==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-AUG-12 4GER . COMPND 2 MOLECULE: GENTLYASE METALLOPROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PAENIBACILLUS POLYMYXA; . AUTHOR A.RUF,M.STIHLE,J.BENZ,M.SCHMIDT,H.SOBEK . 612 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22050.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 422 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 10.5 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 . 25 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 205 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 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 0 0 0 0 0 0 0 0 0 2 4 0 2 0 0 2 0 2 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 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 0 0 PARALLEL BRIDGES PER LADDER . 2 8 6 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 0 ANTIPARALLEL BRIDGES PER LADDER . 4 4 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 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 A 0 0 60 0, 0.0 16,-2.5 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 160.7 8.6 -0.2 69.5 2 2 A T E -A 16 0A 100 14,-0.2 14,-0.2 12,-0.0 2,-0.2 -0.883 360.0-172.9-107.4 102.1 7.5 3.0 71.0 3 3 A G E -A 15 0A 0 12,-1.7 12,-1.9 -2,-0.7 2,-0.3 -0.485 3.4-161.9 -86.7 159.4 9.5 6.1 69.8 4 4 A T E +Ab 14 57A 52 52,-1.8 54,-3.2 10,-0.2 2,-0.3 -0.951 21.8 136.7-133.9 157.7 9.1 9.5 71.3 5 5 A G E -Ab 13 58A 4 8,-1.9 8,-2.4 -2,-0.3 2,-0.3 -0.928 48.6 -82.6 170.5 169.2 10.1 13.0 69.9 6 6 A K E -A 12 0A 114 52,-0.7 54,-0.4 -2,-0.3 58,-0.3 -0.648 37.3-137.1 -92.8 142.0 9.2 16.6 69.4 7 7 A G > - 0 0 1 4,-1.8 3,-2.3 -2,-0.3 55,-0.2 -0.199 43.3 -81.7 -83.5 179.9 7.0 17.8 66.4 8 8 A V T 3 S+ 0 0 32 53,-0.6 54,-0.1 1,-0.3 117,-0.1 0.844 132.3 52.9 -55.7 -35.8 7.6 20.9 64.3 9 9 A L T 3 S- 0 0 94 119,-0.2 -1,-0.3 52,-0.1 -3,-0.0 0.358 121.9-104.2 -82.6 3.7 5.9 23.0 67.1 10 10 A G S < S+ 0 0 43 -3,-2.3 2,-0.4 1,-0.3 -2,-0.1 0.509 73.9 141.0 93.5 3.3 8.1 21.6 69.9 11 11 A D - 0 0 66 1,-0.0 -4,-1.8 -5,-0.0 2,-0.3 -0.668 49.9-129.0 -84.5 126.0 5.4 19.3 71.4 12 12 A T E +A 6 0A 96 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.559 39.3 160.6 -78.4 132.4 6.6 15.8 72.6 13 13 A K E -A 5 0A 33 -8,-2.4 -8,-1.9 -2,-0.3 2,-0.3 -0.907 29.2-128.1-141.8 170.7 4.5 12.9 71.3 14 14 A S E +A 4 0A 73 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.807 26.4 163.2-122.0 160.8 4.9 9.1 70.8 15 15 A F E -A 3 0A 15 -12,-1.9 -12,-1.7 -2,-0.3 2,-0.4 -0.938 41.6 -81.2-164.3 172.7 4.4 6.9 67.8 16 16 A T E +A 2 0A 35 -2,-0.3 2,-0.2 -14,-0.2 -14,-0.2 -0.742 45.5 169.1 -96.5 138.0 5.3 3.3 66.7 17 17 A T - 0 0 1 -16,-2.5 2,-0.4 -2,-0.4 9,-0.2 -0.727 29.0-115.7-132.0 177.4 8.7 2.5 65.3 18 18 