==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 12-APR-07 2PHZ . COMPND 2 MOLECULE: IRON-UPTAKE SYSTEM-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR J.BENACH,H.NEELY,J.SEETHARAMAN,C.X.CHEN,K.CUNNINGHAM,L-C.MA, . 277 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13666.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 6.1 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 . 4 1.4 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 . 19 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.2 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 3 2 0 3 1 0 1 0 1 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 1 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 PARALLEL BRIDGES PER LADDER . 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 20 A K 0 0 160 0, 0.0 11,-2.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 137.9 48.3 2.2 76.7 2 21 A K E -A 11 0A 147 9,-0.2 2,-0.5 7,-0.1 9,-0.2 -0.601 360.0-164.1 -78.5 131.4 47.4 3.1 73.2 3 22 A I E -A 10 0A 6 7,-3.6 7,-2.3 -2,-0.3 2,-0.6 -0.970 7.0-154.8-119.2 126.2 45.3 6.3 72.9 4 23 A E E +A 9 0A 111 -2,-0.5 2,-0.4 5,-0.2 5,-0.2 -0.897 21.5 169.6-101.9 117.2 43.4 7.2 69.7 5 24 A Y E > -A 8 0A 10 3,-2.7 3,-0.7 -2,-0.6 -2,-0.1 -0.972 68.0 -21.7-133.3 120.1 42.9 10.9 69.3 6 25 A L T 3 S- 0 0 68 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.882 127.5 -49.9 48.7 46.5 41.5 12.5 66.2 7 26 A D T 3 S+ 0 0 168 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.766 117.7 107.2 67.5 29.9 42.6 9.5 64.1 8 27 A K E < -A 5 0A 111 -3,-0.7 -3,-2.7 2,-0.0 2,-0.3 -0.999 64.2-127.9-140.6 136.6 46.2 9.4 65.4 9 28 A T E -A 4 0A 65 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.647 24.4-179.9 -87.4 137.3 47.7 6.9 67.8 10 29 A Y E -A 3 0A 25 -7,-2.3 -7,-3.6 -2,-0.3 2,-0.6 -0.986 18.3-145.3-134.3 142.4 49.6 7.9 71.0 11 30 A E E +A 2 0A 136 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.950 31.6 164.5-112.3 119.8 51.3 5.7 73.6 12 31 A V - 0 0 6 -11,-2.2 2,-0.6 -2,-0.6 68,-0.1 -0.974 44.3-109.5-139.9 151.9 51.1 7.0 77.1 13 32 A T - 0 0 93 -2,-0.3 66,-0.1 66,-0.3 -2,-0.0 -0.667 58.3-130.8 -76.5 116.8 51.5 5.9 80.7 14 33 A V S S+ 0 0 29 -2,-0.6 2,-0.1 1,-0.2 108,-0.1 -0.983 73.1 26.7-143.2 153.4 48.0 5.8 82.2 15 34 A P S S+ 0 0 98 0, 0.0 2,-0.3 0, 0.0 107,-0.3 0.519 89.1 164.4 -72.9 149.4 46.2 6.6 84.3 16 35 A T - 0 0 10 105,-2.8 3,-0.1 -2,-0.1 -2,-0.1 -0.930 43.0-173.6-136.9 159.1 48.5 9.6 85.0 17 36 A D S S+ 0 0 111 -2,-0.3 2,-3.3 1,-0.1 22,-0.8 0.476 70.5 96.4-120.1 -18.8 48.7 12.9 86.8 18 37 A K + 0 0 81 20,-0.2 61,-2.0 21,-0.1 62,-1.6 -0.337 57.4 145.9 -72.9 61.6 52.1 13.9 85.4 19 38 A I E -b 80 0B 0 -2,-3.3 21,-2.2 59,-0.2 20,-1.2 -0.907 37.0-158.2-107.9 129.3 50.3 15.9 82.7 20 39 A A E -bc 81 40B 0 60,-2.4 62,-2.9 -2,-0.5 2,-0.6 -0.928 7.0-159.9-109.4 116.9 51.7 19.2 81.4 21 40 A I E +b 82 0B 0 19,-3.1 2,-0.4 -2,-0.6 41,-0.2 -0.870 18.0 166.3-102.2 119.8 49.2 21.5 79.8 22 41 A T - 0 0 0 60,-2.4 2,-1.3 -2,-0.6 43,-0.1 -0.998 66.0 -13.3-134.6 132.8 50.6 24.2 77.4 23 42 A G S S+ 0 0 0 -2,-0.4 2,-1.4 40,-0.2 3,-0.2 0.015 101.7 107.6 71.7 -34.3 48.8 26.3 74.9 24 43 A S > + 0 0 0 -2,-1.3 4,-1.1 58,-0.6 3,-0.2 -0.616 34.9 168.1 -81.5 91.3 45.6 24.2 75.2 25 44 A V H > S+ 0 0 6 -2,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.777 77.8 65.2 -71.0 -25.4 43.2 26.3 77.2 26 45 A E H > S+ 0 0 10 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.903 100.7 49.2 -61.2 -42.4 40.6 23.8 76.2 27 46 A S H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.847 106.7 56.3 -66.3 -34.7 42.4 21.2 78.3 28 47 A X H X S+ 0 0 0 -4,-1.1 4,-1.6 1,-0.2 -2,-0.2 0.941 111.0 43.2 -61.5 -48.8 42.6 23.6 81.2 29 48 A E H X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.842 111.7 53.1 -68.3 -33.0 38.8 23.9 81.2 30 49 A D H X S+ 0 0 1 -4,-2.1 4,-2.9 1,-0.2 -1,-0.2 0.865 106.0 55.9 -68.2 -33.7 38.3 20.2 80.7 31 50 A A H X>S+ 0 0 0 -4,-2.0 5,-2.2 2,-0.2 4,-1.3 0.916 105.0 52.5 -62.3 -41.9 40.5 19.7 83.7 32 51 A K H <5S+ 0 0 36 -4,-1.6 3,-0.3 3,-0.2 -2,-0.2 0.940 113.1 42.8 -58.1 -50.1 38.1 22.0 85.7 33 52 A L H <5S+ 0 0 31 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.905 120.5 41.1 -65.3 -42.7 35.1 19.9 84.7 34 53 A L H <5S- 0 0 0 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 0.528 106.9-124.1 -83.7 -6.1 36.9 16.5 85.3 35 54 A D T <5 + 0 0 91 -4,-1.3 2,-0.4 -3,-0.3 -3,-0.2 0.924 52.1 162.4 62.3 45.9 38.6 17.7 88.5 36 55 A V < - 0 0 8 -5,-2.2 -1,-0.2 -6,-0.1 -2,-0.1 -0.827 30.4-153.3 -99.1 135.6 42.0 16.8 87.1 37 56 A H - 0 0 55 -2,-0.4 -18,-0.1 19,-0.1 19,-0.1 -0.777 17.8-157.9-114.3 86.9 45.1 18.4 88.8 38 57 A P - 0 0 0 0, 0.0 20,-0.3 0, 0.0 -18,-0.2 -0.154 21.0-135.1 -63.2 151.0 47.9 18.7 86.2 39 58 A Q S S+ 0 0 54 -20,-1.2 21,-2.6 -22,-0.8 2,-0.4 0.853 95.6 34.5 -74.1 -37.7 51.6 18.9 87.0 40 59 A G E S+cd 20 60B 0 -21,-2.2 -19,-3.1 19,-0.3 2,-0.3 -0.971 73.5 173.7-122.5 134.2 52.1 21.7 84.5 41 60 A A E - d 0 61B 0 19,-2.2 21,-2.2 -2,-0.4 22,-0.5 -0.936 35.8 -90.9-137.9 162.5 49.5 24.4 83.6 42 61 A I E - 0 0 0 -2,-0.3 2,-0.4 19,-0.2 22,-0.2 -0.464 34.9-146.8 -73.0 136.1 49.2 27.6 81.5 43 62 A S E - d 0 64B 8 20,-2.1 2,-0.6 -2,-0.2 22,-0.5 -0.870 2.9-151.3-105.9 137.2 50.1 30.9 83.2 44 63 A F B > S-G 47 0C 51 3,-3.3 3,-1.0 -2,-0.4 20,-0.1 -0.921 80.1 -17.9-111.2 110.8 48.2 34.0 82.2 45 64 A S T 3 S- 0 0 84 -2,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.921 131.0 -49.5 62.2 44.1 50.3 37.2 82.7 46 65 A G T 3 S+ 0 0 65 -3,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.444 126.4 63.4 78.0 -0.1 52.7 35.4 84.9 47 66 A K B < S-G 44 0C 118 -3,-1.0 -3,-3.3 14,-0.0 -1,-0.2 -0.872 84.0 -97.4-145.9 177.4 50.1 33.8 87.2 48 67 A F - 0 0 31 -2,-0.3 -5,-0.1 -5,-0.2 5,-0.1 -0.915 44.3-121.1-103.9 118.7 47.1 31.4 87.5 49 68 A P >> - 0 0 10 0, 0.0 3,-2.5 0, 0.0 4,-0.7 -0.124 22.7-112.5 -54.1 149.3 43.7 33.1 87.2 50 69 A D G >4 S+ 0 0 135 1,-0.3 3,-0.7 2,-0.2 4,-0.4 0.836 118.6 63.4 -53.3 -32.3 41.3 32.7 90.2 51 70 A X G 34 S+ 0 0 16 1,-0.2 -1,-0.3 2,-0.1 203,-0.0 0.626 110.7 36.0 -67.9 -15.8 39.1 30.7 87.8 52 71 A F G X> S+ 0 0 6 -3,-2.5 3,-1.2 2,-0.1 4,-1.1 0.347 86.4 94.7-118.8 3.1 41.9 28.1 87.4 53 72 A K T << S+ 0 0 99 -4,-0.7 4,-0.2 -3,-0.7 -2,-0.1 0.778 77.6 68.1 -66.3 -23.3 43.3 28.0 91.0 54 73 A D T 34 S+ 0 0 70 -4,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.780 112.2 29.0 -65.6 -27.8 41.0 25.1 91.6 55 74 A I T <4 S+ 0 0 0 -3,-1.2 3,-0.3 1,-0.1 -1,-0.2 0.488 113.3 61.9-112.1 -4.4 43.0 22.9 89.2 56 75 A T >< + 0 0 12 -4,-1.1 3,-1.5 1,-0.2 -2,-0.1 0.131 65.2 111.8-105.9 20.1 46.5 24.4 89.5 57 76 A D T 3 S+ 0 0 88 1,-0.3 -1,-0.2 -4,-0.2 -3,-0.1 0.646 91.6 30.1 -67.5 -14.1 46.9 23.6 93.2 58 77 A K T 3 S+ 0 0 156 -3,-0.3 2,-0.3 -20,-0.3 -1,-0.3 -0.017 106.1 107.6-130.6 26.5 49.6 21.1 92.3 59 78 A A < - 0 0 11 -3,-1.5 -19,-0.3 -19,-0.1 -20,-0.2 -0.807 51.5-153.1-117.8 154.0 50.9 22.7 89.2 60 79 A E E -d 40 0B 122 -21,-2.6 -19,-2.2 -2,-0.3 -2,-0.1 -0.846 42.7 -89.8-113.5 150.3 54.0 24.6 88.0 61 80 A P E -d 41 0B 34 0, 0.0 -19,-0.2 0, 0.0 3,-0.1 -0.336 29.3-171.1 -62.7 138.3 53.8 27.2 85.1 62 81 A T E - 0 0 0 -21,-2.2 7,-3.3 1,-0.5 11,-0.2 0.384 56.5 -91.4-107.4 -2.2 54.4 25.8 81.6 63 82 A G E - E 0 68B 8 -22,-0.5 -20,-2.1 5,-0.2 -1,-0.5 -0.548 62.1 -35.7 116.8 175.4 54.6 29.3 80.1 64 83 A E E > -dE 43 67B 