==== 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 11-FEB-06 2G09 . COMPND 2 MOLECULE: CYTOSOLIC 5'-NUCLEOTIDASE III; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR E.BITTO,C.A.BINGMAN,G.E.WESENBERG,G.N.PHILLIPS JR.,CENTER FO . 582 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27047.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 410 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 5.5 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 41 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 33.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 6 2 0 0 6 2 0 0 0 0 0 0 4 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 3 3 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 PARALLEL BRIDGES PER LADDER . 5 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 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 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 7 A A 0 0 126 0, 0.0 2,-0.5 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 147.2 65.7 67.0 20.8 2 8 A V + 0 0 14 22,-0.1 2,-0.4 3,-0.0 26,-0.1 -0.862 360.0 177.2-102.9 131.5 63.0 69.6 20.2 3 9 A H > - 0 0 99 -2,-0.5 3,-1.2 1,-0.1 4,-0.1 -0.933 14.9-167.4-131.8 112.2 63.5 72.6 17.9 4 10 A L G > S+ 0 0 10 -2,-0.4 3,-1.8 1,-0.3 6,-0.3 0.801 88.0 68.1 -65.6 -29.4 60.5 74.9 17.4 5 11 A K G 3 S+ 0 0 175 1,-0.3 -1,-0.3 -3,-0.1 6,-0.0 0.801 101.1 48.1 -59.3 -28.8 62.4 76.5 14.5 6 12 A X G < S+ 0 0 152 -3,-1.2 -1,-0.3 1,-0.1 -2,-0.2 0.263 91.6 87.8-100.2 9.1 61.9 73.3 12.6 7 13 A X X - 0 0 6 -3,-1.8 3,-1.7 1,-0.1 4,-0.3 -0.929 65.3-156.9-108.2 109.9 58.2 72.9 13.3 8 14 A P G > S+ 0 0 100 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.801 90.2 63.3 -55.4 -33.7 56.2 74.8 10.6 9 15 A E G > S+ 0 0 60 1,-0.3 3,-0.8 2,-0.2 273,-0.1 0.797 99.2 55.8 -61.8 -30.5 53.2 75.1 12.9 10 16 A F G < S+ 0 0 13 -3,-1.7 -1,-0.3 -6,-0.3 -6,-0.1 0.482 96.4 64.7 -81.1 -5.3 55.3 77.2 15.3 11 17 A Q G < S+ 0 0 108 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.2 0.439 72.0 117.0 -95.8 -3.3 56.2 79.7 12.5 12 18 A K S X S- 0 0 80 -3,-0.8 3,-1.9 -4,-0.3 -3,-0.0 -0.408 75.8-122.4 -62.8 143.3 52.6 80.9 12.1 13 19 A S T 3 S+ 0 0 120 1,-0.3 -1,-0.1 -2,-0.1 262,-0.1 0.707 108.6 65.8 -67.6 -20.8 52.4 84.7 13.0 14 20 A S T 3 S+ 0 0 11 260,-0.1 261,-2.9 262,-0.1 2,-0.7 0.598 80.8 98.6 -69.0 -15.2 49.7 83.9 15.6 15 21 A V E < +A 274 0A 19 -3,-1.9 2,-0.5 259,-0.2 259,-0.2 -0.695 49.9 176.8 -87.1 112.8 52.3 82.0 17.7 16 22 A R E +A 273 0A 109 257,-3.1 257,-3.0 -2,-0.7 2,-0.4 -0.975 1.3 174.5-119.2 124.9 53.9 84.1 20.5 17 23 A I - 0 0 33 -2,-0.5 255,-0.1 255,-0.2 254,-0.1 -0.967 18.2-169.2-137.5 115.9 56.4 82.5 