==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 15-OCT-10 3P90 . COMPND 2 MOLECULE: CHLORIDE INTRACELLULAR CHANNEL PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.O.CROSS,S.FANUCCHI,I.A.ACHILONU,M.A.FERNANDES,H.W.DIRR . 236 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12698.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 2 0.8 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 . 11 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 37.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 2 0 1 1 0 0 1 2 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 6 A P 0 0 114 0, 0.0 34,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 119.3 -38.2 -9.2 -12.1 2 7 A Q - 0 0 163 62,-0.1 63,-2.6 1,-0.1 2,-0.5 -0.260 360.0-169.6 -66.1 123.3 -36.4 -6.9 -9.6 3 8 A V E +A 64 0A 7 32,-0.5 34,-2.0 61,-0.2 2,-0.5 -0.945 9.3 176.4-111.9 118.3 -32.8 -5.8 -10.5 4 9 A E E -Ab 63 37A 39 59,-3.0 59,-3.2 -2,-0.5 2,-0.4 -0.945 13.4-160.7-134.0 113.4 -31.0 -4.1 -7.7 5 10 A L E -Ab 62 38A 0 32,-2.8 34,-2.5 -2,-0.5 2,-0.5 -0.770 6.0-156.1 -94.2 129.4 -27.3 -3.0 -7.9 6 11 A F E +Ab 61 39A 6 55,-2.8 55,-1.7 -2,-0.4 2,-0.3 -0.940 19.8 177.8-108.4 122.2 -25.4 -2.3 -4.7 7 12 A V E - b 0 40A 0 32,-1.9 34,-2.2 -2,-0.5 2,-0.3 -0.766 35.1 -90.9-122.9 161.8 -22.5 0.1 -5.1 8 13 A K E - b 0 41A 78 -2,-0.3 9,-2.6 32,-0.2 34,-0.2 -0.573 42.0-131.4 -75.8 133.2 -19.9 1.7 -2.8 9 14 A A B -D 16 0B 10 32,-2.9 7,-0.3 -2,-0.3 34,-0.2 -0.437 18.4-128.5 -79.3 157.7 -20.9 5.1 -1.3 10 15 A G > - 0 0 15 5,-3.1 3,-1.9 7,-0.2 7,-0.2 0.123 50.6 -51.7 -85.8-155.5 -18.6 8.2 -1.3 11 16 A S T 3 S+ 0 0 85 1,-0.3 5,-0.0 5,-0.1 -2,-0.0 0.608 133.8 47.8 -63.3 -22.4 -17.4 10.7 1.3 12 17 A D T 3 S- 0 0 91 3,-0.1 -1,-0.3 0, 0.0 30,-0.1 0.478 109.3-119.6 -93.7 -5.9 -20.8 11.5 2.7 13 18 A G S < S+ 0 0 17 -3,-1.9 29,-0.2 2,-0.2 -2,-0.1 0.524 99.8 67.0 78.4 5.1 -21.8 7.9 2.9 14 19 A A S S+ 0 0 56 27,-0.1 26,-0.3 2,-0.1 3,-0.1 0.742 79.8 66.1-121.3 -55.1 -24.7 8.6 0.5 15 20 A K S S- 0 0 69 1,-0.1 -5,-3.1 -6,-0.1 2,-0.2 -0.241 97.5 -76.4 -74.7 166.6 -23.6 9.5 -3.1 16 21 A I B -D 9 0B 43 -7,-0.3 204,-0.4 202,-0.1 -7,-0.2 -0.451 53.6-151.5 -68.2 125.4 -21.8 7.1 -5.5 17 22 A G - 0 0 1 -9,-2.6 2,-0.3 -2,-0.2 -7,-0.2 -0.298 32.8 -66.7 -90.9 177.6 -18.1 6.7 -4.5 18 23 A N S S+ 0 0 21 205,-0.2 -1,-0.1 -9,-0.1 200,-0.0 -0.533 73.8 125.9 -71.0 