==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-JUN-11 3SBM . COMPND 2 MOLECULE: DISD PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SORANGIUM CELLULOSUM; . AUTHOR C.KHOSLA,I.I.MATHEWS,F.T.WONG,X.JIN . 281 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12467.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 6.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 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 . 18 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 0 3 2 1 0 2 2 1 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL BRIDGES PER LADDER . 1 0 0 1 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 . 0 0 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 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 91 0, 0.0 258,-2.1 0, 0.0 259,-1.8 0.000 360.0 360.0 360.0 171.7 30.2 12.0 30.8 2 2 A K E -a 260 0A 17 256,-0.2 78,-2.4 257,-0.2 79,-1.3 -0.940 360.0-166.6-130.6 139.5 32.2 13.4 27.8 3 3 A A E -ab 261 81A 0 257,-2.6 259,-2.6 -2,-0.3 2,-0.4 -0.978 14.1-141.9-122.5 142.2 31.6 16.2 25.3 4 4 A Y E -ab 262 82A 0 77,-2.1 79,-2.0 -2,-0.4 2,-0.4 -0.879 15.0-156.9-100.8 135.8 33.5 16.9 22.0 5 5 A M E -ab 263 83A 0 257,-2.5 259,-2.8 -2,-0.4 79,-0.2 -0.968 3.1-152.7-114.9 129.4 34.1 20.6 21.2 6 6 A F E - b 0 84A 0 77,-2.3 79,-2.8 -2,-0.4 82,-0.2 -0.880 15.0-136.3-111.8 121.4 34.7 21.6 17.6 7 7 A P - 0 0 1 0, 0.0 2,-0.1 0, 0.0 84,-0.1 -0.229 20.1-169.1 -80.8 161.8 36.9 24.7 16.8 8 8 A G > - 0 0 6 1,-0.3 3,-2.2 79,-0.1 4,-0.3 -0.383 43.0 -10.7-127.2-157.1 36.2 27.5 14.4 9 9 A Q T 3 S+ 0 0 77 1,-0.3 -1,-0.3 76,-0.2 43,-0.1 -0.119 121.6 30.6 -49.3 135.1 37.8 30.5 12.7 10 10 A G T 3 S+ 0 0 56 -3,-0.1 -1,-0.3 259,-0.0 42,-0.0 0.088 100.2 83.0 100.9 -18.8 41.1 31.6 14.2 11 11 A S < + 0 0 10 -3,-2.2 -2,-0.1 256,-0.1 258,-0.1 0.578 66.3 108.9 -93.7 -8.3 42.1 28.0 15.2 12 12 A Q + 0 0 41 -4,-0.3 2,-0.3 39,-0.1 45,-0.0 -0.204 41.4 175.0 -68.3 154.9 43.5 27.0 11.8 13 13 A A > - 0 0 38 30,-0.1 3,-2.2 254,-0.0 -2,-0.0 -0.958 40.9 -92.6-155.4 146.1 47.2 26.5 11.1 14 14 A K T 3 S+ 0 0 144 -2,-0.3 30,-0.2 1,-0.3 29,-0.1 -0.351 114.9 34.3 -54.7 135.6 49.3 25.4 8.2 15 15 A G T > S+ 0 0 10 28,-3.0 3,-1.6 1,-0.3 -1,-0.3 0.209 82.6 147.6 95.2 -11.8 49.8 21.6 8.7 16 16 A M T < + 0 0 1 -3,-2.2 -1,-0.3 27,-0.6 -4,-0.0 -0.251 68.0 9.8 -53.5 137.6 46.4 21.0 10.2 17 17 A G T >> S+ 0 0 13 -3,-0.1 4,-1.2 3,-0.1 3,-1.0 0.482 78.4 145.1 81.1 1.4 45.0 17.6 9.4 18 18 A R H <> S+ 0 0 141 -3,-1.6 4,-0.6 1,-0.3 3,-0.5 0.848 72.9 40.4 -52.9 -46.4 48.1 16.1 7.8 19 19 A A H 3> S+ 0 0 83 1,-0.2 