==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL TRANSPORT 06-JUN-07 2V2I . COMPND 2 MOLECULE: FERRITIN LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR N.DE VAL,J.P.DECLERCQ . 170 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9767.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 77.6 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 . 0 0.0 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 . 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 . 3 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.9 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 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 3 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 111 0, 0.0 72,-0.0 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 130.6 52.2 18.3 21.5 2 3 A Q + 0 0 200 1,-0.2 70,-0.0 3,-0.0 0, 0.0 0.577 360.0 34.3 -69.8 -17.3 51.4 19.6 18.0 3 4 A I S S+ 0 0 93 69,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.555 83.6 117.3-107.3 -26.6 47.8 20.5 19.0 4 5 A R + 0 0 76 68,-0.2 2,-0.3 2,-0.0 68,-0.1 -0.350 33.0 161.2 -61.8 131.5 48.0 21.6 22.6 5 6 A Q - 0 0 157 66,-0.5 3,-0.1 -2,-0.1 -3,-0.0 -0.937 63.9 -8.0-157.1 118.8 46.9 25.2 23.1 6 7 A N S S+ 0 0 95 -2,-0.3 2,-0.6 1,-0.2 -2,-0.0 0.747 90.9 132.4 64.8 32.5 45.9 27.1 26.2 7 8 A Y - 0 0 12 64,-0.1 -1,-0.2 4,-0.0 114,-0.0 -0.918 46.5-147.7-125.3 98.9 45.8 23.9 28.2 8 9 A S > - 0 0 19 -2,-0.6 4,-2.2 1,-0.1 5,-0.1 -0.259 19.5-127.2 -72.5 150.7 47.6 24.1 31.5 9 10 A T H > S+ 0 0 93 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.802 112.1 60.8 -64.9 -25.3 49.4 21.2 33.1 10 11 A E H > S+ 0 0 95 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.943 106.8 42.8 -69.7 -41.6 47.3 22.0 36.2 11 12 A V H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.932 111.5 55.3 -69.0 -45.5 44.0 21.3 34.3 12 13 A E H X S+ 0 0 33 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.901 110.7 44.8 -50.9 -49.7 45.5 18.3 32.6 13 14 A A H X S+ 0 0 35 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.883 112.8 50.4 -62.5 -47.3 46.4 16.7 36.0 14 15 A A H X S+ 0 0 14 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.807 107.5 54.7 -61.6 -37.2 43.0 17.6 37.6 15 16 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.958 106.8 50.8 -61.6 -42.1 41.2 16.0 34.5 16 17 A N H X S+ 0 0 20 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.911 111.6 48.3 -60.9 -39.3 43.1 12.8 35.2 17 18 A R H X S+ 0 0 158 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.931 109.8 51.4 -68.2 -40.2 42.0 12.9 38.9 18 19 A L H X S+ 0 0 7 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.862 104.9 56.4 -63.6 -38.7 38.4 13.6 37.9 19 20 A V H X S+ 0 0 3 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.943 108.6 48.5 -56.7 -44.8 38.6 10.6 35.6 20 21 A N H X S+ 0 0 40 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.928 109.8 51.9 -59.0 -43.4 39.6 8.5 38.6 21 22 A L H X S+ 0 0 62 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.914 111.2 46.3 -63.5 -42.1 36.8 9.9 40.7 22 23 A Y H X S+ 0 0 4 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.858 113.0 49.0 -67.3 -45.8 34.2 9.1 38.0 23 24 A L H X S+ 0 0 44 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.901 