==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-JUN-08 3DEC . COMPND 2 MOLECULE: BETA-GALACTOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON VPI-5482; . AUTHOR D.KUMARAN,J.BONANNO,R.ROMERO,S.K.BURLEY,S.SWAMINATHAN,NEW . 983 4 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 640 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 279 28.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.0 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 . 93 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.7 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 1 1 2 1 2 0 2 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 2 3 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 . 8 4 5 2 5 7 5 2 6 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 3 4 1 0 1 1 0 0 0 1 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 Q 0 0 229 0, 0.0 2,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -53.8 -36.1 -6.2 6.3 2 5 A P > - 0 0 34 0, 0.0 3,-2.1 0, 0.0 4,-0.1 -0.336 360.0 -94.9 -81.7 170.0 -33.6 -6.8 9.3 3 6 A E G > S+ 0 0 79 1,-0.3 3,-1.8 2,-0.2 6,-0.4 0.779 119.2 60.9 -52.7 -37.3 -33.5 -4.8 12.5 4 7 A W G 3 S+ 0 0 3 1,-0.3 188,-1.5 187,-0.1 -1,-0.3 0.382 94.3 66.3 -78.1 4.8 -30.9 -2.3 11.5 5 8 A Q G < S+ 0 0 20 -3,-2.1 2,-0.4 186,-0.2 -1,-0.3 0.231 91.9 80.9-101.2 8.6 -33.1 -1.2 8.6 6 9 A S < - 0 0 39 -3,-1.8 3,-0.2 3,-0.1 186,-0.2 -0.937 65.5-152.8-121.6 141.1 -35.6 0.2 11.1 7 10 A Q S S+ 0 0 16 -2,-0.4 415,-0.1 1,-0.2 -1,-0.1 0.630 99.4 56.2 -85.2 -7.6 -35.5 3.5 13.0 8 11 A Y S S+ 0 0 121 1,-0.1 2,-2.6 -5,-0.1 3,-0.3 0.751 81.1 87.1 -89.3 -27.9 -37.5 1.9 15.8 9 12 A A + 0 0 11 -6,-0.4 -1,-0.1 -3,-0.2 -3,-0.1 -0.363 48.2 138.1 -68.7 62.5 -35.1 -1.0 16.5 10 13 A V - 0 0 25 -2,-2.6 152,-2.0 1,-0.3 2,-0.3 0.659 69.1 -23.2 -92.0 -15.0 -33.0 1.1 18.9 11 14 A G B -A 161 0A 25 -3,-0.3 -1,-0.3 150,-0.2 2,-0.3 -0.965 47.3-152.8-178.8 169.1 -32.6 -1.6 21.6 12 15 A L S S- 0 0 68 148,-0.8 148,-0.3 -2,-0.3 3,-0.1 -0.848 78.8 -7.2-159.9 124.3 -33.8 -4.9 23.1 13 16 A N S S+ 0 0 112 -2,-0.3 158,-0.5 1,-0.2 146,-0.1 0.472 88.0 144.7 70.1 3.8 -33.4 -6.2 26.7 14 17 A K - 0 0 41 146,-0.2 156,-0.2 156,-0.1 -1,-0.2 -0.302 55.8-104.1 -64.4 153.5 -31.0 -3.4 27.7 15 18 A L - 0 0 36 154,-2.6 154,-0.3 1,-0.1 -1,-0.1 -0.442 48.1 -88.0 -65.3 152.9 -31.0 -1.9 31.2 16 19 A D - 0 0 140 -2,-0.1 -1,-0.1 1,-0.1 0, 0.0 -0.444 55.2 -97.8 -59.2 136.3 -32.6 1.5 31.6 17 20 A P + 0 0 43 