==== 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-FEB-03 1ODT . COMPND 2 MOLECULE: CEPHALOSPORIN C DEACETYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR F.VINCENT,S.J.CHARNOCK,K.H.G.VERSCHUEREN,J.P.TURKENBURG,D.J. . 632 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24531.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 450 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 45 7.1 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 . 4 0.6 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 . 44 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 0 2 0 4 2 0 4 4 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 4 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 PARALLEL BRIDGES PER LADDER . 2 1 0 1 2 0 0 0 1 1 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 0 0 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 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 C M 0 0 186 0, 0.0 2,-0.3 0, 0.0 268,-0.1 0.000 360.0 360.0 360.0 -17.8 1.5 80.9 45.2 2 2 C Q - 0 0 101 266,-0.2 293,-0.0 265,-0.1 0, 0.0 -0.925 360.0 -66.1-146.6 159.7 0.5 81.0 41.5 3 3 C L + 0 0 92 -2,-0.3 265,-0.1 1,-0.1 -1,-0.0 -0.202 56.0 149.3 -48.7 142.3 1.9 81.4 38.0 4 4 C F + 0 0 58 263,-0.5 -1,-0.1 2,-0.2 264,-0.1 0.507 45.1 68.2-151.3 -28.8 3.4 84.9 37.4 5 5 C D S S- 0 0 24 262,-0.4 3,-0.1 1,-0.3 6,-0.0 -0.037 100.2 -43.9 -91.7-166.2 6.3 84.7 34.9 6 6 C L S S- 0 0 43 1,-0.1 -1,-0.3 2,-0.1 -2,-0.2 -0.270 73.6 -94.7 -56.3 146.1 6.3 84.0 31.2 7 7 C P >> - 0 0 69 0, 0.0 4,-2.4 0, 0.0 3,-1.2 -0.302 39.1-106.4 -59.6 152.5 4.1 81.1 30.2 8 8 C L H 3> S+ 0 0 65 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.832 118.4 58.1 -54.7 -40.4 6.0 77.8 29.9 9 9 C D H 34 S+ 0 0 107 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.864 112.8 41.6 -59.2 -35.4 5.9 77.8 26.0 10 10 C Q H X4 S+ 0 0 99 -3,-1.2 3,-0.8 2,-0.2 4,-0.4 0.848 110.6 56.4 -77.6 -40.0 7.7 81.1 26.1 11 11 C L H >< S+ 0 0 2 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.915 98.6 62.8 -54.4 -42.0 10.1 80.1 28.9 12 12 C Q T 3< S+ 0 0 109 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.797 112.5 34.3 -59.9 -27.2 11.2 77.1 26.8 13 13 C T T < S+ 0 0 116 -3,-0.8 2,-0.7 -4,-0.5 -1,-0.3 0.247 85.4 124.8-110.3 9.8 12.6 79.5 24.1 14 14 C Y < + 0 0 48 -3,-1.6 268,-0.3 -4,-0.4 -3,-0.0 -0.623 23.4 149.5 -76.1 112.8 13.8 82.3 26.4 15 15 C K - 0 0 110 -2,-0.7 3,-0.1 267,-0.1 264,-0.1 -0.720 28.4-158.1-148.0 85.2 17.5 82.8 25.7 16 16 C P - 0 0 25 0, 0.0 3,-0.1 0, 0.0 2,-0.1 -0.234 33.1 -90.8 -64.7 157.5 18.7 86.4 26.2 17 17 C E - 0 0 167 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.391 51.4 -97.2 -64.9 144.0 21.8 87.7 24.5 18 18 C K - 0 0 75 1,-0.1 -1,-0.1 -3,-0.1 234,-0.1 -0.286 27.2-160.3 -59.3 146.1 25.0 87.2 26.6 19 19 C T + 0 0 39 227,-0.2 -1,-0.1 230,-0.1 227,-0.1 0.261 41.8 136.5-111.7 8.6 26.0 90.3 28.5 20 20 C A - 0 0 26 1,-0.1 227,-0.1 2,-0.1 223,-0.0 -0.357 52.5-127.6 -59.1 126.5 29.6 89.2 29.1 21 21 C P > - 0 0 27 0, 0.0 3,-2.0 0, 0.0 4,-0.3 -0.200 29.0 -97.0 -66.0 166.1 32.0 92.2 28.5 22 22 C K T 3 S+ 0 0 209 1,-0.3 3,-0.3 2,-0.1 4,-0.2 0.778 124.8 48.0 -56.2 -34.2 35.0 91.9 26.1 23 23 C D T 3> S+ 0 0 63 1,-0.2 4,-2.7 2,-0.1 -1,-0.3 0.114 77.6 112.9 -96.5 22.3 37.4 91.1 28.9 24 24 C F H <> S+ 0 0 9 -3,-2.0 4,-1.9 2,-0.2 5,-0.2 0.949 79.9 43.1 -58.3 -53.7 35.1 88.4 30.6 25 25 C S H > S+ 0 0 73 -4,-0.3 4,-2.4 -3,-0.3 -1,-0.2 0.916 114.8 50.6 -61.9 -42.3 37.4 85.5 29.9 26 26 C E H > S+ 0 0 108 -4,-0.2 4,-2.6 1,-0.2 5,-0.2 0.889 106.7 55.8 -63.3 -41.0 40.5 87.5 30.9 27 27 C F H X S+ 0 0 8 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.910 111.4 42.5 -54.9 -49.9 38.9 88.5 34.1 28 28 C W H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.871 112.2 53.5 -68.1 -37.6 38.3 84.9 35.1 29 29 C K H X S+ 0 0 115 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.945 113.0 44.1 -58.0 -48.0 41.7 83.7 34.0 30 30 C L H X S+ 0 0 66 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.867 112.4 53.4 -65.0 -41.6 43.3 86.4 36.2 31 31 C S H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.911 108.8 47.2 -60.2 -47.7 41.0 85.6 39.1 32 32 C L H X S+ 0 0 44 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.859 110.0 55.1 -64.3 -35.2 41.9 81.9 39.0 33 33 C E H X S+ 0 0 93 -4,-1.8 4,-0.9 -5,-0.2 -2,-0.2 0.900 106.7 50.9 -64.8 -36.1 45.6 83.0 38.9 34 34 C E H >< S+ 0 0 60 -4,-1.9 3,-0.6 1,-0.2 4,-0.4 0.916 110.4 49.4 -65.4 -42.8 45.0 85.1 42.0 35 35 C L H >< S+ 0 0 2 -4,-2.2 3,-2.1 1,-0.2 -2,-0.2 0.914 104.6 58.5 -59.4 -42.6 43.5 82.0 43.7 36 36 C A H 3< S+ 0 0 64 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.707 93.9 66.4 -66.9 -24.2 46.4 79.8 42.7 37 37 C K T << S+ 0 0 145 -4,-0.9 2,-0.6 -3,-0.6 -1,-0.3 0.674 88.0 79.2 -69.8 -18.2 48.8 82.0 44.5 38 38 C V S < S- 0 0 17 -3,-2.1 2,-0.2 -4,-0.4 26,-0.1 -0.828 83.4-131.7 -93.3 117.8 47.2 81.1 47.9 39 39 C Q - 0 0 138 -2,-0.6 23,-0.1 1,-0.1 -2,-0.1 -0.528 11.7-138.5 -63.5 133.9 48.3 77.7 49.2 40 40 C A - 0 0 20 -2,-0.2 22,-2.5 21,-0.1 -1,-0.1 0.847 22.3-174.1 -67.5 -38.7 45.3 75.7 50.3 41 41 C E - 0 0 140 20,-0.2 19,-0.1 1,-0.1 -1,-0.1 0.885 19.8-154.9 46.1 54.2 46.8 74.3 53.5 42 42 C P - 0 0 63 0, 0.0 2,-0.4 0, 0.0 19,-0.2 -0.275 12.6-165.1 -66.7 148.0 43.8 72.0 54.1 43 43 C D E -A 60 0A 73 17,-2.5 17,-2.5 2,-0.0 2,-0.5 -0.998 6.1-161.8-134.6 124.5 43.0 70.9 57.7 44 44 C L E -A 59 0A 56 -2,-0.4 15,-0.2 15,-0.2 13,-0.0 -0.955 7.5-174.4-104.3 126.0 40.6 68.1 58.7 45 45 C Q E -A 58 0A 115 13,-2.2 13,-2.6 -2,-0.5 -2,-0.0 -0.972 26.2-124.6-119.9 113.2 39.4 68.1 62.3 46 46 C P E -A 57 0A 96 0, 0.0 2,-0.3 0, 0.0 11,-0.3 -0.252 24.2-152.8 -57.6 152.6 37.3 65.1 63.4 47 47 C V E -A 56 0A 41 9,-2.3 9,-0.5 2,-0.0 2,-0.4 -0.944 17.2-121.4-127.8 139.8 33.8 65.7 64.8 48 48 C D + 0 0 162 -2,-0.3 7,-0.0 7,-0.1 9,-0.0 -0.705 41.6 171.0 -74.3 130.3 31.7 63.6 67.2 49 49 C Y - 0 0 43 -2,-0.4 2,-2.4 2,-0.2 5,-0.1 -0.973 41.3-117.6-144.6 136.1 28.5 62.8 65.4 50 50 C P S S+ 0 0 119 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.391 79.2 89.5 -77.6 67.5 25.7 60.4 66.6 51 51 C A - 0 0 39 -2,-2.4 2,-0.3 3,-0.1 3,-0.2 -0.977 60.7-138.4-155.2 151.2 25.9 57.9 63.6 52 52 C D S S+ 0 0 155 -2,-0.3 3,-0.1 1,-0.1 25,-0.0 -0.734 83.1 41.8 -99.0 157.7 27.7 54.7 62.6 53 53 C G S S+ 0 0 40 -2,-0.3 24,-2.2 1,-0.2 2,-0.3 0.443 103.4 72.3 86.3 4.2 29.0 54.1 59.0 54 54 C V E - B 0 76A 14 22,-0.3 2,-0.4 -3,-0.2 -1,-0.2 -0.985 62.8-146.0-147.7 148.0 30.4 57.6 58.5 55 55 C K E - B 0 75A 106 20,-2.6 20,-2.8 -2,-0.3 2,-0.4 -0.992 22.5-156.0-115.7 133.2 33.3 59.7 59.7 56 56 C V E +AB 47 74A 7 -9,-0.5 -9,-2.3 -2,-0.4 2,-0.3 -0.851 15.3 172.9-117.0 139.5 32.6 63.4 60.0 57 57 C Y E -AB 46 73A 45 16,-2.8 16,-3.1 -2,-0.4 2,-0.6 -0.960 35.6-124.0-137.0 159.2 35.1 66.3 59.9 58 58 C R E -AB 45 72A 53 -13,-2.6 -13,-2.2 -2,-0.3 2,-0.5 -0.944 34.4-158.7 -98.7 113.5 35.4 70.0 59.9 59 59 C L E -AB 44 71A 0 12,-2.7 12,-1.1 -2,-0.6 2,-0.4 -0.875 12.1-178.4 -95.6 128.2 37.4 70.8 56.7 60 60 C T E +AB 43 70A 29 -17,-2.5 -17,-2.5 -2,-0.5 2,-0.3 -0.978 5.9 166.4-123.4 137.6 39.1 74.2 56.6 61 61 C Y E - B 0 69A 1 8,-2.5 8,-3.0 -2,-0.4 2,-0.4 -0.951 33.5-112.9-141.6 165.6 41.2 75.6 53.7 62 62 C K E + B 0 68A 63 -22,-2.5 6,-0.2 -2,-0.3 2,-0.2 -0.817 40.8 165.0-100.0 142.9 42.7 78.9 52.6 63 63 C S > - 0 0 0 4,-2.1 3,-1.5 -2,-0.4 4,-0.5 -0.552 43.0 -17.6-138.1-165.9 41.4 80.5 49.5 64 64 C F G > S+ 0 0 31 1,-0.3 3,-1.1 88,-0.2 62,-0.3 -0.135 129.4 15.5 -43.2 134.7 41.3 83.8 47.6 65 65 C G G 3 S- 0 0 36 1,-0.2 -1,-0.3 -31,-0.2 -30,-0.1 0.713 127.4 -78.4 70.2 19.9 42.3 86.8 49.7 