==== 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 06-SEP-06 2I9U . COMPND 2 MOLECULE: CYTOSINE/GUANINE DEAMINASE RELATED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM ACETOBUTYLICUM; . AUTHOR D.KUMARAN,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX RESEARCH CEN . 838 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28953.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 617 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 92 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 8.5 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 67 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 249 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 3.1 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 1 2 5 4 2 2 2 2 0 1 3 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 1 4 3 7 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 1 1 4 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 . 1 0 2 2 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 9 A N 0 0 123 0, 0.0 29,-2.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 93.2 62.3 21.4 3.7 2 10 A L E +A 29 0A 55 27,-0.2 2,-0.4 28,-0.1 27,-0.2 -0.951 360.0 178.5-122.0 134.2 63.3 18.7 1.3 3 11 A K E -A 28 0A 56 25,-2.8 25,-3.7 -2,-0.4 2,-0.5 -0.987 11.7-157.1-132.7 141.6 66.8 17.5 0.3 4 12 A I E -Ab 27 49A 1 44,-0.5 46,-3.1 -2,-0.4 2,-0.4 -0.979 8.0-168.3-123.2 126.3 67.9 14.7 -2.0 5 13 A F E -Ab 26 50A 0 21,-2.7 21,-2.6 -2,-0.5 2,-0.4 -0.915 1.6-166.2-113.9 137.2 71.2 13.0 -1.8 6 14 A K E +Ab 25 51A 47 44,-2.6 46,-3.0 -2,-0.4 2,-0.3 -0.983 33.4 93.3-125.9 135.6 72.7 10.7 -4.4 7 15 A G E S-A 24 0A 0 17,-2.2 17,-2.2 -2,-0.4 2,-0.9 -0.983 77.6 -47.0 173.8-171.1 75.7 8.4 -4.1 8 16 A N E - b 0 56A 5 47,-2.0 49,-3.1 -2,-0.3 2,-0.3 -0.778 59.8-153.6 -88.4 108.6 76.9 4.9 -3.3 9 17 A L E +Ab 21 57A 0 12,-2.4 12,-2.8 -2,-0.9 2,-0.4 -0.665 19.0 175.9 -90.3 135.7 75.1 3.9 -0.1 10 18 A I E +A 20 0A 0 47,-2.1 2,-0.3 -2,-0.3 10,-0.2 -0.983 18.8 134.9-138.8 123.1 76.4 1.4 2.4 11 19 A F E -A 19 0A 1 8,-1.9 8,-3.7 -2,-0.4 2,-0.5 -0.939 46.2-116.1-156.1 174.2 74.6 0.7 5.7 12 20 A T E + 0 0 0 355,-0.4 345,-0.2 -2,-0.3 6,-0.1 -0.944 21.0 175.3-127.4 110.9 73.6 -2.2 7.9 13 21 A K E S+ 0 0 95 -2,-0.5 2,-0.3 4,-0.3 -1,-0.1 0.794 86.6 16.5 -78.3 -31.0 69.9 -2.9 8.6 14 22 A T E > S-A 17 0A 62 3,-0.6 3,-0.6 1,-0.0 -1,-0.1 -0.868 86.8-112.2-133.2 165.4 71.0 -6.0 10.5 15 23 A S T 3 S+ 0 0 41 -2,-0.3 338,-0.2 1,-0.2 337,-0.1 0.736 103.6 68.3 -76.2 -21.1 74.4 -7.0 11.9 16 24 A D T 3 S+ 0 0 100 1,-0.1 2,-0.3 333,-0.1 -1,-0.2 0.662 106.9 11.6 -74.7 -18.8 75.1 -9.9 9.5 17 25 A K E < -A 14 0A 119 -3,-0.6 -3,-0.6 332,-0.2 -4,-0.3 -1.000 67.5-111.2-159.7 158.2 75.5 -8.0 6.3 18 26 A F E - 0 0 30 -2,-0.3 2,-0.6 -6,-0.1 -6,-0.2 -0.599 24.0-139.1 -86.7 148.4 75.9 -4.7 4.5 19 27 A T E -A 11 0A 29 -8,-3.7 -8,-1.9 -2,-0.2 2,-0.5 -0.952 25.5-166.5-105.7 124.6 73.2 -3.2 2.3 20 28 A I E +A 10 0A 65 -2,-0.6 2,-0.4 -10,-0.2 -10,-0.2 -0.967 14.2 178.4-121.8 127.3 74.8 -1.7 -0.7 21 29 A M E > -A 9 0A 41 -12,-2.8 -12,-2.4 -2,-0.5 3,-1.0 -0.849 17.7-148.8-131.7 97.9 73.1 0.6 -3.2 22 30 A K E 3 S- 0 0 146 -2,-0.4 -14,-0.2 1,-0.3 32,-0.1 -0.314 77.7 -9.0 -64.2 144.2 75.1 1.9 -6.1 23 31 A D E 3 S+ 0 0 86 30,-0.2 -1,-0.3 1,-0.1 -15,-0.2 0.788 98.6 156.7 34.6 49.4 74.2 5.4 -7.4 24 32 A S E < -A 7 0A 1 -17,-2.2 -17,-2.2 -3,-1.0 2,-0.4 -0.579 37.4-120.1-103.1 166.4 71.1 5.5 -5.3 25 33 A Y E -AC 6 37A 39 12,-3.3 12,-2.1 -19,-0.2 2,-0.5 -0.825 13.3-166.3-110.2 141.7 68.9 8.3 -3.9 26 34 A I E -AC 5 36A 0 -21,-2.6 -21,-2.7 -2,-0.4 2,-0.6 -0.985 11.4-157.4-124.2 117.9 68.0 9.3 -0.3 27 35 A V E -AC 4 35A 0 8,-3.1 7,-3.4 -2,-0.5 8,-1.4 -0.866 9.9-165.7 -98.8 120.9 65.1 11.8 -0.0 28 36 A V E -AC 3 33A 3 -25,-3.7 -25,-2.8 -2,-0.6 2,-0.5 -0.918 8.1-177.1-111.9 126.8 65.1 13.7 3.3 29 37 A I E > S-AC 2 32A 63 3,-2.7 3,-1.8 -2,-0.5 -27,-0.2 -0.980 75.0 -15.3-124.9 120.2 62.1 15.7 4.5 30 38 A D T 3 S- 0 0 120 -29,-2.5 -1,-0.1 -2,-0.5 -28,-0.1 0.861 128.4 -54.1 57.3 38.2 62.4 17.7 7.7 31 39 A G T 3 S+ 0 0 5 -30,-0.3 344,-2.6 1,-0.2 2,-0.4 0.312 118.5 102.1 83.1 -9.9 65.5 15.8 8.7 32 40 A K E < S-CD 29 374A 110 -3,-1.8 -3,-2.7 342,-0.2 2,-0.3 -0.864 79.0-104.8-113.2 145.2 64.0 12.3 8.4 33 41 A I E +C 28 0A 3 340,-3.1 339,-3.3 -2,-0.4 -5,-0.2 -0.467 37.3 170.2 -66.8 124.4 64.4 9.8 5.5 34 42 A A E + 0 0 29 -7,-3.4 2,-0.3 1,-0.3 -6,-0.2 0.717 67.4 11.9-103.7 -32.2 61.3 9.6 3.4 35 43 A S E -C 27 0A 15 -8,-1.4 -8,-3.1 335,-0.1 2,-0.4 -0.985 49.8-177.3-153.0 137.8 62.7 7.5 0.6 36 44 A V E +C 26 0A 31 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.949 34.1 134.9-134.8 111.5 65.7 5.3 -0.2 37 45 A S E -C 25 0A 28 -12,-2.1 -12,-3.3 -2,-0.4 -2,-0.0 -0.983 62.6-118.9-155.3 162.6 65.8 3.8 -3.7 38 46 A S S S+ 0 0 66 -2,-0.3 2,-0.4 -14,-0.3 -12,-0.1 0.635 105.1 49.3 -78.2 -15.3 68.0 3.1 -6.7 39 47 A N S S- 0 0 123 -14,-0.1 -1,-0.1 -15,-0.1 -15,-0.1 -0.991 92.3-116.5-127.1 133.4 65.7 5.3 -8.8 40 48 A L - 0 0 35 -2,-0.4 5,-0.1 1,-0.1 -2,-0.1 -0.533 36.6-117.7 -69.9 120.3 64.4 8.7 -7.9 41 49 A P > - 0 0 34 0, 0.0 3,-1.8 0, 0.0 4,-0.3 -0.257 16.7-124.6 -57.2 144.7 60.6 8.6 -7.4 42 50 A D G > S+ 0 0 131 1,-0.3 3,-1.4 2,-0.2 -2,-0.1 0.810 106.9 70.8 -61.4 -30.5 58.8 10.8 -9.9 43 51 A K G 3 S+ 0 0 153 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.587 