==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 12-OCT-93 1GHS . COMPND 2 MOLECULE: 1,3-BETA-GLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HORDEUM VULGARE; . AUTHOR T.P.J.GARRETT,J.N.VARGHESE . 612 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24126.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 431 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 82 13.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 48 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 174 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.3 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 1 1 4 2 0 0 0 4 3 0 1 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 6 6 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 PARALLEL BRIDGES PER LADDER . 3 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 0 0 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 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 I 0 0 40 0, 0.0 27,-1.4 0, 0.0 28,-0.6 0.000 360.0 360.0 360.0 167.3 51.3 7.8 76.5 2 2 A G E -ab 29 272A 3 269,-1.9 271,-2.6 26,-0.2 2,-0.4 -0.654 360.0-151.8-109.7 163.1 50.7 4.5 78.3 3 3 A V E -ab 30 273A 0 26,-2.4 28,-0.9 269,-0.2 2,-0.3 -0.998 21.5-123.9-133.5 134.3 49.5 3.6 81.8 4 4 A C E -ab 31 274A 0 269,-3.1 272,-2.3 -2,-0.4 2,-0.7 -0.614 23.1-143.0 -74.5 139.3 50.5 0.4 83.7 5 5 A Y + 0 0 7 26,-2.8 28,-0.5 -2,-0.3 2,-0.3 -0.847 22.0 178.8-112.2 95.9 47.5 -1.6 84.8 6 6 A G - 0 0 4 -2,-0.7 271,-0.2 271,-0.2 26,-0.0 -0.763 15.5-168.0 -95.8 145.6 47.8 -3.2 88.2 7 7 A V + 0 0 32 -2,-0.3 2,-1.2 1,-0.1 5,-0.1 -0.081 44.0 124.2-123.9 34.8 45.0 -5.3 89.7 8 8 A I + 0 0 77 2,-0.0 273,-2.1 0, 0.0 274,-0.3 -0.547 54.1 83.0 -97.0 68.9 46.2 -5.8 93.3 9 9 A G S S- 0 0 14 -2,-1.2 3,-0.4 271,-0.2 270,-0.1 -0.962 74.4-129.4-159.1 158.8 43.2 -4.4 95.1 10 10 A N S S+ 0 0 111 -2,-0.3 269,-0.1 1,-0.2 -2,-0.0 0.343 100.2 48.9 -98.7 12.1 39.8 -5.7 96.1 11 11 A N S S+ 0 0 75 2,-0.0 -1,-0.2 0, 0.0 268,-0.0 0.107 74.7 126.2-141.9 28.1 37.7 -2.9 94.6 12 12 A L - 0 0 40 -3,-0.4 285,-0.1 1,-0.1 3,-0.1 -0.356 59.0 -95.0 -86.6 163.2 38.8 -2.2 91.0 13 13 A P - 0 0 15 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.191 46.1 -83.8 -74.0 168.0 36.6 -2.2 87.8 14 14 A S >> - 0 0 56 1,-0.1 4,-2.5 4,-0.0 3,-0.6 -0.396 42.8-111.7 -65.7 150.2 35.9 -5.0 85.3 15 15 A R H 3> S+ 0 0 53 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.908 119.9 49.7 -51.8 -46.8 38.6 -5.4 82.6 16 16 A S H 3> S+ 0 0 82 