==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 23-JUN-10 3NND . COMPND 2 MOLECULE: POSSIBLE SUBSTRATE BINDING PROTEIN OF ABC TRANSPO . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOPSEUDOMONAS PALUSTRIS; . AUTHOR Z.ZHANG,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX RESEARCH CENTE . 1326 22 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54875.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 943 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 160 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 8 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 . 97 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 453 34.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.4 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 5 1 0 8 2 0 2 2 11 6 0 0 0 3 1 4 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 14 0 0 2 9 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 4 2 6 0 0 4 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 . 8 2 5 2 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 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 14 B D 0 0 116 0, 0.0 2,-0.4 0, 0.0 43,-0.2 0.000 360.0 360.0 360.0-171.3 -8.2 -59.0 27.7 2 15 B L E -a 44 0A 1 41,-2.1 43,-2.3 2,-0.0 2,-0.5 -0.908 360.0-166.4-133.2 105.4 -7.3 -55.3 27.7 3 16 B K E -a 45 0A 55 -2,-0.4 69,-2.3 67,-0.3 70,-0.8 -0.820 7.4-177.3-107.5 126.4 -10.1 -53.3 26.2 4 17 B I E -ab 46 73A 0 41,-2.3 43,-3.2 -2,-0.5 2,-0.4 -0.968 12.3-150.7-123.7 131.0 -9.7 -49.6 25.2 5 18 B A E -ab 47 74A 0 68,-2.8 70,-2.6 -2,-0.4 2,-0.5 -0.871 4.0-161.9-104.8 134.4 -12.4 -47.4 23.8 6 19 B L E -ab 48 75A 1 41,-3.1 43,-2.3 -2,-0.4 2,-0.4 -0.969 6.1-164.6-112.7 118.4 -11.7 -44.6 21.4 7 20 B I E +a 49 0A 1 68,-3.9 2,-0.3 -2,-0.5 70,-0.2 -0.840 25.5 147.4 -98.1 139.2 -14.5 -42.0 21.1 8 21 B Y E -a 50 0A 1 41,-2.2 2,-2.4 -2,-0.4 43,-2.1 -0.974 61.0-104.3-166.9 155.1 -14.2 -39.7 18.1 9 22 B G + 0 0 0 -2,-0.3 9,-0.4 42,-0.2 10,-0.2 -0.494 46.7 167.1 -75.8 68.4 -16.0 -37.7 15.5 10 23 B K S S+ 0 0 79 -2,-2.4 2,-0.3 8,-0.1 -1,-0.2 0.768 71.5 23.1 -58.1 -27.0 -15.1 -40.3 12.9 11 24 B T S S+ 0 0 59 -3,-0.2 3,-0.3 7,-0.0 40,-0.0 -0.956 105.2 41.9-135.1 158.1 -17.6 -38.5 10.7 12 25 B G S > S- 0 0 29 -2,-0.3 3,-2.2 1,-0.2 4,-0.2 -0.561 107.5 -19.7 101.9-170.2 -18.9 -35.0 10.8 13 26 B P T 3 S+ 0 0 60 