==== 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 HYDROLASE 20-APR-10 3MMZ . COMPND 2 MOLECULE: PUTATIVE HAD FAMILY HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES AVERMITILIS; . AUTHOR V.N.MALASHKEVICH,U.A.RAMAGOPAL,R.TORO,J.M.SAUDER,S.K.BURLEY, . 662 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28349.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 432 65.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 87 13.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 3.8 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 . 5 0.8 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 . 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 . 17 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 181 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.9 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 8 0 1 2 5 0 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 5 3 12 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 . 1 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 0 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 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 2 A S > 0 0 147 0, 0.0 3,-2.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 131.5 17.2 -33.2 -0.2 2 3 A L T 3 + 0 0 73 1,-0.3 625,-0.1 625,-0.0 603,-0.1 -0.298 360.0 8.0 -56.0 130.9 13.5 -33.2 0.4 3 4 A G T 3 S+ 0 0 9 1,-0.2 -1,-0.3 623,-0.1 623,-0.2 0.365 87.3 157.9 80.0 -4.6 12.5 -31.4 3.6 4 5 A A < - 0 0 38 -3,-2.0 -1,-0.2 1,-0.1 3,-0.1 -0.209 43.8-118.8 -54.4 139.4 16.1 -30.1 4.3 5 6 A L - 0 0 51 1,-0.1 -1,-0.1 134,-0.0 134,-0.1 -0.486 38.7 -96.2 -72.3 149.6 16.2 -27.1 6.6 6 7 A P - 0 0 1 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.383 40.6-164.3 -67.8 148.7 17.7 -24.0 5.0 7 8 A T >> - 0 0 60 -3,-0.1 3,-1.5 -2,-0.1 4,-0.6 -0.731 39.6 -92.8-119.4 176.0 21.4 -23.1 5.6 8 9 A A G >4 S+ 0 0 56 149,-0.8 3,-1.0 1,-0.3 149,-0.1 0.872 123.7 59.6 -55.9 -40.0 23.4 -20.0 5.0 9 10 A E G 34 S+ 0 0 165 1,-0.2 -1,-0.3 148,-0.1 148,-0.0 0.661 101.9 55.4 -61.8 -21.1 24.4 -21.2 1.5 10 11 A D G <4 S+ 0 0 52 -3,-1.5 2,-0.4 1,-0.1 -1,-0.2 0.657 102.3 54.6 -88.8 -20.7 20.7 -21.3 0.5 11 12 A I << + 0 0 3 -3,-1.0 93,-0.2 -4,-0.6 3,-0.1 -0.925 34.8 175.3-131.7 145.0 19.5 -17.8 1.2 12 13 A D S S+ 0 0 65 91,-3.0 44,-2.1 -2,-0.4 2,-0.3 0.489 78.8 32.6-111.8 -13.6 20.2 -14.2 0.5 13 14 A A E -ab 56 104A 0 90,-1.3 92,-2.6 42,-0.2 2,-0.4 -0.995 54.7-156.9-150.1 147.9 17.3 -12.6 2.2 14 15 A V E -ab 57 105A 1 42,-2.1 44,-1.4 -2,-0.3 2,-0.4 -0.993 15.3-172.9-128.5 