==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 29-MAY-13 4KYV . COMPND 2 MOLECULE: DEHALOGENASE HALOTAG2; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; . AUTHOR A.KUZIN,S.LEW,J.SEETHARAMAN,M.MAGLAQUI,R.XIAO,E.KOHAN,H.WANG . 597 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24371.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 407 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 4.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 1 0.2 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 . 35 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 15.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 169 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.7 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 7 1 2 1 1 1 3 2 1 1 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 0 4 0 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 PARALLEL BRIDGES PER LADDER . 2 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 0 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 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 4 A H 0 0 230 0, 0.0 2,-0.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -36.5 35.6 -11.6 13.1 2 5 A H - 0 0 80 2,-0.0 2,-0.3 181,-0.0 181,-0.2 -0.823 360.0-160.3-100.0 106.4 34.3 -8.2 14.3 3 6 A H - 0 0 140 -2,-0.8 2,-0.3 179,-0.3 0, 0.0 -0.613 8.7-174.8 -88.5 142.3 37.1 -5.7 14.6 4 7 A H 0 0 119 -2,-0.3 -2,-0.0 179,-0.2 179,-0.0 -0.918 360.0 360.0-144.5 113.1 36.8 -2.5 16.7 5 8 A H 0 0 195 -2,-0.3 -2,-0.0 0, 0.0 178,-0.0 0.792 360.0 360.0 43.8 360.0 39.2 0.4 17.1 6 ! 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 7 14 A E 0 0 226 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 100.3 32.7 7.3 17.5 8 15 A I - 0 0 46 272,-0.0 272,-0.0 275,-0.0 46,-0.0 -0.887 360.0-118.5-102.3 120.6 29.5 6.2 15.8 9 16 A G - 0 0 33 -2,-0.6 45,-0.1 1,-0.1 44,-0.1 -0.240 25.3-173.2 -62.3 141.7 26.5 7.8 17.4 10 17 A T + 0 0 51 43,-0.1 -1,-0.1 44,-0.0 182,-0.1 0.509 55.4 97.6-109.5 -11.0 23.9 5.6 19.0 11 18 A G - 0 0 40 2,-0.0 -2,-0.0 1,-0.0 178,-0.0 -0.317 61.5-147.7 -76.5 163.3 21.3 8.3 19.7 12 19 A F + 0 0 44 -2,-0.1 2,-1.7 2,-0.0 38,-0.0 -0.724 19.8 178.0-130.1 80.0 18.3 9.0 17.6 13 20 A P + 0 0 108 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.369 37.2 116.0 -88.3 59.1 17.8 12.8 18.0 14 21 A