==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 06-AUG-10 3OBE . COMPND 2 MOLECULE: SUGAR PHOSPHATE ISOMERASE/EPIMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PARABACTEROIDES DISTASONIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 576 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26718.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 391 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 72 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 2 0.3 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 . 36 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 183 31.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.1 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 2 2 2 0 3 3 0 0 2 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 10 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 . 5 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 . 2 2 0 0 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 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 33 A I 0 0 139 0, 0.0 12,-0.3 0, 0.0 78,-0.0 0.000 360.0 360.0 360.0 82.7 36.9 31.5 1.2 2 34 A P - 0 0 122 0, 0.0 2,-0.3 0, 0.0 7,-0.1 -0.021 360.0-122.1 -48.6 137.0 35.5 30.1 4.6 3 35 A A - 0 0 8 8,-0.4 3,-0.3 5,-0.4 10,-0.1 -0.616 16.9-143.9 -73.4 143.3 37.0 30.9 8.0 4 36 A T S S+ 0 0 85 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.754 94.7 51.7 -86.3 -23.2 37.9 27.5 9.6 5 37 A D S S+ 0 0 76 1,-0.1 2,-0.3 277,-0.1 -1,-0.2 0.417 114.4 39.2 -93.2 -0.4 37.0 28.7 13.2 6 38 A A - 0 0 35 -3,-0.3 -3,-0.3 5,-0.1 -1,-0.1 -0.981 62.9-148.0-149.9 140.6 33.5 30.1 12.4 7 39 A V + 0 0 159 -2,-0.3 -1,-0.1 -5,-0.1 -2,-0.0 0.720 63.6 114.0 -77.6 -22.4 30.7 28.8 10.1 8 40 A S > - 0 0 60 1,-0.1 3,-1.4 2,-0.1 -5,-0.4 -0.224 65.8-139.6 -58.6 137.3 29.4 32.3 9.3 9 41 A S T 3 S+ 0 0 136 1,-0.3 -1,-0.1 -7,-0.1 -2,-0.0 0.498 102.0 58.3 -76.2 -1.3 29.8 33.4 5.6 10 42 A A T 3 S+ 0 0 90 2,-0.1 2,-0.6 -7,-0.0 -1,-0.3 0.503 78.5 107.9-100.1 -2.5 30.8 36.9 6.9 11 43 A T < - 0 0 50 -3,-1.4 -8,-0.4 -8,-0.1 2,-0.1 -0.674 63.3-139.8 -86.2 117.1 33.7 35.8 9.0 12 44 A A - 0 0 71 -2,-0.6 3,-0.1 1,-0.1 -2,-0.1 -0.400 26.6-105.1 -63.4 142.9 37.1 36.8 7.5 13 45 A G - 0 0 25 -12,-0.3 2,-0.1 -2,-0.1 -1,-0.1 -0.410 42.5 -99.3 -60.8 148.9 39.9 34.3 7.7 14 46 A K - 0 0 11 1,-0.1 2,-0.4 -3,-0.1 -1,-0.1 -0.464 40.5-110.1 -64.6 141.3 42.5 35.1 10.3 15 47 A K + 0 0 131 273,-0.2 2,-0.3 -2,-0.1 28,-0.1 -0.623 51.5 165.2 -79.6 129.2 45.5 36.7 8.8 16 48 A X - 0 0 1 -2,-0.4 28,-2.7 26,-0.2 29,-1.9 -0.963 20.2-152.8-153.6 125.1 48.4 34.3 9.0 17 49 A G E -ab 45 258A 1 240,-1.4 242,-2.9 -2,-0.3 2,-0.4 -0.649 2.3-159.7-104.1 162.9 51.7 