==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 26-OCT-05 2C5A . COMPND 2 MOLECULE: GDP-MANNOSE-3', 5'-EPIMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR L.L.MAJOR,B.A.WOLUCKA,J.H.NAISMITH . 723 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27391.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 491 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 92 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.1 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 . 57 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 220 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.1 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 2 2 0 2 2 2 2 0 0 0 0 0 0 2 2 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 2 8 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 0 PARALLEL BRIDGES PER LADDER . 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 6 2 0 0 0 2 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 13 A T 0 0 88 0, 0.0 2,-1.0 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 158.9 8.9 27.0 -7.6 2 14 A Y > - 0 0 45 1,-0.2 3,-1.1 2,-0.0 314,-0.0 -0.761 360.0-169.5 -86.5 98.5 11.5 28.6 -9.9 3 15 A K T 3 S+ 0 0 171 -2,-1.0 -1,-0.2 1,-0.3 0, 0.0 0.812 75.1 57.2 -70.1 -33.8 11.2 26.2 -12.8 4 16 A E T 3 S+ 0 0 175 -3,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.513 73.7 119.4 -80.8 -3.6 14.2 27.3 -14.8 5 17 A L < - 0 0 17 -3,-1.1 2,-0.7 1,-0.1 233,-0.0 -0.436 67.4-126.7 -64.2 129.2 16.8 26.6 -12.0 6 18 A E - 0 0 139 -2,-0.2 2,-0.4 2,-0.0 -1,-0.1 -0.713 34.0-167.7 -76.3 110.6 19.3 24.1 -13.1 7 19 A R - 0 0 88 -2,-0.7 2,-0.4 0, 0.0 234,-0.0 -0.848 12.7-158.8-107.4 134.1 19.3 21.5 -10.4 8 20 A E - 0 0 80 -2,-0.4 2,-0.0 233,-0.1 236,-0.0 -0.914 33.0-104.8-101.7 146.2 21.8 18.7 -9.8 9 21 A Q - 0 0 89 -2,-0.4 26,-0.0 1,-0.1 -1,-0.0 -0.359 24.2-137.3 -60.0 141.6 20.8 15.6 -7.7 10 22 A Y S S- 0 0 2 1,-0.2 -1,-0.1 2,-0.1 25,-0.0 0.896 87.4 -1.9 -63.6 -48.4 22.3 15.7 -4.3 11 23 A W > + 0 0 44 27,-0.1 3,-1.0 1,-0.1 -1,-0.2 -0.554 66.0 166.8-154.3 71.4 23.4 12.0 -4.0 12 24 A P T 3 + 0 0 93 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.688 65.3 75.7 -69.4 -16.6 22.4 10.0 -7.1 13 25 A S T 3 S- 0 0 102 1,-0.2 2,-0.3 2,-0.0 -2,-0.0 0.711 110.9 -8.3 -71.7 -21.4 24.6 6.9 -6.2 14 26 A E S < S- 0 0 107 -3,-1.0 2,-0.5 2,-0.0 -1,-0.2 -0.960 71.6-101.6-169.3 152.9 22.3 5.6 -3.5 15 27 A N - 0 0 118 -2,-0.3 2,-0.2 -3,-0.1 25,-0.1 -0.733 45.2-161.4 -83.7 130.8 19.2 6.4 -1.4 16 28 A L - 0 0 7 -2,-0.5 25,-3.0 -5,-0.1 2,-0.6 -0.670 24.9-115.9-111.8 162.9 20.3 7.6 2.1 17 29 A K E -a 41 0A 72 -2,-0.2 64,-2.4 23,-0.2 65,-1.6 -0.915 42.5-171.2 -94.8 116.2 18.6 