103.4 43.8 -63.6 -8.3 57.0 12.7 -7.0 44 52 A Y G X S+ 0 0 26 -3,-1.8 3,-1.5 3,-0.1 -1,-0.3 0.427 82.8 122.3-115.9 -2.7 60.4 14.2 -6.3 45 53 A K T < + 0 0 130 -3,-1.4 -3,-0.0 -4,-0.3 0, 0.0 -0.196 65.8 40.7 -58.1 153.7 61.6 15.2 -9.8 46 54 A G T 3 S+ 0 0 80 1,-0.4 -1,-0.2 3,-0.0 3,-0.1 0.203 90.6 114.6 91.2 -17.3 62.4 18.8 -10.3 47 55 A N S < S- 0 0 60 -3,-1.5 -1,-0.4 1,-0.1 -44,-0.1 -0.541 78.6 -93.3 -85.7 153.0 64.0 19.0 -6.9 48 56 A P - 0 0 101 0, 0.0 -44,-0.5 0, 0.0 2,-0.5 -0.358 36.6-148.5 -64.8 144.0 67.8 19.7 -6.5 49 57 A I E -b 4 0A 68 -46,-0.1 2,-1.3 -3,-0.1 -44,-0.2 -0.969 6.6-147.5-119.1 120.3 70.0 16.6 -6.3 50 58 A I E -b 5 0A 63 -46,-3.1 -44,-2.6 -2,-0.5 2,-0.7 -0.755 25.3-160.5 -85.8 98.0 73.1 16.8 -4.2 51 59 A D E -b 6 0A 77 -2,-1.3 -44,-0.2 -46,-0.2 -46,-0.1 -0.751 21.4-178.5 -89.4 110.6 75.2 14.3 -6.3 52 60 A F E > - 0 0 12 -46,-3.0 3,-2.2 -2,-0.7 -44,-0.1 0.253 26.3-159.8 -90.2 11.6 78.2 12.8 -4.5 53 61 A R E 3 - 0 0 175 1,-0.3 -1,-0.3 -47,-0.1 -45,-0.2 -0.139 66.2 -6.0 51.4-127.5 79.2 10.9 -7.7 54 62 A N E 3 S+ 0 0 90 -47,-0.1 -1,-0.3 -32,-0.1 -47,-0.1 0.442 108.0 113.5 -80.0 0.6 81.5 7.9 -7.0 55 63 A N E < - 0 0 22 -3,-2.2 -47,-2.0 1,-0.1 2,-0.4 -0.240 68.5-113.5 -71.1 163.0 81.8 8.8 -3.4 56 64 A I E -bE 8 380A 2 324,-2.4 324,-3.7 -49,-0.2 2,-0.5 -0.791 19.4-157.7-101.4 138.8 80.4 6.6 -0.5 57 65 A I E +bE 9 379A 1 -49,-3.1 -47,-2.1 -2,-0.4 322,-0.2 -0.974 21.4 164.9-115.8 124.2 77.6 7.6 1.8 58 66 A I E - E 0 378A 0 320,-2.2 320,-3.1 -2,-0.5 -47,-0.2 -0.903 41.9 -90.6-132.8 162.1 77.4 5.9 5.2 59 67 A P E - E 0 377A 0 0, 0.0 318,-0.3 0, 0.0 316,-0.1 -0.272 53.3 -96.0 -67.0 161.4 75.5 6.6 8.4 60 68 A G - 0 0 0 316,-1.4 2,-0.3 352,-0.2 59,-0.2 -0.262 42.4 -97.6 -74.0 166.7 77.3 8.7 11.0 61 69 A M E -h 119 0B 0 57,-2.4 59,-2.3 316,-0.1 60,-1.4 -0.665 27.3-152.6 -87.2 142.6 79.2 7.2 13.9 62 70 A N E -h 121 0B 0 293,-2.1 2,-0.8 -2,-0.3 247,-0.4 -0.924 7.4-164.3-119.2 104.0 77.5 6.9 17.3 63 71 A D E -h 122 0B 0 58,-2.0 60,-2.5 -2,-0.6 247,-0.2 -0.795 3.6-171.1 -90.8 106.8 80.1 7.0 20.1 64 72 A L E + 0 0 0 245,-2.6 246,-0.2 -2,-0.8 2,-0.2 0.369 69.1 32.6 -84.4 6.6 78.4 5.7 23.3 65 73 A H E + 0 0 4 244,-0.2 247,-4.0 217,-0.1 246,-0.4 -0.688 64.8 133.7-166.5 110.9 81.1 6.5 25.7 66 74 A A E -h 124 0B 0 57,-1.5 59,-2.4 246,-0.3 2,-0.9 -0.986 45.5-128.1-154.7 144.8 83.7 9.3 25.8 67 75 A H E > -h 125 0B 6 246,-0.4 3,-1.7 -2,-0.3 59,-0.2 -0.846 18.4-168.2 -99.2 102.5 85.0 11.7 28.5 68 76 A A G > S+ 0 0 0 57,-1.7 3,-1.3 -2,-0.9 58,-0.2 0.875 84.9 57.8 -55.3 -41.1 84.7 15.2 26.9 69 77 A S G 3 S+ 0 0 0 56,-0.8 -1,-0.3 57,-0.3 3,-0.2 0.470 97.2 62.4 -71.2 -5.0 86.9 16.7 29.7 70 78 A Q G X + 0 0 1 -3,-1.7 3,-1.5 1,-0.2 -1,-0.2 0.318 65.1 113.8-104.6 8.2 89.8 14.4 29.0 71 79 A Y G X S+ 0 0 7 -3,-1.3 3,-1.5 1,-0.3 -1,-0.2 0.823 71.2 58.3 -46.6 -43.5 90.5 15.6 25.4 72 80 A K G 3 S+ 0 0 16 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.798 99.2 57.6 -61.9 -31.1 93.8 17.2 26.3 73 81 A N G X S+ 0 0 19 -3,-1.5 3,-2.3 2,-0.1 -1,-0.3 0.299 73.9 138.2 -84.4 10.9 95.3 13.8 27.6 74 82 A L T < S- 0 0 4 -3,-1.5 243,-0.1 1,-0.3 748,-0.1 -0.379 81.5 -0.1 -59.3 123.1 94.7 12.2 24.2 75 83 A G T 3 S+ 0 0 0 239,-0.5 2,-0.3 1,-0.2 -1,-0.3 0.555 118.0 102.4 73.9 8.1 97.7 10.0 23.4 76 84 A I < + 0 0 5 -3,-2.3 -1,-0.2 1,-0.2 13,-0.0 -0.847 69.6 13.1-124.0 158.0 99.4 11.1 26.6 77 85 A G + 0 0 4 -2,-0.3 3,-0.2 1,-0.1 -1,-0.2 0.892 64.3 143.8 45.6 62.5 100.0 9.5 30.0 78 86 A M + 0 0 7 -3,-0.2 -1,-0.1 1,-0.1 7,-0.0 -0.398 36.1 103.4-122.7 53.3 99.1 5.9 29.4 79 87 A D S S+ 0 0 55 2,-0.1 2,-0.3 6,-0.0 -1,-0.1 0.183 71.1 66.5-116.1 12.0 101.8 4.3 31.7 80 88 A K S S- 0 0 99 -3,-0.2 2,-0.1 2,-0.0 0, 0.0 -0.938 81.0-105.9-136.4 158.6 99.4 3.4 34.5 81 89 A E > - 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0 0 19 -3,-0.2 -1,-0.2 1,-0.1 5,-0.1 -0.567 57.1 -88.0 -97.3 161.5 87.8 11.7 45.5 159 167 A P > - 0 0 20 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.320 36.1-114.9 -66.6 152.3 90.7 14.1 45.6 160 168 A D T 3 S+ 0 0 162 1,-0.3 3,-0.4 2,-0.1 -2,-0.0 0.761 117.2 50.4 -57.4 -28.3 90.4 17.4 47.5 161 169 A Y T 3 S+ 0 0 107 1,-0.2 -1,-0.3 0, 0.0 2,-0.1 0.514 118.9 36.9 -89.5 -6.0 90.7 19.3 44.3 162 170 A L S < S+ 0 0 1 -3,-1.7 2,-0.3 2,-0.0 -1,-0.2 -0.516 92.9 96.3-146.1 71.7 88.1 17.3 42.5 163 171 A T - 0 0 58 -3,-0.4 2,-0.3 -5,-0.1 -8,-0.2 -0.910 44.3-160.3-148.4 172.6 85.2 16.3 44.8 164 172 A E - 0 0 27 -10,-0.4 2,-0.4 -2,-0.3 -6,-0.1 -0.976 26.5-102.6-155.2 165.7 81.8 17.5 45.8 165 173 A N > - 0 0 87 -2,-0.3 4,-2.9 1,-0.1 3,-0.3 -0.779 29.9-131.2 -92.5 135.8 79.0 17.3 48.4 166 174 A Y H > S+ 0 0 89 -2,-0.4 4,-2.1 1,-0.2 5,-0.2 0.792 106.0 58.1 -58.8 -27.7 76.1 15.0 47.5 167 175 A I H > S+ 0 0 87 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.946 112.6 37.9 -66.8 -48.3 73.6 17.8 48.4 168 176 A T H > S+ 0 0 70 -3,-0.3 4,-3.5 2,-0.2 5,-0.3 0.918 113.0 58.5 -67.7 -44.2 75.1 20.2 45.9 169 177 A S H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.919 109.6 43.5 -51.5 -49.4 75.7 17.5 43.4 170 178 A L H X S+ 0 0 31 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.903 114.3 49.0 -65.6 -43.7 72.0 16.6 43.4 171 179 A N H X S+ 0 0 96 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.927 113.9 47.0 -62.5 -43.3 70.8 20.2 43.3 172 180 A D H X S+ 0 0 26 -4,-3.5 4,-2.3 2,-0.2 -2,-0.2 