A T E -C 25 0B 31 7,-2.0 7,-3.1 -2,-0.2 2,-0.4 -0.988 15.2-135.0-126.9 129.4 10.6 -0.7 64.4 19 19 A A E +C 24 0B 63 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.684 29.8 174.8 -81.9 128.2 13.7 -2.0 66.0 20 20 A S E > -C 23 0B 59 3,-3.0 3,-1.7 -2,-0.4 2,-0.2 -0.898 54.8 -55.1-142.7 110.5 16.0 -3.2 63.2 21 21 A G T 3 S- 0 0 87 -2,-0.4 -1,-0.1 1,-0.2 0, 0.0 -0.380 122.4 -7.2 53.7-122.5 19.5 -4.4 64.2 22 22 A S T 3 S+ 0 0 119 -2,-0.2 -1,-0.2 -3,-0.1 2,-0.2 0.365 131.9 25.6 -86.2 7.7 21.3 -1.7 66.1 23 23 A S E < S-C 20 0B 35 -3,-1.7 -3,-3.0 32,-0.1 2,-0.4 -0.804 78.6 -95.3-151.5-169.9 18.7 1.1 65.7 24 24 A Y E -CD 19 53B 68 29,-2.5 29,-2.1 -5,-0.2 2,-0.4 -0.928 25.8-146.2-119.8 140.3 15.0 2.0 65.1 25 25 A Q E -CD 18 52B 36 -7,-3.1 2,-2.4 -2,-0.4 -7,-2.0 -0.871 26.9-115.1 -99.4 147.3 13.4 2.8 61.9 26 26 A L S S+ 0 0 0 25,-3.2 11,-2.7 -2,-0.4 2,-0.4 -0.404 76.6 122.7 -75.8 75.4 10.6 5.3 61.5 27 27 A K E -E 36 0C 62 -2,-2.4 2,-0.6 9,-0.2 9,-0.2 -0.995 46.9-163.3-149.4 123.2 8.2 2.5 60.5 28 28 A D E > +E 35 0C 1 7,-3.4 7,-2.1 -2,-0.4 3,-0.6 -0.929 7.5 179.2-117.9 108.5 4.9 1.4 62.0 29 29 A T T 3 + 0 0 88 -2,-0.6 -1,-0.1 5,-0.2 7,-0.1 0.382 68.6 77.8 -89.0 7.7 3.9 -2.1 60.8 30 30 A T T 3 S+ 0 0 99 1,-0.1 2,-0.6 5,-0.1 -1,-0.2 0.522 79.2 70.7 -98.7 -6.1 0.7 -2.1 62.9 31 31 A R S X S- 0 0 54 -3,-0.6 3,-2.4 62,-0.0 62,-0.3 -0.923 114.7 -62.3-115.1 104.3 -1.5 0.1 60.7 32 32 A G T 3 S- 0 0 27 -2,-0.6 59,-0.2 1,-0.3 3,-0.1 -0.277 115.1 -19.1 61.1-140.1 -2.5 -1.6 57.4 33 33 A N T 3 S- 0 0 115 57,-2.7 -1,-0.3 1,-0.3 59,-0.2 0.312 122.3 -72.7 -81.1 9.9 0.5 -2.3 55.3 34 34 A G < - 0 0 3 -3,-2.4 59,-3.0 57,-0.2 2,-0.5 -0.277 27.1-115.3 122.8 150.4 2.5 0.2 57.3 35 35 A V E +Ef 28 93C 0 -7,-2.1 -7,-3.4 57,-0.2 2,-0.4 -0.998 42.1 177.3-113.0 119.0 3.2 3.8 58.0 36 36 A V E -Ef 27 94C 4 57,-2.9 59,-1.9 -2,-0.5 2,-0.4 -0.988 12.6-162.4-132.5 131.0 6.7 4.5 56.8 37 37 A T E - f 0 95C 0 -11,-2.7 14,-2.3 -2,-0.4 2,-0.3 -0.969 9.4-173.8-125.3 134.2 8.6 7.8 56.9 38 38 A Y E -Gf 50 96C 21 57,-3.3 59,-2.5 -2,-0.4 2,-0.4 -0.757 21.2-129.3-122.2 154.2 11.7 8.8 55.0 39 39 A T E -Gf 49 97C 19 10,-2.6 10,-2.4 -2,-0.3 59,-0.2 -0.921 2.7-162.3 -99.7 133.2 14.2 11.6 54.7 40 40 A A > - 0 0 5 57,-3.1 3,-2.3 -2,-0.4 5,-0.4 0.410 36.8-131.9 -86.9 -0.0 15.0 13.1 51.3 41 41 A S T 3 - 0 0 44 56,-0.4 58,-0.1 1,-0.3 57,-0.1 0.848 64.7 -59.6 56.9 35.1 18.2 14.6 52.9 42 42 A N T 3 S+ 0 0 81 56,-2.2 -1,-0.3 1,-0.3 2,-0.2 0.644 119.4 102.9 61.8 20.3 17.4 17.9 51.3 43 43 A R S < S- 0 0 168 -3,-2.3 57,-2.8 55,-0.4 -1,-0.3 -0.576 79.9-114.8-108.2-174.1 17.5 16.5 47.8 44 44 A Q S S+ 0 0 39 55,-0.2 2,-0.5 -2,-0.2 414,-0.1 0.288 71.4 116.5-109.8 14.8 14.6 15.7 45.6 45 45 A S - 0 0 72 -5,-0.4 -2,-0.2 2,-0.1 55,-0.1 -0.726 62.2-117.1 -82.6 132.2 14.9 11.9 45.2 46 46 A I S S+ 0 0 34 -2,-0.5 -6,-0.1 525,-0.2 -2,-0.0 -0.915 82.5 9.3-118.0 146.3 11.9 10.1 46.7 47 47 A P S S- 0 0 38 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.955 86.4-176.7 -76.1 -21.5 11.1 8.2 48.8 48 48 A G - 0 0 33 -8,-0.1 2,-0.4 -10,-0.1 -8,-0.2 -0.837 46.4 -29.5 100.2-133.7 14.8 8.7 50.0 49 49 A T E -G 39 0C 85 -10,-2.4 -10,-2.6 -2,-0.4 -8,-0.1 -0.963 65.6-102.6-122.1 142.0 15.9 6.7 53.0 50 50 A I E -G 38 0C 44 -2,-0.4 -12,-0.3 -12,-0.2 2,-0.1 -0.286 47.1-109.6 -55.1 133.5 13.9 5.4 55.9 51 51 A L - 0 0 16 -14,-2.3 -25,-3.2 -25,-0.3 2,-0.3 -0.440 42.1-169.4 -69.0 141.1 14.5 7.7 58.9 52 52 A T E -D 25 0B 87 -27,-0.2 2,-0.3 -2,-0.1 -27,-0.2 -0.927 13.7-175.4-130.8 155.7 16.6 5.9 61.7 53 53 A D E -D 24 0B 35 -29,-2.1 -29,-2.5 -2,-0.3 5,-0.1 -0.973 23.4-138.8-154.3 142.7 17.5 6.7 65.3 54 54 A A S S+ 0 0 74 -2,-0.3 -1,-0.1 -31,-0.2 4,-0.1 0.894 98.9 22.6 -72.1 -40.6 19.8 4.9 67.7 55 55 A D S S- 0 0 109 2,-0.3 -1,-0.2 -32,-0.1 3,-0.1 0.381 102.8-111.1-116.0 2.9 17.8 5.1 71.0 56 56 A N S S+ 0 0 13 1,-0.2 -52,-1.8 -32,-0.1 2,-0.6 0.612 86.2 114.9 72.8 16.6 14.2 5.7 69.8 57 57 A V E -b 4 0A 77 -54,-0.2 -2,-0.3 2,-0.0 -52,-0.2 -0.969 63.7-144.4-110.5 112.0 14.1 9.3 71.1 58 58 A W E -b 5 0A 11 -54,-3.2 -52,-0.7 -2,-0.6 2,-0.4 -0.502 26.0-169.5 -93.9 141.2 13.8 11.1 67.8 59 59 A N + 0 0 145 -2,-0.2 -54,-0.1 -54,-0.1 -52,-0.1 -0.714 59.9 94.3-123.3 75.6 15.3 14.4 66.8 60 60 A D > - 0 0 27 -54,-0.4 4,-3.6 -2,-0.4 5,-0.2 -0.573 47.5-172.9-161.4 81.2 13.6 15.2 63.5 61 61 A P H > S+ 0 0 52 0, 0.0 4,-2.5 0, 0.0 -53,-0.6 0.900 85.4 49.9 -51.1 -46.6 10.6 17.4 64.1 62 62 A A H > S+ 0 0 5 -55,-0.2 4,-2.9 2,-0.2 5,-0.2 0.913 115.2 43.4 -59.4 -41.6 9.4 17.2 60.5 63 63 A G H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.924 110.6 55.6 -76.0 -35.5 9.6 13.4 60.4 64 64 A V H X S+ 0 0 1 -4,-3.6 4,-3.0 -58,-0.3 5,-0.2 0.946 114.8 39.3 -56.0 -46.7 8.1 13.0 63.8 65 65 A D H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.4 0.922 113.3 53.8 -74.8 -38.8 5.0 15.0 62.7 66 66 A A H X S+ 0 0 0 -4,-2.9 4,-1.9 -5,-0.2 -1,-0.2 0.919 117.5 39.4 -55.9 -44.3 4.9 13.4 59.2 67 67 A H H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.953 117.7 46.1 -73.5 -48.5 4.9 9.9 60.8 68 68 A T H X S+ 0 0 11 -4,-3.0 4,-2.6 -5,-0.3 -2,-0.2 0.913 114.7 46.0 -62.3 -41.2 2.6 10.7 63.7 69 69 A Y H X S+ 0 0 25 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.864 110.0 54.1 -79.3 -27.5 -0.0 12.6 61.7 70 70 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 -5,-0.4 -1,-0.2 0.930 111.3 46.4 -67.0 -41.5 -0.0 9.9 59.0 71 71 A A H X S+ 0 0 7 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.913 113.8 48.1 -63.4 -45.0 -0.7 7.3 61.8 72 72 A K H X