61 3,-0.6 3,-1.3 -22,-0.2 -41,-0.2 -0.241 69.9 -93.3 -69.2 159.7 52.1 31.7 78.5 65 84 A K T 3 S+ 0 0 72 -22,-0.5 -1,-0.1 1,-0.3 -40,-0.1 0.779 125.3 23.1 -42.3 -38.4 49.2 30.4 76.4 66 85 A X T 3 S+ 0 0 106 1,-0.2 -1,-0.3 -42,-0.0 -2,-0.0 0.376 114.2 68.3-114.6 3.8 51.2 30.8 73.2 67 86 A E E < S-E 64 0B 145 -3,-1.3 -3,-0.6 2,-0.0 -1,-0.2 -0.532 70.7-159.4-122.9 67.8 54.8 30.7 74.5 68 87 A P E -E 63 0B 16 0, 0.0 2,-1.2 0, 0.0 -5,-0.2 -0.178 15.7-135.2 -48.7 127.1 55.5 27.2 75.7 69 88 A N > - 0 0 54 -7,-3.3 4,-2.4 1,-0.2 3,-0.2 -0.737 21.6-173.3 -90.4 94.3 58.4 27.2 78.1 70 89 A I H > S+ 0 0 28 -2,-1.2 4,-2.8 1,-0.2 5,-0.2 0.820 79.9 54.8 -56.9 -38.7 60.5 24.2 77.0 71 90 A E H > S+ 0 0 156 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.927 111.4 45.0 -64.1 -43.3 63.0 24.4 79.8 72 91 A K H > S+ 0 0 86 -3,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.956 114.0 48.3 -64.2 -50.9 60.2 24.2 82.4 73 92 A I H X S+ 0 0 0 -4,-2.4 4,-1.2 1,-0.2 3,-0.4 0.939 110.5 52.2 -55.4 -48.5 58.4 21.5 80.6 74 93 A L H >< S+ 0 0 71 -4,-2.8 3,-0.6 1,-0.2 -1,-0.2 0.908 106.5 54.1 -54.2 -44.4 61.6 19.5 80.3 75 94 A E H 3< S+ 0 0 138 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.865 102.4 58.3 -58.4 -39.3 62.3 19.8 84.0 76 95 A X H 3< S- 0 0 21 -4,-1.8 -1,-0.2 -3,-0.4 -2,-0.2 0.807 86.6-154.0 -62.0 -33.7 58.9 18.4 84.8 77 96 A K << - 0 0 141 -4,-1.2 -3,-0.1 -3,-0.6 -2,-0.1 0.955 24.7-168.1 54.6 52.1 59.5 15.1 83.0 78 97 A P - 0 0 10 0, 0.0 22,-0.2 0, 0.0 -59,-0.2 -0.271 31.5-130.5 -70.7 157.5 55.8 14.7 82.4 79 98 A D S S+ 0 0 33 -61,-2.0 21,-0.5 1,-0.3 2,-0.3 0.841 93.2 8.8 -75.1 -32.8 54.2 11.4 81.2 80 99 A V E -b 19 0B 0 -62,-1.6 -60,-2.4 19,-0.1 2,-0.5 -0.999 63.2-146.7-150.3 148.4 52.3 13.4 78.6 81 100 A I E -bf 20 101B 0 19,-2.9 21,-3.0 -2,-0.3 2,-0.9 -0.969 10.3-153.1-116.2 123.5 52.2 17.0 77.3 82 101 A L E +bf 21 102B 1 -62,-2.9 -60,-2.4 -2,-0.5 -58,-0.6 -0.859 30.1 167.5 -98.6 102.8 48.9 18.3 76.1 83 102 A A E - f 0 103B 0 19,-2.2 21,-2.0 -2,-0.9 2,-0.3 -0.059 28.2-106.0 -96.4-158.1 49.8 20.9 73.5 84 103 A S E > - f 0 104B 0 19,-0.3 3,-1.4 -2,-0.1 21,-0.2 -0.966 11.2-128.8-139.4 153.0 47.6 22.7 71.0 85 104 A T T 3 S+ 0 0 56 19,-1.7 20,-0.1 -2,-0.3 4,-0.1 0.460 104.5 76.0 -76.8 -0.5 46.9 22.7 67.3 86 105 A K T 3 S+ 0 0 53 18,-0.3 -1,-0.3 2,-0.1 -63,-0.1 0.676 78.2 88.5 -81.4 -19.9 47.6 26.4 67.4 87 106 A F S < S- 0 0 8 -3,-1.4 -4,-0.0 1,-0.1 -21,-0.0 -0.563 85.6-116.7 -79.1 140.5 51.3 25.7 67.7 88 107 A P > - 0 0 75 0, 0.0 4,-2.4 0, 0.0 5,-0.2 -0.359 30.6-103.7 -72.9 161.6 53.2 25.4 64.4 89 108 A E H > S+ 0 0 140 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.885 121.4 56.4 -49.9 -45.3 54.9 22.0 63.6 90 109 A K H > S+ 0 0 167 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.941 108.8 45.3 -53.6 -52.2 58.3 23.4 64.5 91 110 A T H > S+ 0 0 32 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.914 113.2 50.1 -60.2 -44.1 57.1 24.4 68.0 92 111 A L H X S+ 0 0 16 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.895 108.3 53.9 -61.1 -40.4 55.4 21.1 68.5 93 112 A Q H X S+ 0 0 129 -4,-2.9 4,-0.7 -5,-0.2 -1,-0.2 0.919 109.1 48.3 -59.4 -44.9 58.5 19.3 67.4 94 113 A K H >< S+ 0 0 89 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.930 110.4 50.4 -61.8 -46.6 60.5 21.2 70.0 95 114 A I H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.3 4,-0.3 0.850 100.3 67.6 -60.7 -33.2 58.0 20.4 72.7 96 115 A S H >< S+ 0 0 60 -4,-2.1 3,-1.4 1,-0.3 -1,-0.3 0.763 84.0 70.0 -59.7 -27.6 58.2 16.7 71.7 97 116 A T T << S+ 0 0 107 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.516 97.7 53.9 -70.6 -0.8 61.8 16.5 73.0 98 117 A A T < S- 0 0 15 -3,-1.9 -1,-0.3 1,-0.4 2,-0.3 0.495 124.6 -57.2-108.0 -8.1 60.4 16.7 76.5 99 118 A G S < S- 0 0 25 -3,-1.4 -1,-0.4 -4,-0.3 2,-0.2 -0.877 82.5 -27.6 152.9 174.3 57.9 13.9 76.2 100 119 A T - 0 0 56 -21,-0.5 -19,-2.9 -2,-0.3 2,-0.5 -0.364 64.6-158.7 -56.1 118.8 54.9 12.4 74.5 101 120 A T E -f 81 0B 14 -2,-0.2 -19,-0.2 -21,-0.2 -5,-0.1 -0.903 15.4-171.2-113.0 129.9 53.1 15.4 73.0 102 121 A I E -f 82 0B 0 -21,-3.0 -19,-2.2 -2,-0.5 2,-1.0 -0.950 18.8-141.6-118.0 115.2 49.5 15.5 71.9 103 122 A P E -f 83 0B 27 0, 0.0 2,-0.3 0, 0.0 -19,-0.3 -0.647 21.0-145.6 -78.0 107.0 48.2 18.6 70.1 104 123 A V E -f 84 0B 0 -21,-2.0 -19,-1.7 -2,-1.0 -18,-0.3 -0.578 23.5-109.1 -74.8 131.6 44.7 19.1 71.5 105 124 A S - 0 0 3 -2,-0.3 -1,-0.1 -21,-0.2 9,-0.1 -0.364 18.6-158.2 -64.5 133.4 42.3 20.5 68.8 106 125 A H + 0 0 98 -2,-0.1 2,-0.5 -80,-0.0 -1,-0.1 0.403 59.9 113.5 -90.3 0.4 41.3 24.1 69.2 107 126 A I > - 0 0 79 1,-0.1 3,-2.4 3,-0.1 -2,-0.1 -0.649 65.9-141.1 -80.9 121.7 38.2 23.5 67.1 108 127 A S G > S+ 0 0 19 -2,-0.5 3,-1.8 63,-0.3 -1,-0.1 0.779 97.9 63.7 -49.0 -38.3 34.9 23.8 69.0 109 128 A S G 3 S+ 0 0 89 1,-0.3 3,-0.4 62,-0.1 -1,-0.3 0.662 96.2 61.8 -66.3 -12.9 33.2 20.9 67.3 110 129 A N G <> + 0 0 26 -3,-2.4 4,-2.5 1,-0.2 5,-0.3 0.236 68.3 113.3 -94.6 13.5 35.9 18.6 68.8 111 130 A W H <> S+ 0 0 15 -3,-1.8 4,-1.7 1,-0.2 151,-0.3 0.840 75.1 49.9 -57.3 -35.3 34.9 19.4 72.4 112 131 A K H > S+ 0 0 66 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.900 112.9 47.2 -71.0 -37.0 33.7 15.9 73.2 113 132 A E H > S+ 0 0 79 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.900 110.5 50.7 -69.5 -41.3 36.9 14.3 71.9 114 133 A N H X S+ 0 0 6 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.904 112.5 49.7 -61.0 -40.6 39.2 16.7 73.8 115 134 A X H X S+ 0 0 0 -4,-1.7 4,-1.9 -5,-0.3 -2,-0.2 0.893 111.1 47.0 -64.4 -44.2 37.2 15.8 76.9 116 135 A X H X S+ 0 0 43 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.835 107.0 58.9 -70.2 -32.4 37.5 12.1 76.3 117 136 A L H X S+ 0 0 4 -4,-2.4 4,-1.6 2,-0.2 3,-0.2 0.972 108.9 43.2 -60.4 -52.6 41.2 12.4 75.6 118 137 A L H X S+ 0 0 1 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.896 113.7 52.5 -60.6 -38.8 41.8 14.0 79.1 119 138 A A H X>S+ 0 0 0 -4,-1.9 5,-2.9 1,-0.2 4,-0.7 0.844 107.6 51.6 -65.8 -34.1 39.5 11.4 80.7 120 139 A Q H <5S+ 0 0 60 -4,-2.3 -1,-0.2 -3,-0.2 -2,-0.2 0.795 110.1 49.4 -72.6 -28.7 41.4 8.5 79.0 121 140 A L H <5S+ 0 0 0 -4,-1.6 -105,-2.8 1,-0.2 -2,-0.2 0.829 119.4 37.1 -77.9 -31.9 44.7 9.9 80.4 122 141 A T H <5S- 0 0 22 -4,-1.8 -2,-0.2 -107,-0.3 -1,-0.2 0.354 110.9-112.9-102.9 5.0 43.4 10.2 83.9 123 142 A G T <5S+ 0 0 44 -4,-0.7 -3,-0.2 -5,-0.1 3,-0.2 0.848 80.4 121.9 67.8 35.0 41.2 7.1 84.0 124 143 A K >< + 0 0 56 -5,-2.9 4,-2.9 -6,-0.2 3,-0.2 -0.034 16.9 130.1-119.4 32.8 37.9 9.1 84.2 125 144 A E H > S+ 0 0 82 -6,-0.5 4,-3.3 1,-0.2 5,-0.2 0.900 75.6 51.8 -50.9 -47.6 36.0 7.8 81.1 126 145 A K H > S+ 0 0 181 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.900 111.4 46.2 -59.2 -42.6 32.9 7.1 83.1 127 146 A K H > S+ 0 0 99 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.946 115.1 48.1 -64.1 -47.2 32.9 10.6 84.6 128 147 A A H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.916 110.0 50.7 -58.3 -48.4 33.5 12.1 81.2 129 148 A K H X S+ 0 0 121 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.839 109.1 52.1 -60.1 -37.2 30.8 10.0 79.5 130 149 A K H X S+ 0 0 119 -4,-1.7 4,-2.7 -5,-0.2 -1,-0.2 0.904 108.5 49.9 -66.3 -44.6 28.2 11.0 82.1 131 150 A I H X S+ 0 0 29 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.897 113.8 45.6 -62.0 -42.7 28.9 14.8 81.6 132 151 A I H X S+ 0 0 12 