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.672 137.0 38.8 -49.1 -35.5 -17.3 -31.6 11.3 14 27 B L T 3> S+ 0 0 5 -3,-0.3 4,-2.3 1,-0.2 3,-0.4 0.112 78.3 120.1-105.2 24.5 -14.1 -32.8 13.0 15 28 B E H <> + 0 0 100 -3,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.728 67.2 60.0 -63.3 -28.8 -13.6 -35.9 10.9 16 29 B A H > S+ 0 0 40 -3,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.954 110.8 41.6 -64.6 -49.1 -10.2 -34.9 9.6 17 30 B Y H >> S+ 0 0 8 -3,-0.4 4,-2.2 1,-0.2 3,-0.9 0.942 107.1 61.0 -61.0 -53.1 -8.8 -34.8 13.1 18 31 B A H 3X S+ 0 0 0 -4,-2.3 4,-1.9 -9,-0.4 -1,-0.2 0.862 101.4 55.2 -43.2 -43.0 -10.6 -38.0 14.2 19 32 B K H 3X S+ 0 0 102 -4,-1.5 4,-2.1 1,-0.2 -1,-0.3 0.890 108.3 48.0 -61.8 -39.3 -8.7 -40.0 11.5 20 33 B Q H <>S+ 0 0 54 -4,-1.5 5,-2.5 -5,-0.2 3,-0.9 0.972 112.0 45.6 -56.6 -56.9 2.1 -51.0 18.4 31 44 B Y H ><5S+ 0 0 71 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.884 112.2 52.5 -55.2 -40.5 5.3 -49.1 19.4 32 45 B A H 3<5S+ 0 0 33 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.744 115.9 38.5 -71.1 -22.5 4.7 -49.7 23.1 33 46 B T T X<5S- 0 0 13 -4,-1.3 3,-2.3 -3,-0.9 -1,-0.3 0.109 110.1-114.7-114.4 18.8 4.2 -53.5 22.7 34 47 B K T < 5S- 0 0 192 -3,-1.1 -3,-0.2 1,-0.3 -4,-0.1 0.880 77.7 -53.8 42.9 45.9 7.0 -54.0 20.1 35 48 B G T 3 S-E 42 0B 14 3,-2.3 3,-2.0 -2,-0.3 -6,-0.1 -0.980 75.4 -15.9-123.2 126.5 0.8 -56.3 27.4 40 53 B D T 3 S- 0 0 80 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.936 131.3 -48.3 43.3 58.9 1.9 -58.7 30.2 41 54 B G T 3 S+ 0 0 84 1,-0.2 2,-0.4 -3,-0.2 -1,-0.3 0.520 115.0 124.9 65.9 3.8 0.2 -61.6 28.5 42 55 B R E < -E 39 0B 67 -3,-2.0 -3,-2.3 -41,-0.0 2,-0.3 -0.826 59.8-133.2 -96.6 134.2 -2.9 -59.5 28.0 43 56 B K E -E 38 0B 114 -2,-0.4 -41,-2.1 -5,-0.3 2,-0.6 -0.670 19.4-138.0 -83.7 137.4 -4.3 -59.1 24.5 44 57 B I E +a 2 0A 5 -7,-2.8 2,-0.4 -2,-0.3 -41,-0.2 -0.863 23.2 179.3-103.0 115.7 -5.1 -55.5 23.6 45 58 B V E -a 3 0A 51 -43,-2.3 -41,-2.3 -2,-0.6 2,-0.4 -0.888 13.4-151.0-112.5 147.4 -8.4 -54.7 21.7 46 59 B V E -a 4 0A 33 -2,-0.4 2,-0.5 -43,-0.2 -41,-0.2 -0.957 4.3-161.5-121.0 133.1 -9.6 -51.3 20.7 47 60 B I E -a 5 0A 32 -43,-3.2 -41,-3.1 -2,-0.4 2,-0.4 -0.962 9.1-155.8-116.2 123.8 -13.2 -50.4 20.3 48 61 B T E -a 6 0A 55 -2,-0.5 2,-0.4 -43,-0.2 -41,-0.2 -0.807 7.5-170.0-106.1 144.0 -14.1 -47.3 18.3 49 62 B K E -a 7 0A 25 -43,-2.3 -41,-2.2 -2,-0.4 2,-0.6 -0.965 