==== 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 27-JUL-06 2HUT . COMPND 2 MOLECULE: PROBABLE DIPHTHINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR M.SUGAHARA,K.SARABOJI,S.M.MALATHY SONY,M.N.PONNUSWAMY,T.S.KU . 528 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21487.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 9.5 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 . 37 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 130 24.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.8 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 1 0 1 3 3 0 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 3 3 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 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 98 0, 0.0 106,-0.9 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 48.6 56.0 97.7 55.7 2 2 A V E -ab 79 107A 13 76,-1.1 78,-2.9 104,-0.2 2,-0.5 -0.946 360.0-144.3-133.8 152.3 52.6 98.4 57.3 3 3 A L E -ab 80 108A 0 104,-3.0 106,-2.3 -2,-0.3 2,-0.5 -0.975 14.2-159.7-119.7 125.3 49.9 96.4 58.9 4 4 A Y E -ab 81 109A 33 76,-3.2 78,-3.5 -2,-0.5 2,-0.8 -0.891 9.7-158.0-108.2 130.0 46.2 97.2 58.5 5 5 A F E -ab 82 110A 0 104,-3.0 106,-2.9 -2,-0.5 2,-0.5 -0.926 26.8-176.5-101.9 110.0 43.4 96.0 60.9 6 6 A I E -ab 83 111A 0 76,-2.8 78,-1.5 -2,-0.8 2,-0.2 -0.948 18.8-138.7-119.1 129.1 40.3 96.3 58.7 7 7 A G E -a 84 0A 0 104,-2.4 10,-0.5 -2,-0.5 80,-0.2 -0.537 6.2-163.1 -82.5 144.1 36.7 95.6 59.7 8 8 A L - 0 0 2 76,-2.3 7,-0.4 78,-0.6 2,-0.1 0.534 40.6-129.1-101.2 -9.6 34.4 93.7 57.4 9 9 A G B -E 86 0B 1 77,-1.6 77,-3.9 75,-0.3 -1,-0.3 -0.472 32.4 -50.6 100.7-169.1 31.2 94.8 59.1 10 10 A L S S- 0 0 1 75,-0.2 30,-0.3 -2,-0.1 -1,-0.1 0.930 111.4 -3.6 -80.1 -51.9 28.0 93.2 60.5 11 11 A Y S S+ 0 0 51 1,-0.2 30,-1.6 199,-0.2 31,-0.4 0.839 113.0 8.9-113.6 -64.9 26.5 90.8 57.9 12 12 A D S > S- 0 0 18 198,-0.2 3,-1.7 29,-0.2 -1,-0.2 -0.554 81.1 -85.2-117.8-176.2 28.0 90.5 54.4 13 13 A E G > S+ 0 0 34 1,-0.3 3,-0.9 28,-0.2 268,-0.2 0.727 119.2 64.5 -63.7 -22.1 31.1 91.5 52.4 14 14 A R G 3 S+ 0 0 56 1,-0.2 268,-2.9 267,-0.1 269,-0.3 0.465 80.0 80.1 -81.9 -0.2 29.5 94.9 51.5 15 15 A D G < S+ 0 0 1 -3,-1.7 -1,-0.2 -7,-0.4 2,-0.2 0.413 70.8 105.2 -84.5 3.1 29.4 96.0 55.1 16 16 A I S < S- 0 0 1 -3,-0.9 265,-2.4 97,-0.1 266,-0.3 -0.532 81.8-110.1 -77.6 147.7 33.1 96.9 54.7 17 17 A T B > -F 280 0C 1 -10,-0.5 4,-2.4 95,-0.4 263,-0.3 -0.446 21.0-117.8 -77.1 158.4 33.8 100.7 54.4 18 18 A V H > S+ 0 0 9 