22.9 18 24 A K S S+ 0 0 128 -2,-0.4 -1,-0.1 253,-0.4 254,-0.1 0.903 88.8 25.8 -68.6 -42.6 58.3 84.4 25.6 19 25 A N > + 0 0 85 252,-0.4 4,-2.2 248,-0.2 -1,-0.3 -0.725 63.9 171.2-130.4 78.7 60.8 81.6 26.5 20 26 A P H > S+ 0 0 61 0, 0.0 4,-2.4 0, 0.0 -16,-0.2 0.809 79.9 56.7 -63.2 -31.6 61.3 79.2 23.5 21 27 A T H > S+ 0 0 104 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.931 109.6 45.4 -62.9 -47.0 64.2 77.4 25.2 22 28 A R H > S+ 0 0 100 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.908 111.4 53.1 -62.3 -43.4 61.9 76.5 28.2 23 29 A V H X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.903 108.2 51.2 -58.0 -43.4 59.1 75.5 25.8 24 30 A E H X S+ 0 0 46 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.905 109.9 48.9 -62.7 -42.3 61.5 73.1 24.0 25 31 A E H X S+ 0 0 111 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.890 110.8 49.6 -66.9 -35.0 62.5 71.5 27.3 26 32 A I H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.945 114.5 45.1 -64.3 -45.9 58.9 71.0 28.4 27 33 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.897 107.5 58.4 -66.0 -41.3 58.0 69.4 25.0 28 34 A C H X S+ 0 0 31 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.926 108.2 46.5 -48.7 -49.2 61.2 67.4 25.2 29 35 A G H X S+ 0 0 5 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.896 109.2 54.6 -63.3 -40.7 59.8 65.9 28.5 30 36 A L H X S+ 0 0 0 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.934 110.4 45.8 -57.1 -47.3 56.4 65.4 27.0 31 37 A I H >< S+ 0 0 59 -4,-2.7 3,-0.5 1,-0.2 -2,-0.2 0.940 109.0 56.5 -62.2 -46.0 57.9 63.3 24.1 32 38 A K H 3< S+ 0 0 172 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.868 110.5 43.9 -52.7 -41.8 60.1 61.4 26.6 33 39 A G H 3X S- 0 0 16 -4,-2.0 4,-0.7 1,-0.1 3,-0.3 0.725 92.2-176.5 -78.7 -23.2 57.0 60.3 28.6 34 40 A G H XX - 0 0 14 -4,-1.4 3,-1.0 -3,-0.5 4,-0.6 -0.052 54.4 -31.2 56.8-160.3 54.9 59.4 25.5 35 41 A A H >4 S+ 0 0 31 255,-0.3 3,-1.2 1,-0.2 -1,-0.2 0.868 129.7 66.3 -57.8 -42.4 51.3 58.2 25.7 36 42 A A H 34 S+ 0 0 76 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.735 110.7 33.9 -57.7 -26.1 51.7 56.5 29.1 37 43 A K H << S+ 0 0 68 -3,-1.0 189,-2.6 -4,-0.7 -1,-0.3 0.484 96.7 106.3-108.4 -3.8 52.3 59.7 31.0 38 44 A L E << +b 226 0A 1 -3,-1.2 2,-0.3 -4,-0.6 189,-0.2 -0.561 32.9 163.0 -88.0 139.1 50.2 62.2 29.0 39 45 A Q E -b 227 0A 1 187,-1.7 189,-1.9 -2,-0.3 2,-0.4 -0.975 24.8-138.6-140.3 158.6 46.9 63.8 30.0 40 46 A I E -bc 228 154A 0 113,-2.9 115,-2.4 -2,-0.3 2,-0.4 -0.921 12.5-173.4-116.0 137.3 45.0 66.9 28.6 41 47 A I E +bc 229 155A 0 187,-2.6 189,-2.2 -2,-0.4 2,-0.3 -0.998 23.8 155.0-129.9 124.1 43.2 69.5 30.7 42 48 A T E -bc 230 