4,-1.1 2,-0.1 3,-0.3 0.793 109.2 63.1 -69.2 -24.5 47.6 12.5 9.0 20 20 A L H <> S+ 0 0 17 -3,-1.0 4,-1.7 1,-0.2 -1,-0.2 0.837 89.4 64.0 -75.1 -30.8 43.9 12.5 8.4 21 21 A F H < S+ 0 0 2 -4,-1.2 7,-0.2 -3,-0.5 -1,-0.2 0.894 107.7 42.9 -64.9 -37.0 43.9 13.0 4.6 22 22 A D H < S+ 0 0 102 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.2 0.765 111.7 54.9 -79.3 -23.3 45.6 9.7 4.1 23 23 A A H < S+ 0 0 61 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.748 119.7 31.3 -78.6 -24.2 43.4 7.9 6.6 24 24 A F S X S+ 0 0 23 -4,-1.7 4,-2.2 1,-0.1 -1,-0.2 -0.561 71.4 156.9-130.8 66.3 40.2 9.0 4.9 25 25 A P H > S+ 0 0 84 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.857 72.1 51.8 -69.9 -36.8 41.2 9.2 1.2 26 26 A A H > S+ 0 0 47 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.954 113.1 44.4 -63.8 -48.3 37.6 8.8 -0.2 27 27 A L H > S+ 0 0 34 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.898 112.5 53.1 -62.3 -37.5 36.2 11.6 1.9 28 28 A T H X S+ 0 0 8 -4,-2.2 4,-2.3 -7,-0.2 11,-0.3 0.947 110.7 46.6 -62.1 -44.4 39.2 13.8 1.1 29 29 A A H X S+ 0 0 58 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.885 110.7 52.6 -65.8 -37.2 38.7 13.3 -2.6 30 30 A R H X S+ 0 0 140 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.874 107.6 52.0 -67.4 -37.0 34.9 14.0 -2.2 31 31 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.931 107.6 51.9 -62.3 -45.2 35.8 17.3 -0.4 32 32 A D H X>S+ 0 0 45 -4,-2.3 4,-2.3 1,-0.2 5,-0.5 0.870 107.7 53.7 -58.4 -36.5 38.1 18.2 -3.3 33 33 A G H <5S+ 0 0 65 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.926 111.7 43.1 -64.3 -43.2 35.2 17.5 -5.7 34 34 A V H <5S+ 0 0 51 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.900 122.0 39.7 -66.0 -40.0 32.8 19.9 -3.8 35 35 A L H <5S- 0 0 14 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.744 96.7-130.5 -89.6 -28.8 35.4 22.6 -3.4 36 36 A G T <5S+ 0 0 68 -4,-2.3 2,-0.3 1,-0.3 -3,-0.1 0.622 79.4 66.7 84.8 13.8 37.2 22.6 -6.7 37 37 A Y S - 0 0 47 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 -0.616 30.1-166.7 -77.4 113.6 42.9 20.1 -3.1 39 39 A I H > S+ 0 0 0 -2,-0.6 4,-2.1 -11,-0.3 5,-0.2 0.858 90.1 56.0 -67.5 -35.0 41.9 20.4 0.6 40 40 A R H > S+ 0 0 82 1,-0.2 4,-2.9 2,-0.2 5,-0.4 0.949 108.5 46.7 -59.4 -49.0 45.1 18.5 1.5 41 41 A A H >>S+ 0 0 28 1,-0.2 4,-2.3 2,-0.2 5,-1.7 0.904 110.8 52.3 -63.0 -43.5 47.2 21.2 -0.3 42 42 A L H <5S+ 0 0 8 -4,-2.1 4,-0.4 3,-0.2 -1,-0.2 0.936 117.7 37.1 -56.6 -46.4 45.3 24.0 1.3 43 43 A C H <5S+ 0 0 0 -4,-2.1 -28,-3.0 2,-0.1 -27,-0.6 0.894 125.4 37.4 -75.9 -37.7 45.8 22.7 4.8 