==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 08-JUN-10 2XH2 . COMPND 2 MOLECULE: ENOLASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR B.SCHREIER,B.HOCKER . 1748 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58078.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1285 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 121 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 148 8.5 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 . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.5 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 . 4 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 . 104 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 216 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 569 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 44 2.5 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 4 0 2 0 7 12 1 2 4 4 6 2 0 4 3 1 0 0 0 4 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 11 9 8 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 . 12 4 0 4 4 4 0 4 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 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 95 0, 0.0 2,-0.6 0, 0.0 25,-0.4 0.000 360.0 360.0 360.0 130.1 50.1 -3.5 81.0 2 2 A V + 0 0 17 79,-0.4 23,-0.2 23,-0.2 78,-0.2 -0.727 360.0 171.5 -79.6 118.2 49.2 -5.2 77.7 3 3 A S + 0 0 79 21,-2.3 2,-0.3 -2,-0.6 -1,-0.2 0.659 62.5 21.5-101.0 -21.4 49.1 -9.0 78.3 4 4 A K E -A 24 0A 104 20,-1.1 20,-2.6 2,-0.0 2,-0.4 -0.993 49.3-172.1-152.9 137.7 47.7 -10.2 75.0 5 5 A V E +A 23 0A 6 -2,-0.3 2,-0.3 18,-0.2 18,-0.2 -0.998 24.0 171.2-127.6 127.8 47.5 -9.0 71.4 6 6 A Y E -A 22 0A 60 16,-2.3 16,-3.0 -2,-0.4 2,-0.3 -0.990 14.9-163.8-140.8 145.4 45.4 -11.1 69.0 7 7 A A E +A 21 0A 1 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.968 8.7 173.5-129.8 150.0 44.0 -10.9 65.5 8 8 A R E -A 20 0A 18 12,-2.3 12,-2.5 -2,-0.3 2,-0.4 -0.947 36.2-101.0-141.6 163.9 41.3 -12.7 63.5 9 9 A S E +A 19 0A 29 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.752 43.3 169.8 -82.5 133.1 39.6 -12.4 60.1 10 10 A V E -A 18 0A 0 8,-2.4 8,-2.6 -2,-0.4 2,-0.4 -0.835 34.0 -99.0-131.2 173.6 36.2 -10.8 60.1 11 11 A Y E -A 17 0A 7 -2,-0.3 837,-0.1 6,-0.2 2,-0.0 -0.828 26.7-145.3-102.8 134.7 34.0 -9.6 57.2 12 12 A D > - 0 0 1 4,-2.9 3,-1.9 -2,-0.4 366,-0.2 -0.191 43.4 -83.7 -81.7-177.9 33.7 -6.0 55.9 13 13 A S T 3 S+ 0 0 0 364,-2.8 827,-2.8 1,-0.3 365,-0.1 0.609 130.7 50.0 -69.4 -12.6 30.5 -4.4 54.6 14 14 A R T 3 S- 0 0 34 363,-0.2 -1,-0.3 825,-0.2 825,-0.1 0.358 121.2-105.4-100.5 -0.4 31.1 -5.8 51.1 15 15 A G S < S+ 0 0 0 -3,-1.9 -2,-0.1 1,-0.3 614,-0.1 0.726 78.6 131.2 81.9 22.1 31.7 -9.4 52.4 16 16 A N - 0 0 17 20,-0.1 -4,-2.9 1,-0.1 -1,-0.3 -0.845 62.5-102.8 -99.8 142.5 35.4 -9.3 52.0 17 17 A P E +A 11 0A 1 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.277 43.8 171.3 -63.1 148.5 37.7 -10.4 54.8 18 18 A T E -A 10 0A 2 -8,-2.6 -8,-2.4 -6,-0.0 2,-0.5 -0.920 35.6 -85.0-146.0 177.0 39.6 -7.8 56.9 19 19 A V E -A 9 0A 0 -2,-0.3 15,-2.5 -10,-0.2 2,-0.5 -0.728 32.1-172.6 -94.8 126.8 41.7 -7.7 60.1 20 20 A E E -AB 8 33A 1 -12,-2.5 -12,-2.3 -2,-0.5 2,-0.4 -0.974 10.0-163.4-113.5 130.3 40.2 -7.4 63.5 21 21 A V E -AB 7 32A 0 11,-2.9 11,-2.4 -2,-0.5 2,-0.4 -0.916 7.4-165.3-115.5 139.8 42.6 -6.9 66.5 22 22 A E E -AB 6 31A 25 -16,-3.0 -16,-2.3 -2,-0.4 2,-0.5 -0.994 2.3-167.2-122.6 128.9 42.0 -7.3 70.2 23 23 A L E -AB 5 30A 0 7,-2.5 7,-3.4 -2,-0.4 2,-0.5 -0.951 9.7-153.3-112.9 129.4 44.3 -6.0 72.9 24 24 A T E +AB 4 29A 31 -20,-2.6 -21,-2.3 -2,-0.5 -20,-1.1 -0.887 23.4 155.7-106.6 129.6 44.0 -7.2 76.5 25 25 A T E > - B 0 28A 13 3,-2.5 3,-1.7 -2,-0.5 -23,-0.2 -0.758 63.3 -81.8-129.2-175.4 45.0 -5.1 79.5 26 26 A E T 3 S+ 0 0 117 -25,-0.4 3,-0.1 1,-0.3 -24,-0.1 0.707 129.8 58.6 -59.0 -21.4 43.9 -5.1 83.2 27 27 A K T 3 S- 0 0 121 1,-0.3 2,-0.3 93,-0.1 -1,-0.3 0.520 118.4-101.1 -88.8 -6.9 40.9 -2.9 82.0 28 28 A G E < -B 25 0A 28 -3,-1.7 -3,-2.5 2,-0.1 2,-0.5 -0.854 55.3 -29.4 125.8-158.3 39.7 -5.6 79.6 29 29 A V E -B 24 0A 81 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.887 49.5-160.6-110.1 122.3 39.7 -6.5 75.9 30 30 A F E -B 23 0A 29 -7,-3.4 -7,-2.5 -2,-0.5 2,-0.4 -0.906 7.2-159.5-113.2 123.0 39.8 -3.7 73.3 31 31 A R E +B 22 0A 86 -2,-0.5 2,-0.3 -9,-0.2 -9,-0.2 -0.869 14.0 172.2-111.6 130.0 38.7 -4.3 69.8 32 32 A S E -B 21 0A 0 -11,-2.4 -11,-2.9 -2,-0.4 2,-0.4 -0.977 14.7-153.9-131.9 146.3 39.5 -2.4 66.6 33 33 A I E -B 20 0A 6 -2,-0.3 -13,-0.2 -13,-0.2 349,-0.1 -0.954 14.1-130.8-125.7 137.3 38.7 -3.3 62.9 34 34 A V - 0 0 0 -15,-2.5 -15,-0.1 -2,-0.4 2,-0.1 -0.734 21.0-143.8 -89.8 129.5 40.6 -2.2 59.8 35 35 A P - 0 0 12 0, 0.0 2,-0.4 0, 0.0 342,-0.2 -0.298 10.4-141.3 -84.5 177.1 38.6 -0.8 56.9 36 36 A S B -C 376 0B 4 340,-2.9 340,-2.1 -2,-0.1 2,-0.1 -0.981 6.1-151.4-147.1 129.8 39.3 -1.3 53.2 37 37 A G - 0 0 9 -2,-0.4 2,-0.4 338,-0.2 3,-0.2 -0.363 14.6-126.7 -91.1 172.4 39.1 0.9 50.1 38 38 A A S S+ 0 0 42 1,-0.2 337,-0.1 -2,-0.1 3,-0.1 -0.941 88.9 5.7-118.5 145.4 38.5 0.1 46.4 39 39 A N S S- 0 0 119 -2,-0.4 -1,-0.2 1,-0.1 3,-0.1 0.953 94.6-155.1 43.5 