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.855 109.0 52.2 -64.9 -29.4 36.2 -4.2 79.9 17 17 A D H <> S+ 0 0 50 -3,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.890 110.1 51.5 -65.8 -42.0 35.3 -1.2 82.0 18 18 A V H X S+ 0 0 1 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.925 107.7 48.4 -61.3 -51.2 39.0 -0.6 82.3 19 19 A V H X S+ 0 0 10 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.845 111.0 53.3 -57.9 -36.7 39.8 -0.7 78.6 20 20 A Q H X S+ 0 0 119 -4,-1.6 4,-2.4 -5,-0.2 -1,-0.2 0.888 105.7 52.0 -66.4 -43.5 36.8 1.6 78.0 21 21 A L H X S+ 0 0 21 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.896 109.8 51.6 -60.7 -42.7 38.2 4.2 80.5 22 22 A Y H X>S+ 0 0 0 -4,-1.9 5,-2.5 1,-0.2 4,-1.0 0.934 110.4 45.9 -58.8 -53.1 41.5 4.0 78.6 23 23 A R H <5S+ 0 0 152 -4,-2.3 -1,-0.2 3,-0.2 -2,-0.2 0.861 112.5 52.7 -62.0 -33.4 39.9 4.7 75.2 24 24 A S H <5S+ 0 0 91 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.952 112.3 43.1 -66.5 -48.2 37.9 7.5 76.7 25 25 A K H <5S- 0 0 92 -4,-2.4 281,-0.3 -5,-0.1 -1,-0.2 0.553 114.3-117.6 -73.3 -12.8 40.9 9.3 78.2 26 26 A G T <5 + 0 0 46 -4,-1.0 2,-0.5 1,-0.3 -3,-0.2 0.831 55.8 159.6 79.2 30.7 42.9 8.7 75.0 27 27 A I < - 0 0 4 -5,-2.5 -1,-0.3 -6,-0.2 -25,-0.2 -0.787 19.9-172.4 -87.5 126.6 45.5 6.5 76.6 28 28 A N + 0 0 95 -27,-1.4 21,-1.6 -2,-0.5 2,-0.3 0.076 57.4 60.6-110.1 26.3 47.3 4.4 73.9 29 29 A G E -ac 2 49A 2 -28,-0.6 -26,-2.4 19,-0.2 2,-0.4 -0.991 51.1-178.6-152.8 142.2 49.5 2.1 76.0 30 30 A M E -ac 3 50A 1 19,-2.3 21,-2.3 -2,-0.3 2,-0.4 -0.990 9.8-162.8-141.5 140.9 49.0 -0.5 78.6 31 31 A R E -ac 4 51A 0 -28,-0.9 -26,-2.8 -2,-0.4 2,-0.4 -0.978 12.1-170.4-117.6 135.5 51.4 -2.7 80.6 32 32 A I E - c 0 52A 3 19,-2.1 21,-2.1 -2,-0.4 -26,-0.1 -0.982 20.1-139.7-127.6 144.7 50.0 -5.7 82.4 33 33 A Y S S+ 0 0 47 -28,-0.5 2,-0.3 -2,-0.4 19,-0.1 0.428 78.7 10.3 -85.8 -2.0 52.0 -7.8 84.8 34 34 A F S S- 0 0 87 21,-0.1 2,-2.8 22,-0.1 19,-0.2 -0.949 99.4 -72.1-161.1 170.7 51.0 -11.3 83.9 35 35 A A - 0 0 22 19,-0.6 2,-1.0 -2,-0.3 3,-0.1 -0.429 56.7-174.8 -69.9 74.7 49.1 -13.0 81.1 36 36 A D >> - 0 0 4 -2,-2.8 4,-2.6 1,-0.2 3,-0.5 -0.618 10.5-165.0 -77.7 105.5 45.7 -11.7 82.2 37 37 A G H 3> S+ 0 0 27 -2,-1.0 4,-2.7 1,-0.2 5,-0.2 0.884 86.4 52.0 -57.0 -43.3 43.2 -13.4 79.9 38 38 A Q H 3> S+ 0 0 117 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.822 112.2 46.4 -63.5 -34.9 40.3 -11.1 80.8 39 39 A A H <> S+ 0 0 1 -3,-0.5 4,-1.6 2,-0.2 -2,-0.2 0.958 113.4 49.6 -69.8 -49.3 42.5 -8.0 