15.5-144.3-134.8 112.3 -17.3 -45.2 18.6 50 63 B D E +a 8 0A 56 -2,-0.4 -41,-0.2 -43,-0.2 11,-0.1 -0.683 19.3 176.1 -77.0 114.9 -18.3 -42.5 16.2 51 64 B D > - 0 0 0 -43,-2.1 3,-3.5 -2,-0.6 7,-0.4 0.348 35.0-136.4-100.5 4.8 -20.0 -39.7 18.1 52 65 B Q T 3 - 0 0 79 -44,-0.6 -43,-0.2 1,-0.3 -37,-0.1 0.653 60.1 -75.3 53.6 14.8 -20.3 -37.5 15.0 53 66 B S T 3 S+ 0 0 8 1,-0.3 -1,-0.3 -41,-0.1 29,-0.1 0.848 101.1 134.7 61.9 32.0 -19.2 -34.7 17.2 54 67 B K <> - 0 0 96 -3,-3.5 4,-3.0 1,-0.1 -1,-0.3 -0.973 51.8-149.4-110.8 125.4 -22.6 -34.7 18.8 55 68 B P H > S+ 0 0 51 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.906 98.2 50.2 -56.1 -48.4 -22.6 -34.5 22.6 56 69 B D H > S+ 0 0 113 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.926 115.7 42.9 -56.0 -49.9 -25.9 -36.5 23.0 57 70 B L H > S+ 0 0 60 -6,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.897 112.4 53.6 -62.4 -43.6 -24.5 -39.2 20.7 58 71 B S H X S+ 0 0 0 -4,-3.0 4,-1.8 -7,-0.4 -2,-0.2 0.827 104.4 54.8 -64.8 -34.2 -21.1 -39.2 22.3 59 72 B K H X S+ 0 0 106 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.905 113.0 42.6 -62.4 -41.8 -22.6 -39.7 25.8 60 73 B A H X S+ 0 0 54 -4,-1.4 4,-3.7 2,-0.2 5,-0.3 0.964 111.3 53.9 -68.5 -53.2 -24.4 -42.8 24.6 61 74 B A H X S+ 0 0 11 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.859 112.1 46.4 -47.2 -42.0 -21.4 -44.1 22.6 62 75 B L H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.929 113.8 45.9 -71.4 -48.8 -19.3 -43.8 25.8 63 76 B A H X S+ 0 0 18 -4,-2.2 4,-3.1 2,-0.2 5,-0.4 0.988 115.3 48.2 -52.5 -60.6 -21.9 -45.5 28.0 64 77 B E H X>S+ 0 0 90 -4,-3.7 4,-1.9 1,-0.2 5,-1.4 0.889 108.0 57.0 -45.1 -46.9 -22.3 -48.2 25.4 65 78 B A H <5S+ 0 0 0 -4,-2.3 6,-2.0 -5,-0.3 4,-0.5 0.926 118.0 30.3 -54.4 -50.9 -18.5 -48.5 25.2 66 79 B Y H X5S+ 0 0 3 -4,-2.3 4,-0.9 -3,-0.3 -2,-0.2 0.963 128.2 39.4 -72.1 -54.6 -18.1 -49.3 28.9 67 80 B Q H <5S+ 0 0 119 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.943 127.1 26.8 -63.4 -57.0 -21.4 -51.0 29.6 68 81 B D T <5S+ 0 0 124 -4,-1.9 -3,-0.2 -5,-0.4 -1,-0.1 0.859 131.5 32.2 -80.6 -39.0 -21.9 -53.1 26.4 69 82 B D T 4 S- 0 0 1 1,-0.1 4,-1.5 21,-0.1 5,-0.1 -0.645 74.4-141.5 -83.7 129.3 -15.1 -32.2 19.9 80 93 B S H > S+ 0 0 63 22,-0.5 4,-1.1 -2,-0.4 -1,-0.1 0.923 103.5 43.8 -46.0 -50.9 -14.3 -30.1 22.9 81 94 B A H >> S+ 0 0 45 2,-0.2 4,-1.9 1,-0.2 3,-0.7 0.922 107.9 