261,-2.4 4,-2.8 259,-0.5 5,-0.3 0.893 117.9 56.1 -61.3 -37.5 34.9 102.0 51.0 19 19 A K H > S+ 0 0 2 258,-2.4 4,-1.6 260,-0.3 -1,-0.2 0.936 108.1 47.0 -59.1 -47.6 38.1 103.1 52.8 20 20 A G H > S+ 0 0 0 257,-0.3 4,-2.4 92,-0.2 -1,-0.2 0.889 113.3 49.1 -62.7 -40.3 38.7 99.5 53.9 21 21 A L H X S+ 0 0 14 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.970 109.9 47.9 -64.8 -55.6 38.0 98.1 50.5 22 22 A E H < S+ 0 0 101 -4,-2.8 4,-0.4 1,-0.2 -1,-0.2 0.797 117.0 45.2 -57.8 -28.8 40.2 100.4 48.5 23 23 A I H >< S+ 0 0 21 -4,-1.6 3,-0.8 -5,-0.3 -1,-0.2 0.869 111.5 51.1 -81.6 -38.4 43.0 99.7 50.9 24 24 A A H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.885 103.4 60.6 -64.7 -37.3 42.5 96.0 51.0 25 25 A K T 3< S+ 0 0 91 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.753 107.6 45.4 -61.1 -24.6 42.6 95.9 47.2 26 26 A K T < S+ 0 0 163 -3,-0.8 2,-0.3 -4,-0.4 -1,-0.3 0.230 85.5 110.0-107.1 13.5 46.1 97.2 47.3 27 27 A C < - 0 0 2 -3,-1.4 53,-0.2 -4,-0.1 3,-0.1 -0.646 61.6-142.5 -88.1 148.2 47.7 95.1 50.0 28 28 A D S S+ 0 0 85 51,-1.7 2,-0.4 -2,-0.3 52,-0.2 0.844 87.9 23.4 -76.0 -36.6 50.3 92.4 49.0 29 29 A Y E -c 80 0A 106 50,-1.3 52,-2.2 24,-0.1 2,-0.5 -0.999 68.9-160.9-135.4 134.7 49.1 89.9 51.6 30 30 A V E +cd 81 55A 6 24,-0.6 26,-2.0 -2,-0.4 2,-0.2 -0.958 10.7 178.9-122.4 118.5 45.6 89.6 53.2 31 31 A F E +cd 82 56A 8 50,-3.7 52,-2.7 -2,-0.5 2,-0.3 -0.644 6.5 173.1-107.7 168.7 45.0 87.7 56.5 32 32 A A E -cd 83 57A 0 24,-1.5 26,-4.3 50,-0.3 2,-0.3 -0.981 22.1-146.8-170.3 159.0 41.7 87.3 58.4 33 33 A E E - d 0 58A 0 50,-2.1 26,-0.1 -2,-0.3 24,-0.0 -0.978 7.1-176.8-133.1 145.2 39.9 85.5 61.3 34 34 A F + 0 0 54 24,-0.6 5,-0.1 -2,-0.3 50,-0.1 -0.110 65.3 86.6-133.1 35.6 36.3 84.5 61.4 35 35 A Y S S+ 0 0 15 23,-0.1 135,-0.4 1,-0.1 136,-0.1 0.672 74.9 66.3-106.4 -23.6 36.1 83.1 65.0 36 36 A T S S- 0 0 11 1,-0.1 2,-0.3 133,-0.1 -1,-0.1 0.668 118.6 -11.1 -73.1 -16.1 35.3 86.4 66.9 37 37 A S S S- 0 0 3 493,-0.1 2,-0.5 49,-0.0 -1,-0.1 -0.977 70.7-101.2-168.3 176.2 31.9 86.7 65.2 38 38 A L - 0 0 31 -2,-0.3 2,-1.2 -28,-0.1 3,-0.1 -0.943 11.8-166.0-122.1 119.1 29.7 85.4 62.5 39 39 A M > + 0 0 12 -2,-0.5 3,-1.1 1,-0.2 -28,-0.2 -0.792 16.5 179.4 -98.9 88.8 29.0 87.1 59.1 40 40 A A T 3 + 0 0 40 -2,-1.2 -1,-0.2 -30,-0.3 -28,-0.1 0.522 68.0 62.9 -69.2 -9.0 26.0 85.0 58.2 41 41 A G T 3 S+ 0 0 17 -30,-1.6 2,-0.2 -31,-0.1 -1,-0.2 0.343 105.4 26.6-103.6 9.5 25.4 86.8 54.9 42 42 A T < - 0 0 20 -3,-1.1 2,-0.3 -31,-0.4 -3,-0.1 -0.832 62.2-134.4-151.0-174.0 