==== 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 HYDROLASE 09-JUL-03 1PZ3 . COMPND 2 MOLECULE: ALPHA-L-ARABINOFURANOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR K.HOEVEL,D.SHALLOM,K.NIEFIND,V.BELAKHOV,G.SHOHAM,T.BAASOV,Y. . 994 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36442.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 695 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 103 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 139 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 . 89 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 100 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 223 22.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.6 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 3 1 0 0 2 0 6 2 2 0 0 0 2 0 2 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 4 3 9 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 PARALLEL BRIDGES PER LADDER . 8 4 10 0 0 2 1 5 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 . 3 5 0 2 0 1 1 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 5 A K 0 0 159 0, 0.0 2,-0.3 0, 0.0 431,-0.2 0.000 360.0 360.0 360.0 135.8 67.7 -1.6 57.3 2 6 A A E -a 432 0A 1 429,-2.0 431,-2.0 388,-0.1 2,-0.3 -0.943 360.0-152.0-135.3 154.6 66.6 2.0 56.7 3 7 A T E -aB 433 389A 55 386,-2.7 386,-1.7 -2,-0.3 2,-0.3 -0.893 8.2-173.1-127.4 166.0 63.2 3.7 56.6 4 8 A M E -aB 434 388A 4 429,-1.9 431,-2.8 -2,-0.3 2,-0.5 -0.990 19.0-138.7-150.8 141.9 61.7 6.7 54.9 5 9 A I E -aB 435 387A 20 382,-0.7 2,-0.6 -2,-0.3 382,-0.5 -0.933 12.9-164.4-102.1 133.2 58.4 8.6 55.0 6 10 A I + 0 0 1 429,-2.7 2,-0.6 -2,-0.5 432,-0.4 -0.840 20.5 167.9-117.1 87.8 57.2 9.7 51.6 7 11 A E > - 0 0 29 -2,-0.6 3,-2.1 378,-0.4 378,-0.3 -0.924 32.8-151.7-112.1 115.3 54.5 12.3 52.4 8 12 A K T 3 S+ 0 0 57 -2,-0.6 -1,-0.1 1,-0.3 402,-0.1 0.807 98.4 53.6 -45.9 -37.7 53.1 14.5 49.6 9 13 A D T 3 S+ 0 0 90 1,-0.2 2,-0.8 -3,-0.1 -1,-0.3 0.486 91.0 75.9 -88.1 -3.9 52.3 17.2 52.2 10 14 A F S < S+ 0 0 6 -3,-2.1 375,-2.5 375,-0.1 2,-0.3 -0.808 73.2 166.0-102.6 87.4 55.9 17.3 53.7 11 15 A K E -E 384 0B 100 -2,-0.8 373,-0.3 373,-0.3 3,-0.1 -0.797 39.1-167.6-110.5 144.8 57.5 19.3 50.8 12 16 A I E - 0 0 37 371,-3.0 2,-0.3 -2,-0.3 -1,-0.2 0.905 65.1 -70.2 -84.0 -60.1 60.8 21.1 50.4 13 17 A A E -E 383 0B 20 370,-1.1 370,-2.5 326,-0.0 -1,-0.3 -0.931 51.4 -68.5 177.6 160.5 59.9 22.9 47.1 14 18 A E E -E 382 0B 116 368,-0.3 2,-0.5 -2,-0.3 368,-0.3 -0.490 58.2-117.1 -59.4 131.6 59.3 22.6 43.4 15 19 A I - 0 0 7 366,-3.1 2,-0.6 -2,-0.2 366,-0.4 -0.680 18.4-133.9 -75.1 125.8 62.7 