156A 0 113,-2.9 115,-2.7 -2,-0.4 189,-0.2 -0.990 38.2-131.5-148.5 148.1 41.3 72.1 28.7 43 49 A D - 0 0 6 187,-1.5 115,-0.2 -2,-0.3 3,-0.1 -0.383 21.8-142.9 -85.7-174.4 38.4 74.5 28.9 44 50 A F >>> + 0 0 0 113,-0.2 4,-2.7 3,-0.1 3,-2.1 0.778 67.2 78.3-112.5 -70.3 35.8 74.5 26.1 45 51 A D T 345S- 0 0 23 1,-0.3 -1,-0.1 2,-0.2 15,-0.1 -0.201 117.5 -7.6 -55.8 122.3 34.3 77.8 25.1 46 52 A X T 345S+ 0 0 16 4,-0.2 -1,-0.3 13,-0.2 5,-0.2 0.409 132.0 65.9 76.4 -2.6 36.7 79.8 22.8 47 53 A T T <45S+ 0 0 0 -3,-2.1 -2,-0.2 3,-0.1 -1,-0.1 0.718 121.0 12.6-110.6 -55.6 39.5 77.2 23.4 48 54 A L T <5S+ 0 0 1 -4,-2.7 89,-3.1 182,-0.1 2,-0.2 0.757 132.7 56.0 -91.1 -30.1 38.0 74.1 21.7 49 55 A S B S-H 56 0C 106 3,-3.1 3,-1.5 -2,-0.3 -3,-0.0 -0.961 79.3 -11.2-149.3 121.4 33.7 83.3 12.2 54 60 A N T 3 S- 0 0 149 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.855 127.9 -55.0 53.4 40.7 33.5 85.7 9.2 55 61 A G T 3 S+ 0 0 83 1,-0.2 2,-0.5 0, 0.0 -1,-0.3 0.560 119.4 111.8 73.5 9.4 33.8 88.7 11.5 56 62 A K E < S-H 53 0C 148 -3,-1.5 -3,-3.1 0, 0.0 -1,-0.2 -0.960 73.9-116.5-116.3 126.6 30.8 87.5 13.4 57 63 A R E -H 52 0C 127 -2,-0.5 -5,-0.3 -5,-0.3 -6,-0.1 -0.443 27.1-133.0 -67.9 131.4 31.4 86.3 17.0 58 64 A C - 0 0 9 -7,-1.7 2,-0.2 -2,-0.2 76,-0.1 -0.457 29.3 -97.9 -78.7 152.8 30.6 82.6 17.5 59 65 A P - 0 0 8 0, 0.0 76,-0.3 0, 0.0 -13,-0.2 -0.473 19.5-137.5 -78.5 143.7 28.5 81.5 20.5 60 66 A T > - 0 0 35 -2,-0.2 4,-1.5 -15,-0.1 74,-0.0 -0.377 44.4 -96.8 -69.6 168.1 29.6 80.1 23.8 61 67 A C H > S+ 0 0 0 1,-0.2 4,-1.1 2,-0.2 3,-0.1 0.882 130.9 52.7 -57.6 -38.9 27.5 77.2 25.0 62 68 A H H >> S+ 0 0 25 1,-0.2 4,-2.4 2,-0.2 3,-0.6 0.918 106.7 52.9 -59.9 -43.8 25.4 79.7 27.1 63 69 A N H 3> S+ 0 0 52 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.757 97.1 66.0 -64.3 -30.7 24.9 81.8 23.9 64 70 A I H 3< S+ 0 0 4 -4,-1.5 4,-0.3 2,-0.2 -1,-0.2 0.905 110.4 37.0 -56.9 -44.8 23.6 78.7 22.0 65 71 A I H X< S+ 0 0 0 -4,-1.1 3,-1.2 -3,-0.6 -2,-0.2 0.907 113.8 56.8 -72.3 -44.3 20.6 78.7 24.5 66 72 A D H 3< S+ 0 0 16 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.875 114.5 39.2 -51.0 -40.1 20.4 82.6 24.5 67 73 A N T 3< S+ 0 0 103 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.428 94.1 111.1 -96.0 -3.6 20.0 82.7 20.7 68 74 A C S X S- 0 0 15 -3,-1.2 3,-1.3 -4,-0.3 -3,-0.1 -0.110 80.8-105.5 -76.5 171.9 17.7 79.7 20.2 69 75 A K T 3 S+ 0 0 125 1,-0.3 -1,-0.1 59,-0.0 -4,-0.1 0.673 115.6 63.7 -70.3 -19.0 14.1 79.6 19.1 70 76 A L T 3 S+ 0 0 51 -5,-0.1 2,-0.4 2,-0.1 -1,-0.3 0.581 92.4 75.3 -83.5 -8.8 12.9 78.7 22.6 71 77 A V S < S- 0 0 4 -3,-1.3 44,-0.1 -6,-0.2 2,-0.0 -0.893 78.0-133.2-109.9 132.5 14.2 82.1 24.0 72 78 A