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.920 113.3 49.4 -68.2 -42.8 28.6 14.5 77.8 133 152 A A H X S+ 0 0 48 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.908 111.4 49.6 -62.8 -42.8 25.4 12.4 78.1 134 153 A D H X S+ 0 0 63 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.869 108.8 52.7 -64.2 -39.3 23.9 14.9 80.5 135 154 A Y H X S+ 0 0 8 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.934 111.0 46.0 -63.2 -46.3 24.7 17.8 78.3 136 155 A E H X S+ 0 0 92 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.914 116.3 45.7 -62.8 -42.9 23.0 16.2 75.3 137 156 A Q H X S+ 0 0 101 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.936 114.8 46.2 -66.4 -47.5 20.0 15.3 77.3 138 157 A D H X S+ 0 0 61 -4,-3.1 4,-3.2 2,-0.2 5,-0.2 0.905 112.0 53.2 -61.0 -41.3 19.7 18.7 79.0 139 158 A L H X S+ 0 0 24 -4,-2.8 4,-2.6 -5,-0.3 -2,-0.2 0.967 110.5 46.0 -57.4 -54.0 20.2 20.3 75.5 140 159 A K H X S+ 0 0 138 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.937 114.1 49.1 -54.3 -49.2 17.4 18.3 74.1 141 160 A E H X S+ 0 0 94 -4,-2.9 4,-1.3 1,-0.2 -2,-0.2 0.959 110.8 49.1 -55.7 -56.0 15.2 19.1 77.1 142 161 A I H >X S+ 0 0 16 -4,-3.2 4,-1.0 1,-0.2 3,-0.6 0.901 110.4 51.7 -50.7 -47.1 15.9 22.8 76.9 143 162 A K H >< S+ 0 0 87 -4,-2.6 3,-0.6 1,-0.2 -1,-0.2 0.900 104.8 55.6 -60.3 -42.1 15.1 22.9 73.2 144 163 A T H 3< S+ 0 0 108 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.787 114.1 40.2 -64.3 -26.1 11.8 21.1 73.6 145 164 A K H << S+ 0 0 116 -4,-1.3 2,-0.7 -3,-0.6 -1,-0.2 0.527 85.5 103.7-103.1 -2.7 10.6 23.8 76.1 146 165 A I S << S- 0 0 6 -4,-1.0 131,-0.1 -3,-0.6 5,-0.0 -0.689 74.1-128.1 -79.4 118.1 11.9 26.9 74.5 147 166 A N >> - 0 0 89 -2,-0.7 3,-2.2 129,-0.3 4,-1.9 -0.297 19.5-108.3 -66.1 151.5 8.9 28.6 72.9 148 167 A D H 3> S+ 0 0 98 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.803 115.0 69.0 -48.3 -36.8 9.1 29.7 69.2 149 168 A K H 34 S+ 0 0 167 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.825 110.1 34.2 -55.0 -32.3 9.2 33.3 70.3 150 169 A A H X4 S+ 0 0 6 -3,-2.2 3,-1.4 2,-0.1 -1,-0.2 0.850 115.2 56.4 -89.5 -39.1 12.7 32.7 71.6 151 170 A K H 3< S+ 0 0 81 -4,-1.9 34,-0.4 1,-0.3 -2,-0.2 0.852 113.8 39.5 -60.8 -38.4 13.8 30.1 69.1 152 171 A D T 3< S+ 0 0 132 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.1 0.246 98.3 110.9 -96.4 13.7 13.1 32.5 66.2 153 172 A S S < S- 0 0 9 -3,-1.4 2,-0.7 -5,-0.2 32,-0.5 -0.363 75.7-108.8 -84.5 166.0 14.5 35.5 68.1 154 173 A K + 0 0 68 54,-0.1 56,-2.9 30,-0.1 57,-2.1 -0.862 41.1 179.7 -98.9 110.7 17.7 37.3 67.3 155 174 A A E -h 211 0D 0 -2,-0.7 2,-0.4 30,-0.5 57,-0.2 -0.924 3.8-172.1-115.0 139.8 20.4 36.6 70.0 156 175 A L E -h 212 0D 0 55,-2.7 57,-3.0 -2,-0.4 2,-0.5 -0.970 14.7-152.6-134.3 146.6 23.9 38.0 70.0 157 176 A V E +h 213 0D 0 -2,-0.4 11,-0.4 55,-0.2 2,-0.4 -0.975 20.4 176.2-117.3 122.3 27.0 37.4 72.1 158 177 A I E -h 214 0D 0 55,-2.8 57,-2.3 -2,-0.5 2,-0.4 -0.956 14.3-158.1-127.2 148.9 29.5 40.2 72.5 159 178 A R E -hI 215 166D 13 7,-2.1 7,-2.1 -2,-0.4 2,-0.6 -0.981 12.9-140.4-125.0 135.1 32.7 40.4 74.5 160 179 A I E +hI 216 165D 3 55,-2.6 57,-0.6 -2,-0.4 2,-0.4 -0.862 27.1 170.7-100.5 117.5 34.2 43.7 75.6 161 180 A R E > - I 0 164D 55 3,-2.2 3,-3.2 -2,-0.6 60,-0.2 -0.990 68.3 -8.5-128.0 134.7 38.0 43.8 75.4 162 181 A Q T 3 S- 0 0 124 58,-2.8 59,-0.2 -2,-0.4 -1,-0.1 0.839 129.4 -58.5 51.4 34.3 40.2 46.8 75.9 163 182 A G T 3 S+ 0 0 23 1,-0.3 -1,-0.3 57,-0.2 2,-0.3 0.453 114.9 118.4 77.4 -2.1 37.0 48.9 75.9 164 183 A N E < -I 161 0D 58 -3,-3.2 -3,-2.2 36,-0.0 2,-0.5 -0.690 64.3-124.9 -99.1 154.5 36.1 47.6 72.4 165 184 A I E -I 160 0D 17 34,-0.5 34,-2.6 -2,-0.3 2,-0.4 -0.844 31.8-172.9 -97.0 129.3 