==== 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 31-AUG-06 2DXW . COMPND 2 MOLECULE: DIPHTHINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.MIZUTANI,Y.MATSUURA,N.KUNISHIMA,RIKEN STRUCTURAL . 531 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21700.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 378 71.2 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 . 48 9.0 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 . 2 0.4 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 . 69 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 24.9 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 0 4 2 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 2 2 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 0 151 0, 0.0 106,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -5.7 55.6 97.9 54.6 2 2 A V E -ab 79 107A 10 76,-1.1 78,-3.1 104,-0.1 2,-0.4 -0.981 360.0-142.7-148.5 157.3 52.3 98.0 56.4 3 3 A L E -ab 80 108A 0 104,-2.2 106,-2.3 -2,-0.3 2,-0.4 -0.984 17.6-162.0-121.4 129.5 49.5 96.0 58.1 4 4 A Y E -ab 81 109A 34 76,-2.6 78,-3.0 -2,-0.4 2,-0.7 -0.937 10.4-154.2-112.8 133.1 45.9 97.0 57.8 5 5 A F E -ab 82 110A 0 104,-2.9 106,-3.1 -2,-0.4 2,-0.5 -0.942 26.8-175.4-102.4 112.5 43.1 95.7 60.1 6 6 A I E -ab 83 111A 0 76,-2.4 78,-1.8 -2,-0.7 2,-0.2 -0.951 18.0-142.0-120.3 124.6 40.0 96.0 57.9 7 7 A G E -a 84 0A 0 104,-2.2 10,-0.5 -2,-0.5 80,-0.2 -0.544 4.0-161.2 -81.0 146.4 36.4 95.3 59.0 8 8 A L - 0 0 3 76,-2.7 7,-0.3 78,-0.4 3,-0.2 0.471 40.0-130.7-103.0 -7.7 34.0 93.6 56.6 9 9 A G B -E 86 0B 1 77,-1.6 77,-3.3 75,-0.4 -1,-0.3 -0.326 33.0 -46.5 93.7-173.9 30.9 94.6 58.3 10 10 A L S S- 0 0 1 75,-0.2 30,-0.4 5,-0.2 -1,-0.2 0.821 110.3 -7.0 -72.1 -44.3 27.7 93.0 59.6 11 11 A Y S S+ 0 0 54 1,-0.3 30,-2.5 -3,-0.2 31,-0.3 0.749 111.6 14.8-129.5 -50.4 26.2 90.7 57.0 12 12 A D S > S- 0 0 18 29,-0.2 3,-2.3 28,-0.1 -1,-0.3 -0.791 80.1 -88.4-130.8 175.6 27.6 90.5 53.4 13 13 A E G > S+ 0 0 38 1,-0.3 3,-0.9 -2,-0.2 271,-0.1 0.698 118.6 64.2 -57.1 -21.3 30.7 91.5 51.4 14 14 A R G 3 S+ 0 0 67 1,-0.2 271,-2.5 270,-0.1 270,-0.3 0.465 79.9 81.3 -84.4 1.3 29.2 94.9 50.6 15 15 A D G < + 0 0 2 -3,-2.3 -1,-0.2 -7,-0.3 -5,-0.2 0.490 69.0 103.3 -83.4 -0.5 29.2 95.9 54.3 16 16 A I S < S- 0 0 1 -3,-0.9 268,-2.6 -4,-0.1 269,-0.3 -0.497 82.7-109.1 -75.3 148.7 32.9 96.8 53.9 17 17 A T B > -F 283 0C 1 -10,-0.5 4,-2.5 95,-0.4 266,-0.3 -0.458 21.3-116.4 -78.0 156.6 33.6 100.5 53.6 18 18 A V H > S+ 0 0 13 264,-2.5 4,-2.8 262,-0.3 5,-0.2 0.910 119.3 