128.4 -15.1 6.0 -6.6 19 24 A C > - 0 0 21 -2,-0.3 4,-1.6 158,-0.1 5,-0.1 -0.569 43.6-156.9 177.4 110.2 -15.1 2.4 -8.0 20 25 A P H > S+ 0 0 14 0, 0.0 4,-2.3 0, 0.0 158,-0.1 0.807 97.9 57.8 -70.3 -23.5 -14.7 1.7 -11.8 21 26 A F H > S+ 0 0 82 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.873 104.4 50.2 -70.3 -40.3 -16.5 -1.7 -11.2 22 27 A S H > S+ 0 0 1 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.948 113.6 45.5 -57.9 -50.0 -19.6 0.1 -9.8 23 28 A Q H X S+ 0 0 6 -4,-1.6 4,-2.8 1,-0.2 -2,-0.2 0.900 109.3 56.9 -65.4 -39.7 -19.7 2.4 -12.8 24 29 A R H X S+ 0 0 10 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.874 111.2 40.2 -53.3 -52.2 -19.1 -0.5 -15.2 25 30 A L H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.857 113.4 55.0 -71.3 -37.5 -22.2 -2.5 -14.1 26 31 A F H X S+ 0 0 26 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.914 110.2 47.4 -55.1 -48.7 -24.3 0.7 -13.8 27 32 A M H X S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 -2,-0.2 0.934 109.7 52.9 -60.5 -46.3 -23.4 1.4 -17.4 28 33 A V H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.928 113.6 43.4 -54.7 -48.5 -24.2 -2.3 -18.4 29 34 A L H X>S+ 0 0 0 -4,-2.5 4,-0.9 2,-0.2 5,-0.6 0.892 113.2 50.1 -64.9 -45.9 -27.7 -1.9 -16.8 30 35 A W H ><5S+ 0 0 78 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.981 112.7 48.0 -55.4 -50.9 -28.4 1.5 -18.3 31 36 A L H 3<5S+ 0 0 23 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.811 103.8 62.4 -59.9 -31.2 -27.4 0.2 -21.7 32 37 A K H 3<5S- 0 0 2 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.711 98.8-133.5 -71.8 -20.9 -29.6 -2.8 -21.3 33 38 A G T <<5 + 0 0 61 -3,-1.4 -3,-0.1 -4,-0.9 -2,-0.1 0.405 56.7 144.4 84.2 -5.2 -32.8 -0.8 -21.1 34 39 A V < - 0 0 16 -5,-0.6 2,-0.6 1,-0.1 -1,-0.3 -0.168 58.3-111.3 -64.7 156.6 -33.8 -2.9 -18.1 35 40 A T + 0 0 129 -34,-0.1 -32,-0.5 -3,-0.1 2,-0.3 -0.863 59.3 142.2 -90.9 122.3 -35.7 -1.4 -15.1 36 41 A F - 0 0 50 -2,-0.6 2,-0.3 -34,-0.1 -32,-0.2 -0.896 36.7-137.5-145.8 173.0 -33.4 -1.4 -12.2 37 42 A N E -b 4 0A 108 -34,-2.0 -32,-2.8 -2,-0.3 2,-0.4 -0.939 9.7-136.8-136.6 171.7 -32.3 0.6 -9.2 38 43 A V E -b 5 0A 29 -2,-0.3 2,-0.5 -34,-0.2 -32,-0.2 -0.974 11.4-171.8-129.8 133.7 -29.1 1.5 -7.4 39 44 A T E -b 6 0A 48 -34,-2.5 -32,-1.9 -2,-0.4 2,-0.1 -0.963 15.1-147.4-130.6 112.9 -28.3 1.5 -3.7 40 45 A T E -b 7 0A 42 -2,-0.5 2,-0.5 -26,-0.3 -32,-0.2 -0.474 13.1-146.2 -75.0 150.1 -25.1 3.0 -2.5 41 46 A V E -b 8 0A 5 -34,-2.2 -32,-2.9 -2,-0.1 2,-1.0 -0.987 9.4-148.3-126.2 119.3 -23.5 1.4 0.6 42 47 A D > - 0 0 42 -2,-0.5 3,-2.1 3,-0.4 -32,-0.1 -0.799 16.4-156.9 -78.9 104.8 -21.6 3.3 3.3 43 48 A T T 3 S+ 0 0 62 -2,-1.0 3,-0.3 1,-0.3 -1,-0.1 0.571 90.2 55.3 -67.4 -8.3 -19.2 0.4 4.2 44 49 A K T 3 S+ 0 0 185 1,-0.2 -1,-0.3 -31,-0.0 2,-0.1 0.521 118.5 33.3 -96.6 -6.9 -18.6 2.0 7.6 45 50 A R S < S- 0 0 204 -3,-2.1 -3,-0.4 -32,-0.1 2,-0.3 -0.604 82.3-176.0-146.3 71.7 -22.3 2.1 8.4 46 51 A R - 0 0 64 -3,-0.3 -3,-0.1 -5,-0.1 -5,-0.1 -0.571 23.5-122.5 -79.6 138.3 -24.0 -1.0 6.7 47 52 A T > - 0 0 74 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.295 21.0-116.1 -71.2 157.7 -27.8 -1.4 6.9 48 53 A E H > S+ 0 0 170 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.925 116.8 59.8 -54.7 -45.2 -29.3 -4.5 8.4 49 54 A T H >> S+ 0 0 91 1,-0.2 4,-2.3 2,-0.2 3,-0.6 0.943 108.2 40.2 -44.8 -64.2 -30.7 -5.2 4.8 50 55 A V H 3> S+ 0 0 3 1,-0.3 4,-3.4 2,-0.2 -1,-0.2 0.864 111.0 57.6 -58.3 -45.7 -27.2 -5.3 3.1 51 56 A Q H 3< S+ 0 0 108 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.856 113.2 42.0 -51.6 -38.2 -25.6 -7.3 6.0 52 57 A K H << S+ 0 0 173 -4,-1.9 -2,-0.2 -3,-0.6 -1,-0.2 0.844 116.3 47.2 -81.8 -35.1 -28.3 -9.9 5.4 53 58 A L H < S+ 0 0 42 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.906 129.4 18.8 -70.3 -44.0 -28.2 -9.8 1.5 54 59 A C >< + 0 0 5 -4,-3.4 3,-2.1 -5,-0.2 -1,-0.2 -0.640 63.8 175.1-133.6 77.3 -24.4 -10.0 1.3 55 60 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.758 79.0 63.2 -57.8 -25.2 -22.8 -11.3 4.5 56 61 A G T 3 S- 0 0 57 1,-0.1 -5,-0.1 2,-0.1 -2,-0.0 0.648 102.2-130.0 -74.5 -17.8 -19.3 -11.4 2.8 57 62 A G < + 0 0 22 -3,-2.1 -1,-0.1 1,-0.2 -6,-0.0 0.433 48.2 157.5 88.4 -3.4 -19.3 -7.6 2.3 58 63 A Q - 0 0 94 13,-0.0 -1,-0.2 2,-0.0 -2,-0.1 -0.278 30.0-135.3 -59.5 135.7 -18.3 -7.6 -1.4 59 64 A L S S+ 0 0 42 1,-0.1 2,-0.2 11,-0.0 -52,-0.1 -0.980 79.0 40.4-139.5 140.3 -19.2 -4.5 -3.4 60 65 A P S S+ 0 0 6 0, 0.0 11,-0.5 0, 0.0 2,-0.3 0.571 79.3 160.5 -68.3 159.7 -20.4 -4.1 -6.1 61 66 A F E -AC 6 70A 0 -55,-1.7 -55,-2.8 -2,-0.2 2,-0.4 -0.983 29.3-135.8-144.3 155.1 -23.0 -6.9 -5.9 62 67 A L E -AC 5 69A 0 7,-3.0 7,-2.5 -2,-0.3 2,-0.5 -0.929 3.4-156.7-112.9 131.9 -26.2 -7.5 -7.8 63 68 A L E +AC 4 68A 32 -59,-3.2 -59,-3.0 -2,-0.4 2,-0.5 -0.932 17.9 179.7-100.7 122.7 -29.6 -8.6 -6.4 64 69 A Y E > -AC 3 67A 53 3,-3.3 3,-2.1 -2,-0.5 2,-0.5 -0.934 62.7 -47.0-133.0 108.7 -31.6 -10.3 -9.1 65 70 A G T 3 S- 0 0 31 -63,-2.6 -61,-0.0 -2,-0.5 -2,-0.0 -0.612 125.3 -25.8 63.5-115.1 -35.0 -11.5 -8.1 66 71 A T T 3 S+ 0 0 145 -2,-0.5 2,-0.3 -3,-0.1 -1,-0.3 0.499 121.9 94.2-100.2 -8.6 -34.2 -13.3 -4.8 67 72 A E E < -C 64 0A 121 -3,-2.1 -3,-3.3 2,-0.0 2,-0.4 -0.664 60.0-146.6-102.0 141.7 -30.5 -14.1 -5.6 68 73 A V E -C 63 0A 46 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.870 13.9-170.0-102.8 135.2 -27.3 -12.2 -4.9 69 74 A H E -C 62 0A 35 -7,-2.5 -7,-3.0 -2,-0.4 2,-0.2 -0.987 4.8-176.7-124.1 128.9 -24.4 -12.3 -7.3 70 75 A T E +C 61 0A 53 -2,-0.4 -9,-0.1 -9,-0.2 4,-0.1 -0.706 45.2 73.3-116.9 175.3 -20.9 -11.0 -6.5 71 76 A D >> - 0 0 80 -11,-0.5 4,-2.2 -2,-0.2 3,-0.7 0.876 69.1-131.1 79.9 97.1 -17.7 -10.7 -8.7 72 77 A T H 3> S+ 0 0 13 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.845 104.4 50.1 -44.4 -53.3 -18.0 -7.8 -11.2 73 78 A N H 3> S+ 0 0 81 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.896 115.0 46.4 -56.5 -40.0 -16.8 -9.8 -14.3 74 79 A K H <> S+ 0 0 132 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.816 109.0 52.0 -73.5 -36.0 -19.3 -12.6 -13.4 75 80 A I H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.934 111.0 50.6 -62.6 -44.1 -22.2 -10.2 -12.7 76 81 A E H X S+ 0 0 19 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.925 111.5 45.9 -62.0 -47.5 -21.5 -8.7 -16.2 77 82 A E H X S+ 0 0 130 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.928 113.5 50.8 -59.1 -46.7 -21.5 -12.2 -17.9 78 83 A F H X S+ 0 0 50 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.938 110.6 48.9 -54.6 -49.1 -24.6 -13.1 -16.0 79 84 A L H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.908 112.0 47.4 -59.2 -45.0 -26.3 -9.9 -17.1 80 85 A E H < S+ 0 0 20 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.896 114.3 48.8 -63.2 -40.4 -25.4 -10.3 -20.8 81 86 A A H < S+ 0 0 65 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.907 119.8 33.2 -68.8 -41.5 -26.6 -13.9 -20.7 82 87 A V H < S+ 0 0 55 -4,-2.4 2,-0.9 1,-0.2 -2,-0.2 0.721 111.4 59.5 -93.1 -29.3 -30.0 -13.3 -19.1 83 88 A L S < S+ 0 0 4 -4,-2.2 -1,-0.2 -5,-0.3 -49,-0.1 -0.813 84.6 143.5 -98.1 85.6 -31.0 -9.9 -20.4 84 89 A C > - 0 0 43 -2,-0.9 4,-1.2 