==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-NOV-10 3PRT . COMPND 2 MOLECULE: CARBOXYPEPTIDASE T; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOACTINOMYCES VULGARIS; . AUTHOR V.I.TIMOFEEV,V.KH AKPAROV,A.M.GRISHIN,I.P.KURANOVA . 323 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12375.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 220 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 6.2 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 18 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 1 1 1 1 1 0 1 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 1 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 PARALLEL BRIDGES PER LADDER . 0 1 1 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 0 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 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 D 0 0 92 0, 0.0 122,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 168.3 54.8 -71.3 2.3 2 2 A F - 0 0 13 7,-0.2 5,-0.1 1,-0.1 122,-0.1 -0.327 360.0 -92.8 -56.8 144.7 55.4 -71.0 6.1 3 3 A P > - 0 0 14 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.283 40.8-109.6 -55.0 150.3 56.9 -74.1 7.7 4 4 A S G > S+ 0 0 109 1,-0.3 3,-1.5 2,-0.2 4,-0.1 0.811 118.8 61.1 -59.9 -31.8 54.1 -76.4 9.0 5 5 A Y G 3 S+ 0 0 159 1,-0.3 286,-0.3 2,-0.1 -1,-0.3 0.740 112.2 39.3 -65.8 -20.9 55.0 -75.6 12.6 6 6 A D G X S+ 0 0 3 -3,-2.0 3,-2.0 1,-0.1 -1,-0.3 -0.025 75.3 129.3-114.6 27.5 54.2 -71.9 11.8 7 7 A S T < + 0 0 80 -3,-1.5 4,-0.1 1,-0.3 -1,-0.1 0.657 56.1 78.7 -59.5 -18.0 51.1 -72.5 9.6 8 8 A G T 3 S+ 0 0 36 -3,-0.2 -1,-0.3 -4,-0.1 2,-0.1 0.695 75.0 92.5 -64.5 -20.9 49.1 -70.0 11.6 9 9 A Y S < S- 0 0 5 -3,-2.0 2,-0.6 1,-0.1 -7,-0.2 -0.463 82.8-119.4 -71.5 148.6 50.8 -67.2 9.8 10 10 A H - 0 0 56 63,-0.2 -2,-0.1 -2,-0.1 66,-0.1 -0.820 20.9-153.6 -92.7 120.2 49.0 -65.9 6.7 11 11 A N > - 0 0 24 -2,-0.6 4,-2.8 -4,-0.1 5,-0.2 -0.239 44.6 -84.8 -72.8 178.9 50.9 -66.1 3.4 12 12 A Y H > S+ 0 0 20 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.943 130.3 45.1 -57.3 -51.0 49.9 -63.6 0.7 13 13 A N H > S+ 0 0 103 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.901 114.3 49.3 -59.7 -41.3 47.0 -65.6 -0.7 14 14 A E H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.893 110.3 51.8 -65.6 -39.5 45.7 -66.4 2.8 15 15 A M H X S+ 0 0 1 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.937 110.8 47.1 -58.5 -50.3 46.0 -62.7 3.7 16 16 A V H X S+ 0 0 18 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.889 110.6 52.8 -60.7 -42.4 44.0 -61.7 0.6 17 17 A N H X S+ 0 0 99 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.899 110.5 47.6 -60.9 -41.0 41.3 -64.3 1.4 18 18 A K H X S+ 0 0 56 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.901 112.3 48.7 -66.4 -43.5 40.9 -63.0 4.9 19 19 A I H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.925 112.4 49.1 -59.5 -46.5 40.6 -59.4 3.7 20 20 A N H X S+ 0 0 54 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.871 109.1 52.8 -61.9 -38.3 38.1 -60.4 1.1 21 21 A T H X S+ 0 0 72 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.940 113.2 42.7 -64.0 -48.2 36.0 -62.4 3.7 22 22 A V H X S+ 0 0 5 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.927 113.6 51.3 -65.3 -45.3 35.8 -59.4 6.1 23 23 A A H < S+ 0 0 19 -4,-2.8 7,-0.2 1,-0.2 -1,-0.2 0.899 113.2 45.9 -59.6 -39.8 35.1 -56.9 3.3 24 24 A S H < S+ 0 0 81 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.854 113.6 49.7 -70.0 -35.8 32.3 -59.1 2.0 25 25 A N H < S+ 0 0 106 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.679 118.7 36.1 -77.5 -22.7 30.9 -59.7 5.5 26 26 A Y >X + 0 0 78 -4,-1.7 4,-2.0 -3,-0.1 3,-1.2 -0.403 65.6 152.8-128.6 58.4 30.8 -55.9 6.5 27 27 A P T 34 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 26,-0.1 0.729 70.1 61.4 -63.2 -23.3 29.9 -54.1 3.3 28 28 A N T 34 S+ 0 0 137 1,-0.2 25,-1.3 -3,-0.1 24,-0.3 0.802 121.9 19.2 -71.8 -27.2 28.3 -51.1 5.2 29 29 A I T <4 S+ 0 0 5 -3,-1.2 21,-2.3 23,-0.1 2,-0.4 0.471 115.0 68.6-124.6 -5.9 31.6 -50.2 6.9 30 30 A V E < +A 49 0A 7 -4,-2.0 2,-0.4 -7,-0.2 19,-0.2 -0.968 45.6 176.6-124.2 135.0 34.4 -51.8 4.9 31 31 A K E -A 48 0A 104 17,-2.3 17,-2.1 -2,-0.4 2,-0.3 -0.954 17.1-150.7-134.3 116.4 35.7 -51.1 1.4 32 32 A K E +A 47 0A 65 -2,-0.4 2,-0.3 15,-0.2 15,-0.3 -0.610 26.5 156.8 -81.5 142.2 38.7 -52.9 -0.1 33 33 A F E -A 46 0A 57 13,-2.6 13,-2.8 -2,-0.3 2,-0.4 -0.954 35.2-119.2-152.4 167.6 40.9 -51.1 -2.6 34 34 A S E -A 45 0A 38 -2,-0.3 11,-0.2 11,-0.2 3,-0.1 -0.948 4.7-160.7-113.6 137.1 44.5 -51.3 -4.0 35 35 A I E - 0 0 24 9,-2.5 2,-0.3 -2,-0.4 10,-0.1 0.455 67.5 -70.3 -89.4 -1.4 47.1 -48.6 -3.7 36 36 A G E - 0 0 23 8,-0.3 8,-3.1 149,-0.0 2,-0.4 -0.958 59.8 -58.3 147.6-164.0 49.1 -50.1 -6.5 37 37 A K E -A 43 0A 109 -2,-0.3 6,-0.2 6,-0.2 144,-0.1 -0.938 36.5-124.7-122.1 142.7 51.3 -53.1 -7.5 