==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 23-SEP-98 1CS1 . COMPND 2 MOLECULE: PROTEIN (CYSTATHIONINE GAMMA-SYNTHASE); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.CLAUSEN,A.MESSERSCHMIDT . 1536 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45302.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1069 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 86 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 156 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 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 . 73 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 157 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 499 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 32 2.1 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 2 0 3 9 2 6 3 9 4 2 6 3 1 0 0 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 8 4 2 6 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 . 20 0 0 8 12 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 4 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 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 3 A R 0 0 175 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.0 40.9 24.3 20.5 2 4 A K > - 0 0 77 1,-0.1 4,-2.0 1519,-0.1 3,-0.4 -0.153 360.0-101.1 -71.7 167.5 39.9 21.2 18.4 3 5 A Q H > S+ 0 0 44 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.870 121.0 59.2 -60.3 -34.6 39.2 17.8 19.8 4 6 A A H > S+ 0 0 13 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.910 108.8 45.4 -60.6 -39.0 42.6 16.5 18.8 5 7 A T H > S+ 0 0 3 -3,-0.4 4,-2.4 2,-0.2 5,-0.3 0.888 112.4 50.2 -70.7 -40.1 44.2 19.2 21.0 6 8 A I H X S+ 0 0 32 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.936 108.7 51.1 -63.6 -48.4 41.9 18.6 24.0 7 9 A A H < S+ 0 0 1 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.893 115.9 42.7 -58.1 -39.1 42.4 14.8 24.0 8 10 A V H < S+ 0 0 2 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.903 126.1 26.0 -76.6 -42.8 46.2 15.3 24.1 9 11 A R H >< S+ 0 0 30 -4,-2.4 3,-2.1 -5,-0.1 -2,-0.2 0.636 80.2 118.1-102.5 -15.0 46.6 18.2 26.5 10 12 A S T 3< S+ 0 0 12 -4,-2.5 3,-0.1 -5,-0.3 48,-0.1 -0.334 91.7 10.0 -57.1 123.5 43.7 18.2 28.9 11 13 A G T > S+ 0 0 21 1,-0.3 3,-0.9 -2,-0.1 -1,-0.3 0.193 92.5 138.1 94.3 -18.3 45.1 17.6 32.4 12 14 A L T < S+ 0 0 19 -3,-2.1 -1,-0.3 1,-0.2 10,-0.2 -0.317 70.5 17.4 -61.8 144.2 48.8 18.0 31.4 13 15 A N T 3 S+ 0 0 53 8,-3.3 -1,-0.2 7,-0.2 8,-0.1 0.832 80.9 136.9 62.0 34.2 50.9 20.0 33.9 14 16 A D < + 0 0 24 -3,-0.9 2,-0.4 7,-0.4 -2,-0.1 0.895 42.2 94.6 -73.7 -42.5 48.3 19.5 36.6 15 17 A D > + 0 0 7 5,-0.5 4,-0.5 1,-0.2 5,-0.0 -0.343 48.7 177.5 -56.4 109.5 51.0 18.8 