T > - 0 0 73 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.268 21.3-113.0 -77.8 164.5 12.3 85.4 23.3 73 79 A D H > S+ 0 0 128 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.845 117.2 54.9 -64.2 -37.4 13.7 88.7 22.2 74 80 A E H > S+ 0 0 104 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.855 107.1 49.8 -67.1 -36.7 12.9 90.3 25.5 75 81 A C H > S+ 0 0 4 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.928 110.3 50.4 -63.4 -43.6 14.8 87.7 27.4 76 82 A R H X S+ 0 0 61 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.838 106.2 56.3 -64.8 -34.1 17.8 88.3 25.0 77 83 A R H X S+ 0 0 150 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.916 111.3 43.0 -57.5 -46.6 17.5 92.0 25.8 78 84 A K H X S+ 0 0 96 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.896 112.1 52.8 -71.8 -39.4 17.9 91.2 29.5 79 85 A L H X S+ 0 0 12 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.861 110.6 49.0 -60.4 -36.6 20.7 88.7 28.9 80 86 A L H X S+ 0 0 98 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.901 110.1 49.8 -71.4 -42.8 22.5 91.4 26.9 81 87 A Q H X S+ 0 0 104 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.929 110.9 50.0 -60.1 -47.7 22.1 94.0 29.7 82 88 A L H X S+ 0 0 20 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.927 112.9 47.9 -50.8 -48.8 23.4 91.5 32.2 83 89 A K H X S+ 0 0 73 -4,-2.0 4,-3.0 2,-0.2 5,-0.4 0.904 110.4 49.9 -63.6 -45.7 26.4 90.8 30.0 84 90 A E H X S+ 0 0 127 -4,-2.8 4,-0.9 2,-0.2 -1,-0.2 0.924 117.8 40.2 -61.6 -46.3 27.2 94.5 29.4 85 91 A Q H X S+ 0 0 121 -4,-2.3 4,-0.7 -5,-0.2 -2,-0.2 0.925 124.3 36.5 -63.7 -53.4 27.0 95.3 33.1 86 92 A Y H X S+ 0 0 16 -4,-3.1 4,-2.3 -5,-0.2 3,-0.2 0.813 110.4 58.1 -77.6 -33.3 28.8 92.2 34.4 87 93 A Y H X S+ 0 0 53 -4,-3.0 4,-2.3 -5,-0.3 -1,-0.2 0.863 101.1 59.4 -64.7 -34.1 31.4 91.7 31.6 88 94 A A H < S+ 0 0 52 -4,-0.9 -1,-0.2 -5,-0.4 -2,-0.2 0.840 107.7 45.5 -59.8 -37.0 32.7 95.2 32.4 89 95 A I H >< S+ 0 0 33 -4,-0.7 3,-1.1 -3,-0.2 -2,-0.2 0.903 108.8 56.1 -71.2 -44.0 33.4 94.0 35.9 90 96 A E H 3< S+ 0 0 34 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.916 116.5 36.2 -51.5 -44.0 35.0 90.8 34.5 91 97 A V T 3< S+ 0 0 31 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.367 86.4 131.1 -94.9 4.6 37.5 92.9 32.4 92 98 A D < - 0 0 41 -3,-1.1 -3,-0.1 -4,-0.2 8,-0.1 -0.424 45.5-157.2 -66.4 119.9 37.9 95.7 35.0 93 99 A P S S+ 0 0 119 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.697 85.7 52.7 -71.7 -19.4 41.6 96.4 35.6 94 100 A V S S+ 0 0 122 2,-0.1 2,-0.1 0, 0.0 -2,-0.0 0.878 90.5 80.0 -87.4 -38.6 41.2 97.9 39.1 95 101 A L S S- 0 0 39 -6,-0.1 2,-0.1 1,-0.1 5,-0.0 -0.412 82.4-120.3 -69.7 