80.0 40 40 A L H < S+ 0 0 1 -4,-2.6 4,-0.4 2,-0.2 -2,-0.2 0.877 111.9 46.7 -55.8 -48.0 43.8 -9.5 76.8 41 41 A S H >< S+ 0 0 37 -4,-2.7 3,-1.7 1,-0.2 -1,-0.2 0.944 111.5 50.9 -61.8 -49.0 40.3 -10.4 75.5 42 42 A A H 3< S+ 0 0 30 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.795 105.2 61.6 -58.3 -27.2 38.9 -7.0 76.4 43 43 A L T >< S+ 0 0 0 -4,-1.6 3,-2.0 -3,-0.1 5,-0.4 0.536 70.8 127.8 -78.6 -10.6 41.9 -5.6 74.5 44 44 A R T < S- 0 0 151 -3,-1.7 40,-0.2 -4,-0.4 39,-0.1 -0.264 89.6 -11.9 -54.1 123.3 41.0 -7.1 71.1 45 45 A N T 3 S+ 0 0 84 38,-2.6 -1,-0.3 1,-0.1 39,-0.1 0.643 96.3 127.0 57.0 22.4 41.0 -4.4 68.3 46 46 A S S < S- 0 0 15 -3,-2.0 -2,-0.1 37,-0.3 -1,-0.1 0.559 71.3-129.5 -81.0 -16.4 41.1 -1.6 71.0 47 47 A G + 0 0 54 36,-0.4 2,-0.5 -4,-0.3 -3,-0.1 0.627 61.8 137.0 74.7 14.3 44.1 -0.0 69.3 48 48 A I - 0 0 4 -5,-0.4 37,-0.6 -19,-0.0 -1,-0.2 -0.840 52.3-132.0 -98.7 125.1 46.0 0.1 72.6 49 49 A G E -cd 29 85A 4 -21,-1.6 -19,-2.3 -2,-0.5 2,-0.4 -0.467 29.5-150.1 -70.0 147.4 49.7 -0.9 72.4 50 50 A L E -cd 30 86A 0 35,-2.4 37,-2.1 -21,-0.2 38,-1.7 -0.936 26.0-158.0-133.4 140.2 50.7 -3.4 75.1 51 51 A I E -cd 31 88A 0 -21,-2.3 -19,-2.1 -2,-0.4 2,-0.6 -0.979 25.2-160.5-104.1 121.9 53.7 -4.5 77.2 52 52 A L E -cd 32 89A 0 36,-2.5 38,-1.7 -2,-0.5 2,-0.2 -0.911 1.9-157.4-110.0 104.3 53.0 -8.1 78.3 53 53 A D E - d 0 90A 4 -21,-2.1 38,-0.2 -2,-0.6 40,-0.1 -0.572 11.6-144.6 -76.2 143.8 55.0 -9.3 81.3 54 54 A I - 0 0 2 36,-2.7 -19,-0.6 -2,-0.2 -1,-0.1 0.849 45.9-106.8 -77.1 -32.0 55.3 -13.1 81.5 55 55 A G >> - 0 0 8 35,-0.4 3,-2.2 -21,-0.2 4,-0.6 0.244 17.1-111.7 107.0 123.9 55.1 -13.2 85.3 56 56 A N G >4 S+ 0 0 78 1,-0.3 3,-0.9 2,-0.2 4,-0.5 0.801 116.8 63.9 -56.4 -28.8 58.2 -13.9 87.5 57 57 A D G 34 S+ 0 0 123 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.525 102.5 51.7 -71.4 -10.8 56.7 -17.2 88.6 58 58 A Q G <> S+ 0 0 62 -3,-2.2 4,-2.4 2,-0.1 5,-0.3 0.544 83.8 91.0-100.4 -14.5 56.9 -18.3 84.9 59 59 A L H S+ 0 0 69 -4,-0.5 4,-1.1 1,-0.2 -1,-0.2 0.843 113.4 52.0 -66.9 -32.3 62.0 -20.8 85.4 61 61 A N H > S+ 0 0 84 -3,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.899 114.3 41.7 -70.7 -42.6 59.4 -22.7 83.4 62 62 A I H < S+ 0 0 0 -4,-2.4 7,-0.4 1,-0.2 3,-0.3 0.868 110.2 57.7 -73.5 -36.0 60.1 -20.7 80.3 63 63 A A H < S+ 0 0 16 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.806 97.7 65.9 -65.4 -24.9 63.9 -20.8 80.8 64 64 A A H < S- 0 0 75 -4,-1.1 2,-0.3 1,-0.2 -1,-0.2 0.910 112.0 -7.6 -65.4 -47.2 63.9 -24.6 