F - 0 0 25 -2,-1.7 17,-0.1 17,-0.0 3,-0.0 -0.990 65.6-121.4-128.3 132.7 14.8 13.3 15.7 15 22 A D - 0 0 78 -2,-0.4 15,-0.4 15,-0.1 2,-0.1 -0.503 38.8-107.4 -67.9 139.9 11.3 14.4 16.6 16 23 A P - 0 0 18 0, 0.0 2,-0.4 0, 0.0 13,-0.1 -0.434 35.0-171.3 -69.8 138.4 8.7 11.9 15.6 17 24 A H E -A 28 0A 40 11,-0.9 11,-2.2 -2,-0.1 2,-0.4 -0.987 2.4-165.3-125.4 143.7 6.4 12.7 12.7 18 25 A Y E -A 27 0A 71 -2,-0.4 2,-0.4 9,-0.2 9,-0.2 -0.979 6.0-173.4-129.3 142.0 3.4 10.6 11.8 19 26 A V E -A 26 0A 25 7,-2.1 7,-2.4 -2,-0.4 2,-0.6 -1.000 27.7-121.8-134.7 137.3 1.2 10.6 8.6 20 27 A E E +A 25 0A 120 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.675 37.9 172.7 -78.2 119.1 -2.0 8.7 8.0 21 28 A V E > -A 24 0A 3 3,-3.4 3,-1.8 -2,-0.6 74,-0.1 -0.988 65.5 -20.7-135.2 118.6 -1.5 6.5 5.0 22 29 A L T 3 S- 0 0 89 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.896 128.1 -49.5 47.5 47.0 -4.1 3.9 3.8 23 30 A G T 3 S+ 0 0 59 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.547 123.2 95.8 75.1 9.6 -5.7 3.8 7.2 24 31 A E E < S-A 21 0A 45 -3,-1.8 -3,-3.4 53,-0.1 2,-0.5 -0.908 73.8-117.0-131.1 153.9 -2.4 3.3 9.1 25 32 A R E -A 20 0A 74 -2,-0.3 52,-3.2 -5,-0.2 2,-0.4 -0.813 26.2-165.4 -92.2 130.6 0.1 5.6 10.8 26 33 A X E -A 19 0A 1 -7,-2.4 -7,-2.1 -2,-0.5 2,-0.3 -0.960 11.1-141.5-114.0 134.3 3.6 5.8 9.3 27 34 A H E +A 18 0A 3 -2,-0.4 42,-3.0 42,-0.3 2,-0.3 -0.691 26.5 170.3 -91.4 144.4 6.4 7.3 11.3 28 35 A Y E -AB 17 68A 28 -11,-2.2 -11,-0.9 -2,-0.3 2,-0.3 -0.995 34.8-121.1-153.2 150.5 9.1 9.4 9.6 29 36 A V E + B 0 67A 1 38,-2.1 38,-2.0 -2,-0.3 2,-0.3 -0.712 29.9 179.0 -81.5 139.4 12.1 11.7 10.2 30 37 A D E + B 0 66A 13 -15,-0.4 2,-0.2 -2,-0.3 36,-0.2 -0.803 18.9 140.4-145.6 100.9 11.6 15.2 8.8 31 38 A V E + B 0 65A 37 34,-2.0 34,-2.8 -2,-0.3 -17,-0.0 -0.763 33.0 45.7-135.1 179.9 14.4 17.7 9.3 32 39 A G S S+ 0 0 30 32,-0.2 32,-0.2 -2,-0.2 28,-0.1 -0.352 103.0 0.7 77.9-167.3 16.3 20.4 7.5 33 40 A P - 0 0 48 0, 0.0 32,-0.1 0, 0.0 -2,-0.0 -0.124 66.7-130.6 -50.4 149.6 14.6 23.1 5.4 34 41 A R S S+ 0 0 135 30,-0.1 2,-0.2 4,-0.0 -2,-0.0 0.586 84.6 25.4 -85.4 -9.6 10.8 22.9 5.3 35 42 A D S S+ 0 0 126 2,-0.1 29,-0.4 0, 0.0 2,-0.0 -0.786 83.3 64.1-139.5-177.1 10.6 23.2 1.5 36 43 A G S S- 0 0 55 -2,-0.2 27,-0.0 27,-0.1 0, 0.0 -0.163 96.5 -20.7 86.5 174.1 12.6 22.5 -1.6 37 44 A T S S- 0 0 38 67,-0.1 