66 66 C N G < S+ 0 0 99 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.734 81.8 168.1 56.4 30.3 43.7 84.4 52.3 67 67 C A < - 0 0 0 -3,-1.1 -4,-2.1 -4,-0.5 2,-0.7 -0.477 37.7-126.6 -75.3 138.8 40.2 83.7 53.5 68 68 C R E -B 62 0A 75 -6,-0.2 56,-2.7 -2,-0.2 2,-0.4 -0.784 31.6-171.7 -84.6 112.9 39.6 80.8 55.9 69 69 C I E +B 61 0A 1 -8,-3.0 -8,-2.5 -2,-0.7 2,-0.3 -0.887 9.3 169.7-112.7 139.0 36.8 78.7 54.3 70 70 C T E +B 60 0A 1 -2,-0.4 46,-2.2 46,-0.4 2,-0.3 -0.833 11.9 146.5-141.0 174.6 35.2 75.8 56.1 71 71 C G E -B 59 0A 0 -12,-1.1 -12,-2.7 -2,-0.3 2,-0.3 -0.896 50.4 -68.0 168.4 170.7 32.4 73.3 56.2 72 72 C W E -B 58 0A 44 42,-0.5 42,-2.5 25,-0.3 2,-0.4 -0.609 39.1-164.5 -80.6 141.9 31.5 69.8 57.3 73 73 C Y E -BC 57 113A 0 -16,-3.1 -16,-2.8 -2,-0.3 2,-0.4 -0.998 6.1-170.7-130.8 119.1 33.1 66.9 55.4 74 74 C A E -BC 56 112A 0 38,-2.5 38,-2.9 -2,-0.4 -18,-0.2 -0.968 1.0-170.1-120.2 135.3 31.5 63.5 55.8 75 75 C V E -B 55 0A 11 -20,-2.8 -20,-2.6 -2,-0.4 36,-0.1 -0.971 30.8-106.3-127.2 134.1 33.0 60.2 54.5 76 76 C P E -B 54 0A 6 0, 0.0 2,-2.1 0, 0.0 -22,-0.3 -0.341 35.1-122.9 -51.7 133.6 31.7 56.7 54.2 77 77 C D S S+ 0 0 90 -24,-2.2 2,-0.3 2,-0.0 -23,-0.1 -0.526 82.2 87.7 -83.2 73.4 33.4 54.5 57.0 78 78 C K S S- 0 0 147 -2,-2.1 2,-0.2 -25,-0.0 4,-0.0 -0.950 91.3 -73.8-161.3 165.8 34.8 52.1 54.4 79 79 C E S S+ 0 0 198 -2,-0.3 -2,-0.0 1,-0.1 90,-0.0 -0.503 70.3 167.2 -75.3 134.4 37.9 51.8 52.3 80 80 C G S S- 0 0 38 -2,-0.2 2,-0.2 2,-0.1 90,-0.1 -0.002 74.3-177.7 -91.8-156.3 38.0 54.2 49.4 81 81 C P - 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0 0 7 -4,-2.5 54,-0.2 -5,-0.3 53,-0.1 -0.259 43.1-172.3 -58.9 143.4 11.6 89.0 41.1 218 218 C L + 0 0 97 52,-2.2 2,-0.3 2,-0.1 53,-0.2 0.317 66.3 43.0-121.8 4.8 9.0 89.6 43.8 219 219 C E S > S- 0 0 104 51,-1.1 4,-0.5 52,-0.1 3,-0.4 -0.916 90.2 -51.8-139.7 165.9 11.0 88.5 46.8 220 220 C E T 4 S+ 0 0 99 -2,-0.3 -2,-0.1 1,-0.2 50,-0.0 -0.350 92.1 39.0 -63.9 162.3 14.5 89.0 48.1 221 221 C P T >4 S+ 0 0 12 0, 0.0 3,-1.9 0, 0.0 4,-0.3 -0.978 107.8 53.5-105.3 3.7 17.4 88.7 47.5 222 222 C Y T >> S+ 0 0 0 -3,-0.4 3,-2.0 49,-0.4 4,-0.6 0.848 101.9 69.8 -53.3 -32.6 17.7 89.9 43.9 223 223 C L H 3X S+ 0 0 38 -4,-0.5 4,-2.0 1,-0.3 -1,-0.3 0.542 75.3 79.7 -72.2 -5.3 15.8 93.0 45.1 224 224 C E H <> S+ 0 0 5 -3,-1.9 4,-2.3 2,-0.2 -1,-0.3 0.802 89.0 57.3 -61.5 -33.3 18.9 94.1 47.1 225 225 C I H <> S+ 0 0 0 -3,-2.0 4,-2.3 -4,-0.3 5,-0.2 0.962 105.8 48.5 -61.9 -48.2 20.2 95.4 43.8 226 226 C N H X S+ 0 0 52 -4,-0.6 4,-2.0 1,-0.2 -2,-0.2 0.911 110.5 52.4 -55.1 -46.1 17.1 97.6 43.5 227 227 C S H X S+ 0 0 34 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.896 106.6 52.5 -60.1 -38.0 17.7 98.7 47.0 228 228 C F H X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.923 108.2 50.5 -65.8 -41.8 21.3 99.7 46.2 229 229 C F H < S+ 0 0 27 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.846 106.8 55.3 -68.2 -30.8 20.1 101.8 43.3 230 230 C R H < S+ 0 0 153 -4,-2.0 3,-0.2 -5,-0.2 -1,-0.2 0.900 114.4 39.7 -61.3 -39.5 17.6 103.6 45.5 231 231 C R H < S+ 0 0 22 -4,-1.6 183,-2.7 1,-0.3 2,-0.3 0.579 124.7 38.0 -90.0 -9.0 20.4 104.5 47.9 232 232 C N S < S+ 0 0 19 -4,-1.2 -1,-0.3 181,-0.2 6,-0.1 -0.812 73.9 174.6-144.8 88.1 23.0 105.3 45.2 233 233 C G + 0 0 45 -2,-0.3 -4,-0.1 -3,-0.2 -1,-0.1 0.413 28.6 124.1 -93.1 -3.6 21.0 107.0 42.5 234 234 C S > - 0 0 33 1,-0.1 4,-1.7 2,-0.1 3,-0.5 -0.336 60.5-135.9 -61.3 131.4 23.5 108.1 39.9 235 235 C P H > S+ 0 0 88 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.891 106.8 55.7 -54.1 -34.9 22.8 106.7 36.4 236 236 C E H > S+ 0 0 133 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.844 102.7 54.9 -69.2 -35.9 26.5 105.9 36.1 237 237 C T H > S+ 0 0 30 -3,-0.5 4,-3.0 2,-0.2 -1,-0.2 0.926 108.1 49.2 -60.5 -45.9 26.5 103.8 39.3 238 238 C E H X S+ 0 0 93 -4,-1.7 4,-2.4 2,-0.2 5,-0.2 0.940 111.1 48.5 -61.7 -47.2 23.7 101.7 37.9 239 239 C V H X S+ 0 0 107 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.933 114.8 46.2 -57.6 -46.8 25.5 101.1 34.5 240 240 C Q H X S+ 0 0 73 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.925 111.7 51.7 -59.7 -48.6 28.7 100.2 36.4 241 241 C A H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.899 110.2 47.5 -59.7 -44.7 26.8 97.9 38.8 242 242 C M H X S+ 0 0 36 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.884 111.7 51.9 -65.7 -37.1 25.1 96.0 36.0 243 243 C K H X S+ 0 0 100 -4,-2.0 4,-0.7 -5,-0.2 3,-0.3 0.963 109.0 49.1 -64.0 -46.3 28.4 95.6 34.2 244 244 C T H >< S+ 0 0 0 -4,-2.9 3,-1.8 -102,-0.3 4,-0.4 0.954 109.6 53.2 -54.7 -52.8 30.1 94.2 37.3 245 245 C L H >X S+ 0 0 0 -4,-2.4 3,-1.8 1,-0.3 4,-1.0 0.838 96.7 67.8 -49.8 -36.6 27.2 91.7 37.7 246 246 C S H 3< S+ 0 0 8 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.740 91.1 60.1 -66.0 -21.6 27.6 90.5 34.2 247 247 C Y T << S+ 0 0 3 -3,-1.8 -1,-0.3 -4,-0.7 -2,-0.2 0.681 114.2 37.2 -73.1 -19.5 31.0 88.9 35.0 248 248 C F T <4 S+ 0 0 1 -3,-1.8 2,-0.3 -4,-0.4 -2,-0.2 0.485 83.4 119.0-107.3 -3.1 29.2 86.7 37.6 249 249 C D >X - 0 0 2 -4,-1.0 3,-1.7 1,-0.2 