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.268 63.3 152.8 -57.8 143.9 -30.0 4.2 30.9 18 21 A H - 0 0 25 411,-0.1 2,-0.2 -3,-0.1 205,-0.1 -0.874 46.3 -65.9-156.4-173.4 -28.6 5.4 34.3 19 22 A T - 0 0 11 -2,-0.3 2,-0.3 1,-0.1 414,-0.2 -0.550 65.7 -87.6 -84.7 157.5 -25.7 6.9 36.0 20 23 A Y + 0 0 22 413,-0.5 -1,-0.1 -2,-0.2 203,-0.1 -0.495 46.0 179.1 -67.2 121.9 -22.5 4.9 36.2 21 24 A V + 0 0 5 -2,-0.3 200,-0.2 201,-0.1 -1,-0.1 -0.278 8.8 173.9-122.2 46.5 -22.7 2.8 39.4 22 25 A W - 0 0 14 293,-0.1 2,-0.5 1,-0.1 293,-0.3 -0.268 33.6-122.1 -53.1 131.5 -19.5 0.8 39.3 23 26 A P - 0 0 3 0, 0.0 17,-0.3 0, 0.0 291,-0.2 -0.692 31.7-164.7 -80.3 124.8 -18.9 -1.3 42.3 24 27 A Y B -G 313 0B 10 289,-3.0 289,-0.7 -2,-0.5 3,-0.1 -0.569 22.2-135.5-101.0 170.2 -15.7 -0.3 44.1 25 28 A A S S+ 0 0 60 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.660 83.4 20.3 -92.2 -16.3 -13.8 -2.3 46.7 26 29 A D >> - 0 0 85 287,-0.1 4,-1.9 1,-0.1 3,-1.1 -0.995 66.7-124.2-165.1 127.0 -13.0 0.6 49.0 27 30 A A H 3> S+ 0 0 37 -2,-0.3 4,-1.6 1,-0.3 -1,-0.1 0.863 116.5 59.5 -48.9 -33.9 -14.1 4.2 49.9 28 31 A S H 3> S+ 0 0 63 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.862 102.6 50.3 -68.3 -31.6 -10.5 5.1 49.2 29 32 A E H <>>S+ 0 0 20 -3,-1.1 5,-1.4 2,-0.2 4,-1.0 0.893 104.9 60.0 -65.5 -40.4 -10.9 3.8 45.6 30 33 A V H <5S+ 0 0 2 -4,-1.9 3,-0.5 1,-0.2 -2,-0.2 0.867 100.5 53.3 -60.6 -38.4 -14.2 5.9 45.3 31 34 A E H <5S+ 0 0 95 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.878 110.9 46.4 -64.7 -38.5 -12.4 9.2 45.9 32 35 A K H <5S- 0 0 112 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.644 102.0-132.3 -77.7 -12.9 -9.8 8.4 43.2 33 36 A G T <5 + 0 0 18 -4,-1.0 2,-1.7 -3,-0.5 3,-0.3 0.690 55.9 150.3 67.5 20.8 -12.6 7.3 40.7 34 37 A T > < + 0 0 47 -5,-1.4 3,-1.4 1,-0.2 -1,-0.2 -0.297 2.9 144.4 -84.2 52.7 -10.3 4.4 40.1 35 38 A F G > + 0 0 14 -2,-1.7 3,-1.4 1,-0.3 -1,-0.2 0.700 55.9 72.3 -76.1 -18.2 -13.0 1.8 39.3 36 39 A E G 3 S+ 0 0 50 -3,-0.3 -1,-0.3 1,-0.2 7,-0.2 0.647 95.7 53.8 -71.0 -11.6 -11.1 -0.1 36.7 37 40 A Q G < S+ 0 0 149 -3,-1.4 -1,-0.2 5,-0.1 -2,-0.2 0.297 83.3 119.9-105.1 7.5 -8.9 -1.7 39.5 38 41 A S X - 0 0 6 -3,-1.4 3,-1.2 1,-0.1 -14,-0.1 -0.404 69.7-132.2 -68.5 146.2 -11.9 -2.9 41.4 39 42 A P T 3 S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 -15,-0.1 0.654 109.4 58.3 -73.6 -14.2 -12.2 -6.7 42.1 40 43 A Y T 3 S+ 0 0 70 -17,-0.3 175,-2.6 -5,-0.1 2,-0.4 0.231 97.6 74.5 -98.0 10.6 -15.8 -6.3 40.9 41 44 