==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 13-MAY-08 3D3Y . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR K.TAN,H.LI,S.CLANCY,A.JOACHIMIAK,MIDWEST CENTER FOR STRUCTUR . 425 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19499.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 311 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 1 0.2 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 . 25 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 155 36.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 1 1 0 0 1 3 1 0 3 2 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 0 1 0 0 1 0 3 1 1 0 1 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 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 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 -2 A S 0 0 91 0, 0.0 16,-0.0 0, 0.0 374,-0.0 0.000 360.0 360.0 360.0 141.0 30.9 62.9 -1.1 2 -1 A N + 0 0 109 16,-0.1 2,-0.1 2,-0.1 14,-0.1 0.178 360.0 137.7 -98.6 14.3 31.9 63.7 -4.7 3 0 A A - 0 0 35 14,-0.2 2,-0.6 12,-0.1 14,-0.2 -0.368 41.6-156.3 -65.2 133.3 28.6 62.2 -6.0 4 1 A X E -A 16 0A 61 12,-2.3 12,-2.5 -2,-0.1 2,-0.4 -0.962 17.3-159.6-109.8 120.8 26.8 64.0 -8.8 5 2 A S E -A 15 0A 73 -2,-0.6 2,-0.4 10,-0.2 10,-0.2 -0.826 13.3-178.6-113.3 143.9 23.2 63.1 -8.8 6 3 A V E -A 14 0A 41 8,-2.2 8,-3.4 -2,-0.4 2,-0.7 -0.998 28.8-123.8-136.7 136.2 20.5 63.4 -11.5 7 4 A Q E -A 13 0A 105 -2,-0.4 6,-0.2 6,-0.2 3,-0.2 -0.746 22.9-179.6 -75.0 115.8 16.9 62.6 -11.5 8 5 A L E S- 0 0 16 4,-2.4 2,-0.3 -2,-0.7 -1,-0.2 0.968 77.7 -25.6 -75.5 -66.9 16.2 60.1 -14.3 9 6 A V E > S-A 12 0A 42 3,-0.9 3,-2.8 -3,-0.1 -1,-0.5 -0.913 96.8 -63.0-129.6 167.7 12.5 60.1 -13.5 10 7 A K T 3 S+ 0 0 102 -2,-0.3 216,-2.2 1,-0.3 3,-0.1 -0.236 127.7 14.3 -43.9 127.4 10.7 60.9 -10.2 11 8 A G T 3 S+ 0 0 1 214,-0.2 190,-2.8 1,-0.1 2,-0.5 0.318 111.9 91.2 84.3 -8.1 11.8 58.3 -7.6 12 9 A V E < +Ab 9 201A 0 -3,-2.8 -4,-2.4 188,-0.2 -3,-0.9 -0.941 54.8 175.6-126.6 109.4 14.7 57.1 -9.8 13 10 A N E -Ab 7 202A 15 188,-2.2 190,-2.5 -2,-0.5 2,-0.4 -0.877 21.0-146.6-122.7 144.4 18.0 58.8 -9.3 14 11 A L E -Ab 6 203A 0 -8,-3.4 -8,-2.2 -2,-0.4 2,-0.5 -0.900 11.4-168.5-109.1 137.9 21.5 58.4 -10.6 15 12 A H E -Ab 5 204A 1 188,-3.2 190,-2.1 -2,-0.4 2,-0.5 -0.980 2.4-164.8-131.3 118.3 24.6 59.0 -8.5 16 13 A V E -Ab 4 205A 0 -12,-2.5 -12,-2.3 -2,-0.5 190,-0.2 -0.915 2.0-168.6-108.1 123.8 28.0 59.1 -10.2 17 14 A I E - b 0 206A 0 188,-3.7 190,-2.0 -2,-0.5 2,-0.2 -0.880 13.2-155.8-114.9 93.3 31.1 58.9 -7.9 18 15 A P E + b 0 207A 34 0, 0.0 2,-0.3 0, 0.0 190,-0.2 -0.492 26.8 150.8 -71.4 138.4 34.2 59.8 -9.9 19 16 A T - 0 0 22 188,-1.4 3,-0.2 -2,-0.2 190,-0.1 -0.964 44.1-152.7-163.0 150.2 37.5 58.4 -8.7 20 17 A E S S+ 0 0 166 -2,-0.3 188,-0.1 1,-0.1 -1,-0.0 0.195 76.4 99.1-106.1 12.8 40.8 57.3 -10.1 21 18 A K S S+ 