4,-0.9 -0.468 59.0-145.5 -71.2 119.1 26.0 86.0 35.8 250 250 C I H 3> S+ 0 0 0 -43,-2.7 4,-1.8 -2,-0.3 -42,-0.2 0.684 95.1 69.7 -66.1 -20.2 25.8 82.3 35.3 251 251 C M H 34 S+ 0 0 2 -44,-0.3 4,-0.4 1,-0.2 -1,-0.3 0.804 103.0 46.1 -62.4 -27.3 24.1 82.7 32.0 252 252 C N H <4 S+ 0 0 0 -3,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.699 116.6 43.4 -82.8 -27.2 27.4 84.1 30.7 253 253 C L H >< S+ 0 0 0 -4,-0.9 3,-2.3 1,-0.1 4,-0.3 0.687 93.1 86.0 -81.1 -23.6 29.4 81.2 32.3 254 254 C A G >< S+ 0 0 0 -4,-1.8 3,-1.8 1,-0.3 31,-0.5 0.788 77.0 62.1 -60.3 -35.4 27.0 78.5 31.3 255 255 C D G 3 S+ 0 0 47 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.585 96.1 64.8 -68.7 -6.4 28.5 77.8 27.8 256 256 C R G < S+ 0 0 81 -3,-2.3 -1,-0.3 30,-0.0 2,-0.3 0.636 77.1 103.0 -86.6 -16.6 31.7 76.8 29.5 257 257 C V < + 0 0 0 -3,-1.8 28,-0.4 -4,-0.3 -65,-0.1 -0.499 40.2 172.5 -74.0 130.7 30.2 73.8 31.2 258 258 C K + 0 0 133 -67,-0.4 29,-0.1 -2,-0.3 -1,-0.1 0.328 50.1 80.5-126.0 9.4 31.1 70.5 29.5 259 259 C V S S- 0 0 30 1,-0.1 -60,-0.2 -68,-0.1 -61,-0.1 -0.671 93.4 -76.0-108.5 164.7 29.7 67.9 31.9 260 260 C P - 0 0 23 0, 0.0 -60,-2.3 0, 0.0 2,-0.4 -0.374 49.5-162.0 -61.4 139.9 26.1 66.6 32.2 261 261 C V E -gh 200 288A 1 26,-2.2 28,-1.7 -62,-0.2 2,-0.4 -0.986 13.7-169.6-130.0 132.4 23.8 69.0 34.1 262 262 C L E +gh 201 289A 2 -62,-2.2 -60,-2.5 -2,-0.4 2,-0.3 -0.986 18.5 177.5-116.7 135.7 20.4 68.3 35.7 263 263 C M E -gh 202 290A 0 26,-2.2 28,-3.2 -2,-0.4 2,-0.3 -0.936 14.2-152.7-140.8 151.1 18.5 71.4 36.8 264 264 C S E -gh 203 291A 0 -62,-1.5 -60,-1.1 -2,-0.3 2,-0.3 -0.916 9.0-178.2-122.0 155.4 15.1 72.1 38.4 265 265 C I E - h 0 292A 0 26,-2.2 28,-2.9 -2,-0.3 2,-0.4 -0.943 16.1-148.9-148.5 136.4 12.7 75.0 38.3 266 266 C G E > - h 0 293A 0 -2,-0.3 3,-1.5 26,-0.2 28,-0.2 -0.864 18.0-138.1-100.5 134.5 9.4 75.5 40.1 267 267 C L T 3 S+ 0 0 16 26,-2.3 -263,-0.5 -2,-0.4 -262,-0.4 0.640 99.3 50.4 -74.0 -10.9 7.0 77.6 38.1 268 268 C I T 3 S+ 0 0 25 28,-1.8 2,-0.6 25,-0.4 -1,-0.3 0.281 76.5 129.8-107.1 14.1 5.7 79.7 41.1 269 269 C D < + 0 0 2 -3,-1.5 -265,-0.1 27,-0.4 28,-0.1 -0.552 28.4 175.7 -76.6 114.9 9.2 80.6 42.4 270 270 C K S S+ 0 0 49 -2,-0.6 -52,-2.2 3,-0.1 -51,-1.1 0.397 75.7 57.9-100.6 -1.1 9.3 84.3 42.9 271 271 C V S S+ 0 0 26 1,-0.3 -49,-0.4 -54,-0.2 -1,-0.1 0.857 123.1 20.1 -91.4 -56.3 12.8 84.4 44.4 272 272 C T S S- 0 0 0 -66,-0.1 -1,-0.3 -65,-0.0 -3,-0.2 -0.859 97.6-143.0-112.6 86.1 14.6 82.8 41.4 273 273 C P >> - 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