==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN/SIGNALING PROTEIN 11-AUG-07 2JU0 . COMPND 2 MOLECULE: CALCIUM-BINDING PROTEIN NCS-1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.AMES . 227 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14096.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 157 69.2 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 . 7 3.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 1.3 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 . 8 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 43.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.2 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 1 0 0 2 2 2 2 1 1 0 0 0 0 0 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A A 0 0 159 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -74.1 -108.6 46.5 46.8 2 4 A K + 0 0 154 1,-0.1 0, 0.0 2,-0.0 0, 0.0 -0.876 360.0 163.4-104.6 112.7 -105.5 46.2 49.0 3 5 A T - 0 0 121 -2,-0.7 -1,-0.1 0, 0.0 0, 0.0 0.457 43.6-112.7 -95.1-124.1 -104.7 42.7 50.2 4 6 A S - 0 0 35 35,-0.0 29,-0.1 29,-0.0 -2,-0.0 0.324 37.8-153.1-158.8 -1.7 -101.4 41.4 51.5 5 7 A K S S+ 0 0 95 1,-0.2 34,-0.0 2,-0.1 0, 0.0 0.244 73.8 55.8 43.6-175.3 -100.1 39.0 48.9 6 8 A L S S+ 0 0 34 1,-0.2 4,-0.4 2,-0.1 5,-0.3 0.673 71.9 124.8 29.6 28.5 -97.7 36.0 49.8 7 9 A S S S+ 0 0 50 3,-0.1 -1,-0.2 2,-0.1 -2,-0.1 0.182 80.4 24.4 -96.9 18.5 -100.4 35.1 52.3 8 10 A K S > S+ 0 0 166 3,-0.1 4,-1.5 4,-0.0 5,-0.2 0.453 113.4 59.2-146.0 -39.2 -100.7 31.6 50.9 9 11 A D H > S+ 0 0 124 2,-0.2 4,-1.4 3,-0.2 -2,-0.1 0.788 110.5 47.5 -70.3 -25.2 -97.4 30.7 49.1 10 12 A D H > S+ 0 0 26 -4,-0.4 4,-1.5 2,-0.2 3,-0.2 0.979 111.4 43.1 -78.4 -68.9 -95.6 31.2 52.4 11 13 A L H > S+ 0 0 57 -5,-0.3 4,-0.5 1,-0.3 3,-0.3 0.862 117.3 52.0 -45.3 -38.2 -97.6 29.3 54.9 12 14 A T H < S+ 0 0 69 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.946 100.6 58.4 -66.4 -47.6 -97.9 26.5 52.3 13 15 A C H < S+ 0 0 105 -4,-1.4 4,-0.3 -3,-0.2 -1,-0.2 0.804 109.5 52.5 -52.7 -27.0 -94.2 26.3 51.7 14 16 A L H < + 0 0 36 -4,-1.5 3,-0.4 -3,-0.3 -2,-0.1 0.815 52.4 118.6 -75.3-106.5 -93.9 25.5 55.4 15 17 A K S < S+ 0 0 178 -4,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.588 97.7 30.7 52.4 3.6 -96.1 22.7 56.6 16 18 A Q S S+ 0 0 166 1,-0.7 -1,-0.3 -3,-0.0 2,-0.1 0.054 119.0 25.5-147.1 -96.9 -92.7 21.2 57.5 17 19 A S + 0 0 73 -3,-0.4 -1,-0.7 -4,-0.3 2,-0.1 -0.489 62.3 168.0 -78.9 153.0 -89.7 23.3 58.4 18 20 A T - 0 0 62 -2,-0.1 2,-0.6 -3,-0.1 3,-0.1 -0.530 26.4-173.9-170.4 97.9 -90.3 26.7 59.9 19 21 A Y S S+ 0 0 103 1,-0.2 73,-0.2 -2,-0.1 72,-0.1 -0.108 86.3 51.0 -85.4 40.3 -87.8 28.9 61.7 20 22 A F S >S- 0 0 27 -2,-0.6 5,-0.8 68,-0.0 4,-0.2 -0.391 93.2-119.9-175.9 86.4 -90.6 31.3 62.6 21 23 A D T >>5 - 0 0 91 3,-0.2 3,-4.0 -3,-0.1 4,-1.0 0.103 41.0 -98.3 -30.0 139.4 -93.8 30.0 64.3 22 24 A R H 3>5S+ 0 0 198 1,-0.3 4,-1.0 2,-0.2 5,-0.4 0.836 125.0 54.4 -29.2 -71.4 -96.9 30.6 62.1 23 25 A R H 345S+ 0 0 181 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.619 109.6 55.5 -46.6 -9.4 -98.0 33.8 64.0 24 26 A E H X>5S+ 0 0 39 -3,-4.0 3,-2.2 -4,-0.2 4,-1.5 0.927 97.0 54.9 -90.8 -57.8 -94.4 35.0 63.3 25 27 A I H 3X S+ 0 0 105 -3,-2.2 4,-1.6 -5,-0.4 -2,-0.2 0.994 101.3 39.1 -72.2 -64.0 -95.8 39.1 61.6 28 30 A W H X S+ 0 0 41 -4,-1.5 4,-1.7 1,-0.2 3,-0.3 0.913 111.5 63.6 -52.8 -40.8 -92.7 40.5 59.9 29 31 A H H >X S+ 0 0 12 -4,-1.8 4,-2.1 -5,-0.3 3,-2.0 0.955 99.5 49.6 -47.3 -61.1 -94.7 40.7 56.7 30 32 A K H 3X S+ 0 0 103 -4,-1.7 4,-1.5 1,-0.3 -1,-0.3 0.877 108.5 55.2 -47.4 -37.3 -97.1 43.2 58.1 31 33 A G H 3X S+ 0 0 10 -4,-1.6 4,-1.8 -3,-0.3 -1,-0.3 0.828 106.0 53.5 -66.2 -28.1 -94.0 45.1 59.2 32 34 A F H < - 0 0 19 -4,-2.7 3,-1.7 -5,-0.2 -1,-0.3 -0.751 57.3-159.6-164.7 112.2 -93.2 49.6 51.8 37 39 A P T 3 S+ 0 0 79 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.809 98.3 58.7 -63.1 -29.3 -96.8 48.9 50.7 38 40 A S T 3 S- 0 0 76 2,-0.2 -5,-0.1 -5,-0.1 3,-0.1 0.297 115.1-117.3 -83.7 12.9 -95.4 47.6 47.4 39 41 A G S < S+ 0 0 4 -3,-1.7 2,-0.3 1,-0.2 41,-0.2 0.963 72.4 130.0 51.5 57.3 -93.4 45.0 49.3 40 42 A Q - 0 0 71 -8,-0.2 2,-0.8 39,-0.1 39,-0.2 -0.901 42.4-163.3-146.8 115.3 -90.1 46.3 48.1 41 43 A L E -A 78 0A 1 37,-2.2 37,-2.9 -2,-0.3 2,-0.2 -0.851 16.3-164.6-101.8 108.7 -87.1 47.2 50.2 42 44 A A E >> -A 77 0A 29 -2,-0.8 4,-2.1 35,-0.2 3,-0.5 -0.495 34.0-105.0 -89.6 161.2 -84.6 49.4 48.4 43 45 A R H 3> S+ 0 0 112 33,-0.6 4,-3.8 1,-0.2 5,-0.4 0.922 117.0 62.8 -48.2 -52.6 -81.0 50.1 49.3 44 46 A E H 3> S+ 0 0 160 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.902 108.8 42.1 -40.8 -52.2 -81.9 53.6 50.6 45 47 A D H X> S+ 0 0 50 -3,-0.5 4,-1.6 2,-0.2 3,-1.3 0.988 114.2 49.0 -62.1 -59.6 -84.1 52.1 53.2 46 48 A F H >X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.3 3,-0.7 0.921 107.8 56.7 -45.6 -48.1 -81.8 49.3 54.2 47 49 A V H 3X S+ 0 0 39 -4,-3.8 4,-2.4 1,-0.3 -1,-0.3 0.866 104.5 53.3 -53.8 -35.8 -79.0 51.9 54.5 48 50 A K H + 0 0 53 