==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-MAY-01 1H5V . COMPND 2 MOLECULE: ENDOGLUCANASE 5A; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AGARADHAERENS; . AUTHOR A.VARROT,G.SULZENBACHER,M.SCHULEIN,H.DRIGUEZ,G.J.DAVIES . 301 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11427.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 18 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.7 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 2 0 0 0 0 1 1 1 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 1 2 0 1 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 0 1 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 . 0 1 0 0 0 0 0 1 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 4 A S > 0 0 101 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -40.6 17.7 68.0 24.8 2 5 A V H > + 0 0 24 88,-0.4 4,-2.6 87,-0.3 5,-0.3 0.968 360.0 33.2 -62.4 -57.3 18.0 65.6 21.8 3 6 A V H > S+ 0 0 9 87,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.847 115.1 59.6 -70.8 -32.4 17.3 68.0 19.0 4 7 A E H 4 S+ 0 0 153 86,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.902 112.2 41.9 -58.9 -38.6 19.0 70.8 20.9 5 8 A E H < S+ 0 0 104 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.961 127.7 26.3 -70.6 -52.2 22.1 68.7 20.8 6 9 A H H < S+ 0 0 22 -4,-2.6 13,-2.2 1,-0.2 -3,-0.2 0.764 80.4 175.8 -89.2 -33.6 22.0 67.3 17.3 7 10 A G < + 0 0 9 -4,-2.4 2,-0.3 -5,-0.3 -1,-0.2 -0.263 57.1 18.2 64.2-139.8 20.0 69.9 15.3 8 11 A Q S S- 0 0 53 10,-0.1 2,-0.2 1,-0.0 120,-0.1 -0.494 75.9-145.5 -67.6 124.4 19.7 69.3 11.6 9 12 A L + 0 0 3 118,-0.4 2,-0.3 -2,-0.3 9,-0.2 -0.585 24.2 168.3 -84.9 154.2 20.4 65.7 10.5 10 13 A S E -A 17 0A 42 7,-2.2 7,-2.8 -2,-0.2 2,-0.5 -0.952 35.7-105.0-153.2 170.6 22.1 64.9 7.2 11 14 A I E -A 16 0A 28 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.901 31.0-177.3-104.5 129.9 23.6 62.0 5.4 12 15 A S E > S-A 15 0A 50 3,-2.8 3,-1.1 -2,-0.5 -2,-0.0 -0.971 71.6 -24.9-125.5 114.4 27.4 61.9 5.1 13 16 A N T 3 S- 0 0 155 -2,-0.5 -1,-0.1 1,-0.2 205,-0.1 0.891 129.1 -43.4 49.0 43.5 29.0 59.1 3.1 14 17 A G T 3 S+ 0 0 13 1,-0.2 207,-0.4 206,-0.1 2,-0.3 0.605 119.6 90.3 87.1 9.1 26.1 56.8 3.7 15 18 A E E < S-A 12 0A 74 -3,-1.1 -3,-2.8 205,-0.2 2,-0.4 -0.972 77.6-100.6-142.9 158.5 25.5 57.4 7.3 16 19 A L E +A 11 0A 10 -2,-0.3 8,-1.9 -5,-0.2 2,-0.3 -0.608 45.6 168.6 -77.5 125.5 23.3 59.6 9.5 17 20 A V E -AB 10 23A 8 -7,-2.8 -7,-2.2 -2,-0.4 6,-0.2 -0.872 24.6-125.2-132.9 164.5 25.2 62.5 11.1 18 21 A N > - 0 0 3 4,-2.0 