8.0 5.4 18 30 A I E -ab 42 82A 0 23,-2.9 25,-2.9 -2,-0.6 2,-0.5 -0.967 17.6-152.0-123.2 123.6 18.7 11.7 6.0 19 31 A S E -ab 43 83A 0 63,-2.7 65,-2.8 -2,-0.5 2,-0.5 -0.855 14.6-174.2 -97.1 122.4 17.8 13.5 9.3 20 32 A I E > -ab 44 84A 0 23,-2.7 25,-1.8 -2,-0.5 3,-0.5 -0.971 6.9-159.9-122.9 111.0 16.5 17.1 8.7 21 33 A T E 3 S+ab 45 85A 0 63,-2.1 65,-0.8 -2,-0.5 25,-0.2 -0.588 72.4 34.8 -90.5 155.6 15.9 19.2 11.8 22 34 A G T > S+ 0 0 10 23,-1.6 3,-2.0 -2,-0.2 6,-0.4 0.655 70.7 143.5 78.0 18.7 13.7 22.3 11.8 23 35 A A T < + 0 0 0 22,-1.7 23,-0.2 -3,-0.5 -2,-0.1 0.491 59.2 69.7 -79.7 -2.4 11.3 20.7 9.2 24 36 A G T 3 S+ 0 0 1 21,-0.4 27,-0.6 26,-0.1 -1,-0.3 0.553 103.9 57.2 -76.8 -8.1 8.2 22.3 10.8 25 37 A G S <> S- 0 0 27 -3,-2.0 4,-0.7 25,-0.1 5,-0.1 -0.147 99.6 -77.4-112.9-159.7 9.6 25.5 9.5 26 38 A F H > S+ 0 0 32 2,-0.2 4,-1.4 3,-0.1 3,-0.3 0.997 108.3 29.4 -77.3 -73.8 10.7 27.1 6.3 27 39 A I H > S+ 0 0 29 1,-0.2 4,-2.2 2,-0.2 3,-0.3 0.928 119.2 52.2 -65.5 -41.4 14.1 26.2 4.8 28 40 A A H > S+ 0 0 2 -6,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.829 104.3 56.8 -62.0 -35.8 14.2 22.6 6.2 29 41 A S H X S+ 0 0 0 -4,-0.7 4,-2.4 -7,-0.4 -1,-0.2 0.886 108.4 47.4 -66.9 -33.1 10.8 21.7 4.8 30 42 A H H X S+ 0 0 8 -4,-1.4 4,-2.3 -3,-0.3 -2,-0.2 0.903 112.3 48.2 -69.2 -44.7 12.0 22.7 1.3 31 43 A I H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.932 113.4 49.7 -58.8 -44.6 15.2 20.7 1.6 32 44 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.937 110.4 48.1 -62.5 -50.0 13.2 17.7 2.9 33 45 A R H X S+ 0 0 55 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.943 113.5 48.6 -57.2 -42.1 10.7 17.9 0.1 34 46 A R H X S+ 0 0 30 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.931 113.9 44.7 -62.8 -48.5 13.5 18.1 -2.5 35 47 A L H <>S+ 0 0 0 -4,-2.5 5,-2.3 2,-0.2 -1,-0.2 0.859 110.9 53.1 -69.0 -36.8 15.5 15.1 -1.0 36 48 A K H ><5S+ 0 0 44 -4,-2.6 3,-1.8 1,-0.2 -1,-0.2 0.925 108.6 52.3 -62.4 -44.7 12.4 12.9 -0.6 37 49 A H H 3<5S+ 0 0 147 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.778 104.1 55.8 -59.0 -29.6 11.7 13.6 -4.3 38 50 A E T 3<5S- 0 0 32 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.374 129.4 -96.7 -84.3 -0.4 15.2 12.5 -5.2 39 51 A G T < 5S+ 0 0 37 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.418 76.5 137.2 105.9 1.0 14.5 9.2 -3.5 40 52 A H < - 0 0 5 -5,-2.3 2,-0.7 -25,-0.1 -1,-0.3 -0.383 58.0-116.9 -81.0 156.8 16.0 9.6 0.0 41 53 A Y E -a 17 0A 85 -25,-3.0 -23,-2.9 -2,-0.1 2,-0.5 -0.870 36.3-155.7 -93.2 110.2 14.4 8.5 3.3 42 54 A V E -a 18 0A 0 -2,-0.7 18,-2.9 -25,-0.2 19,-1.5 -0.829 15.2-166.5-103.0 121.9 13.8 11.7 5.2 43 55 A I E -ac 19 61A 6 -25,-2.9 -23,-2.7 -2,-0.5 2,-0.3 -0.941 19.7-165.8-101.8 103.5 13.5 11.8 9.0 44 56 A A E -ac 20 62A 0 17,-3.0 19,-2.6 -2,-0.7 2,-0.3 -0.728 7.8-177.1 -93.6 149.0 12.1 15.2 9.9 45 57 A S E +ac 21 63A 0 -25,-1.8 -22,-1.7 -2,-0.3 -23,-1.6 -0.995 16.4 133.0-148.2 152.0 12.0 16.8 13.3 46 58 A D E - c 0 64A 19 17,-1.8 19,-1.7 -2,-0.3 4,-0.1 -0.909 55.2-114.7-176.1 166.3 10.8 19.9 15.0 47 59 A W S S+ 0 0 45 -2,-0.3 312,-2.4 17,-0.2 2,-0.3 0.423 104.1 47.6 -96.7 2.6 8.9 20.9 18.2 48 60 A K S S- 0 0 46 310,-0.1 312,-0.2 17,-0.1 2,-0.1 -0.955 89.8-111.4-133.4 154.4 6.1 22.2 16.0 49 61 A K - 0 0 65 -2,-0.3 2,-0.3 310,-0.3 314,-0.1 -0.429 40.3 -95.0 -79.1 156.8 4.3 20.6 13.0 50 62 A N - 0 0 7 1,-0.1 -25,-0.1 3,-0.1 -26,-0.1 -0.582 30.6-161.7 -70.8 130.0 4.6 21.9 9.5 51 63 A E S S+ 0 0 116 -27,-0.6 -1,-0.1 -2,-0.3 3,-0.1 0.564 82.2 45.3 -86.9 -12.8 1.8 24.3 8.7 52 64 A H S S+ 0 0 59 1,-0.2 2,-0.3 -28,-0.1 -1,-0.1 0.634 110.4 36.3-113.0 -18.2 2.0 24.3 4.9 53 65 A M S S- 0 0 12 2,-0.0 -1,-0.2 5,-0.0 2,-0.2 -0.985 75.7-115.0-139.7 146.6 2.5 20.6 3.8 54 66 A T > - 0 0 97 -2,-0.3 3,-1.6 1,-0.1 4,-0.4 -0.516 43.5-106.6 -72.2 154.9 1.1 17.3 5.0 55 67 A E G >> S+ 0 0 61 1,-0.3 4,-2.1 2,-0.2 3,-1.9 0.844 114.7 56.6 -59.0 -41.3 3.9 15.1 6.3 56 68 A D G 34 S+ 0 0 117 1,-0.3 -1,-0.3 2,-0.2 -2,-0.0 0.683 94.0 69.1 -74.6 -5.2 4.1 12.6 3.5 57 69 A M G <4 S+ 0 0 86 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.736 120.8 13.0 -72.3 -23.3 4.8 15.4 1.1 58 70 A F T <4 S+ 0 0 0 -3,-1.9 2,-0.3 -4,-0.4 -22,-0.2 0.504 124.0 28.1-136.6 -6.5 8.2 16.0 2.6 59 71 A C < - 0 0 1 -4,-2.1 -1,-0.3 1,-0.1 -16,-0.2 -0.982 48.2-142.2-154.7 163.9 9.2 13.2 4.9 60 72 A D S S+ 0 0 62 -18,-2.9 2,-0.3 1,-0.3 -17,-0.2 0.616 98.0 19.5 -95.0 -22.2 9.0 9.5 5.7 61 73 A E E -c 43 0A 61 -19,-1.5 -17,-3.0 -6,-0.1 2,-0.4 -0.985 64.1-160.2-144.5 145.9 8.9 10.2 9.5 62 74 A F E -c 44 0A 27 -2,-0.3 2,-0.6 -19,-0.2 -17,-0.2 -0.980 8.3-163.0-129.2 122.4 8.2 13.3 11.6 63 75 A H E -c 45 0A 53 -19,-2.6 -17,-1.8 -2,-0.4 2,-0.9 -0.910 9.2-153.4-108.4 119.1 9.5 13.5 15.2 64 76 A L E +c 46 0A 52 -2,-0.6 2,-0.3 -19,-0.2 -17,-0.2 -0.810 45.3 136.4 -91.8 104.2 7.9 16.1 17.5 65 77 A V - 0 0 10 -19,-1.7 2,-0.8 -2,-0.9 -17,-0.1 -0.984 62.6-112.0-151.4 148.5 10.8 16.7 19.9 66 78 A D > - 0 0 4 -2,-0.3 3,-1.6 1,-0.1 6,-0.3 -0.792 27.8-160.1 -82.4 106.0 12.6 19.5 21.7 67 79 A L T 3 S+ 0 0 7 -2,-0.8 -1,-0.1 1,-0.3 46,-0.1 0.442 81.0 78.8 -77.6 3.4 16.1 19.3 20.0 68 80 A R T 3 S+ 0 0 4 45,-0.1 2,-0.5 44,-0.1 -1,-0.3 0.570 83.0 81.2 -71.5 -13.2 17.7 21.2 22.9 69 81 A V S X> S- 0 0 23 -3,-1.6 4,-1.8 1,-0.1 3,-1.0 -0.869 76.8-144.4-103.9 122.9 17.6 17.8 24.7 70 82 A M H 3> S+ 0 0 18 -2,-0.5 4,-2.5 1,-0.3 5,-0.2 0.869 98.0 59.8 -54.7 -43.3 20.3 15.3 23.9 71 83 A E H 3> S+ 0 0 131 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.863 108.2 47.4 -59.4 -30.4 18.1 12.2 24.2 72 84 A N H <> S+ 0 0 14 -3,-1.0 4,-2.1 -6,-0.3 -1,-0.2 0.888 108.3 52.8 -75.9 -39.7 15.9 13.7 21.4 73 85 A C H X S+ 0 0 0 -4,-1.8 4,-0.7 1,-0.2 -2,-0.2 0.878 109.6 51.1 -58.7 -39.5 18.9 14.5 19.2 74 86 A L H >X S+ 0 0 49 -4,-2.5 4,-0.9 -5,-0.2 3,-0.8 0.927 107.7 52.2 -64.1 -43.3 20.0 10.9 19.6 75 87 A K H >< S+ 0 0 116 -4,-1.7 3,-0.6 1,-0.2 -2,-0.2 0.914 110.9 46.8 -60.5 -41.8 16.5 9.7 18.6 76 88 A V H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.566 116.3 44.6 -81.4 -6.1 16.5 11.8 15.4 77 89 A T H X< S+ 0 0 0 -3,-0.8 3,-1.8 -4,-0.7 -1,-0.2 0.402 80.2 125.3-111.2 -0.1 20.0 10.7 14.4 78 90 A E T << S- 0 0 120 -4,-0.9 44,-0.1 -3,-0.6 40,-0.0 -0.414 88.7 -4.6 -64.8 125.9 19.6 7.0 15.1 79 91 A G T 3 S+ 0 0 52 42,-0.3 -1,-0.3 1,-0.2 2,-0.2 0.590 100.8 143.6 74.0 8.9 20.5 4.9 12.1 80 92 A V < - 0 0 6 -3,-1.8 -1,-0.2 1,-0.1 -62,-0.2 -0.559 41.7-163.0 -92.4 148.2 21.0 8.0 9.9 81 93 A D S S+ 0 0 58 -64,-2.4 43,-2.4 1,-0.3 44,-1.1 0.919 75.7 16.0 -85.8 -54.0 23.6 8.6 7.1 82 94 A H E -bd 18 125A 7 -65,-1.6 -63,-2.7 42,-0.2 2,-0.4 -0.929 63.3-153.9-128.5 148.9 23.4 12.4 6.7 83 95 A V E -bd 19 126A 1 42,-2.4 44,-3.0 -2,-0.3 2,-0.5 -0.978 7.3-166.2-123.2 137.4 22.1 15.3 8.8 84 96 A F E -bd 20 127A 0 -65,-2.8 -63,-2.1 -2,-0.4 2,-1.0 -0.984 17.9-158.7-115.4 112.2 20.9 18.8 7.8 85 97 A N E +bd 21 128A 2 42,-3.1 44,-1.4 -2,-0.5 -63,-0.1 -0.766 36.5 139.6-101.6 93.7 20.7 20.8 10.9 86 98 A L + 0 0 25 -2,-1.0 -64,-0.2 -65,-0.8 -1,-0.2 0.497 27.4 120.9-110.8 -5.5 18.4 23.7 10.5 87 99 A A + 0 0 15 23,-0.1 2,-0.3 -62,-0.0 42,-0.1 -0.368 33.7 137.8 -66.6 137.5 16.4 23.9 13.7 88 100 A A - 0 0 30 -2,-0.1 2,-0.8 22,-0.1 15,-0.1 -0.929 64.4-103.1-170.1 151.0 16.9 27.2 15.5 89 101 A D + 0 0 11 -2,-0.3 2,-0.3 14,-0.2 18,-0.1 -0.787 67.7 176.4 -81.5 108.7 14.8 29.8 17.4 90 102 A M + 0 0 78 -2,-0.8 2,-0.3 17,-0.0 -2,-0.0 -0.860 21.8 126.7-131.9 148.5 14.8 32.2 14.5 91 103 A G - 0 0 5 -2,-0.3 113,-0.2 113,-0.0 112,-0.1 -0.968 43.9 -91.4-175.2-175.2 13.5 35.4 13.1 92 104 A G >> - 0 0 4 111,-0.8 4,-2.7 -2,-0.3 3,-2.3 -0.063 69.7 -56.1 -94.2-156.8 14.4 38.8 11.5 93 105 A M H 3> S+ 0 0 43 1,-0.3 4,-0.8 2,-0.2 197,-0.1 0.751 129.9 63.6 -64.0 -25.6 15.2 42.1 13.1 94 106 A G H 34 S+ 0 0 1 110,-0.4 253,-2.9 108,-0.2 -1,-0.3 0.661 119.4 24.8 -68.3 -14.3 11.9 42.2 15.0 95 107 A F H X> S+ 0 0 0 -3,-2.3 3,-1.1 251,-0.2 4,-0.6 0.765 112.6 61.4-113.1 -45.9 13.1 39.2 16.9 96 108 A I H >< S+ 0 0 6 -4,-2.7 3,-0.6 1,-0.3 66,-0.2 0.844 103.6 47.1 -63.2 -39.8 16.9 39.0 16.9 97 109 A Q T 3< S+ 0 0 62 -4,-0.8 -1,-0.3 -5,-0.3 3,-0.2 0.580 114.8 44.6 -84.1 -9.0 17.7 42.2 18.7 98 110 A S T <4 S+ 0 0 22 -3,-1.1 -1,-0.2 1,-0.1 -2,-0.2 0.356 112.5 51.5-110.2 2.8 15.2 41.8 21.6 99 111 A N S+ 0 0 30 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.922 74.9 42.8 -55.0 -53.5 19.7 37.8 22.8 101 113 A S H > S+ 0 0 0 439,-0.3 4,-2.8 2,-0.2 5,-0.3 0.930 115.6 45.9 -62.4 -48.0 19.8 35.4 25.7 102 114 A V H > S+ 0 0 3 248,-0.5 4,-2.6 1,-0.2 5,-0.4 0.911 114.8 48.7 -66.0 -38.5 17.0 33.1 24.7 103 115 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.4 0.941 113.0 47.2 -60.5 -49.7 18.4 32.8 21.2 104 116 A M H X S+ 0 0 1 -4,-2.5 4,-1.9 -5,-0.3 5,-0.2 0.941 117.6 41.7 -64.3 -47.0 21.9 32.1 22.4 105 117 A Y H X S+ 0 0 2 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.962 118.9 42.4 -61.1 -56.0 20.8 29.5 24.9 106 118 A N H X S+ 0 0 3 -4,-2.6 4,-2.0 -5,-0.3 5,-0.2 0.931 117.5 45.2 -61.4 -44.2 18.3 27.7 22.8 107 119 A N H X S+ 0 0 2 -4,-2.4 4,-2.7 -5,-0.4 -1,-0.2 0.881 111.7 51.7 -72.6 -35.8 20.3 27.7 19.6 108 120 A T H X S+ 0 0 5 -4,-1.9 4,-2.9 -5,-0.4 5,-0.4 0.916 109.0 51.6 -63.6 -45.0 23.5 26.6 21.3 109 121 A M H X S+ 0 0 2 -4,-2.3 4,-1.6 -5,-0.2 5,-0.2 0.888 114.6 42.3 -59.7 -43.0 21.7 23.7 22.9 110 122 A I H X S+ 0 0 16 -4,-2.0 4,-2.4 -5,-0.2 5,-0.2 0.956 117.3 47.5 -62.7 -49.9 20.3 22.5 19.6 111 123 A S H X S+ 0 0 4 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.894 117.0 40.1 -58.0 -49.8 23.6 23.1 17.7 112 124 A F H X S+ 0 0 3 -4,-2.9 4,-2.1 2,-0.2 5,-0.2 0.908 116.4 47.2 -74.0 -44.8 25.8 21.4 20.2 113 125 A N H X S+ 0 0 5 -4,-1.6 4,-2.4 -5,-0.4 5,-0.2 0.869 109.5 55.7 -69.3 -32.3 23.6 18.4 21.1 114 126 A M H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.908 110.5 43.0 -63.7 -45.9 22.9 17.8 17.4 115 127 A I H X S+ 0 0 0 -4,-1.5 4,-2.4 -5,-0.2 -2,-0.2 0.907 115.2 49.1 -70.2 -37.9 26.5 17.4 16.4 116 128 A E H X S+ 0 0 3 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.908 112.5 48.4 -67.8 -39.1 27.5 15.4 19.4 117 129 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.913 109.6 53.0 -62.7 -40.6 24.5 13.1 18.8 118 130 A A H <>S+ 0 0 0 -4,-2.1 5,-2.5 -5,-0.2 4,-0.4 0.924 110.4 48.0 -60.4 -44.5 25.6 12.8 15.2 119 131 A R H ><5S+ 0 0 62 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.950 112.2 48.4 -58.8 -52.3 29.0 11.8 16.4 120 132 A I H 3<5S+ 0 0 74 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.895 113.7 47.3 -54.9 -42.0 27.6 9.2 18.8 121 133 A N T 3<5S- 0 0 37 -4,-2.6 -42,-0.3 -5,-0.2 -1,-0.3 0.380 114.4-113.1 -88.8 4.2 25.4 7.8 16.1 122 134 A G T < 5 - 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