==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-MAY-13 4KY7 . COMPND 2 MOLECULE: THERMONUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR A.C.ROBINSON,J.L.SCHLESSMAN,B.GARCIA-MORENO E. . 132 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7776.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 84 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 22.0 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 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 . 7 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 20.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.5 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 0 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 2 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 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 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 0 157 0, 0.0 2,-0.4 0, 0.0 67,-0.1 0.000 360.0 360.0 360.0 124.0 15.0 -6.1 -33.5 2 6 A K - 0 0 159 65,-0.1 2,-0.3 66,-0.0 0, 0.0 -0.873 360.0-125.2-115.2 147.9 16.1 -5.0 -30.1 3 7 A L - 0 0 27 -2,-0.4 2,-0.4 62,-0.1 64,-0.1 -0.641 24.9-168.2 -82.0 146.6 14.2 -4.8 -26.8 4 8 A H - 0 0 152 62,-0.3 62,-0.4 -2,-0.3 2,-0.2 -0.983 16.6-135.5-138.0 124.8 14.0 -1.5 -24.9 5 9 A K - 0 0 89 -2,-0.4 60,-0.2 60,-0.2 77,-0.1 -0.587 24.8-164.2 -66.6 146.9 12.8 -1.0 -21.4 6 10 A E E -A 64 0A 63 58,-2.7 58,-1.9 -2,-0.2 -2,-0.0 -0.892 31.2 -83.8-131.3 157.0 10.5 2.1 -20.9 7 11 A P E -A 63 0A 117 0, 0.0 2,-0.3 0, 0.0 56,-0.2 -0.322 49.0-167.4 -61.5 141.7 9.4 4.0 -17.8 8 12 A A E -A 62 0A 21 54,-2.2 54,-0.6 15,-0.1 2,-0.5 -0.872 16.5-141.0-130.3 160.8 6.5 2.4 -16.0 9 13 A T - 0 0 85 13,-0.4 13,-2.7 -2,-0.3 2,-0.3 -0.981 18.2-141.5-124.5 118.2 4.1 3.5 -13.2 10 14 A L E +D 21 0B 47 -2,-0.5 11,-0.2 11,-0.2 3,-0.1 -0.617 24.3 172.6 -81.0 134.0 3.0 1.1 -10.6 11 15 A I E S- 0 0 76 9,-3.0 2,-0.3 1,-0.3 10,-0.2 0.784 70.5 -40.7 -93.0 -55.3 -0.6 1.1 -9.2 12 16 A K E -D 20 0B 124 8,-1.5 8,-3.2 0, 0.0 -1,-0.3 -0.981 50.9-106.3-166.6 151.8 -0.1 -2.1 -7.2 13 17 A A E -D 19 0B 11 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.675 30.1-172.4 -76.2 145.1 1.4 -5.6 -7.1 14 18 A I - 0 0 74 4,-2.1 2,-0.2 1,-0.4 5,-0.2 0.849 54.9 -40.1-107.6 -56.1 -1.3 -8.2 -7.5 15 19 A D S S- 0 0 22 3,-1.9 -1,-0.4 33,-0.1 3,-0.4 -0.714 84.6 -53.9-152.4-159.5 0.3 -11.6 -6.9 16 20 A G S S+ 0 0 0 22,-0.4 77,-0.1 -2,-0.2 23,-0.1 0.825 132.2 16.9 -57.9 -33.3 3.6 -13.4 -7.7 17 21 A D S S+ 0 0 8 20,-0.1 15,-2.8 21,-0.1 2,-0.4 0.258 113.8 71.0-132.5 18.0 3.4 -12.8 -11.5 18 22 A T E + E 0 31B 12 -3,-0.4 -4,-2.1 13,-0.2 -3,-1.9 -0.995 49.1 175.1-135.1 145.5 0.9 -10.1 -12.1 19 23 A V E -DE 13 30B 1 11,-2.3 11,-3.3 -2,-0.4 2,-0.6 -0.941 28.8-124.3-137.8 155.2 1.1 -6.3 -11.4 20 24 A K E -DE 12 29B 61 -8,-3.2 -9,-3.0 -2,-0.3 -8,-1.5 -0.923 32.7-175.5-103.7 122.3 -1.2 -3.4 -12.1 21 25 A L E -DE 10 28B 1 7,-2.7 7,-2.4 -2,-0.6 2,-1.0 -0.778 34.0-125.6-109.0 157.8 0.4 -0.6 -14.0 22 26 A M E - E 0 27B 80 -13,-2.7 2,-0.6 -2,-0.3 -13,-0.4 -0.910 41.0-170.9 -95.0 101.3 -0.8 2.8 -15.1 23 27 A Y E > - E 0 26B 45 3,-3.0 3,-1.5 -2,-1.0 -15,-0.1 -0.891 65.3 -23.4-106.1 114.6 0.0 2.2 -18.8 24 28 A K T 3 S- 0 0 176 -2,-0.6 -1,-0.2 1,-0.3 -16,-0.0 0.917 129.4 -50.0 48.0 41.9 -0.3 5.3 -21.0 25 29 A G T 3 S+ 0 0 53 -3,-0.3 -1,-0.3 1,-0.2 -3,-0.1 0.575 121.1 103.7 76.9 16.5 -2.7 6.7 -18.4 26 30 A Q E < S-E 23 0B 120 -3,-1.5 -3,-3.0 2,-0.0 -1,-0.2 -0.986 74.7-117.8-126.9 139.0 -4.9 3.6 -18.2 27 31 A P E +E 22 0B 81 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.439 45.8 169.2 -68.6 135.0 -4.9 1.0 -15.4 28 32 A M E -E 21 0B 55 -7,-2.4 -7,-2.7 -2,-0.1 2,-0.3 -0.952 34.3-123.5-151.5 135.0 -3.9 -2.3 -16.9 29 33 A T E -E 20 0B 31 -2,-0.3 49,-2.5 -9,-0.2 2,-0.4 -0.597 25.8-158.0 -76.3 134.2 -2.9 -5.7 -15.5 30 34 A F E -Ef 19 78B 1 -11,-3.3 -11,-2.3 -2,-0.3 2,-0.5 -0.961 4.0-154.6-113.4 133.8 0.5 -7.0 -16.6 31 35 A R E -Ef 18 79B 19 47,-3.4 49,-1.6 -2,-0.4 2,-0.3 -0.922 27.6-116.1-102.8 132.3 1.5 -10.7 -16.6 32 36 A L E > - f 0 80B 3 -15,-2.8 3,-0.9 -2,-0.5 49,-0.2 -0.461 33.0-118.0 -73.1 131.7 5.2 -11.4 -16.3 33 37 A L T 3 S+ 0 0 10 47,-2.3 49,-0.1 -2,-0.3 -1,-0.1 -0.327 84.0 6.0 -67.4 146.0 6.6 -13.1 -19.3 34 38 A L T 3 S+ 0 0 3 69,-0.5 68,-1.7 1,-0.1 2,-0.3 0.510 108.5 91.6 70.0 11.5 8.3 -16.6 -19.2 35 39 A V E < -H 101 0C 0 -3,-0.9 2,-0.3 66,-0.3 66,-0.2 -0.904 51.5-161.0-134.2 162.3 7.4 -17.4 -15.5 36 40 A D E -H 100 0C 56 64,-1.9 64,-2.5 -2,-0.3 -3,-0.0 -0.900 8.9-169.3-143.9 115.6 4.7 -19.0 -13.4 37 41 A T - 0 0 5 -2,-0.3 62,-0.2 62,-0.2 -20,-0.1 -0.684 36.5 -97.3 -91.6 153.9 4.4 -18.2 -9.6 38 42 A P - 0 0 13 0, 0.0 -22,-0.4 0, 0.0 -21,-0.1 -0.303 44.0 -98.1 -61.8 156.4 2.0 -20.4 -7.5 39 43 A E > - 0 0 115 1,-0.1 3,-2.6 -24,-0.1 6,-0.3 -0.414 41.2-103.5 -69.0 151.1 -1.5 -19.1 -6.8 40 50 A F T 3 S+ 0 0 111 1,-0.3 5,-0.1 5,-0.2 7,-0.1 0.811 122.2 51.6 -44.2 -40.2 -1.7 -17.4 -3.4 41 51 A N T 3 S+ 0 0 159 4,-0.1 -1,-0.3 2,-0.1 2,-0.3 0.178 99.3 82.6 -89.1 12.8 -3.5 -20.4 -1.9 42 52 A E S X S- 0 0 110 -3,-2.6 3,-2.6 1,-0.1 0, 0.0 -0.796 100.0 -75.2-109.3 164.0 -0.8 -22.9 -3.2 43 53 A K T 3 S+ 0 0 158 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.1 -0.339 121.8 11.6 -62.4 134.8 2.5 -23.6 -1.5 44 54 A Y T 3> S+ 0 0 35 -4,-0.1 4,-2.7 -7,-0.1 -1,-0.3 0.264 97.4 113.0 77.6 -3.5 5.0 -20.7 -2.0 45 55 A G H <> S+ 0 0 0 -3,-2.6 4,-2.5 -6,-0.3 -5,-0.2 0.924 77.6 44.1 -61.4 -49.8 2.1 -18.5 -3.3 46 56 A P H > S+ 0 0 49 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.897 115.2 50.2 -63.5 -41.5 2.2 -16.1 -0.4 47 57 A E H > S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.915 111.9 46.2 -62.5 -45.2 6.0 -16.0 -0.5 48 58 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.915 112.9 51.5 -64.7 -40.3 6.1 -15.3 -4.3 49 59 A S H X S+ 0 0 15 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.928 112.6 44.8 -59.3 -43.8 3.4 -12.6 -3.9 50 60 A A H X S+ 0 0 59 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.849 111.2 53.1 -75.6 -31.3 5.3 -10.9 -1.1 51 61 A F H X S+ 0 0 66 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.954 113.5 42.4 -67.7 -48.6 8.6 -11.1 -2.9 52 62 A T H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.926 114.6 52.7 -61.9 -42.1 7.1 -9.4 -6.1 53 63 A K H X S+ 0 0 96 -4,-2.5 4,-2.6 -5,-0.2 5,-0.4 0.934 111.9 43.6 -59.8 -50.0 5.2 -6.9 -3.9 54 64 A K H X S+ 0 0 136 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.907 113.4 52.9 -63.1 -38.1 8.3 -5.8 -2.0 55 65 A M H < S+ 0 0 36 -4,-2.2 4,-0.4 -5,-0.2 -2,-0.2 0.930 117.9 33.6 -67.7 -42.5 10.4 -5.6 -5.1 56 66 A V H < S+ 0 0 4 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.853 120.8 47.5 -81.0 -34.3 8.1 -3.4 -7.1 57 67 A E H < S+ 0 0 85 -4,-2.6 -2,-0.2 -5,-0.3 -3,-0.2 0.833 114.2 44.5 -73.3 -33.5 6.7 -1.3 -4.3 58 68 A N S < S+ 0 0 99 -4,-1.9 -1,-0.2 -5,-0.4 -2,-0.2 0.514 90.1 108.2 -92.2 -4.1 9.9 -0.5 -2.6 59 69 A A S S- 0 0 21 -4,-0.4 3,-0.1 -3,-0.2 -3,-0.0 -0.452 71.0-133.9 -71.1 150.2 11.8 0.3 -5.9 60 70 A K S S+ 0 0 190 