==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-NOV-09 3AB1 . COMPND 2 MOLECULE: FERREDOXIN--NADP REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CHLOROBACULUM TEPIDUM; . AUTHOR N.MURAKI,D.SEO,G.KURISU . 654 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30307.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 442 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 88 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 12.5 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 . 8 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 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 . 44 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 125 19.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.2 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 2 1 2 0 0 2 1 1 3 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 4 6 4 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 . 4 4 0 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 4 0 0 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 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 D 0 0 125 0, 0.0 106,-0.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 100.6 64.7 18.7 96.0 2 14 A M - 0 0 39 104,-0.1 2,-0.3 106,-0.1 106,-0.2 -0.424 360.0-175.4 -63.3 126.9 62.0 18.4 93.3 3 15 A R E -a 108 0A 60 104,-1.8 106,-1.3 -2,-0.2 107,-0.2 -0.844 31.2-125.8-110.8 159.0 60.4 21.6 92.0 4 16 A D E S+ 0 0 25 23,-0.5 106,-1.1 -2,-0.3 2,-0.4 0.932 92.6 18.9 -67.1 -45.5 57.4 21.6 89.6 5 17 A L E -ab 110 28A 2 22,-1.8 24,-1.7 104,-0.2 2,-0.5 -0.989 61.1-155.1-134.6 128.9 59.2 23.8 87.0 6 18 A T E -ab 111 29A 0 104,-1.8 106,-3.3 -2,-0.4 2,-0.5 -0.892 17.2-156.3 -94.9 130.3 62.8 24.8 86.3 7 19 A I E -ab 112 30A 0 22,-2.8 24,-3.4 -2,-0.5 2,-0.8 -0.951 3.0-152.3-111.0 120.8 63.1 28.1 84.5 8 20 A I E +ab 113 31A 9 104,-3.1 106,-2.7 -2,-0.5 24,-0.2 -0.825 68.1 25.6 -95.8 105.5 66.2 28.6 82.5 9 21 A G - 0 0 8 22,-2.4 23,-0.2 -2,-0.8 22,-0.1 0.139 59.9-140.5 112.2 132.5 66.9 32.4 82.4 10 22 A G + 0 0 0 26,-0.2 28,-3.2 4,-0.1 29,-0.2 -0.137 58.2 121.6-116.8 34.2 66.0 35.3 84.6 11 23 A G S > S- 0 0 11 103,-0.5 4,-2.3 27,-0.3 28,-0.2 -0.152 89.7 -74.0 -74.6-173.4 65.2 38.0 82.1 12 24 A P H > S+ 0 0 14 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.850 134.9 53.7 -55.3 -34.9 61.7 39.6 82.1 13 25 A T H > S+ 0 0 14 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.925 109.9 43.4 -65.7 -50.5 60.3 36.4 80.6 14 26 A G H > S+ 0 0 0 100,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.877 