==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 04-AUG-05 2AL1 . COMPND 2 MOLECULE: ENOLASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR P.A.SIMS,A.L.MENEFEE,T.M.LARSEN,S.O.MANSOORABADI,G.H.REED . 867 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28987.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 644 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 62 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.6 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 . 2 0.2 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 . 54 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 282 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.4 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 2 0 0 1 5 5 1 0 2 2 2 2 0 2 1 1 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 6 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 PARALLEL BRIDGES PER LADDER . 7 2 0 2 2 2 0 2 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 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 1 A A 0 0 65 0, 0.0 2,-0.7 0, 0.0 25,-0.4 0.000 360.0 360.0 360.0 140.8 -3.2 10.0 -3.8 2 2 A V + 0 0 6 1,-0.2 23,-0.2 23,-0.2 78,-0.1 -0.721 360.0 171.5 -81.6 113.5 -1.1 11.8 -1.1 3 3 A S + 0 0 80 21,-2.2 2,-0.3 -2,-0.7 -1,-0.2 0.679 62.5 17.0 -95.7 -20.7 -3.6 13.8 1.0 4 4 A K E -A 24 0A 112 20,-1.1 20,-2.8 72,-0.0 2,-0.4 -0.980 47.8-169.8-158.2 134.8 -1.2 14.8 3.7 5 5 A V E +A 23 0A 9 -2,-0.3 2,-0.4 18,-0.2 18,-0.2 -0.999 24.2 171.7-124.4 131.3 2.5 15.1 4.6 6 6 A Y E -A 22 0A 62 16,-2.3 16,-3.5 -2,-0.4 2,-0.4 -0.999 16.3-161.6-144.8 135.8 3.3 15.9 8.3 7 7 A A E +A 21 0A 1 -2,-0.4 2,-0.3 14,-0.2 14,-0.2 -0.931 12.0 172.9-119.8 145.3 6.5 16.0 10.4 8 8 A R E -A 20 0A 16 12,-2.3 12,-2.9 -2,-0.4 2,-0.4 -0.937 34.8-102.8-136.6 162.6 6.9 15.9 14.2 9 9 A S E +A 19 0A 27 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.763 43.5 165.5 -80.9 131.7 9.7 15.7 16.7 10 10 A V E -A 18 0A 0 8,-2.3 8,-2.5 -2,-0.4 2,-0.4 -0.824 34.9 -98.7-130.9-179.3 10.3 12.3 18.3 11 11 A Y E -A 17 0A 7 -2,-0.3 832,-0.1 6,-0.2 2,-0.1 -0.842 25.0-147.3-110.9 137.1 13.2 10.9 20.4 12 12 A D > - 0 0 1 4,-2.8 3,-1.8 -2,-0.4 366,-0.2 -0.183 44.0 -83.3 -86.3-174.0 16.1 8.7 19.2 13 13 A S T 3 S+ 0 0 0 364,-2.2 822,-2.3 1,-0.3 365,-0.1 0.560 129.8 51.7 -76.6 -9.0 17.8 6.0 21.2 14 14 A R T 3 S- 0 0 38 363,-0.2 -1,-0.3 820,-0.2 820,-0.1 0.370 121.0-106.4 -98.8 -0.4 20.2 8.5 22.9 15 15 A G S < S+ 0 0 0 -3,-1.8 -2,-0.1 1,-0.3 609,-0.1 0.729 77.9 132.2 78.7 24.0 17.2 10.7 23.9 16 16 A