54.1 -57.0 -40.4 34.7 101.9 50.3 19 19 A K H > S+ 0 0 2 261,-2.7 4,-1.8 263,-0.3 -1,-0.2 0.935 108.3 48.5 -58.6 -48.0 37.9 102.9 52.0 20 20 A G H > S+ 0 0 0 260,-0.3 4,-2.6 92,-0.2 -1,-0.2 0.896 112.4 48.5 -60.5 -41.7 38.4 99.4 53.2 21 21 A L H X S+ 0 0 11 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.943 110.1 49.3 -65.6 -48.7 37.8 97.9 49.7 22 22 A E H X S+ 0 0 75 -4,-2.8 4,-0.5 1,-0.2 -1,-0.2 0.823 115.9 44.5 -62.6 -31.1 40.1 100.3 47.8 23 23 A I H >< S+ 0 0 18 -4,-1.8 3,-1.0 -5,-0.2 4,-0.4 0.922 112.0 50.7 -77.7 -45.7 42.9 99.6 50.3 24 24 A A H >< S+ 0 0 0 -4,-2.6 3,-1.3 1,-0.3 -2,-0.2 0.874 104.6 59.8 -58.7 -38.2 42.3 95.8 50.3 25 25 A K H 3< S+ 0 0 75 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.776 107.8 44.9 -61.8 -28.4 42.4 95.7 46.5 26 26 A K T << S+ 0 0 146 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.385 88.4 110.8 -99.2 3.4 45.9 97.1 46.5 27 27 A C < - 0 0 0 -3,-1.3 53,-0.2 -4,-0.4 3,-0.1 -0.456 63.1-141.2 -78.0 152.0 47.4 94.9 49.2 28 28 A D S S+ 0 0 81 51,-2.3 2,-0.4 1,-0.2 52,-0.2 0.849 87.0 21.4 -79.3 -36.9 50.0 92.3 48.3 29 29 A Y E -c 80 0A 109 50,-1.6 52,-2.2 24,-0.1 2,-0.4 -0.990 67.1-161.6-134.8 142.2 48.7 89.7 50.8 30 30 A V E +cd 81 55A 7 24,-0.5 26,-2.4 -2,-0.4 2,-0.3 -0.985 11.3 174.6-130.2 123.7 45.3 89.3 52.4 31 31 A F E +cd 82 56A 6 50,-3.2 52,-3.1 -2,-0.4 2,-0.3 -0.776 6.6 178.0-117.6 164.9 44.5 87.3 55.5 32 32 A A E -cd 83 57A 0 24,-1.9 26,-3.3 -2,-0.3 2,-0.4 -0.989 20.2-145.3-163.1 160.8 41.2 87.0 57.4 33 33 A E E - d 0 58A 0 50,-2.0 26,-0.1 -2,-0.3 24,-0.0 -0.977 8.5-177.7-131.4 144.4 39.5 85.3 60.4 34 34 A F + 0 0 58 24,-0.5 5,-0.1 -2,-0.4 50,-0.1 -0.146 63.5 87.9-134.0 38.6 35.9 84.3 60.5 35 35 A Y S S+ 0 0 17 23,-0.1 135,-0.4 1,-0.1 3,-0.1 0.591 74.6 65.5-110.6 -16.4 35.6 83.0 64.0 36 36 A T S S- 0 0 11 1,-0.2 2,-0.3 133,-0.1 -2,-0.1 0.712 118.1 -7.6 -79.5 -20.2 34.8 86.1 66.0 37 37 A S - 0 0 5 496,-0.1 2,-0.5 49,-0.0 -1,-0.2 -0.976 69.9-104.8-163.6 172.2 31.4 86.5 64.3 38 38 A L - 0 0 34 -2,-0.3 2,-1.0 -28,-0.1 -3,-0.1 -0.941 12.6-162.5-115.4 123.0 29.1 85.2 61.5 39 39 A M > - 0 0 15 -2,-0.5 3,-0.9 1,-0.1 -28,-0.2 -0.851 15.6-177.0 -99.8 94.8 28.5 87.0 58.2 40 40 A A T 3 + 0 0 41 -2,-1.0 -28,-0.1 -30,-0.4 -1,-0.1 0.538 68.7 58.9 -74.1 -8.4 25.4 85.2 57.2 41 41 A G T 3 S+ 0 0 18 -30,-2.5 2,-0.2 -31,-0.1 -1,-0.2 0.230 104.2 35.6-109.1 17.3 24.9 86.9 53.9 42 42 A T < - 0 0 20 -3,-0.9 2,-0.3 -31,-0.3 3,-0.1 -0.839 62.3-132.3-150.4-174.4 28.1 86.1 52.0 43 43 A T > - 0 0 75 