==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 25-JAN-94 151L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR X.-J.ZHANG,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8717.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 6.8 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 . 2 1.2 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 . 9 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 45.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.1 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 0 1 2 1 1 0 0 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 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 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 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 M 0 0 73 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 148.2 -19.6 15.2 -8.4 2 2 A N > - 0 0 65 1,-0.1 4,-2.8 156,-0.1 5,-0.3 -0.970 360.0 -89.1-159.7 171.1 -17.1 12.7 -7.4 3 3 A I H > S+ 0 0 19 -2,-0.3 4,-2.0 2,-0.2 5,-0.2 0.910 126.8 51.3 -56.7 -36.4 -14.1 12.4 -5.2 4 4 A F H >> S+ 0 0 3 1,-0.2 4,-2.0 2,-0.2 3,-1.1 0.990 116.2 38.8 -60.0 -62.1 -11.9 13.6 -8.0 5 5 A E H 3> S+ 0 0 66 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.715 111.9 59.3 -55.9 -27.5 -14.1 16.6 -8.6 6 6 A M H 3X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.3 0.908 111.1 41.4 -71.2 -30.0 -14.6 17.0 -5.0 7 7 A L H S+ 0 0 0 -4,-2.0 4,-3.2 -3,-1.1 5,-2.3 0.833 105.8 60.7 -83.7 -36.4 -10.8 17.3 -4.7 8 8 A R H <5S+ 0 0 135 -4,-2.0 5,-0.2 2,-0.2 -1,-0.2 0.923 114.5 40.1 -53.8 -47.3 -10.3 19.6 -7.7 9 9 A I H <5S+ 0 0 51 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.975 120.3 46.3 -64.0 -56.0 -12.6 21.9 -5.8 10 10 A D H <5S- 0 0 22 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.950 138.6 -7.0 -56.8 -68.1 -10.9 21.1 -2.5 11 11 A E T <5S- 0 0 81 -4,-3.2 -3,-0.2 1,-0.1 -1,-0.2 0.594 98.6-141.2-105.8 -22.5 -7.2 21.3 -3.1 12 12 A G < - 0 0 18 -5,-2.3 2,-0.3 -7,-0.1 18,-0.1 0.093 16.8 -62.8 83.8 172.4 -7.1 21.7 -6.8 13 13 A L - 0 0 47 -5,-0.2 2,-0.4 16,-0.1 16,-0.2 -0.748 28.8-173.7-105.4 141.3 -5.1 20.5 -9.8 14 14 A R E -A 28 0A 116 14,-1.1 14,-3.0 -2,-0.3 4,-0.1 -0.995 0.6-177.0-134.1 118.1 -1.6 20.9 -10.9 15 15 A L E + 0 0 55 -2,-0.4 43,-1.3 12,-0.2 2,-0.4 0.415 66.0 55.4-103.6 3.4 -0.6 19.7 -14.2 16 16 A K E S-C 57 0B 120 41,-0.2 2,-0.3 12,-0.1 41,-0.2 -0.939 104.0 -81.6-131.4 147.6 3.1 20.4 -14.3 17 17 A I E - 0 0 23 39,-2.1 2,-0.5 -2,-0.4 10,-0.2 -0.315 49.6-176.0 -55.4 119.7 5.5 19.1 -11.7 18 18 A Y E -A 26 0A 47 8,-2.5 8,-1.0 -2,-0.3 2,-0.3 -0.946 22.4-136.6-116.9 128.3 5.5 21.4 -8.6 19 19 A K E -A 25 0A 120 -2,-0.5 6,-0.3 6,-0.2 5,-0.2 -0.624 38.6-139.9 -76.2 135.1 7.8 20.8 -5.8 20 20 A D > - 0 0 43 4,-5.1 3,-0.6 -2,-0.3 -1,-0.1 0.266 24.9 -71.1 -82.8-155.1 5.8 21.2 -2.7 21 21 A T T 3 S+ 0 0 120 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 0.515 130.8 30.4 -69.7 -23.4 5.7 22.5 0.8 22 22 A E T 3 S- 0 0 152 2,-0.2 -1,-0.2 3,-0.0 3,-0.1 0.043 124.3 -88.5-137.7 27.7 8.1 19.9 2.0 23 23 A G S < S+ 0 0 32 -3,-0.6 -2,-0.1 1,-0.3 0, 0.0 0.030 83.1 131.4 92.8 -22.2 10.3 19.2 -1.0 24 24 A Y - 0 0 117 -5,-0.2 -4,-5.1 1,-0.1 -1,-0.3 -0.254 56.3-126.2 -63.3 152.0 8.3 16.6 -2.6 25 25 A Y E -AB 19 33A 34 8,-0.5 8,-1.4 11,-0.3 2,-0.3 -0.614 33.6-177.3 -90.0 154.5 7.4 16.7 -6.0 26 26 A T E -AB 18 32A 6 -8,-1.0 -8,-2.5 -2,-0.3 2,-0.3 -0.991 12.8-174.4-154.0 151.5 3.9 16.5 -6.8 27 27 A I E > - B 0 31A 0 4,-1.3 4,-1.9 -2,-0.3 -12,-0.2 -0.984 59.1 -4.4-147.7 154.0 1.6 16.3 -9.8 28 28 A G E 4 S-A 14 0A 0 -14,-3.0 -14,-1.1 -2,-0.3 2,-0.7 -0.521 128.5 -14.1 65.0-130.1 -2.2 16.3 -10.5 29 29 A I T 4 S- 0 0 2 34,-0.3 -1,-0.2 -2,-0.2 3,-0.2 -0.758 127.1 -45.3-102.9 85.1 -3.9 16.2 -7.0 30 30 A G T 4 S+ 0 0 31 -2,-0.7 2,-1.0 1,-0.2 -2,-0.2 0.747 82.4 159.3 70.5 16.5 -1.3 15.3 -4.5 31 31 A H E < -B 27 0A 22 -4,-1.9 -4,-1.3 2,-0.0 -1,-0.2 -0.589 32.9-144.0 -77.0 108.5 0.2 12.5 -6.4 32 32 A L E -B 26 0A 69 -2,-1.0 2,-0.8 -6,-0.2 -6,-0.2 -0.470 11.2-146.4 -73.1 147.3 3.6 12.2 -4.9 33 33 A L E > +B 25 0A 3 -8,-1.4 3,-0.9 1,-0.1 -8,-0.5 -0.864 24.0 179.7-107.7 89.1 6.6 11.4 -7.0 34 34 A A T 3 + 0 0 87 -2,-0.8 -1,-0.1 1,-0.2 8,-0.0 0.650 69.9 54.8 -68.8 -19.8 8.4 9.3 -4.3 35 35 A A T 3 S+ 0 0 78 6,-0.1 2,-0.6 -3,-0.1 -1,-0.2 0.440 86.2 92.2 -92.8 -8.1 11.5 8.4 -6.3 36 36 A A < + 0 0 14 -3,-0.9 -11,-0.3 1,-0.1 -3,-0.1 -0.782 29.3 162.7 -99.3 118.9 12.7 11.9 -7.3 37 37 A A S S+ 0 0 110 -2,-0.6 -1,-0.1 -13,-0.1 -3,-0.0 0.296 85.8 32.3-107.0 12.4 15.2 13.9 -5.2 38 38 A S S S- 0 0 51 -3,-0.0 -2,-0.1 -13,-0.0 -3,-0.0 0.262 87.9-118.4-123.6-120.5 15.6 16.0 -8.4 39 39 A L S > S+ 0 0 76 -14,-0.0 4,-2.0 -20,-0.0 5,-0.1 0.016 115.6 56.0-175.1 -33.6 13.3 16.9 -11.1 40 40 A N H >> S+ 0 0 113 2,-0.2 4,-2.4 1,-0.2 3,-0.5 0.932 110.7 50.0 -70.3 -41.4 15.0 15.4 -13.8 41 41 A A H 3> S+ 0 0 33 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.894 109.6 53.5 -52.0 -43.2 14.5 12.5 -11.4 42 42 