56.1 40.8 1.2 43.5 40 40 A T - 0 0 68 -3,-0.2 -1,-0.1 1,-0.1 281,-0.0 -0.189 20.5 -89.0 -61.2 148.2 43.1 2.5 46.2 41 41 A G > - 0 0 9 1,-0.1 3,-1.8 -3,-0.1 -1,-0.1 -0.315 32.8-122.9 -58.3 141.1 45.6 5.3 45.6 42 42 A V T 3 S+ 0 0 106 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.774 110.8 54.3 -58.4 -26.4 49.0 4.1 44.3 43 43 A H T 3 S+ 0 0 67 278,-0.3 -1,-0.3 2,-0.0 3,-0.1 0.412 81.1 119.1 -91.7 0.6 50.7 5.8 47.2 44 44 A E S < S- 0 0 23 -3,-1.8 305,-0.2 1,-0.1 304,-0.1 -0.343 76.6 -95.4 -64.7 147.2 48.6 4.2 50.0 45 45 A A - 0 0 12 303,-2.5 2,-0.3 279,-0.2 57,-0.2 -0.322 61.8 -79.0 -57.4 146.2 50.4 2.1 52.7 46 46 A L - 0 0 68 55,-2.8 61,-3.0 303,-0.1 2,-0.8 -0.324 35.0-156.2 -63.5 116.8 50.3 -1.6 51.7 47 47 A E - 0 0 50 -2,-0.3 2,-0.5 60,-0.2 -1,-0.1 -0.834 26.0-136.9 -83.9 112.5 47.0 -3.5 52.4 48 48 A M + 0 0 31 -2,-0.8 2,-0.3 57,-0.1 16,-0.3 -0.640 28.0 177.5 -82.5 119.7 48.3 -7.1 52.6 49 49 A R - 0 0 61 -2,-0.5 12,-0.2 14,-0.1 10,-0.1 -0.898 31.6-132.9-119.5 151.2 46.1 -9.7 50.8 50 50 A D - 0 0 26 10,-2.8 9,-0.2 -2,-0.3 3,-0.1 0.814 21.9-151.8 -75.7 -34.4 46.9 -13.4 50.5 51 51 A G + 0 0 59 7,-2.0 2,-1.0 9,-0.3 8,-0.1 0.687 40.7 147.6 68.2 20.2 46.2 -13.7 46.8 52 52 A D > - 0 0 72 3,-0.2 3,-2.3 1,-0.2 6,-1.1 -0.803 36.7-158.8 -86.1 103.3 45.1 -17.4 47.1 53 53 A K T 3 S+ 0 0 89 -2,-1.0 4,-0.3 1,-0.3 -1,-0.2 0.706 87.3 63.3 -55.8 -23.1 42.5 -17.6 44.3 54 54 A S T 3 S+ 0 0 77 3,-0.1 2,-0.4 1,-0.1 -1,-0.3 0.413 102.8 53.9 -86.2 1.3 41.0 -20.7 46.1 55 55 A K S X >S- 0 0 71 -3,-2.3 3,-2.1 1,-0.0 5,-0.7 -0.982 124.3 -17.7-140.3 126.7 40.0 -18.7 49.2 56 56 A W G > 5S- 0 0 29 -2,-0.4 3,-2.2 1,-0.3 -2,-0.1 0.785 114.6 -68.1 52.8 36.2 38.0 -15.5 49.4 57 57 A M G 3 5S- 0 0 69 -4,-0.3 -1,-0.3 1,-0.3 -4,-0.2 0.776 96.5 -57.0 58.4 24.7 38.4 -14.8 45.7 58 58 A G G < 5S+ 0 0 13 -3,-2.1 -7,-2.0 -6,-1.1 -1,-0.3 0.425 119.9 109.8 87.7 4.0 42.1 -14.1 46.5 59 59 A K T < 5 + 0 0 88 -3,-2.2 -3,-0.2 -4,-0.2 -2,-0.1 0.176 40.3 138.6-104.6 17.2 41.2 -11.5 49.1 60 60 A G < - 0 0 0 -5,-0.7 -10,-2.8 -8,-0.3 -9,-0.3 -0.157 41.5-158.0 -53.4 152.1 42.2 -13.4 52.3 61 61 A V > + 0 0 0 -12,-0.2 4,-2.7 -43,-0.1 5,-0.2 0.050 55.2 119.2-121.6 23.9 44.0 -11.6 55.1 62 62 A L H > S+ 0 0 78 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.848 75.7 53.3 -57.8 -35.8 45.5 -14.7 56.8 63 63 A H H > S+ 0 0 100 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.918 110.8 45.3 -68.8 -41.2 49.1 -13.4 56.2 64 64 A A H > S+ 0 0 0 -16,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.912 113.4 50.1 -66.4 -43.5 