33.0 45.6 71.5 166 185 A Y E -IJ 159 198D 23 -7,-2.1 -7,-2.1 -2,-0.5 2,-0.3 -0.954 12.6-168.6-127.6 144.6 33.7 42.3 69.7 167 186 A I E - J 0 197D 4 30,-2.4 30,-2.8 -2,-0.4 -9,-0.1 -0.770 16.7-142.2-119.9 167.6 31.6 39.6 68.0 168 187 A Y - 0 0 9 -11,-0.4 25,-0.2 -2,-0.3 -11,-0.1 -0.858 23.8 -80.7-134.3 165.9 32.7 36.2 66.8 169 188 A P > - 0 0 14 0, 0.0 3,-1.5 0, 0.0 6,-0.2 -0.124 48.4-105.8 -58.0 159.4 32.2 33.6 64.0 170 189 A E T 3 S+ 0 0 64 20,-0.6 10,-0.4 23,-0.3 9,-0.3 0.785 120.8 41.3 -60.6 -29.7 29.1 31.3 64.1 171 190 A Q T 3 S+ 0 0 152 8,-0.1 -63,-0.3 20,-0.1 2,-0.3 0.196 104.5 86.6-104.9 16.4 31.2 28.3 65.2 172 191 A V S X S- 0 0 64 -3,-1.5 3,-1.6 -65,-0.1 4,-0.2 -0.803 86.3 -12.0-119.5 159.1 33.4 30.2 67.7 173 192 A Y T > S- 0 0 8 -2,-0.3 3,-0.9 1,-0.3 4,-0.2 -0.226 127.2 -23.3 55.3-143.8 33.3 31.2 71.4 174 193 A F T >> S+ 0 0 2 1,-0.2 4,-2.2 2,-0.1 3,-1.5 0.625 122.4 88.0 -72.8 -12.1 29.8 30.7 72.8 175 194 A N H <>>S+ 0 0 0 -3,-1.6 4,-2.6 1,-0.3 5,-1.3 0.795 75.6 64.8 -58.1 -31.1 28.2 30.9 69.4 176 195 A S H <4>S+ 0 0 13 -3,-0.9 5,-0.8 -4,-0.2 -1,-0.3 0.802 111.1 37.5 -64.8 -25.9 28.6 27.2 68.8 177 196 A T H <4>S+ 0 0 0 -3,-1.5 5,-3.1 3,-0.2 4,-0.5 0.888 117.3 48.9 -89.3 -44.8 26.1 26.6 71.6 178 197 A L H <5S+ 0 0 0 -4,-2.2 6,-1.6 3,-0.2 -2,-0.2 0.922 135.0 9.8 -60.6 -48.7 23.8 29.5 71.0 179 198 A Y T <5S+ 0 0 10 -4,-2.6 4,-0.4 -9,-0.3 -3,-0.2 0.838 131.7 49.2-100.2 -44.4 23.4 28.9 67.2 180 199 A G T - 0 0 8 0, 0.0 4,-2.0 0, 0.0 3,-0.4 -0.192 29.7-105.8 -58.1 156.8 22.8 37.3 62.5 188 207 A N H > S+ 0 0 120 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.856 119.1 57.0 -54.5 -39.9 24.4 38.1 59.1 189 208 A E H > S+ 0 0 51 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.902 108.1 46.7 -59.7 -43.0 27.4 39.9 60.9 190 209 A V H 4 S+ 0 0 0 -3,-0.4 -20,-0.6 1,-0.2 3,-0.2 0.913 110.7 52.5 -66.0 -42.7 28.2 36.8 62.8 191 210 A K H < S+ 0 0 104 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.875 112.4 45.9 -60.2 -39.0 28.0 34.6 59.7 192 211 A A H < S+ 0 0 73 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.706 88.6 103.1 -78.5 -23.6 30.4 36.9 57.8 193 212 A A < - 0 0 9 -4,-1.4 -23,-0.3 -3,-0.2 3,-0.1 -0.362 48.6-169.5 -63.8 138.9 33.0 37.2 60.6 194 213 A K S S- 0 0 196 1,-0.3 2,-0.3 -25,-0.1 -1,-0.1 0.472 70.8 -17.3-105.9 -7.4 36.1 35.1 60.1 195 214 A A S S- 0 0 58 -28,-0.1 -1,-0.3 -23,-0.0 -28,-0.1 -0.946 113.6 -23.4-176.3 179.1 37.5 35.7 63.6 196 215 A Q S S- 0 0 74 -2,-0.3 2,-0.4 -3,-0.1 -28,-0.2 -0.191 74.1-162.8 -41.6 122.4 37.1 38.0 66.6 197 216 A E E -J 167 0D 93 -30,-2.8 -30,-2.4 -4,-0.1 -1,-0.1 -0.958 18.1-119.7-122.5 132.4 35.6 41.0 64.8 198 217 A L E +J 166 0D 85 -2,-0.4 -32,-0.2 -32,-0.2 2,-0.2 -0.406 40.9 165.8 -66.2 143.1 35.4 44.6 66.0 199 218 A S - 0 0 14 -34,-2.6 -34,-0.5 -2,-0.1 2,-0.3 -0.644 14.9-150.1-138.4-163.9 31.8 46.0 66.2 200 219 A S > - 0 0 24 -2,-0.2 4,-3.4 1,-0.1 5,-0.2 -0.989 37.4 -91.3-166.8 172.8 30.1 49.0 67.7 201 220 A L H > S+ 0 0 13 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.871 124.3 56.2 -60.2 -36.7 27.0 50.6 69.3 202 221 A E H > S+ 0 0 132 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.964 111.2 41.4 -59.0 -53.8 26.1 51.6 65.7 203 222 A K H > S+ 0 0 86 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.925 113.7 52.6 -61.4 -46.7 26.2 48.0 64.5 204 223 A L H X S+ 0 0 0 -4,-3.4 4,-3.2 1,-0.2 -1,-0.2 0.950 109.2 50.5 -53.1 -49.4 24.5 46.8 67.6 205 224 A S H < S+ 0 0 50 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.875 108.8 53.9 -56.1 -38.8 21.8 49.3 67.0 206 225 A E H < S+ 0 0 137 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.975 114.9 36.5 -60.2 -59.0 21.5 48.1 