==== 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 TRANSFERASE 28-MAR-07 2ENI . COMPND 2 MOLECULE: DIPHTHINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR K.SHIMIZU,RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (R . 531 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21568.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 379 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 2 0.4 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 . 39 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 129 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 3.0 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 0 0 1 4 1 1 5 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 4 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 PARALLEL BRIDGES PER LADDER . 5 2 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 M 0 0 101 0, 0.0 106,-1.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 44.7 56.4 98.2 57.3 2 2 A V E -ab 79 107A 22 76,-1.4 78,-3.1 104,-0.2 2,-0.5 -0.930 360.0-153.8-129.5 147.9 52.9 98.7 58.5 3 3 A L E -ab 80 108A 0 104,-3.1 106,-2.3 -2,-0.3 2,-0.5 -0.978 14.3-161.1-118.5 124.4 50.1 96.7 60.2 4 4 A Y E -ab 81 109A 32 76,-3.2 78,-3.2 -2,-0.5 2,-0.8 -0.929 8.8-158.2-110.6 121.0 46.5 97.6 59.5 5 5 A F E -ab 82 110A 0 104,-3.0 106,-3.0 -2,-0.5 2,-0.5 -0.875 24.7-176.1 -94.3 108.3 43.7 96.5 61.9 6 6 A I E -ab 83 111A 0 76,-2.4 78,-1.5 -2,-0.8 2,-0.2 -0.935 18.0-142.3-116.1 122.4 40.6 96.8 59.6 7 7 A G E -a 84 0A 0 104,-2.5 10,-0.5 -2,-0.5 80,-0.2 -0.552 3.7-159.7 -79.8 143.0 37.1 96.2 60.8 8 8 A L - 0 0 3 76,-2.8 7,-0.4 78,-0.4 3,-0.2 0.498 38.6-128.8 -99.0 -7.1 34.7 94.4 58.4 9 9 A G B -E 86 0B 0 77,-1.5 77,-3.3 75,-0.3 -1,-0.3 -0.346 32.4 -49.2 95.9-174.5 31.5 95.5 60.0 10 10 A L S S- 0 0 2 75,-0.2 30,-0.4 5,-0.1 -1,-0.1 0.855 109.5 -7.7 -73.8 -47.0 28.2 93.9 61.2 11 11 A Y S S+ 0 0 57 1,-0.3 30,-2.0 28,-0.2 31,-0.3 0.760 113.4 14.6-126.3 -53.3 26.7 91.6 58.6 12 12 A D S > S- 0 0 20 29,-0.2 3,-2.1 198,-0.1 -1,-0.3 -0.748 81.1 -89.5-126.3 176.2 28.2 91.3 55.1 13 13 A E G > S+ 0 0 34 1,-0.3 3,-0.7 28,-0.2 271,-0.1 0.638 117.7 66.4 -61.5 -14.0 31.4 92.3 53.2 14 14 A R G 3 S+ 0 0 62 1,-0.2 271,-3.0 270,-0.1 272,-0.3 0.488 79.1 79.2 -87.4 -0.4 29.9 95.7 52.3 15 15 A D G < S+ 0 0 0 -3,-2.1 -1,-0.2 -7,-0.4 -5,-0.1 0.482 70.9 105.4 -82.6 -2.1 29.8 96.9 55.9 16 16 A I S < S- 0 0 2 -3,-0.7 268,-2.6 -4,-0.1 269,-0.3 -0.452 81.9-109.0 -72.4 149.5 33.5 97.6 55.6 17 17 A T B > -F 283 0C 2 -10,-0.5 4,-2.4 95,-0.3 266,-0.3 -0.546 19.5-119.1 -81.8 151.4 34.3 101.3 55.3 18 18 A V H > S+ 