==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-MAY-00 1EX7 . COMPND 2 MOLECULE: GUANYLATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.BLASZCZYK,X.JI . 186 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10241.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 137 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 5.9 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 . 2 1.1 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 . 13 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 68 36.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.6 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 0 0 0 0 1 1 1 2 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 2 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 PARALLEL BRIDGES PER LADDER . 0 1 0 0 0 1 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 1 1 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 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 S 0 0 89 0, 0.0 94,-0.4 0, 0.0 91,-0.1 0.000 360.0 360.0 360.0-162.3 9.3 30.0 61.7 2 2 A R - 0 0 64 183,-0.3 113,-0.1 1,-0.1 112,-0.1 -0.465 360.0-110.2 -65.7 136.9 12.3 28.4 63.5 3 3 A P - 0 0 12 0, 0.0 113,-2.7 0, 0.0 2,-0.5 -0.297 24.9-134.2 -69.4 155.2 14.7 31.2 64.6 4 4 A I E -ab 96 116A 0 91,-2.8 93,-3.1 111,-0.2 2,-0.6 -0.927 10.2-157.3-111.8 123.6 18.0 31.5 63.0 5 5 A V E -ab 97 117A 0 111,-3.1 113,-3.1 -2,-0.5 2,-0.5 -0.885 12.7-169.8 -98.4 117.7 21.2 31.9 65.0 6 6 A I E +ab 98 118A 3 91,-3.3 93,-1.5 -2,-0.6 2,-0.3 -0.924 12.1 165.5-110.5 132.0 24.0 33.6 63.0 7 7 A S E + b 0 119A 1 111,-2.3 113,-2.4 -2,-0.5 93,-0.1 -0.904 9.2 126.5-133.6 170.5 27.5 33.7 64.3 8 8 A G - 0 0 10 91,-0.3 113,-0.1 -2,-0.3 4,-0.1 -0.687 59.5 -64.2 155.8 158.7 31.0 34.5 63.0 9 9 A P > - 0 0 11 0, 0.0 3,-0.9 0, 0.0 5,-0.3 -0.348 54.3-105.3 -65.6 145.9 34.0 36.7 63.8 10 10 A S T 3 S+ 0 0 67 1,-0.2 140,-0.0 2,-0.1 -2,-0.0 -0.453 104.7 49.1 -63.3 141.7 33.6 40.5 63.4 11 11 A G T 3 S+ 0 0 7 -2,-0.1 -1,-0.2 -3,-0.1 120,-0.0 0.284 80.1 99.9 106.9 -2.7 35.4 41.8 60.2 12 12 A T S < S- 0 0 1 -3,-0.9 -2,-0.1 108,-0.1 109,-0.0 0.529 99.4-106.1 -92.2 -6.2 33.9 39.2 57.9 13 13 A G S > S+ 0 0 22 107,-0.0 4,-1.7 3,-0.0 3,-0.5 0.549 76.7 137.1 89.5 11.0 31.1 41.5 56.4 14 14 A K H > + 0 0 26 -5,-0.3 4,-1.8 1,-0.2 5,-0.2 0.848 66.4 56.7 -60.8 -34.7 28.4 39.8 58.4 15 15 A S H > S+ 0 0 89 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.888 106.8 51.6 -66.2 -35.5 26.7 43.1 59.4 16 16 A T H > S+ 0 0 53 -3,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.868 