27,-0.5 1,-0.1 2,-0.2 -0.344 71.6-147.1 -55.9 119.4 13.9 19.3 -3.0 38 45 A P - 0 0 6 0, 0.0 67,-2.1 0, 0.0 2,-0.6 -0.578 9.8-129.1 -87.3 156.1 13.9 16.7 -0.2 39 46 A V E -cd 65 105A 0 25,-3.0 27,-2.7 -2,-0.2 2,-0.6 -0.926 25.6-153.5 -98.3 118.8 16.4 13.9 0.2 40 47 A L E -cd 66 106A 0 65,-3.2 67,-2.5 -2,-0.6 2,-0.5 -0.872 5.0-159.2-102.1 113.2 14.3 10.7 0.8 41 48 A F E - d 0 107A 0 25,-2.8 2,-0.6 -2,-0.6 67,-0.2 -0.820 5.8-167.8 -96.7 122.3 16.1 8.0 2.8 42 49 A L E - d 0 108A 2 65,-2.8 67,-1.5 -2,-0.5 70,-0.2 -0.925 3.6-161.0-117.3 112.2 14.7 4.4 2.4 43 50 A H - 0 0 0 -2,-0.6 2,-0.1 25,-0.5 6,-0.1 -0.237 6.1-161.0 -76.1 170.1 15.9 1.7 4.8 44 51 A G > + 0 0 0 67,-0.2 3,-1.2 1,-0.2 66,-0.1 -0.262 41.4 6.8-125.6-141.5 15.6 -2.0 4.1 45 52 A N T 3 S- 0 0 4 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.646 119.4 -6.8 -94.5 150.3 15.6 -5.1 6.2 46 53 A P T 3 S+ 0 0 3 0, 0.0 -1,-0.3 0, 0.0 160,-0.1 -0.528 116.3 79.1 -99.9 49.8 15.7 -5.5 9.2 47 54 A T < - 0 0 1 -3,-1.2 27,-0.3 1,-0.1 2,-0.2 -0.002 51.8-156.6-108.1-160.1 16.2 -1.8 9.9 48 55 A S > - 0 0 11 25,-0.1 3,-2.2 -3,-0.1 4,-0.3 -0.845 59.4 -58.1-161.5-168.8 14.2 1.5 10.1 49 56 A S G > S+ 0 0 2 1,-0.3 3,-1.7 -2,-0.2 4,-0.2 0.736 122.4 80.1 -61.1 -18.4 15.0 5.2 9.8 50 57 A Y G > S+ 0 0 6 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.831 78.9 69.1 -53.5 -31.3 17.4 4.5 12.7 51 58 A L G < S+ 0 0 2 -3,-2.2 3,-0.3 1,-0.3 -1,-0.3 0.804 101.6 44.9 -58.5 -29.7 19.8 3.2 10.0 52 59 A W G X> S+ 0 0 0 -3,-1.7 4,-2.7 -4,-0.3 3,-1.7 0.333 78.5 110.6 -97.5 6.3 20.2 6.7 8.7 53 60 A R T <4 S+ 0 0 3 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.779 84.8 38.4 -59.2 -31.3 20.7 8.5 12.0 54 61 A N T 34 S+ 0 0 30 -3,-0.3 -1,-0.3 -4,-0.3 233,-0.2 0.436 117.6 50.3-100.0 0.1 24.4 9.3 11.5 55 62 A I T X> S+ 0 0 1 -3,-1.7 3,-2.0 2,-0.1 4,-0.5 0.815 97.1 65.0-102.0 -44.3 24.0 10.1 7.8 56 63 A I H >X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.3 3,-1.7 0.830 91.7 63.8 -47.0 -42.5 21.1 12.5 7.9 57 64 A P H 34 S+ 0 0 71 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.705 97.9 56.8 -64.3 -15.3 23.1 15.2 9.9 58 65 A H H <4 S+ 0 0 63 -3,-2.0 -2,-0.2 2,-0.1 4,-0.1 0.687 117.9 32.8 -80.3 -19.9 25.5 15.6 7.0 59 66 A V H XX S+ 0 0 0 -3,-1.7 4,-2.3 -4,-0.5 3,-1.8 0.738 99.4 77.2-108.3 -36.7 22.6 16.5 4.6 60 67 A A T 3< S+ 0 0 