70,-0.8 3,-0.8 67,-0.1 4,-0.3 -0.582 50.0 164.9-132.0 71.4 -69.9 54.9 58.6 59 61 A P T 3> + 0 0 3 0, 0.0 4,-1.6 0, 0.0 3,-0.5 0.503 50.7 106.8 -64.8 -1.7 -71.4 51.4 58.5 60 62 A E H >> S+ 0 0 107 1,-0.3 3,-2.1 2,-0.2 4,-2.1 0.930 72.8 53.0 -42.6 -63.2 -72.8 52.5 55.2 61 63 A D H <> S+ 0 0 79 -3,-0.8 4,-1.8 1,-0.3 -1,-0.3 0.883 109.0 50.7 -42.0 -45.9 -70.4 50.3 53.2 62 64 A F H 3> S+ 0 0 2 -3,-0.5 4,-2.0 -4,-0.3 -1,-0.3 0.792 108.5 53.3 -65.6 -25.5 -71.6 47.4 55.3 63 65 A A H > - 0 0 51 -2,-0.7 4,-2.2 -39,-0.2 3,-0.7 -0.527 31.8-104.8 -89.7 160.2 -88.7 41.4 48.7 80 82 A F H 3> S+ 0 0 3 -41,-0.2 4,-2.0 1,-0.2 5,-0.5 0.925 117.7 62.9 -48.1 -51.9 -90.2 40.0 51.9 81 83 A E H 3> S+ 0 0 92 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.884 109.2 40.9 -41.8 -48.3 -89.5 36.4 50.9 82 84 A E H <> S+ 0 0 11 -3,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.928 114.8 52.3 -69.8 -43.9 -85.8 37.2 50.9 83 85 A F H >X S+ 0 0 3 -4,-2.2 4,-2.5 2,-0.2 3,-1.0 0.987 112.4 41.2 -55.7 -67.9 -85.9 39.3 54.1 84 86 A I H 3X S+ 0 0 8 -4,-2.0 4,-1.7 1,-0.3 5,-0.2 0.913 108.2 62.4 -48.2 -48.6 -87.7 36.8 56.3 85 87 A T H 3X S+ 0 0 63 -4,-1.6 4,-1.8 -5,-0.5 -1,-0.3 0.894 111.4 38.9 -45.9 -43.4 -85.7 33.9 54.9 86 88 A V H < S+ 0 0 10 -4,-1.7 3,-2.3 -5,-0.2 4,-0.5 0.962 115.7 43.8 -83.9 -65.6 -84.3 33.1 60.4 89 91 A T H 3< S+ 0 0 32 -4,-1.8 -2,-0.2 1,-0.3 -3,-0.2 0.901 107.6 63.5 -46.6 -43.9 -81.0 31.7 59.1 90 92 A T T 3< S+ 0 0 23 -4,-3.3 -1,-0.3 -5,-0.2 -2,-0.2 0.841 118.4 26.2 -50.8 -33.3 -79.4 34.7 60.7 91 93 A S S < S+ 0 0 21 -3,-2.3 2,-0.2 -5,-0.4 -2,-0.2 0.791 130.3 3.6 -94.7 -92.6 -80.6 33.4 64.0 92 94 A R + 0 0 147 -4,-0.5 -1,-0.3 -73,-0.2 -73,-0.1 -0.507 56.3 145.2 -93.7 165.6 -81.1 29.6 64.2 93 95 A G - 0 0 8 -2,-0.2 -1,-0.1 -3,-0.1 3,-0.1 0.298 43.2-140.7-168.2 -28.6 -80.4 27.1 61.5 94 96 A T S S+ 0 0 134 1,-0.2 2,-0.3 -5,-0.1 -2,-0.1 0.741 79.6 74.6 60.1 19.8 -79.2 23.8 63.1 95 97 A L S > S- 0 0 111 0, 0.0 3,-1.0 0, 0.0 -1,-0.2 -0.985 102.3 -94.0-155.7 163.0 -76.7 23.6 60.2 96 98 A E T >> S+ 0 0 86 -2,-0.3 4,-1.6 1,-0.3 3,-1.5 0.343 82.2 123.6 -64.0 14.4 -73.5 25.1 58.9 97 99 A E H 3> + 0 0 63 1,-0.3 4,-3.0 2,-0.2 -1,-0.3 0.770 63.6 67.3 -47.9 -23.0 -75.8 27.4 57.0 98 100 A K H <> S+ 0 0 87 -3,-1.0 4,-2.1 2,-0.2 -1,-0.3 0.937 98.7 46.6 -65.6 -45.5 -73.9 30.1 58.7 99 101 A L H <> S+ 0 0 31 -3,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.901 115.3 48.2 -63.7 -38.6 -70.7 29.4 56.9 100 102 A S H X S+ 0 0 36 -4,-1.6 4,-1.7 