105.5 53.3 -68.1 -39.4 26.4 43.9 55.7 17 17 A L H X S+ 0 0 3 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.870 111.0 47.3 -62.1 -37.6 24.8 40.6 54.9 18 18 A L H X S+ 0 0 12 -4,-1.8 4,-3.0 1,-0.2 5,-0.2 0.929 108.2 55.2 -75.0 -34.8 22.2 41.2 57.5 19 19 A K H X S+ 0 0 153 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.902 108.4 48.3 -60.9 -39.2 21.6 44.7 56.3 20 20 A K H X S+ 0 0 66 -4,-2.3 4,-2.1 1,-0.2 3,-0.5 0.978 111.6 50.2 -68.3 -42.4 20.9 43.5 52.8 21 21 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.910 108.8 50.1 -60.6 -45.4 18.5 40.9 54.1 22 22 A F H < S+ 0 0 55 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.2 0.826 111.2 50.9 -65.5 -25.6 16.5 43.2 56.4 23 23 A A H < S+ 0 0 75 -4,-1.5 -2,-0.2 -3,-0.5 -1,-0.2 0.970 114.6 40.1 -72.7 -55.4 16.0 45.7 53.4 24 24 A E H < S+ 0 0 95 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.832 131.9 25.7 -63.1 -35.6 14.8 43.2 50.9 25 25 A Y >X + 0 0 60 -4,-2.4 4,-1.4 -5,-0.3 3,-1.2 -0.408 68.6 148.7-128.9 59.2 12.6 41.2 53.4 26 26 A P T 34 S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.800 77.3 48.9 -66.3 -21.0 11.6 43.7 56.2 27 27 A D T 34 S+ 0 0 133 -3,-0.1 3,-0.1 1,-0.1 -2,-0.1 0.541 109.5 52.7 -96.1 -2.5 8.3 42.0 56.8 28 28 A S T <4 S+ 0 0 53 -3,-1.2 66,-3.7 1,-0.2 2,-0.4 0.764 105.6 46.7-101.5 -23.9 9.7 38.5 57.0 29 29 A F E < -c 94 0A 7 -4,-1.4 2,-0.4 64,-0.3 66,-0.2 -0.942 56.0-163.5-127.3 146.2 12.4 38.8 59.5 30 30 A G E -c 95 0A 7 64,-2.8 66,-2.5 -2,-0.4 2,-0.4 -0.954 20.6-130.0-124.0 144.9 12.8 40.3 62.9 31 31 A F E -c 96 0A 61 -2,-0.4 2,-0.5 64,-0.2 66,-0.2 -0.812 17.8-126.0 -94.7 128.2 16.1 41.0 64.7 32 32 A S - 0 0 1 64,-3.1 2,-0.8 -2,-0.4 66,-0.4 -0.594 25.8-143.1 -72.0 121.3 16.7 39.8 68.3 33 33 A V - 0 0 22 -2,-0.5 48,-0.4 48,-0.1 17,-0.2 -0.819 16.3-145.9 -93.5 107.0 17.7 43.0 70.1 34 34 A S - 0 0 13 -2,-0.8 17,-3.0 15,-0.4 2,-0.4 -0.383 7.8-126.9 -73.9 150.5 20.3 42.1 72.7 35 35 A S E +eF 51 79B 5 44,-2.3 44,-1.9 15,-0.2 2,-0.3 -0.788 36.3 174.3 -86.0 137.2 20.7 43.8 76.0 36 36 A T E -eF 52 78B 0 15,-2.6 17,-2.3 -2,-0.4 42,-0.2 -0.999 37.7-151.2-145.7 151.8 24.2 45.1 76.7 37 37 A T + 0 0 19 40,-2.0 18,-0.1 -2,-0.3 41,-0.1 0.443 66.0 111.6 -93.5 -4.1 26.0 47.2 79.4 38 38 A R S S- 0 0 16 39,-0.5 -2,-0.1 1,-0.1 15,-0.1 -0.384 79.5 -96.5 -73.1 157.3 28.5 48.5 76.9 39 39 A T - 0 0 114 1,-0.1 -1,-0.1 13,-0.1 -2,-0.1 -0.468 46.8-105.4 -62.6 125.2 28.6 52.2 75.9 40 40 A P - 0 0 73 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.119 32.8-139.2 -55.8 