==== 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 17-NOV-06 2NX8 . COMPND 2 MOLECULE: TRNA-SPECIFIC ADENOSINE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PYOGENES SEROTYPE M6; . AUTHOR K.Y.HWANG,W.-H.LEE,Y.K.KIM . 168 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9815.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 9.5 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 6 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 38.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.6 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 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 1 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 6 A S 0 0 165 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -72.7 -4.4 18.9 19.3 2 7 A F - 0 0 113 1,-0.1 2,-0.2 2,-0.0 132,-0.0 -0.507 360.0-146.4 -67.5 121.4 -4.8 21.0 16.1 3 8 A L - 0 0 116 -2,-0.4 3,-0.1 1,-0.0 -1,-0.1 -0.627 20.3-173.5 -94.9 151.5 -2.6 24.1 16.6 4 9 A M + 0 0 146 -2,-0.2 -2,-0.0 1,-0.1 -1,-0.0 -0.572 17.6 158.8-140.7 71.7 -3.3 27.6 15.2 5 10 A P + 0 0 68 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.736 69.8 43.8 -67.6 -20.7 -0.3 29.9 15.9 6 11 A Y S S- 0 0 27 -3,-0.1 35,-0.0 4,-0.0 0, 0.0 -0.960 79.5-123.1-132.2 145.4 -1.4 32.3 13.2 7 12 A S > - 0 0 45 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.184 39.8-102.0 -71.2 172.9 -4.7 33.8 12.0 8 13 A L H > S+ 0 0 110 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.839 124.9 52.7 -66.2 -33.0 -5.9 33.4 8.5 9 14 A E H > S+ 0 0 140 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.886 109.7 47.4 -69.6 -40.4 -4.7 36.9 7.6 10 15 A E H > S+ 0 0 89 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.934 113.2 48.7 -65.8 -44.4 -1.2 36.1 9.0 11 16 A Q H X S+ 0 0 17 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.918 110.2 51.8 -60.7 -43.4 -1.2 32.8 7.1 12 17 A T H X S+ 0 0 36 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.908 107.3 53.1 -60.2 -42.3 -2.3 34.7 3.9 13 18 A Y H X S+ 0 0 111 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.939 111.3 45.9 -57.5 -48.6 0.6 37.2 4.4 14 19 A F H X S+ 0 0 11 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.871 112.1 49.3 -64.6 -40.5 3.1 34.4 4.6 15 20 A M H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.880 109.8 52.4 -68.0 -35.6 1.8 32.5 1.6 16 21 A Q H X S+ 0 0 93 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.854 106.9 53.4 -66.9 -32.2 1.8 