A A H 3> S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.763 104.9 51.0 -65.0 -36.0 10.9 13.7 -11.3 43 43 A K H S+ 0 0 72 -4,-2.4 4,-1.5 2,-0.3 5,-0.5 0.952 109.7 52.7 -59.1 -51.6 11.5 10.2 -15.4 45 45 A E H X5S+ 0 0 37 -4,-2.4 4,-3.8 -5,-0.2 -1,-0.2 0.986 119.5 39.8 -42.4 -61.0 9.5 9.0 -12.5 46 46 A L H X>S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.6 0.901 115.6 43.4 -58.1 -59.7 6.7 10.6 -14.3 47 47 A D H >X5S+ 0 0 33 -4,-5.3 4,-5.2 1,-0.2 3,-0.5 0.994 118.1 48.8 -51.4 -61.4 7.2 9.8 -17.9 48 48 A K H 3<5S+ 0 0 158 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.886 110.1 53.3 -36.0 -59.1 8.0 6.3 -16.9 49 49 A A H 3< - 0 0 14 1,-0.2 3,-0.7 -7,-0.1 -1,-0.2 0.001 38.6-151.1 37.2 -54.6 5.1 14.1 -20.9 55 55 A N T 3 - 0 0 107 -2,-3.9 -1,-0.2 -3,-0.3 -12,-0.1 0.690 68.5 -44.3 62.7 29.9 7.9 16.3 -20.1 56 56 A G T 3 S+ 0 0 5 -13,-0.2 -39,-2.1 -14,-0.1 2,-0.3 0.536 125.8 83.6 96.3 11.2 6.7 17.4 -16.7 57 57 A V B < -C 16 0B 57 -3,-0.7 2,-0.2 -41,-0.2 -41,-0.2 -0.939 54.8-169.2-149.4 121.4 3.1 18.0 -17.7 58 58 A I - 0 0 4 -43,-1.3 -30,-0.1 -2,-0.3 -11,-0.0 -0.660 25.9-110.1-108.7 162.1 0.3 15.4 -18.0 59 59 A T - 0 0 69 -2,-0.2 4,-0.3 1,-0.1 -1,-0.2 0.440 39.3 -94.5 -64.6-141.5 -3.1 15.9 -19.5 60 60 A K S > S+ 0 0 90 2,-0.1 4,-1.7 3,-0.1 5,-0.1 0.750 122.2 47.2-105.4 -45.6 -6.3 15.9 -17.5 61 61 A D H > S+ 0 0 115 2,-0.2 4,-1.9 1,-0.2 -3,-0.0 0.724 109.9 58.5 -69.2 -27.1 -7.4 12.2 -17.7 62 62 A E H > S+ 0 0 32 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.916 102.5 50.0 -68.2 -51.3 -3.8 11.4 -16.8 63 63 A A H > S+ 0 0 1 -4,-0.3 4,-1.7 1,-0.2 -34,-0.3 0.868 113.5 47.4 -54.6 -44.1 -4.1 13.4 -13.6 64 64 A E H X S+ 0 0 53 -4,-1.7 4,-2.0 2,-0.2 5,-0.3 0.891 106.4 59.9 -66.6 -36.7 -7.4 11.4 -12.9 65 65 A K H X S+ 0 0 123 -4,-1.9 4,-1.1 1,-0.2 3,-0.2 0.971 111.0 38.8 -48.4 -60.7 -5.5 8.2 -13.8 66 66 A L H X S+ 0 0 11 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.755 113.7 54.6 -56.8 -41.3 -3.0 8.8 -11.0 67 67 A F H X S+ 0 0 2 -4,-1.7 4,-3.2 2,-0.2 -1,-0.2 0.832 102.9 56.0 -63.3 -44.9 -5.5 10.1 -8.5 68 68 A N H X S+ 0 0 87 -4,-2.0 4,-2.4 2,-0.3 -1,-0.2 0.856 108.9 47.4 -56.5 -45.2 -7.7 7.0 -8.8 69 69 A Q H X S+ 0 0 92 -4,-1.1 4,-2.1 -5,-0.3 -1,-0.2 0.808 110.1 53.5 -70.6 -30.7 -4.8 4.9 -7.9 70 70 A D H X S+ 0 0 40 -4,-1.2 4,-2.1 2,-0.2 -2,-0.3 0.949 108.9 49.2 -69.9 -39.7 -4.1 7.2 -5.1 71 71 A V H X S+ 0 0 18 -4,-3.2 4,-2.6 2,-0.2 -2,-0.2 0.927 110.2 49.8 -62.2 -48.8 -7.6 6.8 -3.9 72 72 