==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-OCT-11 3VIF . COMPND 2 MOLECULE: BETA-GLUCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NEOTERMES KOSHUNENSIS; . AUTHOR W.Y.JENG,C.I.LIU,A.H.J.WANG . 473 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17483.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 3.4 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 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 29 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 156 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 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 5 1 0 1 2 0 0 0 1 1 1 2 1 1 0 1 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 4 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 . 4 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 26 A D > 0 0 100 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 8.0 -3.9 93.6 33.9 2 27 A T G > + 0 0 99 1,-0.3 3,-1.9 2,-0.2 405,-0.1 0.919 360.0 54.4 -55.5 -46.4 -6.1 96.5 32.7 3 28 A V G 3 S+ 0 0 33 1,-0.3 -1,-0.3 404,-0.1 404,-0.2 0.624 109.2 50.9 -66.7 -13.1 -6.5 95.0 29.2 4 29 A Y G < S+ 0 0 45 -3,-1.1 463,-2.1 2,-0.1 2,-0.4 0.349 94.8 88.2-103.0 2.6 -7.8 91.8 30.9 5 30 A T B < S-A 466 0A 35 -3,-1.9 461,-0.2 -4,-0.3 460,-0.1 -0.859 73.9-125.9-108.6 136.7 -10.4 93.5 33.2 6 31 A F - 0 0 3 459,-2.5 -2,-0.1 -2,-0.4 -3,-0.0 -0.551 35.9-101.7 -75.7 139.4 -14.0 94.2 32.3 7 32 A P > - 0 0 43 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.270 35.9-112.3 -53.5 147.9 -15.2 97.8 32.7 8 33 A D T 3 S+ 0 0 147 1,-0.3 -2,-0.1 -3,-0.1 457,-0.0 0.847 114.9 42.5 -55.2 -39.3 -17.3 98.1 35.9 9 34 A E T 3 S+ 0 0 173 2,-0.1 -1,-0.3 406,-0.0 2,-0.1 0.486 84.9 120.8 -88.9 -3.7 -20.6 98.8 34.1 10 35 A F < - 0 0 5 -3,-1.4 2,-0.5 1,-0.1 405,-0.2 -0.395 58.0-136.8 -65.4 134.3 -20.1 96.1 31.4 11 36 A K E -b 415 0B 64 403,-1.9 405,-2.6 -2,-0.1 2,-0.4 -0.841 18.8-169.7-102.4 127.3 -22.9 93.5 31.4 12 37 A L E +b 416 0B 3 -2,-0.5 63,-3.2 403,-0.2 64,-1.0 -0.894 27.0 110.7-112.8 140.3 -22.1 89.8 31.0 13 38 A G E -bc 417 76B 0 403,-2.2 405,-2.3 -2,-0.4 2,-0.3 -0.844 50.9 -85.1-170.6-148.8 -24.6 87.0 30.4 14 39 A A E -bc 418 77B 0 62,-1.3 64,-2.3 403,-0.3 2,-0.3 -0.919 28.1-140.5-145.4 164.7 -26.0 84.4 28.0 15 40 A A E +bc 419 78B 0 403,-2.4 406,-1.7 -2,-0.3 405,-0.7 -0.937 17.7 166.6-136.6 151.5 -28.5 84.1 25.2 16 41 A T - 0 0 0 62,-2.3 2,-0.3 -2,-0.3 408,-0.0 -0.827 23.3-132.7-144.7 178.9 -31.3 81.9 23.8 17 42 A A > - 0 0 0 -2,-0.2 4,-1.1 62,-0.2 3,-0.2 -0.985 24.2-116.4-140.9 149.3 -34.2 82.2 21.2 18 43 A S H >> S+ 0 0 0 -2,-0.3 4,-2.9 1,-0.3 3,-0.9 0.870 109.7 41.8 -56.6 -56.3 -37.8 81.1 21.6 19 44 A Y H 34 S+ 0 0 12 104,-0.3 4,-0.3 1,-0.2 -1,-0.3 0.839 112.8 57.6 -65.0 -30.3 -38.1 78.4 18.9 20 45 A Q H 34 S+ 0 0 2 -3,-0.2 405,-2.4 1,-0.1 -1,-0.2 0.774 126.0 11.4 -69.6 -25.4 -34.7 77.0 19.7 21 46 A I H << S+ 0 0 7 -4,-1.1 37,-2.5 -3,-0.9 35,-0.3 0.653 108.2 72.5-123.9 -27.6 -35.5 76.3 23.4 22 47 A E < + 0 0 7 -4,-2.9 37,-2.3 -5,-0.2 38,-0.4 0.856 53.9 179.7 -75.3 -40.3 -39.2 76.6 24.3 23 48 A G + 0 0 5 29,-0.4 31,-0.3 -5,-0.3 -1,-0.2 -0.436 45.9 107.7 64.3-148.3 -41.1 73.6 22.9 24 49 A A > + 0 0 7 29,-0.6 3,-1.2 1,-0.1 6,-0.2 0.879 46.3 171.5 47.4 46.1 -44.8 73.7 23.7 25 50 A W T 3 S+ 0 0 67 28,-1.1 -1,-0.1 1,-0.3 8,-0.1 0.697 75.0 18.2 -67.2 -24.4 -45.3 74.6 20.0 26 51 A D T 3 S+ 0 0 99 27,-0.2 3,-0.5 6,-0.1 -1,-0.3 0.098 96.8 128.6-129.5 22.0 -49.1 74.2 20.1 27 52 A E S X S- 0 0 66 -3,-1.2 3,-1.7 1,-0.2 4,-0.0 -0.560 72.2 -5.2 -86.1 142.7 -49.8 74.4 23.9 28 53 A N T 3 S- 0 0 88 1,-0.3 -1,-0.2 -2,-0.2 70,-0.2 0.834 132.2 -42.1 48.4 47.9 -52.3 76.7 25.6 29 54 A G T 3 S+ 0 0 48 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.334 88.5 152.0 90.9 -4.3 -53.4 78.7 22.5 30 55 A K < - 0 0 15 -3,-1.7 -1,-0.3 -6,-0.2 55,-0.3 -0.392 37.1-137.8 -62.2 133.8 -50.0 79.3 20.8 31 56 A G - 0 0 7 53,-2.6 2,-0.2 1,-0.1 58,-0.1 -0.406 26.5 -87.5 -88.0 166.8 -50.5 79.6 17.0 32 57 A P - 0 0 66 0, 0.0 96,-2.6 0, 0.0 97,-0.5 -0.475 40.4-163.8 -78.8 145.6 -48.3 78.1 14.4 33 58 A N B > -J 127 0C 1 94,-0.3 4,-2.2 -2,-0.2 3,-0.2 -0.662 38.6 -93.6-118.4 175.5 -45.2 79.8 13.1 34 59 A I H > S+ 0 0 4 92,-2.3 4,-2.2 1,-0.2 91,-0.1 0.707 123.9 53.7 -66.4 -21.1 -43.0 79.3 10.0 35 60 A W H > S+ 0 0 2 2,-0.2 4,-2.5 91,-0.2 5,-0.3 0.840 105.4 52.7 -83.5 -33.0 -40.6 77.0 11.9 36 61 A D H > S+ 0 0 2 -3,-0.2 4,-2.0 2,-0.2 5,-0.3 0.948 113.6 46.6 -55.2 -49.1 -43.5 74.8 13.0 37 62 A T H X S+ 0 0 29 -4,-2.2 4,-2.9 1,-0.2 5,-0.5 0.943 113.4 46.6 -61.7 -47.9 -44.4 74.6 9.3 38 63 A L H X S+ 0 0 3 -4,-2.2 4,-2.5 1,-0.2 7,-0.2 0.948 116.0 42.8 -60.8 -50.5 -40.8 73.9 8.1 39 64 A T H < S+ 0 0 3 