3,-2.3 -2,-0.3 -11,-0.2 -0.232 49.1 -71.3 -99.8-166.8 24.3 65.7 13.0 19 22 A E T 3 S+ 0 0 110 -13,-2.2 -12,-0.1 1,-0.3 -10,-0.1 0.654 132.9 45.9 -64.7 -18.5 25.0 69.3 12.6 20 23 A R T 3 S- 0 0 126 -14,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.249 120.2-104.3-103.6 10.1 28.7 68.9 13.5 21 24 A G S < S+ 0 0 50 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.630 73.7 145.5 74.7 15.1 29.2 65.8 11.4 22 25 A E - 0 0 79 1,-0.1 -4,-2.0 -16,-0.1 -1,-0.3 -0.538 57.9-101.3 -81.5 144.8 29.1 63.5 14.4 23 26 A Q B -B 17 0A 114 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.402 41.3-168.0 -53.8 136.5 27.5 60.0 14.1 24 27 A V - 0 0 5 -8,-1.9 2,-0.5 229,-0.1 -8,-0.2 -0.999 10.3-164.4-132.7 141.6 24.0 59.9 15.5 25 28 A Q - 0 0 35 -2,-0.4 2,-0.4 229,-0.1 229,-0.1 -0.971 8.5-155.7-123.1 113.9 22.0 56.8 16.2 26 29 A L + 0 0 0 -2,-0.5 230,-2.5 227,-0.1 2,-0.4 -0.751 13.5 179.8 -89.7 137.0 18.3 57.2 16.7 27 30 A K E +c 256 0B 14 -2,-0.4 29,-2.0 228,-0.2 30,-0.6 -0.993 23.8 112.7-136.3 129.1 16.5 54.5 18.8 28 31 A G E -cd 257 57B 0 228,-1.6 230,-2.3 -2,-0.4 2,-0.3 -0.870 53.0 -69.4-166.1-162.0 12.8 54.6 19.5 29 32 A M E -cd 258 58B 0 28,-0.9 30,-2.6 228,-0.3 2,-0.4 -0.880 24.6-144.2-114.7 145.0 9.3 53.2 19.1 30 33 A S E -cd 259 59B 0 228,-2.9 231,-2.7 -2,-0.3 230,-0.6 -0.862 23.0-126.0 -93.9 140.4 6.8 53.0 16.4 31 34 A S E -c 261 0B 1 28,-2.9 231,-0.1 -2,-0.4 3,-0.1 -0.323 24.9-117.4 -61.5 164.7 3.2 53.3 17.0 32 35 A H S S- 0 0 9 229,-0.7 29,-0.5 5,-0.3 2,-0.1 -0.177 72.3 -38.5 -80.4-165.1 1.0 50.6 15.8 33 36 A G >> - 0 0 0 1,-0.2 4,-2.8 -2,-0.1 3,-2.0 -0.375 56.0-140.5 -63.3 131.3 -1.6 51.8 13.2 34 37 A L H 3> S+ 0 0 9 27,-2.0 4,-0.5 1,-0.3 -1,-0.2 0.695 100.3 61.1 -66.6 -23.0 -2.8 55.2 14.2 35 38 A Q H 34 S+ 0 0 44 2,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.525 118.7 27.7 -78.5 -7.7 -6.4 54.3 13.1 36 39 A W H <4 S+ 0 0 116 -3,-2.0 -2,-0.2 -4,-0.0 3,-0.2 0.696 132.9 24.1-116.6 -47.5 -6.4 51.5 15.7 37 40 A Y H >< S+ 0 0 46 -4,-2.8 3,-1.4 1,-0.1 -5,-0.3 -0.160 71.5 130.4-125.1 36.5 -4.1 52.3 18.6 38 41 A G G >< + 0 0 10 -4,-0.5 3,-1.8 1,-0.3 -1,-0.1 0.638 56.7 81.2 -63.9 -16.5 -3.9 56.0 18.6 39 42 A Q G 3 S+ 0 0 81 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.768 89.1 55.8 -62.1 -25.9 -4.6 56.2 22.3 40 43 A F G < S+ 0 0 1 -3,-1.4 2,-0.7 221,-0.2 -1,-0.3 0.436 91.3 81.8 -83.5 -1.0 -1.0 55.4 23.0 41 44 A V < + 0 0 0 -3,-1.8 2,-0.3 -7,-0.1 -1,-0.1 -0.908 64.1 106.8-112.8 102.1 0.3 58.3 20.8 42 45 A N S > S- 0 0 16 -2,-0.7 4,-2.4 235,-0.1 5,-0.3 -0.967 80.1 -89.6-165.0 167.6 0.1 61.6 22.9 43 46 A Y H > S+ 0 0 101 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.895 120.9 50.4 -57.4 -44.3 2.4 64.0 24.6 44 47 A E H > S+ 0 0 113 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.931 112.0 44.9 -68.8 -40.4 2.4 62.2 27.9 45 48 A S H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.912 115.5 48.0 -67.7 -39.4 3.2 58.8 26.6 46 49 A M H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.890 110.6 51.3 -70.4 -35.3 5.9 60.2 24.4 47 50 A K H X S+ 0 0 76 -4,-2.5 4,-2.8 -5,-0.3 5,-0.3 0.919 110.4 50.0 -63.7 -41.3 7.4 62.2 27.3 48 51 A W H X>S+ 0 0 72 -4,-2.3 4,-3.2 2,-0.2 5,-0.9 0.924 110.4 49.4 -62.8 -44.5 7.4 59.0 29.4 49 52 A L H X>S+ 0 0 0 -4,-2.5 6,-1.8 3,-0.2 5,-1.3 0.919 113.8 46.7 -60.1 -42.0 9.2 57.1 26.6 50 53 A R H <5S+ 0 0 62 -4,-2.4 4,-0.4 4,-0.2 -2,-0.2 0.948 122.1 34.2 -62.8 -48.5 11.7 60.0 26.4 51 54 A D H <5S+ 0 0 88 -4,-2.8 -2,-0.2 -5,-0.1 -3,-0.2 0.834 129.9 29.6 -84.1 -36.9 12.3 60.2 30.1 52 55 A D H <5S+ 0 0 32 -4,-3.2 -3,-0.2 -5,-0.3 -2,-0.1 0.820 133.2 28.1 -95.3 -37.3 12.0 56.6 31.2 53 56 A W T < S+ 0 0 30 33,-0.4 3,-1.5 1,-0.2 4,-0.1 -0.034 93.2 69.6 -92.0-163.6 -5.3 51.3 3.7 66 69 A S T 3 S- 0 0 47 1,-0.3 -1,-0.2 2,-0.1 -3,-0.1 0.853 135.9 -47.5 57.0 37.7 -6.9 49.1 6.3 67 70 A G T 3 S+ 0 0 37 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.646 114.3 121.7 81.1 9.5 -9.2 51.9 7.5 68 71 A G S X> S- 0 0 0 -3,-1.5 4,-2.9 3,-0.1 3,-0.6 0.356 78.3 -35.9 -82.9-143.1 -6.4 54.5 7.6 69 72 A Y T 34 S+ 0 0 18 -6,-2.6 -5,-0.2 1,-0.3 -4,-0.1 0.763 126.9 59.6 -61.9 -36.6 -6.0 57.8 5.9 70 73 A I T 34 S+ 0 0 45 -6,-2.1 -1,-0.3 1,-0.2 -5,-0.1 0.916 119.6 28.3 -62.5 -43.9 -7.5 57.0 2.5 71 74 A D T <4 S+ 0 0 133 -3,-0.6 -2,-0.2 -7,-0.6 -1,-0.2 0.865 138.8 20.4 -83.2 -36.2 -10.9 56.1 4.1 72 75 A D >< - 0 0 82 -4,-2.9 3,-1.5 1,-0.1 -1,-0.2 -0.809 62.9-177.8-138.9 89.2 -10.8 58.4 7.2 73 76 A P G > + 0 0 66 0, 0.0 3,-2.4 0, 0.0 4,-0.3 0.583 66.1 92.9 -70.3 -1.2 -8.3 61.2 6.9 74 77 A S G > + 0 0 70 1,-0.3 3,-1.7 2,-0.2 4,-0.5 0.734 69.2 77.6 -62.3 -19.9 -9.0 62.4 10.4 75 78 A V G X> S+ 0 0 13 -3,-1.5 4,-1.5 1,-0.3 3,-1.1 0.762 75.7 74.5 -59.9 -24.0 -6.1 60.2 11.3 76 79 A K H <> S+ 0 0 30 -3,-2.4 4,-2.5 1,-0.3 -1,-0.3 0.834 87.2 62.4 -58.0 -28.5 -3.8 62.9 10.0 77 80 A E H <> S+ 0 0 98 -3,-1.7 4,-2.2 -4,-0.3 -1,-0.3 0.818 99.0 53.6 -67.9 -30.3 -4.6 64.9 13.1 78 81 A K H <> S+ 0 0 44 -3,-1.1 4,-2.2 -4,-0.5 -1,-0.2 0.871 107.2 51.3 -69.2 -38.3 -3.0 62.1 15.2 79 82 A V H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.947 