48.3 -10.0 57.8 65 65 A V H X S+ 0 0 15 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.895 110.1 50.6 -59.6 -42.2 46.5 -11.8 60.7 66 66 A K H X>S+ 0 0 119 -4,-2.3 4,-3.4 2,-0.2 5,-0.6 0.898 104.2 58.4 -64.6 -39.4 49.6 -14.1 61.1 67 67 A N H X>S+ 0 0 30 -4,-2.1 5,-2.9 1,-0.2 4,-0.9 0.880 111.4 43.0 -57.3 -38.3 51.8 -11.0 61.2 68 68 A V H <>S+ 0 0 0 -4,-1.6 5,-3.0 3,-0.2 -2,-0.2 0.961 120.3 39.3 -67.4 -53.4 49.8 -9.8 64.2 69 69 A N H <5S+ 0 0 42 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.849 128.6 27.8 -71.5 -35.1 49.6 -13.1 66.0 70 70 A D H <5S+ 0 0 95 -4,-3.4 -1,-0.2 -5,-0.2 -3,-0.2 0.653 133.8 19.7-104.9 -17.0 53.1 -14.4 65.4 71 71 A V T X S+ 0 0 57 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.887 120.1 42.2 -56.8 -41.5 55.1 -11.6 71.0 75 75 A A H < S+ 0 0 34 -4,-1.2 4,-0.2 2,-0.2 -2,-0.2 0.900 112.8 51.5 -73.6 -43.6 57.3 -8.5 70.6 76 76 A F H ><>S+ 0 0 2 -4,-3.2 3,-1.6 1,-0.2 5,-0.5 0.935 109.4 49.5 -61.2 -48.7 54.7 -5.9 71.6 77 77 A V H ><5S+ 0 0 54 -4,-2.4 3,-0.6 1,-0.3 -1,-0.2 0.837 113.7 46.5 -61.2 -31.8 53.8 -7.7 74.9 78 78 A K T 3<5S+ 0 0 183 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.335 94.9 80.1 -92.0 6.6 57.5 -8.0 75.8 79 79 A A T < 5S- 0 0 34 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.459 91.6-132.9 -95.2 -5.9 58.2 -4.4 75.0 80 80 A N T < 5 - 0 0 156 -3,-0.6 2,-0.2 -4,-0.2 -3,-0.1 0.887 40.5-178.5 62.2 41.1 56.8 -2.9 78.2 81 81 A I < - 0 0 30 -5,-0.5 2,-0.8 -79,-0.1 -79,-0.4 -0.544 30.4-136.7 -85.6 138.6 54.8 -0.3 76.3 82 82 A D > - 0 0 72 -2,-0.2 3,-1.9 1,-0.1 7,-0.3 -0.839 12.6-157.7 -88.4 106.8 52.7 2.5 77.9 83 83 A V T 3 S+ 0 0 6 -2,-0.8 38,-0.3 1,-0.3 -1,-0.1 0.739 88.6 67.1 -61.0 -22.2 49.5 2.5 75.7 84 84 A K T 3 S+ 0 0 69 1,-0.2 2,-1.3 37,-0.1 -1,-0.3 0.774 88.4 72.0 -66.7 -26.5 48.7 6.1 76.8 85 85 A D <> + 0 0 78 -3,-1.9 4,-2.1 1,-0.2 3,-0.3 -0.701 64.2 176.5 -91.2 84.9 51.9 7.1 74.9 86 86 A Q H > S+ 0 0 4 -2,-1.3 4,-2.6 1,-0.2 267,-0.2 0.841 76.9 58.6 -61.6 -35.4 50.5 6.7 71.4 87 87 A K H > S+ 0 0 140 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.919 108.1 46.7 -60.0 -43.2 53.7 8.0 69.8 88 88 A A H > S+ 0 0 32 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.889 110.5 52.5 -64.9 -42.4 55.6 5.2 71.6 89 89 A V H X S+ 0 0 0 -4,-2.1 4,-2.0 -7,-0.3 -2,-0.2 0.951 116.1 39.9 -54.5 -50.9 53.1 2.6 70.5 90 90 A D H X S+ 0 0 1 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.873 110.3 57.4 -73.8 -39.0 53.4 3.7 66.9 91 91 A D H X S+ 0 0 108 -4,-2.9 4,-2.1 -5,-0.2 -1,-0.2 0.916 109.4 48.7 -51.5 -44.8 57.2 