35.7 -0.4 17 22 A E H X S+ 0 0 15 -4,-1.6 4,-1.1 2,-0.2 -1,-0.2 0.872 108.7 49.2 -67.3 -35.5 5.4 36.1 0.7 18 23 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.816 107.6 54.6 -72.0 -30.3 6.0 32.6 -0.7 19 24 A L H X S+ 0 0 23 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.850 103.8 54.9 -70.6 -32.9 4.3 33.6 -3.9 20 25 A K H X S+ 0 0 105 -4,-1.7 4,-0.8 2,-0.2 -1,-0.2 0.839 108.0 48.8 -67.5 -31.3 6.7 36.5 -4.1 21 26 A E H >X S+ 0 0 13 -4,-1.1 4,-1.2 1,-0.2 3,-0.7 0.894 107.3 56.5 -71.0 -37.7 9.5 33.9 -3.9 22 27 A S H 3X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.3 -2,-0.2 0.838 100.4 58.1 -59.9 -35.8 7.6 32.0 -6.6 23 28 A E H 3X S+ 0 0 95 -4,-1.7 4,-2.4 1,-0.2 -1,-0.3 0.805 98.3 60.3 -66.4 -30.1 7.8 35.1 -8.8 24 29 A K H <>S+ 0 0 0 -4,-1.2 5,-2.5 2,-0.2 3,-0.7 0.929 111.0 53.3 -63.8 -46.4 11.7 31.6 -10.2 26 31 A L H ><5S+ 0 0 33 -4,-2.0 3,-2.4 1,-0.3 -2,-0.2 0.938 106.4 52.4 -53.1 -51.3 9.2 32.5 -12.9 27 32 A Q H 3<5S+ 0 0 159 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.762 110.2 49.6 -57.5 -27.1 11.3 35.5 -13.9 28 33 A K T <<5S- 0 0 82 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.167 121.5-108.3 -98.8 16.6 14.3 33.2 -14.2 29 34 A A T < 5S+ 0 0 44 -3,-2.4 2,-0.3 1,-0.2 -3,-0.2 0.865 78.2 125.3 60.3 41.2 12.3 30.8 -16.4 30 35 A E S S-AB 42 81A 44 3,-3.5 3,-1.6 -2,-0.4 42,-0.1 -0.989 76.4 -13.1-134.3 124.5 9.2 31.2 13.6 40 45 A D T 3 S- 0 0 128 40,-0.6 -1,-0.1 -2,-0.4 3,-0.1 0.898 130.6 -51.4 53.5 44.2 7.4 33.2 16.3 41 46 A G T 3 S+ 0 0 35 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.589 120.5 107.0 72.6 9.1 5.5 35.1 13.6 42 47 A E E < S-A 39 0A 135 -3,-1.6 -3,-3.5 0, 0.0 2,-0.4 -0.975 73.2-120.9-125.5 135.4 8.7 36.0 11.8 43 48 A I E +A 38 0A 35 -2,-0.4 -5,-0.3 -5,-0.3 3,-0.1 -0.574 32.6 170.7 -71.5 125.0 10.1 34.6 8.5 44 49 A I E + 0 0 9 -7,-3.1 28,-0.3 -2,-0.4 2,-0.3 0.426 64.5 32.5-113.9 -5.1 13.5 33.0 9.2 45 50 A G E -A 37 0A 0 -8,-1.3 -8,-2.8 24,-0.1 2,-0.3 -0.966 58.4-173.9-156.8 137.3 13.9 31.4 5.8 46 51 A R E +A 36 0A 74 -2,-0.3 2,-0.3 18,-0.2 -10,-0.2 -0.952 12.5 166.0-129.7 149.6 13.0 32.0 2.2 47 52 A G E -A 35 0A 0 -12,-2.2 -12,-2.6 -2,-0.3 2,-0.3 -0.995 14.4-177.0-160.7 158.2 13.4 29.9 -0.9 48 53 A H E -A 34 0A 24 -2,-0.3 -14,-0.2 -14,-0.2 2,-0.2 -0.963 47.2 -81.3-150.8 156.3 12.3 29.4 -4.6 49 54 A N + 0 0 10 -16,-1.6 11,-0.2 -18,-0.4 -19,-0.1 -0.456 52.3 157.3 -64.9 131.1 13.1 26.8 -7.2 50 55 A A > + 0 0 1 9,-2.5 4,-2.7 -2,-0.2 