0 0 8 264,-2.6 4,-2.6 1,-0.2 5,-0.3 0.912 119.1 55.5 -52.5 -43.0 35.4 102.7 51.9 19 19 A K H > S+ 0 0 2 261,-3.0 4,-1.9 263,-0.4 -1,-0.2 0.940 108.7 48.3 -54.5 -47.4 38.6 103.7 53.7 20 20 A G H > S+ 0 0 0 260,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.874 110.8 48.8 -61.8 -41.7 39.0 100.1 54.8 21 21 A L H X S+ 0 0 17 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.928 111.2 49.1 -66.3 -45.4 38.4 98.6 51.3 22 22 A E H X S+ 0 0 93 -4,-2.6 4,-0.6 2,-0.2 -1,-0.2 0.863 114.7 44.3 -63.6 -37.3 40.9 100.9 49.6 23 23 A I H >< S+ 0 0 18 -4,-1.9 3,-0.8 -5,-0.3 -1,-0.2 0.915 113.4 50.0 -74.3 -41.8 43.6 100.3 52.1 24 24 A A H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.884 103.1 61.7 -62.6 -38.4 43.1 96.5 52.2 25 25 A K H 3< S+ 0 0 96 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.773 108.4 43.6 -58.4 -28.1 43.1 96.4 48.4 26 26 A K T << S+ 0 0 160 -3,-0.8 2,-0.3 -4,-0.6 -1,-0.3 0.259 87.1 113.1-103.2 10.0 46.7 97.6 48.4 27 27 A C < - 0 0 0 -3,-1.6 53,-0.2 -4,-0.2 3,-0.1 -0.625 60.8-143.3 -84.7 143.1 48.1 95.5 51.2 28 28 A D S S+ 0 0 86 51,-1.7 2,-0.4 -2,-0.3 52,-0.2 0.914 87.3 24.7 -69.5 -43.2 50.7 92.9 50.4 29 29 A Y E -c 80 0A 110 50,-1.6 52,-2.6 24,-0.1 2,-0.5 -0.982 68.4-161.5-128.4 135.9 49.4 90.4 52.9 30 30 A V E +cd 81 55A 7 24,-0.5 26,-2.1 -2,-0.4 2,-0.2 -0.957 12.0 175.1-122.6 117.6 45.9 90.0 54.4 31 31 A F E +cd 82 56A 10 50,-3.3 52,-2.8 -2,-0.5 2,-0.3 -0.700 6.1 173.0-110.8 166.5 45.1 88.1 57.5 32 32 A A E -cd 83 57A 0 24,-1.7 26,-3.2 50,-0.3 2,-0.3 -0.986 21.1-147.3-167.6 160.9 41.8 87.8 59.4 33 33 A E E - d 0 58A 0 50,-1.7 26,-0.1 -2,-0.3 24,-0.0 -0.981 5.8-174.2-135.6 146.4 39.9 86.1 62.2 34 34 A F + 0 0 57 24,-0.5 5,-0.1 -2,-0.3 50,-0.1 -0.195 65.3 87.1-133.8 42.3 36.3 85.1 62.4 35 35 A Y S S+ 0 0 17 23,-0.1 135,-0.4 3,-0.1 3,-0.1 0.582 73.9 65.7-114.9 -17.6 35.9 83.9 66.0 36 36 A T S S- 0 0 14 1,-0.2 2,-0.3 133,-0.1 -2,-0.1 0.709 118.7 -7.5 -79.0 -18.8 35.2 87.1 67.9 37 37 A S S S- 0 0 3 496,-0.1 2,-0.5 49,-0.0 -1,-0.2 -0.980 71.5-105.0-165.5 167.8 31.9 87.6 66.2 38 38 A L - 0 0 34 -2,-0.3 2,-1.2 -3,-0.1 3,-0.1 -0.911 13.0-162.6-112.4 120.0 29.6 86.2 63.4 39 39 A M > - 0 0 14 -2,-0.5 3,-1.2 1,-0.2 -28,-0.2 -0.779 15.6-177.0 -95.9 90.5 29.1 88.0 60.1 40 40 A A T 3 + 0 0 41 -2,-1.2 -1,-0.2 -30,-0.4 -28,-0.1 0.652 70.0 57.5 -65.0 -20.0 25.9 86.1 59.0 41 41 A G T 3 S+ 0 0 13 -30,-2.0 2,-0.3 -3,-0.1 -1,-0.2 0.228 103.6 43.5-101.2 16.8 25.5 87.8 55.6 42 42 A T < - 0 0 22 -3,-1.2 2,-0.3 -31,-0.3 -3,-0.1 -0.856 60.4-137.9-146.4-178.7 28.8 86.9 53.9 43 43 A T > - 0 0 74 -2,-0.3 4,-1.7 1,-0.1 