19 -4,-3.0 -2,-0.1 1,-0.3 5,-0.1 0.714 83.9 66.7 -54.5 -27.1 20.1 18.3 6.8 61 68 A P T 34 S+ 0 0 105 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.855 118.9 21.6 -62.5 -28.5 22.1 21.5 6.8 62 69 A S T <4 S+ 0 0 64 -3,-1.8 2,-0.3 1,-0.2 -2,-0.2 0.738 125.3 32.6-108.8 -31.0 21.4 21.9 3.1 63 70 A H S < S- 0 0 47 -4,-2.3 -1,-0.2 -27,-0.0 -27,-0.1 -0.956 80.5-100.1-134.2 147.7 18.3 19.9 2.2 64 71 A R - 0 0 37 -27,-0.5 -25,-3.0 -29,-0.4 2,-0.5 -0.415 41.7-151.2 -56.0 137.1 15.0 18.7 3.7 65 72 A C E -Bc 31 39A 0 -34,-2.8 -34,-2.0 -27,-0.2 2,-0.4 -0.984 15.6-177.5-120.2 127.3 15.6 15.1 4.9 66 73 A I E +Bc 30 40A 0 -27,-2.7 -25,-2.8 -2,-0.5 -36,-0.2 -0.985 5.2 173.3-125.8 126.1 12.7 12.6 5.0 67 74 A A E -B 29 0A 0 -38,-2.0 -38,-2.1 -2,-0.4 -18,-0.1 -0.832 13.1-163.3-137.0 97.8 13.1 9.1 6.3 68 75 A P E -B 28 0A 1 0, 0.0 2,-0.6 0, 0.0 -25,-0.5 -0.434 20.8-126.8 -76.8 152.3 10.1 6.9 6.7 69 76 A D - 0 0 2 -42,-3.0 -42,-0.3 -21,-0.1 3,-0.1 -0.910 39.0-116.5 -88.4 122.4 9.8 3.7 8.6 70 77 A L > - 0 0 1 -2,-0.6 3,-2.1 1,-0.1 6,-0.3 -0.184 44.8 -77.7 -56.4 151.8 8.4 1.2 6.2 71 78 A I T 3 S+ 0 0 1 1,-0.3 7,-0.1 17,-0.1 -1,-0.1 -0.242 121.5 16.8 -54.8 136.6 4.9 -0.2 7.1 72 79 A G T 3 S+ 0 0 1 5,-2.4 2,-0.3 1,-0.2 -1,-0.3 0.502 117.0 88.3 77.6 3.9 5.2 -2.9 9.9 73 80 A X S X S- 0 0 0 -3,-2.1 3,-2.1 4,-0.2 -1,-0.2 -0.854 83.4 -4.5-132.1 166.3 8.7 -1.6 10.7 74 81 A G T 3 S- 0 0 9 -27,-0.3 -26,-0.1 -2,-0.3 -3,-0.0 -0.240 126.4 -28.8 51.4-131.6 10.3 1.0 13.0 75 82 A K T 3 S+ 0 0 77 -48,-0.1 -1,-0.3 -4,-0.0 -47,-0.1 0.296 108.7 115.7 -98.3 9.3 7.6 3.1 14.7 76 83 A S S < S- 0 0 6 -3,-2.1 -50,-0.2 -6,-0.3 -6,-0.1 -0.315 76.1 -85.1 -73.6 161.0 5.1 2.6 11.9 77 84 A D - 0 0 43 -52,-3.2 -5,-2.4 1,-0.1 -4,-0.2 -0.153 32.1-132.2 -62.0 163.7 1.8 0.8 12.4 78 85 A K - 0 0 74 -7,-0.1 -1,-0.1 -6,-0.1 -7,-0.0 -0.622 27.1-178.2-123.2 70.1 1.5 -2.9 12.1 79 86 A P - 0 0 15 0, 0.0 2,-1.9 0, 0.0 -55,-0.0 -0.215 43.9 -97.6 -63.1 160.8 -1.5 -3.9 10.0 80 87 A D S S+ 0 0 165 2,-0.0 2,-0.2 3,-0.0 -2,-0.0 -0.554 73.0 142.1 -82.1 76.4 -2.3 -7.6 9.4 81 88 A L - 0 0 31 -2,-1.9 123,-0.0 1,-0.1 0, 0.0 -0.684 64.7-124.1-111.8 167.4 -0.6 -7.9 6.0 82 89 A D - 0 0 96 -2,-0.2 126,-0.1 126,-0.0 -1,-0.1 0.657 43.7-139.2 -79.0 -18.9 1.5 -10.6 4.3 83 90 A Y + 0 0 11 1,-0.1 2,-0.0 125,-0.1 -2,-0.0 0.833 38.6 165.7 60.9 36.0 4.2 -7.9 