120.8 15.0 -13.1 5.2 15 16 A V E -ab 58 106A 0 90,-3.1 92,-2.3 -2,-0.4 2,-0.5 -0.964 10.0-155.9-119.2 132.2 11.5 -11.4 5.1 16 17 A L E -ab 59 107A 0 42,-2.9 44,-2.5 -2,-0.4 92,-0.1 -0.925 14.5-146.0-119.7 128.7 9.3 -11.5 8.1 17 18 A D - 0 0 9 90,-2.1 44,-0.1 -2,-0.5 3,-0.1 -0.369 22.3-151.8 -64.7 162.2 5.6 -11.2 8.7 18 19 A F >>> + 0 0 0 42,-0.5 4,-3.1 1,-0.2 3,-2.1 0.750 65.8 57.0-105.8 -81.4 4.9 -9.4 12.0 19 20 A D T 345S+ 0 0 29 1,-0.3 -1,-0.2 2,-0.2 90,-0.2 -0.317 123.2 8.0 -61.5 129.2 1.7 -10.3 13.9 20 21 A G T 345S+ 0 0 2 6,-0.1 125,-0.3 1,-0.1 -1,-0.3 0.274 130.8 58.4 87.4 -12.0 1.5 -14.0 14.7 21 22 A T T <45S+ 0 0 0 -3,-2.1 125,-0.9 124,-0.1 128,-0.3 0.750 122.5 17.9-115.1 -51.5 5.0 -14.5 13.5 22 23 A Q T <5S+ 0 0 1 -4,-3.1 18,-0.4 123,-0.2 2,-0.3 0.341 137.6 39.2 -96.0 -2.1 7.1 -12.2 15.7 23 24 A T S - 0 0 59 4,-1.6 3,-1.6 -2,-0.3 6,-0.0 -0.549 43.5 -89.2-107.4-179.2 -7.2 0.9 24.9 31 32 A S T 3 S+ 0 0 121 1,-0.3 -2,-0.0 -2,-0.2 -1,-0.0 0.693 126.7 51.6 -64.6 -21.6 -10.4 3.0 24.6 32 33 A D T 3 S- 0 0 142 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.456 121.5-105.7 -92.5 -3.2 -8.9 5.3 22.0 33 34 A G < + 0 0 50 -3,-1.6 2,-0.1 1,-0.3 -2,-0.1 0.592 63.9 158.4 87.2 11.4 -7.8 2.3 19.9 34 35 A R - 0 0 88 1,-0.0 -4,-1.6 323,-0.0 2,-0.3 -0.490 30.4-143.4 -64.8 140.7 -4.1 2.6 20.7 35 36 A E E -F 29 0B 66 -6,-0.2 323,-0.4 -2,-0.1 2,-0.3 -0.836 20.7-177.7-116.1 143.1 -2.4 -0.8 20.1 36 37 A F E -F 28 0B 30 -8,-2.0 -8,-3.0 -2,-0.3 2,-0.3 -0.992 6.8-173.5-135.1 140.7 0.4 -2.6 22.0 37 38 A V E -G 356 0C 4 319,-1.6 319,-2.8 -2,-0.3 2,-0.5 -0.946 22.6-120.6-133.1 158.7 2.0 -5.9 21.1 38 39 A S E -G 355 0C 38 -12,-0.3 -14,-0.4 -2,-0.3 317,-0.2 -0.870 28.0-175.3-101.1 125.3 4.5 -8.3 22.7 39 40 A V E -G 354 0C 1 315,-2.8 315,-2.6 -2,-0.5 2,-0.5 -0.709 23.7-113.6-113.0 170.5 7.8 -9.1 21.0 40 41 A H E > -G 353 0C 21 -18,-0.4 4,-1.7 -2,-0.2 3,-0.3 -0.879 2.2-147.6-116.9 130.1 10.5 -11.6 22.0 41 42 A R H > S+ 0 0 32 311,-3.3 4,-2.0 -2,-0.5 5,-0.1 0.815 101.8 58.4 -60.4 -35.3 14.1 -10.7 23.0 42 43 A G H > S+ 0 0 1 310,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.882 104.5 50.9 -61.5 -41.1 15.3 -14.0 21.5 43 44 A D H > S+ 0 0 1 -3,-0.3 4,-3.0 2,-0.2 5,-0.2 0.907 107.4 54.6 -60.0 -42.7 13.9 -13.0 18.2 44 45 A G H X S+ 0 0 15 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.903 110.1 45.7 -56.4 -43.7 15.8 -9.7 18.6 45 46 A L H X S+ 0 0 77 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.912 114.3 48.0 -64.9 -44.7 19.0 -11.6 19.1 46 47 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.899 