28.6 86.0 53.0 43 43 A T > - 0 0 75 -2,-0.2 4,-1.7 1,-0.1 3,-0.3 -0.927 38.5 -97.9-144.8 166.2 31.5 83.6 52.5 44 44 A L H > S+ 0 0 59 -2,-0.3 4,-3.7 1,-0.2 5,-0.2 0.924 120.9 57.5 -53.4 -46.0 35.2 83.8 52.1 45 45 A G H > S+ 0 0 39 1,-0.3 4,-3.0 2,-0.2 -1,-0.2 0.885 106.1 46.5 -52.8 -46.7 34.8 83.5 48.3 46 46 A R H > S+ 0 0 146 -3,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.832 114.7 48.7 -67.3 -31.5 32.6 86.5 48.0 47 47 A I H X S+ 0 0 3 -4,-1.7 4,-2.3 -3,-0.2 5,-0.3 0.941 113.1 47.4 -71.3 -48.0 34.9 88.5 50.3 48 48 A Q H X>S+ 0 0 55 -4,-3.7 4,-2.6 1,-0.2 5,-1.0 0.910 111.1 51.3 -58.5 -44.6 37.9 87.4 48.2 49 49 A K H <5S+ 0 0 188 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.914 111.3 47.7 -60.3 -43.6 36.1 88.2 44.9 50 50 A L H <5S+ 0 0 42 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.877 120.4 37.3 -65.3 -38.7 35.3 91.7 46.2 51 51 A I H <5S- 0 0 4 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.665 98.4-136.7 -88.3 -19.4 38.9 92.3 47.4 52 52 A G T <5 + 0 0 56 -4,-2.6 2,-0.3 -5,-0.3 -3,-0.2 0.829 66.9 107.1 67.5 29.6 40.5 90.5 44.5 53 53 A K S - 0 0 39 -2,-0.3 4,-2.1 -26,-0.1 5,-0.2 -0.443 33.1-101.6 -93.3 172.7 42.4 80.3 63.7 60 60 A R H > S+ 0 0 100 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.873 124.8 51.4 -63.8 -35.6 42.3 81.6 67.3 61 61 A E H >>S+ 0 0 126 2,-0.2 4,-1.8 1,-0.2 5,-0.8 0.894 107.2 53.3 -68.1 -39.1 45.4 79.6 68.1 62 62 A D H >5S+ 0 0 41 3,-0.2 4,-1.6 2,-0.2 7,-0.2 0.942 116.4 39.1 -59.0 -48.9 47.2 81.1 65.1 63 63 A V H X5S+ 0 0 1 -4,-2.1 4,-1.2 3,-0.2 5,-0.2 0.978 119.1 41.4 -66.6 -61.6 46.4 84.7 66.2 64 64 A E H <5S+ 0 0 72 -4,-2.5 -1,-0.2 -5,-0.2 -3,-0.2 0.742 130.9 25.1 -63.7 -23.7 46.8 84.5 70.0 65 65 A L H <5S+ 0 0 113 -4,-1.8 -3,-0.2 -5,-0.3 -2,-0.2 0.811 134.5 19.5-110.1 -40.6 50.0 82.4 69.8 66 66 A N H >XS+ 0 0 0 -4,-1.2 4,-2.8 1,-0.3 5,-1.2 0.940 83.4 48.8 -53.1 -48.2 50.5 86.2 65.1 68 68 A E H 345S+ 0 0 76 1,-0.2 -1,-0.3 -5,-0.2 -2,-0.1 0.394 114.6 46.1 -74.0 5.1 54.1 87.5 65.1 69 69 A N H <45S+ 0 0 101 -3,-2.2 -1,-0.2 -7,-0.2 -2,-0.2 0.644 122.4 32.8-112.3 -32.2 55.3 84.4 63.3 70 70 A I H <5S+ 0 0 27 -4,-2.7 4,-0.3 -8,-0.2 -2,-0.2 0.880 134.2 16.2 -92.6 -45.7 52.6 84.1 60.7 71 71 A V T >X5S+ 0 0 0 -4,-2.8 4,-1.7 -5,-0.3 3,-0.6 0.900 114.0 60.0 -98.3 -52.9 51.7 87.8 59.9 72 72 A M H 3>4 S+ 0 0 64 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.944 110.1 40.1 -53.5 -48.3 57.3 88.7 59.1 74 74 A L H X> S+ 0 0 52 -3,-0.6 4,-1.5 -4,-0.3 3,-1.3 