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.899 90.9 0.3 -65.5 -38.6 12.7 3.9 -6.7 61 71 A K - 0 0 117 -52,-0.0 24,-3.0 -3,-0.0 2,-0.3 -0.998 62.3-147.1-152.6 159.6 11.4 3.1 -10.2 62 72 A I E -AB 8 84A 10 -54,-0.6 -54,-2.2 -2,-0.3 2,-0.3 -0.846 13.6-170.5-119.7 149.2 9.9 0.4 -12.3 63 73 A E E -AB 7 83A 31 20,-2.1 20,-2.7 -2,-0.3 2,-0.4 -0.947 9.8-147.5-136.4 151.9 10.3 -0.2 -16.1 64 74 A D E -AB 6 82A 1 -58,-1.9 -58,-2.7 -2,-0.3 2,-0.4 -0.916 7.6-165.8-118.8 151.5 8.5 -2.5 -18.4 65 75 A E E - B 0 81A 11 16,-2.1 16,-2.8 -2,-0.4 -60,-0.2 -0.936 8.0-152.2-137.3 111.5 10.0 -4.3 -21.5 66 76 A F - 0 0 20 -62,-0.4 -62,-0.3 -2,-0.4 14,-0.2 -0.455 17.0-132.6 -75.7 157.2 7.9 -5.9 -24.2 67 77 A D - 0 0 1 12,-0.4 41,-0.1 3,-0.3 -1,-0.1 -0.140 36.5 -86.1 -91.7-163.4 9.4 -8.8 -26.1 68 78 A K S S+ 0 0 94 39,-0.3 40,-0.2 -2,-0.1 3,-0.1 0.575 104.7 40.4 -82.0 -21.1 9.3 -9.1 -29.9 69 79 A G S S+ 0 0 30 1,-0.3 39,-0.1 38,-0.1 -2,-0.0 0.171 105.5 4.2-103.2-132.5 5.8 -10.8 -30.2 70 80 A Q - 0 0 103 1,-0.1 -1,-0.3 -4,-0.1 -3,-0.3 -0.181 47.7-169.8 -65.7 137.8 2.4 -10.5 -28.6 71 81 A R S S+ 0 0 126 1,-0.2 8,-1.9 -3,-0.1 2,-0.4 0.503 71.8 39.1-102.1 -14.4 2.1 -7.7 -26.1 72 82 A T B S-G 78 0B 77 6,-0.3 6,-0.2 -42,-0.1 -1,-0.2 -0.995 77.8-135.0-137.5 142.2 -1.3 -8.6 -24.7 73 83 A D > - 0 0 23 4,-2.5 3,-2.4 -2,-0.4 -2,-0.1 -0.300 38.2 -86.8 -86.6-177.3 -2.6 -12.0 -23.9 74 84 A K T 3 S+ 0 0 171 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.569 128.3 52.2 -67.3 -8.9 -6.0 -13.6 -24.5 75 85 A Y T 3 S- 0 0 172 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.200 121.5-105.0-109.1 13.4 -7.3 -12.1 -21.3 76 86 A G S < S+ 0 0 49 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.505 73.9 139.5 81.4 1.4 -6.2 -8.6 -22.1 77 87 A R - 0 0 70 -49,-0.1 -4,-2.5 1,-0.1 -1,-0.3 -0.591 56.2-114.8 -79.7 145.1 -3.2 -8.5 -19.8 78 88 A G E -fG 30 72B 1 -49,-2.5 -47,-3.4 -2,-0.3 2,-0.5 -0.434 24.5-142.9 -71.6 150.6 -0.0 -6.9 -21.0 79 89 A L E +f 31 0B 18 -8,-1.9 -12,-0.4 -49,-0.2 2,-0.3 -0.981 40.7 130.5-122.3 115.6 2.9 -9.3 -21.3 80 90 A A E -f 32 0B 1 -49,-1.6 -47,-2.3 -2,-0.5 2,-0.4 -0.982 59.1-104.8-153.4 165.0 6.3 -7.9 -20.3 81 91 A Y E -B 65 0A 0 -16,-2.8 -16,-2.1 -2,-0.3 2,-0.4 -0.841 40.9-150.6 -91.0 136.9 9.5 -8.2 -18.4 82 92 A I E -B 64 0A 2 -2,-0.4 7,-3.0 -18,-0.2 8,-0.6 -0.937 9.0-163.4-114.5 132.0 9.3 -5.9 -15.3 83 93 A Y E -BC 63 88A 16 -20,-2.7 -20,-2.1 -2,-0.4 2,-0.6 -0.950 7.9-159.7-117.6 141.3 12.4 -4.3 -13.8 84 94 A A E > S-BC 62 87A 6 3,-2.6 3,-2.1 -2,-0.4 -22,-0.2 -0.974 85.0 -22.0-120.8 113.0 12.7 -2.7 -10.4 85 95 A D T 3 S- 0 0 53 -24,-3.0 -1,-0.2 -2,-0.6 -23,-0.1 0.901 130.5 -50.8 48.5 43.7 15.7 -0.3 -10.1 86 96 A G T 3 S+ 0 0 44 -25,-0.2 2,-0.5 1,-0.2 -1,-0.3 0.290 113.8 115.3 84.7 -7.5 17.2 -2.2 -13.1 87 97 A K E < -C 84 0A 143 -3,-2.1 -3,-2.6 1,-0.0 2,-0.4 -0.843 69.6-120.4 -98.2 128.6 16.8 -5.8 -11.7 88 98 A M E > -C 83 0A 9 -2,-0.5 4,-2.3 -5,-0.2 -5,-0.3 -0.491 14.7-158.4 -70.7 119.6 14.4 -8.0 -13.6 89 99 A V H > S+ 0 0 1 -7,-3.0 4,-2.6 -2,-0.4 5,-0.3 0.905 92.7 56.9 -63.3 -42.6 11.6 -9.2 -11.4 90 100 A N H > S+ 0 0 0 -8,-0.6 4,-1.5 1,-0.2 -1,-0.2 0.922 111.6 42.5 -57.9 -43.5 10.9 -12.2 -13.7 91 101 A E H > S+ 0 0 68 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.898 111.7 54.2 -68.8 -40.5 14.6 -13.4 -13.3 92 102 A A H X S+ 0 0 22 -4,-2.3 4,-1.8 1,-0.2 6,-0.2 0.914 107.0 50.7 -66.7 -37.7 14.7 -12.7 -9.5 93 103 A L H <>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 6,-0.9 0.927 113.7 45.5 -60.3 -47.2 11.6 -14.9 -8.9 94 104 A V H ><5S+ 0 0 0 -4,-1.5 3,-1.7 -5,-0.3 -2,-0.2 0.926 109.4 54.6 -62.8 -42.0 13.1 -17.7 -10.8 95 105 A R H 3<5S+ 0 0 76 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.823 110.5 46.9 -67.2 -27.2 16.5 -17.4 -9.2 96 106 A Q T 3<5S- 0 0 76 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.319 115.0-114.4 -92.5 5.1 14.8 -17.7 -5.7 97 107 A G T < 5S+ 0 0 0 -3,-1.7 32,-2.4 2,-0.2 -3,-0.2 0.761 85.5 118.7 62.7 32.6 12.8 -20.7 -6.7 98 108 A L S - 0 0 140 -2,-1.0 3,-1.9 3,-0.4 -71,-0.0 -0.887 34.1-126.4-104.2 139.3 6.2 -19.1 -26.7 106 116 A K G > S+ 0 0 185 -2,-0.4 3,-0.5 1,-0.3 -1,-0.1 0.764 106.6 58.5 -58.3 -27.2 8.6 -18.7 -29.7 107 117 A G G 3 S+ 0 0 48 1,-0.3 -39,-0.3 2,-0.1 -1,-0.3 0.752 116.3 32.3 -69.4 -18.9 7.5 -15.1 -30.4 108 118 A N G < S+ 0 0 7 -3,-1.9 -3,-0.4 -40,-0.2 -1,-0.3 -0.587 80.9 110.2-147.0 61.2 8.4 -13.9 -26.9 109 119 A N X + 0 0 58 -3,-0.5 3,-2.1 -5,-0.1 4,-0.4 0.123 25.4 127.5-131.5 23.2 11.4 -15.7 -25.6 110 120 A T T 3 S+ 0 0 58 1,-0.3 3,-0.4 2,-0.1 4,-0.2 0.871 82.3 39.5 -52.1 -44.0 14.3 -13.3 -25.6 111 121 A H T 3> S+ 0 0 36 1,-0.2 4,-2.2 2,-0.1 -1,-0.3 0.196 82.3 109.9 -96.2 23.5 15.2 -13.9 -22.0 112 