39.2 16 18 A E T 4 S+ 0 0 145 -2,-0.4 -1,-0.2 2,-0.1 -2,-0.0 0.653 72.8 55.8 -90.0 -16.4 51.7 22.1 40.9 17 19 A Q T 4 S+ 0 0 45 1,-0.1 -1,-0.1 3,-0.0 -2,-0.1 0.909 122.0 15.2 -84.6 -46.0 54.3 20.7 43.3 18 20 A Y T 4 S- 0 0 26 2,-0.1 409,-0.3 407,-0.1 -2,-0.1 0.464 94.9-118.8-110.4 -2.0 56.9 18.9 41.2 19 21 A G < + 0 0 0 -4,-0.5 398,-2.6 1,-0.2 2,-0.2 0.793 48.3 173.3 70.1 26.8 56.1 20.3 37.7 20 22 A C B -A 416 0A 0 396,-0.2 -5,-0.5 1,-0.2 396,-0.2 -0.483 28.1-152.1 -67.8 136.3 55.3 16.9 36.3 21 23 A V S S+ 0 0 0 394,-2.2 -8,-3.3 -2,-0.2 -7,-0.4 0.951 88.6 49.2 -73.7 -50.4 54.0 17.1 32.8 22 24 A V S S- 0 0 14 393,-0.5 391,-0.4 1335,-0.3 -1,-0.1 -0.770 101.8-114.5 -88.9 126.8 52.0 13.9 33.2 23 25 A P - 0 0 7 0, 0.0 389,-0.2 0, 0.0 -2,-0.1 -0.308 30.0-114.0 -63.3 142.8 49.9 13.9 36.4 24 26 A P - 0 0 3 0, 0.0 2,-0.8 0, 0.0 387,-0.2 -0.156 31.5-101.4 -68.2 168.5 50.8 11.4 39.1 25 27 A I B -B 410 0B 0 385,-2.2 385,-2.4 383,-0.0 2,-1.3 -0.860 29.6-153.3 -97.5 112.1 48.4 8.6 40.1 26 28 A H + 0 0 5 -2,-0.8 25,-0.3 383,-0.2 26,-0.2 -0.692 28.1 161.5 -87.4 89.5 46.7 9.6 43.4 27 29 A L + 0 0 9 -2,-1.3 -1,-0.2 381,-0.2 206,-0.1 0.687 29.9 125.5 -81.7 -19.5 45.9 6.2 44.9 28 30 A S - 0 0 0 379,-0.4 945,-0.3 -3,-0.2 17,-0.1 -0.112 51.8-153.9 -46.9 125.5 45.4 7.6 48.4 29 31 A S S S+ 0 0 2 943,-2.5 16,-2.0 936,-0.1 17,-0.4 0.700 76.8 28.2 -74.7 -20.5 42.0 6.7 49.9 30 32 A T B -C 44 0C 0 942,-0.5 376,-1.9 14,-0.2 377,-0.4 -0.915 65.1-143.3-141.6 167.6 42.1 9.8 52.1 31 33 A Y B -D 405 0D 0 12,-0.7 1062,-0.5 -2,-0.3 374,-0.2 -0.991 25.0-115.7-134.0 138.3 43.4 13.3 52.4 32 34 A N - 0 0 18 372,-2.5 8,-0.3 -2,-0.4 1060,-0.2 -0.370 34.3-111.6 -72.3 151.1 44.7 15.3 55.4 33 35 A F - 0 0 14 1058,-2.5 1058,-0.2 6,-0.2 3,-0.1 -0.549 14.1-130.0 -79.7 146.9 42.7 18.4 56.6 34 36 A T S S- 0 0 102 4,-2.3 2,-0.3 1,-0.2 -1,-0.1 0.940 85.6 -35.3 -60.0 -44.7 44.4 21.8 56.2 35 37 A G B > S-E 38 0E 28 3,-1.4 3,-2.0 -3,-0.0 -1,-0.2 -0.908 97.7 -39.4-162.0-179.2 43.5 22.3 59.8 36 38 A F T 3 S- 0 0 26 1,-0.3 1044,-0.0 -2,-0.3 -2,-0.0 -0.301 131.8 -0.6 -55.2 132.8 40.7 21.5 62.3 37 39 A N T 3 S+ 0 0 91 1,-0.1 -1,-0.3 1067,-0.1 1071,-0.0 0.843 113.3 105.0 53.3 35.6 37.4 21.8 60.5 38 40 A E B < +E 35 0E 32 -3,-2.0 -4,-2.3 0, 0.0 -3,-1.4 -0.581 45.4 172.0-145.0 78.0 39.3 22.8 57.4 39 41 A P - 0 0 59 0, 0.0 -6,-0.2 0, 0.0 4,-0.1 -0.393 29.2-120.5 -81.7 165.8 39.4 20.0 54.8 40 42 A R - 0 0 70 2,-0.6 363,-0.1 -8,-0.3 -9,-0.1 -0.234 49.1 -70.1 -92.3-171.6 40.8 20.5 51.3 41 43 A A S S+ 0 0 80 -2,-0.1 2,-0.4 2,-0.1 362,-0.1 0.795 124.4 40.0 -50.6 -32.4 38.9 20.0 48.0 42 44 A H + 0 0 9 361,-0.3 -2,-0.6 -10,-0.1 3,-0.1 -0.928 51.7 162.2-121.0 146.0 39.0 