114.7 52.2 -63.7 -39.1 61.6 33.9 83.2 15 27 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 3,-0.3 0.950 111.2 43.9 -61.1 -53.6 60.6 36.3 86.0 16 28 A F H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.889 112.3 55.6 -60.7 -38.7 57.0 36.7 84.9 17 29 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.830 105.0 51.9 -58.3 -37.0 57.0 33.0 84.3 18 30 A A H X S+ 0 0 1 -4,-1.6 4,-1.9 -3,-0.3 -2,-0.2 0.865 109.5 49.1 -70.5 -37.3 58.0 32.5 87.9 19 31 A F H X S+ 0 0 4 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.900 107.5 55.8 -60.9 -44.0 55.1 34.8 89.0 20 32 A Q H X S+ 0 0 10 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.869 104.7 53.2 -58.0 -37.8 52.9 32.6 86.8 21 33 A C H <>S+ 0 0 0 -4,-1.6 5,-2.6 2,-0.2 -1,-0.2 0.957 111.5 44.9 -62.0 -51.4 54.0 29.5 88.7 22 34 A G H ><5S+ 0 0 11 -4,-1.9 3,-2.5 1,-0.2 -2,-0.2 0.959 110.9 52.9 -52.1 -58.3 53.1 31.2 92.0 23 35 A M H 3<5S+ 0 0 62 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.830 115.0 43.3 -46.1 -38.7 49.8 32.4 90.7 24 36 A N T 3<5S- 0 0 47 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.233 116.8-111.9 -98.5 12.1 49.0 28.9 89.6 25 37 A N T < 5S+ 0 0 142 -3,-2.5 2,-0.4 1,-0.2 -3,-0.2 0.872 72.0 128.6 57.2 45.3 50.2 27.2 92.8 26 38 A I < - 0 0 11 -5,-2.6 -1,-0.2 -6,-0.1 2,-0.2 -0.982 55.6-122.9-125.3 144.3 53.3 25.4 91.4 27 39 A S + 0 0 48 -2,-0.4 -22,-1.8 50,-0.0 -23,-0.5 -0.523 37.7 167.1 -82.6 150.7 56.8 25.5 92.8 28 40 A C E -b 5 0A 8 -24,-0.2 50,-1.8 -2,-0.2 2,-0.3 -0.965 26.1-147.4-152.5 166.0 59.6 26.6 90.6 29 41 A R E -bc 6 78A 3 -24,-1.7 -22,-2.8 -2,-0.3 2,-0.5 -0.983 14.7-140.0-134.8 147.7 63.2 27.8 90.5 30 42 A I E -bc 7 79A 0 48,-2.8 50,-3.6 -2,-0.3 2,-0.7 -0.950 11.7-160.5-102.3 123.1 64.9 30.2 88.2 31 43 A I E -bc 8 80A 2 -24,-3.4 -22,-2.4 -2,-0.5 2,-0.4 -0.929 16.6-174.7-101.7 113.8 68.4 29.2 87.1 32 44 A E - 0 0 12 48,-3.8 51,-2.2 -2,-0.7 50,-0.1 -0.923 25.9-153.0-118.0 134.4 70.2 32.3 85.8 33 45 A S S S+ 0 0 33 -2,-0.4 51,-0.2 49,-0.2 -1,-0.1 0.769 76.7 69.0 -72.7 -30.8 73.7 32.5 84.2 34 46 A M S S- 0 0 47 2,-0.3 48,-2.4 48,-0.1 49,-0.3 -0.310 92.4-109.7 -85.8 170.8 74.5 36.1 85.3 35 47 A P S S+ 0 0 85 0, 0.0 2,-0.3 0, 0.0 46,-0.1 0.562 103.0 33.1 -74.9 -8.9 75.2 37.4 88.9 36 48 A Q S S- 0 0 96 3,-0.0 3,-0.3 45,-0.0 -2,-0.3 -0.943 84.5-111.4-139.6 159.9 71.9 39.2 88.8 37 49 A L S S+ 0 0 28 -2,-0.3 -26,-0.2 1,-0.2 28,-0.0 -0.509 77.3 80.9 -82.2 161.1 68.4 38.7 87.4 38 50 A G >> - 0 0 0 -28,-3.2 3,-1.1 -2,-0.2 4,-0.9 0.293 66.1-149.4 128.2 -8.5 67.0 40.9 84.6 39 51 A G H >> S- 0 0 12 -3,-0.3 4,-1.7 1,-0.2 3,-0.5 -0.105 72.4 -7.5 50.7-136.3 68.5 39.6 81.3 40 52 A Q H 3>>S+ 0 0 45 1,-0.2 4,-2.0 2,-0.2 5,-0.9 0.774 133.0 60.6 -61.2 -30.9 69.1 42.1 78.5 41 53 A L H <45S+ 0 0 4 -3,-1.1 4,-0.4 1,-0.2 21,-0.2 0.876 110.1 38.3 -67.2 -40.6 67.3 44.9 80.4 42 54 A A H <<5S+ 0 0 7 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.811 125.5 38.0 -80.0 -32.1 69.7 44.8 83.4 43 55 A A H <5S+ 0 0 37 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.2 0.945 125.9 26.0 -85.1 -56.4 72.9 44.2 81.3 44 56 A L T <5S+ 0 0 84 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.1 0.762 137.0 7.4 -89.8 -29.2 72.6 46.2 78.1 45 57 A Y > < + 0 0 51 -5,-0.9 3,-1.3 -4,-0.4 16,-0.5 0.017 63.9 150.0-149.4 43.3 70.3 49.1 78.9 46 58 A P T 3 S+ 0 0 40 0, 0.0 16,-2.5 0, 0.0 17,-0.4 0.754 83.5 39.3 -49.0 -33.8 69.4 49.4 82.7 47 59 A E T 3 S+ 0 0 167 14,-0.2 2,-0.2 13,-0.1 -5,-0.1 0.588 90.1 104.6 -98.5 -13.6 69.0 53.2 82.5 48 60 A K S < S- 0 0 80 -3,-1.3 13,-2.6 -7,-0.2 2,-0.3 -0.497 75.0-114.5 -73.7 138.5 67.2 53.6 79.2 49 61 A H E -H 60 0B 76 11,-0.3 2,-0.4 -2,-0.2 600,-0.2 -0.565 22.1-150.0 -79.1 126.2 63.5 54.4 79.2 50 62 A I E +H 59 0B 2 9,-4.4 9,-2.3 -2,-0.3 3,-0.1 -0.801 19.2 172.6 -93.9 139.6 61.1 51.8 77.8 51 63 A Y + 0 0 22 -2,-0.4 -1,-0.1 7,-0.2 5,-0.1 0.615 64.1 65.5-119.3 -20.8 57.8 53.1 76.3 52 64 A D + 0 0 31 2,-0.1 2,-0.5 3,-0.1 246,-0.3 -0.019 69.4 104.1-105.9 25.9 56.1 50.1 74.7 53 65 A V S > S- 0 0 4 3,-0.5 3,-1.9 244,-0.1 6,-0.0 -0.956 84.8 -99.4-104.3 128.0 55.3 47.9 77.7 54 66 A A T 3 S+ 0 0 5 -2,-0.5 333,-0.1 1,-0.3 -2,-0.1 -0.173 99.5 3.9 -55.7 127.2 51.6 48.2 78.6 55 67 A G T 3 S+ 0 0 5 331,-0.2 -1,-0.3 332,-0.1 332,-0.1 0.437 103.0 103.0 80.1 0.4 50.6 50.6 81.4 56 68 A F < - 0 0 26 -3,-1.9 -3,-0.5 1,-0.2 3,-0.3 -0.870 51.2-172.1-111.7 92.3 54.2 51.8 81.9 57 69 A P S S- 0 0 55 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.891 76.8 -9.7 -53.0 -46.8 54.2 55.3 80.2 58 70 A E S S+ 0 0 97 -6,-0.1 -7,-0.2 2,-0.0 -9,-0.1 -0.821 79.2 167.0-159.1 109.9 58.0 55.7 80.5 59 71 A V E -H 50 0B 14 -9,-2.3 -9,-4.4 -3,-0.3 2,-0.2 -0.990 37.0-119.7-135.4 130.2 60.1 53.4 82.6 60 72 A P E >> -H 49 0B 29 0, 0.0 4,-1.5 0, 0.0 3,-1.4 -0.540 34.7-120.4 -65.2 133.9 63.8 52.8 83.0 61 73 A A H 3> S+ 0 0 0 -13,-2.6 4,-2.1 -16,-0.5 3,-0.3 0.816 110.6 52.0 -44.4 -47.0 64.5 49.1 82.0 62 74 A I H 3> S+ 0 0 45 -16,-2.5 4,-1.7 1,-0.2 -1,-0.3 0.776 106.0 54.7 -66.8 -30.0 66.0 48.2 85.4 63 75 A D H <> S+ 0 0 71 -3,-1.4 4,-2.4 -17,-0.4 -1,-0.2 0.857 106.9 51.6 -67.9 -36.4 63.0 49.6 87.3 64 76 A L H X S+ 0 0 2 -4,-1.5 4,-3.1 -3,-0.3 5,-0.2 0.944 107.1 52.2 -65.7 -49.6 60.7 47.3 85.1 65 77 A V H X S+ 0 0 7 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.905 111.5 48.1 -45.4 -49.1 62.9 44.3 86.0 66 78 A E H X S+ 0 0 112 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.858 110.5 50.4 -63.9 -41.2 62.4 45.4 89.7 67 79 A S H X S+ 0 0 40 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.910 113.7 45.8 -60.3 -45.1 58.6 45.7 89.2 68 80 A L H X S+ 0 0 0 -4,-3.1 4,-1.6 2,-0.2 -2,-0.2 0.875 113.8 48.5 -67.0 -41.3 58.5 42.3 87.6 69 81 A W H X S+ 0 0 67 -4,-2.5 4,-3.0 -5,-0.2 -2,-0.2 0.913 108.3 52.4 -66.6 -45.1 60.6 40.7 90.3 70 82 A A H X S+ 0 0 49 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.904 108.3 53.8 -56.1 -43.0 58.6 42.3 93.2 71 83 A Q H < S+ 0 0 3 -4,-1.7 4,-0.2 1,-0.2 -1,-0.2 0.888 116.4 37.5 -56.6 -43.3 55.5 40.8 91.6 72 84 A A H >< S+ 0 0 0 -4,-1.6 3,-1.5 1,-0.2 -2,-0.2 0.794 102.8 69.1 -81.2 -30.3 57.1 37.3 91.5 73 85 A E H >< S+ 0 0 109 -4,-3.0 3,-2.8 1,-0.3 -1,-0.2 0.807 81.8 75.3 -66.6 -28.8 59.0 37.3 94.9 74 86 A R T 3< S+ 0 0 180 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.872 97.4 49.5 -39.2 -43.2 55.8 37.2 96.9 75 87 A Y T < S- 0 0 82 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.312 107.2-132.5 -89.5 6.6 55.7 33.6 95.9 76 88 A N < - 0 0 133 -3,-2.8 2,-0.1 1,-0.1 -3,-0.1 0.859 29.8-172.6 44.2 60.0 59.3 32.9 97.0 77 89 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 -48,-0.2 -0.499 32.1-103.7 -73.2 150.0 60.7 31.0 94.0 78 90 A D E -c 29 0A 59 -50,-1.8 -48,-2.8 -2,-0.1 2,-0.5 -0.591 37.3-158.2 -69.5 132.1 64.2 29.5 94.3 79 91 A V E -c 30 0A 53 -2,-0.3 2,-0.6 -50,-0.2 -48,-0.2 -0.977 9.0-168.5-117.7 121.4 66.7 31.6 92.5 80 92 A V E -c 31 0A 24 -50,-3.6 -48,-3.8 -2,-0.5 3,-0.3 -0.945 12.6-172.3-109.0 113.9 70.0 30.2 91.3 81 93 A L + 0 0 63 -2,-0.6 -48,-0.2 1,-0.2 3,-0.1 -0.615 60.8 28.6 -99.6 162.2 72.5 32.8 90.1 82 94 A N S S+ 0 0 97 -48,-2.4 2,-0.4 -2,-0.2 -49,-0.2 0.818 92.8 112.9 58.6 35.6 75.9 32.4 88.4 83 95 A E - 0 0 26 -51,-2.2 2,-0.5 -3,-0.3 -1,-0.2 -0.982 51.0-156.0-141.2 129.2 75.0 29.0 86.9 84 96 A T - 0 0 34 -2,-0.4 17,-1.6 -51,-0.2 2,-0.4 -0.901 19.9-130.5-104.4 123.9 74.5 28.2 83.2 85 97 A V E +D 100 0A 4 -2,-0.5 15,-0.3 15,-0.2 171,-0.1 -0.620 33.2 167.4 -73.8 125.9 72.3 25.2 82.2 86 98 A T E + 0 0 51 13,-3.0 2,-0.3 -2,-0.4 14,-0.2 0.607 58.2 9.0-117.1 -22.4 74.2 23.1 79.8 87 99 A K E -D 99 0A 112 12,-1.5 12,-3.3 