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.802 120.4 42.9 -73.5 -24.9 -40.1 71.2 10.5 40 65 A H H < S+ 0 0 72 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.870 126.3 28.9 -82.5 -41.3 -43.5 69.5 10.2 41 66 A E H < S+ 0 0 132 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.750 130.4 34.5 -92.8 -26.1 -43.9 69.7 6.4 42 67 A H >< + 0 0 61 -4,-2.5 3,-2.5 -5,-0.5 4,-0.2 -0.403 57.3 149.9-130.5 58.2 -40.2 69.6 5.3 43 68 A P G > S+ 0 0 59 0, 0.0 3,-1.7 0, 0.0 6,-0.5 0.769 70.9 73.5 -62.2 -20.9 -38.3 67.4 7.7 44 69 A D G 3 S+ 0 0 130 1,-0.3 4,-0.1 -3,-0.1 -5,-0.1 0.621 89.5 59.4 -65.0 -13.2 -36.0 66.7 4.7 45 70 A Y G < S+ 0 0 39 -3,-2.5 2,-0.4 -7,-0.2 -1,-0.3 0.558 100.2 67.6 -86.1 -9.8 -34.6 70.2 5.1 46 71 A V S X S- 0 0 10 -3,-1.7 3,-2.5 -4,-0.2 383,-0.2 -0.911 91.8-103.7-120.7 136.3 -33.4 69.5 8.7 47 72 A V G > S+ 0 0 38 381,-2.6 3,-1.8 -2,-0.4 384,-0.3 -0.318 108.6 0.0 -54.0 131.0 -30.7 67.2 10.0 48 73 A D G 3 S- 0 0 138 1,-0.3 -1,-0.3 382,-0.1 3,-0.1 0.547 115.7 -86.5 67.7 7.1 -32.3 64.1 11.5 49 74 A G G < S+ 0 0 31 -3,-2.5 -1,-0.3 -6,-0.5 -2,-0.2 0.842 76.6 177.9 59.2 30.1 -35.8 65.5 10.6 50 75 A A < - 0 0 12 -3,-1.8 2,-0.3 -7,-0.2 -1,-0.2 -0.270 13.0-165.4 -67.2 154.6 -35.5 67.3 14.0 51 76 A T - 0 0 37 -3,-0.1 4,-0.5 -11,-0.0 3,-0.4 -0.920 30.8-127.9-130.7 163.0 -38.2 69.7 15.2 52 77 A G S S+ 0 0 2 -2,-0.3 -29,-0.4 1,-0.2 -27,-0.1 0.100 71.7 119.5 -89.1 23.6 -38.6 72.3 17.9 53 78 A D S S- 0 0 49 1,-0.1 -28,-1.1 -30,-0.1 -29,-0.6 0.858 99.9 -2.6 -59.4 -37.7 -41.8 70.6 19.2 54 79 A I S > S+ 0 0 84 -3,-0.4 3,-2.7 -31,-0.3 4,-0.2 0.662 85.3 156.2-116.5 -49.1 -40.1 70.1 22.6 55 80 A A T 3 S- 0 0 1 -4,-0.5 -34,-0.2 1,-0.3 -33,-0.1 -0.282 85.0 -19.1 54.2-131.3 -36.5 71.4 22.2 56 81 A D T 3 S- 0 0 0 -35,-0.3 -1,-0.3 -36,-0.2 -34,-0.2 0.436 86.2-127.2 -83.1 -0.4 -35.3 72.3 25.8 57 82 A D X> + 0 0 28 -3,-2.7 4,-2.5 -36,-0.1 3,-1.3 0.791 53.3 156.6 57.2 33.8 -38.9 72.4 27.0 58 83 A S H 3> + 0 0 0 -37,-2.5 4,-0.8 1,-0.3 -36,-0.2 0.685 61.6 71.7 -66.0 -16.0 -38.2 75.9 28.4 59 84 A Y H 34 S+ 0 0 21 -37,-2.3 -1,-0.3 -5,-0.2 3,-0.1 0.917 116.7 22.9 -59.8 -41.1 -41.9 76.7 28.2 60 85 A H H <4 S+ 0 0 85 -3,-1.3 3,-0.3 -38,-0.4 -2,-0.2 0.782 129.6 46.9 -90.0 -30.8 -42.2 74.3 31.1 61 86 A L H >X + 0 0 36 -4,-2.5 4,-1.5 1,-0.2 3,-1.3 0.107 66.1 122.6-106.7 21.6 -38.6 74.5 32.5 62 