N - 0 0 22 1,-0.1 -4,-2.8 41,-0.0 -1,-0.3 -0.840 61.9-101.1-104.0 147.6 17.9 13.4 21.3 17 17 A P E +A 11 0A 1 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.258 44.4 169.8 -60.4 146.6 15.2 14.8 19.1 18 18 A T E -A 10 0A 2 -8,-2.5 -8,-2.3 -6,-0.1 2,-0.4 -0.940 36.3 -86.6-148.0 176.5 14.9 13.7 15.5 19 19 A V E -A 9 0A 0 -2,-0.3 15,-2.5 -10,-0.2 2,-0.5 -0.693 31.7-170.5 -94.2 128.8 12.4 14.0 12.6 20 20 A E E -AB 8 33A 0 -12,-2.9 -12,-2.3 -2,-0.4 2,-0.4 -0.964 8.5-161.5-111.1 131.6 9.4 11.8 12.1 21 21 A V E -AB 7 32A 0 11,-3.0 11,-2.4 -2,-0.5 2,-0.5 -0.924 6.1-164.3-113.4 136.6 7.4 12.0 8.9 22 22 A E E -AB 6 31A 27 -16,-3.5 -16,-2.3 -2,-0.4 2,-0.5 -0.986 4.1-168.4-116.1 126.3 3.8 10.7 8.3 23 23 A L E -AB 5 30A 0 7,-2.8 7,-2.8 -2,-0.5 2,-0.5 -0.959 10.4-154.5-112.0 123.0 2.6 10.4 4.7 24 24 A T E +AB 4 29A 30 -20,-2.8 -21,-2.2 -2,-0.5 -20,-1.1 -0.854 22.5 155.8-106.5 129.6 -1.2 9.8 4.3 25 25 A T E > - B 0 28A 12 3,-2.5 3,-1.3 -2,-0.5 -23,-0.2 -0.734 61.8 -87.2-126.9-176.5 -2.8 8.1 1.3 26 26 A E T 3 S+ 0 0 124 -25,-0.4 3,-0.1 1,-0.2 -24,-0.1 0.630 127.3 62.0 -66.3 -12.0 -6.1 6.2 0.8 27 27 A K T 3 S- 0 0 96 1,-0.3 2,-0.3 93,-0.0 -1,-0.2 0.577 118.6-100.5 -90.4 -10.9 -4.1 3.2 1.9 28 28 A G E < -B 25 0A 27 -3,-1.3 -3,-2.5 2,-0.1 2,-0.5 -0.896 54.6 -31.0 132.5-155.4 -3.5 4.7 5.3 29 29 A V E -B 24 0A 84 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.896 48.4-162.0-111.8 123.2 -0.8 6.5 7.3 30 30 A F E -B 23 0A 24 -7,-2.8 -7,-2.8 -2,-0.5 2,-0.4 -0.902 6.7-162.1-116.1 126.2 2.9 5.7 6.6 31 31 A R E +B 22 0A 81 -2,-0.5 2,-0.4 -9,-0.2 -9,-0.2 -0.869 12.3 174.3-116.9 131.1 5.6 6.7 9.1 32 32 A S E -B 21 0A 0 -11,-2.4 -11,-3.0 -2,-0.4 2,-0.4 -0.998 13.2-155.5-133.3 141.6 9.3 7.0 8.7 33 33 A I E -B 20 0A 5 -2,-0.4 -13,-0.2 -13,-0.2 345,-0.1 -0.943 15.0-129.0-121.3 139.6 11.9 8.2 11.3 34 34 A V - 0 0 1 -15,-2.5 -15,-0.1 -2,-0.4 2,-0.1 -0.706 20.9-146.3 -88.2 125.7 15.3 9.8 10.6 35 35 A P - 0 0 11 0, 0.0 2,-0.4 0, 0.0 342,-0.2 -0.266 10.1-140.7 -81.0 175.6 18.3 8.3 12.4 36 36 A S B -C 376 0B 5 340,-2.9 340,-1.8 -2,-0.1 2,-0.1 -0.981 4.9-139.7-147.4 129.5 21.3 10.3 13.6 37 37 A G - 0 0 10 -2,-0.4 3,-0.2 338,-0.2 337,-0.1 -0.356 10.7-168.5 -80.0 160.7 25.1 9.6 13.6 38 38 A A S S+ 0 0 40 1,-0.1 2,-2.2 -2,-0.1 -1,-0.1 0.664 92.9 44.8-103.6 -61.5 27.7 10.4 16.3 39 39 A S S S+ 0 0 5 2,-0.0 2,-0.4 0, 0.0 -1,-0.1 -0.512 89.2 177.4 -81.6 71.8 30.9 9.7 14.3 40 40 A T - 0 0 62 -2,-2.2 2,-0.0 -3,-0.2 281,-0.0 -0.649 30.6-117.4 -83.4 130.1 29.5 11.6 11.3 41 41 A G > - 0 0 5 -2,-0.4 3,-1.7 1,-0.1 -1,-0.1 -0.337 20.0-123.7 -60.3 143.9 31.7 12.0 8.2 42 42 A V T 3 S+ 0 0 99 1,-0.3 -1,-0.1 279,-0.1 -2,-0.0 0.679 110.5 54.9 -66.4 -14.9 32.5 15.6 7.4 43 43 A H T 3 S+ 0 0 57 278,-0.3 -1,-0.3 2,-0.0 3,-0.1 0.295 79.9 122.5-104.2 9.3 31.0 15.1 3.9 44 44 A E S < S- 0 0 26 -3,-1.7 305,-0.2 1,-0.1 3,-0.1 -0.354 74.1 -92.7 -66.8 150.6 27.6 13.8 5.0 45 45 A A - 0 0 7 303,-2.8 2,-0.2 279,-0.2 57,-0.2 -0.256 63.8 -74.3 -55.2 152.1 24.4 15.7 3.9 46 46 A L - 0 0 67 55,-2.5 61,-2.5 303,-0.1 2,-0.8 -0.330 35.5-159.1 -66.3 120.2 23.3 18.3 6.4 47 47 A E - 0 0 54 -2,-0.2 2,-0.6 60,-0.2 -1,-0.1 -0.886 25.9-140.4 -85.6 106.6 21.7 17.2 9.6 48 48 A M + 0 0 31 -2,-0.8 16,-0.3 57,-0.1 2,-0.3 -0.606 25.5 179.8 -81.9 116.6 19.8 20.4 10.5 49 49 A R - 0 0 62 -2,-0.6 12,-0.2 1,-0.1 10,-0.1 -0.844 30.3-134.7-115.2 152.7 19.9 21.2 14.2 50 50 A D - 0 0 32 10,-2.4 9,-0.2 -2,-0.3 3,-0.1 0.882 21.1-152.0 -77.1 -39.7 18.4 24.2 15.9 51 51 A G + 0 0 47 7,-1.8 2,-0.9 1,-0.3 8,-0.1 0.692 39.7 149.6 71.1 19.1 21.3 25.1 18.1 52 52 A D > - 0 0 75 3,-0.2 3,-2.1 1,-0.2 6,-0.9 -0.770 34.5-160.5 -79.7 105.4 19.1 26.6 20.8 53 53 A K T 3 S+ 0 0 193 -2,-0.9 4,-0.3 1,-0.3 -1,-0.2 0.692 86.2 61.9 -65.5 -16.7 21.1 25.9 23.9 54 54 A S T 3 S+ 0 0 69 1,-0.1 2,-0.4 3,-0.1 -1,-0.3 0.450 102.8 55.1 -91.0 -1.6 18.0 26.4 26.0 55 55 A K S X >S- 0 0 68 -3,-2.1 3,-2.2 1,-0.1 5,-0.6 -0.989 122.7 -17.4-134.9 126.4 16.1 23.5 24.4 56 56 A W G > 5S- 0 0 30 -2,-0.4 3,-1.9 1,-0.3 -2,-0.1 0.801 116.0 -66.2 58.4 33.3 17.3 19.9 24.0 57 57 A M G 3 5S- 0 0 72 -4,-0.3 -1,-0.3 1,-0.3 -4,-0.2 0.755 96.9 -58.1 61.3 22.1 20.9 20.7 24.7 58 58 A G G < 5S+ 0 0 11 -3,-2.2 -7,-1.8 -6,-0.9 -1,-0.3 0.520 118.5 110.8 87.8 7.6 20.8 22.7 21.5 59 59 A K T < 5 + 0 0 94 -3,-1.9 -3,-0.1 -4,-0.3 -2,-0.1 0.085 38.3 141.1-110.0 24.8 19.8 19.6 19.4 60 60 A G < - 0 0 0 -5,-0.6 -10,-2.4 -8,-0.2 -9,-0.2 -0.221 40.1-157.8 -59.8 152.9 16.3 20.5 18.5 61 61 A V > + 0 0 0 -12,-0.2 4,-2.8 -43,-0.1 5,-0.2 -0.008 54.6 120.8-120.7 28.8 15.0 19.7 15.0 62 62 A L H > S+ 0 0 91 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.875 75.3 51.1 -59.9 -39.8 12.2 22.3 14.9 63 63 A H H > S+ 0 0 105 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 111.8 46.7 -67.1 -41.5 13.7 24.0 11.8 64 64 A A H > S+ 0 0 0 -16,-0.3 4,-1.5 2,-0.2 -2,-0.2 0.929 113.4 48.9 -62.0 -46.4 13.9 20.7 10.0 65 65 A V H X S+ 0 0 16 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.900 110.1 52.0 -59.3 -41.2 10.4 19.8 11.0 66 66 A K H X>S+ 0 0 117 -4,-2.5 4,-2.9 