0.919 112.6 50.0 -63.4 -43.3 73.2 20.9 40.4 173 181 A T H X S+ 0 0 10 -4,-2.6 4,-2.6 -5,-0.3 -2,-0.2 0.969 113.6 43.7 -59.5 -55.3 72.1 17.8 38.6 174 182 A E H X S+ 0 0 50 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.880 111.5 55.4 -58.9 -38.4 68.4 18.6 38.9 175 183 A E H X S+ 0 0 84 -4,-2.5 4,-1.7 -5,-0.3 -1,-0.2 0.925 109.9 46.2 -60.4 -43.8 69.1 22.2 38.0 176 184 A I H X S+ 0 0 7 -4,-2.3 4,-2.0 2,-0.2 5,-0.3 0.925 110.6 53.8 -64.3 -43.9 70.8 21.0 34.8 177 185 A I H X S+ 0 0 3 -4,-2.6 4,-3.0 1,-0.2 3,-0.3 0.944 109.1 47.1 -55.1 -53.0 67.9 18.6 34.0 178 186 A L H < S+ 0 0 97 -4,-2.6 4,-0.3 1,-0.2 -1,-0.2 0.838 112.0 52.0 -60.4 -34.3 65.2 21.3 34.3 179 187 A K H < S+ 0 0 90 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.837 126.4 19.3 -73.1 -32.8 67.3 23.6 32.1 180 188 A Y H >X S+ 0 0 0 -4,-2.0 3,-0.7 -3,-0.3 4,-0.6 0.556 91.0 97.1-117.7 -8.9 67.8 21.2 29.2 181 189 A K T 3< S+ 0 0 76 -4,-3.0 -3,-0.1 -5,-0.3 -2,-0.1 0.824 107.4 17.9 -51.7 -35.2 65.2 18.4 29.5 182 190 A D T 34 S+ 0 0 129 -4,-0.3 -1,-0.2 -5,-0.2 -2,-0.1 0.306 106.4 87.6-121.1 8.6 63.0 20.1 26.9 183 191 A K T <4 S+ 0 0 110 -3,-0.7 2,-0.3 1,-0.1 -2,-0.1 0.998 92.1 22.2 -71.5 -71.6 65.3 22.5 25.2 184 192 A S < - 0 0 25 -4,-0.6 -1,-0.1 3,-0.5 -43,-0.0 -0.685 61.7-144.4 -99.7 154.3 67.0 20.6 22.3 185 193 A N S S+ 0 0 143 -2,-0.3 3,-0.1 1,-0.1 -1,-0.1 0.618 100.6 30.1 -90.0 -14.1 65.7 17.5 20.6 186 194 A I S S+ 0 0 34 1,-0.2 -39,-3.2 -41,-0.1 2,-0.6 0.537 109.3 65.1-121.5 -11.4 69.1 16.0 20.1 187 195 A V E S+j 147 0B 0 -41,-0.3 -3,-0.5 -7,-0.1 -39,-0.2 -0.945 70.3 162.6-115.1 108.5 71.3 17.2 23.0 188 196 A K E -j 148 0B 71 -41,-2.8 -39,-2.9 -2,-0.6 2,-0.2 -0.851 38.0-104.1-128.5 161.5 69.9 15.8 26.2 189 197 A P E -j 149 0B 5 0, 0.0 2,-0.3 0, 0.0 -39,-0.2 -0.493 29.7-168.7 -82.4 152.1 70.9 15.2 29.9 190 198 A I - 0 0 8 -41,-1.6 2,-0.3 -2,-0.2 28,-0.2 -0.993 30.3-108.9-143.0 133.9 71.8 11.8 31.2 191 199 A I B -l 218 0D 2 26,-2.3 28,-2.2 -2,-0.3 -41,-0.1 -0.480 40.1-173.5 -65.0 123.7 72.3 10.7 34.8 192 200 A T E +k 152 0C 0 -41,-0.5 -39,-2.4 -2,-0.3 2,-0.3 -0.585 18.7 173.9-128.7 74.3 76.0 10.2 35.3 193 201 A P E -k 153 0C 0 0, 0.0 28,-0.2 0, 0.0 -39,-0.2 -0.632 36.3-133.3 -72.3 136.5 77.4 8.7 38.6 194 202 A R - 0 0 5 -41,-2.6 27,-0.7 -2,-0.3 2,-0.2 0.918 65.3 -62.9 -56.8 -45.3 81.1 8.3 37.8 195 203 A F > - 0 0 9 -42,-0.3 3,-3.0 25,-0.2 4,-0.5 -0.769 53.7 -79.3 164.9 154.9 81.0 4.8 39.3 196 204 A V G > S+ 0 0 0 25,-0.4 3,-1.8 1,-0.3 -1,-0.1 0.806 121.2 56.3 -35.5 -55.1 80.3 2.9 42.6 197 205 A P G 3 S+ 0 0 11 0, 0.0 -1,-0.3 0, 0.0 3,-0.0 0.589 113.1 44.6 -61.4 -6.3 83.8 3.5 44.2 198 206 A S G < S+ 0 0 8 -3,-3.0 -42,-2.6 -45,-0.1 -43,-1.6 0.377 102.7 74.0-116.2 1.3 83.2 7.3 43.7 199 207 A C < - 0 0 4 -3,-1.8 -1,-0.1 -4,-0.5 2,-0.1 -0.963 66.4-140.8-125.7 132.7 79.6 7.6 44.9 200 208 A S > - 0 0 16 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.314 31.9-110.6 -76.8 166.6 78.1 7.5 48.4 201 209 A N H > S+ 0 0 65 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.893 119.6 58.0 -65.6 -38.2 74.7 5.8 49.0 202 210 A E H > S+ 0 0 101 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.945 110.2 43.0 -54.6 -51.3 73.2 9.2 49.6 203 211 A L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.960 113.9 49.0 -61.2 -54.6 74.3 10.4 46.2 204 212 A M H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.868 111.5 49.3 -56.9 -39.2 73.3 7.2 44.3 205 213 A D H X S+ 0 0 74 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.913 112.1 49.1 -67.6 -39.6 69.8 7.1 45.9 206 214 A G H X S+ 0 0 11 -4,-1.9 4,-1.7 -5,-0.3 -2,-0.2 0.867 112.5 47.4 -65.9 -36.8 69.3 10.7 45.0 207 215 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.881 109.0 54.5 -70.7 -38.4 70.4 10.1 41.4 208 216 A G H X S+ 0 0 10 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.897 108.1 50.0 -60.8 -39.7 68.1 7.1 41.3 209 217 A K H X S+ 0 0 139 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.886 110.2 50.0 -66.0 -39.4 65.2 9.3 42.3 210 218 A L H X S+ 0 0 9 -4,-1.7 4,-2.6 2,-0.2 6,-0.3 0.922 108.3 52.1 -65.7 -44.0 66.1 11.9 39.6 211 219 A S H X>S+ 0 0 2 -4,-2.7 5,-1.9 2,-0.2 4,-0.6 0.937 115.9 41.1 -57.0 -48.5 66.3 9.2 36.9 212 220 A Y H ><5S+ 0 0 191 -4,-2.0 3,-1.0 3,-0.2 -2,-0.2 0.965 114.6 51.2 -63.3 -54.5 62.8 7.9 37.9 213 221 A K H 3<5S+ 0 0 126 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.837 124.7 27.4 -52.9 -41.7 61.3 11.4 38.4 214 222 A Y H 3<5S- 0 0 37 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.296 103.7-123.6-106.6 8.3 62.4 12.7 35.0 215 223 A R T <<5 + 0 0 208 -3,-1.0 -3,-0.2 -4,-0.6 -4,-0.1 0.922 53.5 167.2 48.6 53.0 62.5 9.4 33.2 216 224 A L < - 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0 0 15 -3,-1.5 3,-0.1 -6,-0.2 -3,-0.1 -0.769 58.1-159.8-100.3 141.9 76.9 -7.1 47.0 240 248 A N S S+ 0 0 141 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.666 80.4 4.5 -88.1 -19.8 77.7 -10.3 45.1 241 249 A F S >> S- 0 0 29 1,-0.1 3,-1.4 27,-0.1 4,-0.7 -0.989 78.6 -97.8-163.5 157.0 78.8 -8.3 42.1 242 250 A Y H >> S+ 0 0 6 -2,-0.3 3,-1.1 1,-0.3 4,-0.7 0.864 115.0 48.3 -39.0 -63.5 79.5 -4.8 40.7 243 251 A G H 3> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.671 95.5 74.5 -59.8 -20.2 76.3 -4.2 38.8 244 252 A E H <> S+ 0 0 60 -3,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.885 92.5 53.8 -61.8 -39.6 