122 A E H <> S+ 0 0 47 -3,-2.1 4,-2.7 1,-0.2 5,-0.3 0.923 78.0 47.1 -61.6 -47.8 14.6 -17.6 -22.0 113 123 A Q H > S+ 0 0 173 -3,-0.4 4,-1.9 -4,-0.4 -1,-0.2 0.921 112.5 51.1 -63.9 -42.3 18.3 -18.6 -21.7 114 124 A L H > S+ 0 0 61 -4,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.906 113.3 45.2 -57.0 -45.1 18.8 -16.1 -18.9 115 125 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.864 110.9 50.9 -71.1 -36.9 15.8 -17.4 -16.9 116 126 A R H X S+ 0 0 107 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.850 108.4 54.6 -71.9 -23.0 16.6 -21.1 -17.4 117 127 A K H X S+ 0 0 161 -4,-1.9 4,-1.9 -5,-0.3 -2,-0.2 0.952 110.8 46.0 -70.6 -43.7 20.2 -20.3 -16.1 118 128 A A H X S+ 0 0 5 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.912 112.0 50.5 -63.0 -40.2 18.5 -18.8 -13.0 119 129 A E H X S+ 0 0 14 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.868 106.1 55.1 -67.0 -39.8 16.2 -21.8 -12.6 120 130 A A H X S+ 0 0 58 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.910 109.6 47.9 -59.9 -39.7 19.1 -24.3 -12.8 121 131 A Q H X S+ 0 0 68 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.911 111.3 49.6 -66.5 -40.8 20.8 -22.4 -10.0 122 132 A A H <>S+ 0 0 0 -4,-2.4 5,-2.5 1,-0.2 4,-0.5 0.899 112.8 47.8 -65.8 -36.9 17.6 -22.4 -7.9 123 133 A K H ><5S+ 0 0 91 -4,-2.6 3,-0.9 2,-0.2 -2,-0.2 0.930 109.5 51.8 -68.6 -41.9 17.2 -26.1 -8.5 124 134 A K H 3<5S+ 0 0 160 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.894 113.9 45.0 -58.4 -43.8 20.9 -26.9 -7.6 125 135 A E T 3<5S- 0 0 93 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.541 108.8-129.6 -80.4 -3.6 20.3 -25.0 -4.3 126 136 A K T < 5 - 0 0 104 -3,-0.9 2,-0.4 -4,-0.5 6,-0.3 0.918 41.8-178.7 60.8 42.3 16.9 -26.8 -3.8 127 137 A L > < - 0 0 37 -5,-2.5 3,-2.8 3,-0.1 -1,-0.2 -0.624 43.5 -57.9 -81.4 124.4 15.2 -23.4 -3.2 128 138 A N G > S+ 0 0 56 -2,-0.4 3,-2.6 1,-0.3 -30,-0.2 -0.139 135.1 30.8 61.1-109.2 11.5 -23.1 -2.3 129 139 A I G 3 S+ 0 0 36 -32,-2.4 -1,-0.3 1,-0.3 -31,-0.1 0.817 130.3 44.4 -50.8 -30.5 9.5 -24.8 -5.2 130 140 A W G < S+ 0 0 51 -3,-2.8 -1,-0.3 -33,-0.2 -2,-0.3 0.280 86.7 124.2-101.3 12.9 12.6 -27.1 -5.6 131 141 A S < 0 0 54 -3,-2.6 -4,-0.1 -4,-0.2 -5,-0.1 -0.300 360.0 360.0 -76.9 154.5 13.1 -27.8 -1.9 132 142 A E 0 0 197 -6,-0.3 -4,-0.1 -2,-0.0 -2,-0.1 -0.929 360.0 360.0-121.1 360.0 13.2 -31.4 -0.7