16.3 48.6 43 45 A D S S+ 0 0 33 -2,-0.4 -12,-0.7 1,-0.3 1050,-0.5 0.427 75.8 22.8-134.8 -13.2 38.5 14.3 51.9 44 46 A Y B >> -C 30 0C 15 4,-0.3 4,-2.3 -14,-0.2 3,-1.7 -0.810 66.0-139.1-161.6 116.3 37.7 10.8 50.7 45 47 A S T 34 S+ 0 0 6 -16,-2.0 -15,-0.1 1,-0.3 -1,-0.1 0.743 100.7 61.5 -44.3 -37.1 38.6 9.2 47.4 46 48 A R T 34 S+ 0 0 7 -17,-0.4 -1,-0.3 1,-0.2 184,-0.2 0.890 115.1 35.3 -61.9 -36.5 35.3 7.4 47.0 47 49 A R T <4 S- 0 0 100 -3,-1.7 2,-0.3 1,-0.3 -2,-0.2 0.873 138.8 -3.0 -83.2 -42.8 33.6 10.8 46.9 48 50 A G < - 0 0 8 -4,-2.3 -1,-0.3 177,-0.1 -4,-0.3 -0.955 60.7-180.0-155.9 134.2 36.3 12.8 45.1 49 51 A N > - 0 0 0 -2,-0.3 4,-1.9 -3,-0.1 5,-0.1 -0.996 28.9-134.0-136.0 137.7 39.8 11.9 43.8 50 52 A P H > S+ 0 0 1 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.852 106.6 47.8 -62.0 -36.9 42.3 14.3 42.0 51 53 A T H > S+ 0 0 8 -25,-0.3 4,-1.8 2,-0.2 5,-0.2 0.919 111.5 49.3 -71.3 -42.7 43.1 11.8 39.3 52 54 A R H > S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.867 108.5 57.3 -62.5 -34.2 39.5 10.9 38.6 53 55 A D H X S+ 0 0 41 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.900 103.7 51.2 -63.5 -43.5 38.8 14.7 38.4 54 56 A V H X S+ 0 0 5 -4,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.939 113.6 43.1 -61.6 -47.2 41.4 15.2 35.7 55 57 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.871 111.3 55.6 -68.9 -33.7 40.0 12.5 33.4 56 58 A Q H X S+ 0 0 27 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.943 108.9 47.4 -63.2 -44.8 36.4 13.6 34.2 57 59 A R H X S+ 0 0 115 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.886 111.7 50.6 -63.1 -38.1 37.3 17.2 33.0 58 60 A A H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.910 112.7 45.4 -65.9 -44.2 39.0 15.8 29.8 59 61 A L H X S+ 0 0 0 -4,-2.5 4,-1.1 2,-0.2 6,-0.2 0.872 112.0 51.9 -69.1 -36.2 35.9 13.6 28.9 60 62 A A H >X>S+ 0 0 3 -4,-2.4 5,-2.4 -5,-0.2 4,-1.1 0.934 109.4 50.5 -65.2 -43.3 33.5 16.5 29.6 61 63 A E H 3<5S+ 0 0 91 -4,-2.4 3,-0.3 1,-0.2 -1,-0.2 0.883 106.4 55.3 -60.6 -39.6 35.5 18.8 27.3 62 64 A L H 3<5S+ 0 0 8 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.768 115.5 37.2 -66.9 -26.1 35.5 16.2 24.5 63 65 A E H <<5S- 0 0 5 -4,-1.1 120,-0.3 -3,-0.6 121,-0.3 0.494 111.9-117.3-102.9 -4.8 31.7 16.0 24.6 64 66 A G T <5 + 0 0 62 -4,-1.1 -3,-0.2 -3,-0.3 2,-0.1 0.751 65.2 145.3 76.0 24.6 31.2 19.7 25.3 65 67 A G < - 0 0 15 -5,-2.4 147,-0.3 -6,-0.2 -1,-0.2 -0.456 61.8-118.3 -92.7 166.1 29.5 19.0 28.6 66 68 A A S S- 0 0 56 145,-2.1 2,-0.3 1,-0.2 146,-0.2 0.897 87.2 -30.2 -68.8 -38.5 29.7 21.0 31.8 67 69 A G E -F 211 0F 13 144,-1.3 144,-2.3 -7,-0.1 2,-0.3 -0.976 58.9-127.9-168.4 173.0 31.2 18.2 33.7 68 70 A A E -F 