80.8 65 65 A S X - 0 0 33 -4,-0.8 4,-1.9 -3,-0.3 -1,-0.2 -0.995 49.4-124.8-153.4 160.2 62.8 -25.3 77.3 66 66 A T H > S+ 0 0 77 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.817 114.5 58.5 -74.8 -31.0 61.6 -24.0 74.0 67 67 A S H > S+ 0 0 82 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.903 105.4 50.5 -65.4 -32.0 58.7 -26.4 74.1 68 68 A N H > S+ 0 0 53 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.945 113.2 44.7 -66.2 -48.0 57.8 -24.7 77.5 69 69 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 -7,-0.4 -2,-0.2 0.837 111.6 53.9 -63.7 -33.9 58.0 -21.2 75.8 70 70 A A H X S+ 0 0 42 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.908 107.8 49.8 -67.7 -42.6 56.0 -22.5 72.7 71 71 A S H X S+ 0 0 65 -4,-2.0 4,-1.7 2,-0.2 5,-0.2 0.907 111.7 48.6 -62.2 -42.2 53.2 -23.7 75.0 72 72 A W H X S+ 0 0 17 -4,-2.0 4,-2.7 2,-0.2 5,-0.4 0.936 113.0 47.1 -64.1 -47.9 53.1 -20.3 76.8 73 73 A V H X>S+ 0 0 4 -4,-2.4 5,-2.8 1,-0.2 4,-2.1 0.935 110.7 54.0 -59.1 -41.6 53.0 -18.4 73.4 74 74 A Q H <5S+ 0 0 128 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.835 119.3 31.3 -62.3 -35.4 50.3 -20.8 72.1 75 75 A N H <5S+ 0 0 92 -4,-1.7 -1,-0.2 -3,-0.1 -2,-0.2 0.786 130.2 30.9 -93.7 -34.3 48.0 -20.2 75.1 76 76 A N H <5S+ 0 0 41 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.588 131.6 18.7-106.3 -11.8 48.7 -16.6 76.1 77 77 A V T >X5S+ 0 0 0 -4,-2.1 3,-2.5 -5,-0.4 4,-1.8 0.699 110.8 63.0-123.1 -56.0 49.8 -14.8 72.9 78 78 A R T 34 S+ 0 0 44 -3,-2.5 4,-2.2 3,-0.1 -2,-0.2 0.715 90.9 120.8-112.6 -22.8 45.0 -12.5 71.0 81 81 A Y T < S+ 0 0 19 -4,-1.8 4,-0.1 1,-0.3 509,-0.1 -0.730 73.0 14.5 -95.0 142.2 47.5 -11.3 68.4 82 82 A P T 4 S+ 0 0 4 0, 0.0 -1,-0.3 0, 0.0 509,-0.3 -0.990 123.1 59.1 -85.4 2.7 47.2 -9.4 66.0 83 83 A A T 4 S+ 0 0 23 504,-0.1 -38,-2.6 -3,-0.1 2,-0.5 0.829 108.5 52.3 -54.9 -40.3 43.9 -8.1 67.3 84 84 A V S < S- 0 0 0 -4,-2.2 2,-1.9 -40,-0.2 -40,-0.1 -0.904 93.8-132.4 -97.2 129.3 45.7 -7.0 70.5 85 85 A N E -d 49 0A 51 -37,-0.6 -35,-2.4 -2,-0.5 2,-0.8 -0.467 29.4-178.5 -85.5 72.3 48.7 -4.9 69.6 86 86 A I E +d 50 0A 2 -2,-1.9 -35,-0.2 -37,-0.2 3,-0.1 -0.578 7.0 172.4 -73.4 112.5 51.3 -6.6 71.8 87 87 A K E + 0 0 70 -37,-2.1 36,-1.8 -2,-0.8 2,-0.3 0.885 59.6 13.9 -87.3 -43.8 54.4 -4.6 71.2 88 88 A Y E -de 51 123A 31 -38,-1.7 -36,-2.5 34,-0.2 2,-0.4 -0.909 54.8-148.6-133.4 159.9 56.7 -6.2 73.8 89 89 A I E -de 52 124A 0 34,-1.9 36,-2.8 -2,-0.3 2,-0.8 -1.000 15.1-149.7-128.8 122.5 57.0 -9.1 76.2 90 90 A A E -de 53 125A 0 -38,-1.7 -36,-2.7 -2,-0.4 2,-1.9 -0.902 2.9-157.3 -95.6 106.9 58.9 -8.6 79.5 91 91 A A E S- 0 0 0 34,-2.6 16,-0.1 -2,-0.8 15,-0.1 -0.615 73.5 -13.5 -82.6 75.0 60.5 -11.9 80.5 92 92 A G E - 0 0 1 -2,-1.9 35,-2.2 34,-0.1 2,-0.5 -0.021 66.6-123.3 107.9 146.5 60.7 -10.9 84.2 93 93 A N E S- e 0 127A 30 33,-0.2 35,-0.2 1,-0.1 -37,-0.1 -0.975 82.1 -29.6-131.4 114.2 60.3 -7.8 86.2 94 94 A E S S- 0 0 61 33,-3.1 34,-0.1 -2,-0.5 -1,-0.1 0.863 82.0-167.4 48.4 47.4 63.0 -6.6 88.5 95 95 A V - 0 0 14 32,-0.4 2,-0.4 4,-0.1 -1,-0.2 -0.388 3.3-165.1 -65.6 143.0 64.2 -10.2 89.0 96 96 A Q > + 0 0 95 -2,-0.1 3,-0.6 4,-0.0 2,-0.3 -0.971 39.3 5.1-134.2 144.0 66.7 -10.7 91.9 97 97 A G G > S- 0 0 53 -2,-0.4 3,-1.0 1,-0.2 4,-0.2 -0.651 119.2 -16.8 97.0-146.9 69.1 -13.4 93.0 98 98 A G G > S+ 0 0 51 -2,-0.3 3,-1.4 1,-0.2 -1,-0.2 0.648 124.0 77.7 -72.3 -12.7 69.9 -16.7 91.2 99 99 A A G X> S+ 0 0 40 -3,-0.6 3,-2.9 1,-0.3 4,-0.6 0.815 76.7 70.8 -66.1 -29.3 66.7 -16.0 89.3 100 100 A T G X4 S+ 0 0 23 -3,-1.0 3,-0.9 1,-0.3 4,-0.5 0.809 85.3 71.0 -56.5 -26.3 68.6 -13.5 87.2 101 101 A Q G <4 S+ 0 0 159 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.658 96.1 52.7 -63.5 -14.1 70.3 -16.7 85.8 102 102 A S G <> S+ 0 0 29 -3,-2.9 4,-1.8 1,-0.1 5,-0.2 0.652 86.5 80.7 -97.6 -15.6 67.1 -17.5 84.1 103 103 A I H S+ 0 0 23 -4,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.934 114.5 44.6 -75.3 -45.2 68.7 -14.8 79.2 105 105 A P H > S+ 0 0 45 0, 0.0 4,-2.7 0, 0.0 -2,-0.2 0.841 114.4 50.2 -67.5 -27.7 67.7 -18.4 78.4 106 106 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.873 110.7 51.4 -74.0 -35.9 64.0 -17.5 78.8 107 107 A M H X S+ 0 0 0 -4,-1.3 4,-1.7 -5,-0.2 -1,-0.2 0.839 113.0 43.8 -65.0 -41.4 64.6 -14.6 76.5 108 108 A R H X S+ 0 0 143 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.955 112.4 52.9 -67.6 -54.6 66.2 -16.9 73.9 109 109 A N H X S+ 0 0 24 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.812 110.6 46.8 -51.0 -35.7 63.5 -19.5 74.3 110 110 A L H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 5,-0.3 0.912 109.6 54.0 -77.9 -37.1 60.7 -16.9 73.7 111 111 A N H X S+ 0 0 44 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.846 110.6 47.5 -62.4 -35.4 62.6 -15.5 70.6 112 112 A A H X S+ 0 0 49 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.892 113.8 46.2 -73.6 -38.1 62.7 -19.0 69.2 113 113 A A H X S+ 0 0 11 -4,-1.5 4,-1.4 -5,-0.2 -2,-0.2 0.823 112.2 48.7 -72.4 -40.0 59.1 -19.7 69.9 114 114 A L H X>S+ 0 0 2 -4,-2.6 5,-3.3 2,-0.2 4,-0.6 0.928 111.5 53.8 -65.5 -42.2 57.8 -16.4 68.5 115 115 A S H ><5S+ 0 0 82 -4,-1.6 3,-2.8 -5,-0.3 5,-0.3 0.983 110.7 42.4 -55.9 -64.1 59.9 -17.0 65.5 116 116 A A H 3<5S+ 0 0 94 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.790 111.3 57.2 -57.8 -25.4 58.5 -20.5 64.7 117 117 A A H 3<5S- 0 0 24 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.573 115.5-118.5 -81.9 -5.8 55.0 -19.2 65.4 118 118 A G T <<5S+ 0 0 65 -3,-2.8 -3,-0.2 -4,-0.6 3,-0.2 0.739 80.9 122.3 75.6 24.9 55.6 -16.6 62.8 119 119 A L > < + 0 0 8 -5,-3.3 3,-1.2 -6,-0.2 -4,-0.2 -0.156 19.2 138.9-111.8 41.1 55.2 -13.8 65.4 120 120 A G T 3 + 0 0 52 -6,-0.3 -1,-0.1 1,-0.3 -5,-0.1 0.469 57.5 73.1 -64.3 -7.0 58.5 -12.1 64.9 121 121 A A T 3 S+ 0 0 58 -3,-0.2 -1,-0.3 -7,-0.1 2,-0.2 0.896 79.2 85.7 -74.2 -39.2 57.2 -8.5 65.2 122 122 A I S < S- 0 0 4 -3,-1.2 2,-0.3 -8,-0.1 -34,-0.2 -0.442 77.5-143.9 -62.8 131.3 56.7 -9.0 68.9 123 123 A K E -e 88 0A 71 -36,-1.8 -34,-1.9 -2,-0.2 2,-0.5 -0.804 2.5-140.4-103.7 141.7 59.9 -8.1 70.7 124 124 A V E +e 89 0A 1 -2,-0.3 2,-0.2 -36,-0.2 -34,-0.2 -0.847 36.3 138.6-106.2 128.1 61.4 -9.8 73.8 125 125 A S E -e 90 0A 0 -36,-2.8 -34,-2.6 -2,-0.5 2,-0.3 -0.569 41.1-112.9-143.2-162.1 63.1 -7.9 76.6 126 126 A T E - 0 0 3 36,-0.3 38,-1.3 -36,-0.2 2,-0.6 -0.986 21.6-123.6-148.5 144.1 63.3 -7.7 80.4 127 127 A S E -ef 93 164A 2 -35,-2.2 -33,-3.1 -2,-0.3 -32,-0.4 -0.808 33.0-179.4 -94.7 122.0 62.2 -5.1 82.9 128 128 A I E - f 0 165A 6 36,-2.2 38,-3.1 -2,-0.6 2,-0.3 -0.757 22.5-127.1-118.3 164.9 64.8 -3.7 85.3 129 129 A R E > - f 0 166A 75 -2,-0.3 3,-1.7 36,-0.2 4,-0.2 -0.778 32.5-109.7-106.3 154.6 64.9 -1.2 88.1 130 130 A F G > S+ 0 0 38 36,-1.2 3,-2.9 -2,-0.3 37,-0.1 0.746 108.6 78.1 -51.9 -30.6 67.3 1.7 88.2 131 131 A D G 3 S+ 0 0 74 1,-0.3 -1,-0.3 14,-0.0 14,-0.1 0.448 80.3 73.3 -65.7 3.8 69.3 0.1 91.1 132 132 A E G < S+ 0 0 6 -3,-1.7 13,-2.1 1,-0.1 14,-0.6 0.671 87.1 74.4 -83.4 -24.4 70.8 -2.1 88.3 133 133 A V E < -I 144 0B 8 -3,-2.9 3,-0.3 11,-0.2 11,-0.2 -0.873 67.5-167.3-100.3 118.5 72.8 1.0 87.2 134 134 A A E +I 143 0B 29 9,-3.1 9,-1.9 -2,-0.5 82,-0.1 -0.458 65.4 26.4 -97.9 171.9 75.9 2.1 89.3 135 135 A N + 0 0 116 7,-0.2 -1,-0.2 1,-0.2 6,-0.1 0.806 68.1 164.7 39.6 46.5 77.9 5.3 89.2 136 136 A S + 0 0 45 -3,-0.3 6,-0.2 5,-0.1 -1,-0.2 0.349 36.2 109.6 -70.8 2.1 74.9 7.1 87.8 137 137 A F S S+ 0 0 147 4,-0.2 -1,-0.1 1,-0.1 -2,-0.0 -0.959 81.9 22.3-134.8 121.0 76.4 10.5 88.6 138 138 A P S > S- 0 0 28 0, 