138.7 39.3 95.2 40.9 96 102 A T > - 0 0 59 -2,-0.1 4,-1.2 1,-0.1 -1,-0.1 -0.429 25.7-112.1 -71.6 157.8 41.3 92.2 42.1 97 103 A V H > S+ 0 0 65 1,-0.2 4,-0.6 2,-0.2 3,-0.4 0.886 120.1 54.5 -59.5 -38.8 40.3 88.8 40.8 98 104 A E H >4 S+ 0 0 131 1,-0.2 3,-1.3 2,-0.2 -1,-0.2 0.914 104.2 54.2 -60.8 -45.1 39.0 87.8 44.3 99 105 A E H 34 S+ 0 0 101 1,-0.3 4,-0.5 2,-0.1 -1,-0.2 0.768 103.2 58.2 -58.7 -27.0 36.8 90.9 44.4 100 106 A K H 3X S+ 0 0 22 -4,-1.2 4,-2.1 -3,-0.4 -1,-0.3 0.663 83.5 87.3 -77.5 -18.2 35.3 89.8 41.0 101 107 A F H S+ 0 0 70 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.846 112.2 54.6 -61.4 -33.5 30.7 87.6 43.9 103 109 A Y H > S+ 0 0 86 -4,-0.5 4,-2.6 2,-0.2 -2,-0.2 0.882 109.0 48.0 -65.4 -39.7 30.0 89.5 40.7 104 110 A X H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.926 110.1 51.7 -68.5 -41.3 30.6 86.4 38.6 105 111 A V H X S+ 0 0 64 -4,-2.3 4,-2.4 -5,-0.2 5,-0.2 0.954 112.5 47.2 -57.8 -47.5 28.3 84.3 40.9 106 112 A E H X S+ 0 0 83 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.937 112.6 48.0 -57.9 -53.4 25.6 87.0 40.4 107 113 A W H X S+ 0 0 37 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.938 116.0 42.2 -53.7 -55.3 26.0 87.2 36.6 108 114 A Y H X S+ 0 0 33 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.845 115.8 49.2 -64.4 -37.9 25.9 83.4 36.1 109 115 A T H X S+ 0 0 86 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.897 115.4 45.2 -64.6 -42.6 23.0 82.9 38.7 110 116 A K H X S+ 0 0 96 -4,-2.7 4,-1.2 -5,-0.2 -2,-0.2 0.884 116.0 44.1 -70.2 -41.6 21.0 85.7 37.0 111 117 A S H X S+ 0 0 8 -4,-2.7 4,-1.7 -5,-0.2 -2,-0.2 0.901 114.4 48.8 -72.7 -42.1 21.6 84.5 33.4 112 118 A H H X S+ 0 0 10 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.887 109.5 56.0 -59.0 -40.0 21.0 80.9 34.3 113 119 A G H X S+ 0 0 26 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.808 104.2 51.9 -62.6 -34.0 17.8 82.1 36.0 114 120 A L H X S+ 0 0 22 -4,-1.2 4,-1.2 2,-0.2 -1,-0.2 0.881 109.7 49.4 -68.4 -40.4 16.6 83.8 32.8 115 121 A L H X S+ 0 0 0 -4,-1.7 4,-0.6 2,-0.2 3,-0.3 0.905 107.1 55.2 -63.7 -43.7 17.1 80.6 30.9 116 122 A I H >< S+ 0 0 52 -4,-2.3 3,-1.0 1,-0.2 -1,-0.2 0.885 106.5 51.3 -55.5 -42.5 15.1 78.6 33.5 117 123 A E H 3< S+ 0 0 138 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.818 100.9 63.6 -64.4 -32.8 12.1 81.0 33.1 118 124 A Q H 3< S- 0 0 49 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.665 109.3-121.8 -67.9 -19.0 12.2 80.4 29.3 119 125 A G << - 0 0 31 -3,-1.0 -3,-0.1 -4,-0.6 -2,-0.1 0.994 31.1-166.3 76.6 71.4 11.4 76.7 29.7 120 126 A I - 0 0 0 -5,-0.3 74,-2.9 74,-0.2 2,-0.3 -0.790 6.6-151.2 -94.7 110.6 14.2 74.7 28.1 121 127 A P B > -I 