2,-0.0 -1,-0.3 -0.977 52.9-167.1-154.3 165.3 72.2 19.8 79.7 88 100 A Y E -D 98 0A 38 -2,-0.3 2,-0.3 10,-0.3 10,-0.3 -0.936 6.4-156.0-143.6 165.3 69.0 18.1 80.7 89 101 A T E -D 97 0A 63 8,-1.9 8,-1.9 -2,-0.3 2,-0.5 -0.951 12.2-143.7-145.5 131.3 67.6 14.6 80.8 90 102 A K E -D 96 0A 76 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.833 30.2-145.1 -86.6 125.7 64.0 13.4 80.7 91 103 A L > - 0 0 60 4,-2.4 3,-2.9 -2,-0.5 -2,-0.0 -0.435 28.0 -94.6 -91.4 165.8 63.7 10.3 83.0 92 104 A D T 3 S+ 0 0 181 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.729 125.3 53.7 -44.5 -31.6 61.6 7.2 82.7 93 105 A D T 3 S- 0 0 113 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.416 118.2-108.7 -92.2 0.8 59.0 8.8 84.9 94 106 A G S < S+ 0 0 15 -3,-2.9 -2,-0.1 1,-0.3 -1,-0.0 0.240 80.0 123.0 91.6 -13.0 58.6 12.0 82.8 95 107 A T - 0 0 20 -5,-0.1 -4,-2.4 1,-0.1 2,-0.3 -0.183 55.0-121.4 -74.4 174.3 60.4 14.2 85.3 96 108 A F E -DE 90 108A 0 12,-3.8 12,-2.0 -6,-0.2 2,-0.4 -0.891 17.2-163.7-127.8 148.8 63.5 16.3 84.4 97 109 A E E -DE 89 107A 69 -8,-1.9 -8,-1.9 -2,-0.3 2,-0.4 -0.983 14.0-169.8-128.7 118.5 67.1 16.7 85.5 98 110 A T E -DE 88 106A 0 8,-2.6 8,-2.5 -2,-0.4 2,-0.4 -0.917 8.9-150.5-110.4 136.5 68.8 19.9 84.3 99 111 A R E -DE 87 105A 128 -12,-3.3 -13,-3.0 -2,-0.4 -12,-1.5 -0.877 4.4-154.7-111.9 137.7 72.6 20.3 84.7 100 112 A T E > -D 85 0A 2 4,-2.5 3,-1.7 -2,-0.4 -15,-0.2 -0.577 35.4-100.8-102.7 169.4 74.6 23.5 85.2 101 113 A N T 3 S+ 0 0 99 -17,-1.6 -16,-0.1 1,-0.3 -18,-0.1 0.685 119.7 61.4 -64.9 -20.4 78.2 24.2 84.4 102 114 A T T 3 S- 0 0 80 -18,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.137 121.4-105.6 -90.8 17.9 79.3 23.8 88.1 103 115 A G S < S+ 0 0 41 -3,-1.7 2,-0.3 1,-0.2 -2,-0.1 0.508 73.1 145.9 71.5 4.7 78.1 20.2 87.9 104 116 A N - 0 0 76 1,-0.0 -4,-2.5 -5,-0.0 2,-0.4 -0.578 36.3-150.2 -74.1 135.2 74.9 20.9 89.9 105 117 A V E - E 0 99A 75 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.891 7.1-160.1-110.5 138.6 71.8 18.9 89.0 106 118 A Y E - E 0 98A 28 -8,-2.5 -8,-2.6 -2,-0.4 2,-0.4 -0.969 6.2-146.3-126.6 130.4 68.2 20.2 89.4 107 119 A R E + E 0 97A 100 -2,-0.4 -104,-1.8 -106,-0.4 2,-0.3 -0.773 27.6 153.3 -99.4 135.6 65.1 18.2 89.6 108 120 A S E -aE 3 96A 0 -12,-2.0 -12,-3.8 -2,-0.4 -104,-0.2 -0.985 49.9-126.8-155.3 156.4 61.7 19.3 88.2 109 121 A R E S- 0 0 101 -106,-1.3 2,-0.3 -2,-0.3 -104,-0.2 0.657 97.5 -9.2 -76.6 -19.6 58.5 17.9 86.8 110 122 A A E S-a 5 0A 0 -106,-1.1 -104,-1.8 -107,-0.2 2,-0.3 -0.944 70.9-130.7-163.4 170.5 58.9 20.1 83.7 111 