112.3 48.7 -65.3 -42.0 18.4 -13.9 16.2 47 48 A I H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 -1,-0.2 0.903 110.2 51.1 -65.1 -43.3 17.5 -11.0 13.9 48 49 A A H X S+ 0 0 36 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.893 110.6 49.9 -60.9 -40.5 20.6 -9.0 14.9 49 50 A A H X S+ 0 0 16 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.897 112.2 46.6 -65.3 -42.3 22.7 -12.1 14.1 50 51 A L H <>S+ 0 0 0 -4,-2.1 5,-1.4 2,-0.2 4,-0.2 0.929 114.7 47.2 -65.4 -44.4 21.1 -12.6 10.7 51 52 A R H ><5S+ 0 0 92 -4,-2.8 3,-1.9 1,-0.2 -2,-0.2 0.932 111.0 51.6 -60.9 -47.2 21.5 -8.9 9.9 52 53 A K H 3<5S+ 0 0 167 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.800 101.3 62.8 -58.6 -33.3 25.2 -8.9 11.1 53 54 A S T 3<5S- 0 0 53 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.497 121.6-107.0 -73.7 -5.6 25.8 -11.9 8.8 54 55 A G T < 5 + 0 0 62 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.416 67.6 148.1 98.1 -0.6 25.0 -9.7 5.8 55 56 A L < - 0 0 21 -5,-1.4 2,-0.5 1,-0.1 -1,-0.3 -0.392 53.3-115.6 -64.9 141.2 21.5 -11.0 4.8 56 57 A T E -a 13 0A 46 -44,-2.1 -42,-2.1 -2,-0.1 2,-0.3 -0.730 41.0-162.6 -80.2 127.4 19.1 -8.5 3.4 57 58 A X E +a 14 0A 8 -2,-0.5 2,-0.3 -44,-0.2 -42,-0.2 -0.782 17.8 168.3-117.6 155.9 16.2 -8.2 5.8 58 59 A L E -a 15 0A 2 -44,-1.4 -42,-2.9 -2,-0.3 2,-0.4 -0.956 23.8-145.9-161.4 140.6 12.6 -6.8 5.6 59 60 A I E -ac 16 79A 0 19,-2.0 21,-2.7 -2,-0.3 2,-0.4 -0.935 22.2-162.7-104.0 137.9 9.4 -6.8 7.7 60 61 A L E + c 0 80A 0 -44,-2.5 -42,-0.5 -2,-0.4 2,-0.3 -0.983 15.8 164.1-122.7 130.3 6.2 -6.9 5.6 61 62 A S E - c 0 81A 8 19,-2.4 21,-0.7 -2,-0.4 22,-0.4 -0.983 31.2-145.3-145.8 135.2 2.7 -6.0 6.9 62 63 A T S S+ 0 0 60 -2,-0.3 21,-2.1 19,-0.2 20,-0.6 0.965 81.8 60.7 -60.9 -58.1 -0.5 -5.2 5.0 63 64 A E S S- 0 0 105 19,-0.2 2,-0.6 18,-0.2 19,-0.3 -0.395 95.7-104.1 -74.2 146.8 -1.9 -2.6 7.4 64 65 A Q + 0 0 122 17,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 -0.606 51.2 176.9 -61.6 113.0 -0.3 0.7 8.3 65 66 A N >> - 0 0 1 -2,-0.6 4,-1.3 1,-0.1 3,-0.5 -0.891 25.7-167.9-133.9 100.8 0.9 -0.3 11.8 66 67 A P H 3> S+ 0 0 65 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.768 89.5 61.4 -62.5 -23.6 3.0 2.3 13.7 67 68 A V H 3> S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.917 101.3 52.2 -67.9 -40.6 3.9 -0.4 16.2 68 69 A V H <> S+ 0 0 0 -3,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.880 107.5 52.6 -60.7 -36.9 5.6 -2.5 13.5 69 70 A A H X S+ 0 0 35 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.877 106.8 