34.0 7.3 18 50 A L E -ab 46 259A 0 27,-1.6 29,-2.6 240,-0.3 2,-0.7 -0.996 19.7-135.1-136.7 132.6 54.2 31.3 6.4 19 51 A Q E > -a 47 0A 1 240,-3.3 3,-2.0 -2,-0.4 242,-0.3 -0.767 22.9-148.5 -80.4 115.2 57.9 31.4 5.6 20 52 A T G >> S+ 0 0 4 27,-2.4 3,-2.0 -2,-0.7 4,-0.6 0.652 87.4 80.2 -71.8 -13.7 57.9 29.2 2.6 21 53 A Y G >4 S+ 0 0 120 26,-0.4 3,-0.8 1,-0.3 -1,-0.3 0.808 80.8 75.0 -55.9 -24.9 61.4 27.9 3.2 22 54 A S G <4 S+ 0 0 3 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.733 99.6 39.7 -55.1 -29.2 59.4 25.6 5.6 23 55 A L G X4 S+ 0 0 2 -3,-2.0 3,-2.3 1,-0.2 4,-0.2 0.599 84.3 175.3 -99.5 -13.8 58.1 23.5 2.7 24 56 A G T XX S- 0 0 26 -3,-0.8 4,-1.5 -4,-0.6 3,-1.0 -0.120 71.9 -3.6 33.2-116.9 61.3 23.4 0.6 25 57 A Q H 3> S+ 0 0 105 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.669 121.6 76.6 -74.4 -16.9 60.9 21.3 -2.4 26 58 A E H <4 S+ 0 0 51 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.867 107.2 32.8 -66.1 -31.6 57.4 20.2 -1.4 27 59 A L H X4 S+ 0 0 7 -3,-1.0 3,-1.8 -4,-0.2 7,-0.3 0.920 116.1 55.6 -83.6 -49.0 56.0 23.6 -2.6 28 60 A L H >< S+ 0 0 50 -4,-1.5 3,-0.5 1,-0.3 -2,-0.2 0.797 101.2 59.0 -57.9 -33.4 58.5 24.2 -5.4 29 61 A Q T 3< S+ 0 0 147 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.1 0.616 126.7 12.4 -74.6 -16.8 57.7 21.0 -7.2 30 62 A D T <> S+ 0 0 72 -3,-1.8 4,-2.7 -4,-0.2 -1,-0.3 -0.429 73.4 168.1-157.0 76.7 54.0 21.8 -7.6 31 63 A X H <> S+ 0 0 33 -3,-0.5 4,-3.2 1,-0.2 5,-0.3 0.912 71.9 51.1 -72.4 -43.9 53.4 25.5 -6.8 32 64 A P H > S+ 0 0 84 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.946 118.9 38.4 -54.8 -49.4 49.8 26.1 -8.0 33 65 A N H > S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.905 116.6 51.6 -70.5 -37.1 48.5 23.1 -6.1 34 66 A G H X S+ 0 0 5 -4,-2.7 4,-2.2 -7,-0.3 -1,-0.2 0.901 109.5 50.1 -64.3 -44.3 50.7 23.7 -3.1 35 67 A L H X S+ 0 0 2 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.881 108.8 52.4 -60.9 -38.8 49.6 27.4 -2.9 36 68 A N H X S+ 0 0 104 -4,-1.8 4,-3.0 -5,-0.3 -2,-0.2 0.917 107.8 52.2 -63.0 -42.8 46.0 26.2 -3.1 37 69 A R H X S+ 0 0 99 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.914 109.1 49.2 -57.1 -45.8 46.7 23.9 -0.2 38 70 A L H X>S+ 0 0 0 -4,-2.2 5,-2.1 2,-0.2 4,-0.7 0.932 111.8 49.0 -61.2 -45.0 48.2 26.7 1.9 39 71 A A H ><5S+ 0 0 33 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.925 108.8 53.2 -60.3 -43.8 45.1 28.9 1.1 40 72 A K H 3<5S+ 0 0 74 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.858 106.2 53.9 -61.3 -33.9 42.8 26.0 2.1 41 73 A A H 3<5S- 0 0 21 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.642 126.3 -99.5 -76.0 -12.7 44.6 25.7 5.4 42 74 A G T <<5S+ 0 0 12 -3,-1.2 -3,-0.2 -4,-0.7 -26,-0.2 0.409 70.6 147.1 110.0 -2.1 44.0 29.4 6.1 43 75 A Y < + 0 0 4 -5,-2.1 -1,-0.3 -6,-0.2 -26,-0.2 -0.478 15.0 171.7 -65.2 137.9 47.3 31.0 5.2 44 76 A T + 0 0 28 -28,-2.7 37,-1.1 1,-0.2 2,-0.3 0.602 59.6 43.3-114.0 -25.8 46.9 34.5 3.8 45 77 A D E -ac 17 81A 32 -29,-1.9 -27,-1.6 35,-0.2 2,-0.4 -0.936 60.4-154.9-134.6 144.0 50.5 35.8 3.6 46 78 A L E -ac 18 82A 1 35,-2.6 37,-1.9 -2,-0.3 38,-1.7 -0.959 6.5-160.4-119.0 142.6 53.9 34.4 2.5 47 79 A E E -ac 19 84A 0 -29,-2.6 -27,-2.4 -2,-0.4 -26,-0.4 -0.989 28.6-164.5-113.8 119.1 57.4 35.4 3.5 48 80 A I E - c 0 85A 0 36,-2.1 38,-2.5 -2,-0.5 2,-0.3 -0.200 11.7-164.1 -98.1-170.7 59.7 34.1 0.7 49 81 A F + 0 0 16 36,-0.2 38,-0.1 -2,-0.1 35,-0.0 -0.924 50.3 78.8-155.9 172.5 63.4 33.5 0.3 50 82 A G + 0 0 2 36,-0.5 9,-1.4 -2,-0.3 37,-0.1 0.541 45.9 165.5 100.9 3.6 66.0 33.0 -2.4 51 83 A Y B -I 58 0B 22 35,-0.6 2,-0.5 7,-0.2 -1,-0.2 -0.316 23.2-152.8 -53.4 134.6 66.6 36.4 -3.8 52 84 A R > - 0 0 46 5,-2.6 4,-2.4 1,-0.1 5,-0.3 -0.968 6.1-156.0-116.4 121.4 69.8 36.4 -6.0 53 85 A E T 4 S+ 0 0 74 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.728 89.2 55.8 -72.0 -20.9 71.6 39.7 -6.2 54 86 A D T 4 S+ 0 0 127 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.948 125.5 18.8 -76.1 -43.2 73.3 39.1 -9.5 55 87 A T T 4 S- 0 0 76 2,-0.1 -2,-0.2 -3,-0.1 -1,-0.1 0.594 92.6-130.9 -99.9 -18.6 70.1 38.3 -11.5 56 88 A G < + 0 0 4 -4,-2.4 12,-0.3 1,-0.3 2,-0.2 0.595 69.6 117.0 72.5 11.7 67.5 39.9 -9.3 57 89 A K - 0 0 94 -5,-0.3 -5,-2.6 10,-0.1 2,-0.4 -0.468 62.9-119.3-106.0 175.5 65.4 36.6 -9.5 58 90 A F B +IJ 51 66B 5 8,-2.1 8,-2.7 -7,-0.2 2,-0.3 -0.952 38.9 151.2-119.1 135.1 64.4 34.1 -6.8 59 91 A G - 0 0 13 -9,-1.4 6,-0.1 -2,-0.4 -10,-0.0 -0.967 40.6-104.6-151.9 168.5 65.3 30.5 -6.7 60 92 A D 0 0 56 4,-0.4 -39,-0.0 -2,-0.3 -1,-0.0 -0.092 360.0 360.0 -76.7-170.1 65.9 27.7 -4.3 61 93 A Y 0 0 198 -2,-0.0 -1,-0.1 2,-0.0 -11,-0.0 0.111 360.0 360.0-108.1 360.0 69.3 26.4 -3.3 62 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 63 98 A T 0 0 162 0, 0.0 2,-0.2 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0 -41.4 68.3 25.5 -12.2 64 99 A T - 0 0 115 2,-0.0 -4,-0.4 0, 0.0 2,-0.3 -0.595 360.0-164.7 -95.1 148.5 65.3 27.8 -12.8 65 100 A F - 0 0 95 -2,-0.2 2,-0.4 -6,-0.1 -6,-0.2 -0.911 12.2-135.4-130.2 149.9 64.6 31.2 -11.3 66 101 A I B -J 58 0B 37 -8,-2.7 -8,-2.1 -2,-0.3 2,-0.1 -0.935 12.6-132.2-115.3 136.0 61.4 33.2 -11.2 67 102 A A > - 0 0 34 -2,-0.4 4,-2.3 -10,-0.2 3,-0.2 -0.456 30.1-109.4 -72.9 155.6 60.9 37.0 -11.8 68 103 A S H > S+ 0 0 2 -12,-0.3 4,-3.1 1,-0.2 5,-0.3 0.866 116.0 53.9 -53.0 -48.9 58.9 39.1 -9.4 69 104 A K H > S+ 0 0 161 