==== 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 30-MAR-07 2PCK . COMPND 2 MOLECULE: DIPHTHINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.YAMAMOTO,Y.MORIKAWA,Y.MATSUURA,H.SHIMADA,N.KUNISHIMA,RIKEN . 530 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21405.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 372 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 9.4 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 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 12.8 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 . 14 2.6 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 6 0 0 0 4 4 0 3 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 3 4 1 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 0 4 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 0 130 0, 0.0 106,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 60.5 55.4 96.2 54.5 2 2 A V E -a 79 0A 25 76,-0.6 78,-3.6 72,-0.1 2,-0.4 -0.941 360.0-126.3-146.0 164.6 52.4 96.9 56.8 3 3 A L E -ab 80 108A 0 104,-2.1 106,-2.2 -2,-0.3 2,-0.4 -0.962 18.4-163.1-120.9 133.5 49.5 95.2 58.6 4 4 A Y E -ab 81 109A 40 76,-2.4 78,-3.3 -2,-0.4 2,-0.7 -0.948 11.6-153.5-116.2 132.5 45.9 96.2 58.3 5 5 A F E -ab 82 110A 0 104,-3.2 106,-3.8 -2,-0.4 2,-0.5 -0.924 26.2-176.9-100.4 113.7 43.1 95.2 60.7 6 6 A I E -ab 83 111A 0 76,-2.3 78,-1.5 -2,-0.7 2,-0.2 -0.950 19.0-141.0-120.7 120.8 40.0 95.4 58.5 7 7 A G E -a 84 0A 0 104,-2.6 10,-0.4 -2,-0.5 80,-0.2 -0.536 2.7-155.8 -76.2 141.8 36.5 94.8 59.8 8 8 A L - 0 0 5 76,-3.4 7,-0.3 78,-0.3 79,-0.1 0.467 40.9-122.5 -95.0 -6.6 34.1 92.9 57.4 9 9 A G B -E 86 0B 0 77,-1.6 77,-3.1 75,-0.3 -1,-0.3 -0.299 31.1 -58.3 94.8-179.7 30.9 94.2 58.8 10 10 A L S S- 0 0 1 75,-0.2 30,-0.4 5,-0.2 -1,-0.1 0.902 109.4 -4.9 -73.0 -53.3 27.7 92.8 60.4 11 11 A Y S S+ 0 0 53 1,-0.3 30,-1.4 199,-0.2 31,-0.3 0.810 114.9 13.9-119.1 -62.0 26.0 90.5 57.8 12 12 A D S > S- 0 0 13 198,-0.2 3,-1.9 29,-0.2 -1,-0.3 -0.655 80.9 -91.5-120.8 178.0 27.4 90.1 54.3 13 13 A E G > S+ 0 0 34 1,-0.3 3,-0.6 28,-0.2 270,-0.1 0.591 117.0 68.0 -68.9 -8.1 30.5 90.9 52.4 14 14 A R G 3 S+ 0 0 63 1,-0.2 270,-2.7 269,-0.1 271,-0.3 0.528 77.9 80.0 -87.4 -4.5 29.1 94.3 51.3 15 15 A D G < + 0 0 1 -3,-1.9 -1,-0.2 -7,-0.3 2,-0.2 0.457 69.9 106.2 -80.6 2.9 29.1 95.6 54.9 16 16 A I S < S- 0 0 2 -3,-0.6 267,-2.9 97,-0.1 268,-0.4 -0.555 80.2-111.1 -77.9 145.3 32.8 96.3 54.4 17 17 A T B > -F 282 0C 1 -10,-0.4 4,-2.2 95,-0.4 3,-0.4 -0.466 20.7-114.8 -79.5 