5,-0.2 -0.910 34.9-107.4-139.0 164.6 31.5 84.3 53.2 44 44 A L H > S+ 0 0 65 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.884 119.9 55.3 -61.4 -37.4 35.3 84.3 53.1 45 45 A G H > S+ 0 0 41 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.914 105.1 50.1 -62.0 -45.1 35.1 84.0 49.4 46 46 A R H > S+ 0 0 133 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.865 111.6 49.1 -62.7 -36.8 32.9 87.1 49.0 47 47 A I H X S+ 0 0 3 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.928 113.1 46.9 -68.3 -44.7 35.3 89.1 51.2 48 48 A Q H X>S+ 0 0 54 -4,-2.5 4,-2.6 1,-0.2 5,-0.8 0.909 111.5 51.3 -62.2 -42.4 38.3 87.9 49.1 49 49 A K H <5S+ 0 0 184 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.905 113.1 46.0 -61.4 -41.3 36.5 88.7 45.9 50 50 A L H <5S+ 0 0 47 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.863 119.1 38.9 -70.6 -38.2 35.8 92.2 47.2 51 51 A I H <5S- 0 0 5 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.719 98.5-134.9 -86.1 -22.0 39.3 92.9 48.4 52 52 A G T <5 + 0 0 61 -4,-2.6 2,-0.3 1,-0.3 -3,-0.2 0.722 70.0 100.3 74.7 21.3 41.0 91.1 45.5 53 53 A K S - 0 0 36 -2,-0.3 4,-2.0 -26,-0.1 5,-0.2 -0.462 34.8-100.0 -93.0 170.1 42.4 80.8 64.9 60 60 A R H > S+ 0 0 106 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.886 127.1 49.8 -57.4 -38.1 42.2 82.2 68.4 61 61 A E H >>S+ 0 0 126 1,-0.2 4,-2.0 2,-0.2 5,-1.0 0.898 105.0 56.4 -68.2 -40.5 45.4 80.4 69.3 62 62 A D H >5S+ 0 0 40 3,-0.2 4,-0.8 2,-0.2 7,-0.2 0.906 118.9 34.0 -57.1 -40.7 47.1 81.7 66.2 63 63 A V H X5S+ 0 0 1 -4,-2.0 4,-1.7 3,-0.2 5,-0.2 0.983 119.7 44.0 -77.5 -66.5 46.4 85.2 67.4 64 64 A E H <5S+ 0 0 71 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.2 0.788 132.5 22.0 -52.8 -32.3 46.5 85.1 71.2 65 65 A L H <5S+ 0 0 102 -4,-2.0 -1,-0.2 -5,-0.3 -3,-0.2 0.780 135.5 24.0-107.9 -34.3 49.7 83.0 71.1 66 66 A N H >XS+ 0 0 0 -4,-1.7 4,-2.7 1,-0.3 5,-1.4 0.937 84.9 48.6 -54.6 -48.4 50.4 86.9 66.3 68 68 A E H 345S+ 0 0 72 -5,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.507 114.9 46.3 -71.0 -4.6 54.0 88.1 66.5 69 69 A N H <45S+ 0 0 102 -3,-1.6 -1,-0.2 -7,-0.2 -2,-0.2 0.601 124.4 28.8-108.9 -21.1 55.2 84.9 64.9 70 70 A I H <5S+ 0 0 30 -4,-2.0 4,-0.3 -3,-0.4 -2,-0.2 0.817 134.2 17.1-106.0 -45.6 52.7 84.8 62.1 71 71 A V T >X5S+ 0 0 0 -4,-2.7 4,-1.4 -5,-0.4 3,-0.9 0.920 115.9 55.4 -96.7 -58.4 51.6 88.3 61.3 72 72 A L H 3>4 S+ 0 0 59 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.891 106.8 42.2 -49.4 -46.3 57.2 89.4 60.9 74 74 A L H X> S+ 0 0 54 -3,-0.9 3,-1.4 -4,-0.3 4,-0.9 0.819 104.6 67.2 -70.4 -30.8 55.8 90.2 57.5 75 75 A