63.4 207 226 A X H < S- 0 0 9 -4,-2.5 -2,-0.2 -5,-0.1 -1,-0.2 0.844 86.1-166.6 -63.5 -34.8 21.0 44.4 64.3 208 227 A N < - 0 0 61 -4,-3.2 -3,-0.1 -5,-0.3 -54,-0.1 0.909 18.4-152.7 41.8 57.6 18.9 45.5 67.4 209 228 A P - 0 0 1 0, 0.0 33,-0.8 0, 0.0 -54,-0.2 -0.027 19.1-136.0 -53.4 155.5 19.0 41.9 68.8 210 229 A D S S+ 0 0 37 -56,-2.9 2,-0.4 1,-0.3 -55,-0.2 0.846 93.5 27.1 -82.9 -36.0 16.3 40.5 71.1 211 230 A H E -h 155 0D 16 -57,-2.1 -55,-2.7 2,-0.0 2,-0.4 -0.985 67.0-171.8-129.8 136.5 18.8 39.1 73.4 212 231 A I E -hk 156 248D 0 35,-2.1 37,-2.7 -2,-0.4 2,-0.6 -0.974 8.1-162.0-132.4 118.8 22.4 40.2 74.1 213 232 A F E -hk 157 249D 1 -57,-3.0 -55,-2.8 -2,-0.4 2,-0.5 -0.886 16.6-165.1 -96.0 124.2 24.9 38.2 76.2 214 233 A V E -hk 158 250D 0 35,-2.8 37,-3.2 -2,-0.6 2,-0.5 -0.966 6.3-163.3-117.0 124.9 27.6 40.6 77.2 215 234 A Q E +h 159 0D 3 -57,-2.3 -55,-2.6 -2,-0.5 2,-0.4 -0.937 13.5 172.4-109.8 123.4 30.9 39.2 78.6 216 235 A F E -h 160 0D 17 -2,-0.5 2,-0.4 -57,-0.2 40,-0.1 -0.946 8.8-173.3-136.6 114.1 33.2 41.7 80.4 217 236 A S > - 0 0 8 -57,-0.6 3,-0.7 -2,-0.4 4,-0.2 -0.894 21.3-144.4-108.1 135.3 36.3 40.8 82.3 218 237 A D G > S+ 0 0 116 -2,-0.4 3,-2.2 1,-0.2 6,-0.2 0.914 99.5 58.8 -61.0 -45.2 38.2 43.3 84.4 219 238 A D G 3 S+ 0 0 100 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.744 106.4 49.3 -57.8 -25.0 41.6 41.8 83.6 220 239 A E G < S+ 0 0 42 -3,-0.7 -58,-2.8 1,-0.2 -1,-0.3 0.373 116.0 42.3 -97.0 5.6 40.9 42.4 79.9 221 240 A N X + 0 0 2 -3,-2.2 3,-1.7 -60,-0.2 6,-0.2 -0.060 68.1 138.4-139.1 33.2 39.9 46.0 80.4 222 241 A A T 3 S+ 0 0 69 -3,-0.5 2,-0.2 1,-0.3 -2,-0.1 0.866 77.5 43.7 -47.9 -48.4 42.5 47.3 82.9 223 242 A D T 3 S+ 0 0 156 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 -0.155 124.9 33.4 -94.8 40.7 42.9 50.6 81.2 224 243 A K X + 0 0 116 -3,-1.7 3,-2.2 -2,-0.2 4,-0.3 0.089 60.2 155.3 176.9 45.5 39.2 51.2 80.6 225 244 A P T 3 S+ 0 0 72 0, 0.0 4,-0.3 0, 0.0 3,-0.3 0.689 77.6 59.6 -57.8 -19.0 37.2 49.7 83.5 226 245 A D T 3> S+ 0 0 100 1,-0.2 4,-3.2 2,-0.1 5,-0.4 0.539 73.3 102.7 -87.2 -8.9 34.4 52.2 82.7 227 246 A A H <> S+ 0 0 20 -3,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.876 85.5 40.6 -41.0 -54.8 33.9 50.9 79.1 228 247 A L H > S+ 0 0 21 -3,-0.3 4,-2.9 -4,-0.3 -1,-0.2 0.923 115.7 49.1 -65.9 -44.9 30.8 48.9 79.9 229 248 A K H > S+ 0 0 93 -4,-0.3 4,-1.4 1,-0.2 -2,-0.2 0.936 110.7 51.5 -59.4 -46.0 29.2 51.5 82.3 230 249 A D H X S+ 0 0 88 -4,-3.2 4,-0.7 1,-0.2 -1,-0.2 0.873 111.5 48.7 -58.0 -37.8 29.9 54.2 79.7 231 250 A L H >< S+ 0 0 21 -4,-1.7 3,-1.1 -5,-0.4 6,-0.3 0.944 108.5 52.0 -68.3 -46.7 28.1 52.0 77.1 232 251 A E H 3< S+ 0 0 51 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.708 109.5 50.7 -64.6 -19.7 25.1 51.4 79.4 233 252 A K H 3< S+ 0 0 113 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.611 84.2 109.7 -92.7 -12.9 24.6 55.1 79.9 234 253 A N S S+ 0 0 98 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.814 105.0 55.6 -55.7 -34.7 21.2 57.0 74.9 236 255 A I H >> S+ 0 0 76 2,-0.2 4,-0.6 1,-0.2 3,-0.6 0.892 106.1 50.5 -68.6 -38.5 21.6 54.7 71.9 237 256 A W H >4 S+ 0 0 10 -3,-0.4 3,-1.6 -6,-0.3 6,-0.3 0.946 107.0 54.9 -62.1 -47.2 22.2 51.7 74.1 238 257 A K H 3< S+ 0 0 120 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.671 105.7 52.5 -62.1 -18.4 19.1 52.5 76.2 239 258 A S H << S+ 0 0 57 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.575 82.1 115.0 -93.6 -11.2 16.9 52.6 73.1 240 259 A L S S+ 0 0 70 1,-0.2 4,-2.1 2,-0.2 6,-0.2 0.915 108.7 53.8 -56.2 -47.3 15.2 46.6 72.0 242 261 A A H 4>S+ 0 0 0 -33,-0.8 5,-3.7 1,-0.2 6,-0.2 0.912 110.2 47.4 -56.3 -44.9 17.2 44.2 74.2 243 262 A V H >45S+ 0 