53.5 -67.0 -49.4 -18.0 -29.9 23.8 82 95 B A H 3> S+ 0 0 0 1,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.779 108.5 56.6 -58.4 -22.6 -19.0 -33.6 23.2 83 96 B A H 3X S+ 0 0 4 -4,-1.5 4,-0.9 2,-0.2 -1,-0.3 0.819 101.7 53.0 -77.0 -33.7 -16.1 -34.2 25.6 84 97 B L H << S+ 0 0 126 -4,-1.1 3,-0.3 -3,-0.7 -2,-0.2 0.845 106.1 53.8 -69.6 -34.4 -17.6 -32.1 28.4 85 98 B A H X S+ 0 0 23 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.858 106.3 56.6 -62.0 -31.6 -20.8 -34.0 28.2 86 99 B D H X S+ 0 0 0 -4,-0.7 4,-1.7 -5,-0.2 3,-0.2 0.721 80.0 83.5 -78.3 -28.3 -18.8 -37.2 28.6 87 100 B L H X S+ 0 0 26 -4,-0.9 4,-1.5 -3,-0.3 -1,-0.2 0.866 94.2 47.3 -45.9 -48.7 -17.0 -36.4 31.9 88 101 B P H > S+ 0 0 53 0, 0.0 4,-4.2 0, 0.0 5,-0.4 0.928 103.9 60.2 -59.5 -46.4 -20.0 -37.6 34.0 89 102 B V H X S+ 0 0 4 -4,-0.5 4,-2.0 1,-0.3 -2,-0.2 0.868 104.0 52.3 -52.5 -38.9 -20.4 -40.8 32.0 90 103 B A H <>S+ 0 0 0 -4,-1.7 5,-2.0 2,-0.2 4,-0.4 0.943 115.9 39.7 -57.5 -50.3 -16.9 -41.8 33.1 91 104 B E H ><5S+ 0 0 98 -4,-1.5 3,-1.7 2,-0.2 -2,-0.2 0.956 113.9 52.8 -64.8 -52.9 -17.9 -41.1 36.7 92 105 B E H 3<5S+ 0 0 141 -4,-4.2 -1,-0.2 1,-0.3 -2,-0.2 0.847 116.6 41.2 -51.6 -35.6 -21.3 -42.7 36.3 93 106 B N T 3<5S- 0 0 28 -4,-2.0 -1,-0.3 -5,-0.4 -2,-0.2 0.435 105.8-128.8 -96.4 0.6 -19.6 -45.8 34.9 94 107 B K T < 5 + 0 0 144 -3,-1.7 2,-0.3 -4,-0.4 194,-0.2 0.822 68.7 112.2 55.9 39.5 -16.7 -45.8 37.4 95 108 B K < - 0 0 46 -5,-2.0 -1,-0.2 -6,-0.2 2,-0.2 -0.856 69.7 -89.2-134.2 169.2 -14.0 -46.0 34.7 96 109 B I E -c 73 0A 0 -24,-0.6 -22,-2.4 -2,-0.3 2,-0.4 -0.511 28.4-165.0 -85.4 144.0 -11.3 -43.8 33.3 97 110 B L E -cd 74 107A 0 9,-3.2 11,-2.0 -2,-0.2 2,-0.6 -0.953 4.9-160.2-127.5 117.1 -11.6 -41.2 30.5 98 111 B I E -cd 75 108A 1 -24,-2.6 -22,-3.0 -2,-0.4 2,-0.6 -0.849 21.6-136.5 -94.7 119.3 -8.6 -39.8 28.8 99 112 B V - 0 0 18 9,-2.2 11,-0.4 -2,-0.6 -22,-0.3 -0.668 29.3-170.6 -89.4 115.1 -9.6 -36.6 27.1 100 113 B E - 0 0 6 -2,-0.6 -23,-0.2 -24,-0.5 -93,-0.1 -0.945 55.0 -20.7-166.3 129.3 -8.1 -36.3 23.6 101 114 B P 0 0 21 0, 0.0 -23,-0.2 0, 0.0 9,-0.1 -0.925 360.0 360.0 -84.1 -26.2 -7.9 -34.2 21.6 102 115 B A 0 0 53 -25,-2.8 -22,-0.5 -2,-0.1 -21,-0.1 -0.105 360.0 360.0 35.0 360.0 -10.8 -32.0 22.7 103 ! 