193 0D 35 0, 0.0 3,-1.2 0, 0.0 4,-0.4 -0.633 14.8-136.4 -81.2 140.5 13.4 70.9 27.5 122 128 A K G > S+ 0 0 116 70,-2.9 3,-1.6 -2,-0.3 4,-0.4 0.868 104.4 61.4 -55.3 -40.6 16.2 68.4 27.5 123 129 A A G 3 S+ 0 0 85 69,-0.4 4,-0.3 1,-0.3 3,-0.3 0.714 100.1 54.9 -62.7 -22.3 14.7 66.7 24.5 124 130 A K G <> S+ 0 0 78 -3,-1.2 4,-2.4 1,-0.2 -1,-0.3 0.530 81.4 89.4 -88.2 -7.5 15.2 69.9 22.4 125 131 A L H <> S+ 0 0 9 -3,-1.6 4,-2.5 -4,-0.4 5,-0.2 0.869 83.1 56.0 -63.3 -39.1 18.9 70.3 23.1 126 132 A K H > S+ 0 0 77 -4,-0.4 4,-2.7 -3,-0.3 -1,-0.2 0.954 112.2 41.3 -52.1 -56.0 19.9 68.2 20.0 127 133 A E H > S+ 0 0 88 -4,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.906 113.4 53.4 -59.4 -48.6 17.9 70.5 17.6 128 134 A I H X S+ 0 0 6 -4,-2.4 4,-0.6 2,-0.2 -1,-0.2 0.914 113.5 43.4 -53.5 -46.0 19.0 73.7 19.3 129 135 A V H >< S+ 0 0 7 -4,-2.5 3,-0.8 1,-0.2 5,-0.3 0.926 113.5 50.3 -69.0 -46.0 22.7 72.6 18.9 130 136 A A H 3< S+ 0 0 60 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.848 115.1 44.2 -59.5 -38.1 22.2 71.4 15.3 131 137 A D H 3< S+ 0 0 122 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.534 99.2 98.4 -82.9 -8.4 20.5 74.8 14.4 132 138 A S S << S- 0 0 29 -3,-0.8 -68,-0.1 -4,-0.6 -3,-0.1 -0.191 79.3-121.1 -79.9 171.5 23.1 76.9 16.3 133 139 A D + 0 0 130 2,-0.0 -1,-0.1 -69,-0.0 -3,-0.1 0.102 60.6 140.9 -96.3 21.2 26.2 78.8 15.0 134 140 A V - 0 0 27 -5,-0.3 2,-0.4 -76,-0.1 -74,-0.1 -0.357 28.7-172.4 -67.0 141.8 28.7 76.9 17.2 135 141 A X - 0 0 61 -76,-0.3 -85,-2.9 -85,-0.3 2,-0.2 -0.999 17.2-138.8-136.4 138.2 32.0 76.0 15.6 136 142 A L B -G 49 0B 13 -2,-0.4 -87,-0.3 -87,-0.3 3,-0.1 -0.628 40.5 -92.2 -88.0 150.4 34.9 73.8 16.7 137 143 A K > - 0 0 0 -89,-3.1 3,-1.5 -2,-0.2 142,-0.3 -0.293 53.0 -88.4 -58.9 143.2 38.5 75.0 16.1 138 144 A E B 3 S+j 279 0E 110 140,-2.4 142,-3.0 1,-0.2 143,-0.2 -0.284 115.5 31.8 -51.3 130.6 40.1 73.8 12.9 139 145 A G T 3> S+ 0 0 13 140,-0.2 4,-2.0 141,-0.1 -1,-0.2 0.513 75.1 131.0 95.1 6.7 41.8 70.4 13.4 140 146 A Y H <> + 0 0 58 -3,-1.5 4,-2.6 1,-0.2 5,-0.4 0.841 67.7 57.0 -61.2 -35.4 39.4 69.2 16.1 141 147 A E H > S+ 0 0 96 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.944 111.5 41.6 -65.9 -43.7 38.9 65.8 14.4 142 148 A N H > S+ 0 0 88 2,-0.2 4,-2.4 3,-0.2 5,-0.3 0.826 114.2 55.0 -66.3 -35.3 42.7 65.0 14.5 143 149 A F H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.998 117.9 31.8 -59.0 -64.8 42.9 66.5 18.0 144 150 A F H X S+ 0 0 1 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.830 119.7 56.7 -61.6 -34.7 40.2 64.2 19.5 145 151 A G H X S+ 0 0 26 -4,-2.4 4,-2.4 -5,-0.4 -1,-0.2 0.921 108.2 42.5 -66.7 -50.4 41.1 61.4 17.1 146 152 A K H X S+ 