1,-0.1 3,-0.4 -0.783 35.7 -28.7-130.2 166.6 -31.0 -10.8 -24.2 85 90 A P T 4 S+ 0 0 68 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.090 109.3 23.5 -52.1 151.4 -32.7 -10.2 -27.6 86 91 A P T 4 S+ 0 0 134 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.929 134.1 37.4 -73.7 -29.6 -35.4 -9.5 -28.6 87 92 A R T 4 S+ 0 0 188 -3,-0.4 -4,-0.0 -2,-0.1 0, 0.0 0.812 130.0 15.5 -50.2 -44.1 -36.3 -7.9 -25.2 88 93 A Y S < S- 0 0 34 -4,-1.2 -55,-0.1 -55,-0.0 -56,-0.1 -0.953 87.1-102.3-136.3 148.7 -32.8 -6.4 -24.5 89 94 A P - 0 0 65 0, 0.0 2,-0.4 0, 0.0 -6,-0.1 -0.414 30.3-116.5 -74.9 150.0 -29.8 -5.7 -26.8 90 95 A K - 0 0 117 1,-0.1 -6,-0.1 -6,-0.1 -9,-0.0 -0.731 29.6-173.5 -72.8 136.3 -26.6 -7.9 -26.8 91 96 A L + 0 0 11 -2,-0.4 79,-1.9 2,-0.1 80,-0.3 0.496 40.2 119.6-113.9 -11.6 -23.8 -5.7 -25.6 92 97 A A S S- 0 0 51 77,-0.2 -2,-0.1 78,-0.1 2,-0.0 -0.286 71.6-106.8 -55.9 135.9 -20.9 -8.0 -26.2 93 98 A A - 0 0 16 1,-0.1 -1,-0.1 3,-0.1 -2,-0.1 -0.360 16.9-144.3 -57.5 145.8 -18.3 -6.7 -28.6 94 99 A L S S+ 0 0 145 70,-0.2 -1,-0.1 1,-0.1 3,-0.1 0.838 87.3 61.2 -74.8 -43.9 -18.1 -8.4 -32.1 95 100 A N S >> S- 0 0 33 1,-0.1 3,-2.2 69,-0.1 4,-0.6 -0.832 76.6-147.4 -94.7 115.9 -14.4 -8.1 -32.4 96 101 A P G >4 S+ 0 0 103 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.812 95.7 62.8 -53.8 -34.1 -12.5 -10.0 -29.7 97 102 A E G >> S+ 0 0 119 1,-0.3 4,-2.2 2,-0.2 3,-1.8 0.769 89.0 67.3 -68.4 -22.8 -9.7 -7.5 -29.7 98 103 A S G <4 S+ 0 0 2 -3,-2.2 -1,-0.3 1,-0.3 66,-0.1 0.811 94.7 61.4 -58.8 -28.7 -12.0 -4.7 -28.6 99 104 A N G << S+ 0 0 76 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.482 113.4 33.6 -75.3 -4.6 -12.2 -6.7 -25.3 100 105 A T T X4 S+ 0 0 80 -3,-1.8 3,-2.2 -4,-0.1 4,-0.3 0.693 83.7 109.2-123.1 -31.5 -8.4 -6.3 -24.8 101 106 A A T 3< S+ 0 0 12 -4,-2.2 34,-0.1 1,-0.3 74,-0.1 -0.178 93.6 7.7 -47.6 126.3 -7.3 -2.9 -26.2 102 107 A G T > S+ 0 0 3 29,-0.2 3,-1.8 1,-0.1 4,-0.5 0.393 85.9 126.7 82.6 -3.1 -6.4 -0.5 -23.3 103 108 A L T < S+ 0 0 88 -3,-2.2 4,-0.4 1,-0.3 3,-0.3 0.779 71.4 53.4 -59.9 -28.6 -6.6 -3.1 -20.6 104 109 A D T 3> S+ 0 0 66 -4,-0.3 4,-1.2 1,-0.2 -1,-0.3 0.425 85.4 85.5 -85.0 0.1 -3.1 -2.3 -19.3 105 110 A I H <> S+ 0 0 2 -3,-1.8 4,-2.6 1,-0.2 5,-0.2 0.904 84.4 54.4 -72.1 -39.8 -3.6 1.4 -18.9 106 111 A F H > S+ 0 0 43 -4,-0.5 4,-3.0 -3,-0.3 -1,-0.2 0.928 109.2 46.2 -59.4 -49.3 -5.1 1.3 -15.4 