2,-0.2 3,-0.3 0.974 109.3 50.0 -66.2 -54.1 -72.6 29.2 53.6 101 103 A W H X S+ 0 0 45 -4,-3.0 4,-1.5 1,-0.3 -1,-0.2 0.902 109.6 53.9 -51.5 -41.1 -74.5 32.5 54.1 102 104 A A H X S+ 0 0 7 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.3 0.921 100.8 59.8 -60.8 -42.9 -71.2 34.1 54.9 103 105 A F H < S+ 0 0 4 -4,-1.8 -1,-0.2 -3,-0.3 4,-0.2 0.935 102.2 52.5 -51.0 -49.9 -69.7 32.9 51.6 104 106 A E H >< S+ 0 0 77 -4,-1.7 3,-1.2 1,-0.2 -1,-0.2 0.907 110.3 49.0 -54.3 -41.8 -72.4 34.8 49.7 105 107 A L H 3< S+ 0 0 0 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.918 107.1 53.7 -65.5 -42.8 -71.5 37.9 51.6 106 108 A Y T 3< S+ 0 0 14 -4,-2.7 9,-0.5 1,-0.2 2,-0.3 0.358 104.3 65.0 -74.7 10.3 -67.7 37.5 51.0 107 109 A D X + 0 0 2 -3,-1.2 3,-2.5 -4,-0.2 -1,-0.2 -0.642 56.9 177.0-134.7 79.2 -68.5 37.3 47.2 108 110 A L T 3 S+ 0 0 44 1,-0.3 -1,-0.2 -2,-0.3 -2,-0.1 0.924 91.5 46.0 -45.4 -52.8 -69.9 40.5 45.9 109 111 A N T 3 S- 0 0 64 4,-0.1 -1,-0.3 1,-0.1 5,-0.1 0.617 96.0-152.1 -67.8 -8.3 -70.0 39.0 42.4 110 112 A H < + 0 0 117 -3,-2.5 -2,-0.1 -6,-0.2 -1,-0.1 0.820 41.1 151.8 39.4 35.2 -71.6 36.0 44.1 111 113 A D S S- 0 0 69 2,-0.6 -1,-0.2 1,-0.1 3,-0.1 0.070 75.5 -98.1 -82.8 28.8 -70.0 34.1 41.2 112 114 A G S S+ 0 0 37 -5,-0.2 52,-0.8 1,-0.1 2,-0.4 0.305 108.9 77.3 74.5 -14.4 -69.7 31.0 43.4 113 115 A Y E S-B 163 0B 110 50,-0.2 -2,-0.6 51,-0.1 50,-0.2 -0.988 74.5-138.9-131.7 137.6 -66.2 32.1 43.9 114 116 A I E -B 162 0B 0 48,-2.5 48,-0.7 -2,-0.4 2,-0.4 -0.445 16.3-146.9 -87.9 163.2 -64.8 34.9 46.1 115 117 A T E >> -B 161 0B 32 -9,-0.5 4,-2.4 46,-0.2 3,-1.5 -0.998 24.9-121.4-136.0 139.5 -62.0 37.2 45.1 116 118 A F H 3> S+ 0 0 118 44,-1.3 4,-1.8 -2,-0.4 5,-0.2 0.830 118.8 55.8 -43.6 -33.0 -59.2 38.9 47.0 117 119 A D H 3> S+ 0 0 96 2,-0.2 4,-1.7 1,-0.1 -1,-0.3 0.896 111.0 42.5 -69.0 -38.3 -60.7 42.1 45.7 118 120 A E H <> S+ 0 0 7 -3,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.968 110.3 54.0 -72.5 -53.7 -64.1 41.2 47.2 119 121 A M H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.931 110.2 48.8 -45.5 -53.2 -62.8 39.9 50.5 120 122 A L H X S+ 0 0 54 -4,-1.8 4,-3.8 -5,-0.3 5,-0.4 0.945 104.4 59.9 -53.7 -50.9 -61.0 43.1 51.1 121 123 A T H X S+ 0 0 48 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.923 112.6 37.9 -43.3 -56.3 -64.1 45.2 50.2 122 124 A I H >X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 3,-1.5 0.989 115.2 51.5 -61.7 -60.3 -66.0 43.6 53.0 123 125 A V H 3X S+ 0 0 3 -4,-2.6 4,-1.2 1,-0.3 -1,-0.2 0.891 108.9 53.2 -43.4 -45.6 -63.2 43.4 55.5 124 126 A A H 3X S+ 0 0 32 -4,-3.8 4,-1.7 -5,-0.3 -1,-0.3 0.863 107.3 53.4 -60.6 -33.5 -62.6 47.1 54.8 125 127 A S H << S+ 0 0 4 -3,-1.5 3,-0.4 -4,-1.4 -63,-0.2 0.978 107.3 47.1 -66.0 -55.3 -66.3 47.7 55.6 126 128 A V H X S+ 0 0 5 -4,-2.0 4,-0.6 1,-0.2 3,-0.5 0.719 108.8 60.8 -59.9 -17.2 -66.3 46.0 59.0 127 129 A Y H < S+ 0 0 42 -4,-1.2 2,-1.3 -5,-0.4 -1,-0.2 0.929 101.6 49.6 -75.7 -45.5 -63.1 48.1 59.6 128 130 A K T < S+ 0 0 139 -4,-1.7 -70,-0.8 -3,-0.4 -1,-0.2 -0.387 104.7 64.5 -90.6 58.6 -64.8 51.4 59.2 129 131 A M T 4 S+ 0 0 23 -2,-1.3 -72,-0.6 1,-0.5 -2,-0.1 0.407 97.1 20.7-137.5 -75.5 -67.7 50.7 61.6 130 132 A M < - 0 0 43 -4,-0.6 -1,-0.5 -74,-0.1 -72,-0.1 -0.305 67.5-122.2 -95.0-176.9 -67.0 50.0 65.2 131 133 A G S >> S+ 0 0 37 1,-0.1 3,-4.0 2,-0.1 4,-0.5 0.678 92.9 87.7 -99.4 -22.2 -64.0 51.0 67.4 132 134 A S H >> S+ 0 0 48 1,-0.3 4,-1.5 2,-0.2 3,-0.8 0.874 72.9 75.1 -43.6 -41.8 -63.0 47.5 68.5 133 135 A M H 34 S+ 0 0 17 1,-0.3 -1,-0.3 -7,-0.2 4,-0.2 0.736 90.9 60.7 -45.9 -19.1 -60.9 47.3 65.3 134 136 A V H X4 S+ 0 0 111 -3,-4.0 3,-2.5 1,-0.2 -1,-0.3 0.947 96.2 53.5 -75.9 -49.9 -58.7 49.6 67.3 135 137 A T H X< S+ 0 0 100 -3,-0.8 3,-0.9 -4,-0.5 -2,-0.2 0.817 86.8 85.2 -54.7 -27.7 -58.0 47.2 70.2 136 138 A L T 3< + 0 0 27 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.801 55.3 119.8 -43.5 -30.1 -57.0 44.8 67.5 137 139 A N T < + 0 0 140 -3,-2.5 -1,-0.2 -4,-0.2 -2,-0.1 0.532 42.4 94.3 -1.5 -68.1 -53.5 46.5 67.8 138 140 A E S < S- 0 0 142 -3,-0.9 3,-0.1 3,-0.0 -1,-0.0 -0.128 109.8 -40.9 -41.3 104.3 -51.8 43.3 68.8 139 141 A D S S+ 0 0 93 1,-0.1 0, 0.0 0, 0.0 0, 0.0 0.015 108.9 77.4 59.6-175.5 -50.6 42.2 65.4 140 142 A E - 0 0 32 5,-0.0 2,-0.3 6,-0.0 -1,-0.1 0.097 54.0-175.9 63.8 173.6 -52.8 42.6 62.3 141 143 A A + 0 0 39 1,-0.4 5,-0.2 2,-0.1 -5,-0.0 -0.852 41.4 1.8-172.7-152.0 -53.3 45.9 60.6 142 144 A T S >> S- 0 0 69 -2,-0.3 4,-1.4 1,-0.1 3,-1.2 -0.051 77.9-103.4 -47.7 159.5 -55.1 47.6 57.8 143 145 A P H 3> S+ 0 0 19 0, 0.0 4,-2.3 0, 0.0 5,-0.3 0.921 115.6 73.0 -55.0 -47.7 -57.5 45.3 56.0 144 146 A E H 3> S+ 0 0 109 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.813 104.6 41.8 -37.2 -38.9 -55.1 44.9 53.0 145 147 A M H <> S+ 0 0 98 -3,-1.2 4,-2.8 2,-0.2 5,-0.3 0.969 107.3 58.0 -76.3 -55.8 -53.0 42.8 55.2 146 148 A R H X S+ 0 0 3 -4,-1.4 4,-2.5 1,-0.2 -2,-0.2 0.877 112.7 42.5 -39.9 -49.1 -55.8 40.8 57.0 147 149 A V H X S+ 0 0 6 -4,-2.3 4,-2.3 2,-0.2 