111.5 50.2 -61.8 -34.2 35.5 5.5 37.5 24 25 A R H X S+ 0 0 58 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.878 109.8 51.0 -66.9 -39.8 35.5 5.1 41.3 25 26 A A H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.919 108.3 51.7 -63.7 -40.6 31.9 6.3 41.3 26 27 A S H X S+ 0 0 18 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.912 110.1 49.8 -62.4 -33.9 31.0 3.8 38.6 27 28 A Y H X S+ 0 0 100 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.885 108.3 52.2 -73.6 -41.4 32.5 1.0 40.7 28 29 A T H X S+ 0 0 13 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.923 111.4 47.6 -59.8 -43.5 30.6 2.1 43.8 29 30 A Y H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.800 107.1 55.8 -68.8 -38.4 27.4 2.0 41.8 30 31 A L H X S+ 0 0 74 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.898 111.0 45.4 -51.1 -50.9 28.2 -1.5 40.3 31 32 A S H X S+ 0 0 34 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.927 112.7 50.7 -64.8 -41.9 28.6 -2.7 44.0 32 33 A L H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.927 110.5 50.4 -58.3 -47.5 25.3 -1.0 45.0 33 34 A G H X S+ 0 0 0 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.958 111.5 45.2 -60.9 -50.7 23.5 -2.5 42.1 34 35 A F H < S+ 0 0 94 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.769 107.4 59.2 -66.0 -29.4 24.6 -6.1 42.7 35 36 A Y H >< S+ 0 0 37 -4,-1.9 3,-1.5 1,-0.2 7,-0.3 0.929 106.2 47.9 -59.2 -43.7 23.9 -5.8 46.5 36 37 A F H 3< S+ 0 0 0 -4,-1.8 7,-2.1 1,-0.3 11,-0.3 0.703 105.3 61.2 -78.2 -7.7 20.2 -5.0 45.7 37 38 A D T 3< S+ 0 0 97 -4,-0.9 -1,-0.3 5,-0.2 -2,-0.2 0.514 78.9 115.9 -86.3 -14.4 20.2 -8.0 43.3 38 39 A R S X> S- 0 0 110 -3,-1.5 4,-2.2 -4,-0.3 3,-2.0 -0.382 76.1-125.0 -53.2 143.9 21.0 -10.3 46.2 39 40 A D T 34 S+ 0 0 146 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 0.758 112.4 53.2 -65.6 -21.9 18.2 -12.9 46.9 40 41 A D T 34 S+ 0 0 103 1,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.316 120.3 31.0 -97.8 14.9 18.1 -11.6 50.5 41 42 A V T <4 S+ 0 0 35 -3,-2.0 -2,-0.2 -6,-0.1 -5,-0.1 0.572 80.8 173.4-129.4 -58.3 17.7 -8.0 49.5 42 43 A A < + 0 0 66 -4,-2.2 2,-0.4 -7,-0.3 -5,-0.2 0.917 17.5 143.5 59.2 48.8 15.7 -8.4 46.2 43 44 A L >> - 0 0 17 -7,-2.1 4,-2.4 1,-0.1 3,-1.1 -0.756 22.2-178.8-115.9 92.4 14.8 -4.9 45.1 44 45 A E H 3> S+ 0 0 125 -2,-0.4 4,-2.9 1,-0.3 5,-0.2 0.846 79.6 56.5 -69.3 -35.4 15.0 -5.0 41.3 45 46 A G H 3> S+ 0 0 8 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.814 111.0 43.8 -53.4 -46.8 14.0 -1.3 40.9 46 47 A V H <> S+ 0 0 0 -3,-1.1 4,-2.3 2,-0.2 5,-0.3 0.893 110.9 55.0 -68.0 -43.4 16.9 -0.3 43.1 47 48 A C H X S+ 0 0 6 -4,-2.4 4,-2.5 -11,-0.3 -2,-0.2 0.952 111.8 44.0 -51.7 -53.0 19.3 -2.7 41.4 48 49 A H H X S+ 0 0 93 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.890 109.0 57.5 -66.3 -36.4 18.4 -1.1 38.0 49 50 A F H X S+ 0 0 18 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.913 113.4 38.9 -57.8 -47.3 18.7 2.5 39.4 50 51 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.872 112.9 54.6 -77.1 -34.8 22.2 1.9 40.5 51 52 A R H X S+ 0 0 114 -4,-2.5 4,-1.5 -5,-0.3 -2,-0.2 0.913 108.0 51.0 -65.2 -30.9 23.4 -0.1 37.6 52 53 A E H X S+ 0 0 103 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.916 108.9 51.4 -74.1 -34.3 22.2 2.6 35.2 53 54 A L H X S+ 0 0 11 -4,-1.5 4,-2.3 -5,-0.2 5,-0.2 0.866 103.2 59.0 -67.6 -33.8 24.2 5.1 37.3 54 55 A A H X S+ 0 0 11 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.895 108.8 46.0 -55.4 -49.3 27.3 2.9 37.0 55 56 A E H X S+ 0 0 73 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.911 109.6 52.9 -63.4 -43.5 27.0 3.3 33.3 56 57 A E H X S+ 0 0 79 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.908 111.2 46.9 -55.0 -47.2 26.4 7.1 33.4 57 58 A K H X S+ 0 0 9 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.853 111.1 51.1 -62.8 -45.8 29.6 7.6 35.5 58 59 A R H X S+ 0 0 90 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.903 110.1 49.9 -54.1 -49.7 31.7 5.4 33.2 59 60 A E H X S+ 0 0 60 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.890 107.7 54.7 -61.9 -34.3 30.4 7.4 30.3 60 61 A G H X S+ 0 0 7 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.938 107.4 49.9 -57.9 -52.5 31.4 10.6 32.2 61 62 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.926 110.7 50.7 -50.1 -45.1 35.0 9.2 32.6 62 63 A E H X S+ 0 0 97 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.857 107.9 50.8 -69.1 -33.5 35.1 8.4 28.8 63 64 A R H X S+ 0 0 106 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.901 110.8 49.4 -70.6 -35.6 34.0 11.8 27.8 64 65 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.910 111.1 50.9 -63.8 -41.1 36.7 13.4 30.1 65 66 A L H X S+ 0 0 34 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.884 109.4 49.8 -65.0 -44.4 39.3 11.1 28.5 66 67 A K H X S+ 0 0 138 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.911 111.7 48.6 -60.7 -42.0 38.2 12.1 25.0 67 68 A M H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 6,-0.2 0.893 105.5 57.5 -64.2 -49.7 38.5 15.7 25.9 68 69 A Q H X>S+ 0 0 0 -4,-2.7 5,-2.5 2,-0.2 4,-0.7 0.926 112.0 42.4 -40.7 -59.2 41.9 15.2 27.5 69 70 A N H ><5S+ 0 0 106 -4,-1.9 3,-0.8 3,-0.2 -2,-0.2 0.901 109.6 57.3 -57.9 -39.6 43.1 13.8 24.1 70 71 A Q H 3<5S+ 0 0 108 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.859 110.9 44.5 -59.9 -33.9 41.2 16.6 22.1 71 72 A R H 3<5S- 0 0 26 -4,-2.2 -66,-0.5 -5,-0.1 -1,-0.2 0.575 120.4-107.7 -91.9 -3.0 43.2 19.2 24.1 72 73 A G T <<5S+ 0 0 15 -3,-0.8 -3,-0.2 -4,-0.7 -68,-0.2 0.568 73.0 136.7 82.8 18.9 46.5 17.4 23.7 73 74 A G < - 0 0 8 -5,-2.5 2,-0.6 -6,-0.2 -1,-0.2 -0.206 54.5-113.5 -85.2 172.6 46.8 16.2 27.3 74 75 A R - 0 0 175 -2,-0.0 2,-0.2 2,-0.0 -58,-0.1 -0.951 19.9-132.6-117.0 117.0 47.9 12.7 28.3 75 76 A A - 0 0 27 -2,-0.6 2,-0.4 -10,-0.1 -62,-0.1 -0.463 26.2-175.4 -58.3 131.8 45.5 10.3 30.1 76 77 A L - 0 0 97 -2,-0.2 2,-0.4 -63,-0.1 -2,-0.0 -0.997 9.2-152.2-138.6 126.2 47.2 8.8 33.1 77 78 A F - 0 0 128 -2,-0.4 2,-0.3 -58,-0.1 -60,-0.1 -0.847 9.2-167.9-104.7 141.9 45.4 6.1 35.1 78 79 A Q - 0 0 148 -2,-0.4 -2,-0.0 -62,-0.2 0, 0.0 -0.792 40.4 -69.2-116.0 171.1 45.7 5.2 38.7 79 80 A D - 0 0 153 -2,-0.3 2,-0.7 1,-0.1 -1,-0.2 -0.153 48.1-130.8 -50.4 139.8 44.5 2.4 41.0 80 81 A L - 0 0 71 -3,-0.1 2,-0.2 -57,-0.1 -1,-0.1 -0.933 21.4-133.8 -97.7 113.0 40.7 2.4 41.5 81 82 A Q - 0 0 116 -2,-0.7 3,-0.1 1,-0.1 -54,-0.1 -0.463 23.1-109.6 -62.3 144.9 39.9 2.1 45.1 82 83 A K - 0 0 143 -2,-0.2 -1,-0.1 1,-0.1 -54,-0.1 -0.217 48.4 -81.3 -68.1 159.0 37.2 -0.4 46.0 83 84 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 -58,-0.1 -0.186 38.7-113.2 -61.3 164.0 33.9 1.1 47.2 84 85 A S S S+ 0 0 87 -3,-0.1 2,-0.3 2,-0.0 -2,-0.1 0.606 95.7 38.5 -81.7 -9.2 33.6 2.2 50.8 85 86 A Q - 0 0 80 1,-0.1 3,-0.1 -57,-0.0 -54,-0.0 -0.938 52.5-160.9-139.5 151.3 31.1 -0.5 51.8 86 87 A D S S+ 0 0 127 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.607 92.1 35.6 -95.4 -25.6 30.6 -4.2 51.0 87 88 A E - 0 0 141 1,-0.0 -1,-0.2 -52,-0.0 -55,-0.1 -0.955 68.8-159.1-131.2 140.4 26.9 -4.1 52.1 88 89 A W - 0 0 4 -2,-0.3 2,-0.2 1,-0.3 9,-0.1 0.314 22.6-143.0-119.5 12.7 24.7 -1.1 51.6 89 90 A G - 0 0 28 4,-0.1 -1,-0.3 5,-0.1 2,-0.2 -0.427 52.3 -16.5 71.3-141.6 21.9 -1.5 54.1 90 91 A T S > S- 0 0 61 -2,-0.2 4,-2.5 1,-0.0 5,-0.2 -0.531 77.0 -88.4 -99.3 176.8 18.3 -0.4 53.2 91 92 A T H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.917 127.1 48.0 -57.5 -43.7 17.1 1.7 50.3 92 93 A P H > S+ 0 0 12 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.875 110.0 53.3 -64.3 -36.1 17.4 5.0 52.3 93 94 A D H > S+ 0 0 77 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.923 112.3 45.0 -57.4 -48.4 21.0 4.1 53.4 94 95 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.912 112.8 49.2 -66.6 -41.8 21.9 3.5 49.8 95 96 A M H X S+ 0 0 0 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.878 110.0 52.5 -67.3 -37.2 20.2 6.7 48.5 96 97 A K H X S+ 0 0 100 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.964 110.4 47.6 -58.7 -45.4 22.0 8.7 51.2 97 98 A A H X S+ 0 0 27 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.843 110.0 53.2 -62.8 -38.3 25.3 7.3 50.2 98 99 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.858 108.7 49.6 -64.4 -42.0 24.5 8.0 46.5 99 100 A I H X S+ 0 0 24 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.903 109.1 51.4 -66.7 -42.2 23.8 11.6 47.3 100 101 A V H X S+ 0 0 103 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.913 111.9 48.4 -53.8 -48.9 27.1 11.9 49.3 101 102 A L H X S+ 0 0 30 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.903 111.0 48.6 -58.2 -52.7 28.9 10.5 46.3 102 103 A E H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.897 108.5 53.6 -57.5 -42.5 27.2 12.9 43.8 103 104 A K H X S+ 0 0 131 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.814 108.6 51.3 -59.0 -39.4 27.9 15.9 46.0 104 105 A S H X S+ 0 0 53 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.924 112.1 45.5 -64.9 -34.4 31.6 14.9 46.0 105 106 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.898 112.7 50.7 -68.9 -51.3 31.6 14.6 42.2 106 107 A N H X S+ 0 0 30 -4,-3.0 4,-2.5 2,-0.2 5,-0.2 0.935 109.6 50.2 -54.2 -39.9 29.8 17.9 41.8 107 108 A Q H X S+ 0 0 98 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.897 109.2 52.2 -68.9 -36.6 32.3 19.7 44.1 108 109 A A H X S+ 0 0 22 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.881 110.1 48.4 -63.3 -37.9 35.1 18.2 42.0 109 110 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.928 112.1 49.0 -65.5 -42.2 33.5 19.6 38.9 110 111 A L H X S+ 0 0 75 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.881 111.2 50.3 -67.1 -42.8 33.0 23.0 40.5 111 112 A D H X S+ 0 0 95 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.910 