0 0 70 -4,-2.4 4,-1.4 2,-0.2 6,-0.2 0.902 115.4 52.1 -66.0 -38.7 44.8 61.0 18.0 147 153 A L H <>S+ 0 0 0 -4,-1.8 5,-2.7 -5,-0.3 3,-0.3 0.929 112.4 43.2 -62.8 -45.6 44.0 61.3 21.7 148 154 A Q H ><5S+ 0 0 13 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.898 108.8 59.6 -68.9 -38.9 41.3 58.6 21.7 149 155 A Q H 3<5S+ 0 0 70 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.848 114.8 35.3 -51.8 -38.8 43.5 56.4 19.6 150 156 A H T 3<5S- 0 0 61 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.295 111.8-119.6-103.1 8.0 46.1 56.4 22.3 151 157 A G T < 5 + 0 0 27 -3,-1.4 -3,-0.2 1,-0.2 -4,-0.1 0.788 48.3 173.4 57.0 35.7 43.6 56.5 25.2 152 158 A I < - 0 0 2 -5,-2.7 -1,-0.2 -6,-0.2 -113,-0.2 -0.587 35.5-115.6 -76.1 125.1 44.9 59.8 26.5 153 159 A P - 0 0 19 0, 0.0 -113,-2.9 0, 0.0 2,-0.4 -0.405 30.9-166.4 -59.7 130.9 42.7 61.2 29.3 154 160 A V E -cd 40 179A 0 24,-2.8 26,-3.4 -115,-0.2 2,-0.6 -0.992 4.9-166.6-123.5 122.2 41.0 64.5 28.3 155 161 A F E -cd 41 180A 0 -115,-2.4 -113,-2.9 -2,-0.4 2,-0.7 -0.940 2.3-165.8-112.1 109.4 39.4 66.7 31.1 156 162 A I E -cd 42 181A 0 24,-3.2 26,-3.1 -2,-0.6 2,-0.6 -0.901 7.6-174.2 -99.2 116.1 37.2 69.4 29.7 157 163 A F E - d 0 182A 0 -115,-2.7 2,-0.4 -2,-0.7 -113,-0.2 -0.937 12.0-179.3-120.7 101.6 36.5 71.8 32.5 158 164 A S - 0 0 1 24,-3.0 26,-0.3 -2,-0.6 44,-0.1 -0.905 40.1-159.5-120.6 132.6 34.0 74.4 31.5 159 165 A A S S+ 0 0 17 -2,-0.4 45,-0.1 24,-0.1 -1,-0.1 0.375 83.0 82.2 -76.3 3.1 32.4 77.4 33.1 160 166 A G S S- 0 0 5 1,-0.1 24,-0.5 43,-0.1 2,-0.5 0.517 101.5 -61.6 -82.7-135.1 29.7 77.0 30.3 161 167 A I > - 0 0 0 1,-0.1 4,-2.4 22,-0.1 3,-0.2 -0.984 37.9-153.4-124.0 117.6 26.7 74.6 30.2 162 168 A G H > S+ 0 0 0 22,-2.2 4,-2.7 -2,-0.5 5,-0.2 0.860 91.9 53.0 -62.2 -40.5 27.6 70.9 30.3 163 169 A D H > S+ 0 0 15 21,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.884 113.5 44.7 -62.5 -39.7 24.5 69.5 28.5 164 170 A V H > S+ 0 0 0 -3,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.938 112.7 49.8 -68.2 -50.9 25.1 71.9 25.6 165 171 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.928 111.5 50.4 -53.2 -47.6 28.9 71.3 25.4 166 172 A E H X S+ 0 0 40 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.888 109.7 49.7 -61.5 -42.2 28.3 67.5 25.4 167 173 A E H X S+ 0 0 18 -4,-1.7 4,-2.5 -5,-0.2 5,-0.2 0.883 108.6 54.5 -65.9 -35.5 25.7 67.8 22.6 168 174 A V H X S+ 0 0 7 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.948 114.3 38.4 -59.5 -52.0 28.2 69.9 20.6 169 175 A I H <>S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 6,-0.7 0.852 113.9 56.0 -74.4 -32.2 31.0 67.3 20.7 170 176 A R H ><5S+ 0 0 39 -4,-2.5 3,-1.7 -5,-0.2 -2,-0.2 0.955 