5,-0.4 0.974 109.3 54.9 -66.6 -54.0 -57.0 39.6 53.5 148 150 A K H X S+ 0 0 145 -4,-1.6 4,-1.6 -5,-0.3 -1,-0.2 0.889 114.1 44.4 -46.7 -40.3 -53.5 38.9 52.1 149 151 A K H X S+ 0 0 41 -4,-2.8 4,-0.9 2,-0.2 -1,-0.2 0.933 111.1 53.2 -71.4 -45.4 -53.0 36.7 55.1 150 152 A I H >X S+ 0 0 15 -4,-2.5 4,-4.6 -5,-0.3 3,-2.4 0.978 109.4 46.4 -53.7 -63.0 -56.4 35.0 55.0 151 153 A F H 3X S+ 0 0 22 -4,-2.3 4,-1.6 1,-0.3 7,-0.2 0.931 114.0 48.6 -45.9 -51.6 -56.1 33.9 51.4 152 154 A K H 3< S+ 0 0 171 -4,-1.6 -1,-0.3 -5,-0.4 -2,-0.2 0.666 120.8 40.0 -64.6 -12.1 -52.6 32.6 52.1 153 155 A L H << S+ 0 0 44 -3,-2.4 -2,-0.3 -4,-0.9 -1,-0.2 0.772 125.1 32.9-104.0 -37.2 -54.2 30.9 55.1 154 156 A M H < S+ 0 0 24 -4,-4.6 16,-0.3 1,-0.2 2,-0.2 0.275 122.3 48.5-102.9 10.4 -57.5 29.7 53.6 155 157 A D >< + 0 0 6 -4,-1.6 3,-0.7 -5,-0.4 -1,-0.2 -0.645 47.2 163.1-152.1 90.4 -56.2 29.1 50.1 156 158 A K T 3 S+ 0 0 133 1,-0.2 -4,-0.1 -2,-0.2 -1,-0.1 0.378 77.1 69.1 -88.2 6.3 -53.0 27.1 49.6 157 159 A N T 3 S- 0 0 70 0, 0.0 -1,-0.2 0, 0.0 -5,-0.1 0.543 91.7-144.8 -97.7 -10.2 -53.9 26.5 46.0 158 160 A E < + 0 0 166 -3,-0.7 -2,-0.1 -7,-0.2 4,-0.1 0.940 44.0 148.8 42.8 74.8 -53.3 30.2 45.1 159 161 A D - 0 0 44 2,-0.2 2,-2.4 -4,-0.0 -1,-0.1 0.129 61.6-118.3-120.8 17.7 -56.1 30.5 42.6 160 162 A G S S+ 0 0 36 -5,-0.1 -44,-1.3 -45,-0.1 2,-0.3 -0.156 94.7 47.5 75.0 -48.3 -57.0 34.1 43.1 161 163 A Y E S-B 115 0B 124 -2,-2.4 2,-0.3 -46,-0.2 -46,-0.2 -0.854 72.3-146.9-123.2 160.1 -60.5 33.1 44.2 162 164 A I E -B 114 0B 0 -48,-0.7 -48,-2.5 -2,-0.3 2,-0.3 -0.862 10.3-135.2-124.0 160.8 -61.9 30.5 46.5 163 165 A T E > -B 113 0B 34 -2,-0.3 4,-3.6 -50,-0.2 5,-0.3 -0.757 32.1-102.9-114.4 160.6 -65.1 28.4 46.4 164 166 A L H > S+ 0 0 70 -52,-0.8 4,-2.9 -2,-0.3 5,-0.2 0.873 120.2 59.5 -46.6 -39.9 -67.6 27.5 49.1 165 167 A D H > S+ 0 0 115 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.981 114.0 32.0 -55.3 -62.4 -65.9 24.1 49.3 166 168 A E H > S+ 0 0 20 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.875 115.1 61.8 -65.5 -34.9 -62.5 25.4 50.3 167 169 A F H X S+ 0 0 12 -4,-3.6 4,-1.5 1,-0.2 -1,-0.2 0.952 104.3 48.5 -55.9 -48.6 -64.0 28.3 52.1 168 170 A R H X S+ 0 0 91 -4,-2.9 4,-2.9 -5,-0.3 3,-0.4 0.961 113.7 45.9 -56.2 -54.3 -65.8 25.9 54.5 169 171 A E H X S+ 0 0 110 -4,-1.8 4,-1.3 1,-0.3 -2,-0.2 0.978 108.6 53.3 -53.6 -63.5 -62.6 23.9 55.1 170 172 A G H < S+ 0 0 12 -4,-2.6 -1,-0.3 -16,-0.3 -2,-0.2 0.812 114.4 47.7 -42.6 -31.2 -60.3 26.9 55.7 171 173 A S H >< S+ 