38 38 A S > - 0 0 5 4,-2.8 3,-1.3 -2,-0.4 74,-0.1 -0.144 47.0 -89.4 -64.9 172.5 54.6 -54.4 -6.1 39 39 A Y T 3 S+ 0 0 117 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.895 130.8 46.5 -53.5 -44.0 57.5 -54.8 -8.4 40 40 A E T 3 S- 0 0 102 1,-0.0 -1,-0.3 2,-0.0 -2,-0.0 0.455 126.6 -98.7 -83.0 -3.0 56.5 -58.4 -9.3 41 41 A G S < S+ 0 0 41 -3,-1.3 2,-0.3 1,-0.3 -2,-0.1 0.594 71.0 145.6 101.7 12.7 52.8 -57.3 -9.8 42 42 A R - 0 0 68 1,-0.1 -4,-2.8 3,-0.0 -1,-0.3 -0.612 54.1-106.3 -79.3 141.9 51.1 -58.2 -6.6 43 43 A E E -A 37 0A 54 -2,-0.3 2,-1.2 -6,-0.2 -6,-0.2 -0.417 17.4-135.1 -69.4 140.6 48.3 -55.9 -5.4 44 44 A L E - 0 0 0 -8,-3.1 -9,-2.5 -2,-0.1 -8,-0.3 -0.744 36.0-153.7 -95.1 85.4 49.0 -53.6 -2.5 45 45 A W E +A 34 0A 45 -2,-1.2 64,-1.2 -11,-0.2 65,-0.5 -0.290 22.9 164.4 -73.7 145.2 45.7 -54.2 -0.7 46 46 A A E -AB 33 108A 0 -13,-2.8 -13,-2.6 62,-0.2 2,-0.3 -0.944 19.9-148.8-145.0 160.5 44.0 -51.8 1.6 47 47 A V E -AB 32 107A 0 60,-1.7 60,-2.0 -2,-0.3 2,-0.4 -0.952 8.5-145.4-125.3 156.0 40.7 -51.2 3.3 48 48 A K E -AB 31 106A 14 -17,-2.1 -17,-2.3 -2,-0.3 2,-0.5 -0.967 18.8-163.4-106.8 135.0 38.8 -48.2 4.4 49 49 A I E +AB 30 105A 0 56,-3.2 56,-3.0 -2,-0.4 2,-0.3 -0.991 34.2 109.4-123.2 122.5 36.7 -48.8 7.5 50 50 A S > - 0 0 0 -21,-2.3 3,-0.7 -2,-0.5 51,-0.2 -0.910 69.8 -86.2-178.5 153.1 34.0 -46.2 8.4 51 51 A D T 3 S+ 0 0 31 49,-2.0 -22,-0.1 52,-0.3 -2,-0.0 -0.464 121.7 20.3 -65.0 149.7 30.2 -45.7 8.6 52 52 A N T > S+ 0 0 89 -24,-0.3 3,-1.8 1,-0.1 -1,-0.3 0.944 86.2 179.0 48.7 52.3 29.0 -44.6 5.2 53 53 A V T < + 0 0 11 -25,-1.3 -24,-0.1 -3,-0.7 -2,-0.1 0.765 66.5 63.0 -60.1 -29.2 32.3 -46.1 3.9 54 54 A G T 3 S+ 0 0 58 -26,-0.2 2,-0.4 -4,-0.1 -1,-0.3 0.512 97.3 64.6 -78.2 -6.8 31.6 -45.3 0.2 55 55 A T S < S- 0 0 75 -3,-1.8 2,-0.9 0, 0.0 0, 0.0 -0.953 83.5-122.4-119.6 142.2 31.6 -41.5 0.8 56 56 A D - 0 0 77 -2,-0.4 2,-0.2 2,-0.0 -3,-0.1 -0.712 38.7-170.1 -80.1 104.9 34.5 -39.2 1.9 57 57 A E - 0 0 56 -2,-0.9 2,-1.8 -5,-0.1 47,-0.1 -0.511 36.3-102.0 -93.3 164.0 33.2 -37.6 5.0 58 58 A N S S+ 0 0 155 -2,-0.2 -1,-0.0 45,-0.0 -2,-0.0 -0.589 79.2 124.2 -85.8 74.6 34.8 -34.7 6.9 59 59 A E S S- 0 0 20 -2,-1.8 44,-0.2 45,-0.0 2,-0.0 -0.940 70.9 -89.7-132.5 151.2 36.2 -36.9 9.6 60 60 A P - 0 0 22 0, 0.0 44,-2.4 0, 0.0 2,-0.3 -0.380 44.0-140.7 -62.2 140.4 39.7 -37.5 10.9 61 61 A E E -cd 104 197A 0 135,-2.2 137,-2.7 42,-0.2 138,-0.9 -0.821 15.7-167.3-107.5 147.3 