6,-0.4 -0.071 19.3 132.9-148.0 37.7 16.5 27.5 -8.8 51 56 A R H >>S+ 0 0 131 8,-0.3 4,-1.8 2,-0.2 5,-0.6 0.920 78.5 43.1 -56.5 -51.9 17.7 24.2 -10.2 52 57 A E H 45S+ 0 0 107 2,-0.2 -1,-0.2 1,-0.2 -2,-0.1 0.916 117.3 45.4 -65.0 -44.7 18.7 25.5 -13.6 53 58 A E H 45S+ 0 0 110 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.909 122.8 35.2 -66.2 -42.4 20.4 28.6 -12.2 54 59 A S H <5S- 0 0 33 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.629 94.9-136.2 -87.3 -15.1 22.3 26.8 -9.5 55 60 A N T <5 + 0 0 144 -4,-1.8 2,-0.5 -5,-0.3 -3,-0.2 0.728 63.6 132.8 63.5 20.5 22.9 23.6 -11.4 56 61 A Q > < - 0 0 93 -5,-0.6 3,-1.3 -6,-0.4 -1,-0.2 -0.924 52.3-154.7-108.8 121.8 21.9 21.9 -8.2 57 62 A A T 3 S+ 0 0 84 -2,-0.5 -1,-0.1 1,-0.2 -6,-0.1 0.723 95.3 50.6 -65.3 -24.2 19.4 19.0 -8.4 58 63 A I T 3 S+ 0 0 79 1,-0.1 2,-2.5 -7,-0.1 -1,-0.2 0.421 76.0 114.6 -94.5 1.0 18.2 19.6 -4.8 59 64 A M < + 0 0 16 -3,-1.3 -9,-2.5 4,-0.1 -8,-0.3 -0.271 37.4 142.6 -75.1 57.7 17.6 23.3 -5.2 60 65 A H > - 0 0 51 -2,-2.5 4,-2.1 -11,-0.2 3,-0.2 -0.527 66.5-101.9 -88.3 163.2 13.8 23.3 -4.7 61 66 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.896 120.4 50.4 -52.0 -49.2 12.2 26.2 -2.8 62 67 A E H > S+ 0 0 6 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.871 109.6 50.8 -59.8 -40.0 11.7 24.2 0.4 63 68 A M H > S+ 0 0 31 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 111.3 47.9 -65.4 -42.2 15.4 23.1 0.5 64 69 A M H X S+ 0 0 40 -4,-2.1 4,-2.0 2,-0.2 -18,-0.2 0.905 113.3 48.4 -65.1 -41.6 16.6 26.6 0.0 65 70 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 -2,-0.2 0.896 110.1 51.5 -66.2 -41.3 14.2 27.9 2.8 66 71 A I H X S+ 0 0 11 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.930 109.1 49.9 -63.2 -44.3 15.3 25.1 5.2 67 72 A N H X S+ 0 0 93 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.923 113.4 47.1 -59.5 -43.3 19.0 26.0 4.6 68 73 A E H X S+ 0 0 88 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.928 112.5 48.6 -65.1 -44.0 18.2 29.6 5.3 69 74 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.890 111.5 50.0 -63.5 -40.0 16.2 28.8 8.4 70 75 A N H X>S+ 0 0 33 -4,-2.8 4,-1.8 2,-0.2 5,-1.6 0.931 111.6 48.5 -64.2 -44.4 18.9 26.5 9.8 71 76 A A H <5S+ 0 0 78 -4,-2.3 3,-0.2 -5,-0.2 -2,-0.2 0.951 110.8 50.8 -59.8 -49.1 21.5 29.2 9.2 72 77 A H H <5S+ 0 0 116 -4,-2.8 -2,-0.2 -28,-0.3 -1,-0.2 0.926 120.2 34.9 -53.6 -49.7 19.3 31.8 10.9 73 78 A E H <5S- 0 0 62 