154.2 33.6 100.0 54.0 18 18 A V H > S+ 0 0 9 263,-2.9 4,-2.3 261,-0.3 5,-0.3 0.879 118.4 56.5 -53.2 -35.8 34.8 101.3 50.6 19 19 A K H > S+ 0 0 4 260,-2.3 4,-1.3 262,-0.4 -1,-0.2 0.908 108.2 45.9 -62.7 -41.3 38.1 102.1 52.4 20 20 A G H > S+ 0 0 0 -3,-0.4 4,-2.7 259,-0.3 -1,-0.2 0.831 111.5 52.3 -71.8 -32.3 38.6 98.5 53.5 21 21 A L H X S+ 0 0 15 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.945 110.6 45.0 -69.6 -48.1 37.7 97.1 50.2 22 22 A E H X S+ 0 0 96 -4,-2.3 4,-0.8 -5,-0.2 -1,-0.2 0.806 117.3 46.4 -71.1 -24.1 40.1 99.1 48.2 23 23 A I H >< S+ 0 0 19 -4,-1.3 3,-0.6 -5,-0.3 4,-0.3 0.928 110.9 49.3 -80.9 -44.5 42.9 98.5 50.7 24 24 A A H >< S+ 0 0 0 -4,-2.7 3,-1.0 1,-0.2 -2,-0.2 0.830 106.2 61.5 -61.2 -27.9 42.3 94.8 51.0 25 25 A K H 3< S+ 0 0 97 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.866 106.0 43.9 -61.2 -39.6 42.3 94.6 47.2 26 26 A K T << S+ 0 0 168 -4,-0.8 2,-0.3 -3,-0.6 -1,-0.2 0.282 89.5 111.8 -95.6 13.9 45.9 95.9 47.0 27 27 A C < - 0 0 2 -3,-1.0 53,-0.2 -4,-0.3 3,-0.1 -0.660 60.1-146.3 -89.3 141.9 47.3 93.8 49.8 28 28 A D S S+ 0 0 89 51,-1.2 2,-0.4 -2,-0.3 52,-0.2 0.892 86.6 26.8 -71.5 -40.4 49.8 91.0 48.9 29 29 A Y E -c 80 0A 104 50,-1.9 52,-2.4 45,-0.1 2,-0.5 -0.978 67.6-164.2-127.9 137.6 48.6 88.7 51.7 30 30 A V E -cd 81 55A 7 24,-0.6 26,-2.7 -2,-0.4 2,-0.2 -0.961 8.7-179.0-125.4 117.7 45.2 88.5 53.3 31 31 A F E +cd 82 56A 6 50,-4.1 52,-3.2 -2,-0.5 2,-0.3 -0.722 7.0 179.3-106.0 163.1 44.5 86.6 56.5 32 32 A A E -cd 83 57A 0 24,-2.0 26,-5.0 -2,-0.2 2,-0.3 -0.997 19.7-156.3-159.7 159.4 41.1 86.2 58.4 33 33 A E E - d 0 58A 0 50,-1.6 26,-0.1 -2,-0.3 24,-0.0 -0.989 6.0-178.1-136.9 144.3 39.3 84.7 61.3 34 34 A F + 0 0 56 24,-0.5 5,-0.1 -2,-0.3 50,-0.1 -0.238 63.7 88.2-136.3 44.2 35.6 83.9 61.6 35 35 A Y S S+ 0 0 17 23,-0.1 135,-0.4 3,-0.1 136,-0.1 0.471 74.5 65.6-118.9 -10.6 35.4 82.7 65.2 36 36 A T S S- 0 0 16 1,-0.2 2,-0.3 134,-0.1 -2,-0.1 0.704 119.6 -15.9 -84.2 -20.2 34.8 86.0 67.0 37 37 A S - 0 0 3 495,-0.1 2,-0.4 49,-0.0 -1,-0.2 -0.951 68.0 -99.4-164.8-175.7 31.4 86.3 65.3 38 38 A L - 0 0 34 -2,-0.3 2,-1.0 -28,-0.1 3,-0.1 -0.975 8.9-161.5-127.9 129.2 29.1 85.1 62.5 39 39 A M > - 0 0 12 -2,-0.4 3,-1.5 1,-0.2 -28,-0.2 -0.809 16.7-176.7-104.3 85.4 28.3 86.8 59.2 40 40 A A T 3 S+ 0 0 39 -2,-1.0 -1,-0.2 -30,-0.4 -28,-0.1 0.764 71.6 58.2 -58.4 -25.6 25.1 85.0 58.4 41 41 A G T 3 S+ 0 0 16 -30,-1.4 2,-0.3 -3,-0.1 -1,-0.3 0.283 105.5 38.0 -97.6 12.2 24.6 86.6 55.0 42 42 A T < - 0 0 23 -3,-1.5 2,-0.3 -31,-0.3 -3,-0.1 -0.913 60.2-136.3-150.5 176.2 27.8 85.5 53.2 43 43 A T > - 0 0 71 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.892 35.8-105.6-132.8 166.9 30.5 82.9 52.5 44 44 A L H > S+ 0 0 68 -2,-0.3 4,-3.4 1,-0.2 5,-0.3 0.897 118.3 60.4 -56.2 -43.0 34.4 82.8 52.2 45 45 A G H > S+ 0 0 42 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.896 106.5 43.9 -55.0 -45.3 34.0 82.4 48.5 46 46 A R H > S+ 0 0 127 -3,-0.3 4,-3.0 2,-0.2 5,-0.2 0.877 112.4 51.3 -73.7 -36.5 32.1 85.7 48.1 47 47 A I H X S+ 0 0 5 -4,-2.0 4,-3.3 2,-0.2 5,-0.3 0.984 114.2 45.1 -57.1 -53.3 34.5 87.6 50.4 48 48 A Q H X>S+ 0 0 58 -4,-3.4 4,-3.0 1,-0.2 5,-1.2 0.947 113.8 49.8 -51.2 -51.0 37.4 86.2 48.3 49 49 A K H <5S+ 0 0 182 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.933 113.8 45.1 -55.8 -46.4 35.5 87.0 45.1 50 50 A L H <5S+ 0 0 46 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.898 118.3 42.3 -68.1 -38.4 34.8 90.6 46.3 51 51 A I H <5S- 0 0 5 -4,-3.3 -1,-0.2 -5,-0.2 -2,-0.2 0.800 100.5-136.3 -77.0 -25.6 38.3 91.2 47.5 52 52 A G T <5 + 0 0 60 -4,-3.0 2,-0.3 -5,-0.3 -3,-0.2 0.795 68.7 99.5 73.6 28.2 39.8 89.5 44.5 53 53 A K S - 0 0 37 -2,-0.2 4,-2.8 -26,-0.1 5,-0.2 -0.550 32.7-102.9 -97.4 168.9 41.9 79.7 64.0 60 60 A R H > S+ 0 0 116 1,-0.2 4,-2.9 2,-0.2 5,-0.4 0.914 126.2 47.8 -58.1 -37.2 41.7 81.1 67.5 61 61 A E H >>S+ 0 0 128 2,-0.2 4,-2.3 1,-0.2 5,-1.1 0.928 109.0 52.5 -68.7 -41.9 44.9 79.1 68.3 62 62 A D H >5S+ 0 0 41 3,-0.2 4,-1.5 2,-0.2 7,-0.2 0.960 119.2 37.2 -52.2 -52.0 46.6 80.3 65.1 63 63 A V H X5S+ 0 0 2 -4,-2.8 4,-1.7 3,-0.2 5,-0.2 0.992 120.4 41.9 -63.6 -67.8 45.8 83.9 66.2 64 64 A E H <5S+ 0 0 74 -4,-2.9 -3,-0.2 -5,-0.2 -1,-0.2 0.799 131.6 23.5 -58.2 -32.1 46.2 83.8 70.0 65 65 A L H <5S+ 0 0 106 -4,-2.3 -3,-0.2 -5,-0.4 -1,-0.2 0.823 135.5 25.2-105.7 -33.8 49.4 81.6 69.9 66 66 A N H >XS+ 0 0 0 -4,-1.7 4,-2.7 1,-0.3 5,-1.6 0.957 87.0 47.5 -53.9 -51.7 49.9 85.5 65.2 68 68 A E H 345S+ 0 0 77 -5,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.626 116.9 45.0 -64.4 -15.4 53.5 86.8 65.4 69 69 A N H <45S+ 0 0 101 -3,-1.1 -1,-0.2 -7,-0.2 -2,-0.2 0.693 124.2 29.8 -99.4 -26.0 54.7 83.6 63.7 70 70 A I H <5S+ 0 0 28 -4,-2.6 4,-0.4 -3,-0.3 -3,-0.2 0.853 133.0 19.4 -97.8 -48.2 52.1 83.4 60.9 71 71 A V T X5S+ 0 0 0 -4,-2.7 4,-0.8 -5,-0.4 3,-0.5 0.903 114.6 54.8 -97.9 -56.3 51.1 86.9 60.1 72 72 A L T >44 S+ 0 0 71 0, 0.0 3,-1.6 0, 0.0 4,-0.4 0.932 101.9 48.3 -46.9 -54.3 56.6 87.8 59.4 74 74 A L G 3> S+ 0 0 50 -3,-0.5 4,-0.7 -4,-0.4 