21.7 41.8 16 20 A D > - 0 0 42 -2,-0.5 3,-2.4 324,-0.4 4,-0.1 -0.741 14.5-137.6 -75.4 121.3 63.9 24.4 39.4 17 21 A K G > S+ 0 0 109 -2,-0.6 3,-2.1 1,-0.3 46,-0.2 0.727 95.5 79.0 -57.8 -20.5 65.0 22.4 36.3 18 22 A R G > S+ 0 0 23 323,-0.3 325,-2.5 1,-0.3 3,-1.3 0.569 70.8 80.4 -69.3 -6.9 68.0 24.6 36.1 19 23 A I G < S+ 0 0 1 -3,-2.4 -1,-0.3 323,-0.4 -2,-0.2 0.618 87.5 60.0 -65.6 -11.4 69.6 22.5 38.9 20 24 A Y G < S+ 0 0 0 -3,-2.1 -1,-0.3 -4,-0.1 -2,-0.2 -0.039 85.4 124.9-104.4 30.7 70.3 20.1 36.1 21 25 A G E < -l 344 0C 0 -3,-1.3 324,-2.3 322,-1.3 2,-0.2 -0.127 40.4-162.7 -77.4 177.6 72.4 22.6 34.2 22 26 A S E -lm 345 64C 0 41,-2.4 43,-2.4 322,-0.3 2,-0.3 -0.729 9.6-124.7-146.2-159.9 76.0 22.4 33.0 23 27 A F E -lm 346 65C 0 322,-0.8 325,-2.2 41,-0.3 324,-0.6 -0.988 8.9-166.0-161.5 129.8 78.8 24.6 31.7 24 28 A I - 0 0 0 41,-2.8 2,-0.3 -2,-0.3 322,-0.0 -0.983 14.8-177.0-125.5 123.8 81.1 24.9 28.7 25 29 A E - 0 0 5 -2,-0.4 2,-2.0 41,-0.2 6,-0.2 -0.785 43.0-105.4-108.1 155.1 84.3 27.0 28.9 26 30 A H S S+ 0 0 6 41,-1.9 2,-0.4 -2,-0.3 69,-0.1 -0.614 80.1 129.1 -74.0 84.4 86.8 27.9 26.2 27 31 A L S > S- 0 0 5 -2,-2.0 3,-2.2 286,-0.1 4,-0.3 -0.983 71.5 -46.3-146.5 127.7 89.1 25.5 28.0 28 32 A G T 3 S- 0 0 8 -2,-0.4 4,-0.4 1,-0.3 3,-0.2 -0.174 118.0 -20.4 50.8-126.1 91.1 22.6 26.4 29 33 A R T 3 S+ 0 0 37 284,-0.4 -1,-0.3 1,-0.2 6,-0.1 0.178 104.1 106.3-103.6 18.9 88.9 20.5 24.1 30 34 A A S < >S+ 0 0 0 -3,-2.2 5,-1.7 4,-0.2 -1,-0.2 0.926 102.3 10.9 -62.9 -44.8 85.5 21.5 25.5 31 35 A V T > >S+ 0 0 1 -4,-0.3 5,-2.5 -3,-0.2 3,-1.6 0.877 126.9 56.7 -94.2 -64.0 84.8 23.7 22.5 32 36 A Y B 3 5S+t 36 0D 30 -4,-0.4 -1,-0.2 1,-0.3 5,-0.2 -0.621 131.8 1.2 -82.4 106.9 87.5 22.8 20.0 33 37 A G T 3 5S+ 0 0 14 3,-2.7 -1,-0.3 -2,-0.9 4,-0.2 0.417 131.7 67.1 91.6 3.3 87.2 19.0 19.4 34 38 A G T < 5S- 0 0 0 -3,-1.6 -3,-0.2 2,-0.4 15,-0.2 0.572 121.1 -3.9-113.5 -91.7 84.3 18.8 21.8 35 39 A I T - 0 0 9 10,-3.0 3,-2.2 -2,-0.5 6,-0.2 -0.611 19.6-173.6-153.2 84.2 85.0 19.8 15.1 38 42 A P T 3 S+ 0 0 72 0, 0.0 9,-0.1 0, 0.0 5,-0.1 0.776 84.2 56.5 -58.7 -29.6 84.6 20.8 11.4 39 43 A G T 3 S+ 0 0 65 8,-0.1 8,-0.0 3,-0.1 320,-0.0 0.563 83.3 111.2 -73.3 -7.4 86.8 18.0 10.1 40 44 A H S X S- 0 0 7 -3,-2.2 3,-2.0 7,-0.2 -3,-0.1 -0.408 70.9-133.8 -81.3 139.1 84.7 15.3 11.8 41 45 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 320,-0.0 0.811 108.9 48.3 -58.8 -27.3 82.6 12.9 9.6 42 46 A Q T 3 S+ 0 0 99 -5,-0.1 8,-2.3 5,-0.1 9,-0.2 0.265 84.4 123.3 -98.3 13.5 79.7 13.5 11.9 43 47 A A B < -V 49 0E 26 -3,-2.0 6,-0.2 6,-0.2 5,-0.1 -0.469 56.9-131.2 -70.7 140.5 79.9 