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.603 99.9-135.4 -81.5 -13.9 18.8 29.6 14.0 74 79 A G T <5S+ 0 0 69 -4,-1.8 2,-0.3 -3,-0.2 -3,-0.2 0.922 75.1 96.4 57.0 43.1 22.2 28.1 13.8 75 80 A N S + 0 0 0 22,-3.1 3,-0.6 -2,-0.4 -1,-0.1 -0.465 19.9 166.0-122.4 57.8 13.5 23.8 13.3 79 84 A L T 3 + 0 0 93 1,-0.2 23,-0.1 23,-0.2 3,-0.1 -0.306 62.1 21.8 -71.4 157.0 11.0 23.2 16.1 80 85 A D T 3 S+ 0 0 129 21,-0.2 -40,-0.6 1,-0.2 2,-0.3 0.850 98.3 132.1 53.1 38.4 8.0 25.5 16.6 81 86 A T E < -B 39 0A 1 -3,-0.6 23,-0.9 20,-0.2 2,-0.4 -0.824 48.1-148.9-119.5 155.5 8.2 26.5 13.0 82 87 A T E -Bc 38 104A 5 -44,-2.3 -44,-3.5 -2,-0.3 2,-0.5 -0.995 9.7-154.2-126.8 128.8 5.6 26.8 10.2 83 88 A L E -Bc 37 105A 0 21,-3.1 23,-3.4 -2,-0.4 2,-0.5 -0.897 5.7-166.5-106.5 126.0 6.5 26.2 6.6 84 89 A F E +Bc 36 106A 0 -48,-3.5 -48,-2.8 -2,-0.5 2,-0.4 -0.944 13.0 170.9-110.5 127.0 4.5 27.8 3.8 85 90 A V E -Bc 35 107A 0 21,-2.2 23,-1.5 -2,-0.5 -50,-0.2 -0.998 34.9-136.5-139.2 134.1 5.0 26.5 0.3 86 91 A T E S+ 0 0 0 -52,-2.1 23,-2.2 -2,-0.4 2,-0.4 0.775 91.1 35.1 -59.4 -31.0 3.0 27.4 -2.9 87 92 A I E S- c 0 109A 8 -53,-0.3 23,-0.2 21,-0.2 3,-0.1 -0.965 101.0 -89.2-128.5 145.5 2.9 23.8 -4.1 88 93 A E - 0 0 2 21,-2.3 26,-0.1 -2,-0.4 -2,-0.1 -0.254 57.3-104.4 -49.7 124.6 2.7 20.5 -2.2 89 94 A P - 0 0 0 0, 0.0 27,-3.0 0, 0.0 28,-0.5 -0.182 31.3-125.6 -56.6 142.6 6.3 19.3 -1.4 90 95 A C B > -E 115 0B 18 25,-0.3 4,-2.3 26,-0.2 5,-0.2 -0.063 38.8 -85.6 -74.9-175.5 7.8 16.5 -3.5 91 96 A V H > S+ 0 0 64 23,-0.6 4,-2.3 2,-0.2 5,-0.2 0.908 126.9 49.9 -62.2 -44.3 9.3 13.4 -1.9 92 97 A M H > S+ 0 0 65 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.948 114.5 42.8 -61.3 -49.7 12.7 14.9 -1.4 93 98 A C H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.882 111.6 54.5 -66.5 -37.7 11.4 18.1 0.3 94 99 A S H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.946 109.6 48.0 -59.9 -47.3 8.9 16.2 2.4 95 100 A G H X S+ 0 0 24 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.904 112.4 49.4 -59.0 -41.2 11.7 14.0 3.7 96 101 A A H X S+ 0 0 16 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.910 107.3 54.2 -64.3 -43.5 13.8 17.1 4.4 97 102 A I H <>S+ 0 0 0 -4,-3.1 5,-1.7 1,-0.2 4,-0.4 0.880 109.2 49.3 -58.6 -39.0 10.9 18.7 6.2 98 103 A G H ><5S+ 0 0 1 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.900 109.2 51.2 -68.1 -39.6 10.7 15.7 8.5 99 104 A L H 3<5S+ 0 0 115 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.790 106.4 54.8 -67.7 -28.2 14.4 15.7 9.2 100 105 A A T 3<5S- 0 0 6 -4,-1.8 -22,-3.1 -5,-0.1 -1,-0.2 0.551 108.2-127.4 -81.2 -8.9 14.2 19.4 10.2 101 106 A R T < 5 + 0 0 93 -3,-1.0 -21,-0.2 -4,-0.4 -20,-0.2 0.773 44.1 170.9 66.3 28.4 11.5 18.5 12.7 102 107 A I < - 0 0 2 -5,-1.7 -1,-0.2 1,-0.2 -23,-0.2 -0.607 17.4-165.7 -72.3 118.3 9.2 21.2 11.3 103 108 A P + 0 0 53 0, 0.0 31,-2.9 0, 0.0 2,-0.4 0.600 66.5 48.9 -81.5 -13.7 5.8 20.5 13.0 104 109 A H E +cd 82 134A 10 -23,-0.9 -21,-3.1 29,-0.2 2,-0.4 -0.970 57.4 174.7-138.9 122.7 3.6 22.6 10.8 105 110 A V E -cd 83 135A 0 29,-2.3 31,-2.5 -2,-0.4 2,-0.5 -0.986 4.3-176.8-129.7 132.0 3.3 22.8 7.0 106 111 A I E +cd 84 136A 1 -23,-3.4 -21,-2.2 -2,-0.4 2,-0.3 -0.985 9.6 178.8-127.2 121.0 0.9 24.8 4.9 107 112 A Y E -cd 85 137A 5 29,-2.3 31,-1.2 -2,-0.5 32,-0.8 -0.894 20.9-145.4-122.7 156.7 0.8 24.5 1.1 108 113 A G E S+ 0 0 3 -23,-1.5 30,-1.5 -2,-0.3 33,-0.3 0.930 74.9 15.9 -79.1 -90.5 -1.3 26.0 -1.6 109 114 A A E S-c 87 0A 15 -23,-2.2 -21,-2.3 32,-0.2 -1,-0.2 -0.608 81.8-111.8 -90.0 149.7 -2.0 23.8 -4.6 110 115 A S - 0 0 60 -2,-0.2 2,-0.6 -23,-0.2 -1,-0.1 -0.314 15.4-132.6 -76.6 161.2 -1.5 20.0 -4.6 111 116 A N > + 0 0 34 1,-0.1 4,-2.2 -22,-0.1 9,-0.3 -0.843 24.6 177.5-117.3 89.8 1.2 18.3 -6.7 112 117 A Q T 4 S+ 0 0 158 -2,-0.6 -1,-0.1 1,-0.2 -2,-0.0 0.701 79.3 44.1 -66.5 -21.7 -0.6 15.4 -8.4 113 118 A K T 4 S+ 0 0 163 1,-0.0 -1,-0.2 6,-0.0 -2,-0.1 0.834 135.6 6.1 -94.0 -37.1 2.5 14.3 -10.2 114 119 A F T 4 S+ 0 0 131 -26,-0.1 -23,-0.6 -24,-0.0 -2,-0.2 0.323 85.3 143.2-129.0 6.0 5.3 14.4 -7.6 115 120 A G B <> +E 90 0B 0 -4,-2.2 5,-2.8 -25,-0.2 6,-1.3 -0.264 22.0 179.5 -55.5 123.4 3.4 15.3 -4.4 116 121 A G T 5S+ 0 0 0 -27,-3.0 7,-2.3 4,-0.2 8,-0.4 0.345 72.7 57.7-107.7 6.8 4.9 13.5 -1.3 117 122 A V T 5S- 0 0 1 -28,-0.5 8,-0.2 5,-0.2 -1,-0.1 0.806 133.4 -19.7-102.1 -40.1 2.5 14.8 1.3 118 123 A D T 5S+ 0 0 49 -7,-0.1 4,-0.1 4,-0.1 -2,-0.1 0.556 126.8 61.0-136.1 -41.0 -0.9 13.7 0.1 119 124 A S T 5S- 0 0 44 -8,-0.1 -3,-0.2 1,-0.1 -7,-0.1 0.988 124.5 -2.3 -60.5 -78.3 -0.7 13.0 -3.6 120 125 A L S + 0 0 97 -2,-0.3 3,-1.0 1,-0.1 -5,-0.2 -0.460 42.7 149.7-130.4 57.4 2.1 10.8 2.8 123 128 A I G > + 0 0 22 -7,-2.3 3,-0.9 1,-0.2 8,-0.3 0.835 64.7 58.0 -61.2 -39.5 5.6 11.2 4.2 124 129 A L G 3 S+ 0 0 0 -8,-0.4 9,-2.1 1,-0.2 -1,-0.2 0.619 116.6 34.2 -71.2 -12.0 4.9 14.0 6.7 125 130 A T G < S+ 0 0 67 -3,-1.0 2,-0.4 7,-0.2 -1,-0.2 0.210 84.3 131.2-125.4 13.0 2.3 11.9 8.6 126 131 A