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 0.0 104 126 B N > 0 0 69 0, 0.0 3,-2.5 0, 0.0 -14,-0.0 0.000 360.0 360.0 360.0 164.6 -13.7 -35.7 38.4 105 127 B R T 3 + 0 0 108 1,-0.3 209,-0.0 -9,-0.0 -9,-0.0 0.564 360.0 62.4 -62.2 -9.5 -11.3 -38.3 39.5 106 128 B Y T 3 S+ 0 0 22 -19,-0.1 -9,-3.2 -10,-0.1 2,-0.4 0.489 87.9 88.4 -94.7 -2.5 -11.9 -40.4 36.4 107 129 B I E < -d 97 0A 6 -3,-2.5 2,-0.4 -11,-0.2 -9,-0.2 -0.797 49.4-178.9-101.1 134.3 -10.7 -37.8 34.0 108 130 B F E -d 98 0A 0 -11,-2.0 -9,-2.2 -2,-0.4 207,-0.2 -1.000 17.2-147.7-127.1 133.3 -7.1 -37.4 32.9 109 131 B R - 0 0 120 205,-3.1 -9,-0.1 -2,-0.4 204,-0.0 -0.477 13.5-128.9-104.7 173.4 -6.2 -34.6 30.5 110 132 B T - 0 0 31 -11,-0.4 205,-0.1 1,-0.2 2,-0.1 0.493 50.6-106.0-107.7 -6.6 -3.6 -34.3 27.8 111 133 B G - 0 0 6 2,-0.0 2,-0.4 196,-0.0 -1,-0.2 -0.169 32.3 -76.2 105.7 162.3 -1.7 -31.1 28.5 112 134 B R + 0 0 116 204,-0.4 2,-0.3 -2,-0.1 753,-0.0 -0.838 55.1 167.7 -97.2 134.1 -1.5 -27.6 27.2 113 135 B N > - 0 0 23 -2,-0.4 4,-1.6 1,-0.0 3,-0.2 -0.861 47.7-103.8-140.7 177.5 0.5 -27.1 24.0 114 136 B S H > S+ 0 0 53 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.747 113.9 59.8 -78.4 -25.6 1.2 -24.7 21.2 115 137 B S H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.840 107.2 48.9 -65.7 -33.3 -1.0 -26.4 18.6 116 138 B Q H > S+ 0 0 50 2,-0.2 4,-3.7 1,-0.2 -2,-0.2 0.914 110.3 48.5 -72.4 -46.3 -3.9 -25.8 20.9 117 139 B D H X S+ 0 0 99 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.892 114.7 48.1 -54.5 -41.4 -3.0 -22.2 21.4 118 140 B A H X S+ 0 0 17 -4,-1.9 4,-2.6 2,-0.3 -2,-0.2 0.890 111.8 46.2 -73.7 -42.9 -2.7 -22.0 17.6 119 141 B I H X S+ 0 0 27 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.931 112.8 54.8 -58.5 -46.2 -6.0 -23.7 17.0 120 142 B S H X S+ 0 0 60 -4,-3.7 4,-2.6 2,-0.2 -2,-0.3 0.942 109.4 45.0 -46.4 -59.2 -7.3 -21.3 19.7 121 143 B N H X S+ 0 0 113 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.955 110.8 52.2 -56.0 -53.9 -6.1 -18.3 17.9 122 144 B A H X S+ 0 0 14 -4,-2.6 4,-2.3 1,-0.2 102,-0.3 0.903 110.7 50.3 -49.8 -46.5 -7.4 -19.4 14.5 123 145 B V H X S+ 0 0 30 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.950 109.2 49.6 -55.6 -55.0 -10.8 -19.9 16.1 124 146 B A H < S+ 0 0 37 -4,-2.6 3,-0.4 1,-0.2 -2,-0.2 0.912 109.9 53.2 -50.9 -45.3 -10.8 -16.5 17.7 125 147 B I H >< S+ 0 0 52 -4,-2.7 3,-2.0 1,-0.2 -1,-0.2 0.940 105.6 51.5 -58.9 -50.0 -9.9 -15.0 14.3 126 148 B G H 3< S+ 0 0 13 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.798 107.8 54.7 -56.6 -29.4 -12.8 -16.7 12.4 127 149 B K T 3< S+ 0 0 103 -4,-1.5 -1,-0.3 -3,-0.4 2,-0.2 0.230 102.8 72.3 -90.5 13.7 -15.2 -15.3 15.1 128 150 B Q S < S- 0 0 113 -3,-2.0 60,-0.0 -5,-0.1 -3,-0.0 -0.747 88.5 -81.5-125.0 173.1 -14.0 -11.7 14.5 129 151 B G - 0 0 38 -2,-0.2 60,-1.7 29,-0.0 2,-0.4 -0.176 27.3-150.1 -75.2 162.5 -14.4 -9.1 11.8 130 152 B V - 0 0 6 27,-0.4 29,-2.2 58,-0.1 2,-0.4 -0.965 12.0-175.9-133.2 120.5 -12.6 -8.7 8.5 131 153 B T E -f 159 0C 10 58,-2.5 2,-0.4 -2,-0.4 29,-0.2 -0.953 8.8-163.6-115.0 133.9 -12.1 -5.3 6.9 132 154 B I E -f 160 0C 2 27,-2.6 29,-2.1 -2,-0.4 30,-0.8 -0.907 15.0-172.1-121.0 142.7 -10.5 -4.9 3.5 133 155 B A E -fg 162 192C 0 58,-2.4 60,-2.2 -2,-0.4 2,-0.3 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293 D F H > S+ 0 0 6 -273,-1.2 4,-1.9 1,-0.2 -272,-0.1 0.844 127.6 47.5 -51.7 -39.8 12.4 14.6 12.4 1276 294 D F H > S+ 0 0 8 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.787 108.6 53.1 -81.5 -26.2 15.4 16.9 12.2 1277 295 D T H > S+ 0 0 1 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.932 112.4 44.5 -70.4 -45.0 13.4 19.9 11.1 1278 296 D A H X S+ 0 0 6 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.885 110.9 56.4 -67.3 -36.3 11.1 19.6 14.0 1279 297 D G H X S+ 0 0 6 -4,-1.9 4,-2.3 -5,-0.3 -1,-0.2 0.934 107.9 45.9 -58.0 -50.4 14.1 19.0 16.2 1280 298 D G H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.853 111.6 54.8 -60.5 -34.8 15.7 22.3 15.2 1281 299 D F H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.959 107.0 48.6 -63.1 -50.5 12.3 23.8 15.7 1282 300 D S H X S+ 0 0 12 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.902 109.5 52.9 -55.6 -45.9 12.1 22.5 19.3 1283 301 D A H X S+ 0 0 1 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.924 109.3 49.1 -54.5 -48.0 15.6 23.8 20.0 1284 302 D A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.850 110.8 51.5 -59.7 -36.1 14.6 27.3 18.8 1285 303 D X H X S+ 0 0 17 -4,-2.0 4,-2.3 1,-0.2 5,-0.3 0.873 104.8 55.0 -71.1 -37.6 11.5 27.1 21.0 1286 304 D A H X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.927 111.9 45.2 -60.7 -41.9 13.4 26.2 24.1 1287 305 D V H X S+ 0 0 0 -4,-1.7 4,-3.5 2,-0.2 5,-0.3 0.962 114.2 43.8 -70.0 -54.1 15.6 29.3 23.6 1288 306 D V H X S+ 0 0 5 -4,-2.1 4,-1.8 1,-0.2 5,-0.2 0.918 117.2 47.5 -60.2 -44.1 12.9 31.9 22.8 1289 307 D T H X S+ 0 0 33 