S+ 0 0 115 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.840 110.1 51.3 -60.3 -36.1 -3.4 9.5 63.3 73 73 A T H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.893 108.7 52.2 -68.7 -37.5 -5.0 10.1 59.8 74 74 A Y H X S+ 0 0 17 -4,-2.3 4,-2.2 2,-0.2 11,-0.3 0.968 112.0 45.7 -57.1 -44.2 -5.0 6.3 59.3 75 75 A D H X S+ 0 0 64 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.856 111.7 53.2 -70.1 -36.8 -6.8 5.9 62.7 76 76 A Y H X S+ 0 0 22 -4,-2.0 4,-2.9 2,-0.2 5,-0.4 0.915 110.0 45.8 -66.8 -49.4 -9.2 8.8 61.8 77 77 A Y H X S+ 0 0 2 -4,-2.6 6,-2.1 1,-0.2 4,-1.8 0.879 117.0 44.5 -66.4 -40.3 -10.4 7.3 58.5 78 78 A K H X S+ 0 0 80 -4,-2.2 4,-1.1 4,-0.3 -2,-0.2 0.939 119.5 41.6 -69.5 -40.3 -10.8 3.8 60.0 79 79 A A H < S+ 0 0 91 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.900 125.4 32.8 -73.9 -40.9 -12.6 5.1 63.2 80 80 A K H < S+ 0 0 57 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.862 136.5 16.9 -85.3 -37.0 -14.8 7.7 61.5 81 81 A F H < S- 0 0 26 -4,-1.8 -3,-0.2 -5,-0.4 -2,-0.2 0.303 93.4-116.7-123.4 0.4 -15.5 6.2 58.1 82 82 A G < + 0 0 68 -4,-1.1 2,-0.5 -5,-0.3 -4,-0.3 0.751 66.8 145.7 65.9 23.4 -14.7 2.5 58.4 83 83 A R - 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0 0 131 -2,-0.5 -9,-0.3 -9,-0.2 53,-0.1 -0.848 30.6-124.1 -91.4 123.0 27.3 13.3 16.3 550 245 B G - 0 0 36 -2,-0.7 -12,-0.2 -11,-0.5 -11,-0.2 -0.245 19.1-161.7 -71.4 151.7 23.6 13.5 15.5 551 246 B I - 0 0 30 -14,-2.8 4,-0.5 1,-0.2 -13,-0.2 0.351 46.5-104.1-109.2 0.3 21.6 10.5 14.5 552 247 B G > - 0 0 33 -14,-2.8 4,-2.3 -15,-0.3 -1,-0.2 0.082 30.9 -85.2 89.5 149.0 18.6 12.2 12.9 553 248 B R H > S+ 0 0 39 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.843 122.3 58.7 -57.8 -39.2 15.0 12.8 14.1 554 249 B D H > S+ 0 0 106 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.958 113.6 36.1 -62.9 -46.2 13.8 9.4 12.9 555 250 B A H > S+ 0 0 9 -4,-0.5 4,-2.0 2,-0.2 -2,-0.2 0.927 117.3 52.2 -69.6 -41.7 16.3 7.4 15.0 556 251 B A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.928 109.0 49.4 -65.5 -41.7 16.2 9.8 18.0 557 252 B V H X S+ 0 0 0 -4,-2.4 4,-3.3 1,-0.2 5,-0.3 0.935 110.5 50.8 -67.4 -36.0 12.3 9.7 18.2 558 253 B Q H X S+ 0 0 61 -4,-1.7 4,-2.6 -5,-0.3 -1,-0.2 0.909 112.4 47.8 -63.5 -38.4 12.3 5.9 18.1 559 254 B I H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.917 115.1 44.0 -68.8 -44.8 14.8 5.8 20.9 560 255 B Y H X S+ 0 0 1 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.912 112.5 52.0 -69.0 -40.8 12.9 8.3 23.0 561 256 B Y H X S+ 0 0 25 -4,-3.3 4,-2.2 1,-0.2 5,-0.3 0.964 113.8 43.8 -60.6 -47.5 9.6 6.6 22.4 562 257 B S H X>S+ 0 0 13 -4,-2.6 4,-2.7 -5,-0.3 5,-0.8 0.935 113.9 51.2 -63.9 -41.0 11.0 3.3 23.5 563 258 B A H X>S+ 0 0 0 -4,-2.4 5,-1.4 1,-0.2 