D < > - 0 0 25 -3,-0.9 5,-1.4 -4,-0.2 3,-0.3 -0.560 46.0-155.3 -72.3 121.0 3.9 8.5 8.2 127 132 A E T > 5S+ 0 0 175 -2,-0.4 3,-0.8 3,-0.2 -1,-0.2 0.853 90.2 64.6 -65.0 -37.2 4.1 6.8 11.5 128 133 A R T 3 5S+ 0 0 226 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.900 113.2 34.5 -53.1 -43.4 7.1 4.6 10.5 129 134 A L T 3 5S- 0 0 93 -3,-0.3 -1,-0.3 -6,-0.1 -2,-0.2 0.461 108.6-135.8 -88.8 -2.3 9.1 7.8 10.2 130 135 A N T < 5 + 0 0 120 -3,-0.8 2,-0.3 -4,-0.2 -3,-0.2 0.649 44.8 161.3 55.9 17.8 7.1 9.1 13.2 131 136 A H < - 0 0 11 -5,-1.4 -1,-0.2 -8,-0.3 -2,-0.1 -0.540 17.6-175.7 -66.9 129.1 6.7 12.4 11.4 132 137 A R + 0 0 220 -2,-0.3 2,-0.2 -3,-0.1 -7,-0.2 -0.401 18.0 160.9-125.5 55.7 3.7 14.0 13.1 133 138 A V - 0 0 14 -9,-2.1 2,-0.7 -29,-0.1 -29,-0.2 -0.552 40.4-130.9 -80.4 137.8 3.4 17.2 11.1 134 139 A Q E -d 104 0A 34 -31,-2.9 -29,-2.3 -2,-0.2 2,-0.4 -0.816 31.4-159.3 -87.5 116.3 0.1 19.1 11.1 135 140 A V E +d 105 0A 21 -2,-0.7 2,-0.4 -31,-0.2 -29,-0.2 -0.857 15.5 179.8-106.1 132.8 -0.6 19.7 7.4 136 141 A E E -d 106 0A 33 -31,-2.5 -29,-2.3 -2,-0.4 2,-0.3 -0.977 8.7-177.8-127.3 140.0 -2.9 22.4 6.0 137 142 A R E +d 107 0A 128 -2,-0.4 -29,-0.2 -31,-0.2 -28,-0.1 -0.919 48.7 53.5-137.6 163.0 -3.6 22.9 2.3 138 143 A G > + 0 0 42 -30,-1.5 3,-2.0 -31,-1.2 2,-0.4 0.246 56.1 150.5 101.2 -13.5 -5.5 25.2 -0.1 139 144 A L T 3 S- 0 0 21 -32,-0.8 -1,-0.3 1,-0.3 5,-0.1 -0.385 87.9 -21.6 -59.1 111.4 -4.1 28.5 1.1 140 145 A L T >> S+ 0 0 37 -2,-0.4 4,-2.2 -32,-0.1 3,-0.5 0.807 87.8 160.4 55.2 34.8 -4.3 30.7 -2.0 141 146 A A H <> + 0 0 33 -3,-2.0 4,-2.7 -33,-0.3 5,-0.3 0.855 66.2 58.2 -52.8 -42.7 -4.4 27.6 -4.2 142 147 A A H 3> S+ 0 0 78 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.899 110.4 42.2 -56.3 -45.3 -5.8 29.4 -7.2 143 148 A D H <> S+ 0 0 80 -3,-0.5 4,-2.3 2,-0.2 5,-0.2 0.894 113.4 52.0 -70.0 -41.5 -2.8 31.9 -7.3 144 149 A C H X S+ 0 0 0 -4,-2.2 4,-0.7 1,-0.2 -2,-0.2 0.878 115.6 41.9 -62.5 -38.4 -0.3 29.1 -6.6 145 150 A A H X S+ 0 0 47 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.818 111.3 57.9 -77.5 -31.9 -1.7 27.1 -9.5 146 151 A N H X S+ 0 0 88 -4,-1.9 4,-2.3 -5,-0.3 -2,-0.2 0.918 103.4 49.0 -65.1 -48.9 -2.1 30.2 -11.7 147 152 A I H X S+ 0 0 18 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.812 110.4 54.3 -63.6 -26.9 1.6 31.2 -11.7 148 153 A M H X S+ 0 0 27 -4,-0.7 4,-2.1 -5,-0.2 -1,-0.2 0.909 106.5 50.1 -71.5 -42.8 2.4 27.6 -12.6 149 154 A Q H X S+ 0 0 141 