210 0F 6 -2,-0.3 2,-0.5 142,-0.2 142,-0.2 -0.945 3.8-146.4-137.7 155.9 31.5 14.4 34.0 69 71 A V E -F 209 0F 3 140,-2.6 140,-1.7 -2,-0.3 2,-0.5 -0.969 19.5-148.5-122.3 112.0 31.1 11.6 36.5 70 72 A L E -F 208 0F 0 -2,-0.5 161,-2.5 138,-0.2 138,-0.3 -0.720 18.0-168.5 -83.3 124.4 33.5 8.6 36.0 71 73 A T E -FG 207 230F 0 136,-2.5 136,-2.3 -2,-0.5 159,-0.3 -0.620 34.0-107.8-106.9 168.2 32.0 5.3 37.1 72 74 A N S S+ 0 0 13 157,-2.1 2,-0.3 134,-0.2 158,-0.1 0.707 98.0 5.3 -72.5 -18.7 33.6 1.9 37.6 73 75 A T S > S- 0 0 2 156,-0.3 4,-1.0 133,-0.2 134,-0.4 -0.960 73.6-111.3-152.6 164.2 32.0 0.3 34.5 74 76 A G H >> S+ 0 0 0 132,-0.4 4,-1.9 -2,-0.3 3,-0.6 0.904 119.4 56.0 -65.6 -38.4 29.8 1.4 31.7 75 77 A M H 3> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.866 105.0 51.4 -62.7 -34.5 27.0 -0.6 33.2 76 78 A S H 3> S+ 0 0 0 922,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.735 105.6 55.4 -76.6 -18.1 27.3 1.3 36.5 77 79 A A H - 0 0 82 -2,-0.4 3,-3.0 1,-0.1 29,-0.3 -0.866 59.4 -54.2-132.5 166.9 11.9 5.4 41.4 88 90 A P T 3 S+ 0 0 35 0, 0.0 27,-0.2 0, 0.0 26,-0.2 -0.131 128.9 21.6 -46.2 129.8 9.1 2.8 41.7 89 91 A G T 3 S+ 0 0 45 1,-0.4 26,-0.1 24,-0.3 2,-0.1 0.121 95.8 117.9 97.6 -20.7 6.3 3.8 39.3 90 92 A D < - 0 0 22 -3,-3.0 26,-3.5 24,-0.3 -1,-0.4 -0.462 59.1-129.2 -78.6 155.3 8.4 6.0 37.1 91 93 A L E -h 116 0F 7 44,-0.3 46,-2.6 24,-0.2 47,-1.2 -0.883 16.6-166.4-114.1 140.6 8.8 5.1 33.5 92 94 A L E -hi 117 138F 1 24,-2.4 26,-2.5 -2,-0.4 2,-0.5 -0.963 9.3-154.3-118.7 132.2 11.9 4.7 31.3 93 95 A V E +hi 118 139F 0 45,-2.1 47,-2.6 -2,-0.4 26,-0.2 -0.956 23.0 176.2-108.6 127.0 11.6 4.5 27.5 94 96 A A E -h 119 0F 0 24,-2.9 26,-2.8 -2,-0.5 2,-0.1 -0.862 36.2 -85.3-128.2 162.3 14.6 2.6 25.9 95 97 A P E > -h 120 0F 2 0, 0.0 3,-1.5 0, 0.0 26,-0.2 -0.436 28.5-134.4 -68.6 140.2 15.5 1.5 22.4 96 98 A H T 3 S+ 0 0 85 24,-1.9 25,-0.2 1,-0.3 23,-0.1 0.747 108.1 40.7 -65.8 -21.8 14.1 -1.8 21.3 97 99 A D T 3 S+ 0 0 40 23,-0.3 49,-0.6 45,-0.1 -1,-0.3 -0.010 87.6 139.7-116.6 29.6 17.6 -2.7 20.0 98 100 A C < - 0 0 11 -3,-1.5 5,-0.1 1,-0.2 47,-0.1 -0.106 65.1 -59.3 -70.0 170.2 19.8 -1.3 22.8 99 101 A Y > - 0 0 47 1,-0.1 4,-2.4 3,-0.1 5,-0.2 -0.146 48.0-123.7 -47.9 136.7 22.9 -3.0 24.3 100 102 A G H > S+ 0 0 42 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.867 111.1 53.6 -54.5 -39.8 22.1 -6.4 25.8 101 103 A G H > S+ 0 0 5 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.933 109.3 48.5 -61.6 -45.3 23.5 -5.4 29.1 102 104 A S H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.931 112.1 48.0 -60.1 -48.4 21.2 -2.3 29.2 103 105 A Y H X S+ 0 0 110 -4,-2.4 4,-3.1 1,-0.2 5,-0.3 0.952 112.5 49.2 -57.2 -50.8 18.1 -4.4 