110.4 44.4 -59.0 -51.6 28.6 64.4 20.4 171 177 A Q H 3<5S+ 0 0 69 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.823 109.5 57.2 -66.5 -28.9 27.2 65.8 17.1 172 178 A A T 3<5S- 0 0 32 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.549 113.8-121.7 -75.3 -6.0 30.7 66.5 16.0 173 179 A G T < 5S+ 0 0 51 -3,-1.7 -3,-0.2 -4,-0.3 -2,-0.1 0.735 86.8 101.0 74.5 24.3 31.5 62.8 16.5 174 180 A V < + 0 0 6 -5,-2.5 2,-1.8 1,-0.1 -4,-0.2 0.262 33.9 111.0-127.6 11.1 34.3 63.4 19.0 175 181 A Y + 0 0 18 -6,-0.7 294,-2.4 -5,-0.2 295,-0.3 -0.552 52.5 168.5 -86.0 74.6 32.8 62.7 22.5 176 182 A H B > -K 468 0F 32 -2,-1.8 3,-1.9 292,-0.3 292,-0.3 -0.281 51.4 -97.1 -86.6 171.2 34.9 59.6 23.0 177 183 A S T 3 S+ 0 0 34 290,-2.4 291,-0.1 1,-0.3 -1,-0.1 0.750 119.9 62.4 -61.0 -28.1 35.4 57.5 26.2 178 184 A N T 3 S+ 0 0 19 289,-0.3 -24,-2.8 -25,-0.1 2,-0.6 0.535 86.9 92.3 -73.9 -6.7 38.7 59.3 27.0 179 185 A V E < -d 154 0A 7 -3,-1.9 2,-0.5 -26,-0.2 -24,-0.2 -0.799 54.5-173.6 -98.8 113.8 36.8 62.6 27.3 180 186 A K E -d 155 0A 86 -26,-3.4 -24,-3.2 -2,-0.6 2,-0.5 -0.917 10.8-153.2-105.9 133.8 35.5 63.7 30.8 181 187 A V E -d 156 0A 9 -2,-0.5 2,-0.5 -26,-0.2 -24,-0.2 -0.936 14.1-179.7-111.5 121.6 33.3 66.8 31.0 182 188 A V E +d 157 0A 19 -26,-3.1 -24,-3.0 -2,-0.5 2,-0.2 -0.984 34.8 114.0-115.6 116.7 33.1 68.9 34.2 183 189 A S S S- 0 0 12 -2,-0.5 2,-0.9 -26,-0.2 -24,-0.1 -0.839 73.9 -56.1-157.6-169.5 30.8 71.8 33.8 184 190 A N - 0 0 2 -24,-0.5 -22,-2.2 -26,-0.3 -21,-0.4 -0.818 60.0-162.9 -86.8 103.7 27.5 73.5 34.9 185 191 A F - 0 0 44 -2,-0.9 13,-3.1 13,-0.4 2,-0.1 -0.702 16.5-112.5 -96.0 142.3 25.0 70.8 34.2 186 192 A X E -L 197 0G 2 -2,-0.3 2,-0.5 11,-0.2 11,-0.3 -0.369 17.5-142.4 -71.6 147.6 21.2 71.3 34.0 187 193 A D E -L 196 0G 49 9,-3.3 8,-3.2 -2,-0.1 9,-1.2 -0.962 21.7-155.6-111.1 125.0 18.8 70.0 36.5 188 194 A F E -L 194 0G 36 -2,-0.5 6,-0.2 6,-0.2 2,-0.0 -0.757 5.6-132.9-106.5 146.3 15.6 68.8 34.9 189 195 A D > - 0 0 60 4,-2.8 3,-2.7 -2,-0.3 -1,-0.1 -0.200 47.0 -78.3 -85.5-178.1 12.1 68.4 36.4 190 196 A E T 3 S+ 0 0 202 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.776 133.6 50.8 -51.8 -31.1 9.7 65.4 36.1 191 197 A N T 3 S- 0 0 141 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.315 120.9-106.2 -90.2 6.3 8.8 66.6 32.5 192 198 A G S < S+ 0 0 24 -3,-2.7 -70,-2.9 1,-0.3 2,-0.4 0.815 75.9 138.6 70.5 31.4 12.4 67.0 31.4 193 199 A V B -I 121 0D 42 -72,-0.3 -4,-2.8 -71,-0.1 -1,-0.3 -0.899 62.6-101.0-108.6 136.3 12.3 70.8 31.6 194 200 A L E +L 188 0G 4 -74,-2.9 -6,-0.2 -2,-0.4 -74,-0.2 -0.337 46.7 161.5 -55.2 125.3 15.2 72.8 33.0 195 201 A K E - 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