156.7 26.7 52.9 72.6 41 41 A R > - 0 0 151 1,-0.1 3,-2.9 -3,-0.1 -3,-0.0 -0.793 38.2 -67.8-114.9 157.7 28.8 53.6 69.4 42 42 A A T 3 S+ 0 0 111 1,-0.3 -1,-0.1 -2,-0.3 3,-0.1 -0.108 122.2 13.5 -52.7 134.3 28.2 56.1 66.7 43 43 A G T 3 S+ 0 0 73 1,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.267 92.9 132.4 84.7 -12.8 25.1 55.3 64.7 44 44 A E < - 0 0 42 -3,-2.9 2,-0.5 1,-0.1 -1,-0.3 -0.573 44.0-151.8 -73.8 140.5 23.9 52.8 67.2 45 45 A V >>> - 0 0 72 -2,-0.2 3,-3.1 -3,-0.1 4,-2.4 -0.953 15.7-122.3-117.3 123.1 20.2 53.2 68.2 46 46 A N B 345S+h 50 0C 94 -2,-0.5 5,-0.2 1,-0.3 0, 0.0 -0.285 102.3 21.3 -54.8 130.3 18.8 52.2 71.5 47 47 A G T 345S+ 0 0 26 3,-2.1 -1,-0.3 -13,-0.2 4,-0.2 0.309 128.4 53.3 89.1 -7.8 16.0 49.7 71.0 48 48 A K T <45S+ 0 0 128 -3,-3.1 -2,-0.2 2,-0.7 3,-0.1 0.750 117.2 21.4-121.6 -52.0 17.4 48.8 67.5 49 49 A D T <5S- 0 0 70 -4,-2.4 -15,-0.4 1,-0.4 2,-0.3 0.896 137.0 -21.5 -76.0 -43.0 21.0 47.9 67.6 50 50 A Y B < -h 46 0C 52 -5,-0.7 -3,-2.1 -17,-0.2 2,-0.8 -0.916 59.1-111.8-158.4 155.3 21.0 47.0 71.2 51 51 A N E -e 35 0B 57 -17,-3.0 -15,-2.6 -2,-0.3 2,-0.6 -0.930 39.5-152.1 -92.4 101.6 19.0 47.6 74.4 52 52 A F E +e 36 0B 33 -2,-0.8 2,-0.3 -17,-0.2 -15,-0.2 -0.705 26.6 166.2 -81.4 122.9 21.6 49.6 76.3 53 53 A V - 0 0 38 -17,-2.3 2,-0.1 -2,-0.6 -2,-0.0 -0.865 35.4 -97.7-134.8 166.9 21.0 49.1 80.0 54 54 A S > - 0 0 70 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.280 34.6-110.0 -80.4 167.5 22.8 49.7 83.2 55 55 A V H > S+ 0 0 63 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.916 119.5 54.1 -62.8 -38.8 24.9 47.1 85.1 56 56 A D H > S+ 0 0 128 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.938 109.7 46.1 -64.1 -39.6 22.2 47.1 87.8 57 57 A E H > S+ 0 0 76 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.908 111.2 52.3 -69.1 -39.1 19.5 46.4 85.4 58 58 A F H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.942 110.3 48.0 -61.5 -47.6 21.6 43.6 83.7 59 59 A K H X S+ 0 0 91 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.917 111.3 53.0 -56.2 -38.2 22.2 41.9 87.1 60 60 A S H X S+ 0 0 39 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.921 106.5 50.9 -62.3 -43.6 18.5 42.3 87.7 61 61 A M H <>S+ 0 0 8 -4,-2.3 5,-2.6 2,-0.2 6,-0.4 0.916 110.9 49.1 -58.3 -46.0 17.7 40.6 84.4 62 62 A I H ><5S+ 0 0 42 -4,-2.5 3,-2.5 1,-0.2 -2,-0.2 0.981 111.5 48.8 -57.3 -53.4 20.0 37.7 85.3 63 63 A K H 3<5S+ 0 0 161 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.850 112.1 48.5 -60.5 -31.9 18.4 37.3 88.7 64 64 A N T 3<5S- 0 0 105 