0 0 113 186,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.757 80.0 49.1 -72.2 -24.7 41.3 54.9 -7.2 22 19 A Y - 0 0 43 -3,-0.2 186,-0.3 2,-0.1 -3,-0.1 -0.816 60.1-148.5-124.1 155.7 40.2 51.8 -9.2 23 20 A K S S+ 0 0 131 -2,-0.3 73,-2.2 184,-0.1 2,-0.3 0.440 88.4 56.6 -96.5 -6.2 40.8 50.1 -12.5 24 21 A T E S-C 95 0A 32 71,-0.2 2,-0.4 73,-0.0 184,-0.3 -0.782 78.5-127.1-119.7 171.5 37.2 48.8 -12.6 25 22 A V E -C 94 0A 1 69,-3.0 69,-2.1 -2,-0.3 2,-0.4 -0.970 18.7-152.2-121.9 124.5 33.8 50.5 -12.5 26 23 A R E -CD 93 206A 87 180,-2.6 180,-2.3 -2,-0.4 2,-0.4 -0.845 9.9-166.8 -98.7 140.9 31.2 49.3 -9.9 27 24 A L E -CD 92 205A 3 65,-2.9 65,-2.3 -2,-0.4 2,-0.4 -0.978 5.4-176.6-125.6 140.1 27.6 49.6 -10.7 28 25 A L E -CD 91 204A 3 176,-2.1 176,-2.8 -2,-0.4 2,-0.6 -0.989 10.5-170.3-137.7 123.6 24.7 49.2 -8.2 29 26 A V E -CD 90 203A 0 61,-2.9 61,-3.0 -2,-0.4 2,-0.6 -0.978 17.3-169.7-109.1 115.6 21.0 49.4 -8.9 30 27 A R E -CD 89 202A 6 172,-3.0 172,-2.0 -2,-0.6 2,-0.5 -0.929 11.8-162.0-115.8 114.3 19.2 49.5 -5.5 31 28 A F E -CD 88 201A 0 57,-2.8 57,-2.2 -2,-0.6 2,-0.4 -0.836 16.4-160.8 -90.0 127.4 15.4 49.1 -5.3 32 29 A N E +CD 87 200A 0 168,-3.0 168,-1.9 -2,-0.5 2,-0.3 -0.932 18.9 156.5-119.5 130.8 14.2 50.3 -1.9 33 30 A T E -C 86 0A 30 53,-1.8 53,-2.5 -2,-0.4 2,-0.1 -0.949 48.5 -83.1-142.9 161.9 10.9 49.4 -0.2 34 31 A R E -C 85 0A 100 -2,-0.3 51,-0.3 51,-0.2 2,-0.2 -0.450 56.5-100.3 -60.4 137.1 9.3 49.3 3.3 35 32 A L + 0 0 0 49,-3.1 2,-0.3 -2,-0.1 133,-0.1 -0.473 57.0 173.4 -60.7 131.2 10.2 46.0 5.1 36 33 A N >> - 0 0 28 132,-0.2 3,-2.3 -2,-0.2 4,-1.6 -0.927 41.2-145.0-155.1 113.2 7.0 44.0 4.6 37 34 A H T 34 S+ 0 0 79 -2,-0.3 4,-0.4 1,-0.3 -1,-0.1 0.789 102.1 63.5 -51.9 -28.1 6.2 40.4 5.4 38 35 A E T 34 S+ 0 0 124 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.712 118.0 22.6 -69.1 -21.3 4.0 40.3 2.3 39 36 A T T <> S+ 0 0 16 -3,-2.3 4,-2.9 2,-0.1 5,-0.2 0.451 94.5 91.5-127.0 -3.9 7.0 40.9 -0.1 40 37 A I H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -3,-0.1 0.949 97.1 38.3 -60.7 -52.2 10.2 39.8 1.7 41 38 A T H > S+ 0 0 4 -4,-0.4 4,-2.7 2,-0.2 5,-0.3 0.866 115.5 55.1 -68.0 -35.5 10.3 36.3 0.5 42 39 A K H > S+ 0 0 47 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.946 109.8 46.2 -60.5 -48.8 9.0 37.5 -2.9 43 40 A R H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.916 112.2 51.7 -59.6 -46.5 11.9 39.9 -3.2 44 41 A T H X S+ 0 0 9 -4,-2.3 4,-1.1 -5,-0.2 -2,-0.2 0.934 114.1 41.4 -55.9 -50.3 14.4 37.2 -2.1 45 42 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 3,-0.4 0.896 111.4 57.0 -66.8 -40.9 13.2 34.7 -4.7 46 43 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 -5,-0.3 5,-0.3 0.878 99.8 59.0 -55.4 -41.1 13.0 37.3 -7.4 47 44 A S H X S+ 0 0 8 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.893 108.7 45.4 -59.9 -36.2 