0 28 -6,-0.3 3,-1.4 3,-0.2 -1,-0.2 0.923 110.6 50.4 -64.0 -45.6 17.8 46.8 76.8 244 263 A K H 3<5S+ 0 0 134 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.836 113.7 45.8 -62.8 -32.5 14.2 48.0 76.9 245 264 A E T 3<5S- 0 0 101 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.377 112.7-120.1 -90.7 4.8 13.0 44.5 77.4 246 265 A D T < 5S+ 0 0 138 -3,-1.4 -3,-0.2 -4,-0.2 -2,-0.1 0.922 70.9 137.6 55.8 43.7 15.7 43.8 80.0 247 266 A H < + 0 0 62 -5,-3.7 -35,-2.1 -6,-0.2 2,-0.5 -0.148 29.9 111.0-110.1 36.2 17.1 41.1 77.8 248 267 A V E -k 212 0D 33 -6,-0.2 2,-0.6 -37,-0.2 -35,-0.2 -0.957 47.8-167.5-111.4 124.6 20.7 42.0 78.3 249 268 A Y E -k 213 0D 19 -37,-2.7 -35,-2.8 -2,-0.5 3,-0.5 -0.926 3.0-161.5-119.5 108.2 22.7 39.4 80.3 250 269 A V E S-k 214 0D 55 -2,-0.6 -35,-0.2 1,-0.2 -37,-0.1 -0.741 72.2 -13.1 -90.9 131.1 26.2 40.5 81.5 251 270 A N + 0 0 59 -37,-3.2 -1,-0.2 -2,-0.4 -36,-0.1 0.905 69.7 162.3 45.3 56.4 28.6 37.8 82.6 252 271 A S S S+ 0 0 39 -3,-0.5 2,-0.3 -38,-0.2 -1,-0.1 0.600 77.1 35.0 -75.4 -11.2 26.0 35.0 82.7 253 272 A V S S- 0 0 8 18,-0.1 -1,-0.1 4,-0.0 4,-0.1 -0.984 119.4 -74.5-139.1 144.7 29.2 32.9 82.6 254 273 A D > - 0 0 62 -2,-0.3 3,-2.0 1,-0.2 -2,-0.1 -0.143 48.9-126.9 -38.9 127.7 32.6 33.6 84.2 255 274 A P T 3 S+ 0 0 28 0, 0.0 -38,-0.2 0, 0.0 -1,-0.2 0.584 105.3 56.6 -59.7 -12.7 33.9 36.3 81.8 256 275 A L T 3 S+ 0 0 49 -40,-0.1 -2,-0.1 3,-0.0 -39,-0.0 0.454 74.5 126.6-100.2 -1.0 37.2 34.4 81.3 257 276 A A < - 0 0 0 -3,-2.0 -4,-0.0 1,-0.1 -206,-0.0 -0.333 63.0-133.4 -57.8 135.8 35.5 31.2 80.0 258 277 A Q - 0 0 50 -233,-0.1 -1,-0.1 1,-0.1 -85,-0.1 0.843 30.1-135.0 -60.3 -40.8 36.9 30.2 76.6 259 278 A G S S+ 0 0 0 -86,-0.1 -82,-0.2 -85,-0.1 -1,-0.1 -0.062 82.9 58.0 112.4 -35.0 33.5 29.6 75.1 260 279 A G S S+ 0 0 14 4,-0.1 2,-0.2 -84,-0.1 -149,-0.1 -0.038 78.8 95.2-124.6 36.0 33.8 26.3 73.2 261 280 A T S > S- 0 0 2 1,-0.1 4,-3.2 -236,-0.0 5,-0.3 -0.723 87.6 -98.3-116.3 169.6 34.8 23.6 75.7 262 281 A A H > S+ 0 0 0 -151,-0.3 4,-2.5 -2,-0.2 5,-0.2 0.912 126.1 49.0 -52.8 -44.0 32.7 21.2 77.7 263 282 A W H > S+ 0 0 22 2,-0.2 4,-1.9 -237,-0.2 -1,-0.2 0.939 114.2 43.3 -61.8 -50.3 33.0 23.5 80.7 264 283 A S H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.892 115.9 48.5 -63.0 -42.4 32.0 26.6 78.7 265 284 A K H X S+ 0 0 2 -4,-3.2 4,-2.7 2,-0.2 -2,-0.2 0.921 110.8 49.7 -65.6 -45.2 29.2 24.9 76.9 266 285 A V H X S+ 0 0 15 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.878 115.8 44.1 -61.3 -39.7 27.7 23.3 80.1 267 286 A R H X S+ 0 0 100 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.921 114.5 47.6 -73.2 -43.8 27.8 26.7 81.8 268 287 A F H X S+ 0 0 2 -4,-2.9 4,-3.4 2,-0.2 5,-0.2 0.876 107.2 57.4 -66.2 -36.4 26.4 28.6 78.8 269 288 A L H X S+ 0 0 6 -4,-2.7 4,-3.1 2,-0.2 -1,-0.2 0.968 109.3 44.6 -57.0 -54.1 23.6 26.1 78.3 270 289 A K H X S+ 0 0 101 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.911 114.9 48.8 -56.4 -46.0 22.3 26.6 81.9 271 290 A A H < S+ 0 0 6 -4,-2.1 4,-0.5 2,-0.2 -1,-0.2 0.940 113.1 47.1 -60.4 -47.0 22.6 30.4 81.6 272 291 A A H >X S+ 0 0 1 -4,-3.4 4,-3.4 1,-0.2 3,-1.2 0.912 111.6 51.9 -60.5 -42.2 20.8 30.3 78.2 273 292 A A H 3X S+ 0 0 17 -4,-3.1 4,-1.1 1,-0.3 -1,-0.2 0.898 106.9 52.4 -61.1 -42.2 18.2 28.1 79.8 274 293 A E H 3< S+ 0 0 151 -4,-2.6 -1,-0.3 3,-0.2 -2,-0.2 0.501 120.7 33.9 -74.5 -2.8 17.7 30.5 82.7 275 294 A K H <4 S+ 0 0 100 -3,-1.2 -2,-0.2 -4,-0.5 -1,-0.2 0.700 118.7 44.7-118.2 -39.1 17.1 33.4 80.3 276 295 A L H < 0 0 9 -4,-3.4 -129,-0.3 -5,-0.2 -3,-0.2 0.560 360.0 360.0 -86.0 -9.0 15.4 32.0 77.2 277 296 A T < 0 0 92 -4,-1.1 -3,-0.2 -5,-0.3 -4,-0.1 0.567 360.0 360.0-135.7 360.0 12.9 29.9 79.2