3.9 84 91 A F >> - 0 0 67 1,-0.1 4,-1.5 127,-0.0 3,-0.6 -0.292 56.8 -99.6 -63.1 165.3 5.1 -8.9 0.4 85 92 A F H 3> S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 3,-0.2 0.905 126.3 61.5 -54.0 -42.0 7.2 -6.3 -1.6 86 93 A D H 3> S+ 0 0 100 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.849 99.7 53.4 -57.0 -36.8 4.0 -5.3 -3.2 87 94 A D H <> S+ 0 0 19 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.916 109.6 48.2 -62.0 -43.6 2.6 -4.3 0.2 88 95 A H H X S+ 0 0 4 -4,-1.5 4,-2.5 1,-0.2 5,-0.3 0.857 109.3 53.6 -65.0 -34.9 5.6 -2.1 0.8 89 96 A V H X S+ 0 0 11 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.939 109.3 48.8 -62.1 -46.3 5.2 -0.6 -2.7 90 97 A R H X S+ 0 0 92 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.915 115.2 42.6 -61.8 -46.7 1.6 0.3 -2.0 91 98 A Y H X S+ 0 0 15 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.882 115.5 47.8 -71.8 -39.2 2.4 2.0 1.4 92 99 A L H X S+ 0 0 3 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.941 109.8 53.2 -68.2 -43.0 5.5 3.8 0.2 93 100 A D H X S+ 0 0 43 -4,-2.7 4,-1.9 -5,-0.3 -2,-0.2 0.927 113.5 44.0 -50.9 -48.1 3.7 5.1 -2.9 94 101 A A H X S+ 0 0 27 -4,-1.8 4,-2.6 -5,-0.2 -1,-0.2 0.845 109.9 55.7 -72.7 -33.7 0.9 6.5 -0.7 95 102 A F H X S+ 0 0 0 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.928 108.0 48.9 -58.5 -48.9 3.4 7.9 1.9 96 103 A I H <>S+ 0 0 1 -4,-2.6 5,-1.9 1,-0.2 4,-0.3 0.917 114.8 44.4 -60.5 -43.1 5.1 9.9 -0.8 97 104 A E H ><5S+ 0 0 103 -4,-1.9 3,-1.2 -5,-0.2 -1,-0.2 0.869 107.9 58.5 -69.8 -35.9 1.8 11.3 -2.1 98 105 A A H 3<5S+ 0 0 51 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.788 107.7 47.2 -64.5 -27.8 0.5 12.0 1.4 99 106 A L T 3<5S- 0 0 31 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.481 110.8-125.9 -89.4 -4.3 3.5 14.3 2.0 100 107 A G T < 5 + 0 0 55 -3,-1.2 -3,-0.2 -4,-0.3 2,-0.1 0.774 44.4 175.7 64.6 28.6 2.9 15.9 -1.4 101 108 A L < + 0 0 10 -5,-1.9 -1,-0.2 1,-0.1 3,-0.1 -0.422 11.5 173.0 -68.9 137.5 6.5 15.3 -2.6 102 109 A E + 0 0 154 1,-0.5 2,-0.3 -2,-0.1 -1,-0.1 0.663 62.5 12.6-105.0 -94.0 7.3 16.2 -6.1 103 110 A E S S+ 0 0 94 24,-0.1 -1,-0.5 25,-0.0 2,-0.3 -0.700 76.6 176.3 -86.6 140.8 11.0 16.0 -7.2 104 111 A V E - e 0 127A 0 22,-3.1 24,-2.8 -2,-0.3 25,-0.6 -0.915 33.0-133.0-137.5 164.0 13.2 14.1 -4.8 105 112 A V E -de 39 129A 2 -67,-2.1 -65,-3.2 -2,-0.3 2,-0.4 -0.978 33.1-142.0-109.5 135.7 16.8 12.8 -4.4 106 113 A L E -de 40 130A 2 23,-2.7 25,-3.3 -2,-0.4 2,-0.4 -0.801 20.1-175.2-102.6 140.6 16.8 9.1 -3.2 107 114 A V E +de 41 131A 0 -67,-2.5 -65,-2.8 -2,-0.4 2,-0.3 -0.969 28.8 174.4-129.1 114.8 19.2 7.5 -0.8 108 115 A I E -de 42 132A 0 23,-2.6 25,-1.0 -2,-0.4 2,-0.3 -0.896 23.5-177.3-138.3 153.8 18.5 3.8 -0.6 109 116 A H E >> - e 0 133A 0 -67,-1.5 3,-2.2 -2,-0.3 4,-0.5 -0.998 56.7 -36.0-148.7 138.1 19.6 0.5 0.8 110 117 A D H >> S+ e 0 135A 10 24,-1.4 4,-1.6 23,-0.8 3,-0.8 -0.163 132.4 1.4 54.0-127.1 18.5 -3.2 0.5 111 118 A W H 3> S+ 0 0 6 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.782 133.2 61.5 -65.5 -22.8 14.7 -3.4 0.1 112 119 A G H <> S+ 0 0 0 -3,-2.2 4,-2.8 2,-0.2 -2,-0.3 0.836 102.3 52.1 -67.0 -30.6 14.6 0.3 0.3 113 120 A S H < + 0 0 28 -4,-1.6 3,-2.3 -3,-0.3 -1,-0.2 -0.350 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1,-0.2 5,-0.1 2,-0.2 -1,-0.1 0.855 120.3 54.8 -56.3 -38.5 23.6 -3.3 23.0 188 195 A V 0 0 76 1,-0.2 4,-1.6 3,-0.2 -1,-0.2 0.925 360.0 360.0 -62.5 -46.5 22.2 0.2 22.7 189 196 A E 0 0 6 2,-0.2 4,-2.0 3,-0.1 -2,-0.2 0.917 360.0 360.0 -66.0 360.0 22.1 0.0 18.9 190 ! 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 0.0 191 198 A D > 0 0 68 0, 0.0 4,-1.4 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -34.2 18.0 -2.5 21.3 192 199 A H T 4 + 0 0 58 -4,-1.6 3,-0.2 1,-0.2 -3,-0.1 0.926 360.0 43.5 -61.7 -43.8 16.9 0.3 18.9 193 200 A Y T 4 S+ 0 0 5 -4,-2.0 -1,-0.2 1,-0.2 4,-0.2 0.806 113.2 51.8 -71.4 -29.2 16.7 -2.4 16.2 194 201 A R T >4 S+ 0 0 60 1,-0.2 3,-2.1 -5,-0.2 -1,-0.2 0.742 87.5 88.2 -75.0 -26.5 15.0 -4.9 18.4 195 202 A E G >< S+ 0 0 88 -4,-1.4 3,-0.9 1,-0.3 -1,-0.2 0.828 86.4 45.2 -48.9 -47.8 12.3 -2.5 19.5 196 203 A P G 3 S+ 0 0 16 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.629 116.6 47.8 -72.7 -10.1 9.7 -3.1 16.7 197 204 A F G < + 0 0 1 -3,-2.1 -2,-0.2 -4,-0.2 6,-0.1 0.061 64.6 119.4-123.5 24.7 10.1 -6.9 17.0 198 205 A L S < S+ 0 0 127 -3,-0.9 -1,-0.1 -4,-0.2 -3,-0.1 0.809 73.1 61.3 -59.2 -32.0 9.8 -7.7 20.7 199 206 A K S > S- 0 0 136 -3,-0.2 3,-1.9 1,-0.1 4,-0.1 -0.868 81.4-137.5-101.8 129.6 6.7 -9.8 20.0 200 207 A P G > S+ 0 0 59 0, 0.0 3,-2.0 0, 0.0 4,-0.1 0.847 102.2 63.3 -49.4 -38.3 7.0 -12.9 17.7 201 208 A V G > S+ 0 0 116 1,-0.3 3,-0.6 2,-0.1 -33,-0.0 0.749 97.3 57.9 -63.4 -22.6 3.7 -11.9 16.0 202 209 A D G < S+ 0 0 43 -3,-1.9 -1,-0.3 1,-0.2 4,-0.2 0.349 85.2 82.9 -89.0 7.0 5.2 -8.7 14.8 203 210 A R G X> + 0 0 21 -3,-2.0 4,-1.1 1,-0.2 3,-1.1 0.424 52.7 105.2 -95.1 1.8 8.0 -10.4 12.9 204 211 A E H X> S+ 0 0 35 -3,-0.6 4,-2.5 1,-0.3 3,-0.9 0.879 78.3 55.0 -46.8 -46.3 6.1 -11.3 9.7 205 212 A P H 3> S+ 0 0 2 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.861 104.7 55.0 -58.2 -33.1 7.9 -8.6 7.7 206 213 A L H <4 S+ 0 0 0 -3,-1.1 -2,-0.2 1,-0.2 -3,-0.1 0.725 111.9 42.5 -72.9 -26.3 11.2 -10.0 8.7 207 214 A W H X S+ 0 0 1 -4,-1.8 3,-1.6 -5,-0.2 4,-0.7 0.941 104.3 44.4 -64.1 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5,-0.2 0.926 108.7 39.5 -55.2 -51.2 -11.0 12.9 45.4 587 292 B L H > S+ 0 0 50 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.877 115.5 51.7 -69.8 -38.6 -12.2 13.1 41.8 588 293 B I H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.963 116.3 41.4 -62.7 -48.4 -8.8 13.9 40.4 589 294 B G H X S+ 0 0 0 -4,-3.2 4,-2.4 2,-0.2 -2,-0.2 0.939 116.5 47.0 -63.3 -48.6 -7.3 11.0 42.2 590 295 B S H X S+ 0 0 45 -4,-3.0 4,-1.5 -5,-0.3 -1,-0.2 0.871 113.8 48.0 -66.1 -35.6 -10.1 8.5 41.5 591 296 B E H X S+ 0 0 28 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.876 110.2 51.1 -73.1 -37.0 -10.3 9.4 37.8 592 297 B I H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.939 110.4 50.8 -60.1 -43.6 -6.5 9.2 37.4 593 298 B A H < S+ 0 0 27 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.845 111.0 48.4 -63.6 -33.8 -6.7 5.7 39.0 594 299 B R H < S+ 0 0 162 -4,-1.5 4,-0.3 -5,-0.2 -1,-0.2 0.818 114.0 46.8 -71.7 -33.3 -9.5 4.7 36.6 595 300 B W H >< S+ 0 0 34 -4,-1.8 3,-1.3 -3,-0.2 4,-0.2 0.825 95.5 72.3 -83.1 -36.8 -7.6 6.0 33.6 596 301 B L G >< S+ 0 0 2 -4,-2.4 3,-2.5 1,-0.3 4,-0.5 0.856 89.1 59.9 -49.5 -46.7 -4.2 4.4 34.3 597 302 B P G > S+ 0 0 85 0, 0.0 3,-1.1 0, 0.0 -1,-0.3 0.802 95.7 64.4 -57.1 -27.2 -5.3 0.8 33.5 598 303 B G G < S+ 0 0 72 -3,-1.3 -2,-0.2 -4,-0.3 -3,-0.1 0.550 95.1 60.9 -68.6 -8.6 -6.1 1.9 30.0 599 304 B L G < S+ 0 0 21 -3,-2.5 -1,-0.2 -4,-0.2 2,-0.2 0.608 76.2 110.7 -92.9 -16.0 -2.5 2.7 29.5 600 305 B A < 0 0 80 -3,-1.1 0, 0.0 -4,-0.5 0, 0.0 -0.421 360.0 360.0 -63.9 127.9 -1.3 -0.9 30.0 601 306 B G 0 0 114 -2,-0.2 -2,-0.1 0, 0.0 -3,-0.0 -0.977 360.0 360.0 167.9 360.0 0.0 -2.5 26.8