44 44 A Q H <5S+ 0 0 70 -4,-2.9 -3,-0.2 -30,-0.2 -2,-0.2 0.870 136.8 9.8 -83.1 -48.2 49.4 21.3 4.4 45 45 A D T <5S- 0 0 90 -4,-2.3 -3,-0.2 -5,-0.4 4,-0.2 0.618 70.8-153.8-109.1 -22.4 51.1 23.9 2.2 46 46 A D > < + 0 0 30 -5,-1.7 3,-2.0 -4,-0.4 -4,-0.2 0.902 23.7 178.9 38.7 56.1 48.7 26.9 1.9 47 47 A P T 3 S+ 0 0 67 0, 0.0 -1,-0.1 0, 0.0 -5,-0.1 0.641 74.9 40.4 -67.7 -16.8 50.3 27.6 -1.5 48 48 A D T 3 S- 0 0 94 -6,-0.1 -2,-0.1 0, 0.0 -6,-0.0 0.186 109.8-118.5-112.2 10.9 48.1 30.6 -2.3 49 49 A Q S < S+ 0 0 131 -3,-2.0 3,-0.1 -4,-0.2 -3,-0.1 0.884 77.7 121.9 53.6 45.2 48.1 32.0 1.3 50 50 A R > + 0 0 68 1,-0.1 3,-2.1 2,-0.1 6,-0.4 0.528 32.5 97.2-117.6 5.0 44.4 31.7 1.7 51 51 A L T 3 S+ 0 0 4 1,-0.3 -1,-0.1 -9,-0.2 -39,-0.1 0.817 86.7 55.1 -60.0 -28.0 44.0 29.5 4.7 52 52 A S T 3 S+ 0 0 83 -3,-0.1 2,-0.5 4,-0.1 -1,-0.3 0.521 88.6 90.5 -78.4 -12.5 43.5 32.8 6.7 53 53 A Q S X> S- 0 0 82 -3,-2.1 3,-2.5 1,-0.1 4,-2.3 -0.840 79.6-135.8 -94.1 123.2 40.7 33.9 4.5 54 54 A T H 3> S+ 0 0 9 -2,-0.5 4,-2.2 1,-0.3 -1,-0.1 0.704 99.9 66.2 -60.2 -29.0 37.3 32.7 5.8 55 55 A Q H 34 S+ 0 0 50 1,-0.2 -1,-0.3 2,-0.2 58,-0.2 0.808 119.6 27.1 -60.2 -27.6 35.9 31.5 2.4 56 56 A F H <> S+ 0 0 33 -3,-2.5 4,-2.1 -6,-0.4 -2,-0.3 0.739 116.9 59.7 -99.2 -34.7 38.8 28.9 2.6 57 57 A T H X S+ 0 0 0 -4,-2.3 4,-2.8 -7,-0.3 5,-0.3 0.865 99.8 58.1 -62.9 -42.7 39.2 28.6 6.3 58 58 A Q H X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.964 109.6 41.9 -58.6 -50.8 35.6 27.4 6.8 59 59 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.905 114.6 52.9 -60.1 -39.1 35.9 24.4 4.5 60 60 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.946 113.0 43.1 -62.3 -47.5 39.4 23.6 5.9 61 61 A L H X S+ 0 0 1 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.893 112.6 52.9 -65.3 -43.2 38.2 23.6 9.5 62 62 A Y H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.3 5,-0.2 0.942 112.5 44.7 -59.7 -46.2 35.0 21.6 8.6 63 63 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.958 115.9 45.5 -63.9 -47.9 37.0 18.9 6.9 64 64 A V H X S+ 0 0 2 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.932 115.2 47.8 -61.8 -43.9 39.7 18.6 9.6 65 65 A N H X S+ 0 0 0 -4,-2.9 4,-2.1 -5,-0.2 -1,-0.2 0.894 113.3 47.9 -61.8 -40.9 37.1 18.7 12.3 66 66 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.933 114.5 44.4 -70.6 -45.4 34.9 16.0 10.6 67 67 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.881 111.0 54.8 -66.3 -36.9 37.8 13.7 9.9 68 68 A S H X S+ 0 0 19 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.908 108.9 49.5 -60.9 -39.7 39.1 14.2 13.4 69 69 A