52.5 -68.5 -37.3 7.7 0.5 12.5 70 71 A A H X S+ 0 0 11 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.922 112.1 45.9 -60.8 -45.2 8.8 1.0 16.1 71 72 A R H X S+ 0 0 10 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.915 110.3 53.5 -63.7 -45.6 10.0 -2.6 16.2 72 73 A A H X>S+ 0 0 2 -4,-2.6 5,-1.9 1,-0.2 4,-0.8 0.897 107.1 51.6 -57.5 -41.7 11.7 -2.4 12.8 73 74 A R H ><5S+ 0 0 177 -4,-2.1 3,-0.9 2,-0.2 -1,-0.2 0.929 109.5 49.7 -61.6 -46.0 13.7 0.7 14.0 74 75 A K H 3<5S+ 0 0 93 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.912 113.8 45.7 -57.7 -43.7 14.8 -1.2 17.1 75 76 A L H 3<5S- 0 0 12 -4,-2.4 -1,-0.2 2,-0.1 -2,-0.2 0.531 106.5-129.6 -76.9 -9.0 15.9 -4.2 15.0 76 77 A K T <<5 + 0 0 146 -3,-0.9 -3,-0.2 -4,-0.8 -4,-0.1 0.835 68.6 119.4 59.6 36.6 17.6 -1.8 12.4 77 78 A I < - 0 0 9 -5,-1.9 -1,-0.2 -6,-0.1 -2,-0.1 -0.943 66.5-105.0-128.0 149.9 15.8 -3.5 9.5 78 79 A P - 0 0 75 0, 0.0 -19,-2.0 0, 0.0 2,-0.4 -0.321 29.3-154.6 -74.7 160.6 13.4 -1.9 7.0 79 80 A V E -c 59 0A 31 -21,-0.2 2,-0.5 2,-0.1 -19,-0.2 -0.995 10.3-159.9-132.2 139.7 9.7 -2.3 7.0 80 81 A L E +c 60 0A 65 -21,-2.7 -19,-2.4 -2,-0.4 2,-0.3 -0.982 31.4 153.0-114.2 116.6 7.0 -2.1 4.3 81 82 A H E +c 61 0A 37 -2,-0.5 -17,-0.3 -21,-0.2 -19,-0.2 -0.956 44.7 50.1-140.7 158.8 3.6 -1.5 5.8 82 83 A G S S+ 0 0 45 -21,-0.7 2,-0.3 -20,-0.6 -19,-0.2 0.950 78.9 148.2 74.3 54.1 0.4 0.1 4.5 83 84 A I - 0 0 36 -21,-2.1 -1,-0.2 -22,-0.4 3,-0.2 -0.928 54.6-135.8-128.0 144.8 0.5 -1.8 1.3 84 85 A D S S+ 0 0 155 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.925 94.1 14.0 -65.8 -46.4 -2.3 -3.1 -1.0 85 86 A R > - 0 0 126 1,-0.1 4,-2.1 -23,-0.0 -1,-0.3 -0.946 59.5-155.6-140.0 114.7 -0.7 -6.6 -1.6 86 87 A K H > S+ 0 0 10 -2,-0.4 4,-2.3 1,-0.2 -1,-0.1 0.879 96.7 52.0 -50.4 -46.1 2.1 -8.1 0.4 87 88 A D H > S+ 0 0 16 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.867 109.5 47.2 -67.1 -40.0 3.2 -10.4 -2.4 88 89 A L H > S+ 0 0 84 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.864 112.3 50.2 -69.0 -36.3 3.4 -7.7 -5.0 89 90 A A H X S+ 0 0 21 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.898 112.4 48.4 -65.8 -40.5 5.4 -5.5 -2.7 90 91 A L H X S+ 0 0 1 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.931 109.4 51.6 -64.0 -48.1 7.7 -8.4 -2.0 91 92 A K H X S+ 0 0 90 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.911 113.2 45.4 -55.3 -46.0 8.1 -9.2 -5.8 92 93 A Q H X S+ 0 0 95 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.900 111.3 52.8 -64.5 -43.3 9.1 -5.5 -6.4 93 94 A W H X S+ 0 0 17 -4,-2.3 