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.920 34.8-105.7-141.6 165.6 30.8 83.5 51.3 44 44 A L H > S+ 0 0 67 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.925 120.6 56.8 -59.2 -42.3 34.6 83.5 51.2 45 45 A G H > S+ 0 0 43 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.902 106.1 47.3 -55.5 -46.0 34.3 83.2 47.4 46 46 A R H > S+ 0 0 146 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.874 112.5 49.4 -66.0 -37.2 32.2 86.4 47.1 47 47 A I H X S+ 0 0 4 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.936 111.1 50.1 -66.7 -45.1 34.5 88.4 49.4 48 48 A Q H X>S+ 0 0 57 -4,-2.9 4,-2.0 1,-0.2 5,-1.1 0.887 110.1 51.2 -59.5 -40.0 37.5 87.2 47.3 49 49 A K H <5S+ 0 0 184 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.913 110.6 47.9 -64.9 -43.3 35.8 88.2 44.1 50 50 A L H <5S+ 0 0 46 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.919 119.1 38.4 -63.8 -45.6 35.0 91.7 45.4 51 51 A I H <5S- 0 0 4 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.728 100.4-136.4 -78.8 -22.7 38.5 92.3 46.6 52 52 A G T <5 + 0 0 58 -4,-2.0 2,-0.3 -5,-0.3 -3,-0.2 0.802 67.2 102.4 71.0 30.0 40.1 90.6 43.7 53 53 A K S - 0 0 38 -2,-0.3 4,-2.3 -26,-0.1 5,-0.2 -0.431 35.2 -99.1 -89.6 169.6 42.0 79.9 62.8 60 60 A R H > S+ 0 0 108 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.880 127.2 49.1 -57.2 -37.4 41.7 81.3 66.3 61 61 A E H >>S+ 0 0 122 2,-0.2 4,-2.5 1,-0.2 5,-1.0 0.919 106.5 54.5 -68.6 -43.6 45.0 79.4 67.1 62 62 A D H >5S+ 0 0 48 3,-0.2 4,-1.1 2,-0.2 7,-0.2 0.923 118.3 36.7 -54.6 -45.7 46.8 80.7 64.0 63 63 A V H X5S+ 0 0 1 -4,-2.3 4,-1.7 3,-0.2 5,-0.2 0.986 120.7 41.4 -71.7 -62.4 45.9 84.3 65.2 64 64 A E H <5S+ 0 0 72 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.831 131.3 24.6 -58.3 -36.4 46.2 84.1 69.0 65 65 A L H <5S+ 0 0 106 -4,-2.5 -3,-0.2 -5,-0.3 -1,-0.2 0.779 136.2 23.8-101.1 -30.6 49.4 81.9 69.0 66 66 A N H >XS+ 0 0 0 -4,-1.7 4,-2.2 1,-0.3 5,-1.5 0.931 85.6 51.0 -56.1 -44.2 49.9 86.1 64.3 68 68 A E H 345S+ 0 0 79 -5,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.543 115.3 43.1 -70.2 -7.5 53.5 87.2 64.5 69 69 A N H <45S+ 0 0 106 -3,-1.7 -1,-0.2 -7,-0.2 -2,-0.2 0.650 123.6 31.8-109.5 -24.2 54.7 84.1 62.6 70 70 A I H <5S+ 0 0 25 -4,-2.3 4,-0.3 -8,-0.2 -3,-0.2 0.842 132.2 18.7-100.7 -45.1 52.1 84.0 59.9 71 71 A V T >X5S+ 0 0 0 -4,-2.2 4,-1.3 -5,-0.4 3,-0.9 0.926 115.5 55.4 -94.4 -57.6 51.1 87.6 59.2 72 72 A L H 3>4 S+ 0 0 59 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.925 107.6 43.1 -56.9 -42.8 56.7 88.6 58.6 74 74 A L H X> S+ 0 