4,-1.3 0.910 116.5 39.5 -56.6 -46.5 12.8 4.9 26.5 564 259 B F H <5S+ 0 0 1 -4,-2.7 -113,-0.5 3,-0.2 -1,-0.2 0.732 121.5 40.0 -85.3 -22.4 9.7 6.6 27.8 565 260 B T H <5S+ 0 0 19 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.782 129.7 23.3-101.6 -22.3 7.2 4.0 27.1 566 261 B N H <5S+ 0 0 109 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.731 127.5 32.0-106.4 -35.5 9.2 0.9 28.2 567 262 B Y T < - 0 0 84 -2,-0.1 3,-1.9 -117,-0.1 -115,-0.2 -0.675 41.4 -80.4-128.0-177.2 8.6 4.5 35.7 570 265 B S T 3 S+ 0 0 28 1,-0.3 -116,-3.0 -2,-0.2 -118,-0.1 0.801 126.1 36.5 -63.2 -27.3 6.5 7.0 37.6 571 266 B S T 3 S+ 0 0 52 -118,-0.2 -1,-0.3 -112,-0.0 -525,-0.2 0.209 82.0 141.0-107.7 14.3 9.4 8.4 39.8 572 267 B S < - 0 0 5 -3,-1.9 -110,-0.2 -121,-0.2 2,-0.2 -0.319 34.1-158.0 -61.2 147.0 12.2 8.3 37.2 573 268 B D > - 0 0 43 -115,-0.1 4,-2.1 -114,-0.1 5,-0.2 -0.488 37.9 -84.6-113.6-178.5 14.6 11.3 37.3 574 269 B F H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.913 128.2 54.4 -64.9 -37.5 16.9 12.7 34.6 575 270 B S H > S+ 0 0 51 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.885 108.9 49.5 -60.0 -39.4 19.7 10.2 35.5 576 271 B N H > S+ 0 0 74 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.886 108.0 53.5 -62.3 -40.6 17.2 7.4 34.9 577 272 B A H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.922 106.3 53.4 -62.7 -43.9 16.1 8.9 31.6 578 273 B R H X S+ 0 0 39 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.950 111.1 44.4 -48.5 -57.1 19.8 8.9 30.5 579 274 B A H X S+ 0 0 60 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.871 115.6 50.0 -58.4 -37.9 20.1 5.2 31.3 580 275 B A H X S+ 0 0 7 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.918 111.6 46.3 -70.7 -40.4 16.7 4.5 29.5 581 276 B V H X S+ 0 0 0 -4,-3.2 4,-2.0 2,-0.2 -2,-0.2 0.931 113.6 50.0 -67.8 -45.0 17.7 6.5 26.4 582 277 B I H X S+ 0 0 28 -4,-2.8 4,-2.3 -5,-0.3 -2,-0.2 0.932 112.3 48.0 -54.8 -51.2 21.1 4.6 26.3 583 278 B Q H X S+ 0 0 81 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.941 110.1 50.8 -63.0 -46.5 19.4 1.2 26.7 584 279 B A H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.886 109.5 51.3 -52.6 -39.9 16.9 2.0 24.0 585 280 B A H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.5 0.942 111.7 47.6 -64.5 -45.4 19.7 3.0 21.6 586 281 B K H X S+ 0 0 81 -4,-2.3 4,-2.7 3,-0.2 -2,-0.2 0.935 111.2 51.8 -60.9 -45.2 21.6 -0.3 22.4 587 282 B D H < S+ 0 0 77 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.924 120.1 33.2 -55.2 -47.3 18.3 -2.3 21.8 588 283 B Q H < S+ 0 0 68 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.777 137.6 17.3 -84.0 -25.9 17.7 -0.8 18.5 589 284 B Y H < S- 0 0 90 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.557 111.5 -86.1-125.4 -15.5 