74.1 -5.2 41.8 245 253 A V H <>S+ 0 0 0 -4,-0.7 5,-2.2 1,-0.2 3,-1.0 0.945 111.2 49.9 -62.9 -46.5 73.7 0.2 40.7 247 255 A D H ><5S+ 0 0 58 -4,-2.0 3,-1.8 1,-0.3 5,-0.2 0.857 99.9 64.5 -59.6 -38.4 70.5 -1.8 40.5 248 256 A K H 3<5S+ 0 0 118 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.824 108.6 41.6 -55.5 -31.8 69.9 -1.4 44.2 249 257 A F T <<5S- 0 0 19 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.327 121.3-104.2-100.0 6.7 69.5 2.3 43.6 250 258 A G T < 5S+ 0 0 16 -3,-1.8 -3,-0.2 -4,-0.2 3,-0.1 0.817 90.4 115.5 76.1 31.2 67.5 2.1 40.3 251 259 A L < + 0 0 1 -5,-2.2 -4,-0.2 1,-0.1 -3,-0.1 -0.089 53.1 79.1-121.0 33.0 70.4 2.9 38.1 252 260 A F S S- 0 0 0 -6,-0.2 -1,-0.1 -5,-0.2 26,-0.1 -0.289 116.4 -37.0-138.4 54.0 70.7 -0.4 36.2 253 261 A G S S+ 0 0 18 2,-0.3 4,-0.1 -3,-0.1 -2,-0.1 0.290 92.8 114.8 118.4 -14.7 68.1 -0.6 33.5 254 262 A N S S+ 0 0 115 2,-0.1 -3,-0.1 -7,-0.0 3,-0.0 0.863 99.4 15.9 -56.3 -33.1 64.9 1.0 34.7 255 263 A T S S- 0 0 19 -5,-0.1 -2,-0.3 -39,-0.1 -37,-0.2 -0.827 124.7 -57.8-128.7 165.0 65.6 3.5 31.9 256 264 A P - 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0 0 41 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.179 28.2 -98.8 -73.3 171.9 80.8 -12.3 36.3 267 275 A K H > S+ 0 0 93 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.914 125.3 47.2 -58.4 -44.4 78.1 -14.7 35.1 268 276 A E H > S+ 0 0 102 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.895 110.1 51.0 -65.6 -43.2 75.5 -13.1 37.4 269 277 A E H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.894 111.2 50.5 -61.4 -38.3 76.4 -9.6 36.4 270 278 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.920 110.3 48.3 -64.6 -46.1 76.1 -10.6 32.8 271 279 A N H X S+ 0 0 61 -4,-2.3 4,-3.6 2,-0.2 -2,-0.2 0.893 111.7 50.1 -62.4 -40.5 72.7 -12.2 33.4 272 280 A L H X S+ 0 0 13 -4,-2.6 4,-3.4 2,-0.2 5,-0.2 0.926 108.2 52.4 -64.1 -44.2 71.5 -9.0 35.2 273 281 A I H <>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 4,-0.4 0.940 115.2 42.8 -54.7 -48.0 72.7 -6.9 32.4 274 282 A K H ><5S+ 0 0 101 -4,-2.4 3,-1.1 3,-0.2 -2,-0.2 0.948 115.2 49.1 -62.1 -51.3 70.7 -9.1 30.0 275 283 A R H 3<5S+ 0 0 162 -4,-3.6 -2,-0.2 1,-0.3 -3,-0.2 0.920 115.9 41.0 -56.0 -50.3 67.7 -9.2 32.4 276 284 A N T 3<5S- 0 0 34 -4,-3.4 -1,-0.3 -5,-0.1 -2,-0.2 0.405 110.4-121.0 -82.0 2.8 67.5 -5.4 33.0 277 285 A N T < 5 + 0 0 102 -3,-1.1 -20,-0.4 -4,-0.4 2,-0.2 0.910 49.1 172.1 58.4 45.1 68.2 -4.7 29.3 278 286 A V < - 0 0 1 -5,-2.8 28,-0.6 -6,-0.2 2,-0.5 -0.575 30.3-125.8 -83.6 148.0 71.4 -2.7 30.1 279 287 A T E -no 258 306D 15 -22,-3.1 -20,-2.7 -2,-0.2 2,-0.5 -0.861 16.4-145.3-100.5 126.5 73.6 -1.7 27.1 280 288 A I E -no 