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.166 112.2-117.8 -95.3 17.1 14.9 37.4 87.3 65 65 A N T < 5 + 0 0 138 -3,-2.5 -3,-0.2 1,-0.1 -2,-0.1 0.873 63.7 146.3 55.5 45.9 15.7 34.8 84.6 66 66 A E < + 0 0 73 -5,-2.6 16,-1.9 -6,-0.1 17,-0.5 0.536 44.7 87.1 -95.3 -1.1 15.0 37.2 81.7 67 67 A F E -G 81 0B 25 -6,-0.4 14,-0.3 14,-0.2 3,-0.2 -0.710 55.9-161.6-106.3 147.7 17.6 35.7 79.4 68 68 A I E S- 0 0 33 12,-4.0 2,-0.3 1,-0.5 13,-0.2 0.855 93.0 -19.6 -74.8 -45.0 17.7 33.0 76.9 69 69 A E E -G 80 0B 15 11,-1.4 11,-1.8 -3,-0.1 -1,-0.5 -0.986 67.9-171.9-153.7 157.6 21.5 33.2 77.3 70 70 A W E +G 79 0B 113 -2,-0.3 2,-0.3 9,-0.2 9,-0.3 -0.990 7.2 169.0-153.6 157.8 24.0 35.8 78.5 71 71 A A E -G 78 0B 9 7,-2.9 7,-2.4 -2,-0.3 2,-0.3 -0.905 29.5-116.0-152.9 173.3 27.8 36.3 78.5 72 72 A Q E -G 77 0B 93 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.912 23.4-176.6-116.4 149.5 30.5 38.9 79.2 73 73 A F E > S-G 76 0B 100 3,-2.5 3,-1.9 -2,-0.3 -2,-0.0 -0.957 74.9 -11.7-142.6 122.6 32.9 40.1 76.6 74 74 A S T 3 S- 0 0 84 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.845 129.6 -53.6 52.9 36.7 35.7 42.6 77.5 75 75 A G T 3 S+ 0 0 55 1,-0.3 2,-0.3 -37,-0.0 -1,-0.3 0.451 118.4 104.3 81.6 1.0 34.1 43.2 81.0 76 76 A N E < - G 0 73B 57 -3,-1.9 -3,-2.5 -40,-0.0 2,-0.3 -0.808 67.6-120.0-112.8 159.5 30.7 44.1 79.6 77 77 A Y E + G 0 72B 37 -2,-0.3 -40,-2.0 -5,-0.2 -39,-0.5 -0.731 27.0 177.0-100.5 147.5 27.5 42.0 79.6 78 78 A Y E +FG 36 71B 39 -7,-2.4 -7,-2.9 -2,-0.3 2,-0.3 -0.992 8.7 163.6-139.2 144.7 25.5 40.9 76.6 79 79 A G E -FG 35 70B 0 -44,-1.9 -44,-2.3 -2,-0.3 2,-0.5 -0.986 36.1-123.3-166.3 154.9 22.4 38.7 76.4 80 80 A S E - G 0 69B 0 -11,-1.8 -12,-4.0 -2,-0.3 -11,-1.4 -0.864 36.5-143.3 -95.5 121.6 19.5 37.4 74.4 81 81 A T E > - G 0 67B 11 -2,-0.5 4,-1.9 -48,-0.4 -14,-0.2 -0.621 17.8-134.1 -94.0 148.2 16.2 38.0 76.1 82 82 A V H > S+ 0 0 72 -16,-1.9 4,-2.3 -2,-0.3 5,-0.2 0.938 107.1 56.2 -52.5 -47.6 13.1 35.8 76.2 83 83 A A H > S+ 0 0 46 -17,-0.5 4,-2.8 2,-0.2 5,-0.2 0.937 104.7 47.0 -57.6 -51.9 11.0 38.9 75.5 84 84 A S H > S+ 0 0 15 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.941 113.3 49.9 -61.4 -41.7 12.7 40.1 72.3 85 85 A V H X S+ 0 0 17 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.905 113.3 45.5 -63.9 -39.0 12.6 36.6 70.8 86 86 A K H X S+ 0 0 123 -4,-2.3 4,-2.8 1,-0.2 5,-0.4 0.893 107.4 56.4 -74.5 -38.1 8.9 36.1 71.6 87 87 A Q H X S+ 0 0 119 -4,-2.8 4,-1.4 -5,-0.2 -1,-0.2 0.869 113.7 41.1 -59.9 -31.2 7.7 39.6 70.4 88 88 A V H X>S+ 0 0 19 -4,-1.5 5,-2.1 -5,-0.2 4,-0.5 0.948 119.0 42.6 -76.3 -51.9 9.2 38.9 67.0 89 89 A S H ><5S+ 0 0 46 -4,-1.7 3,-1.6 -5,-0.2 -2,-0.2 0.935 115.7 49.5 -60.5 -52.2 8.2 35.3 66.6 90 90 A K H 3<5S+ 0 0 161 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.951 103.5 63.7 -49.1 -52.8 4.8 36.1 68.0 91 91 A S H 3<5S- 0 0 73 -4,-1.4 -1,-0.3 -5,-0.4 -2,-0.2 0.674 119.7-111.2 -48.7 -21.6 4.8 39.0 65.4 92 92 A G T <<5S+ 0 0 62 -3,-1.6 2,-0.2 -4,-0.5 -3,-0.2 0.616 79.6 118.3 96.7 11.9 4.9 36.4 62.7 93 93 A K S - 0 0 58 -2,-0.3 4,-2.5 -93,-0.1 5,-0.2 -0.175 46.1 -86.8 -92.4-171.6 28.9 34.7 69.6 101 101 A M H > S+ 0 0 41 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.886 127.4 56.9 -65.7 -33.0 30.1 31.2 69.9 102 102 A Q H > S+ 0 0 101 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.936 109.8 46.4 -55.7 -45.6 29.4 31.2 73.7 103 103 A G H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.925 109.3 54.3 -63.6 -41.9 25.8 32.1 72.8 104 104 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.946 108.8 47.8 -58.4 -48.4 25.6 29.4 70.1 105 105 A K H X S+ 0 0 108 -4,-2.6 4,-0.8 1,-0.2 -1,-0.2 0.861 112.5 50.5 -60.3 -35.4 26.7 26.8 72.6 106 106 A S H >< S+ 0 0 49 -4,-1.9 3,-0.7 -5,-0.2 -2,-0.2 0.921 111.4 46.0 -66.8 -49.2 24.1 28.0 75.1 107 107 A V H >< S+ 0 0 4 -4,-2.9 3,-2.0 1,-0.3 6,-0.2 0.878 104.3 63.9 -67.5 -31.3 21.2 28.0 72.6 108 108 A K H 3< S+ 0 0 78 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.887 98.6 54.9 -57.7 -33.1 22.2 24.6 71.4 109 109 A A T << S+ 0 0 81 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.249 90.3 81.1 -91.1 22.0 21.4 23.3 74.8 110 110 A I X> - 0 0 36 -3,-2.0 3,-3.3 1,-0.1 4,-0.5 -0.636 58.2-179.5-118.8 72.6 17.9 24.7 74.6 111 111 A P G >4 S+ 0 0 103 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.758 74.1 66.4 -48.5 -29.5 16.1 22.0 72.6 112 112 A E G 34 S+ 0 0 157 1,-0.2 -3,-0.0 -3,-0.1 -2,-0.0 0.701 88.7 63.4 -71.4 -16.9 12.9 23.9 72.7 113 113 A L G <4 S- 0 0 42 -3,-3.3 -1,-0.2 -6,-0.2 -5,-0.1 0.845 81.7-159.3 -77.3 -21.1 14.1 26.8 70.6 114 114 A N << + 0 0 101 -3,-0.8 -2,-0.1 -4,-0.5 -1,-0.1 0.831 27.4 178.9 50.0 37.4 14.6 24.4 67.7 115 115 A A - 0 0 10 -5,-0.3 2,-0.3 -8,-0.2 -111,-0.2 -0.215 27.0-132.8 -68.5 159.5 17.0 27.1 66.2 116 116 A R E -b 4 0A 10 -113,-2.7 -111,-3.1 2,-0.0 2,-0.5 -0.847 21.4-139.9-100.6 145.6 18.9 26.8 63.0 117 117 A F E +b 5 0A 14 -2,-0.3 47,-1.4 -113,-0.2 46,-1.4 -0.934 20.6 177.4-119.9 130.5 22.6 27.7 63.1 118 118 A L E -bd 6 164A 0 -113,-3.1 -111,-2.3 -2,-0.5 2,-0.4 -0.998 9.4-162.3-132.2 134.2 24.5 29.6 