110.5 49.0 -58.6 -46.9 0.2 62.4 13.1 80 83 A K H X S+ 0 0 43 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.903 108.3 54.1 -61.0 -39.7 0.1 66.2 13.8 81 84 A E H X S+ 0 0 78 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.916 110.7 46.2 -59.0 -45.7 -0.4 65.5 17.5 82 85 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.900 113.3 48.2 -63.6 -44.2 2.7 63.3 17.4 83 86 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.929 112.6 47.6 -64.8 -45.9 4.8 65.8 15.5 84 87 A E H X S+ 0 0 92 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.891 112.0 50.7 -64.9 -37.1 3.8 68.6 17.7 85 88 A A H X S+ 0 0 5 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.923 109.2 50.9 -63.1 -44.0 4.6 66.5 20.8 86 89 A A H X>S+ 0 0 0 -4,-2.4 5,-2.2 2,-0.2 4,-0.8 0.890 110.6 49.3 -61.6 -39.9 8.0 65.6 19.4 87 90 A I H ><5S+ 0 0 35 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.951 113.4 46.2 -63.6 -46.0 8.8 69.3 18.8 88 91 A D H 3<5S+ 0 0 117 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.840 116.7 44.8 -64.3 -34.5 7.7 70.2 22.3 89 92 A L H 3<5S- 0 0 1 -4,-2.4 -87,-0.3 -5,-0.2 -1,-0.2 0.454 109.5-123.3 -89.2 -4.6 9.7 67.2 23.8 90 93 A D T <<5 + 0 0 34 -3,-0.8 -87,-2.3 -4,-0.8 -88,-0.4 0.843 68.2 122.4 62.7 42.7 12.8 68.0 21.6 91 94 A I < - 0 0 0 -5,-2.2 -1,-0.2 -89,-0.2 -34,-0.2 -0.777 64.9 -96.6-123.3 167.8 13.0 64.6 19.9 92 95 A Y E -e 57 0B 0 -36,-2.2 -34,-1.5 -2,-0.3 2,-0.4 -0.502 34.8-158.8 -80.4 157.6 12.9 63.4 16.3 93 96 A V E -ef 58 129B 0 35,-2.7 37,-2.3 -36,-0.2 2,-0.5 -0.998 9.2-146.8-143.0 134.2 9.7 62.2 14.7 94 97 A I E -ef 59 130B 0 -36,-2.4 -34,-2.9 -2,-0.4 2,-0.8 -0.897 6.4-153.7-103.3 123.8 9.1 60.0 11.7 95 98 A I E -ef 60 131B 1 35,-2.7 37,-2.9 -2,-0.5 2,-0.6 -0.873 22.6-163.5 -93.8 105.1 6.0 60.7 9.6 96 99 A D E -ef 61 132B 0 -36,-2.1 -34,-2.0 -2,-0.8 2,-1.2 -0.866 22.1-154.9-108.2 113.6 5.3 57.3 8.0 97 100 A W E -e 62 0B 0 35,-2.7 38,-2.4 -2,-0.6 2,-1.8 -0.730 30.9-151.6 -77.1 93.7 3.0 56.8 5.0 98 101 A H E +e 63 0B 2 -36,-2.3 -34,-1.1 -2,-1.2 -33,-0.4 -0.490 23.7 173.4 -93.7 75.0 2.3 53.3 6.0 99 102 A I + 0 0 0 -2,-1.8 37,-1.0 -36,-0.2 4,-0.1 -0.474 20.0 131.1 -71.7 147.3 1.5 51.3 3.0 100 103 A L S S+ 0 0 52 -2,-0.2 -1,-0.1 35,-0.1 38,-0.1 0.030 75.7 30.3-158.4 -77.0 1.2 47.5 3.4 101 104 A S S S+ 0 0 72 1,-0.2 2,-1.7 2,-0.1 3,-0.1 0.877 115.3 65.2 -62.5 -36.7 -1.9 45.8 1.9 102 105 A D S S+ 0 0 10 1,-0.2 -1,-0.2 3,-0.0 6,-0.1 -0.686 81.3 178.5 -79.4 78.1 -1.7 48.5 -0.7 103 106 A N + 0 0 56 -2,-1.7 35,-2.0 -4,-0.1 -1,-0.2 0.588 54.1 66.1 -78.4 -15.4 1.6 46.9 -1.7 104 107 A D S > S- 0 0 36 33,-0.2 3,-2.0 1,-0.1 4,-0.3 -0.943 74.7-144.9-103.8 120.9 2.5 49.1 -4.6 105 108 A P G > S+ 0 0 1 0, 0.0 3,-0.6 0, 0.0 7,-0.2 0.707 95.6 69.9 -60.7 -19.1 3.3 52.7 -3.5 106 109 A N G > S+ 0 0 54 1,-0.2 3,-1.1 2,-0.1 4,-0.3 0.647 76.5 81.8 -73.9 -10.5 1.8 54.0 -6.8 107 110 A I G < S+ 0 0 83 -3,-2.0 -1,-0.2 1,-0.3 3,-0.2 0.912 111.2 18.6 -57.1 -45.5 -1.7 52.9 -5.7 108 111 A Y G <> S+ 0 0 51 -3,-0.6 4,-2.5 -4,-0.3 -1,-0.3 -0.164 85.6 130.9-118.5 36.9 -2.2 56.1 -3.7 109 112 A K H <> S+ 0 0 50 -3,-1.1 4,-2.5 1,-0.2 5,-0.2 0.901 72.7 50.6 -61.0 -44.5 0.6 58.3 -5.2 110 113 A E H > S+ 0 0 159 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.926 113.8 45.7 -61.8 -41.1 -1.6 61.3 -5.8 111 114 A E H > S+ 0 0 74 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.875 110.7 53.4 -66.9 -38.7 -2.8 61.2 -2.2 112 115 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.907 108.0 50.6 -64.4 -43.5 0.8 60.7 -0.9 113 116 A K H X S+ 0 0 57 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.933 112.2 46.6 -62.0 -44.7 2.0 63.8 -2.8 114 117 A D H X S+ 0 0 89 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.928 113.8 48.7 -62.3 -42.7 -0.8 65.9 -1.4 115 118 A F H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.938 113.8 45.0 -62.9 -48.1 -0.2 64.6 2.2 116 119 A F H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.841 109.6 55.9 -70.9 -30.4 3.6 65.1 2.0 117 120 A D H X S+ 0 0 48 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.961 112.0 43.9 -60.8 -46.9 3.1 68.6 0.5 118 121 A E H X S+ 0 0 46 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.945 115.8 46.2 -64.4 -46.6 0.9 69.5 3.5 119 122 A M H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.908 113.9 47.4 -65.4 -42.3 3.2 67.9 6.1 120 123 A S H X S+ 0 0 1 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.847 111.2 52.0 -71.8 -31.3 6.4 69.5 4.7 121 124 A E H < S+ 0 0 114 -4,-2.2 4,-0.2 -5,-0.2 -1,-0.2 0.917 115.7 41.5 -63.5 -46.3 4.8 72.9 4.5 122 125 A L H < S+ 0 0 81 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.883 134.5 14.6 -66.0 -47.0 3.7 72.7 8.1 123 126 A Y H >< S+ 0 0 9 -4,-2.5 3,-2.3 -5,-0.2 6,-0.3 0.379 87.4 108.2-116.6 1.5 6.8 71.2 9.6 124 127 A G T 3< S+ 0 0 4 -4,-1.7 41,-0.2 1,-0.3 42,-0.2 0.699 76.2 60.0 -64.8 -22.0 9.6 71.5 7.1 125 128 A D T 3 S+ 0 0 151 -4,-0.2 -1,-0.3 -5,-0.1 -2,-0.1 0.499 89.4 86.8 -80.1 -7.7 11.4 74.2 9.0 126 129 A Y X - 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