0.0 3,-3.1 0, 0.0 4,-0.2 0.659 100.2-126.8 -64.0 163.1 77.3 12.2 86.4 139 139 A P G > S+ 0 0 2 0, 0.0 3,-2.4 0, 0.0 76,-0.1 0.867 109.9 65.4 -50.3 -35.4 74.9 10.3 84.1 140 140 A S G 3 S+ 0 0 24 1,-0.3 -4,-0.1 75,-0.1 -3,-0.1 0.586 92.0 63.8 -62.6 -13.8 77.9 9.6 81.8 141 141 A A G < S+ 0 0 26 -3,-3.1 -1,-0.3 -6,-0.1 -4,-0.2 0.456 75.8 129.3 -90.7 -0.1 79.4 7.6 84.6 142 142 A G < + 0 0 0 -3,-2.4 2,-0.3 -4,-0.2 77,-0.2 -0.334 27.5 164.3 -62.5 136.0 76.6 5.0 84.5 143 143 A V E -I 134 0B 48 -9,-1.9 -9,-3.1 -2,-0.1 2,-0.4 -0.994 43.2-104.1-151.3 139.1 77.6 1.3 84.3 144 144 A F E -I 133 0B 20 72,-0.4 -11,-0.2 -2,-0.3 -12,-0.1 -0.550 25.7-158.6 -67.6 125.5 75.7 -1.9 84.9 145 145 A K S S+ 0 0 108 -13,-2.1 2,-0.3 -2,-0.4 -1,-0.2 0.805 70.7 70.1 -76.4 -28.7 76.8 -3.3 88.3 146 146 A N S > S- 0 0 52 -14,-0.6 3,-0.7 1,-0.1 4,-0.3 -0.700 74.1-140.4 -95.1 139.3 75.7 -6.9 87.5 147 147 A A T >> S+ 0 0 84 -2,-0.3 3,-1.9 1,-0.2 4,-0.9 0.887 97.5 62.5 -62.0 -40.8 77.5 -9.1 85.0 148 148 A Y H 3> S+ 0 0 36 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.747 90.6 69.1 -58.5 -27.5 74.4 -10.8 83.6 149 149 A M H <> S+ 0 0 0 -3,-0.7 4,-2.0 1,-0.2 -1,-0.3 0.682 94.3 55.0 -67.5 -19.1 73.1 -7.4 82.3 150 150 A T H <> S+ 0 0 51 -3,-1.9 4,-2.1 -4,-0.3 -1,-0.2 0.916 105.3 52.6 -77.3 -42.8 75.9 -7.2 79.7 151 151 A D H X S+ 0 0 64 -4,-0.9 4,-1.7 1,-0.2 -2,-0.2 0.892 112.8 46.5 -53.3 -44.4 74.8 -10.6 78.4 152 152 A V H X S+ 0 0 1 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.940 107.7 54.0 -67.9 -46.3 71.2 -9.2 78.1 153 153 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.866 109.3 50.2 -57.6 -37.5 72.3 -5.9 76.5 154 154 A R H X S+ 0 0 133 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.898 109.8 49.0 -68.4 -39.5 74.1 -7.8 73.8 155 155 A L H X S+ 0 0 24 -4,-1.7 4,-1.9 2,-0.2 6,-0.2 0.921 112.5 48.6 -67.5 -41.3 71.1 -10.0 73.1 156 156 A L H X>S+ 0 0 0 -4,-2.8 5,-1.6 2,-0.2 4,-1.4 0.930 109.4 54.4 -62.8 -41.2 68.8 -7.0 72.9 157 157 A A H ><5S+ 0 0 48 -4,-2.4 3,-0.5 -5,-0.2 -2,-0.2 0.941 112.6 41.0 -55.8 -53.3 71.4 -5.3 70.5 158 158 A S H 3<5S+ 0 0 99 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.760 117.9 47.9 -70.0 -26.7 71.3 -8.3 68.1 159 159 A T H 3<5S- 0 0 35 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.551 103.9-124.0 -93.2 -7.1 67.6 -8.8 68.3 160 160 A G T <<5 + 0 0 54 -4,-1.4 -3,-0.2 -3,-0.5 -4,-0.1 0.818 64.1 138.8 69.5 26.7 66.6 -5.2 67.8 161 161 A A < - 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