Y H X S+ 0 0 10 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.923 109.1 50.8 -62.5 -48.7 35.7 13.1 14.7 70 70 A L H X S+ 0 0 15 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.898 110.1 50.1 -58.8 -39.1 35.7 10.0 12.5 71 71 A K H X S+ 0 0 91 -4,-2.4 4,-1.0 2,-0.2 -1,-0.2 0.935 111.2 48.6 -65.3 -45.1 39.1 9.1 13.8 72 72 A R H >X S+ 0 0 71 -4,-2.3 4,-2.4 1,-0.2 3,-0.6 0.887 107.5 55.4 -62.2 -38.1 37.9 9.5 17.4 73 73 A R H 3< S+ 0 0 163 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.849 108.5 49.8 -63.0 -31.1 34.8 7.4 16.6 74 74 A E H 3< S+ 0 0 127 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.774 121.0 33.3 -74.0 -23.7 37.1 4.6 15.5 75 75 A E H << S+ 0 0 124 -4,-1.0 2,-0.3 -3,-0.6 -2,-0.2 0.632 116.6 29.5-115.5 -17.7 39.3 4.8 18.6 76 76 A E S < S- 0 0 59 -4,-2.4 -1,-0.1 -5,-0.1 0, 0.0 -0.905 85.7 -78.2-145.2 164.5 37.1 5.7 21.7 77 77 A A - 0 0 68 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.1 -0.211 64.0 -88.3 -59.5 153.2 33.6 5.4 23.2 78 78 A P - 0 0 98 0, 0.0 -76,-0.2 0, 0.0 -1,-0.1 -0.305 43.0-109.2 -67.6 149.1 31.0 7.9 21.7 79 79 A P - 0 0 8 0, 0.0 -76,-0.2 0, 0.0 3,-0.1 -0.417 11.3-142.0 -71.8 154.2 30.6 11.3 23.3 80 80 A D S S+ 0 0 69 -78,-2.4 2,-0.3 1,-0.2 -77,-0.2 0.720 82.8 16.4 -82.1 -29.3 27.5 12.2 25.2 81 81 A F E -b 3 0A 10 -79,-1.3 -77,-2.1 135,-0.1 2,-0.3 -0.965 63.4-152.7-145.5 156.9 27.3 15.8 23.9 82 82 A L E +bc 4 218A 0 135,-2.3 137,-2.5 -2,-0.3 2,-0.3 -0.977 14.3 171.5-130.3 145.4 28.6 17.9 21.0 83 83 A A E -bc 5 219A 0 -79,-2.0 -77,-2.3 -2,-0.3 2,-0.4 -0.965 8.9-167.1-153.1 136.7 29.2 21.6 20.7 84 84 A G E -b 6 0A 0 135,-0.5 2,-0.9 -2,-0.3 5,-0.3 -0.966 25.0-122.1-126.7 149.0 31.0 23.6 18.1 85 85 A H > - 0 0 22 -79,-2.8 3,-2.2 -2,-0.4 2,-0.6 -0.765 68.4 -64.7 -93.0 102.8 32.2 27.2 18.0 86 86 A S T > S+ 0 0 13 -2,-0.9 3,-1.5 1,-0.3 4,-0.5 -0.386 141.1 25.8 58.7-100.2 30.5 29.0 15.0 87 87 A L T >> S+ 0 0 1 -2,-0.6 3,-1.9 1,-0.3 4,-0.8 0.922 118.3 66.9 -51.9 -36.9 31.9 27.1 12.0 88 88 A G H <> S+ 0 0 0 -3,-2.2 4,-2.3 1,-0.3 -1,-0.3 0.725 82.1 73.4 -60.3 -23.3 32.3 24.3 14.5 89 89 A E H <> S+ 0 0 8 -3,-1.5 4,-2.6 -5,-0.3 -1,-0.3 0.852 92.9 55.3 -56.7 -36.5 28.6 23.9 14.8 90 90 A F H <> S+ 0 0 1 -3,-1.9 4,-2.1 -4,-0.5 -1,-0.2 0.894 107.6 48.8 -65.3 -40.0 28.5 22.4 11.3 91 91 A S H X S+ 0 0 0 -4,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.898 111.1 50.0 -60.5 -42.1 31.0 19.8 12.4 92 92 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.899 110.1 49.6 -64.3 -44.6 29.0 19.1 15.5 93 93 A L H <>S+ 0 0 3 -4,-2.6 5,-2.5 2,-0.2 6,-0.5 0.890 110.1 