60.4 119 119 A F E -bd 7 165A 1 45,-2.1 47,-3.3 -2,-0.4 2,-0.6 -0.949 6.5-154.4-120.9 132.9 28.2 30.5 60.6 120 120 A I E - d 0 166A 3 -113,-2.4 47,-0.2 -2,-0.4 -108,-0.1 -0.964 19.8-164.8-109.2 110.9 29.8 33.1 58.5 121 121 A A E - d 0 167A 4 45,-2.7 47,-3.4 -2,-0.6 -113,-0.0 -0.685 19.7-117.7-100.6 151.6 33.5 32.5 58.1 122 122 A P - 0 0 7 0, 0.0 47,-0.1 0, 0.0 3,-0.1 -0.448 34.3-109.1 -75.1 155.8 36.3 34.7 56.8 123 123 A P S S- 0 0 46 0, 0.0 2,-0.3 0, 0.0 46,-0.1 0.807 95.3 -27.7 -61.3 -27.1 38.1 33.6 53.6 124 124 A S > - 0 0 45 1,-0.1 4,-1.8 0, 0.0 5,-0.2 -0.947 60.0-107.1-173.3 164.8 41.0 32.9 56.0 125 125 A V H > S+ 0 0 33 -2,-0.3 4,-2.4 2,-0.2 5,-0.1 0.866 119.0 57.9 -71.2 -33.8 42.5 34.1 59.3 126 126 A E H > S+ 0 0 106 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.933 107.5 46.8 -62.0 -45.9 45.3 35.8 57.4 127 127 A D H > S+ 0 0 46 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.878 109.9 54.0 -62.5 -37.6 42.7 37.9 55.5 128 128 A L H X S+ 0 0 3 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.890 106.2 53.1 -61.5 -40.1 40.8 38.7 58.8 129 129 A K H X S+ 0 0 64 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.934 107.3 51.0 -59.7 -41.8 44.0 40.0 60.2 130 130 A K H X S+ 0 0 113 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.901 110.0 49.8 -61.5 -44.9 44.6 42.3 57.3 131 131 A R H X S+ 0 0 103 -4,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.935 112.0 47.6 -62.2 -39.9 41.1 43.7 57.6 132 132 A L H >X S+ 0 0 3 -4,-2.2 3,-0.7 1,-0.2 4,-0.6 0.924 115.4 43.4 -71.7 -41.9 41.6 44.3 61.3 133 133 A E H >< S+ 0 0 105 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.816 107.8 63.4 -68.9 -30.3 44.9 46.0 60.9 134 134 A G H 3< S+ 0 0 67 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.638 95.5 58.4 -67.7 -20.4 43.5 47.9 58.0 135 135 A R H << S- 0 0 141 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.782 91.5-146.4 -83.0 -28.7 40.9 49.7 60.2 136 136 A G << + 0 0 66 -3,-0.6 -3,-0.1 -4,-0.6 -2,-0.1 0.348 69.3 102.7 82.3 -5.3 43.6 51.3 62.4 137 137 A T + 0 0 104 -5,-0.3 2,-0.3 2,-0.1 -4,-0.1 0.560 65.6 65.5 -86.9 -16.2 41.4 51.1 65.6 138 138 A E S S- 0 0 71 -6,-0.4 2,-0.1 -5,-0.1 -2,-0.1 -0.735 72.0-120.1-113.7 168.8 42.8 48.1 67.5 139 139 A T > - 0 0 77 -2,-0.3 4,-1.6 1,-0.1 5,-0.1 -0.262 31.7-106.9 -83.1 177.7 46.1 47.2 69.2 140 140 A E H > S+ 0 0 135 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.880 122.0 50.1 -68.7 -43.5 48.5 44.4 68.4 141 141 A E H > S+ 0 0 123 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.880 