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.912 112.5 43.1 -57.4 -44.4 56.0 39.6 -11.7 70 105 A D H > S+ 0 0 89 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.862 115.0 50.4 -71.0 -36.0 55.6 35.8 -12.3 71 106 A Y H X S+ 0 0 15 -4,-2.3 4,-2.1 2,-0.2 5,-0.3 0.972 111.4 47.1 -63.9 -53.7 56.0 35.1 -8.6 72 107 A K H X S+ 0 0 76 -4,-3.1 4,-2.9 1,-0.2 5,-0.3 0.909 111.1 53.4 -55.1 -43.3 53.4 37.7 -7.6 73 108 A K H X S+ 0 0 119 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.921 108.1 48.3 -58.4 -48.9 51.0 36.4 -10.2 74 109 A X H X S+ 0 0 46 -4,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.944 117.0 41.7 -57.2 -51.3 51.1 32.8 -9.0 75 110 A V H <>S+ 0 0 0 -4,-2.1 5,-2.1 2,-0.2 3,-0.5 0.944 114.3 50.8 -66.3 -47.2 50.6 33.7 -5.4 76 111 A D H ><5S+ 0 0 62 -4,-2.9 3,-1.8 -5,-0.3 -1,-0.2 0.916 107.0 55.0 -56.6 -43.0 47.9 36.3 -6.1 77 112 A D H 3<5S+ 0 0 108 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.829 105.1 53.8 -61.4 -32.3 46.0 33.8 -8.2 78 113 A A T 3<5S- 0 0 22 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.489 122.7-106.3 -78.4 -2.3 46.0 31.4 -5.2 79 114 A G T < 5S+ 0 0 60 -3,-1.8 2,-0.2 -4,-0.4 -3,-0.2 0.743 84.8 113.2 78.7 26.3 44.4 34.1 -2.9 80 115 A L < - 0 0 7 -5,-2.1 2,-0.4 -6,-0.1 -1,-0.3 -0.641 55.0-141.3-117.1 173.1 47.7 34.7 -1.1 81 116 A R E -c 45 0A 97 -37,-1.1 -35,-2.6 -2,-0.2 2,-0.9 -0.983 13.8-133.3-138.2 133.9 50.0 37.7 -0.9 82 117 A I E +c 46 0A 4 -2,-0.4 -35,-0.2 34,-0.2 3,-0.1 -0.782 39.8 160.6 -79.0 105.6 53.8 37.8 -0.7 83 118 A S E + 0 0 3 -37,-1.9 36,-1.9 -2,-0.9 37,-1.9 0.605 55.8 23.3-107.6 -15.3 54.2 40.3 2.1 84 119 A S E -c 47 0A 0 -38,-1.7 -36,-2.1 35,-0.2 2,-0.3 -0.925 57.0-161.3-145.9 170.9 57.7 39.7 3.2 85 120 A S E -c 48 0A 0 35,-0.5 37,-2.9 -38,-0.3 2,-0.5 -0.974 14.7-139.2-156.9 132.5 61.1 38.3 2.0 86 121 A H B +d 122 0A 19 -38,-2.5 -35,-0.6 -2,-0.3 -36,-0.5 -0.878 35.4 157.9 -93.9 126.9 64.2 37.0 3.7 87 122 A L - 0 0 8 35,-2.3 38,-0.2 -2,-0.5 -35,-0.1 -0.996 21.9-167.5-151.5 148.0 67.5 38.1 2.0 88 123 A T - 0 0 56 -2,-0.3 -2,-0.0 -37,-0.2 35,-0.0 -0.997 30.6-111.2-134.5 131.5 71.1 38.5 3.0 89 124 A P - 0 0 7 0, 0.0 13,-0.1 0, 0.0 -37,-0.0 -0.312 16.2-134.5 -57.5 146.7 73.9 40.2 1.1 90 125 A S S S+ 0 0 87 2,-0.0 2,-0.4 0, 0.0 -38,-0.0 0.803 86.5 93.7 -65.9 -29.8 76.6 38.0 -0.4 91 126 A L - 0 0 49 1,-0.2 7,-0.0 10,-0.1 14,-0.0 -0.540 54.2-178.8 -68.7 121.0 79.1 40.6 1.0 92 127 A R + 0 0 218 -2,-0.4 2,-1.1 1,-0.1 36,-0.4 0.516 50.6 97.0-100.1 -5.4 80.1 39.3 4.4 93 128 A E - 0 0 123 34,-0.1 2,-1.7 1,-0.1 5,-0.1 -0.705 55.0-165.5 -92.4 95.1 82.5 42.1 5.5 94 129 A Y + 0 0 36 -2,-1.1 2,-0.3 34,-0.1 44,-0.1 -0.581 35.8 138.8 -85.3 81.2 