41.6 -40.2 9.0 62 62 A V E -cd 105 199A 0 42,-2.2 44,-2.5 -2,-0.3 2,-0.4 -0.939 4.2-154.8-130.6 149.4 43.9 -42.8 10.5 63 63 A L E -cd 106 200A 0 136,-1.5 138,-2.1 -2,-0.3 2,-0.4 -0.994 9.9-176.5-131.6 136.7 46.3 -45.2 8.9 64 64 A Y E +cd 107 201A 1 42,-2.0 44,-2.9 -2,-0.4 2,-0.3 -0.998 14.2 177.2-123.4 133.6 47.8 -48.6 9.9 65 65 A T E -cd 108 202A 0 136,-2.3 138,-3.3 -2,-0.4 2,-0.3 -0.943 5.7-170.8-136.7 161.0 50.4 -50.3 7.8 66 66 A A E + d 0 203A 0 42,-1.4 45,-2.1 -2,-0.3 46,-0.3 -0.944 50.5 33.0-145.9 160.7 52.5 -53.5 7.9 67 67 A L + 0 0 1 136,-0.6 45,-0.8 5,-0.3 49,-0.2 0.860 44.3 149.3 58.7 48.3 55.4 -55.5 6.3 68 68 A H S S+ 0 0 0 135,-0.5 2,-0.5 43,-0.2 77,-0.4 0.863 77.9 53.0 -58.7 -38.0 57.8 -52.9 5.0 69 69 A H S > S- 0 0 4 1,-0.1 3,-1.9 3,-0.1 61,-0.2 -0.898 85.6-138.9-112.2 127.8 60.3 -55.6 5.8 70 70 A A T 3 S+ 0 0 0 59,-1.6 59,-0.2 -2,-0.5 -1,-0.1 0.784 97.6 50.2 -55.7 -41.6 59.8 -59.1 4.4 71 71 A R T 3 S+ 0 0 34 57,-1.3 2,-1.3 1,-0.2 -1,-0.3 0.521 85.8 89.9 -78.5 -5.0 60.8 -61.2 7.5 72 72 A E X + 0 0 3 -3,-1.9 3,-2.1 1,-0.2 4,-0.4 -0.312 46.6 153.7 -92.7 55.6 58.5 -59.3 9.9 73 73 A H T >> + 0 0 11 -2,-1.3 4,-1.3 214,-0.4 3,-1.0 0.725 58.4 72.3 -61.8 -29.2 55.5 -61.5 9.3 74 74 A L H 3> S+ 0 0 2 213,-0.3 4,-1.6 -3,-0.3 -1,-0.3 0.791 90.2 64.7 -55.9 -25.7 53.9 -60.8 12.7 75 75 A T H <> S+ 0 0 0 -3,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.853 96.5 53.0 -68.7 -35.1 53.0 -57.4 11.4 76 76 A V H <> S+ 0 0 4 -3,-1.0 4,-2.3 -4,-0.4 -1,-0.2 0.912 109.3 50.3 -63.8 -40.7 50.7 -58.8 8.7 77 77 A E H X S+ 0 0 10 -4,-1.3 4,-2.3 1,-0.2 -2,-0.2 0.850 108.4 53.4 -62.6 -35.6 48.9 -60.6 11.5 78 78 A M H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.892 108.6 48.2 -65.7 -41.9 48.7 -57.3 13.4 79 79 A A H X S+ 0 0 1 -4,-2.1 4,-2.0 30,-0.2 -2,-0.2 0.901 112.7 48.6 -65.5 -40.7 47.1 -55.6 10.4 80 80 A L H X S+ 0 0 6 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.888 110.2 51.9 -67.7 -37.0 44.6 -58.5 10.0 81 81 A Y H X S+ 0 0 51 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.911 107.6 52.5 -61.7 -42.8 43.8 -58.3 13.8 82 82 A T H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.905 107.4 52.3 -60.2 -43.7 43.2 -54.5 13.4 83 83 A L H X S+ 0 0 0 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.924 112.8 44.3 -56.6 -48.1 40.7 -55.3 10.6 84 84 A D H X>S+ 0 0 31 -4,-2.1 4,-2.6 1,-0.2 5,-0.5 0.883 108.2 60.3 -62.8 -41.3 38.9 -57.7 