109.5 47.9 -67.9 -42.7 47.2 42.7 71.6 142 142 A S H > S+ 0 0 29 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.928 111.6 51.0 -71.1 -33.7 43.5 43.0 70.8 143 143 A I H X S+ 0 0 11 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.943 108.0 51.7 -67.7 -36.6 44.0 41.7 67.3 144 144 A N H X S+ 0 0 71 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.930 111.2 50.1 -60.5 -40.2 45.9 38.6 68.5 145 145 A K H X S+ 0 0 141 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.883 110.8 47.2 -64.1 -42.1 43.1 38.0 70.9 146 146 A R H X S+ 0 0 69 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.914 109.8 53.5 -71.4 -31.6 40.5 38.3 68.2 147 147 A L H X S+ 0 0 15 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.836 108.0 51.1 -70.1 -32.6 42.5 36.0 65.9 148 148 A S H X S+ 0 0 76 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.907 110.2 49.0 -68.6 -41.7 42.6 33.4 68.6 149 149 A A H X S+ 0 0 49 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.912 110.3 51.1 -60.2 -39.5 38.9 33.6 69.1 150 150 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.905 108.9 51.3 -67.0 -37.8 38.3 33.3 65.3 151 151 A Q H X S+ 0 0 114 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.872 107.9 52.7 -63.3 -41.0 40.5 30.2 65.2 152 152 A A H X S+ 0 0 44 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.895 109.6 48.7 -60.2 -42.9 38.5 28.7 68.1 153 153 A E H X S+ 0 0 21 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.873 108.5 52.5 -67.5 -35.7 35.2 29.3 66.2 154 154 A L H X S+ 0 0 49 -4,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.871 110.8 49.0 -66.7 -33.3 36.6 27.8 63.0 155 155 A A H >< S+ 0 0 58 -4,-1.9 3,-0.6 1,-0.2 4,-0.3 0.922 109.6 50.9 -73.4 -42.1 37.6 24.7 65.0 156 156 A Y H ><>S+ 0 0 47 -4,-2.7 3,-1.9 1,-0.2 5,-0.8 0.899 104.0 58.5 -60.0 -38.6 34.2 24.5 66.6 157 157 A A H ><5S+ 0 0 15 -4,-2.3 3,-1.8 1,-0.3 5,-0.4 0.880 95.5 64.5 -62.2 -26.6 32.5 24.7 63.2 158 158 A E T <<5S+ 0 0 177 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.594 88.3 68.3 -74.0 -5.1 34.4 21.5 62.1 159 159 A T T < 5S- 0 0 99 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.457 117.8-111.8 -83.5 -4.7 32.6 19.5 64.7 160 160 A G T < 5S+ 0 0 57 -3,-1.8 -2,-0.1 -4,-0.2 -3,-0.1 0.756 71.1 143.3 79.6 25.9 29.4 20.0 62.6 161 161 A A < + 0 0 9 -5,-0.8 2,-0.3 -4,-0.2 -4,-0.1 0.821 55.2 67.3 -68.6 -23.8 27.8 22.3 65.1 162 162 A H S S- 0 0 20 -5,-0.4 -44,-0.2 -6,-0.2 3,-0.1 -0.719 74.1-139.9-101.0 154.9 26.3 24.5 62.5 163 163 A D S S+ 0 0 95 -46,-1.4 2,-0.3 -2,-0.3 -45,-0.2 0.825 92.3 9.0 -71.4 -33.2 23.6 23.6 59.9 164 164 A K E -d 118 0A 90 -47,-1.4 -45,-2.1 -3,-0.1 2,-0.5 -0.994 61.1-154.3-151.5 141.9 25.5 25.6 57.3 165 165 A V E -d 119 0A 61 -2,-0.3 2,-0.5 -47,-0.2 -45,-0.2 -0.976 13.6-167.7-114.5 128.4 28.9 27.3 57.0 166 166 A I E -d 120 0A 0 -47,-3.3 -45,-2.7 -2,-0.5 2,-0.7 -0.974 11.6-149.9-116.4 127.3 29.2 30.2 54.5 167 167 A V E -d 121 0A 56 -2,-0.5 2,-1.6 -47,-0.2 3,-0.1 -0.831 14.1-147.6 -92.7 116.2 32.7 31.6 53.6 168 168 A N + 0 0 10 -47,-3.4 3,-0.1 -2,-0.7 -154,-0.0 -0.626 48.4 136.4 -91.4 88.9 32.2 35.2 52.8 169 169 A D S S+ 0 0 98 -2,-1.6 2,-0.2 1,-0.3 -1,-0.2 0.106 78.3 26.1-108.6 18.1 34.8 35.9 50.1 170 170 A D S > S- 0 0 91 -3,-0.1 4,-2.5 1,-0.1 -1,-0.3 -0.720 73.6-139.7-177.8 120.9 32.3 38.0 48.0 171 171 A L H > S+ 0 0 63 1,-0.2 4,-2.3 -2,-0.2 5,-0.2 0.939 101.0 44.6 -60.1 -49.3 29.3 39.9 49.4 172 172 A D H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.890 114.4 48.4 -68.0 -37.1 26.8 39.1 46.7 173 173 A K H > S+ 0 0 67 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.953 113.8 46.3 -67.3 -43.0 27.7 35.4 46.5 174 174 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.862 110.4 55.4 -61.8 -35.3 27.5 34.9 50.3 175 175 A Y H X S+ 0 0 12 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 0.927 107.3 50.0 -64.6 -43.7 24.2 36.8 50.2 176 176 A K H X S+ 0 0 115 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.970 112.0 45.8 -52.4 -59.6 23.0 34.3 47.6 177 177 A E H X S+ 0 0 61 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.912 109.3 56.5 -56.1 -43.6 24.0 31.4 49.8 178 178 A L H X S+ 0 0 2 -4,-2.9 4,-2.7 -5,-0.2 -1,-0.2 0.940 109.1 45.9 -51.6 -50.7 22.5 33.0 52.8 179 179 A K H X S+ 0 0 50 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.871 110.6 52.1 -63.5 -42.2 19.1 33.3 50.9 180 180 A D H < S+ 0 0 86 -4,-2.3 4,-0.4 2,-0.2 -1,-0.2 0.850 113.2 46.5 -59.3 -42.3 19.2 29.7 49.7 181 181 A F H >< S+ 0 0 27 -4,-2.5 3,-1.2 -5,-0.3 4,-0.4 0.976 114.5 44.4 -63.4 -58.3 19.9 28.5 53.2 182 182 A I H >< S+ 0 0 4 -4,-2.7 3,-1.0 1,-0.3 -2,-0.2 0.916 116.1 44.8 -58.7 -41.9 17.2 30.6 54.9 183 183 A F T 3< S+ 0 0 88 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.500 83.1 93.1 -89.8 2.2 14.5 29.9 52.5 184 184 A A T < S- 0 0 60 -3,-1.2 2,-0.6 -4,-0.4 -1,-0.3 0.816 91.7-140.3 -52.8 -28.4 15.4 26.1 52.4 185 185 A E < 0 0 110 -3,-1.0 -183,-0.3 -4,-0.4 -1,-0.2 -0.481 360.0 360.0 102.5 -49.2 12.6 26.3 55.1 186 186 A K 0 0 182 -2,-0.6 -1,-0.2 -185,-0.1 -4,-0.1 0.027 360.0 360.0-174.9 360.0 14.0 23.8 57.7