0 0 28 -4,-1.5 3,-3.6 -3,-0.4 -2,-0.2 0.975 104.5 53.1 -76.7 -58.7 -63.0 27.9 58.2 172 174 A K H 3< S+ 0 0 153 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.629 102.0 67.6 -53.0 -8.8 -63.4 24.6 60.1 173 175 A V T 3< S+ 0 0 92 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.646 78.2 79.7 -87.0 -14.6 -59.6 24.8 60.5 174 176 A D < 0 0 56 -3,-3.6 -1,-0.2 1,-0.2 -2,-0.2 0.953 360.0 360.0 -56.7 -51.6 -59.8 27.9 62.8 175 177 A P 0 0 116 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.924 360.0 360.0 -61.1 360.0 -60.7 25.8 65.9 176 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 177 121 B A 0 0 134 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -1.1 -47.5 29.1 61.9 178 122 B S - 0 0 49 -25,-0.0 -25,-0.0 0, 0.0 -29,-0.0 0.287 360.0-144.7-165.9 -38.2 -50.3 31.4 61.0 179 123 B Y > + 0 0 161 1,-0.2 4,-0.6 3,-0.0 3,-0.3 0.820 46.2 147.9 62.7 29.0 -52.0 32.8 64.1 180 124 B G T 4 + 0 0 10 1,-0.2 4,-0.4 2,-0.1 -1,-0.2 -0.051 42.6 93.9 -86.1 36.1 -55.3 32.7 62.4 181 125 B F T > S+ 0 0 114 -2,-0.2 4,-1.9 2,-0.1 -1,-0.2 0.929 88.5 30.4 -90.2 -65.5 -57.0 32.0 65.7 182 126 B Q H >>S+ 0 0 119 -3,-0.3 4,-1.6 1,-0.2 5,-0.6 0.860 117.0 61.3 -63.7 -33.3 -58.1 35.4 67.0 183 127 B V H X5S+ 0 0 5 -4,-0.6 4,-1.4 1,-0.2 5,-0.3 0.939 106.2 44.5 -59.8 -46.4 -58.6 36.7 63.5 184 128 B A H >5S+ 0 0 21 -4,-0.4 4,-1.6 3,-0.2 -2,-0.2 0.944 118.8 41.9 -65.2 -47.8 -61.2 34.1 62.7 185 129 B R H X5S+ 0 0 180 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.999 119.1 39.0 -63.8 -70.2 -63.2 34.5 65.9 186 130 B R H >X5S+ 0 0 133 -4,-1.6 4,-1.7 2,-0.2 3,-0.7 0.921 115.7 53.9 -47.6 -52.8 -63.2 38.3 66.4 187 131 B V H 3X< S+ 0 0 14 -4,-1.7 3,-1.7 1,-0.3 -2,-0.2 0.899 110.0 60.3 -47.3 -44.7 -68.0 42.2 63.9 191 135 B L H 3< S+ 0 0 12 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.939 117.3 30.9 -48.8 -46.3 -69.4 40.7 60.7 192 136 B Q T << S- 0 0 61 -4,-1.8 -1,-0.3 -3,-0.9 -2,-0.3 0.321 126.2-123.0 -91.4 6.5 -72.3 39.6 62.9 193 137 B T < - 0 0 13 -3,-1.7 -3,-0.1 -4,-0.4 -2,-0.1 0.408 35.8 -61.8 64.4 153.1 -71.6 42.7 64.9 194 138 B N - 0 0 31 2,-0.1 31,-0.1 1,-0.1 3,-0.0 0.129 46.5-114.1 -54.3 179.6 -70.8 42.7 68.6 195 139 B L S S- 0 0 74 30,-0.1 2,-0.1 29,-0.1 30,-0.1 0.715 87.9 -18.2 -92.6 -23.3 -73.4 41.5 71.1 196 140 B F S S+ 0 0 148 1,-0.1 -2,-0.1 29,-0.0 3,-0.1 -0.413 76.1 113.6-148.5-134.4 -73.9 44.8 72.8 197 141 B N + 0 0 112 1,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.945 67.0 109.7 52.6 51.9 -72.3 48.2 