17.3 11.9 44 48 A D > - 0 0 36 4,-2.5 3,-2.1 -2,-0.2 -1,-0.1 -0.094 40.7 -77.7 -79.6-176.2 76.9 19.2 10.8 45 49 A E T 3 S+ 0 0 184 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.737 134.7 45.9 -55.8 -27.5 76.8 22.1 8.2 46 50 A N T 3 S- 0 0 84 2,-0.1 -1,-0.3 61,-0.0 -3,-0.0 0.210 122.7-101.5-102.1 11.7 78.1 24.4 10.9 47 51 A G S < S+ 0 0 6 -3,-2.1 -10,-3.0 1,-0.3 2,-0.3 0.398 74.2 140.8 88.2 0.0 80.9 22.1 12.2 48 52 A F B -U 36 0D 2 -12,-0.2 -4,-2.5 1,-0.1 2,-0.4 -0.577 58.7-113.9 -81.8 133.1 79.1 20.9 15.3 49 53 A R B > -V 43 0E 0 -14,-1.8 4,-1.8 -2,-0.3 -6,-0.2 -0.509 21.2-158.3 -66.5 117.6 79.5 17.2 16.2 50 54 A Q H > S+ 0 0 71 -8,-2.3 4,-2.1 -2,-0.4 -1,-0.2 0.837 90.1 57.7 -68.5 -30.5 76.1 15.6 15.8 51 55 A D H > S+ 0 0 23 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.924 107.7 47.3 -67.6 -40.0 77.0 12.7 18.1 52 56 A V H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.901 107.7 56.9 -64.1 -42.6 77.8 15.1 21.0 53 57 A I H X S+ 0 0 2 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.918 108.2 47.2 -54.3 -46.9 74.5 16.9 20.3 54 58 A E H X S+ 0 0 87 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.905 110.1 51.9 -64.9 -40.3 72.6 13.7 20.8 55 59 A L H X S+ 0 0 22 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.895 112.9 45.1 -62.9 -40.5 74.5 12.8 24.0 56 60 A V H >X>S+ 0 0 0 -4,-2.5 4,-0.8 2,-0.2 5,-0.8 0.913 110.0 54.9 -66.8 -44.0 73.7 16.3 25.5 57 61 A K H ><5S+ 0 0 90 -4,-2.4 3,-1.1 -5,-0.3 -2,-0.2 0.892 102.7 56.4 -58.3 -37.4 70.1 16.1 24.4 58 62 A E H 3<5S+ 0 0 87 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.828 103.2 55.4 -67.9 -27.9 69.6 12.8 26.2 59 63 A L H <<5S- 0 0 0 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.670 99.3-142.1 -73.1 -18.2 70.8 14.6 29.4 60 64 A Q T <<5 - 0 0 97 -3,-1.1 -3,-0.1 -4,-0.8 -2,-0.1 0.885 25.8-174.5 55.9 44.2 68.0 17.2 29.0 61 65 A V < - 0 0 3 -5,-0.8 -1,-0.2 54,-0.2 -40,-0.2 -0.603 10.7-166.4 -72.8 115.0 70.3 20.0 30.2 62 66 A P + 0 0 13 0, 0.0 56,-2.5 0, 0.0 2,-0.3 0.743 66.6 22.0 -77.4 -25.6 68.1 23.1 30.5 63 67 A I E - n 0 118C 1 54,-0.3 -41,-2.4 -46,-0.2 2,-0.4 -0.998 60.0-162.6-148.6 140.6 70.8 25.7 30.9 64 68 A I E -mn 22 119C 0 54,-2.1 56,-2.3 -2,-0.3 -41,-0.3 -0.984 17.2-137.0-132.7 123.6 74.6 25.9 30.1 65 69 A R E -mn 23 120C 3 -43,-2.4 -41,-2.8 -2,-0.4 56,-0.2 -0.490 36.1-143.4 -79.1 142.6 77.0 28.5 31.5 66 70 A Y E - n 0 121C 1 54,-2.0 56,-2.3 2,-0.2 -41,-0.2 -0.950 48.8 -3.1-166.8 148.2 79.4 30.0 29.0 67 71 A P S S+ 0 0 2 0, 0.0 -41,-1.9 0, 0.0 2,-0.3 -0.939 98.7 85.5 -95.4 5.5 82.1 31.1 28.1 68 72 A G + 0 0 0 -43,-0.2 -2,-0.2 3,-0.1 2,-0.2 -0.951 0.2 103.5-176.0 173.0 83.8 30.8 31.5 69 73 A G S >> S- 0 0 0 -2,-0.3 3,-1.7 101,-0.1 4,-0.5 0.626 109.0 -14.5 82.8 162.5 85.1 30.2 34.0 70 74 A N G >4 S+ 0 0 24 1,-0.3 3,-0.9 2,-0.2 4,-0.3 0.800 128.4 68.5 -52.6 -33.6 88.7 31.6 34.3 71 75 A F G >4 S+ 0 0 6 1,-0.2 3,-1.4 2,-0.2 -1,-0.3 0.837 91.4 59.4 -52.6 -40.1 88.7 32.3 30.5 72 76 A V G X4 S+ 0 0 2 -3,-1.7 3,-1.4 1,-0.3 -1,-0.2 0.796 88.3 71.5 -68.5 -26.0 86.1 35.0 30.7 73 77 A S G << S+ 0 0 0 -3,-0.9 54,-1.7 -4,-0.5 -1,-0.3 0.612 111.2 30.4 -70.7 -14.3 88.0 37.3 33.0 74 78 A G G < S+ 0 0 33 -3,-1.4 2,-0.3 -4,-0.3 -1,-0.3 0.256 100.0 112.3-118.1 11.6 90.5 38.1 30.2 75 79 A Y < - 0 0 20 -3,-1.4 2,-0.6 -4,-0.2 49,-0.2 -0.675 52.9-151.8 -97.4 139.4 88.1 37.8 27.2 76 80 A N > - 0 0 44 -2,-0.3 3,-1.9 1,-0.1 4,-0.3 -0.942 9.3-153.7-104.4 112.7 86.8 40.4 24.8 77 81 A W G > S+ 0 0 10 -2,-0.6 3,-1.7 1,-0.3 28,-0.3 0.828 92.0 62.7 -57.0 -32.3 83.4 39.4 23.5 78 82 A E G > S+ 0 0 59 1,-0.3 3,-1.1 2,-0.2 -1,-0.3 0.742 90.4 68.6 -66.1 -22.6 83.9 41.5 20.4 79 83 A D G < S+ 0 0 20 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.654 100.9 48.4 -67.9 -20.8 86.8 39.3 19.4 80 84 A G G < S+ 0 0 0 -3,-1.7 26,-0.3 -4,-0.3 2,-0.3 0.249 100.7 75.4-107.3 11.0 84.5 36.3 18.8 81 85 A V S < S+ 0 0 15 -3,-1.1 71,-0.0 -4,-0.1 5,-0.0 -0.851 75.9 25.6-120.5 161.1 81.8 38.0 16.7 82 86 A G S S- 0 0 11 -2,-0.3 5,-0.1 73,-0.1 73,-0.1 -0.232 104.8 -4.6 84.2-176.6 81.6 39.1 13.0 83 87 A P > - 0 0 79 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.164 65.2-128.4 -54.0 136.4 83.4 37.8 10.0 84 88 A K G > S+ 0 0 94 1,-0.2 3,-1.3 2,-0.2 -3,-0.0 0.823 103.5 63.4 -57.5 -32.7 86.0 35.2 10.9 85 89 A E G 3 S+ 0 0 173 1,-0.3 -1,-0.2 3,-0.0 -3,-0.0 0.763 104.4 48.4 -69.3 -21.3 88.9 36.9 9.0 86 90 A Q G < S+ 0 0 129 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.496 86.2 104.2 -94.3 -3.3 88.6 39.9 11.3 87 91 A R < - 0 0 26 -3,-1.3 2,-0.1 -4,-0.5 -7,-0.1 -0.660 69.1-134.0 -80.3 125.4 88.6 37.8 14.6 88 92 A P - 0 0 35 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.446 9.4-117.5 -80.3 152.5 92.1 38.1 16.3 89 93 A R - 0 0 166 -2,-0.1 2,-0.3 12,-0.1 11,-0.2 -0.779 41.1-166.5 -83.6 130.7 94.1 35.3 17.7 90 94 A R E -W 99 0F 110 9,-2.5 9,-2.9 -2,-0.5 2,-0.8 -0.880 27.0-120.5-121.6 151.1 94.5 35.9 21.4 91 95 A L E -W 98 0F 106 -2,-0.3 2,-1.0 7,-0.2 7,-0.2 -0.794 26.8-149.8 -85.4 112.5 96.7 34.6 24.2 92 96 A D E >> -W 97 0F 12 5,-3.1 5,-1.3 -2,-0.8 4,-0.7 -0.758 10.0-168.5 -82.5 108.9 94.3 33.2 26.8 93 97 A L T 45S+ 0 0 104 -2,-1.0 -1,-0.2 1,-0.2 -22,-0.1 0.718 77.0 