28.3 104 106 A R H X S+ 0 0 57 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.868 111.0 49.8 -58.9 -39.4 18.9 -7.0 30.9 105 107 A L H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.2 5,-0.2 0.946 114.9 42.4 -66.1 -48.1 19.4 -4.4 33.6 106 108 A F H X S+ 0 0 2 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.931 116.5 48.4 -64.6 -46.1 16.1 -2.6 32.9 107 109 A D H X S+ 0 0 58 -4,-3.1 4,-2.1 -5,-0.3 -2,-0.2 0.942 110.6 50.9 -60.3 -47.8 14.2 -5.8 32.5 108 110 A S H < S+ 0 0 8 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.887 117.1 39.1 -59.0 -39.9 15.6 -7.4 35.7 109 111 A L H ><>S+ 0 0 11 -4,-1.9 5,-1.8 2,-0.2 3,-1.7 0.888 112.4 53.3 -81.3 -38.8 14.7 -4.3 37.8 110 112 A A H ><5S+ 0 0 26 -4,-2.9 3,-1.7 1,-0.3 -2,-0.2 0.880 102.7 61.3 -63.0 -31.9 11.4 -3.5 36.2 111 113 A K T 3<5S+ 0 0 149 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.617 105.0 49.0 -68.6 -10.1 10.4 -7.1 36.9 112 114 A R T < 5S- 0 0 51 -3,-1.7 -1,-0.3 3,-0.1 -2,-0.2 0.352 120.7-108.4-106.6 0.6 10.9 -6.3 40.6 113 115 A G T < 5S+ 0 0 38 -3,-1.7 -24,-0.3 -4,-0.3 -3,-0.2 0.501 80.7 129.3 86.6 4.1 8.8 -3.1 40.5 114 116 A C S - 0 0 53 -2,-0.3 3,-1.9 -26,-0.2 7,-0.4 -0.722 31.9-164.0 -80.7 99.4 11.6 1.3 18.0 122 124 A Q T 3 S+ 0 0 7 -2,-1.3 31,-0.2 1,-0.3 -1,-0.2 0.486 83.1 67.1 -67.1 -2.1 12.6 4.9 18.2 123 125 A G T 3 S+ 0 0 44 1,-0.1 2,-1.0 29,-0.1 -1,-0.3 0.653 83.3 82.0 -89.2 -17.7 12.8 5.0 14.4 124 126 A D <> - 0 0 52 -3,-1.9 4,-3.3 1,-0.2 5,-0.3 -0.777 68.5-161.4 -90.9 98.1 9.0 4.5 14.3 125 127 A E H > S+ 0 0 82 -2,-1.0 4,-2.8 1,-0.2 -1,-0.2 0.839 89.5 48.0 -46.7 -45.7 7.5 8.0 14.9 126 128 A Q H > S+ 0 0 140 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.952 114.4 44.8 -63.3 -52.1 4.1 6.6 15.8 127 129 A A H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.947 116.5 47.4 -58.0 -48.8 5.5 4.0 18.2 128 130 A L H X S+ 0 0 0 -4,-3.3 4,-2.6 -7,-0.4 5,-0.2 0.914 109.3 53.3 -58.8 -46.5 7.8 6.7 19.7 129 131 A R H X S+ 0 0 120 -4,-2.8 4,-1.3 -5,-0.3 -1,-0.2 0.898 109.3 49.4 -55.8 -43.3 5.1 9.3 20.0 130 132 A A H X S+ 0 0 58 -4,-2.2 4,-0.5 2,-0.2 -1,-0.2 0.849 109.9 50.4 -67.0 -36.4 2.9 6.8 22.0 131 133 A A H >< S+ 0 0 2 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.943 110.9 48.4 -67.8 -46.5 5.7 5.9 24.4 132 134 A L H >< S+ 0 0 6 -4,-2.6 3,-1.5 1,-0.3 -1,-0.2 0.767 101.5 65.1 -65.2 -24.3 6.5 9.5 25.1 133 135 A A H 3< S+ 0 0 75 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.725 89.4 66.8 -68.6 -21.8 2.7 10.1 25.7 134 136 A E T << S- 0 0 114 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.449 113.0-125.3 -77.5 0.2 3.1 7.8 28.7 135 137 A K < - 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