A Y E < -K 214 0C 22 -3,-1.2 2,-0.3 173,-0.2 173,-0.2 -0.954 55.1-179.1-122.0 140.8 -14.8 -4.9 37.5 42 45 A X E -K 213 0C 38 171,-2.8 171,-2.4 -2,-0.4 -5,-0.1 -0.878 18.7-140.0-143.8 117.6 -13.3 -6.8 34.5 43 46 A S E -K 212 0C 47 -2,-0.3 169,-0.2 169,-0.2 167,-0.0 -0.379 8.7-166.3 -68.0 146.0 -12.2 -5.4 31.2 44 47 A L + 0 0 0 167,-2.7 168,-0.2 2,-0.1 -1,-0.1 0.138 52.9 120.8-107.4 12.1 -12.9 -7.3 28.0 45 48 A N + 0 0 41 166,-0.4 2,-0.3 32,-0.0 32,-0.0 -0.409 40.4 75.2 -73.1 158.4 -10.6 -5.0 26.1 46 49 A G E S-B 78 0A 26 32,-2.0 32,-2.0 -2,-0.1 2,-0.3 -0.948 90.4 -16.8 135.4-161.9 -7.7 -6.7 24.3 47 50 A Q E -B 77 0A 109 -2,-0.3 2,-0.3 30,-0.2 30,-0.2 -0.661 61.2-175.9 -85.3 133.1 -7.3 -8.8 21.2 48 51 A W E -B 76 0A 2 28,-2.6 28,-1.9 -2,-0.3 77,-0.2 -0.933 33.6-101.7-126.8 153.3 -10.5 -10.4 19.8 49 52 A K E -BC 75 124A 43 75,-3.0 75,-2.2 -2,-0.3 2,-0.4 -0.500 49.3-167.7 -70.9 140.5 -11.2 -12.7 16.9 50 53 A F E +BC 74 123A 4 24,-2.4 24,-0.6 73,-0.2 2,-0.3 -0.978 21.0 179.5-140.9 149.0 -12.4 -10.7 14.0 51 54 A H E - C 0 122A 55 71,-1.5 71,-2.9 -2,-0.4 2,-0.4 -0.994 9.1-163.6-149.2 142.2 -13.9 -11.2 10.6 52 55 A W E + C 0 121A 73 -2,-0.3 2,-0.3 69,-0.2 69,-0.2 -0.993 10.7 169.3-132.9 130.5 -15.0 -8.7 8.0 53 56 A V E - C 0 120A 17 67,-2.2 67,-2.7 -2,-0.4 2,-0.6 -0.994 32.2-135.7-134.4 153.4 -17.3 -8.9 4.9 54 57 A K E S+ C 0 119A 101 -2,-0.3 65,-0.2 65,-0.2 64,-0.1 -0.928 89.9 37.0 -91.4 120.6 -18.9 -6.6 2.4 55 58 A N S > S- 0 0 30 63,-3.3 3,-2.8 -2,-0.6 4,-0.2 0.776 76.0-131.8 98.2 97.1 -22.5 -7.9 2.2 56 59 A P G > S+ 0 0 0 0, 0.0 3,-0.7 0, 0.0 60,-0.1 0.582 103.8 65.4 -50.6 -18.1 -24.3 -9.3 5.2 57 60 A D G 3 S+ 0 0 83 1,-0.2 4,-0.2 59,-0.1 -2,-0.1 0.792 98.9 52.4 -73.9 -26.4 -25.4 -12.4 3.2 58 61 A T G < S+ 0 0 84 -3,-2.8 -1,-0.2 -4,-0.1 -4,-0.1 0.249 88.4 114.2 -93.8 11.6 -21.8 -13.5 2.9 59 62 A R S < S- 0 0 54 -3,-0.7 2,-1.8 -4,-0.2 3,-0.1 -0.463 82.8-102.4 -82.9 157.0 -21.1 -13.3 6.6 60 63 A P > - 0 0 14 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.546 42.4-171.3 -71.4 84.3 -20.4 -16.2 8.9 61 64 A K T 3 S+ 0 0 107 -2,-1.8 3,-0.4 1,-0.3 -3,-0.0 0.738 76.1 47.0 -54.5 -26.9 -23.9 -16.4 10.4 62 65 A D T > S+ 0 0 76 1,-0.2 3,-2.6 -3,-0.1 -1,-0.3 0.384 70.6 113.5-103.8 8.7 -23.2 -18.8 13.1 63 66 A F T < S+ 0 0 0 -3,-2.1 -1,-0.2 1,-0.3 -2,-0.1 0.653 70.2 67.4 -52.1 -19.0 -20.0 -17.4 14.6 64 67 A Y T 3 S+ 0 0 54 -3,-0.4 -1,-0.3 -4,-0.2 91,-0.3 0.526 76.9 95.5 -82.8 -9.5 -21.8 -16.6 17.8 65 68 