111.2 48.0 -57.6 -46.9 36.7 22.9 41.7 112 113 A L H X S+ 0 0 7 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.882 110.3 52.4 -66.4 -32.4 37.9 22.1 38.1 113 114 A H H X S+ 0 0 43 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.870 108.3 50.2 -63.3 -48.6 35.7 24.9 36.7 114 115 A A H X S+ 0 0 60 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.889 110.5 51.0 -58.1 -40.2 37.2 27.3 39.1 115 116 A L H X S+ 0 0 48 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.944 110.7 47.9 -62.6 -44.8 40.7 26.1 38.1 116 117 A G H <>S+ 0 0 0 -4,-2.5 5,-2.3 2,-0.2 4,-0.2 0.926 110.7 51.4 -65.8 -36.2 39.9 26.6 34.4 117 118 A S H ><5S+ 0 0 78 -4,-2.5 3,-1.5 1,-0.3 -2,-0.2 0.967 111.6 46.8 -68.2 -37.0 38.5 30.0 35.1 118 119 A A H 3<5S+ 0 0 81 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.788 114.1 48.4 -63.3 -42.0 41.7 30.9 36.9 119 120 A Q T 3<5S- 0 0 73 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.320 113.4-121.3 -79.7 2.0 43.7 29.5 34.0 120 121 A A T < 5 + 0 0 67 -3,-1.5 -3,-0.2 -4,-0.2 -2,-0.1 0.956 60.1 150.6 50.5 57.6 41.6 31.4 31.5 121 122 A D >< + 0 0 1 -5,-2.3 4,-1.8 1,-0.1 -1,-0.2 -0.810 16.4 171.0-120.7 78.7 40.5 28.2 29.8 122 123 A P H > S+ 0 0 94 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.821 75.4 61.1 -66.4 -27.1 37.0 28.9 28.3 123 124 A H H > S+ 0 0 86 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.947 107.5 44.4 -63.2 -50.4 36.9 25.6 26.4 124 125 A L H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.896 112.4 52.3 -56.2 -45.9 37.2 23.6 29.6 125 126 A C H X S+ 0 0 14 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.955 112.8 44.4 -64.1 -37.7 34.6 25.8 31.3 126 127 A D H X S+ 0 0 94 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.825 109.8 56.2 -65.2 -49.3 32.1 25.3 28.5 127 128 A F H X S+ 0 0 15 -4,-2.2 4,-1.9 -5,-0.2 5,-0.2 0.904 110.6 44.3 -51.9 -46.2 32.8 21.5 28.3 128 129 A L H X>S+ 0 0 0 -4,-2.2 5,-2.8 2,-0.2 4,-1.8 0.845 114.6 48.6 -67.8 -38.9 32.0 21.1 32.0 129 130 A E H <>S+ 0 0 93 -4,-1.5 5,-0.9 -5,-0.2 -2,-0.2 0.950 114.9 44.7 -69.6 -39.3 28.9 23.3 31.8 130 131 A S H <5S+ 0 0 70 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.792 128.7 20.6 -72.3 -41.5 27.6 21.5 28.7 131 132 A H H <5S+ 0 0 67 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.589 131.9 17.3-108.2 -15.5 28.2 17.9 29.8 132 133 A F T X5S+ 0 0 6 -4,-1.8 4,-2.3 -5,-0.2 5,-0.2 0.710 104.7 62.3-127.3 -50.5 28.5 17.7 33.6 133 134 A L H > S+ 0 0 99 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.904 108.7 46.1 -54.7 -44.7 23.5 16.7 34.7 136 137 A E H X S+ 0 0 4 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.907 111.5 50.4 -63.1 -51.8 24.7 16.6 38.3 137 138 A V H X S+ 0 0 84 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.940 113.1 46.8 -50.6 -49.9 22.2 19.2 39.5 138 139 A K H X S+ 0 0 119 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.926 114.4 47.8 -60.1 -41.1 19.3 17.2 37.8 139 140 A L H X S+ 0 0 23 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.923 110.3 49.7 -69.2 -42.4 20.6 14.0 39.3 140 141 A I H X S+ 0 0 34 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.875 110.2 51.8 -62.8 -40.6 21.0 15.3 42.8 141 142 A K H X S+ 0 0 131 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.921 