259 307D 0 26,-3.1 28,-2.9 -2,-0.5 2,-0.8 -0.766 6.0-148.8 -90.5 128.6 77.3 -2.6 27.3 281 289 A V E -no 260 308D 0 -22,-2.5 -20,-2.6 -2,-0.5 2,-0.5 -0.859 10.2-151.6-101.0 106.9 79.7 -0.1 25.7 282 290 A H E + o 0 309D 0 26,-3.2 28,-2.1 -2,-0.8 -218,-0.1 -0.656 16.1 179.9 -78.7 119.7 82.7 -1.9 24.3 283 291 A C > + 0 0 0 -2,-0.5 4,-2.1 26,-0.2 3,-0.4 -0.603 7.4 168.5-122.1 71.3 85.7 0.3 24.4 284 292 A P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.808 73.5 53.0 -53.3 -40.8 88.6 -1.8 22.9 285 293 A T H > S+ 0 0 0 25,-0.3 4,-2.7 1,-0.2 5,-0.2 0.911 111.8 47.5 -65.2 -39.6 91.2 0.9 22.4 286 294 A S H > S+ 0 0 0 -3,-0.4 4,-2.5 24,-0.2 6,-0.3 0.911 108.2 54.8 -65.0 -43.0 90.8 1.9 26.1 287 295 A N H <>S+ 0 0 0 -4,-2.1 5,-1.6 1,-0.2 6,-0.9 0.870 113.1 43.4 -59.3 -38.4 91.0 -1.7 27.2 288 296 A F H ><5S+ 0 0 2 -4,-1.9 3,-1.0 3,-0.2 -2,-0.2 0.963 113.6 49.1 -71.4 -53.6 94.4 -2.0 25.4 289 297 A N H 3<5S+ 0 0 2 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.840 118.9 37.4 -57.4 -38.9 95.9 1.3 26.5 290 298 A L T 3<5S- 0 0 3 -4,-2.5 -208,-0.4 -5,-0.2 -1,-0.3 0.463 106.6-123.3 -93.4 -0.4 95.1 0.9 30.2 291 299 A G T < 5 + 0 0 1 -3,-1.0 -3,-0.2 -4,-0.3 -4,-0.1 0.856 62.3 146.2 62.1 35.1 95.8 -2.9 30.1 292 300 A S < - 0 0 2 -5,-1.6 2,-0.3 -6,-0.3 -66,-0.3 0.909 58.6-100.0 -69.4 -44.5 92.3 -3.5 31.5 293 301 A G - 0 0 1 -6,-0.9 2,-0.5 -9,-0.1 -1,-0.3 -0.890 37.1 -71.7 146.3-174.3 91.8 -6.8 29.6 294 302 A M - 0 0 12 -2,-0.3 0, 0.0 -31,-0.1 0, 0.0 -0.959 42.1-131.2-122.7 117.4 90.0 -8.0 26.5 295 303 A M - 0 0 0 -2,-0.5 2,-1.6 1,-0.1 3,-0.2 -0.387 11.4-132.1 -68.9 135.0 86.2 -8.2 26.4 296 304 A P > + 0 0 23 0, 0.0 4,-1.5 0, 0.0 3,-0.3 -0.584 35.6 169.7 -86.0 76.2 84.5 -11.4 25.2 297 305 A V H > S+ 0 0 1 -2,-1.6 4,-2.8 1,-0.2 5,-0.2 0.856 70.7 54.2 -58.1 -43.3 82.1 -9.7 22.8 298 306 A R H > S+ 0 0 38 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.891 105.6 55.1 -61.2 -38.3 80.8 -12.9 21.0 299 307 A K H > S+ 0 0 79 -3,-0.3 4,-0.9 1,-0.2 -1,-0.2 0.910 112.2 43.0 -60.0 -42.8 80.0 -14.4 24.4 300 308 A Y H <>S+ 0 0 1 -4,-1.5 5,-2.0 1,-0.2 3,-0.5 0.903 113.5 50.6 -70.4 -42.6 77.8 -11.3 25.2 301 309 A L H ><5S+ 0 0 50 -4,-2.8 3,-1.3 1,-0.2 -2,-0.2 0.826 104.4 58.6 -65.5 -31.6 76.2 -11.2 21.7 302 310 A N H 3<5S+ 0 0 112 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.828 104.2 52.6 -66.9 -28.2 75.4 -14.9 21.9 303 311 A L T 3<5S- 0 0 66 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.420 119.4-111.4 -85.5 0.2 73.4 -14.1 25.1 304 312 A G T < 5 + 0 0 40 -3,-1.3 -3,-0.2 1,-0.2 2,-0.1 0.630 62.3 158.6 79.5 13.4 71.4 -11.3 23.2 305 313 A I < - 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