16.6 38.2 -6.8 48 45 A S H X S+ 0 0 27 -4,-1.1 4,-1.7 -3,-0.4 -2,-0.2 0.904 113.3 50.2 -70.9 -37.4 17.5 34.6 -7.7 49 46 A L H X S+ 0 0 1 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.925 111.6 45.9 -67.6 -43.7 15.2 34.5 -10.7 50 47 A X H < S+ 0 0 3 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.718 114.9 48.7 -75.8 -18.8 16.5 37.7 -12.3 51 48 A E H < S+ 0 0 69 -4,-1.0 -1,-0.2 -5,-0.3 -2,-0.2 0.819 103.6 57.0 -84.3 -36.7 20.1 36.7 -11.8 52 49 A T H < S- 0 0 13 -4,-1.7 2,-0.3 1,-0.2 11,-0.2 0.856 122.2 -28.0 -73.3 -38.7 20.1 33.2 -13.2 53 50 A N < - 0 0 4 -4,-1.1 68,-0.5 10,-0.1 2,-0.3 -0.956 55.1-148.8-163.9 170.7 18.8 34.0 -16.7 54 51 A S - 0 0 1 3,-1.9 3,-0.3 -2,-0.3 62,-0.1 -0.861 42.8 -85.4-140.1 178.0 16.6 36.6 -18.6 55 52 A L S S+ 0 0 74 64,-2.2 66,-0.1 60,-0.3 61,-0.1 0.883 128.9 31.4 -52.3 -45.1 14.3 36.6 -21.6 56 53 A N S S+ 0 0 88 63,-0.5 -1,-0.2 1,-0.3 60,-0.0 0.521 123.9 45.7-101.3 -7.3 17.2 37.1 -24.1 57 54 A Y S S+ 0 0 40 -3,-0.3 -3,-1.9 58,-0.1 -1,-0.3 -0.683 79.2 176.8-121.4 70.5 19.9 35.2 -22.1 58 55 A P + 0 0 48 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 0.420 56.4 26.8 -69.9 -0.3 17.5 32.3 -21.4 59 56 A N S > S- 0 0 60 1,-0.0 4,-2.3 -3,-0.0 5,-0.2 -0.950 85.5-102.0-151.4 174.3 20.0 30.1 -19.6 60 57 A Q H > S+ 0 0 95 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.770 118.1 56.8 -75.6 -24.7 23.1 30.3 -17.5 61 58 A V H > S+ 0 0 102 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.944 111.9 42.6 -64.2 -48.3 25.4 29.3 -20.4 62 59 A K H > S+ 0 0 92 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.887 115.5 48.9 -68.4 -39.4 24.1 32.2 -22.5 63 60 A L H X S+ 0 0 2 -4,-2.3 4,-2.4 -6,-0.2 3,-0.2 0.950 112.1 46.9 -67.7 -47.1 24.2 34.7 -19.6 64 61 A S H X S+ 0 0 57 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.862 109.1 56.1 -67.8 -27.8 27.7 33.9 -18.5 65 62 A E H X S+ 0 0 107 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.873 106.9 49.5 -66.7 -38.4 28.8 34.1 -22.2 66 63 A R H X S+ 0 0 26 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.934 108.1 53.6 -64.6 -44.3 27.4 37.6 -22.3 67 64 A L H <>S+ 0 0 23 -4,-2.4 6,-2.1 1,-0.2 5,-0.9 0.877 109.2 49.4 -55.2 -35.2 29.3 38.4 -19.1 68 65 A A H >X5S+ 0 0 62 -4,-1.7 3,-1.0 4,-0.2 4,-0.7 0.902 106.5 54.1 -73.3 -40.6 32.4 37.2 -20.9 69 66 A E H 3<5S+ 0 0 106 -4,-2.1 2,-0.4 1,-0.3 -1,-0.2 0.845 98.8 66.6 -57.9 -34.5 31.7 39.3 -23.9 70 67 A L T 3<5S- 0 0 1 -4,-2.1 25,-0.3 -5,-0.1 -1,-0.3 -0.092 133.6 -89.7 -81.5 36.4 31.5 42.2 -21.5 71 68 A Y T <45S- 0 0 68 -3,-1.0 24,-0.2 -2,-0.4 -3,-0.2 0.825 83.9 -51.5 64.8 32.7 35.3 41.8 -20.8 72 69 A G S < -E 85 0A 69 3,-2.5 3,-2.6 -2,-0.4 -47,-0.1 -0.901 59.6 -55.1-146.6 112.4 18.2 47.7 7.0 83 80 A G T 3 S- 0 0 2 -2,-0.3 151,-0.3 1,-0.3 150,-0.1 -0.374 122.6 -17.0 58.3-129.3 16.0 49.2 9.7 84 81 A N