80.5 44.5 7.7 95 130 A T > - 0 0 44 -2,-1.7 3,-0.9 1,-0.1 4,-0.3 -0.853 65.9-116.2-122.5 155.9 82.9 47.4 7.7 96 131 A K G > S+ 0 0 90 -2,-0.3 3,-1.5 1,-0.3 -1,-0.1 0.903 116.7 57.6 -55.8 -39.5 82.5 51.2 7.5 97 132 A E G 3 S+ 0 0 155 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.779 105.2 50.4 -62.4 -31.0 84.4 51.1 4.2 98 133 A N G X> S+ 0 0 17 -3,-0.9 4,-1.9 1,-0.2 3,-0.6 0.355 76.8 103.9 -88.5 0.9 81.9 48.7 2.7 99 134 A X H <> S+ 0 0 27 -3,-1.5 4,-2.3 -4,-0.3 -1,-0.2 0.902 79.6 52.4 -57.8 -40.2 78.8 50.7 3.6 100 135 A P H 3> S+ 0 0 72 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.872 107.7 52.3 -62.2 -35.4 78.4 51.9 -0.1 101 136 A K H <> S+ 0 0 126 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.885 109.3 48.7 -64.3 -41.5 78.5 48.3 -1.3 102 137 A F H X S+ 0 0 1 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.897 107.7 56.0 -64.6 -38.5 75.8 47.3 1.1 103 138 A D H X S+ 0 0 25 -4,-2.3 4,-2.8 -5,-0.2 5,-0.2 0.909 105.4 52.0 -57.6 -43.0 73.8 50.3 -0.1 104 139 A E H X S+ 0 0 117 -4,-1.8 4,-2.2 1,-0.2 5,-0.3 0.931 109.6 49.4 -62.4 -41.2 74.0 49.0 -3.7 105 140 A F H X S+ 0 0 15 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.937 114.9 43.5 -57.1 -52.8 72.8 45.6 -2.6 106 141 A W H X S+ 0 0 1 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.845 111.2 54.1 -69.4 -33.5 69.8 47.1 -0.8 107 142 A K H X S+ 0 0 87 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.953 113.7 41.5 -63.4 -49.8 68.9 49.6 -3.5 108 143 A K H X S+ 0 0 95 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.943 114.6 51.2 -65.2 -42.9 68.7 46.9 -6.2 109 144 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 0.883 108.6 52.5 -61.0 -37.8 66.9 44.5 -3.9 110 145 A T H X S+ 0 0 5 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.922 106.2 53.0 -65.7 -42.9 64.4 47.2 -3.0 111 146 A D H X S+ 0 0 115 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.912 113.7 43.7 -57.2 -43.7 63.6 47.9 -6.7 112 147 A I H X S+ 0 0 24 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.915 114.2 48.8 -69.6 -40.1 62.9 44.2 -7.3 113 148 A H H X>S+ 0 0 0 -4,-2.5 5,-1.5 2,-0.2 4,-1.5 0.786 104.4 58.9 -77.7 -23.4 60.9 43.8 -4.1 114 149 A A H <5S+ 0 0 50 -4,-2.6 3,-0.3 2,-0.2 -1,-0.2 0.927 107.4 48.4 -65.6 -41.6 58.8 46.9 -4.9 115 150 A E H <5S+ 0 0 125 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.899 108.7 53.1 -59.3 -41.0 57.8 45.1 -8.1 116 151 A L H <5S- 0 0 1 -4,-1.6 -34,-0.2 -5,-0.1 -1,-0.2 0.767 109.3-130.3 -68.6 -26.4 57.1 42.0 -6.0 117 152 A G T <5 + 0 0 27 -4,-1.5 -3,-0.2 -3,-0.3 -2,-0.1 0.659 46.5 161.0 84.7 23.2 54.7 44.2 -3.8 118 153 A V < - 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