A H 3< S+ 0 0 0 -4,-1.4 32,-0.2 1,-0.3 -1,-0.2 0.668 89.6 65.2 -64.4 -17.4 54.6 93.6 58.7 76 76 A K T << S+ 0 0 92 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.2 0.751 117.8 23.5 -77.8 -22.5 58.3 94.6 59.1 77 77 A E T <4 S+ 0 0 155 -3,-1.4 2,-0.3 -4,-0.3 -2,-0.2 0.294 126.6 35.0-124.0 6.8 58.9 94.4 55.3 78 78 A N S < S- 0 0 42 -4,-0.9 -76,-1.4 -76,-0.1 2,-0.8 -0.919 82.7 -93.6-151.5 175.6 55.3 94.8 54.0 79 79 A D E -a 2 0A 55 -2,-0.3 -51,-1.7 -78,-0.2 -50,-1.6 -0.884 51.9-176.4 -96.3 111.3 51.9 96.5 54.2 80 80 A V E -ac 3 29A 0 -78,-3.1 -76,-3.2 -2,-0.8 2,-0.4 -0.900 14.6-159.3-117.2 143.2 49.9 93.9 56.2 81 81 A A E -ac 4 30A 0 -52,-2.6 -50,-3.3 -2,-0.4 2,-0.5 -0.908 4.9-163.2-119.7 147.5 46.2 93.9 57.1 82 82 A F E -ac 5 31A 0 -78,-3.2 -76,-2.4 -2,-0.4 -50,-0.3 -0.982 18.4-158.7-128.0 113.6 44.5 92.0 59.9 83 83 A L E +ac 6 32A 0 -52,-2.8 -50,-1.7 -2,-0.5 -76,-0.2 -0.681 14.1 173.2 -97.2 151.5 40.7 91.9 59.4 84 84 A T E -a 7 0A 0 -78,-1.5 -76,-2.8 -2,-0.3 -75,-0.3 -0.965 37.1 -92.5-148.9 160.8 38.0 91.3 62.0 85 85 A P S S- 0 0 0 0, 0.0 -75,-0.2 0, 0.0 28,-0.1 -0.337 92.2 -12.0 -70.7 162.1 34.2 91.3 62.3 86 86 A G B S-E 9 0B 1 -77,-3.3 -77,-1.5 -79,-0.1 -78,-0.4 -0.102 129.4 -15.3 46.6-140.1 32.6 94.5 63.5 87 87 A D > - 0 0 0 446,-2.7 3,-1.4 -80,-0.2 25,-0.1 -0.828 68.3-132.4 -93.9 132.2 35.1 97.0 64.9 88 88 A P T 3 S+ 0 0 0 0, 0.0 6,-0.4 0, 0.0 -1,-0.1 0.658 100.4 42.0 -58.8 -20.1 38.5 95.3 65.7 89 89 A L T 3 S+ 0 0 9 444,-0.1 2,-0.6 5,-0.1 3,-0.3 0.243 88.5 101.5-114.9 14.3 38.9 96.8 69.2 90 90 A V S < S- 0 0 0 -3,-1.4 3,-0.1 1,-0.2 -3,-0.1 -0.883 102.1 -15.9-104.1 118.8 35.4 96.5 70.5 91 91 A A S S+ 0 0 42 -2,-0.6 2,-0.3 1,-0.2 -1,-0.2 0.891 118.0 93.6 57.5 41.4 34.7 93.6 72.9 92 92 A T S S- 0 0 26 -3,-0.3 -1,-0.2 441,-0.1 3,-0.1 -0.812 79.6-123.8-143.1-178.4 38.0 91.8 71.9 93 93 A T S > S+ 0 0 85 -2,-0.3 3,-1.2 1,-0.1 4,-0.4 0.169 77.1 112.4-117.2 14.9 41.5 91.8 73.2 94 94 A H G >> + 0 0 0 -6,-0.4 3,-0.9 1,-0.3 4,-0.5 0.671 59.5 76.9 -62.1 -18.5 43.0 92.9 69.9 95 95 A A G >4 S+ 0 0 18 1,-0.3 3,-1.6 2,-0.2 4,-0.5 0.904 89.1 57.0 -58.1 -42.2 44.0 96.2 71.5 96 96 A E G X> S+ 0 0 50 -3,-1.2 4,-1.3 1,-0.3 3,-0.9 0.739 92.8 70.2 -61.4 -24.3 46.9 94.5 73.2 97 97 A L H <> S+ 0 0 2 -3,-0.9 4,-2.1 -4,-0.4 -1,-0.3 0.789 88.2 62.6 -66.3 -25.6 48.1 93.4 69.8 98 98 A R H S+ 0 0 3 -3,-0.9 4,-2.5 -4,-0.5 -1,-0.2 0.889 106.5 50.2 -72.5 -40.1 51.5 96.7 71.9 100 100 A R H X S+ 0 0 39 -4,-1.3 4,-0.8 1,-0.2 -2,-0.2 0.887 110.3 51.8 -63.1 -38.0 53.1 93.6 70.4 101 101 A A H ><>S+ 0 0 0 -4,-2.1 5,-2.8 2,-0.2 3,-0.7 0.919 108.5 50.3 -63.8 -44.1 53.4 95.5 67.1 102 102 A K H ><5S+ 0 0 101 -4,-2.0 3,-2.1 1,-0.2 -2,-0.2 0.951 109.3 50.6 -59.4 -49.1 55.1 98.4 68.9 103 103 A R H 3<5S+ 0 0 163 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.645 109.2 52.2 -66.0 -13.2 57.6 96.0 70.6 104 104 A A T <<5S- 0 0 25 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.247 119.0-110.7-103.8 11.0 58.4 94.4 67.2 105 105 A G T < 5S+ 0 0 48 -3,-2.1 2,-0.5 1,-0.2 -3,-0.2 0.871 71.7 141.2 63.2 38.0 59.0 97.8 65.6 106 106 A V < - 0 0 6 -5,-2.8 2,-0.3 -8,-0.1 -1,-0.2 -0.952 49.4-133.6-116.3 128.8 55.9 97.7 63.5 107 107 A E E -b 2 0A 104 -106,-1.4 -104,-3.1 -2,-0.5 2,-0.4 -0.631 27.7-165.6 -78.5 133.9 53.7 100.7 62.8 108 108 A S E -b 3 0A 16 -2,-0.3 2,-0.3 -106,-0.2 -104,-0.2 -0.941 10.8-172.6-126.3 148.2 50.0 100.0 63.2 109 109 A Y E -b 4 0A 50 -106,-2.3 -104,-3.0 -2,-0.4 2,-0.5 -0.957 16.1-136.0-134.7 153.6 46.9 101.8 62.3 110 110 A V E -b 5 0A 6 -2,-0.3 2,-0.6 368,-0.2 -104,-0.2 -0.940 10.0-169.1-117.0 129.1 43.2 101.2 63.0 111 111 A I E -b 6 0A 3 -106,-3.0 -104,-2.5 -2,-0.5 -94,-0.1 -0.954 23.6-145.1-116.1 109.0 40.4 101.5 60.5 112 112 A H - 0 0 9 -2,-0.6 -95,-0.3 -106,-0.2 -92,-0.2 -0.129 16.6-172.3 -69.5 166.6 37.0 101.4 62.3 113 113 A A - 0 0 0 266,-0.1 268,-0.2 -97,-0.1 -97,-0.1 -0.969 42.2 -64.3-153.9 160.8 33.8 99.8 61.1 114 114 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -105,-0.1 -0.270 57.4-159.0 -54.7 131.6 30.2 99.6 62.3 115 115 A S >> - 0 0 0 264,-0.3 4,-2.4 -29,-0.2 3,-1.3 -0.851 30.4-126.5-116.6 150.2 30.0 97.9 65.6 116 116 A I H 3> S+ 0 0 0 -2,-0.3 4,-0.8 1,-0.3 -1,-0.1 0.794 108.2 71.1 -61.9 -24.1 27.1 96.2 67.5 117 117 A Y H 34 S+ 0 0 12 1,-0.2 -1,-0.3 2,-0.2 -26,-0.0 0.826 111.8 24.5 -63.9 -32.1 28.1 98.5 70.3 118 118 A S H X4 S+ 0 0 0 -3,-1.3 3,-2.1 1,-0.1 -1,-0.2 0.694 109.0 74.5-102.7 -24.0 26.7 101.6 68.5 119 119 A A H >< S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.3 -2,-0.2 0.641 74.6 83.0 -63.2 -13.0 24.2 99.7 66.3 120 120 A V G ><>S+ 0 0 1 -4,-0.8 3,-2.1 1,-0.3 5,-0.6 0.687 70.5 82.0 -64.4 -14.6 22.0 99.3 69.4 121 121 A G G X 5S+ 0 0 1 -3,-2.1 3,-1.6 1,-0.3 -1,-0.3 0.765 76.3 69.3 -60.8 -23.2 20.8 102.8 68.5 122 122 A I G < 5S+ 0 0 5 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.646 84.9 69.5 -70.8 -12.9 18.5 101.1 66.0 123 123 A T G < 5S- 0 0 0 -3,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.529 112.2-118.0 -80.1 -7.0 16.5 99.7 69.0 124 124 A G T < 5S+ 0 0 4 -3,-1.6 2,-0.4 1,-0.3 125,-0.2 0.430 72.1 133.3 85.2 -2.4 15.4 103.2 69.8 125 125 A L < - 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