0 50 -3,-0.9 3,-1.5 -4,-0.3 4,-1.4 0.813 103.8 65.1 -71.1 -32.2 55.1 89.5 55.3 75 75 A A H 3< S+ 0 0 1 -4,-1.3 -1,-0.2 1,-0.3 32,-0.2 0.576 90.2 69.1 -68.5 -8.1 54.0 92.9 56.5 76 76 A K T << S+ 0 0 106 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.696 118.4 16.3 -83.5 -19.3 57.7 93.8 56.8 77 77 A E T <4 S+ 0 0 153 -3,-1.5 2,-0.3 -4,-0.2 -2,-0.2 0.353 127.8 44.0-131.4 -0.0 58.3 93.8 53.0 78 78 A N S < S- 0 0 42 -4,-1.4 -76,-1.1 -76,-0.1 2,-0.7 -0.905 83.7-100.2-142.1 167.8 54.7 94.0 51.7 79 79 A D E -a 2 0A 54 -2,-0.3 -51,-2.3 -78,-0.2 -50,-1.6 -0.841 49.8-173.7 -90.9 118.3 51.3 95.7 52.1 80 80 A V E -ac 3 29A 0 -78,-3.1 -76,-2.6 -2,-0.7 2,-0.4 -0.912 15.0-159.6-121.1 145.1 49.2 93.3 54.1 81 81 A A E -ac 4 30A 0 -52,-2.2 -50,-3.2 -2,-0.4 2,-0.5 -0.947 4.7-161.3-123.1 143.4 45.6 93.2 55.2 82 82 A F E -ac 5 31A 0 -78,-3.0 -76,-2.4 -2,-0.4 2,-0.3 -0.976 18.8-157.1-123.2 111.3 43.9 91.3 57.9 83 83 A L E +ac 6 32A 0 -52,-3.1 -50,-2.0 -2,-0.5 -76,-0.2 -0.675 14.7 173.9 -94.3 144.9 40.1 91.1 57.4 84 84 A T E -a 7 0A 0 -78,-1.8 -76,-2.7 -2,-0.3 -75,-0.4 -0.974 36.2 -96.9-144.1 157.3 37.5 90.5 60.1 85 85 A P S S- 0 0 0 0, 0.0 -75,-0.2 0, 0.0 28,-0.1 -0.349 91.4 -11.0 -69.8 157.1 33.7 90.4 60.4 86 86 A G B S-E 9 0B 1 -77,-3.3 -77,-1.6 -79,-0.1 -78,-0.4 -0.205 129.5 -14.6 53.4-139.1 32.1 93.6 61.7 87 87 A D > - 0 0 0 446,-2.5 3,-1.5 -80,-0.2 25,-0.1 -0.850 67.9-132.7 -95.8 131.4 34.5 96.1 63.2 88 88 A P T 3 S+ 0 0 0 0, 0.0 6,-0.4 0, 0.0 -1,-0.1 0.732 101.0 42.1 -56.0 -25.5 38.0 94.5 63.8 89 89 A L T 3 S+ 0 0 8 5,-0.1 2,-0.6 444,-0.1 304,-0.3 0.275 88.7 101.1-109.0 12.5 38.4 95.9 67.3 90 90 A V S < S- 0 0 0 -3,-1.5 -3,-0.1 443,-0.2 3,-0.1 -0.867 102.4 -16.2-103.5 118.5 34.9 95.4 68.8 91 91 A A S S+ 0 0 42 -2,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.848 117.0 99.0 59.9 33.7 34.3 92.5 71.1 92 92 A T S S- 0 0 21 -3,-0.3 -1,-0.3 441,-0.1 3,-0.2 -0.852 77.8-128.9-134.5 168.8 37.5 90.9 69.9 93 93 A T S > S+ 0 0 88 -2,-0.3 3,-1.0 1,-0.1 4,-0.4 0.102 75.8 113.1-104.4 21.5 40.9 90.8 71.4 94 94 A H T >> + 0 0 2 -6,-0.4 3,-1.4 1,-0.2 4,-0.5 0.721 56.1 78.4 -67.3 -19.9 42.5 91.9 68.1 95 95 A A H >> S+ 0 0 18 1,-0.3 3,-1.9 -3,-0.2 4,-0.5 0.918 88.2 58.6 -55.3 -39.2 43.6 95.3 69.6 96 96 A E H X> S+ 0 0 58 -3,-1.0 4,-1.4 1,-0.3 3,-1.0 0.775 90.9 71.2 -60.9 -25.9 46.5 93.5 71.2 97 97 A L H <> S+ 0 0 3 -3,-1.4 4,-1.8 -4,-0.4 -1,-0.3 0.747 89.0 61.9 -63.9 -22.1 47.6 92.4 67.7 98 98 A R H S+ 0 0 0 -4,-1.8 5,-3.0 2,-0.2 3,-0.4 0.938 110.5 48.0 -62.4 -46.7 52.8 