67.2 -73.9 -19.6 96.1 33.7 30.0 94 98 A A T 45S+ 0 0 25 1,-0.2 -1,-0.2 -23,-0.1 -23,-0.1 0.939 121.9 13.3 -63.6 -48.2 93.7 31.5 32.0 95 99 A W T 45S- 0 0 51 -3,-0.2 -1,-0.2 -69,-0.1 -2,-0.2 0.171 101.2-118.6-118.1 14.8 94.7 28.3 30.3 96 100 A K T <5S+ 0 0 111 -4,-0.7 211,-3.4 1,-0.2 212,-0.5 0.888 70.9 130.2 46.8 48.2 97.9 29.4 28.6 97 101 A S E < -W 92 0F 10 -5,-1.3 -5,-3.1 210,-0.2 2,-0.7 -0.834 66.1-111.8-123.1 160.3 96.5 28.6 25.2 98 102 A V E -W 91 0F 24 210,-2.1 2,-0.6 -2,-0.3 212,-0.3 -0.890 32.5-155.5 -91.6 117.8 96.1 30.5 21.9 99 103 A E E -W 90 0F 13 -9,-2.9 -9,-2.5 -2,-0.7 210,-0.1 -0.876 11.2-170.0 -94.2 119.4 92.4 31.1 21.4 100 104 A T - 0 0 24 -2,-0.6 -1,-0.1 -11,-0.2 -9,-0.0 0.643 26.5-138.6 -79.6 -19.7 91.5 31.6 17.7 101 105 A N + 0 0 1 2,-0.1 -12,-0.1 1,-0.1 -2,-0.0 0.644 57.4 140.3 62.5 21.4 87.9 32.8 18.4 102 106 A E S S+ 0 0 73 1,-0.1 2,-0.5 -15,-0.0 -1,-0.1 0.825 73.4 47.7 -58.3 -32.5 86.7 30.7 15.6 103 107 A I S S+ 0 0 0 4,-0.1 2,-0.2 -67,-0.0 -2,-0.1 -0.973 78.0 159.8-106.1 127.3 83.8 30.0 18.0 104 108 A G > - 0 0 0 -2,-0.5 4,-2.3 -24,-0.1 3,-0.4 -0.676 56.6 -69.1-130.7-167.8 82.3 33.0 19.6 105 109 A L H > S+ 0 0 5 -28,-0.3 4,-2.2 1,-0.3 5,-0.2 0.833 125.3 52.1 -64.5 -36.0 79.1 33.8 21.3 106 110 A N H > S+ 0 0 2 -26,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.918 111.5 47.3 -65.9 -40.8 76.8 33.7 18.3 107 111 A E H > S+ 0 0 26 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.899 110.9 52.9 -66.1 -36.0 78.0 30.2 17.2 108 112 A F H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.916 106.6 52.2 -65.6 -36.8 77.7 29.0 20.8 109 113 A M H X S+ 0 0 25 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.893 107.9 52.7 -63.6 -37.8 74.0 30.2 20.8 110 114 A D H X S+ 0 0 47 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.914 111.5 46.0 -63.0 -44.4 73.5 28.2 17.6 111 115 A W H X S+ 0 0 0 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.913 110.2 52.8 -62.4 -46.8 74.9 25.1 19.3 112 116 A A H X>S+ 0 0 1 -4,-2.7 5,-2.3 1,-0.2 4,-0.7 0.883 105.6 55.2 -58.8 -39.3 72.8 25.7 22.5 113 117 A K H ><5S+ 0 0 168 -4,-2.1 3,-0.8 1,-0.2 -1,-0.2 0.891 104.4 54.2 -59.1 -42.0 69.7 25.9 20.4 114 118 A M H 3<5S+ 0 0 81 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.800 111.8 43.5 -66.1 -31.6 70.4 22.5 18.8 115 119 A V H 3<5S- 0 0 8 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.435 114.4-115.6 -94.6 1.0 70.7 20.8 22.2 116 120 A G T <<5 + 0 0 62 -3,-0.8 2,-0.4 -4,-0.7 -3,-0.2 0.721 69.5 133.7 77.3 22.5 67.6 22.6 23.6 117 121 A A < - 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