12.8 85 85 A L H X5S+ 0 0 6 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.909 109.7 38.7 -55.7 -48.4 39.0 -55.3 15.8 86 86 A F H <5S+ 0 0 0 -4,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.687 125.0 38.8 -79.4 -18.4 37.0 -52.5 14.1 87 87 A T H ><5S+ 0 0 1 -4,-1.0 3,-1.1 -3,-0.2 -2,-0.2 0.889 112.0 48.4 -98.6 -50.7 34.6 -54.9 12.3 88 88 A Q H 3<5S+ 0 0 102 -4,-2.6 -3,-0.2 1,-0.3 -2,-0.1 0.789 117.5 44.7 -63.4 -29.0 33.7 -57.7 14.7 89 89 A N T >X S+ 0 0 93 -2,-0.5 4,-3.0 1,-0.2 5,-0.2 0.894 94.1 52.8 -62.1 -39.8 30.3 -48.6 22.1 95 95 A R H > S+ 0 0 80 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.942 114.2 40.3 -62.4 -49.8 33.9 -47.3 22.0 96 96 A I H > S+ 0 0 6 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.911 115.2 53.4 -65.7 -42.7 34.8 -49.1 18.8 97 97 A T H X S+ 0 0 12 -4,-2.7 4,-2.5 -8,-0.3 -2,-0.2 0.926 108.2 50.0 -55.7 -48.5 31.4 -48.3 17.3 98 98 A N H < S+ 0 0 98 -4,-3.0 4,-0.4 2,-0.2 -1,-0.2 0.844 110.8 50.5 -60.8 -35.4 31.9 -44.6 18.1 99 99 A L H >X S+ 0 0 10 -4,-1.7 3,-1.2 2,-0.2 4,-1.1 0.951 111.6 45.5 -67.3 -49.9 35.4 -44.7 16.4 100 100 A V H 3< S+ 0 0 0 -4,-2.7 -49,-2.0 1,-0.3 3,-0.4 0.885 113.4 51.9 -61.3 -36.8 34.0 -46.3 13.2 101 101 A N T 3< S+ 0 0 43 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.564 122.6 29.4 -74.7 -10.3 31.1 -43.8 13.2 102 102 A N T <4 S+ 0 0 81 -3,-1.2 2,-0.3 -4,-0.4 -2,-0.2 0.273 114.4 55.8-136.9 9.6 33.5 -40.8 13.6 103 103 A R < - 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0 0 8 -42,-1.9 2,-0.3 -2,-0.2 3,-0.2 -0.975 8.1-168.1-142.0 130.6 68.0 -43.9 9.9 258 258 A D + 0 0 0 -100,-1.2 -105,-0.1 -2,-0.3 -106,-0.1 -0.879 66.4 34.1-118.9 155.7 67.1 -41.7 6.9 259 259 A G S S+ 0 0 0 -108,-0.9 -110,-3.0 -2,-0.3 -1,-0.2 0.667 80.7 152.2 77.0 18.3 64.4 -42.2 4.3 260 260 A G > - 0 0 5 -3,-0.2 4,-1.8 -109,-0.2 -109,-0.2 -0.432 55.5-117.0 -80.3 157.1 62.0 -43.8 6.7 261 261 A M H > S+ 0 0 0 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.887 111.9 48.0 -61.9 -40.5 58.2 -43.8 6.4 262 262 A D H > S+ 0 0 5 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.871 107.4 53.8 -76.3 -32.4 57.5 -41.9 9.6 263 263 A D H > S+ 0 0 0 2,-0.2 4,-2.8 3,-0.2 5,-0.2 0.873 116.0 42.4 -58.2 -40.1 60.1 -39.2 8.9 264 264 A W H X>S+ 0 0 7 -4,-1.8 4,-2.9 2,-0.2 5,-0.7 0.938 112.7 51.1 -71.0 -47.9 58.3 -38.7 5.6 265 265 A A H X5S+ 0 0 0 -4,-3.4 6,-1.9 1,-0.2 4,-1.0 0.912 123.6 31.6 -57.3 -43.2 54.8 -38.9 7.1 266 266 A Y H X5S+ 0 0 0 -4,-2.3 4,-1.9 4,-0.3 -2,-0.2 0.918 121.8 48.3 -80.3 -46.4 55.7 -36.3 9.7 267 267 A G H <5S+ 0 0 12 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.912 124.7 28.7 -60.3 -45.4 58.2 -34.3 7.7 268 268 A Q H <5S+ 0 0 114 -4,-2.9 -1,-0.2 -5,-0.2 -3,-0.2 0.812 140.5 16.1 -87.3 -33.3 56.1 -33.9 4.6 269 269 A H H < S- 0 0 50 2,-0.2 4,-1.8 4,-0.1 -75,-0.1 -0.794 91.4 -91.1-136.8 174.2 65.6 -60.2 21.4 283 283 A Y T 4 S+ 0 0 174 -2,-0.2 4,-0.2 2,-0.2 -1,-0.0 0.640 95.9 91.7 -64.3 -21.4 67.2 -62.2 18.6 284 284 A N T 4 S+ 0 0 134 1,-0.3 -2,-0.2 2,-0.1 -1,-0.2 -0.961 114.3 0.9-110.6 111.6 65.6 -65.5 19.9 285 285 A P T >4 S+ 0 0 46 0, 0.0 3,-2.2 0, 0.0 -1,-0.3 -0.987 103.5 155.9 -87.8 1.2 63.0 -65.8 18.5 286 286 A G T 3< S- 0 0 3 -4,-1.8 -80,-0.1 1,-0.3 -2,-0.1 -0.204 74.1 -3.6 56.6-127.8 63.8 -62.5 16.7 287 287 A F T 3 S+ 0 0 46 1,-0.2 -214,-0.4 -4,-0.2 -213,-0.3 0.572 132.6 59.0 -76.2 -7.7 62.0 -62.2 13.4 288 288 A Y < + 0 0 43 -3,-2.2 -1,-0.2 -216,-0.1 -2,-0.1 -0.492 64.3 173.3-127.4 65.2 60.4 -65.6 13.6 289 289 A P - 0 0 1 0, 0.0 5,-0.1 0, 0.0 -5,-0.0 -0.417 45.7 -94.6 -67.2 147.1 58.2 -66.0 16.8 290 290 A P > - 0 0 52 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.301 32.4-116.3 -59.8 144.8 56.2 -69.3 16.9 291 291 A D G > S+ 0 0 44 -286,-0.3 3,-1.5 1,-0.3 4,-0.4 0.713 107.5 78.8 -60.6 -18.2 52.6 -69.0 15.6 292 292 A E G 3 S+ 0 0 161 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.722 91.5 52.8 -58.5 -23.5 51.3 -69.8 19.1 293 293 A V G <> S+ 0 0 2 -3,-2.1 4,-3.2 1,-0.2 5,-0.3 0.522 81.9 94.0 -91.0 -6.9 52.1 -66.1 20.2 294 294 A I H <> S+ 0 0 23 -3,-1.5 4,-1.8 -4,-0.2 5,-0.3 0.910 86.0 44.2 -55.3 -53.5 50.1 -64.4 17.3 295 295 A G H > S+ 0 0 47 -4,-0.4 4,-2.2 1,-0.2 5,-0.2 0.934 119.1 44.5 -57.7 -47.5 46.8 -63.9 19.1 296 296 A R H > S+ 0 0 128 -4,-0.3 4,-1.4 1,-0.2 -2,-0.2 0.923 115.1 45.0 -63.3 -47.6 48.5 -62.7 22.2 297 297 A E H < S+ 0 0 6 -4,-3.2 -18,-0.2 2,-0.2 -1,-0.2 0.656 116.8 45.0 -81.4 -15.4 51.1 -60.4 20.6 298 298 A T H >< S+ 0 0 5 -4,-1.8 3,-2.2 -5,-0.3 -2,-0.2 0.905 113.8 46.9 -83.6 -54.4 48.6 -58.8 18.2 299 299 A S H >< S+ 0 0 54 -4,-2.2 3,-2.1 -5,-0.3 4,-0.3 0.753 97.1 76.4 -59.4 -24.5 45.8 -58.2 20.8 300 300 A R T 3< S+ 0 0 66 -4,-1.4 3,-0.3 1,-0.3 -1,-0.3 0.809 95.5 48.6 -51.7 -33.8 48.5 -56.8 23.1 301 301 A N T <> S+ 0 0 0 -3,-2.2 4,-2.6 1,-0.2 -1,-0.3 0.284 78.6 107.6 -94.4 9.4 