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.909 108.4 53.5 -61.4 -40.9 0.1 27.8 -15.6 150 155 A T H X S+ 0 0 32 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.925 106.5 53.4 -58.8 -44.9 1.8 31.0 -16.6 151 156 A F H X S+ 0 0 23 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.922 109.1 47.3 -56.1 -48.5 5.1 29.2 -16.4 152 157 A F H X S+ 0 0 107 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.855 112.3 49.1 -64.3 -37.0 4.0 26.4 -18.7 153 158 A R H X S+ 0 0 104 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.931 112.5 47.7 -67.5 -46.3 2.5 28.7 -21.3 154 159 A Q H X S+ 0 0 50 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.860 108.7 56.8 -62.4 -33.9 5.7 30.8 -21.3 155 160 A G H X S+ 0 0 23 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.897 106.3 48.0 -64.8 -41.2 7.7 27.6 -21.7 156 161 A R H X S+ 0 0 155 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.897 112.1 50.6 -66.0 -38.6 5.8 26.6 -24.8 157 162 A E H X S+ 0 0 97 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.897 110.8 47.7 -65.7 -41.2 6.4 30.1 -26.2 158 163 A R H X S+ 0 0 96 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.878 112.1 50.9 -66.0 -38.0 10.1 29.9 -25.5 159 164 A K H X S+ 0 0 157 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.818 108.7 51.9 -68.3 -32.4 10.2 26.5 -27.1 160 165 A K H X S+ 0 0 163 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.885 110.4 47.4 -72.6 -39.5 8.4 27.8 -30.2 161 166 A I H X S+ 0 0 101 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.928 112.4 49.7 -66.7 -44.7 10.9 30.7 -30.6 162 167 A A H X S+ 0 0 50 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.887 109.4 51.4 -61.3 -40.8 13.9 28.3 -30.1 163 168 A K H X S+ 0 0 146 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.883 110.8 49.8 -63.9 -37.9 12.4 25.9 -32.7 164 169 A H H X S+ 0 0 112 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.883 111.3 46.8 -67.6 -41.9 12.1 28.8 -35.1 165 170 A L H < S+ 0 0 117 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.841 111.6 50.9 -71.0 -35.0 15.6 30.1 -34.7 166 171 A I H < S+ 0 0 149 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.929 110.5 50.7 -67.2 -46.1 17.2 26.6 -35.0 167 172 A K H < 0 0 141 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.1 0.986 360.0 360.0 -53.6 -75.2 15.3 26.0 -38.3 168 173 A E < 0 0 193 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 -0.832 360.0 360.0-146.2 360.0 16.2 29.2 -40.1