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.944 115.1 47.0 -58.0 -50.6 10.7 30.6 25.6 1290 308 D A H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.3 5,-0.3 0.939 113.0 46.6 -58.0 -52.2 13.7 30.6 28.0 1291 309 D V H X S+ 0 0 3 -4,-3.5 4,-1.3 1,-0.2 5,-0.3 0.762 113.8 49.3 -67.2 -26.1 14.9 34.1 27.1 1292 310 D Q H < S+ 0 0 107 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.891 114.1 46.0 -73.5 -39.6 11.4 35.5 27.4 1293 311 D K H < S+ 0 0 128 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.861 117.1 42.4 -72.9 -37.1 10.9 33.8 30.7 1294 312 D A H < S- 0 0 21 -4,-2.8 -1,-0.2 2,-0.2 -3,-0.2 0.842 92.4-143.5 -75.3 -34.4 14.3 34.9 32.1 1295 313 D K S < S+ 0 0 125 -4,-1.3 2,-0.3 1,-0.3 -3,-0.1 0.688 75.1 62.9 69.5 19.9 14.0 38.5 30.7 1296 314 D S S S- 0 0 14 -5,-0.3 -1,-0.3 -6,-0.2 -2,-0.2 -0.958 77.3-130.3-155.8 175.1 17.8 38.2 30.1 1297 315 D T + 0 0 19 -2,-0.3 2,-0.4 -3,-0.1 -279,-0.1 0.170 61.8 132.9-114.8 15.0 20.5 36.4 28.2 1298 316 D D > - 0 0 75 1,-0.1 4,-1.8 -7,-0.1 5,-0.2 -0.533 59.8-134.6 -68.5 123.8 22.6 35.8 31.3 1299 317 D T H > S+ 0 0 15 -2,-0.4 4,-2.7 1,-0.2 3,-0.5 0.896 103.0 48.0 -39.7 -56.1 23.7 32.2 31.4 1300 318 D E H > S+ 0 0 85 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.894 111.8 46.2 -60.9 -46.8 22.9 31.9 35.2 1301 319 D K H > S+ 0 0 126 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.718 113.6 53.9 -68.7 -20.2 19.4 33.4 34.9 1302 320 D L H X S+ 0 0 2 -4,-1.8 4,-2.6 -3,-0.5 -2,-0.2 0.912 104.5 50.2 -78.5 -48.0 18.8 31.2 31.9 1303 321 D I H X S+ 0 0 4 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.912 112.6 50.9 -55.7 -38.9 19.7 27.9 33.6 1304 322 D A H < S+ 0 0 65 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.924 111.5 45.2 -64.7 -44.9 17.3 28.9 36.4 1305 323 D A H < S+ 0 0 8 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.871 111.1 53.9 -67.1 -36.7 14.5 29.7 34.0 1306 324 D X H >< S+ 0 0 0 -4,-2.6 3,-1.7 2,-0.1 14,-0.4 0.770 84.4 93.1 -75.3 -29.5 14.9 26.5 32.0 1307 325 D E T 3< S+ 0 0 42 -4,-1.4 14,-0.2 1,-0.3 3,-0.1 -0.519 108.2 0.6 -66.4 126.6 14.8 24.1 34.9 1308 326 D G T 3 S+ 0 0 50 12,-2.5 2,-0.3 -2,-0.3 -1,-0.3 0.495 101.6 147.8 74.9 2.8 11.2 22.9 35.3 1309 327 D X < - 0 0 10 -3,-1.7 11,-2.1 11,-0.2 2,-0.4 -0.535 38.1-149.7 -78.0 130.3 10.3 25.0 32.3 1310 328 D E E +Q 1319 0R 62 -2,-0.3 2,-0.3 9,-0.2 9,-0.3 -0.774 20.1 173.3 -93.7 144.2 7.6 