0.839 109.4 62.5 -68.2 -32.1 55.5 89.6 55.9 75 75 A A H 3< S+ 0 0 0 -4,-1.7 -1,-0.2 1,-0.3 32,-0.2 0.670 94.2 61.6 -68.1 -17.7 54.4 92.9 57.4 76 76 A K T << S+ 0 0 89 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.643 119.6 25.3 -83.6 -13.1 58.0 94.1 57.8 77 77 A E T <4 S+ 0 0 155 -3,-1.3 2,-0.2 -4,-0.3 -2,-0.2 0.426 126.5 33.5-125.9 -7.3 58.5 93.9 54.0 78 78 A N S < S- 0 0 38 -4,-1.5 -76,-1.1 -5,-0.1 2,-0.8 -0.801 84.1 -92.3-140.9-179.2 55.0 94.3 52.6 79 79 A D E -a 2 0A 56 -2,-0.2 -51,-1.7 -78,-0.2 -50,-1.3 -0.902 50.6-172.0-100.7 108.9 51.6 96.0 53.1 80 80 A V E -ac 3 29A 0 -78,-2.9 -76,-3.2 -2,-0.8 2,-0.4 -0.833 14.0-157.6-111.0 144.7 49.5 93.5 55.0 81 81 A A E -ac 4 30A 0 -52,-2.2 -50,-3.7 -2,-0.4 2,-0.5 -0.935 2.3-161.4-118.9 140.0 45.9 93.5 55.9 82 82 A F E -ac 5 31A 0 -78,-3.5 -76,-2.8 -2,-0.4 2,-0.3 -0.975 16.5-159.2-120.3 114.3 44.2 91.7 58.8 83 83 A L E +ac 6 32A 0 -52,-2.7 -50,-2.1 -2,-0.5 -76,-0.2 -0.730 14.6 170.7 -98.4 144.0 40.4 91.3 58.3 84 84 A T E -a 7 0A 0 -78,-1.5 -76,-2.3 -2,-0.3 -75,-0.3 -0.958 38.4 -94.7-144.0 160.2 37.8 90.6 61.0 85 85 A P S S- 0 0 0 0, 0.0 -75,-0.2 0, 0.0 28,-0.1 -0.347 92.5 -12.0 -70.6 162.6 34.0 90.5 61.3 86 86 A G B S-E 9 0B 1 -77,-3.9 -77,-1.6 -79,-0.1 -78,-0.6 -0.127 129.4 -15.6 47.5-136.1 32.4 93.7 62.5 87 87 A D > - 0 0 0 443,-2.0 3,-1.5 -80,-0.2 25,-0.1 -0.877 66.0-134.3-100.6 129.6 34.9 96.2 64.0 88 88 A P T 3 S+ 0 0 0 0, 0.0 6,-0.4 0, 0.0 7,-0.1 0.725 100.2 42.0 -53.6 -30.3 38.4 94.6 64.7 89 89 A L T 3 S+ 0 0 9 5,-0.1 2,-0.7 441,-0.1 3,-0.3 0.306 89.4 100.0-106.3 11.3 38.8 96.2 68.2 90 90 A V S < S- 0 0 0 -3,-1.5 -3,-0.1 1,-0.2 26,-0.1 -0.860 103.8 -16.4-102.3 114.1 35.3 95.8 69.6 91 91 A A S S+ 0 0 42 -2,-0.7 2,-0.3 1,-0.3 -1,-0.2 0.873 116.9 97.1 64.2 37.8 34.8 92.8 72.0 92 92 A T S S- 0 0 22 -3,-0.3 -1,-0.3 438,-0.1 3,-0.2 -0.825 79.0-125.5-139.7 176.7 38.1 91.2 70.8 93 93 A T S > S+ 0 0 80 -2,-0.3 3,-1.3 1,-0.1 4,-0.4 0.103 77.7 113.1-112.4 18.2 41.6 91.2 72.2 94 94 A H T >> + 0 0 1 -6,-0.4 3,-1.4 1,-0.3 4,-0.5 0.724 56.9 74.6 -62.7 -25.9 42.9 92.4 68.9 95 95 A A H >> S+ 0 0 17 1,-0.3 3,-1.3 -3,-0.2 4,-0.7 0.834 88.8 63.9 -57.2 -30.7 44.0 95.8 70.2 96 96 A E H X> S+ 0 0 70 -3,-1.3 4,-1.7 1,-0.3 3,-1.0 0.842 89.7 65.7 -61.9 -33.7 46.9 93.8 71.8 97 97 A L H <> S+ 0 0 4 -3,-1.4 4,-1.9 -4,-0.4 -1,-0.3 0.735 93.0 60.7 -63.5 -20.4 48.1 92.9 68.3 98 98 A R H <>S+ 0 0 0 -4,-1.9 5,-2.6 2,-0.2 3,-0.7 0.951 109.8 49.2 -65.9 -48.9 53.2 95.2 65.8 102 102 A K H ><5S+ 0 0 