87 A Y H 3X S+ 0 0 33 -4,-0.8 4,-2.2 1,-0.3 -1,-0.2 0.816 73.2 59.1 -56.3 -32.4 -38.0 78.2 32.5 63 88 A K H 3> S+ 0 0 118 -3,-0.3 4,-2.3 1,-0.2 -1,-0.3 0.858 103.1 52.8 -66.0 -31.1 -37.2 78.1 36.3 64 89 A E H <> S+ 0 0 91 -3,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.865 106.6 53.2 -68.2 -37.0 -34.4 75.7 35.5 65 90 A D H X S+ 0 0 2 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.929 109.7 47.8 -61.3 -44.2 -33.0 78.2 33.0 66 91 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.916 108.2 56.4 -64.4 -40.4 -33.0 80.9 35.6 67 92 A K H X S+ 0 0 142 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.911 110.1 43.5 -53.8 -49.7 -31.3 78.5 38.0 68 93 A I H X S+ 0 0 12 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.857 111.3 54.5 -70.7 -32.8 -28.4 77.9 35.7 69 94 A L H X>S+ 0 0 0 -4,-2.3 5,-2.2 2,-0.2 4,-1.4 0.904 110.1 47.8 -60.4 -40.6 -28.2 81.6 34.8 70 95 A K H <5S+ 0 0 118 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.913 111.4 49.8 -67.3 -42.4 -27.9 82.3 38.5 71 96 A E H <5S+ 0 0 122 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.910 111.4 49.8 -58.9 -43.4 -25.2 79.5 38.9 72 97 A L H <5S- 0 0 2 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.805 110.7-125.2 -64.6 -29.9 -23.3 81.1 35.9 73 98 A G T <5 + 0 0 39 -4,-1.4 -3,-0.2 1,-0.2 -61,-0.2 0.688 42.7 177.7 84.9 23.5 -23.5 84.5 37.5 74 99 A A < - 0 0 6 -5,-2.2 -61,-0.2 -6,-0.2 -1,-0.2 -0.357 23.8-166.1 -60.0 135.7 -25.2 86.1 34.5 75 100 A Q S S+ 0 0 77 -63,-3.2 41,-2.7 1,-0.2 2,-0.3 0.708 78.2 27.7 -87.4 -26.0 -26.1 89.8 34.9 76 101 A V E -cd 13 116B 0 -64,-1.0 -62,-1.3 39,-0.2 2,-0.5 -0.989 63.0-158.0-139.0 141.1 -28.3 89.7 31.8 77 102 A Y E -cd 14 117B 0 39,-2.5 41,-2.5 -2,-0.3 2,-0.6 -0.983 11.0-157.8-120.0 116.3 -30.3 87.0 30.0 78 103 A R E +cd 15 118B 0 -64,-2.3 -62,-2.3 -2,-0.5 2,-0.3 -0.856 28.0 153.5 -92.2 122.0 -31.1 87.6 26.3 79 104 A F E - d 0 119B 3 39,-2.3 41,-2.7 -2,-0.6 2,-0.3 -0.899 33.5-124.2-138.6 167.3 -34.1 85.7 25.2 80 105 A S E - d 0 120B 2 -2,-0.3 2,-0.4 39,-0.2 41,-0.2 -0.807 14.1-126.6-116.2 159.7 -36.7 86.1 22.5 81 106 A I - 0 0 0 39,-2.1 2,-0.8 -2,-0.3 42,-0.4 -0.879 22.9-125.6-102.2 134.3 -40.5 86.2 22.6 82 107 A S >> - 0 0 2 -2,-0.4 4,-1.3 1,-0.2 3,-1.2 -0.701 15.2-154.0 -79.4 111.4 -42.5 83.9 20.3 83 108 A W H >> S+ 0 0 1 -2,-0.8 4,-3.3 1,-0.3 3,-0.8 