24.0 29.9 1311 329 D F E -Q 1318 0R 9 7,-2.6 7,-3.0 -2,-0.4 2,-0.4 -0.989 30.1-115.4-147.8 148.9 7.8 25.0 26.3 1312 330 D D E +Q 1317 0R 76 -2,-0.3 5,-0.2 5,-0.2 -23,-0.1 -0.699 35.1 175.6 -88.6 134.3 5.7 24.1 23.2 1313 331 D T E > -Q 1316 0R 1 3,-2.5 3,-3.1 -2,-0.4 -55,-0.3 -0.857 50.3 -88.7-131.1 168.0 7.3 22.2 20.3 1314 332 D P T 3 S+ 0 0 1 0, 0.0 -59,-0.1 0, 0.0 -56,-0.1 0.576 129.3 45.0 -50.9 -12.7 6.1 20.7 17.0 1315 333 D K T 3 S- 0 0 50 1,-0.5 2,-0.3 -37,-0.1 -3,-0.0 0.250 123.8 -88.0-118.0 11.7 5.2 17.5 18.9 1316 334 D G E < S-Q 1313 0R 13 -3,-3.1 -3,-2.5 -64,-0.1 -1,-0.5 -0.746 70.9 -17.4 117.2-165.2 3.5 19.1 22.0 1317 335 D K E -Q 1312 0R 37 -396,-0.5 13,-4.0 13,-0.3 2,-0.3 -0.660 56.6-176.0 -88.0 124.2 4.5 20.4 25.4 1318 336 D X E -QR13111329R 12 -7,-3.0 -7,-2.6 -2,-0.4 2,-0.3 -0.772 8.4-161.2-111.3 161.1 7.9 19.6 26.8 1319 337 D V E -QR13101328R 30 9,-1.7 9,-2.0 -2,-0.3 2,-0.6 -0.996 20.7-124.6-137.2 141.1 9.4 20.4 30.2 1320 338 D F E - R 01327R 4 -11,-2.1 -12,-2.5 -14,-0.4 2,-0.3 -0.779 26.1-133.1 -83.7 121.5 13.0 20.3 31.2 1321 339 D R E >>> - R 01326R 28 5,-2.9 4,-1.6 -2,-0.6 3,-0.5 -0.591 9.4-144.9 -71.7 130.2 13.6 18.1 34.2 1322 340 D K G >45S+ 0 0 140 -2,-0.3 3,-0.5 1,-0.2 -1,-0.1 0.955 90.8 61.0 -61.5 -51.7 15.7 19.9 36.8 1323 341 D E G 345S+ 0 0 81 1,-0.2 -1,-0.2 2,-0.1 -803,-0.0 0.711 128.1 7.2 -53.8 -28.3 17.7 16.9 38.1 1324 342 D D G <45S- 0 0 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28.2 177.9 -97.1 127.9 -2.0 11.4 34.2 1334 352 D F E -G 917 0M 8 -417,-3.1 -417,-2.3 -2,-0.5 2,-0.3 -0.923 3.2-174.0-125.0 150.7 -5.4 9.8 33.7 1335 353 D K E -G 916 0M 46 -2,-0.3 -393,-1.7 -395,-0.3 2,-0.4 -0.946 13.2-145.9-139.9 160.2 -6.7 6.6 35.1 1336 354 D V E -G 915 0M 0 -421,-1.9 -421,-2.6 -2,-0.3 2,-0.5 -0.990 13.0-137.9-128.4 142.4 -9.8 4.4 34.8 1337 355 D K E -G 914 0M 80 -2,-0.4 -423,-0.2 -423,-0.2 4,-0.2 -0.859 18.2-176.2 -97.4 126.6 -11.4 2.2 37.4 1338 356 D V >> + 0 0 4 -425,-2.0 4,-1.5 -2,-0.5 3,-0.6 0.569 57.5 91.4-103.5 -11.6 -12.5 -1.2 36.0 1339 357 D D H >> S+ 0 0 38 -426,-0.5 4,-3.4 1,-0.2 3,-0.6 0.922 85.0 54.1 -51.9 -53.6 -14.2 -2.9 38.9 1340 358 D P H 3> S+ 0 0 20 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.831 111.6 44.4 -48.8 -40.3 -17.7 -1.6 38.0 1341 359 D A H <> S+ 0 0 14 -3,-0.6 4,-3.1 2,-0.2 -2,-0.2 0.720 116.4 44.8 -84.7 -24.0 -17.5 -2.9 34.4 1342 360 D V H