A D H X S+ 0 0 97 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.951 110.4 50.0 -56.2 -49.5 -7.5 3.0 -4.1 73 73 A A H X S+ 0 0 37 -4,-2.1 4,-2.0 1,-0.3 -1,-0.2 0.851 111.1 50.2 -55.8 -39.9 -4.2 2.9 -2.1 74 74 A A H X S+ 0 0 17 -4,-2.1 4,-1.9 2,-0.2 -1,-0.3 0.862 107.4 53.6 -65.9 -40.1 -5.7 5.1 0.5 75 75 A V H X S+ 0 0 31 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.925 108.3 51.7 -62.3 -41.4 -8.7 2.8 0.7 76 76 A R H X S+ 0 0 136 -4,-2.7 4,-1.0 1,-0.2 -1,-0.2 0.890 106.5 51.5 -60.7 -47.1 -6.3 0.0 1.3 77 77 A G H < S+ 0 0 12 -4,-2.0 3,-0.4 1,-0.2 4,-0.3 0.899 109.4 50.5 -60.0 -37.5 -4.6 1.8 4.1 78 78 A I H >< S+ 0 0 0 -4,-1.9 3,-1.0 1,-0.2 7,-0.5 0.887 105.8 56.5 -61.1 -44.5 -7.9 2.6 5.9 79 79 A L H 3< S+ 0 0 66 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.694 107.3 46.8 -62.8 -27.7 -9.1 -1.1 5.7 80 80 A R T 3< S+ 0 0 196 -4,-1.0 2,-0.5 -3,-0.4 -1,-0.3 0.450 96.4 98.5 -91.9 -8.4 -6.0 -2.4 7.5 81 81 A N <> - 0 0 34 -3,-1.0 4,-3.6 -4,-0.3 -3,-0.0 -0.773 62.1-158.2 -88.0 122.3 -6.5 0.3 10.1 82 82 A A T 4 S+ 0 0 86 -2,-0.5 -1,-0.1 2,-0.2 -4,-0.0 0.862 92.9 46.2 -68.1 -40.8 -8.3 -0.7 13.2 83 83 A K T 4 S+ 0 0 86 1,-0.1 4,-0.3 2,-0.1 -1,-0.2 0.802 125.1 34.8 -72.3 -27.7 -9.5 2.7 14.3 84 84 A L T > S+ 0 0 0 -6,-0.3 4,-2.4 2,-0.1 -2,-0.2 0.777 99.0 68.4 -95.9 -39.8 -10.7 3.3 10.8 85 85 A K H X S+ 0 0 89 -4,-3.6 4,-2.8 -7,-0.5 5,-0.2 0.884 101.3 50.6 -51.2 -46.9 -12.0 0.1 9.0 86 86 A P H > S+ 0 0 53 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.900 114.1 43.8 -56.8 -49.9 -15.1 -0.3 11.2 87 87 A V H >> S+ 0 0 2 -4,-0.3 3,-1.1 2,-0.2 4,-0.8 0.995 114.4 49.1 -58.5 -64.7 -16.2 3.3 10.7 88 88 A Y H >< S+ 0 0 25 -4,-2.4 3,-1.5 1,-0.3 -1,-0.2 0.858 109.1 51.8 -40.6 -52.6 -15.5 3.3 7.0 89 89 A D H 3< S+ 0 0 77 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.846 108.8 53.7 -54.7 -38.3 -17.4 0.0 6.4 90 90 A S H << S+ 0 0 37 -4,-1.4 -1,-0.3 -3,-1.1 -2,-0.2 0.540 96.4 92.9 -73.1 -14.5 -20.3 1.7 8.3 91 91 A L S << S- 0 0 6 -3,-1.5 2,-0.1 -4,-0.8 31,-0.0 -0.465 74.4-119.3 -87.8 155.8 -20.2 4.7 5.9 92 92 A D > - 0 0 53 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.224 37.7 -97.2 -79.7 174.5 -22.1 5.4 2.9 93 93 A A T 4 S+ 0 0 76 2,-0.2 4,-0.3 1,-0.2 -1,-0.1 0.579 123.6 45.8 -71.3 -13.1 -20.6 5.9 -0.5 94 94 A V T > S+ 0 0 28 2,-0.1 4,-1.3 3,-0.1 -1,-0.2 0.760 113.6 45.8 -96.3 -42.1 -20.8 9.7 -0.1 95 95 A R H > S+ 0 0 26 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.854 107.3 58.0 -71.5 -35.0 -19.5 10.0 3.5 96 96 A R H X S+ 0 0 80 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.927 103.5 55.2 -58.9 -43.3 -16.7 7.6 2.7 97 97 A C H > S+ 0 0 24 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.879 107.8 48.5 -55.3 -39.2 -15.7 10.1 0.0 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.853 109.1 52.8 -67.9 -40.1 -15.6 12.8 2.7 99 99 A L H X S+ 0 0 1 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.819 109.7 48.9 -66.5 -36.1 -13.5 10.6 5.0 100 100 A I H >X S+ 0 0 4 -4,-2.5 4,-3.0 2,-0.2 3,-0.9 0.929 104.6 58.1 -68.4 -47.6 -11.0 10.1 2.2 101 101 A N H 3X S+ 0 0 0 -4,-2.2 4,-1.0 1,-0.3 -2,-0.2 0.950 105.2 52.4 -49.8 -43.0 -10.9 13.8 1.6 102 102 A M H 3X>S+ 0 0 6 -4,-1.8 4,-2.1 1,-0.2 5,-0.6 0.890 107.8 51.0 -63.7 -30.6 -9.9 14.1 5.1 103 103 A V H X< - 0 0 23 -4,-2.0 3,-1.7 -5,-0.6 4,-1.4 0.268 37.7 -62.0 75.3 157.2 -3.5 11.5 6.3 108 108 A E H 3> S+ 0 0 62 1,-0.3 4,-3.7 2,-0.2 5,-0.2 0.760 133.4 54.7 -35.3 -54.4 -4.5 8.4 8.4 109 109 A T H 3> S+ 0 0 135 2,-0.2 4,-1.3 3,-0.2 -1,-0.3 0.865 114.9 44.1 -50.5 -40.4 -2.4 9.3 11.4 110 110 A G H XX S+ 0 0 22 -3,-1.7 3,-2.5 -4,-0.5 4,-0.7 0.981 114.9 42.3 -67.3 -82.3 -4.3 12.5 11.3 111 111 A V H >< S+ 0 0 1 -4,-1.4 3,-1.4 1,-0.3 -2,-0.2 0.766 110.9 59.2 -30.7 -52.1 -7.7 11.4 10.7 112 112 A A H 3< S+ 0 0 13 -4,-3.7 -1,-0.3 1,-0.2 -2,-0.2 0.870 92.8 65.5 -53.1 -42.0 -7.3 8.7 13.2 113 113 A G H << S+ 0 0 57 -3,-2.5 2,-3.3 -4,-1.3 -1,-0.2 0.769 78.1 86.5 -52.5 -29.3 -6.5 11.1 16.1 114 114 A F S+ 0 0 77 -3,-0.2 4,-2.0 2,-0.2 5,-0.2 0.904 103.1 47.2-103.1 -50.4 -14.3 11.2 18.8 117 117 A S H > S+ 0 0 2 -3,-0.4 4,-3.8 1,-0.2 5,-0.2 0.878 111.1 59.9 -61.5 -27.6 -16.2 12.4 15.8 118 118 A L H X S+ 0 0 9 -4,-1.5 4,-4.0 2,-0.2 5,-0.3 0.912 101.1 52.0 -63.2 -42.1 -15.4 9.1 14.3 119 119 A R H > S+ 0 0 179 -4,-0.4 4,-2.8 -5,-0.3 -1,-0.2 0.955 114.4 43.2 -57.9 -47.4 -17.2 7.3 17.1 120 120 A M H <>S+ 0 0 27 -4,-2.0 5,-1.2 1,-0.2 -2,-0.2 0.922 114.1 51.8 -64.6 -40.2 -20.2 9.5 16.4 121 121 A L H ><5S+ 0 0 8 -4,-3.8 3,-1.9 -5,-0.2 -1,-0.2 0.938 109.0 48.1 -60.0 -48.6 -19.7 8.9 12.8 122 122 A Q H 3<5S+ 0 0 87 -4,-4.0 -1,-0.2 1,-0.3 -2,-0.2 0.939 111.7 53.9 -58.0 -40.9 -19.5 5.2 13.2 123 123 A Q T 3<5S- 0 0 93 -4,-2.8 -1,-0.3 -5,-0.3 -2,-0.2 0.169 112.7-117.0 -81.8 20.1 -22.7 5.6 15.3 124 124 A K T < 5 + 0 0 109 -3,-1.9 2,-3.0 1,-0.2 -3,-0.2 0.309 63.5 146.4 67.3 -9.6 -24.7 7.5 12.7 125 125 A R >< - 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