123 A V E -af 6 281A 0 169,-3.0 171,-2.7 -2,-0.3 2,-0.5 -0.996 2.1-152.3-141.4 147.3 61.1 22.9 82.4 112 124 A L E -af 7 282A 1 -106,-3.3 -104,-3.1 -2,-0.3 2,-0.7 -0.962 11.8-150.0-116.7 119.2 60.8 26.3 80.7 113 125 A I E +af 8 283A 0 169,-3.4 171,-2.3 -2,-0.5 -104,-0.1 -0.824 31.7 155.0 -87.4 114.9 63.6 27.7 78.5 114 126 A A + 0 0 7 -106,-2.7 -103,-0.5 -2,-0.7 -100,-0.4 -0.265 22.4 133.7-131.9 43.2 63.5 31.4 78.8 115 127 A A > - 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0 0 40 -124,-0.4 2,-0.2 1,-0.3 -89,-0.1 0.030 67.8-104.8-111.2 24.8 81.8 45.9 71.2 248 260 A G - 0 0 33 -125,-0.1 -125,-1.8 -3,-0.1 -1,-0.3 -0.629 50.7 -47.6 95.5-147.6 78.9 44.3 73.2 249 261 A F B -I 122 0C 78 -127,-0.3 2,-0.1 -2,-0.2 -129,-0.0 -0.939 48.8-101.9-136.9 150.3 77.9 40.7 73.6 250 262 A K - 0 0 83 -129,-3.2 2,-0.5 -2,-0.3 -130,-0.4 -0.383 24.6-146.3 -77.0 151.9 77.3 37.6 71.5 251 263 A S + 0 0 71 -2,-0.1 2,-0.3 -131,-0.1 -133,-0.2 -0.862 47.3 103.6-127.1 92.0 73.9 36.3 70.5 252 264 A N S S- 0 0 78 -2,-0.5 -133,-0.2 -135,-0.4 4,-0.1 -0.963 77.9 -95.1-158.7 167.6 73.4 32.5 70.2 253 265 A L > - 0 0 9 -2,-0.3 3,-1.9 1,-0.2 -135,-0.1 0.487 51.9-161.4 -66.4 -4.3 71.8 29.6 72.1 254 266 A G G > S- 0 0 26 1,-0.3 3,-1.3 2,-0.2 4,-0.2 -0.351 70.9 -7.1 56.3-129.5 75.1 28.7 73.7 255 267 A P G > S+ 0 0 28 0, 0.0 3,-1.2 0, 0.0 -1,-0.3 0.718 129.9 69.6 -66.1 -23.0 75.0 25.1 75.1 256 268 A L G X S+ 0 0 10 -3,-1.9 3,-0.8 1,-0.2 5,-0.2 0.534 82.8 73.8 -75.4 -7.8 71.3 24.9 74.3 257 269 A A G < S+ 0 0 33 -3,-1.3 -1,-0.2 1,-0.2 4,-0.2 0.753 93.7 53.2 -70.3 -27.4 72.1 24.9 70.6 258 270 A R G < S+ 0 0 179 -3,-1.2 2,-0.5 -4,-0.2 -1,-0.2 0.163 79.8 106.6-101.5 14.1 73.3 21.3 70.9 259 271 A W S < S- 0 0 14 -3,-0.8 2,-3.4 2,-0.1 -172,-0.0 -0.826 88.6-113.0 -83.9 133.9 70.1 20.0 72.6 260 272 A D S S+ 0 0 168 -2,-0.5 2,-0.4 2,-0.0 -2,-0.1 -0.235 72.4 132.4 -75.1 60.5 68.5 18.0 69.8 261 273 A L - 0 0 11 -2,-3.4 -2,-0.1 -5,-0.2 15,-0.0 -0.880 66.9 -92.4-116.1 143.0 65.6 20.4 69.4 262 274 A E - 0 0 120 -2,-0.4 7,-2.1 7,-0.1 2,-0.3 -0.267 47.5-165.4 -54.1 126.8 64.1 21.9 66.3 263 275 A L E -Q 268 0F 73 5,-0.2 2,-0.3 -6,-0.0 5,-0.2 -0.790 17.9-174.6-113.2 157.9 65.7 25.3 65.5 264 276 A Y E > S-Q 267 0F 112 3,-2.0 3,-0.6 -2,-0.3 -2,-0.0 -0.772 76.6 -24.0-153.7 105.7 64.8 28.1 63.2 265 277 A E T 3 S- 0 0 154 -2,-0.3 3,-0.1 1,-0.2 0, 0.0 0.951 124.9 -47.0 55.7 60.7 67.2 31.0 62.8 266 278 A N T 3 S+ 0 0 94 1,-0.2 2,-0.3 -9,-0.0 -1,-0.2 0.602 121.0 101.3 61.2 15.0 69.0 30.6 66.1 267 279 A A E < S-Q 264 0F 5 -3,-0.6 -3,-2.0 -15,-0.1 2,-0.5 -0.881 78.6-105.4-125.2 157.5 65.7 30.3 68.0 268 280 A L E -Qr 263 288F 0 19,-3.4 21,-2.9 -2,-0.3 -5,-0.2 -0.748 34.9-125.4 -86.3 124.2 63.8 27.3 69.5 269 281 A V E - r 0 289F 27 -7,-2.1 2,-0.3 -2,-0.5 8,-0.2 -0.426 34.2-173.3 -70.8 141.1 60.7 26.3 67.4 270 282 A V - 0 0 10 19,-2.2 6,-0.2 -2,-0.1 12,-0.1 -0.975 16.3-134.1-144.5 141.1 57.6 26.2 69.5 271 283 A D > - 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0 0 39 -2,-0.4 3,-2.5 -21,-0.2 -19,-0.1 -0.947 64.4 -71.2-147.0 150.8 44.0 31.4 67.1 610 303 B P T 3 S+ 0 0 82 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.158 124.1 18.6 -47.6 128.2 45.0 27.9 68.4 611 304 B G T 3 S+ 0 0 16 1,-0.2 -3,-0.0 -338,-0.1 -340,-0.0 0.396 85.9 161.0 90.9 -1.4 46.2 28.3 72.0 612 305 B K < - 0 0 25 -3,-2.5 2,-0.5 1,-0.1 -1,-0.2 -0.262 25.6-156.8 -54.4 129.6 44.5 31.7 72.6 613 306 B L - 0 0 23 2,-0.1 2,-1.9 3,-0.0 5,-0.1 -0.958 15.6-135.3-107.7 127.7 44.0 32.6 76.2 614 307 B K + 0 0 130 -2,-0.5 2,-0.3 4,-0.1 -9,-0.1 -0.552 63.3 113.6 -85.3 78.2 41.2 35.1 76.9 615 308 B I S > S- 0 0 37 -2,-1.9 4,-1.4 1,-0.1 5,-0.1 -0.851 77.1-104.6-137.5 170.9 43.0 37.3 79.3 616 309 B I H > S+ 0 0 21 -2,-0.3 4,-1.9 2,-0.2 3,-0.5 0.967 113.3 53.9 -62.5 -55.2 44.4 40.9 79.5 617 310 B Q H > S+ 0 0 3 -246,-0.3 4,-1.4 1,-0.3 -315,-0.2 0.829 110.2 48.1 -47.9 -45.0 48.1 40.1 79.0 618 311 B T H > S+ 0 0 1 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.849 108.9 51.5 -69.4 -39.7 47.5 38.2 75.8 619 312 B G H X S+ 0 0 0 -4,-1.4 4,-1.9 -3,-0.5 -1,-0.2 0.822 105.2 59.4 -68.3 -30.5 45.2 40.8 74.2 620 313 B L H X S+ 0 0 1 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.926 109.3 39.9 -65.5 -47.3 47.9 43.4 74.9 621 314 B S H X S+ 0 0 4 -4,-1.4 4,-2.0 -323,-0.2 -1,-0.2 0.769 112.3 58.0 -74.2 -25.4 50.6 41.7 72.8 622 315 B E H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.879 104.0 52.4 -65.2 -40.5 48.0 40.7 70.2 623 316 B A H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.884 109.4 49.8 -61.1 -41.1 47.3 44.5 69.8 624 317 B T H X S+ 0 0 8 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.891 112.7 46.4 -63.0 -43.7 51.0 45.0 69.3 625 318 B M H X S+ 0 0 14 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.885 112.7 49.4 -69.3 -39.3 51.2 42.3 66.6 626 319 B A H X S+ 0 0 2 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.910 113.8 44.8 -65.9 -43.6 48.1 43.5 64.8 627 320 B V H X S+ 0 0 0 -4,-2.1 4,-0.8 2,-0.2 -2,-0.2 0.909 111.9 54.1 -67.4 -41.7 49.3 47.1 64.6 628 321 B R H >< S+ 0 0 78 -4,-2.1 3,-0.7 1,-0.2 4,-0.3 0.924 114.3 39.1 -56.2 -51.3 52.8 46.0 63.6 629 322 B H H >X S+ 0 0 50 -4,-2.1 3,-1.8 1,-0.2 4,-0.5 0.814 102.6 70.1 -71.4 -31.6 51.6 44.0 60.6 630 323 B S H >X S+ 0 0 0 -4,-1.9 4,-3.1 1,-0.3 3,-0.9 0.745 85.8 71.9 -58.9 -22.1 48.8 46.5 59.6 631 324 B L H < S- 0 0 59 -4,-2.7 3,-1.0 -5,-0.2 -1,-0.3 -0.728 88.8-162.3-120.9 78.5 51.8 51.6 53.8 636 329 B P T 3 S+ 0 0 100 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.344 71.4 9.3 -69.3 141.8 52.4 48.9 51.1 637 330 B G T 3 S+ 0 0 90 -5,-0.3 2,-0.2 1,-0.2 -5,-0.1 0.110 92.7 133.3 83.2 -21.9 55.9 48.5 49.7 638 331 B E < - 0 0 119 -3,-1.0 2,-0.4 -7,-0.2 -1,-0.2 -0.445 61.4-119.1 -70.8 129.3 57.4 50.8 52.4 639 332 B K - 0 0 164 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.537 26.4-137.9 -69.3 121.4 60.5 49.4 54.1 640 333 B I - 0 0 104 -2,-0.4 2,-0.8 2,-0.0 -1,-0.1 -0.703 7.6-141.1 -86.2 128.9 59.9 49.0 57.9 641 334 B R - 0 0 198 -2,-0.4 2,-2.1 1,-0.1 -1,-0.0 -0.806 9.5-143.5 -96.0 107.4 62.7 50.1 60.2 642 335 B N + 0 0 114 -2,-0.8 2,-0.3 2,-0.0 -1,-0.1 -0.450 39.8 152.9 -71.8 75.9 63.1 47.7 63.2 643 336 B V - 0 0 53 -2,-2.1 2,-0.2 4,-0.0 -2,-0.0 -0.775 43.8-121.6 -95.9 149.3 64.0 50.2 66.0 644 337 B F > - 0 0 116 -2,-0.3 4,-3.1 1,-0.1 5,-0.2 -0.623 25.2-115.7 -81.5 152.9 63.2 49.4 69.6 645 338 B S H > S+ 0 0 9 -2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.893 115.5 54.8 -54.7 -44.1 60.9 51.9 71.4 646 339 B S H > S+ 0 0 21 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.900 115.1 37.3 -56.1 -48.5 63.8 52.8 73.8 647 340 B V H > S+ 0 0 62 2,-0.2 4,-1.9 1,-0.2 3,-0.4 0.878 116.3 53.6 -72.5 -41.0 66.2 53.6 71.0 648 341 B K H X S+ 0 0 29 -4,-3.1 4,-1.0 1,-0.2 -2,-0.2 0.840 109.8 46.8 -64.4 -37.1 63.5 55.2 68.8 649 342 B M H < S+ 0 0 29 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.617 110.2 54.8 -81.8 -14.6 62.4 57.6 71.6 650 343 B A H >X S+ 0 0 44 -4,-0.5 4,-1.5 -3,-0.4 3,-0.6 0.841 105.1 52.5 -80.3 -39.6 66.1 58.5 72.3 651 344 B K H 3X S+ 0 0 96 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.809 111.2 46.5 -64.1 -34.2 66.7 59.5 68.6 652 345 B E H 3< S+ 0 0 106 -4,-1.0 -1,-0.2 2,-0.2 -2,-0.2 0.454 107.1 58.2 -90.6 -3.9 63.7 61.8 68.7 653 346 B K H <4 S+ 0 0 82 -3,-0.6 -2,-0.2 2,-0.1 -1,-0.2 0.750 109.4 45.2 -86.1 -33.6 64.9 63.3 72.1 654 347 B K H < 0 0 71 -4,-1.5 -2,-0.2 1,-0.0 -3,-0.1 0.939 360.0 360.0 -69.6 -51.3 68.2 64.2 70.4 655 348 B A < 0 0 121 -4,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.995 360.0 360.0 -59.8 360.0 66.5 65.7 67.3