94.6 65.1 102 102 A K H ><5S+ 0 0 100 -4,-2.2 3,-2.8 1,-0.2 -2,-0.2 0.959 109.4 50.8 -59.0 -53.8 54.7 97.5 66.8 103 103 A R H 3<5S+ 0 0 167 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.754 109.6 54.0 -57.7 -22.2 57.2 95.2 68.6 104 104 A A T 3<5S- 0 0 27 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.356 120.2-110.6 -92.9 4.4 57.8 93.6 65.2 105 105 A G T < 5S+ 0 0 65 -3,-2.8 2,-0.5 1,-0.2 -3,-0.2 0.765 74.6 135.7 72.7 25.8 58.6 97.0 63.6 106 106 A V < - 0 0 4 -5,-3.0 2,-0.3 -6,-0.2 -1,-0.2 -0.928 50.4-138.6-111.2 124.4 55.4 96.9 61.5 107 107 A E E -b 2 0A 122 -106,-0.6 -104,-2.2 -2,-0.5 2,-0.3 -0.610 25.0-160.2 -77.9 137.6 53.2 100.0 61.2 108 108 A S E -b 3 0A 14 -2,-0.3 2,-0.3 -106,-0.2 -104,-0.2 -0.920 11.6-167.1-124.8 150.3 49.5 99.2 61.4 109 109 A Y E -b 4 0A 67 -106,-2.3 -104,-2.9 -2,-0.3 2,-0.5 -0.949 13.3-139.1-131.2 151.4 46.3 101.0 60.4 110 110 A V E -b 5 0A 8 -2,-0.3 2,-0.5 -106,-0.2 -104,-0.2 -0.948 9.7-169.1-118.6 130.3 42.7 100.4 61.2 111 111 A I E -b 6 0A 3 -106,-3.1 -104,-2.2 -2,-0.5 -94,-0.1 -0.972 21.7-144.1-116.7 115.0 39.7 100.6 58.8 112 112 A H - 0 0 9 -2,-0.5 -95,-0.4 -106,-0.2 -92,-0.2 -0.196 17.4-175.7 -75.5 167.1 36.4 100.5 60.6 113 113 A A - 0 0 0 266,-0.1 268,-0.2 -97,-0.1 -97,-0.1 -0.946 44.7 -60.0-153.9 165.4 33.2 98.9 59.4 114 114 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -105,-0.1 -0.272 56.9-160.0 -54.1 134.6 29.5 98.6 60.7 115 115 A S >> - 0 0 0 264,-0.3 4,-2.4 -29,-0.2 3,-1.1 -0.904 28.3-129.7-120.9 147.1 29.5 96.9 64.1 116 116 A I H 3> S+ 0 0 0 -2,-0.3 4,-1.3 1,-0.2 -1,-0.1 0.837 106.0 71.5 -62.3 -28.9 26.6 95.2 65.9 117 117 A Y H 34 S+ 0 0 1 1,-0.2 -1,-0.2 2,-0.2 46,-0.0 0.826 113.6 23.9 -56.2 -35.0 27.5 97.4 68.9 118 118 A S H X4 S+ 0 0 0 -3,-1.1 3,-2.0 1,-0.1 -1,-0.2 0.684 109.8 73.2-103.0 -24.6 26.1 100.4 67.1 119 119 A A H >< S+ 0 0 0 -4,-2.4 3,-2.5 1,-0.3 -2,-0.2 0.725 76.5 81.9 -63.2 -18.6 23.7 98.7 64.7 120 120 A V G ><> + 0 0 0 -4,-1.3 3,-2.4 1,-0.3 5,-0.6 0.659 68.5 85.3 -61.6 -10.2 21.5 98.0 67.7 121 121 A G G X 5S+ 0 0 1 -3,-2.0 3,-1.9 1,-0.3 -1,-0.3 0.806 74.4 71.1 -60.1 -25.3 20.3 101.6 67.1 122 122 A I G < 5S+ 0 0 5 -3,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.610 82.6 70.1 -68.4 -10.7 17.9 100.0 64.7 123 123 A T G < 5S- 0 0 0 -3,-2.4 -1,-0.3 2,-0.2 -2,-0.2 0.625 111.9-118.6 -77.6 -12.5 16.0 98.5 67.6 124 124 A G T < 5S+ 0 0 4 -3,-1.9 2,-0.4 1,-0.3 125,-0.2 0.439 72.5 132.3 90.6 -2.9 14.8 102.1 68.4 125 125 A L < - 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