4,-2.1 2,-0.2 6,-0.2 0.883 110.8 46.8 -60.1 -42.4 11.4 -5.5 -3.4 94 95 A C H X>S+ 0 0 2 -4,-2.6 5,-1.7 2,-0.2 4,-1.2 0.931 109.0 54.1 -64.3 -47.8 13.3 -8.6 -4.7 95 96 A E H <5S+ 0 0 114 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.861 113.3 44.6 -56.1 -37.0 13.5 -7.3 -8.2 96 97 A E H <5S+ 0 0 127 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.847 109.6 51.8 -76.2 -39.5 15.2 -4.1 -6.8 97 98 A Q H <5S- 0 0 87 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.659 109.2-123.7 -69.3 -14.6 17.5 -5.9 -4.3 98 99 A G T <5 + 0 0 69 -4,-1.2 2,-0.4 1,-0.3 -3,-0.2 0.613 63.1 148.1 75.9 18.2 18.7 -8.0 -7.3 99 100 A I < - 0 0 19 -5,-1.7 -1,-0.3 -6,-0.2 -2,-0.1 -0.698 52.2-125.0 -97.1 131.5 17.7 -11.0 -5.2 100 101 A A > - 0 0 40 -2,-0.4 3,-2.1 1,-0.2 -88,-0.2 -0.570 15.6-139.7 -67.3 125.5 16.4 -14.3 -6.7 101 102 A P G > S+ 0 0 34 0, 0.0 20,-2.8 0, 0.0 3,-1.8 0.801 101.9 68.9 -59.9 -25.0 13.1 -15.1 -5.0 102 103 A E G 3 S+ 0 0 127 1,-0.3 18,-0.1 18,-0.3 -2,-0.0 0.729 100.8 47.5 -61.8 -21.4 14.3 -18.7 -4.9 103 104 A R G < S+ 0 0 81 -3,-2.1 -91,-3.0 18,-0.1 -90,-1.3 0.051 91.3 105.2-110.6 21.7 16.9 -17.6 -2.4 104 105 A V E < -b 13 0A 0 -3,-1.8 18,-2.2 -93,-0.2 2,-0.5 -0.905 56.1-154.7-104.0 130.8 14.4 -15.7 -0.2 105 106 A L E -bd 14 122A 0 -92,-2.6 -90,-3.1 -2,-0.5 2,-0.4 -0.917 14.4-173.5-100.2 123.3 13.2 -17.0 3.1 106 107 A Y E -bd 15 123A 0 16,-1.5 18,-3.0 -2,-0.5 2,-0.4 -0.988 8.8-154.6-120.6 130.1 9.8 -15.7 4.1 107 108 A V E +bd 16 124A 1 -92,-2.3 -90,-2.1 -2,-0.4 2,-0.3 -0.885 26.4 151.6-109.2 130.1 8.2 -16.4 7.6 108 109 A G E - d 0 125A 0 16,-2.4 18,-1.8 -2,-0.4 21,-0.1 -0.865 34.0-161.3-148.6 177.1 4.5 -16.4 8.1 109 110 A N + 0 0 6 -2,-0.3 21,-2.0 16,-0.2 2,-0.2 0.491 66.2 43.8-140.0 -17.5 1.6 -17.8 10.1 110 111 A D S > S- 0 0 44 19,-0.2 3,-2.4 23,-0.1 4,-0.2 -0.802 87.3 -88.9-139.6 177.1 -1.8 -17.3 8.3 111 112 A V G > S+ 0 0 79 1,-0.3 3,-1.5 -2,-0.2 -1,-0.0 0.736 115.1 68.8 -65.8 -22.9 -3.6 -17.5 5.0 112 113 A N G 3 S+ 0 0 88 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.539 95.5 59.2 -70.1 -5.3 -2.7 -13.9 4.0 113 114 A D G <> S+ 0 0 0 -3,-2.4 4,-2.6 1,-0.1 -1,-0.3 0.513 79.3 90.2 -93.9 -9.4 0.9 -15.1 3.7 114 115 A L H <> S+ 0 0 29 -3,-1.5 4,-2.3 -4,-0.2 5,-0.2 0.875 82.3 52.8 -62.1 -39.8 0.1 -17.8 1.1 115 116 A P H > S+ 0 0 61 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.910 112.5 47.3 -61.5 -37.6 0.7 -15.5 -1.9 116 117 A C H > S+ 0 0 0 -4,-0.2 4,-1.6 1,-0.2 3,-0.4 0.910 108.8 54.3 -64.0 -44.3 4.1 -14.7 -0.5 117 118 A F H < S+ 0 0 4 -4,-2.6 -1,-0.2 