109.8 49.6 -57.3 -47.9 17.4 16.8 42.7 142 143 A K H X S+ 0 0 103 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.912 112.2 47.7 -57.8 -44.0 16.1 13.4 41.6 143 144 A M H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.878 110.6 52.0 -67.8 -37.5 17.9 11.7 44.5 144 145 A G H X S+ 0 0 28 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.916 110.0 48.7 -58.2 -47.3 16.6 14.3 46.9 145 146 A D H X S+ 0 0 66 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.898 112.1 49.8 -60.0 -46.3 13.1 13.7 45.7 146 147 A H H X S+ 0 0 19 -4,-2.3 4,-3.5 1,-0.2 5,-0.2 0.916 110.0 49.9 -59.1 -46.8 13.6 9.9 46.1 147 148 A L H X S+ 0 0 24 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.858 108.8 51.4 -61.6 -47.3 14.9 10.2 49.6 148 149 A T H X S+ 0 0 73 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.925 114.3 44.9 -54.0 -47.1 12.1 12.4 50.7 149 150 A N H X S+ 0 0 61 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.954 113.1 48.9 -66.1 -45.6 9.7 9.8 49.3 150 151 A I H X S+ 0 0 2 -4,-3.5 4,-2.3 1,-0.2 3,-0.3 0.946 112.3 50.3 -54.6 -43.5 11.5 6.8 50.8 151 152 A Q H X S+ 0 0 87 -4,-2.8 4,-1.3 1,-0.3 -1,-0.2 0.894 108.4 51.2 -69.4 -39.5 11.6 8.6 54.2 152 153 A R H X S+ 0 0 154 -4,-2.2 4,-0.7 1,-0.2 -1,-0.3 0.818 115.8 43.7 -53.3 -46.6 7.9 9.3 54.1 153 154 A L H X S+ 0 0 49 -4,-1.6 4,-1.5 -3,-0.3 8,-0.3 0.772 114.7 43.9 -72.6 -41.8 7.2 5.7 53.4 154 155 A V H < S+ 0 0 34 -4,-2.3 4,-0.2 2,-0.2 -2,-0.2 0.545 104.1 63.3 -96.0 -7.8 9.6 3.9 55.8 155 156 A G H < S+ 0 0 67 -4,-1.3 3,-0.2 -5,-0.3 -1,-0.2 0.893 106.7 49.8 -62.0 -42.1 8.7 6.2 58.7 156 157 A S H < S- 0 0 101 -4,-0.7 2,-0.3 1,-0.2 -2,-0.2 0.973 141.8 -27.3 -63.2 -68.3 5.2 4.6 58.2 157 158 A Q X - 0 0 139 -4,-1.5 4,-2.6 1,-0.1 -1,-0.2 -0.972 65.8-144.6-157.1 113.9 6.1 0.9 58.1 158 159 A A H > S+ 0 0 62 -2,-0.3 4,-2.5 -4,-0.2 5,-0.2 0.918 90.3 40.3 -64.4 -56.6 9.6 0.1 56.9 159 160 A G H > S+ 0 0 60 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.950 120.3 44.6 -58.2 -48.9 9.3 -3.2 54.9 160 161 A L H > S+ 0 0 109 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.916 113.3 51.1 -59.5 -49.6 6.1 -2.3 53.3 161 162 A G H X S+ 0 0 2 -4,-2.6 4,-2.2 -8,-0.3 -7,-0.2 0.904 109.6 50.5 -58.3 -38.3 7.3 1.3 52.5 162 163 A E H X S+ 0 0 26 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.910 111.2 48.1 -68.1 -39.1 10.5 -0.0 50.8 163 164 A Y H X S+ 0 0 129 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.921 111.5 50.0 -60.6 -51.3 8.6 -2.5 48.7 164 165 A L H X S+ 0 0 63 -4,-2.5 4,-2.8 2,-0.2 5,-0.4 0.899 109.2 51.4 -65.1 -32.4 6.1 0.2 47.6 165 166 A F H X>S+ 0 0 2 -4,-2.2 4,-2.3 2,-0.2 5,-2.0 0.946 111.8 46.5 -66.9 -44.1 8.8 2.6 46.6 166 167 A E H <5S+ 0 0 8 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.897 119.0 42.3 -65.1 -34.1 10.6 0.0 44.5 167 168 A R H <5S+ 0 0 128 -4,-2.4 -1,-0.2 3,-0.2 -2,-0.2 0.848 124.9 29.7 -75.9 -45.4 7.4 -1.0 42.9 168 169 A L H <5S+ 0 0 139 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.669 130.9 25.1-107.0 -13.5 5.8 2.4 42.3 169 170 A T T <5 0 0 73 -4,-2.3 -3,-0.2 -5,-0.4 -4,-0.1 0.743 360.0 360.0-110.5 -48.3 8.5 4.9 41.8 170 171 A L < 0 0 58 -5,-2.0 -3,-0.2 -122,-0.0 -4,-0.2 0.773 360.0 360.0 -90.3 360.0 11.4 2.8 40.6