T 3 S+ 0 0 28 149,-3.5 -49,-3.1 148,-0.3 2,-0.3 0.193 123.9 88.1 -90.9 15.8 12.5 49.4 8.3 85 82 A Q E < -CE 34 82A 4 -3,-2.6 -3,-2.5 148,-0.4 2,-0.4 -0.796 59.2-153.8-114.5 152.7 13.7 49.0 4.7 86 83 A H E -CE 33 81A 0 -53,-2.5 -53,-1.8 -2,-0.3 2,-0.4 -0.999 18.2-153.6-126.2 130.3 14.3 46.0 2.5 87 84 A W E -CE 32 80A 8 -7,-3.1 -7,-2.0 -2,-0.4 2,-0.5 -0.886 11.8-160.4-112.4 137.3 16.8 46.4 -0.3 88 85 A F E -CE 31 79A 0 -57,-2.2 -57,-2.8 -2,-0.4 2,-0.5 -0.978 23.9-162.6-117.7 118.6 17.0 44.5 -3.7 89 86 A N E -CE 30 78A 16 -11,-3.0 -11,-1.9 -2,-0.5 2,-0.6 -0.911 19.4-172.3-122.3 115.7 20.5 45.0 -5.0 90 87 A I E -CE 29 77A 1 -61,-3.0 -61,-2.9 -2,-0.5 2,-0.4 -0.922 20.1-174.0-107.6 122.6 21.8 44.4 -8.5 91 88 A S E +CE 28 76A 57 -15,-3.1 -15,-2.5 -2,-0.6 2,-0.3 -0.915 11.3 177.2-121.0 145.8 25.6 44.7 -8.7 92 89 A X E -CE 27 75A 6 -65,-2.3 -65,-2.9 -2,-0.4 2,-0.4 -0.991 12.6-163.4-143.5 146.6 28.1 44.7 -11.5 93 90 A N E +CE 26 74A 30 -19,-2.2 -19,-2.2 -2,-0.3 2,-0.3 -0.999 19.6 174.6-126.7 127.2 31.9 45.1 -11.7 94 91 A I E -C 25 0A 2 -69,-2.1 -69,-3.0 -2,-0.4 2,-0.2 -0.969 35.4-106.2-133.1 150.7 33.4 45.9 -15.2 95 92 A V E -C 24 0A 42 -25,-0.3 -71,-0.2 -2,-0.3 10,-0.1 -0.553 44.8-108.3 -74.7 139.3 36.9 46.7 -16.4 96 93 A N > - 0 0 18 -73,-2.2 3,-2.2 -2,-0.2 4,-0.3 -0.388 22.9-116.4 -67.1 144.7 37.3 50.4 -17.3 97 94 A D G > S+ 0 0 40 1,-0.3 3,-1.6 2,-0.2 6,-0.1 0.768 111.0 73.9 -49.1 -29.7 37.7 51.3 -21.1 98 95 A H G 3 S+ 0 0 142 1,-0.3 -1,-0.3 -75,-0.1 -75,-0.0 0.809 99.9 42.7 -56.5 -29.6 41.2 52.6 -20.3 99 96 A Y G < S+ 0 0 114 -3,-2.2 -1,-0.3 -76,-0.2 2,-0.2 0.369 106.4 77.2-101.7 3.7 42.4 48.9 -19.9 100 97 A L < - 0 0 34 -3,-1.6 3,-0.2 -4,-0.3 -4,-0.0 -0.723 69.2-137.8-115.9 163.3 40.5 47.6 -23.0 101 98 A Q S S+ 0 0 173 -2,-0.2 2,-0.6 1,-0.2 -1,-0.1 0.972 87.6 2.1 -88.2 -70.2 41.2 47.7 -26.7 102 99 A D S S+ 0 0 148 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.833 96.4 135.2-124.2 92.4 38.0 48.4 -28.7 103 100 A S - 0 0 18 -2,-0.6 3,-0.1 -3,-0.2 -3,-0.0 -0.917 48.7-169.4-140.3 155.9 35.3 48.8 -26.1 104 101 A Q > + 0 0 110 -2,-0.3 4,-2.4 1,-0.1 3,-0.3 -0.439 31.4 166.8-135.9 59.0 32.3 50.8 -25.0 105 102 A V H > + 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.778 68.3 49.7 -57.0 -37.8 32.1 49.2 -21.7 106 103 A L H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.956 113.9 45.3 -67.8 -47.6 29.7 51.6 -20.0 107 104 A A H > S+ 0 0 31 -3,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.894 115.0 49.2 -58.5 -41.3 27.2 51.5 -22.8 108 105 A E H X S+ 0 0 49 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.905 110.9 49.0 -70.0 -39.7 27.5 47.7 -23.0 109 106 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.920 110.1 50.7 -65.7 -43.5 27.0 47.3 -19.2 110 107 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.900 108.6 52.7 -62.2 -39.3 23.9 49.6 -19.2 111 108 A D H X S+ 0 0 64 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.921 109.0 50.2 -59.2 -42.1 22.5 47.6 -22.1 112 109 A F H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.935 110.2 49.2 -64.3 -45.3 23.0 44.4 -20.0 113 110 A L H X S+ 0 0 2 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.889 107.6 54.9 -54.4 -42.4 21.3 45.9 -17.0 114 111 A K H X S+ 0 0 79 -4,-2.4 4,-2.6 2,-0.2 5,-0.4 0.901 109.5 48.0 -60.6 -40.6 18.4 47.0 -19.3 115 112 A E H X S+ 0 0 40 -4,-1.9 4,-1.8 3,-0.2 -60,-0.3 0.955 114.8 44.8 -61.6 -52.8 18.1 43.3 -20.3 116 113 A I H < S+ 0 0 1 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.915 122.4 35.7 -57.3 -46.7 18.2 42.0 -16.7 117 114 A I H < S+ 0 0 0 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.907 130.3 25.9 -80.3 -42.3 15.8 44.6 -15.3 118 115 A F H < S+ 0 0 48 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.502 122.8 47.2-104.7 -9.3 13.3 45.1 -18.1 119 116 A A S < S+ 0 0 19 -4,-1.8 -64,-2.2 -5,-0.4 -63,-0.5 -0.400 72.4 163.5-129.9 59.5 13.5 41.8 -20.0 120 117 A P - 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0 0 59 -2,-0.2 2,-0.1 4,-0.0 -2,-0.0 -0.990 25.0-131.5-130.2 134.5 31.4 61.9 9.1 387 384 A T > - 0 0 92 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.340 33.5-107.5 -72.5 165.4 34.8 62.0 7.6 388 385 A A H > S+ 0 0 31 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.923 122.0 54.0 -61.1 -43.6 37.2 59.2 8.4 389 386 A E H > S+ 0 0 164 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 111.6 43.6 -54.5 -45.5 39.2 61.6 10.6 390 387 A E H > S+ 0 0 72 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.868 110.0 55.6 -72.6 -35.3 36.1 62.6 12.6 391 388 A W H X S+ 0 0 32 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.966 111.5 44.6 -57.3 -52.1 34.9 59.0 12.9 392 389 A I H X S+ 0 0 40 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.898 111.7 52.5 -59.5 -45.0 38.2 58.1 14.5 393 390 A A H X S+ 0 0 44 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.913 108.8 50.8 -57.2 -42.2 38.3 61.2 16.7 394 391 A R H X S+ 0 0 115 -4,-2.6 4,-0.6 2,-0.2 -2,-0.2 0.922 110.1 48.6 -68.9 -40.1 34.8 60.3 18.0 395 392 A I H >< S+ 0 0 0 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.955 112.3 50.1 -57.3 -49.9 35.8 56.7 18.8 396 393 A N H 3< S+ 0 0 70 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.817 107.1 55.2 -55.3 -33.5 38.9 58.1 20.6 397 394 A A H 3< S+ 0 0 67 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.509 73.6 123.8 -86.1 -7.6 36.9 60.6 22.7 398 395 A V << - 0 0 5 -3,-1.2 2,-0.2 -4,-0.6 -44,-0.1 -0.357 46.7-157.9 -57.5 131.3 34.4 58.1 24.2 399 396 A T > - 0 0 65 1,-0.1 4,-1.7 -2,-0.1 5,-0.1 -0.647 28.1-111.5-109.2 164.2 34.6 58.3 28.1 400 397 A I H > S+ 0 0 40 -2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.923 