3,-0.3 0.625 97.8 75.8 -62.4 -12.9 55.0 88.4 56.0 75 75 A A G << S+ 0 0 0 -3,-2.0 -1,-0.3 -4,-0.8 32,-0.1 0.588 83.4 62.4 -78.7 -11.4 54.5 92.1 57.0 76 76 A K T <4 S+ 0 0 93 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.1 0.833 117.9 24.8 -82.9 -32.0 58.1 93.2 56.6 77 77 A E T 4 S+ 0 0 171 -4,-0.4 2,-0.3 -3,-0.3 -2,-0.2 0.378 129.1 33.2-110.8 0.8 58.3 92.4 52.9 78 78 A N S < S- 0 0 36 -4,-0.7 2,-0.6 -50,-0.0 -76,-0.6 -0.938 80.5-102.9-148.7 169.8 54.6 92.8 52.0 79 79 A D E -a 2 0A 50 -78,-0.3 -50,-1.9 -2,-0.3 -51,-1.2 -0.892 44.0-167.6 -97.8 121.7 51.4 94.5 52.8 80 80 A V E -ac 3 29A 0 -78,-3.6 -76,-2.4 -2,-0.6 2,-0.4 -0.903 9.8-158.2-117.7 142.9 49.2 92.2 54.9 81 81 A A E -ac 4 30A 0 -52,-2.4 -50,-4.1 -2,-0.4 2,-0.5 -0.932 3.6-160.5-119.8 141.6 45.6 92.4 55.8 82 82 A F E -ac 5 31A 0 -78,-3.3 -76,-2.3 -2,-0.4 2,-0.3 -0.943 16.4-161.7-122.4 107.0 43.8 90.7 58.7 83 83 A L E +ac 6 32A 0 -52,-3.2 -50,-1.6 -2,-0.5 -76,-0.2 -0.625 13.7 169.7 -92.4 148.4 40.0 90.5 58.2 84 84 A T E -a 7 0A 0 -78,-1.5 -76,-3.4 -2,-0.3 -75,-0.3 -0.967 38.2 -93.0-149.2 160.5 37.4 89.9 60.9 85 85 A P S S- 0 0 0 0, 0.0 -75,-0.2 0, 0.0 28,-0.1 -0.313 92.9 -9.7 -69.9 161.0 33.6 90.0 61.3 86 86 A G B S-E 9 0B 1 -77,-3.1 -77,-1.6 -79,-0.1 -78,-0.3 -0.166 129.7 -16.0 49.3-138.6 32.1 93.3 62.5 87 87 A D > - 0 0 0 445,-3.0 3,-1.9 -80,-0.2 25,-0.1 -0.879 66.4-132.2 -99.8 127.7 34.7 95.7 63.8 88 88 A P T 3 S+ 0 0 0 0, 0.0 6,-0.4 0, 0.0 -1,-0.1 0.734 101.5 39.2 -46.9 -35.5 38.2 94.0 64.5 89 89 A L T 3 S+ 0 0 9 5,-0.1 2,-0.6 443,-0.1 3,-0.5 0.366 90.0 103.9-102.4 6.5 38.7 95.6 67.9 90 90 A V S < S- 0 0 0 -3,-1.9 -3,-0.1 1,-0.2 3,-0.1 -0.799 101.3 -18.3-102.5 125.4 35.2 95.4 69.4 91 91 A A S S+ 0 0 42 -2,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.853 117.7 100.4 49.9 36.2 34.5 92.7 72.0 92 92 A T S S- 0 0 21 -3,-0.5 -1,-0.3 440,-0.1 3,-0.2 -0.813 79.4-127.7-125.7 175.6 37.6 90.8 70.8 93 93 A T S > S+ 0 0 83 -2,-0.3 3,-1.3 1,-0.1 4,-0.4 0.186 78.6 110.7-105.8 17.8 41.0 90.6 72.2 94 94 A H T >> + 0 0 1 -6,-0.4 3,-1.3 1,-0.2 4,-0.6 0.722 58.6 73.8 -62.5 -26.2 42.5 91.6 68.8 95 95 A A H >> S+ 0 0 13 1,-0.3 3,-1.2 -3,-0.2 4,-0.7 0.851 90.4 60.9 -60.1 -28.3 43.7 95.0 70.1 96 96 A E H X> S+ 0 0 48 -3,-1.3 4,-1.3 1,-0.3 3,-0.5 0.806 91.8 67.1 -65.2 -26.5 46.4 93.1 71.9 97 97 A L H <> S+ 0 0 2 -3,-1.3 4,-2.2 -4,-0.4 -1,-0.3 0.759 90.2 63.1 -66.1 -22.8 47.6 91.9 68.5 98 98 A R H <>S+ 0 0 0 -4,-2.2 5,-2.7 2,-0.2 3,-0.9 0.946 113.3 45.7 -58.3 -47.7 53.0 