21.3 -0.2 17.2 590 285 B G >< - 0 0 29 -4,-2.7 3,-1.9 -5,-0.5 6,-0.3 -0.043 38.3 -85.9 111.9 142.0 23.7 -2.4 19.2 591 286 B A T 3 S+ 0 0 62 1,-0.3 -1,-0.1 -5,-0.2 -5,-0.1 0.794 128.4 31.6 -44.3 -37.5 25.7 -2.1 22.5 592 287 B N T 3 S+ 0 0 155 -6,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.140 91.7 133.4-110.4 14.9 28.5 -0.3 20.7 593 288 B S <> - 0 0 18 -3,-1.9 4,-2.0 1,-0.1 5,-0.1 -0.081 69.5-114.3 -69.9 164.3 26.7 1.5 18.0 594 289 B A H > S+ 0 0 71 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.882 119.4 54.4 -60.0 -37.5 27.1 5.1 16.9 595 290 B E H > S+ 0 0 47 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.888 106.5 50.0 -65.8 -39.4 23.5 5.7 18.2 596 291 B A H > S+ 0 0 6 -6,-0.3 4,-2.0 -11,-0.2 -1,-0.2 0.918 113.1 46.5 -70.0 -38.5 24.4 4.3 21.6 597 292 B T H X S+ 0 0 79 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.917 112.9 49.3 -64.1 -44.8 27.5 6.6 21.9 598 293 B A H X S+ 0 0 5 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.896 108.3 55.0 -64.2 -40.9 25.5 9.7 20.7 599 294 B A H X S+ 0 0 0 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.2 0.958 111.9 42.6 -54.4 -51.0 22.8 8.8 23.3 600 295 B A H >X S+ 0 0 22 -4,-2.0 4,-2.5 1,-0.2 3,-0.5 0.937 115.2 49.5 -61.8 -44.3 25.4 8.8 26.1 601 296 B K H 3X S+ 0 0 80 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.835 101.7 62.2 -65.3 -34.7 27.1 11.9 24.8 602 297 B S H 3X S+ 0 0 0 -4,-2.7 4,-1.1 1,-0.2 -1,-0.2 0.856 110.8 40.2 -59.1 -38.8 23.9 13.9 24.5 603 298 B F H S+ 0 0 0 -4,-1.1 5,-2.4 -3,-0.5 4,-0.8 0.849 111.1 56.0 -77.8 -42.2 23.4 13.6 28.2 604 299 B D H ><5S+ 0 0 53 -4,-2.5 3,-1.0 3,-0.2 -2,-0.2 0.933 107.2 53.1 -47.8 -45.3 27.1 14.2 29.0 605 300 B A H 3<5S+ 0 0 0 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.889 110.2 44.7 -64.5 -36.2 26.6 17.4 27.0 606 301 B V H 3<5S- 0 0 0 -4,-1.1 -96,-3.9 -5,-0.1 -1,-0.2 0.450 118.2-110.3 -90.7 3.8 23.6 18.6 29.2 607 302 B G T <<5S+ 0 0 16 -3,-1.0 2,-0.7 -4,-0.8 -3,-0.2 0.758 73.3 136.7 82.3 20.7 25.4 17.6 32.5 608 303 B V < 0 0 3 -5,-2.4 -1,-0.3 1,-0.1 -2,-0.1 -0.926 360.0 360.0-100.3 112.1 23.1 14.6 33.3 609 304 B N 0 0 141 -2,-0.7 -1,-0.1 -3,-0.1 -5,-0.1 0.655 360.0 360.0-105.0 360.0 25.4 11.8 34.4 610 !* 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 0.0 611 405 A T 0 0 5 0, 0.0 -504,-0.1 0, 0.0 -506,-0.1 0.000 360.0 360.0 360.0 -29.1 -1.3 22.0 49.8 612 406 A K 0 0 99 -506,-0.4 -506,-0.1 -508,-0.1 -422,-0.0 -0.864 360.0 360.0-129.5 360.0 -0.8 25.2 47.6 613 !* 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 0.0 614 405 B T 0 0 6 0, 0.0 -202,-0.1 0, 0.0 -204,-0.1 0.000 360.0 360.0 360.0 -28.7 0.9 23.2 27.2 615 406 B K 0 0 85 -204,-0.3 -204,-0.1 -206,-0.1 -120,-0.0 -0.837 360.0 360.0-132.0 360.0 2.3 25.9 29.7