116.9 56.4 -61.1 -46.3 33.6 55.9 30.9 401 398 A P H > S+ 0 0 85 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.875 107.4 50.4 -54.7 -36.1 30.6 58.1 32.0 402 399 A E H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.892 110.6 48.6 -66.9 -39.1 29.3 57.9 28.4 403 400 A I H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.879 110.2 51.6 -64.9 -41.7 29.7 54.1 28.5 404 401 A Q H X S+ 0 0 42 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.880 108.6 51.8 -62.4 -42.5 27.9 53.9 31.9 405 402 A E H X S+ 0 0 64 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.916 108.8 49.2 -61.4 -44.8 25.0 56.0 30.4 406 403 A V H X S+ 0 0 1 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.947 111.9 50.9 -56.4 -46.4 24.7 53.6 27.4 407 404 A A H < S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.882 110.0 48.6 -61.7 -38.9 24.7 50.7 30.0 408 405 A K H < S+ 0 0 120 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.832 109.1 53.4 -70.2 -32.5 22.0 52.4 32.1 409 406 A R H < S+ 0 0 109 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.792 86.6 101.9 -69.9 -31.5 19.8 53.0 28.9 410 407 A L < - 0 0 0 -4,-1.6 2,-0.4 -5,-0.2 -147,-0.2 -0.302 54.4-170.9 -53.8 136.1 20.0 49.3 28.0 411 408 A E E - I 0 262C 81 -149,-1.8 -149,-2.8 0, 0.0 -3,-0.0 -0.942 21.1-128.7-140.1 114.8 16.8 47.5 28.9 412 409 A L E + I 0 261C 40 -2,-0.4 -151,-0.3 -151,-0.3 3,-0.1 -0.343 36.4 161.4 -62.1 136.1 16.4 43.7 28.7 413 410 A Q E + 0 0 0 -153,-2.9 -169,-2.5 1,-0.4 2,-0.3 0.602 54.0 18.8-129.3 -32.7 13.2 42.8 26.7 414 411 A A E -gI 244 260C 0 -154,-1.8 -154,-2.7 -171,-0.2 2,-0.4 -0.998 48.2-166.0-149.9 147.1 13.4 39.2 25.5 415 412 A I E -gI 245 259C 6 -171,-2.3 -169,-2.6 -2,-0.3 2,-0.5 -0.995 8.8-165.7-133.3 128.2 15.2 35.9 26.3 416 413 A F E -gI 246 258C 1 -158,-2.6 -158,-3.0 -2,-0.4 2,-0.5 -0.975 3.2-169.0-118.2 129.3 15.1 33.0 24.0 417 414 A F E -gI 247 257C 6 -171,-2.5 -169,-2.3 -2,-0.5 2,-0.8 -0.964 9.3-165.3-119.7 115.4 16.3 29.6 25.2 418 415 A L E -gI 248 256C 0 -162,-2.9 -162,-2.3 -2,-0.5 2,-0.6 -0.900 23.1-156.5-100.8 106.9 16.8 26.7 22.8 419 416 A E E -g 249 0C 47 -171,-3.2 -169,-1.8 -2,-0.8 2,-0.1 -0.764 7.5-131.0-101.5 121.3 17.0 23.8 25.2 420 417 A G E -g 250 0C 14 -2,-0.6 2,-0.6 -171,-0.2 -169,-0.2 -0.432 7.5-152.8 -69.3 133.9 18.8 20.6 24.2 421 418 A E E +g 251 0C 83 -171,-2.5 -169,-0.6 -2,-0.1 -1,-0.0 -0.962 31.7 153.8 -98.2 112.5 17.0 17.3 24.7 422 419 A T + 0 0 112 -2,-0.6 2,-0.4 -171,-0.1 -1,-0.1 0.528 48.1 81.5-113.7 -12.5 19.9 14.8 25.2 423 420 A E - 0 0 177 -3,-0.1 2,-0.1 1,-0.0 -1,-0.0 -0.782 69.9-134.2-105.2 138.4 18.0 12.2 27.3 424 421 A N 0 0 151 -2,-0.4 -2,-0.1 1,-0.2 -1,-0.0 -0.455 360.0 360.0 -85.5 158.4 15.7 9.5 26.0 425 422 A D 0 0 233 -2,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.171 360.0 360.0 84.7 360.0 12.3 8.3 27.2