48.3 -53.7 20.9 302 302 A K H <> S+ 0 0 84 -3,-2.1 4,-2.1 1,-0.2 5,-0.2 0.925 80.8 44.9 -52.8 -53.9 44.5 -53.3 21.0 303 303 A E H > S+ 0 0 75 -4,-0.3 4,-2.5 -3,-0.3 -1,-0.2 0.891 113.7 50.4 -62.8 -38.5 44.4 -50.3 23.3 304 304 A A H > S+ 0 0 0 -4,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.902 109.2 51.7 -64.6 -42.4 47.2 -48.5 21.4 305 305 A V H X S+ 0 0 0 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.911 113.1 44.4 -60.3 -42.8 45.4 -49.1 18.1 306 306 A L H X S+ 0 0 3 -4,-2.1 4,-2.9 -5,-0.2 -2,-0.2 0.908 110.1 56.6 -69.9 -39.7 42.2 -47.6 19.5 307 307 A Y H X S+ 0 0 24 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.911 106.2 47.7 -58.5 -48.0 44.1 -44.7 21.1 308 308 A V H X S+ 0 0 0 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.875 113.2 49.7 -64.3 -34.4 45.7 -43.5 17.8 309 309 A A H >< S+ 0 0 0 -4,-1.4 3,-0.7 -5,-0.2 4,-0.3 0.937 113.0 46.9 -64.3 -47.3 42.3 -43.7 16.1 310 310 A E H >< S+ 0 0 65 -4,-2.9 3,-1.4 1,-0.2 4,-0.3 0.924 110.5 51.4 -58.6 -47.4 40.8 -41.7 19.0 311 311 A K H 3< S+ 0 0 39 -4,-2.9 -1,-0.2 1,-0.3 6,-0.2 0.591 86.1 85.1 -74.0 -10.7 43.5 -39.0 19.0 312 312 A A T << S+ 0 0 0 -4,-0.7 -1,-0.3 -3,-0.7 -251,-0.2 0.780 80.3 67.5 -57.6 -27.1 43.2 -38.4 15.3 313 313 A D S < S- 0 0 102 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.995 131.1 -13.4 -58.6 -68.9 40.4 -36.0 16.1 314 314 A a > - 0 0 21 -4,-0.3 3,-2.3 1,-0.1 4,-0.3 -0.763 66.0-178.1-135.3 91.0 42.6 -33.4 17.8 315 315 A P G > S+ 0 0 6 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.832 83.1 64.9 -58.6 -31.9 46.0 -34.9 18.6 316 316 A Y G > >S+ 0 0 61 1,-0.3 5,-2.1 2,-0.2 3,-0.8 0.542 81.3 80.5 -68.2 -8.7 47.0 -31.6 20.3 317 317 A S G X 5S+ 0 0 59 -3,-2.3 3,-0.6 3,-0.2 -1,-0.3 0.786 79.4 67.7 -65.8 -27.8 44.3 -32.3 22.9 318 318 A V G < 5S+ 0 0 34 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.740 107.5 38.2 -67.0 -23.8 46.7 -34.7 24.7 319 319 A I G < 5S- 0 0 51 -3,-0.8 -1,-0.3 -4,-0.2 -2,-0.2 0.386 127.2-102.6-103.0 -2.1 48.9 -31.6 25.6 320 320 A G T < 5S+ 0 0 67 -3,-0.6 -3,-0.2 -4,-0.3 2,-0.1 0.352 76.3 131.7 102.6 -3.6 45.8 -29.5 26.2 321 321 A K < - 0 0 111 -5,-2.1 -1,-0.3 -6,-0.1 2,-0.2 -0.463 51.0-125.7 -82.2 152.0 45.6 -27.4 23.0 322 322 A S 0 0 120 -2,-0.1 -1,-0.1 -5,-0.1 -8,-0.0 -0.624 360.0 360.0 -92.1 155.3 42.5 -26.9 20.9 323 323 A a 0 0 108 -2,-0.2 -9,-0.0 -9,-0.0 -10,-0.0 -0.798 360.0 360.0-107.7 360.0 42.3 -27.6 17.1