73.1 198 142 B T S S- 0 0 49 1,-0.2 -1,-0.2 2,-0.1 -144,-0.1 -0.952 80.2 -40.9-158.5 135.6 -75.1 49.9 71.2 199 143 B S S S- 0 0 92 -2,-0.3 -1,-0.2 -146,-0.1 3,-0.1 -0.094 73.1-103.5 44.3-139.1 -77.9 52.3 72.1 200 144 B S - 0 0 126 1,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.377 69.4 -25.4-143.4 -68.9 -79.4 51.4 75.4 201 145 B G - 0 0 69 2,-0.0 2,-0.2 0, 0.0 -1,-0.2 -0.994 50.3-126.6-156.4 155.7 -82.8 49.7 75.4 202 146 B S + 0 0 83 -2,-0.3 2,-0.3 -3,-0.1 -3,-0.0 -0.638 28.8 164.6-103.4 163.3 -85.9 49.3 73.2 203 147 B D > - 0 0 118 -2,-0.2 2,-0.8 0, 0.0 3,-0.7 -0.934 49.9 -80.4-173.1 148.8 -89.6 49.8 74.0 204 148 B K T 3 S+ 0 0 171 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.374 93.9 92.2 -58.4 101.3 -93.0 50.3 72.5 205 149 B N T 3 + 0 0 105 -2,-0.8 -1,-0.2 1,-0.1 -3,-0.0 0.336 47.8 101.6-159.5 -39.9 -92.8 54.0 71.5 206 150 B V < + 0 0 78 -3,-0.7 -1,-0.1 1,-0.2 5,-0.0 -0.243 32.0 144.4 -58.4 146.2 -91.5 54.4 68.0 207 151 B K + 0 0 150 -3,-0.1 -1,-0.2 3,-0.0 4,-0.1 0.369 63.8 48.4-147.0 -62.9 -94.2 55.2 65.4 208 152 B I S S+ 0 0 155 2,-0.1 2,-0.1 3,-0.0 -2,-0.1 0.806 101.9 80.6 -60.5 -27.4 -93.3 57.6 62.6 209 153 B H S S- 0 0 110 1,-0.1 2,-0.1 2,-0.0 -174,-0.0 -0.380 97.9 -91.1 -77.8 159.7 -90.1 55.6 62.1 210 154 B E - 0 0 71 1,-0.1 3,-0.2 -2,-0.1 -1,-0.1 -0.385 22.8-147.5 -69.7 147.4 -90.1 52.3 60.1 211 155 B N S > S+ 0 0 43 -180,-0.3 4,-1.7 1,-0.2 5,-0.2 0.633 90.3 73.4 -89.9 -13.9 -90.7 49.1 62.1 212 156 B V H > S+ 0 0 7 -181,-0.3 4,-1.7 2,-0.2 5,-0.3 0.811 93.7 55.2 -69.5 -27.5 -88.4 47.0 59.8 213 157 B A H > S+ 0 0 3 2,-0.2 4,-1.9 -3,-0.2 5,-0.4 0.983 109.5 41.8 -69.4 -57.1 -85.3 48.7 61.3 214 158 B P H >>S+ 0 0 42 0, 0.0 4,-1.3 0, 0.0 5,-0.6 0.886 114.0 54.4 -57.8 -40.9 -86.0 47.9 65.0 215 159 B A H X5S+ 0 0 34 -4,-1.7 4,-1.8 3,-0.2 5,-0.4 0.964 114.6 37.8 -59.7 -53.6 -87.1 44.3 64.2 216 160 B L H X>S+ 0 0 0 -4,-1.7 4,-2.1 3,-0.2 5,-0.7 0.997 121.1 41.3 -62.5 -66.6 -84.0 43.4 62.2 217 161 B V H X5S+ 0 0 5 -4,-1.9 4,-2.2 -5,-0.3 5,-0.4 0.946 120.1 42.2 -47.1 -65.1 -81.3 45.1 64.2 218 162 B L H X5S+ 0 0 76 -4,-1.3 4,-1.7 -5,-0.4 5,-0.3 0.908 126.0 35.9 -52.2 -45.1 -82.7 44.3 67.7 219 163 B S H XXS+ 0 0 8 -4,-1.8 4,-3.4 -5,-0.6 5,-0.6 0.993 116.4 47.4 -73.5 -70.5 -83.5 40.7 66.6 220 164 B S H X5S+ 0 0 6 -4,-2.1 4,-1.0 -5,-0.4 -3,-0.2 0.817 120.4 43.7 -40.2 -37.8 -80.7 39.7 64.2 221 165 B M H X<5S+ 0 0 80 -4,-3.4 3,-1.0 -5,-0.3 -1,-0.2 0.847 108.9 52.6 -72.9 -32.2 -80.6 36.5 68.5 224 168 B S H 3<