4.2 67.0 92 92 A F H X S+ 0 0 45 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.943 112.7 45.1 -63.5 -50.1 57.5 0.5 68.1 93 93 A L H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 3,-0.2 0.913 114.1 49.6 -58.9 -44.9 55.2 -0.9 65.4 94 94 A I H X S+ 0 0 56 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.890 109.0 52.2 -63.1 -40.4 56.9 1.2 62.7 95 95 A S H < S+ 0 0 84 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.790 107.2 53.1 -69.7 -27.4 60.4 0.1 63.8 96 96 A L H < S+ 0 0 59 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.921 113.9 41.6 -70.8 -46.5 59.4 -3.6 63.6 97 97 A D H < S- 0 0 8 -4,-1.8 -2,-0.2 -5,-0.1 -3,-0.1 0.923 83.6-171.2 -67.3 -49.1 58.2 -3.2 60.0 98 98 A G < + 0 0 63 -4,-2.8 2,-0.3 1,-0.2 -3,-0.1 0.615 43.1 109.8 65.6 16.0 61.1 -1.0 58.9 99 99 A T S > S- 0 0 48 -5,-0.3 3,-1.1 1,-0.1 -1,-0.2 -0.939 71.7-127.3-121.4 150.1 59.7 -0.1 55.5 100 100 A A T 3 S+ 0 0 99 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.895 111.0 35.0 -55.3 -45.5 58.3 3.2 54.2 101 101 A N T 3 S- 0 0 73 -56,-0.1 -55,-2.8 -3,-0.1 6,-0.3 0.170 110.7-112.5-102.7 14.9 55.0 1.7 53.0 102 102 A K <> + 0 0 6 -3,-1.1 4,-1.4 -57,-0.2 6,-0.1 0.871 67.3 146.5 57.7 40.9 54.6 -0.9 55.7 103 103 A S T 4 + 0 0 48 2,-0.2 -1,-0.1 3,-0.2 -5,-0.0 0.612 58.6 62.2 -85.8 -11.3 55.1 -3.7 53.2 104 104 A K T 4 S+ 0 0 136 1,-0.1 -1,-0.2 -7,-0.1 -6,-0.1 0.951 125.4 10.0 -76.5 -52.5 56.8 -6.1 55.6 105 105 A L T 4 S- 0 0 3 -6,-0.1 -38,-0.2 -34,-0.0 -2,-0.2 0.738 110.5-111.6 -97.0 -29.2 53.9 -6.5 58.1 106 106 A G >X - 0 0 0 -4,-1.4 4,-2.1 3,-0.1 3,-1.3 0.208 14.0-110.8 97.3 133.3 51.1 -4.9 56.2 107 107 A A H 3> S+ 0 0 4 -61,-3.0 4,-2.9 -6,-0.3 5,-0.2 0.810 121.2 60.1 -64.3 -27.3 49.4 -1.6 57.1 108 108 A N H 34 S+ 0 0 5 -62,-0.7 -1,-0.3 2,-0.2 4,-0.2 0.537 106.4 45.4 -78.4 -8.7 46.4 -3.8 57.9 109 109 A A H <> S+ 0 0 0 -3,-1.3 4,-0.8 2,-0.1 -2,-0.2 0.789 118.3 42.9 -91.1 -41.5 48.4 -5.7 60.5 110 110 A I H >X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 3,-0.5 0.930 107.8 56.0 -68.7 -50.4 49.8 -2.5 62.0 111 111 A L H 3X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.858 100.7 57.4 -57.9 -44.3 46.8 -0.3 62.1 112 112 A G H 3> S+ 0 0 0 -5,-0.2 4,-2.2 -4,-0.2 -1,-0.2 0.890 110.5 44.0 -53.4 -43.5 44.6 -2.6 64.2 113 113 A V H S+ 0 0 5 -4,-2.1 5,-2.3 1,-0.2 4,-0.5 0.903 110.9 48.9 -58.1 -39.6 41.2 5.7 77.1 123 123 A A H ><5S+ 0 0 28 -4,-1.8 3,-0.8 2,-0.2 -2,-0.2 0.891 109.2 50.9 -69.7 -39.8 40.0 3.0 79.4 124 124 A E H 3<5S+ 0 0 71 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