1,-0.2 5,-0.5 0.881 103.6 57.2 -64.3 -38.3 9.2 23.3 9.9 67 67 A N H X>S+ 0 0 31 -4,-2.0 5,-2.7 1,-0.2 4,-1.0 0.852 109.8 46.0 -63.3 -34.0 10.8 22.7 6.5 68 68 A V H <>S+ 0 0 0 -4,-1.5 5,-3.5 3,-0.2 -2,-0.2 0.966 119.3 38.4 -66.4 -52.5 8.7 19.6 6.1 69 69 A N H <5S+ 0 0 41 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.794 128.0 30.3 -75.2 -28.0 5.4 21.1 7.2 70 70 A D H <5S+ 0 0 94 -4,-2.9 -1,-0.2 -5,-0.2 -3,-0.2 0.662 133.5 18.7-110.1 -20.0 5.7 24.6 5.6 71 71 A V T X S+ 0 0 71 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.923 119.4 43.8 -60.2 -43.4 2.3 21.9 0.6 75 75 A A H X S+ 0 0 35 -4,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.886 115.5 48.2 -67.1 -40.0 4.2 21.6 -2.6 76 76 A F H X>S+ 0 0 0 -4,-3.1 4,-2.1 2,-0.2 5,-0.6 0.914 113.2 46.1 -70.4 -43.6 4.3 17.8 -2.4 77 77 A V H <5S+ 0 0 46 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.900 112.4 52.3 -64.6 -40.4 0.6 17.4 -1.6 78 78 A K H <5S+ 0 0 188 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.923 112.2 45.4 -57.5 -45.5 -0.2 19.8 -4.4 79 79 A A H <5S- 0 0 52 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.846 86.2-160.2 -69.0 -36.3 2.0 17.8 -6.9 80 80 A N T <5 - 0 0 73 -4,-2.1 2,-0.2 1,-0.2 -3,-0.1 0.937 15.2-164.0 47.7 53.2 0.6 14.4 -5.8 81 81 A I < - 0 0 31 -5,-0.6 -1,-0.2 1,-0.1 2,-0.1 -0.483 31.9 -96.2 -63.0 132.7 3.5 12.6 -7.3 82 82 A D > - 0 0 71 -2,-0.2 3,-1.6 1,-0.2 7,-0.3 -0.310 29.9-146.2 -45.5 114.6 2.9 8.9 -7.8 83 83 A V T 3 S+ 0 0 8 1,-0.3 38,-0.3 -2,-0.1 -1,-0.2 0.780 98.2 62.7 -65.3 -23.8 4.4 7.3 -4.6 84 84 A K T 3 S+ 0 0 66 1,-0.2 2,-1.6 37,-0.1 -1,-0.3 0.747 87.2 78.1 -68.6 -23.9 5.4 4.3 -6.7 85 85 A D <> + 0 0 75 -3,-1.6 4,-2.5 1,-0.2 3,-0.2 -0.588 58.2 168.3 -87.0 76.4 7.6 6.6 -8.7 86 86 A Q H > S+ 0 0 5 -2,-1.6 4,-2.5 1,-0.2 5,-0.3 0.872 72.9 56.9 -63.7 -38.8 10.5 6.9 -6.2 87 87 A K H > S+ 0 0 135 -3,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.924 110.7 44.1 -54.3 -47.4 12.8 8.5 -8.7 88 88 A A H > S+ 0 0 23 -3,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.910 110.2 54.9 -67.7 -43.6 10.3 11.3 -9.2 89 89 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 -7,-0.3 -1,-0.2 0.928 115.0 39.7 -51.2 -47.3 9.6 11.7 -5.5 90 90 A D H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.811 111.4 56.6 -81.4 -29.1 13.3 12.2 -4.8 91 91 A D H X S+ 0 0 76 -4,-2.4 4,-2.3 -5,-0.3 5,-0.3 0.919 109.7 48.2 -59.1 -45.0 13.7 14.4 -7.9 92 92 A F H X S+ 0 0 40 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.955 115.1 43.4 -56.9 -52.1 11.0 16.6 -6.5 93 93 A L H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.923 115.5 47.1 -66.8 -45.2 12.6 16.7 -3.0 94 94 A I H X S+ 0 0 49 -4,-2.8 4,-3.6 1,-0.2 5,-0.3 0.916 115.0 45.4 -63.1 -44.7 16.2 17.2 -4.2 95 95 A S H < S+ 0 0 87 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.846 107.4 59.0 -70.7 -32.1 15.2 20.0 -6.7 96 96 A L H < S+ 0 0 50 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.910 114.6 36.9 -60.0 -42.2 13.0 21.6 -4.1 97 97 A D H < S- 0 0 5 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.948 90.0-171.4 -72.4 -52.4 16.1 21.9 -1.9 98 98 A G < + 0 0 60 -4,-3.6 2,-0.3 1,-0.2 -3,-0.1 0.557 40.8 110.3 79.7 9.3 18.3 22.6 -5.0 99 99 A T S > S- 0 0 49 -5,-0.3 3,-0.6 1,-0.1 -1,-0.2 -0.763 75.0-115.8-115.9 163.9 21.7 22.4 -3.2 100 100 A A T 3 S+ 0 0 90 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.930 112.0 25.6 -58.1 -51.3 24.6 20.0 -3.2 101 101 A N T 3 S- 0 0 79 -56,-0.1 -55,-2.5 -57,-0.0 6,-0.3 0.053 109.9-105.1-114.9 24.1 24.3 18.8 0.4 102 102 A K S <> S+ 0 0 5 -3,-0.6 4,-1.2 -57,-0.2 5,-0.2 0.872 70.0 147.3 59.8 41.0 20.7 19.4 1.1 103 103 A S T 4 + 0 0 64 3,-0.2 -1,-0.1 2,-0.2 -5,-0.0 0.544 58.5 61.1 -88.8 -9.7 21.6 22.5 3.2 104 104 A K T 4 S+ 0 0 131 1,-0.1 -1,-0.1 2,-0.0 -7,-0.1 0.953 126.3 9.0 -79.8 -54.2 18.5 24.5 2.4 105 105 A L T 4 S- 0 0 4 -38,-0.0 -38,-0.2 -34,-0.0 -2,-0.2 0.717 110.6-114.1 -97.4 -24.8 15.8 22.1 3.8 106 106 A G >X - 0 0 0 -4,-1.2 4,-1.8 3,-0.1 3,-1.5 0.300 13.3-107.1 94.9 134.1 18.1 19.7 5.6 107 107 A A H 3> S+ 0 0 6 -61,-2.5 4,-2.4 -6,-0.3 5,-0.2 0.800 120.7 58.8 -60.5 -28.0 18.7 16.0 4.8 108 108 A N H 34 S+ 0 0 5 -62,-0.7 -1,-0.3 1,-0.2 4,-0.2 0.537 106.1 48.5 -86.0 -4.1 16.7 15.2 8.0 109 109 A A H <> S+ 0 0 0 -3,-1.5 4,-0.6 2,-0.1 -2,-0.2 0.779 117.1 40.7 -88.4 -39.3 13.7 17.0 6.5 110 110 A I H >X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 3,-0.6 0.892 105.2 61.7 -77.1 -39.8 13.9 15.3 3.1 111 111 A L H 3X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.3 5,-0.3 0.878 97.3 56.5 -64.3 -40.8 14.7 11.7 4.1 112 112 A G H 3> S+ 0 0 0 1,-0.2 4,-2.3 -4,-0.2 -1,-0.3 0.865 110.4 45.7 -58.5 -38.4 11.5 11.0 6.1 113 113 A V H S+ 0 0 4 -4,-2.0 5,-2.4 1,-0.2 4,-0.4 0.910 110.9 48.8 -59.5 -42.3 4.4 -0.9 -1.1 123 123 A A H ><5S+ 0 0 28 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.904 109.5 51.2 -65.9 -42.1 1.0 -0.7 0.4 124 124 A E H 3<5S+ 0 0 68 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.895 112.6 47.0 -58.7 -38.1 -0.6 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