105 -4,-2.3 3,-2.3 1,-0.3 -2,-0.2 0.933 109.2 51.4 -55.7 -50.0 54.9 98.2 67.4 103 103 A R H 3<5S+ 0 0 153 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.754 108.1 55.0 -60.0 -22.6 57.4 96.1 69.3 104 104 A A T <<5S- 0 0 25 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.269 120.3-109.4 -94.3 10.8 58.2 94.4 66.0 105 105 A G T < 5S+ 0 0 54 -3,-2.3 2,-0.4 1,-0.2 -3,-0.2 0.680 78.0 130.2 71.2 18.0 58.9 97.7 64.3 106 106 A V < - 0 0 5 -5,-2.6 2,-0.3 -6,-0.2 -1,-0.2 -0.886 53.4-135.6-109.3 134.6 55.8 97.6 62.2 107 107 A E E -b 2 0A 115 -106,-0.9 -104,-3.0 -2,-0.4 2,-0.4 -0.656 21.6-159.6 -86.0 141.3 53.3 100.4 61.9 108 108 A S E -b 3 0A 17 -2,-0.3 2,-0.3 -106,-0.2 -104,-0.2 -0.935 7.5-166.6-124.2 147.6 49.6 99.5 62.2 109 109 A Y E -b 4 0A 50 -106,-2.3 -104,-3.0 -2,-0.4 2,-0.5 -0.934 12.7-139.3-128.8 153.3 46.5 101.3 61.0 110 110 A V E -b 5 0A 7 -2,-0.3 2,-0.6 365,-0.2 -104,-0.2 -0.960 10.7-170.7-120.6 128.8 42.8 100.7 61.9 111 111 A I E -b 6 0A 2 -106,-2.9 -104,-2.4 -2,-0.5 -94,-0.1 -0.958 22.6-142.5-117.2 111.5 39.9 100.9 59.5 112 112 A H - 0 0 6 -2,-0.6 -95,-0.4 -106,-0.2 -92,-0.2 -0.190 18.4-175.4 -71.0 162.0 36.6 100.8 61.3 113 113 A A - 0 0 0 -97,-0.1 265,-0.2 263,-0.1 -97,-0.1 -0.934 44.6 -59.4-148.7 166.8 33.4 99.0 60.1 114 114 A P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 -105,-0.1 -0.276 57.8-160.5 -52.9 132.5 29.8 98.6 61.3 115 115 A S >> - 0 0 0 261,-0.3 4,-2.0 -29,-0.2 3,-1.4 -0.913 28.7-130.4-120.6 146.6 29.8 97.1 64.8 116 116 A I H 3> S+ 0 0 0 -2,-0.4 4,-1.5 1,-0.3 -1,-0.1 0.847 104.4 72.8 -61.1 -29.9 27.0 95.3 66.7 117 117 A Y H 34 S+ 0 0 12 1,-0.2 -1,-0.3 2,-0.2 -26,-0.0 0.793 113.5 22.2 -56.0 -30.9 27.9 97.6 69.6 118 118 A S H X4 S+ 0 0 0 -3,-1.4 3,-1.5 2,-0.1 -1,-0.2 0.586 110.2 74.1-110.3 -17.1 26.3 100.6 67.9 119 119 A A H >< S+ 0 0 0 -4,-2.0 3,-2.7 1,-0.3 -2,-0.2 0.753 77.2 79.7 -67.1 -23.7 24.0 98.7 65.5 120 120 A V G ><> + 0 0 1 -4,-1.5 3,-1.6 1,-0.3 5,-0.5 0.556 69.6 85.7 -61.8 -3.8 21.8 98.0 68.5 121 121 A G G X 5S+ 0 0 1 -3,-1.5 3,-1.7 1,-0.3 -1,-0.3 0.755 74.1 70.9 -67.2 -20.7 20.6 101.5 67.9 122 122 A I G < 5S+ 0 0 4 -3,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.630 84.5 68.1 -70.6 -12.2 18.2 99.9 65.5 123 123 A T G < 5S- 0 0 0 -3,-1.6 -1,-0.3 2,-0.2 -2,-0.2 0.542 112.2-118.5 -82.1 -7.3 16.3 98.4 68.4 124 124 A G T < 5S+ 0 0 4 -3,-1.7 2,-0.3 1,-0.3 125,-0.2 0.347 71.5 131.1 87.6 -7.5 15.2 102.0 69.4 125 125 A L S - 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