0.902 93.9 48.7 -52.1 -49.5 -44.8 86.2 18.3 84 109 A A H 34 S+ 0 0 0 41,-0.6 -53,-2.6 1,-0.2 -1,-0.3 0.647 104.2 59.9 -73.1 -14.3 -47.4 83.4 17.7 85 110 A R H <4 S+ 0 0 1 -3,-1.2 14,-0.5 -55,-0.3 -1,-0.2 0.791 118.0 31.5 -74.1 -30.5 -47.4 82.5 21.4 86 111 A V H << S+ 0 0 0 -4,-1.3 10,-3.1 -3,-0.8 -2,-0.2 0.853 136.7 23.6 -91.0 -46.4 -48.5 86.1 22.2 87 112 A L S >< S- 0 0 1 -4,-3.3 3,-2.3 8,-0.2 -1,-0.3 -0.857 71.2-172.9-122.2 87.6 -50.6 86.9 19.1 88 113 A P T 3 S+ 0 0 18 0, 0.0 41,-0.2 0, 0.0 -1,-0.1 0.744 86.9 43.9 -61.3 -24.3 -51.7 83.4 17.8 89 114 A E T 3 S- 0 0 98 2,-0.4 2,-1.7 5,-0.4 3,-0.1 0.294 107.2-125.5 -98.3 4.2 -53.1 85.0 14.6 90 115 A G S < S+ 0 0 1 -3,-2.3 -1,-0.0 1,-0.2 58,-0.0 -0.288 87.2 89.0 81.7 -56.0 -50.2 87.3 14.1 91 116 A H S > S- 0 0 67 -2,-1.7 3,-0.6 1,-0.1 -2,-0.4 -0.319 92.3-112.4 -61.7 161.1 -52.5 90.3 13.9 92 117 A D T 3 S+ 0 0 69 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 0.234 90.3 100.6 -90.2 16.8 -53.3 92.0 17.3 93 118 A N T 3 S+ 0 0 111 1,-0.2 2,-0.5 -6,-0.1 -1,-0.2 0.832 86.1 40.2 -68.2 -33.8 -57.0 91.0 17.5 94 119 A I < - 0 0 88 -3,-0.6 2,-0.5 2,-0.0 -5,-0.4 -0.981 66.7-167.6-122.8 122.7 -56.3 88.1 19.9 95 120 A V - 0 0 63 -2,-0.5 2,-0.9 -8,-0.2 -8,-0.2 -0.939 21.3-136.0-106.1 123.4 -53.8 88.3 22.7 96 121 A N >> - 0 0 24 -10,-3.1 4,-1.9 -2,-0.5 3,-0.8 -0.722 9.7-160.3 -83.7 106.6 -53.1 84.9 24.3 97 122 A Q H 3> S+ 0 0 116 -2,-0.9 4,-3.0 1,-0.3 5,-0.2 0.831 90.3 61.1 -57.2 -33.7 -53.1 85.4 28.0 98 123 A D H 3> S+ 0 0 39 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.899 105.8 46.9 -59.9 -40.6 -51.1 82.2 28.5 99 124 A G H <> S+ 0 0 0 -3,-0.8 4,-2.2 -14,-0.5 5,-0.3 0.915 111.8 49.7 -66.7 -43.4 -48.3 83.7 26.4 100 125 A I H X S+ 0 0 2 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.938 112.8 48.1 -57.0 -48.3 -48.4 86.9 28.4 101 126 A D H X S+ 0 0 72 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.898 109.1 53.9 -60.2 -42.7 -48.3 84.9 31.7 102 127 A Y H X S+ 0 0 10 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.950 112.2 41.4 -59.1 -54.0 -45.4 82.8 30.5 103 128 A Y H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.885 114.5 52.5 -68.5 -34.4 -43.1 85.7 29.6 104 129 A N H X S+ 0 0 29 -4,-2.5 4,-3.0 -5,-0.3 5,-0.3 0.923 108.8 51.5 -60.7 -42.1 -44.2 87.6 32.8 105 130 A N H X S+ 0 0 73 