93.9 65.7 102 102 A K H ><5S+ 0 0 82 -4,-2.9 3,-3.6 1,-0.3 -2,-0.2 0.972 108.4 54.8 -59.3 -51.5 54.6 97.0 67.3 103 103 A R H 3<5S+ 0 0 148 -4,-3.3 -1,-0.3 1,-0.3 -2,-0.2 0.655 109.5 50.7 -57.9 -13.3 57.0 94.9 69.4 104 104 A A T <<5S- 0 0 46 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.217 121.4-110.0-103.5 10.4 57.9 93.3 66.1 105 105 A G T < 5S+ 0 0 48 -3,-3.6 2,-0.5 1,-0.2 -3,-0.2 0.881 74.8 136.3 64.5 34.6 58.5 96.7 64.4 106 106 A V < - 0 0 4 -5,-2.7 -1,-0.2 -8,-0.2 2,-0.2 -0.963 49.6-138.7-113.4 116.0 55.4 96.3 62.1 107 107 A E - 0 0 117 -2,-0.5 -104,-2.1 -106,-0.4 2,-0.4 -0.550 23.0-160.2 -72.5 141.8 53.2 99.3 61.8 108 108 A S E -b 3 0A 10 -2,-0.2 2,-0.3 -106,-0.2 -104,-0.2 -0.940 10.7-163.1-127.0 148.9 49.5 98.6 61.9 109 109 A Y E -b 4 0A 58 -106,-2.2 -104,-3.2 -2,-0.4 2,-0.5 -0.935 12.9-139.2-126.9 149.4 46.4 100.4 60.8 110 110 A V E -b 5 0A 8 -2,-0.3 2,-0.7 366,-0.2 -104,-0.2 -0.946 9.1-167.4-114.9 124.8 42.7 99.8 61.7 111 111 A I E -b 6 0A 2 -106,-3.8 -104,-2.6 -2,-0.5 -94,-0.1 -0.933 22.7-142.7-108.5 110.3 39.9 100.0 59.2 112 112 A H - 0 0 9 -2,-0.7 -95,-0.4 -106,-0.2 -92,-0.2 -0.158 17.4-171.7 -70.3 163.6 36.6 100.1 61.1 113 113 A A - 0 0 0 -97,-0.1 267,-0.3 265,-0.1 2,-0.2 -0.946 44.0 -67.6-147.0 162.0 33.4 98.4 60.0 114 114 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -28,-0.1 -0.434 57.2-158.8 -59.2 123.2 29.8 98.4 61.2 115 115 A S >> - 0 0 0 -2,-0.2 4,-1.4 263,-0.2 3,-1.2 -0.746 27.9-124.8-104.3 152.2 29.8 96.7 64.7 116 116 A I H 3> S+ 0 0 0 -2,-0.3 4,-0.8 1,-0.2 -1,-0.1 0.710 105.8 74.6 -66.6 -18.0 26.9 95.1 66.5 117 117 A Y H 34 S+ 0 0 17 1,-0.2 -1,-0.2 2,-0.2 -26,-0.0 0.808 108.4 26.4 -66.6 -30.8 27.8 97.5 69.4 118 118 A S H X4 S+ 0 0 0 -3,-1.2 3,-1.9 1,-0.1 -1,-0.2 0.597 105.9 77.1-105.6 -14.7 26.3 100.5 67.6 119 119 A A H >< S+ 0 0 0 -4,-1.4 3,-2.8 1,-0.3 4,-0.2 0.745 74.4 81.8 -65.4 -20.2 23.8 98.6 65.5 120 120 A V G ><>S+ 0 0 1 -4,-0.8 3,-2.7 1,-0.3 5,-0.6 0.740 70.1 82.9 -55.9 -19.0 21.7 98.4 68.7 121 121 A G G X 5S+ 0 0 1 -3,-1.9 3,-1.7 1,-0.3 -1,-0.3 0.835 77.7 66.7 -53.4 -31.7 20.6 101.8 67.7 122 122 A I G < 5S+ 0 0 4 -3,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.560 86.9 69.7 -67.8 -8.0 18.1 100.0 65.4 123 123 A T G < 5S- 0 0 0 -3,-2.7 -1,-0.3 2,-0.2 -2,-0.2 0.586 110.3-119.2 -85.8 -7.3 16.3 98.8 68.6 124 124 A G T < 5S+ 0 0 3 -3,-1.7 2,-0.4 1,-0.3 125,-0.2 0.375 73.1 130.3 88.3 -8.1 15.2 102.3 69.3 125 125 A L S - 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