51.3 -64.6 -38.0 25.8 18.7 13.4 94 94 A F H ><5S+ 0 0 25 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.951 109.2 50.7 -57.1 -47.8 27.6 16.3 11.0 95 95 A A H 3<5S+ 0 0 10 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.840 109.0 52.8 -62.5 -30.2 28.8 14.2 14.0 96 96 A A T 3<5S- 0 0 0 -4,-1.7 119,-2.8 -5,-0.1 -1,-0.3 0.428 116.6-113.8 -85.3 -1.5 25.2 14.1 15.2 97 97 A G T < 5S+ 0 0 22 -3,-1.8 -3,-0.2 2,-0.3 -2,-0.1 0.711 75.8 133.0 79.0 18.7 23.9 12.8 11.9 98 98 A V S - 0 0 86 -2,-0.3 4,-2.6 -3,-0.1 5,-0.3 -0.243 42.1 -93.1 -87.5 175.7 26.1 13.9 5.8 101 101 A F H > S+ 0 0 7 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.920 122.2 42.8 -55.7 -50.6 29.7 14.9 5.1 102 102 A E H > S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.839 112.2 53.2 -70.1 -35.0 29.2 16.4 1.7 103 103 A T H > S+ 0 0 42 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.942 109.6 48.5 -65.3 -47.0 26.0 18.2 2.6 104 104 A G H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.901 109.9 53.3 -57.2 -39.7 27.7 19.9 5.5 105 105 A L H X S+ 0 0 0 -4,-1.9 4,-2.5 -5,-0.3 -1,-0.2 0.914 106.6 51.7 -65.9 -39.8 30.6 20.9 3.3 106 106 A A H X S+ 0 0 25 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.911 110.3 49.7 -60.3 -40.4 28.3 22.5 0.8 107 107 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.906 113.4 44.7 -66.8 -43.5 26.7 24.6 3.6 108 108 A V H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.842 108.1 57.8 -72.1 -32.8 30.1 25.7 4.9 109 109 A K H X S+ 0 0 59 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.953 112.5 41.7 -57.0 -49.7 31.4 26.5 1.4 110 110 A K H X S+ 0 0 58 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.933 112.9 52.8 -62.8 -44.8 28.4 28.9 1.1 111 111 A R H X S+ 0 0 4 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.939 111.7 46.5 -58.1 -45.3 28.7 30.3 4.6 112 112 A G H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.867 111.3 51.7 -65.7 -40.3 32.4 31.1 4.0 113 113 A E H X S+ 0 0 70 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.950 113.6 43.6 -58.7 -49.9 31.7 32.7 0.6 114 114 A L H X S+ 0 0 14 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.900 117.1 45.1 -66.1 -41.4 29.0 34.9 2.1 115 115 A M H < S+ 0 0 4 -4,-2.6 3,-0.5 -5,-0.3 -1,-0.2 0.907 113.1 50.5 -72.2 -37.6 31.0 35.9 5.2 116 116 A G H < S+ 0 0 13 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.772 112.3 48.1 -69.2 -29.2 34.2 36.5 3.2 117 117 A D H < S+ 0 0 131 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.592 91.1 101.5 -85.3 -12.6 32.3 38.7 0.8 118 118 A A < - 