 85 86 A M H > S+ 0 0 14 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.958 111.9 48.2 -61.3 -52.6 7.3 18.2 0.6 86 87 A T H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.913 113.3 47.1 -53.6 -51.7 6.8 20.1 -2.7 87 88 A G H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.940 117.0 41.3 -57.3 -53.8 5.1 17.2 -4.5 88 89 A H H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.843 114.3 51.5 -66.3 -38.2 2.7 16.3 -1.6 89 90 A W H <>S+ 0 0 0 -4,-2.9 5,-1.6 -5,-0.2 -1,-0.2 0.871 111.6 48.1 -68.5 -36.7 1.9 19.9 -0.8 90 91 A E H ><5S+ 0 0 0 -4,-2.2 3,-2.2 -5,-0.3 279,-0.3 0.924 105.5 58.3 -66.4 -45.4 1.0 20.6 -4.5 91 92 A I H 3<5S+ 0 0 0 -4,-2.3 278,-1.4 1,-0.3 -2,-0.2 0.858 105.6 52.0 -50.4 -39.0 -1.1 17.4 -4.7 92 93 A M T 3<5S- 0 0 0 -4,-1.4 131,-2.4 276,-0.1 -1,-0.3 0.236 134.6 -80.7 -90.5 12.8 -3.2 18.9 -1.8 93 94 A G T < 5S+ 0 0 4 -3,-2.2 290,-0.9 1,-0.3 289,-0.4 0.608 88.8 115.8 110.0 18.4 -3.8 22.3 -3.6 94 95 A L < - 0 0 10 -5,-1.6 2,-0.4 -8,-0.1 -1,-0.3 -0.613 51.1-140.7-110.6 168.6 -0.8 24.4 -3.0 95 96 A Y - 0 0 91 124,-0.3 2,-0.6 -2,-0.2 -9,-0.0 -0.992 16.6-160.8-126.9 125.8 2.0 26.1 -5.1 96 97 A I + 0 0 1 -2,-0.4 -16,-1.7 1,-0.1 -15,-0.5 -0.914 16.5 173.8-113.4 112.8 5.5 26.0 -3.7 97 98 A D + 0 0 95 -2,-0.6 -1,-0.1 -18,-0.2 -11,-0.0 0.787 67.5 68.0 -84.4 -30.9 8.0 28.5 -5.1 98 99 A T S S- 0 0 39 -18,-0.1 -1,-0.1 -17,-0.0 2,-0.1 -0.832 77.9-146.4-100.2 111.1 10.9 27.8 -2.7 99 100 A P - 0 0 32 0, 0.0 2,-0.3 0, 0.0 90,-0.2 -0.380 16.0-114.3 -76.9 151.3 12.4 24.3 -3.1 100 101 A F - 0 0 12 -2,-0.1 -18,-0.2 88,-0.1 2,-0.2 -0.695 36.9-128.1 -84.4 137.1 13.8 22.2 -0.3 101 102 A Q - 0 0 72 88,-2.7 90,-0.3 -2,-0.3 2,-0.3 -0.568 13.4-153.6 -95.1 146.6 17.5 21.6 -0.6 102 103 A V - 0 0 61 -2,-0.2 54,-0.1 54,-0.1 52,-0.1 -0.835 7.5-151.1-109.9 155.8 19.7 18.4 -0.5 103 104 A F > + 0 0 15 50,-0.4 3,-1.2 52,-0.4 49,-0.1 -0.630 26.8 160.4-133.1 75.2 23.3 18.4 0.7 104 105 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.690 87.1 41.0 -70.3 -19.5 25.5 15.7 -1.0 105 106 A E T 3 S- 0 0 177 1,-0.5 2,-0.1 22,-0.1 -2,-0.0 0.249 124.9 -98.8-107.2 8.7 28.7 17.5 -0.1 106 107 A G < - 0 0 11 -3,-1.2 -1,-0.5 2,-0.0 21,-0.1 -0.350 54.3 -46.1 98.6 176.7 27.5 18.5 3.4 107 108 A F - 0 0 6 -2,-0.1 81,-0.1 1,-0.1 -4,-0.0 -0.564 67.2 -94.3 -83.9 147.7 26.0 21.7 4.8 108 109 A P >> - 0 0 42 0, 0.0 4,-1.5 0, 0.0 3,-0.6 -0.237 29.4-118.6 -61.0 149.7 27.5 25.1 4.1 109 110 A K H 3> S+ 0 0 140 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.846 110.0 62.6 -55.9 -40.2 30.1 26.6 6.5 110 111 A E H 3> S+ 0 0 124 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.870 104.8 45.5 -55.7 -44.5 27.8 29.6 7.2 111 112 A L H <> S+ 0 0 3 -3,-0.6 4,-1.7 2,-0.2 -1,-0.2 0.923 114.7 46.6 -66.1 -47.2 25.0 27.5 8.7 112 113 A L H X S+ 0 0 18 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.862 110.8 52.4 -65.8 -38.9 27.3 25.3 10.9 113 114 A D H X S+ 0 0 57 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.886 110.0 48.5 -63.0 -41.6 29.2 28.3 12.2 114 115 A E H X S+ 0 0 69 -4,-1.6 4,-1.2 -5,-0.2 -2,-0.2 0.828 111.6 49.8 -68.9 -33.8 25.9 30.0 13.2 115 116 A L H X S+ 0 0 2 -4,-1.7 4,-1.8 2,-0.2 6,-0.3 0.873 111.0 49.6 -70.6 -39.4 24.8 26.8 14.9 116 117 A E H X>S+ 0 0 68 -4,-2.3 4,-2.6 1,-0.2 5,-0.6 0.914 111.1 49.5 -61.7 -45.0 28.1 26.6 16.8 117 118 A E H <5S+ 0 0 144 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.783 114.7 44.4 -66.8 -29.9 27.9 30.2 17.9 118 119 A K H <5S+ 0 0 124 -4,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.770 123.2 33.1 -85.8 -29.7 24.3 29.7 19.2 119 120 A T H <5S- 0 0 31 -4,-1.8 -2,-0.2 2,-0.2 -3,-0.2 0.752 94.0-131.1 -98.0 -30.7 24.8 26.4 21.0 120 121 A G T <5 + 0 0 69 -4,-2.6 2,-0.3 1,-0.3 -3,-0.1 0.775 69.2 114.3 79.2 29.2 28.4 26.7 22.2 121 122 A R < - 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