A K S X S- 0 0 79 -3,-2.6 3,-2.6 1,-0.1 90,-0.1 -0.698 79.8-130.4 -82.7 135.2 -22.3 -20.2 18.8 66 69 A P T 3 S+ 0 0 69 0, 0.0 -1,-0.1 0, 0.0 89,-0.1 0.878 109.2 57.5 -51.2 -37.5 -19.7 -21.5 21.2 67 70 A S T 3 S+ 0 0 107 2,-0.1 2,-0.4 -5,-0.0 -4,-0.1 0.627 81.1 102.7 -64.6 -16.6 -19.3 -24.5 18.8 68 71 A Y S < S- 0 0 76 -3,-2.6 2,-0.6 -6,-0.3 -5,-0.0 -0.573 74.3-130.4 -74.5 128.1 -18.5 -22.3 15.8 69 72 A Y + 0 0 182 -2,-0.4 3,-0.2 1,-0.1 -2,-0.1 -0.659 35.4 166.6 -90.6 123.8 -14.7 -22.5 15.2 70 73 A T > + 0 0 12 -2,-0.6 3,-1.2 1,-0.1 -20,-0.1 -0.039 41.0 114.0-117.3 27.2 -12.9 -19.1 14.8 71 74 A G T 3 S+ 0 0 41 1,-0.3 -1,-0.1 -22,-0.1 -2,-0.0 0.743 74.8 55.8 -74.9 -24.2 -9.3 -20.3 15.1 72 75 A G T 3 S+ 0 0 72 -3,-0.2 2,-0.3 2,-0.0 -1,-0.3 0.135 90.6 100.1 -96.2 20.7 -8.4 -19.5 11.5 73 76 A W S < S- 0 0 34 -3,-1.2 -22,-0.1 1,-0.1 -3,-0.0 -0.723 74.5-115.7 -96.3 157.5 -9.5 -15.9 12.0 74 77 A A E -B 50 0A 50 -24,-0.6 -24,-2.4 -2,-0.3 2,-0.3 -0.275 28.1-114.2 -78.0 169.3 -7.2 -12.9 12.6 75 78 A D E -B 49 0A 84 -26,-0.2 2,-0.3 -2,-0.0 -26,-0.2 -0.743 25.8-165.2 -98.6 161.4 -7.2 -10.8 15.8 76 79 A I E -B 48 0A 2 -28,-1.9 -28,-2.6 -2,-0.3 2,-0.3 -0.971 26.4-108.6-141.9 147.9 -8.2 -7.2 16.0 77 80 A K E -B 47 0A 97 -2,-0.3 -30,-0.2 -30,-0.2 -32,-0.0 -0.594 38.1-121.8 -78.9 135.4 -7.6 -4.7 18.8 78 81 A V E S+B 46 0A 2 -32,-2.0 -32,-2.0 -2,-0.3 2,-0.1 -0.992 86.5 33.4-125.3 129.8 -10.6 -3.7 20.8 79 82 A P S S+ 0 0 18 0, 0.0 129,-0.3 0, 0.0 2,-0.1 0.498 94.5 89.9 -86.9 163.2 -11.6 -0.8 21.2 80 83 A G S S- 0 0 2 127,-4.2 127,-0.4 -2,-0.1 271,-0.1 -0.257 77.6 -90.2 150.5 126.0 -10.8 0.9 17.9 81 84 A N > - 0 0 0 269,-0.8 3,-1.3 125,-0.2 125,-0.2 -0.199 34.1-134.1 -54.1 140.2 -12.4 1.5 14.6 82 85 A W G > >S+ 0 0 0 123,-1.9 3,-2.2 1,-0.3 5,-1.9 0.775 100.0 72.4 -73.6 -20.9 -11.6 -1.3 12.2 83 86 A E G > 5S+ 0 0 17 122,-0.4 3,-0.6 1,-0.3 -1,-0.3 0.766 97.1 52.7 -59.0 -24.9 -10.8 1.2 9.4 84 87 A R G < 5S+ 0 0 57 -3,-1.3 -1,-0.3 266,-0.3 -2,-0.2 0.196 104.4 55.8-100.0 17.7 -7.7 2.0 11.4 85 88 A Q G < 5S- 0 0 59 -3,-2.2 -1,-0.2 2,-0.2 -2,-0.2 -0.030 128.7 -81.7-133.0 31.8 -6.6 -1.6 11.7 86 89 A G T < 5S+ 0 0 77 -3,-0.6 2,-0.4 1,-0.2 -3,-0.2 0.425 90.7 119.9 94.0 1.5 -6.5 -2.5 8.0 87 90 A Y < - 0 0 61 -5,-1.9 -1,-0.2 2,-0.0 -2,-0.2 -0.834 68.6 -34.1-106.1 138.1 -10.2 -3.2 7.3 88 91 A G S S- 0 0 36 -2,-0.4 2,-0.4 1,-0.1 480,-0.1 -0.120 89.8 -47.0 64.0-155.6 -12.6 -1.6 4.9 89 92 A T - 0 0 36 478,-0.1 2,-0.4 114,-0.1 -6,-0.1 -0.962 34.0-143.1-132.0 119.3 -12.6 2.1 4.0 90 93 A A - 0 0 7 -2,-0.4 2,-0.4 -7,-0.3 477,-0.3 -0.570 29.7-171.5 -66.3 125.7 -12.2 5.2 6.1 91 94 A I E -N 203 0D 2 112,-1.1 112,-3.7 -2,-0.4 2,-0.6 -0.987 15.2-161.3-127.2 130.8 -14.4 7.8 4.5 92 95 A Y E +N 202 0D 0 -2,-0.4 483,-1.7 481,-0.4 2,-0.3 -0.954 26.0 148.9-109.6 117.6 -14.7 11.5 5.3 93 96 A V E -N 201 0D 5 108,-0.7 108,-0.6 -2,-0.6 5,-0.1 -0.887 25.9-156.4-134.5 175.9 -17.8 13.4 4.1 94 97 A N S S+ 0 0 10 -2,-0.3 -1,-0.1 106,-0.1 312,-0.1 0.828 75.2 7.2-121.4 -75.2 -19.7 16.4 5.6 95 98 A E S S+ 0 0 111 310,-0.1 2,-0.2 105,-0.1 105,-0.1 0.166 119.1 71.9-104.4 16.6 -23.4 17.4 5.0 96 99 A T S S- 0 0 70 311,-0.1 2,-0.5 310,-0.0 310,-0.1 -0.748 86.0-110.4-125.8 164.8 -23.9 14.1 3.1 97 100 A Y > - 0 0 5 -2,-0.2 3,-1.3 309,-0.2 11,-0.1 -0.910 21.0-140.5 -98.1 130.7 -24.2 10.4 3.9 98 101 A E T 3 S+ 0 0 13 -2,-0.5 6,-0.1 1,-0.3 -1,-0.1 0.817 103.8 54.2 -61.9 -29.6 -21.3 8.5 2.6 99 102 A F T 3 S+ 0 0 0 1,-0.2 2,-2.3 4,-0.1 -1,-0.3 0.663 84.5 85.2 -78.4 -15.7 -23.6 5.6 1.6 100 103 A D S < S+ 0 0 51 -3,-1.3 2,-0.3 7,-0.1 -1,-0.2 -0.449 78.1 104.7 -80.5 65.7 -25.8 8.0 -0.4 101 104 A D S > >S- 0 0 45 -2,-2.3 3,-1.6 5,-0.2 5,-1.3 -0.990 81.8-117.3-151.2 154.5 -23.5 7.5 -3.4 102 105 A K G > 5S+ 0 0 144 -2,-0.3 3,-1.1 1,-0.3 -1,-0.1 0.741 109.4 67.5 -66.8 -24.9 -23.2 5.6 -6.7 103 106 A X G 3 5S+ 0 0 63 1,-0.2 -1,-0.3 468,-0.2 -4,-0.1 0.784 107.3 40.8 -62.0 -26.3 -20.3 3.6 -5.5 104 107 A F G < 5S- 0 0 6 -3,-1.6 13,-0.3 2,-0.2 -1,-0.2 0.233 109.6-119.9-109.3 10.5 -22.7 1.9 -3.1 105 108 A N T < 5S+ 0 0 118 -3,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.893 75.3 115.4 50.9 47.8 -25.7 1.5 -5.5 106 109 A F < - 0 0 40 -5,-1.3 2,-0.4 -7,-0.1 -5,-0.2 -0.993 51.5-162.1-153.0 136.8 -27.8 3.7 -3.2 107 110 A K - 0 0 177 -2,-0.3 -6,-0.1 -7,-0.2 -7,-0.1 -0.914 51.3 -91.3-111.0 144.3 -29.6 7.0 -3.0 108 111 A K + 0 0 82 -2,-0.4 5,-0.1 -8,-0.1 -1,-0.0 -0.269 55.2 160.4 -61.6 141.1 -30.5 8.1 0.5 109 112 A N B > -O 112 0E 91 3,-0.7 3,-2.4 -3,-0.0 -1,-0.1 -0.417 39.2-110.3-165.4 68.2 -33.9 6.9 1.6 110 113 A P T 3 S+ 0 0 35 0, 0.0 3,-0.1 0, 0.0 -105,-0.0 -0.162 95.3 20.1 -56.1 146.9 -34.5 7.0 5.3 111 114 A P T 3 S+ 0 0 32 0, 0.0 2,-0.3 0, 0.0 84,-0.1 -0.954 111.5 85.3 -85.8 14.6 -34.7 4.9 7.3 112 115 A L B < -O 109 0E 66 -3,-2.4 -3,-0.7 80,-0.1 -107,-0.1 -0.563 50.2-172.8 -86.8 136.6 -33.0 2.5 4.8 113 116 A V - 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