1,-0.2 -3,-0.2 0.898 107.0 51.7 -54.3 -42.9 4.8 -18.3 0.2 118 119 A A H < S+ 0 0 71 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.791 109.4 50.9 -65.8 -28.4 4.1 -19.1 -3.5 119 120 A L H < S+ 0 0 56 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.833 102.7 65.5 -77.9 -35.6 6.5 -16.4 -4.7 120 121 A V S < S- 0 0 13 -4,-1.6 -18,-0.3 -3,-0.1 -15,-0.1 -0.503 71.4-133.5 -99.9 159.5 9.6 -17.4 -2.6 121 122 A G S S+ 0 0 18 -20,-2.8 -19,-0.2 -17,-0.2 -16,-0.2 0.820 100.4 39.2 -74.3 -32.5 11.9 -20.4 -2.5 122 123 A W E +d 105 0A 11 -18,-2.2 -16,-1.5 -21,-0.4 2,-0.3 -0.589 68.2 176.4-125.2 68.7 11.9 -20.9 1.3 123 124 A P E -d 106 0A 11 0, 0.0 15,-3.1 0, 0.0 16,-1.2 -0.591 13.8-166.1 -71.7 133.2 8.5 -20.3 2.8 124 125 A V E -de 107 139A 0 -18,-3.0 -16,-2.4 -2,-0.3 2,-0.4 -0.992 8.2-155.1-127.6 126.7 8.6 -21.0 6.6 125 126 A A E -de 108 140A 0 14,-2.2 16,-2.5 -2,-0.4 -16,-0.2 -0.832 18.8-126.7 -96.3 139.1 5.6 -21.4 8.9 126 127 A V > - 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0 0 23 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.735 45.0-123.5 -85.4 132.4 38.6 -47.0 29.2 264 101 B A > - 0 0 39 -2,-0.4 3,-2.0 1,-0.1 -88,-0.2 -0.636 12.4-141.3 -73.1 124.3 39.3 -43.6 30.6 265 102 B P G > S+ 0 0 41 0, 0.0 20,-2.7 0, 0.0 3,-1.6 0.767 98.9 69.7 -60.1 -23.6 36.2 -42.4 32.6 266 103 B E G 3 S+ 0 0 122 18,-0.3 18,-0.1 1,-0.3 -2,-0.0 0.709 99.2 49.0 -63.1 -22.3 36.9 -38.9 31.2 267 104 B R G < S+ 0 0 84 -3,-2.0 -91,-3.2 18,-0.1 -90,-1.3 0.123 90.6 104.9-107.3 19.7 35.8 -40.2 27.8 268 105 B V E < -j 177 0D 0 -3,-1.6 18,-2.3 -93,-0.2 2,-0.6 -0.884 56.0-155.0-101.6 129.3 32.6 -41.9 29.0 269 106 B L E -jl 178 286D 0 -92,-2.5 -90,-3.0 -2,-0.5 2,-0.4 -0.922 15.8-173.6 -98.6 123.9 29.2 -40.3 28.3 270 107 B Y E -jl 179 287D 0 16,-1.6 18,-3.2 -2,-0.6 2,-0.5 -0.982 8.6-156.4-122.8 129.8 26.7 -41.5 30.9 271 108 B V E +jl 180 288D 0 -92,-2.3 -90,-2.2 -2,-0.4 2,-0.3 -0.908 25.6 151.3-110.8 126.5 22.9 -40.7 30.7 272 109 B G E - l 0 289D 0 16,-2.4 18,-1.7 -2,-0.5 21,-0.1 -0.851 34.0-162.6-145.6-179.7 20.7 -40.6 33.8 273 110 B N + 0 0 6 -2,-0.3 21,-2.2 16,-0.2 2,-0.2 0.493 66.1 46.8-142.1 -17.1 17.6 -39.2 35.5 274 111 B D S > S- 0 0 47 19,-0.2 3,-2.4 23,-0.1 4,-0.3 -0.797 87.9 -88.4-136.4 177.3 17.6 -39.7 39.3 275 112 B V G > S+ 0 0 82 1,-0.3 3,-1.2 -2,-0.2 55,-0.1 0.726 116.6 65.6 -65.1 -23.8 19.7 -39.5 42.4 276 113 B N G 3 S+ 0 0 73 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.511 97.8 59.2 -74.6 -3.4 21.1 -43.0 42.1 277 114 B D G <> S+ 0 0 0 -3,-2.4 4,-2.5 2,-0.1 3,-0.3 0.564 