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.926 112.7 44.9 -61.2 -43.5 -43.3 84.5 34.8 106 131 A L H X S+ 0 0 5 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.940 114.5 48.0 -64.2 -49.2 -39.9 84.3 33.2 107 132 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.927 113.9 46.9 -57.2 -47.4 -39.2 88.0 33.6 108 133 A N H X S+ 0 0 74 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.889 111.1 51.3 -65.1 -38.7 -40.3 88.0 37.2 109 134 A E H X S+ 0 0 54 -4,-2.3 4,-0.8 -5,-0.3 -1,-0.2 0.912 111.0 49.1 -64.2 -43.2 -38.2 84.9 37.9 110 135 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 3,-1.2 0.963 112.6 46.5 -58.1 -53.1 -35.2 86.6 36.4 111 136 A L H ><5S+ 0 0 73 -4,-2.6 3,-1.8 1,-0.3 -2,-0.2 0.887 107.6 56.4 -60.4 -38.0 -35.6 89.8 38.4 112 137 A A H 3<5S+ 0 0 81 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.697 110.8 46.6 -64.7 -20.1 -36.2 87.8 41.6 113 138 A N T <<5S- 0 0 41 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.174 122.0-106.4-108.2 13.0 -32.8 86.2 41.0 114 139 A G T < 5S+ 0 0 65 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.737 76.2 132.8 71.8 27.0 -31.0 89.5 40.2 115 140 A I < - 0 0 4 -5,-2.5 -39,-0.2 -6,-0.1 -1,-0.2 -0.935 51.7-133.5-114.4 130.0 -30.8 88.9 36.4 116 141 A E E -d 76 0B 46 -41,-2.7 -39,-2.5 -2,-0.5 2,-0.3 -0.672 18.8-130.2 -84.3 128.4 -31.8 91.6 33.9 117 142 A P E -d 77 0B 1 0, 0.0 44,-0.5 0, 0.0 45,-0.5 -0.584 18.9-171.2 -76.2 137.6 -34.0 90.5 31.0 118 143 A M E -de 78 162B 0 -41,-2.5 -39,-2.3 -2,-0.3 2,-0.5 -0.989 17.1-154.6-125.0 119.1 -33.0 91.6 27.4 119 144 A V E -de 79 163B 0 43,-2.5 45,-2.8 -2,-0.4 2,-0.6 -0.865 15.5-159.7-111.7 122.6 -35.7 90.8 25.0 120 145 A T E -de 80 164B 0 -41,-2.7 -39,-2.1 -2,-0.5 3,-0.2 -0.843 7.8-162.3 -87.8 122.6 -35.5 90.1 21.3 121 146 A M E S+ 0 0 1 43,-3.0 2,-0.5 -2,-0.6 -38,-0.2 0.911 78.1 29.3 -72.5 -42.7 -38.9 90.7 19.7 122 147 A Y E + e 0 166B 3 43,-1.4 45,-2.2 42,-0.4 -1,-0.3 -0.905 55.1 160.3-129.1 107.6 -38.3 88.8 16.5 123 148 A H S S- 0 0 2 -2,-0.5 -104,-0.3 -42,-0.4 -43,-0.1 -0.394 77.2 -72.5-123.8 53.2 -35.9 85.8 16.3 124 149 A W S S+ 0 0 13 43,-0.1 2,-1.0 1,-0.1 -90,-0.1 0.252 98.2 116.2 95.4 -6.1 -37.2 84.2 13.1 125 150 A D + 0 0 1 -91,-0.1 -41,-0.6 -92,-0.1 -42,-0.2 -0.477 41.2 178.7-100.4 63.1 -40.5 82.6 14.2 126 151 A L - 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