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0 0 11 26,-0.6 -1,-0.3 -3,-0.1 2,-0.1 -0.948 64.2-130.2-119.9 139.2 36.8 41.9 31.4 130 130 A D > - 0 0 92 -2,-0.4 4,-2.4 25,-0.1 5,-0.2 -0.336 33.1-101.2 -80.0 167.6 33.5 40.3 32.3 131 131 A E H > S+ 0 0 64 23,-0.2 4,-2.6 1,-0.2 5,-0.2 0.890 120.3 49.6 -56.2 -45.7 30.4 40.6 30.1 132 132 A E H > S+ 0 0 127 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.900 111.0 50.0 -68.1 -34.9 28.7 43.2 32.3 133 133 A R H > S+ 0 0 83 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.916 110.2 50.5 -66.6 -41.8 31.8 45.3 32.4 134 134 A V H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.939 111.4 49.0 -58.6 -48.2 32.1 45.2 28.6 135 135 A R H X S+ 0 0 102 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.915 110.5 50.3 -57.5 -45.5 28.5 46.2 28.3 136 136 A E H X S+ 0 0 79 -4,-2.4 4,-3.2 1,-0.2 5,-0.2 0.914 109.7 50.7 -58.8 -45.4 29.0 49.1 30.7 137 137 A L H X S+ 0 0 7 -4,-2.5 4,-1.8 2,-0.2 6,-0.2 0.899 108.9 50.8 -64.1 -39.9 32.0 50.3 28.8 138 138 A L H <>S+ 0 0 17 -4,-2.4 5,-2.3 2,-0.2 4,-0.2 0.936 115.2 44.0 -59.7 -45.0 30.2 50.3 25.4 139 139 A D H ><5S+ 0 0 122 -4,-2.2 3,-1.5 -5,-0.2 -2,-0.2 0.958 114.0 47.7 -63.9 -53.5 27.4 52.3 27.0 140 140 A Q H 3<5S+ 0 0 121 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.779 113.6 48.1 -63.9 -26.8 29.5 54.8 28.9 141 141 A N T 3<5S- 0 0 55 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.301 111.4-116.5-100.7 9.4 31.8 55.5 25.8 142 142 A G T < 5 + 0 0 40 -3,-1.5 2,-1.7 -4,-0.2 -3,-0.2 0.797 57.9 154.7 69.2 27.7 28.9 56.0 23.4 143 143 A A > < + 0 0 5 -5,-2.3 3,-1.4 -6,-0.2 -1,-0.2 -0.455 4.6 158.9 -89.9 74.1 29.7 53.0 21.2 144 144 A T T 3 + 0 0 111 -2,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.522 66.3 58.0 -79.3 -3.7 26.2 52.5 19.9 145 145 A A T 3 S+ 0 0 21 -3,-0.1 17,-1.9 17,-0.1 2,-0.4 0.067 87.1 94.5-114.1 27.8 27.3 50.6 16.8 146 146 A V E < -H 161 0C 9 -3,-1.4 2,-0.2 15,-0.2 15,-0.2 -0.979 50.4-174.0-123.4 132.9 29.1 47.8 18.7 147 147 A D E -H 160 0C 45 13,-3.3 13,-2.6 -2,-0.4 2,-0.7 -0.722 34.8-104.2-114.6 156.4 27.6 44.4 19.6 148 148 A I E +H 159 0C 7 -2,-0.2 11,-0.3 11,-0.2 3,-0.1 -0.813 38.0 178.5 -79.6 121.6 29.0 41.5 21.7 149 149 A A E + 0 0 0 9,-2.5 95,-2.5 -2,-0.7 2,-0.4 0.814 62.3 20.4 -93.5 -39.9 29.9 38.8 19.2 150 150 A N E -Hi 158 244C 18 8,-1.9 8,-2.1 93,-0.2 2,-0.7 -0.996 47.9-165.0-136.4 135.9 31.3 36.1 21.4 151 151 A L E +Hi 157 245C 11 93,-2.8 96,-2.8 -2,-0.4 95,-0.7 -0.927 31.4 159.5-109.6 92.0 30.9 35.2 25.1 152 152 A N E - 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