82.8 84.1 -91.2 -15.2 22.8 -41.7 38.9 278 115 B L H <> S+ 0 0 19 -3,-1.2 4,-1.9 -4,-0.3 5,-0.2 0.902 86.6 51.0 -61.6 -44.3 24.7 -39.0 40.8 279 116 B P H > S+ 0 0 55 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.851 112.3 49.0 -62.7 -30.0 27.7 -41.2 41.9 280 117 B C H >> S+ 0 0 0 -3,-0.3 4,-1.4 -4,-0.2 3,-0.6 0.903 106.6 56.1 -67.6 -44.2 28.0 -42.3 38.2 281 118 B F H 3< S+ 0 0 5 -4,-2.5 3,-0.2 1,-0.2 -1,-0.2 0.872 105.6 52.1 -51.0 -42.0 27.9 -38.7 37.1 282 119 B A H 3< S+ 0 0 74 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.778 107.0 53.6 -70.7 -27.0 30.9 -37.9 39.3 283 120 B L H << S+ 0 0 57 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.826 102.9 65.1 -75.3 -31.9 32.9 -40.8 37.9 284 121 B V S < S- 0 0 14 -4,-1.4 -18,-0.3 -3,-0.2 -15,-0.1 -0.533 71.9-132.5-105.9 160.6 32.6 -39.8 34.2 285 122 B G S S+ 0 0 15 -20,-2.7 -19,-0.2 -17,-0.2 -16,-0.2 0.853 100.8 38.3 -71.4 -35.8 33.7 -37.0 31.9 286 123 B W E +l 269 0D 14 -18,-2.3 -16,-1.6 -21,-0.4 2,-0.3 -0.588 67.4 177.4-126.0 70.2 30.3 -36.5 30.2 287 124 B P E -l 270 0D 13 0, 0.0 15,-3.0 0, 0.0 16,-1.3 -0.579 12.2-169.5 -70.4 129.8 27.3 -36.8 32.6 288 125 B V E -lm 271 303D 0 -18,-3.2 -16,-2.4 -2,-0.3 2,-0.4 -0.985 8.1-157.2-124.5 129.8 24.1 -36.1 30.7 289 126 B A E -lm 272 304D 0 14,-2.3 16,-2.6 -2,-0.4 -16,-0.2 -0.871 19.8-124.3-103.1 140.7 20.6 -35.7 32.2 290 127 B V > - 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0 0 21 -4,-1.7 3,-2.0 -5,-0.3 -1,-0.3 -0.216 49.8 -51.6 91.1 172.9 -16.1 -33.9 6.5 651 161 D P T 3 5S+ 0 0 123 0, 0.0 -1,-0.2 0, 0.0 -5,-0.1 0.735 136.2 47.6 -60.3 -27.0 -16.8 -33.6 10.2 652 162 D S T > 5S- 0 0 41 -3,-0.3 3,-1.7 4,-0.2 -2,-0.1 0.423 107.1-122.2 -94.1 4.9 -19.4 -36.5 10.3 653 163 D L T < 5 - 0 0 12 -3,-2.0 -3,-0.2 1,-0.3 -7,-0.1 0.765 63.7 -71.3 60.0 27.2 -17.0 -38.9 8.3 654 164 D D T 3 - 0 0 81 4,-2.2 3,-2.1 -2,-0.3 6,-0.1 -0.270 44.4 -84.7 -81.8 176.3 -25.9 -36.0 5.8 658 168 D K T 3 S+ 0 0 222 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.924 130.4 51.4 -42.8 -58.8 -26.4 -32.3 6.3 659 169 D E T 3 S- 0 0 159 1,-0.1 -1,-0.3 2,-0.0 -2,-0.0 0.449 122.6-108.0 -67.0 0.4 -29.8 -32.7 7.8 660 170 D G < + 0 0 41 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.762 70.0 140.5 80.2 29.1 -28.3 -35.3 10.2 661 171 D H - 0 0 101 1,-0.1 -4,-2.2 0, 0.0 -1,-0.3 -0.781 60.7 -87.8-103.3 150.8 -29.7 -38.5 8.9 662 172 D H B -A 656 0H 148 -2,-0.3 2,-0.6 -6,-0.2 -6,-0.3 -0.280 36.2-137.3 -58.8 126.7 -27.9 -41.9 8.6 663 173 D H - 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