107 112 A A H > S+ 0 0 70 -4,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.762 112.7 51.2 -63.9 -32.9 -2.2 -0.7 -13.9 108 113 A K H X S+ 0 0 83 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.860 111.4 47.4 -71.9 -39.9 0.3 1.7 -15.6 109 114 A F H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.931 108.5 57.1 -59.8 -48.1 -1.6 4.7 -14.1 110 115 A S H X S+ 0 0 25 -4,-3.0 4,-1.6 1,-0.2 5,-0.2 0.905 108.5 44.1 -53.4 -49.0 -1.5 2.9 -10.8 111 116 A A H X S+ 0 0 45 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.917 114.8 51.8 -60.2 -41.6 2.3 2.7 -10.8 112 117 A Y H < S+ 0 0 0 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.874 115.1 38.2 -62.8 -45.7 2.5 6.3 -12.0 113 118 A I H < S+ 0 0 0 -4,-2.9 122,-0.3 1,-0.2 121,-0.2 0.637 116.2 50.1 -83.2 -22.0 0.2 7.8 -9.3 114 119 A K H < S+ 0 0 109 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.709 86.3 109.3 -91.8 -21.4 1.4 5.7 -6.3 115 120 A N < + 0 0 20 -4,-1.5 120,-0.4 -5,-0.2 119,-0.0 -0.278 37.3 175.2 -50.2 134.0 5.1 6.3 -7.0 116 121 A S + 0 0 72 118,-0.1 120,-0.5 119,-0.1 -1,-0.1 0.289 53.7 101.3-120.8 -2.5 6.9 8.6 -4.5 117 122 A N >> - 0 0 83 1,-0.1 3,-2.8 118,-0.1 4,-0.6 -0.771 56.3-162.3 -90.2 103.5 10.3 8.1 -6.1 118 123 A P T 34 S+ 0 0 89 0, 0.0 4,-0.4 0, 0.0 3,-0.3 0.690 88.1 66.3 -56.3 -24.5 11.2 11.3 -8.3 119 124 A A T 34 S+ 0 0 87 1,-0.2 4,-0.2 2,-0.1 3,-0.1 0.706 106.4 40.2 -70.0 -19.9 13.8 9.2 -10.1 120 125 A L T <> S+ 0 0 73 -3,-2.8 4,-2.9 1,-0.1 5,-0.2 0.500 87.7 93.2-112.6 -3.9 11.1 7.0 -11.7 121 126 A N H X S+ 0 0 30 -4,-0.6 4,-1.5 -3,-0.3 -1,-0.1 0.769 86.7 48.2 -61.2 -33.0 8.4 9.6 -12.5 122 127 A D H > S+ 0 0 123 -4,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.900 113.1 47.5 -79.9 -38.9 9.5 10.2 -16.0 123 128 A N H > S+ 0 0 99 -4,-0.2 4,-2.7 2,-0.2 5,-0.2 0.974 112.9 48.9 -60.9 -58.0 9.8 6.4 -16.8 124 129 A L H X S+ 0 0 27 -4,-2.9 4,-1.9 1,-0.2 -12,-0.2 0.830 111.1 50.1 -51.0 -39.3 6.3 5.7 -15.3 125 130 A E H X S+ 0 0 55 -4,-1.5 4,-3.1 -5,-0.2 -1,-0.2 0.947 110.2 49.9 -65.3 -47.1 4.8 8.6 -17.2 126 131 A K H X S+ 0 0 138 -4,-2.4 4,-3.4 1,-0.2 -2,-0.2 0.934 108.9 52.9 -56.1 -48.3 6.3 7.3 -20.5 127 132 A G H X S+ 0 0 22 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.874 110.9 47.1 -53.5 -42.9 4.9 3.8 -19.7 128 133 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 -20,-0.2 -2,-0.2 0.954 111.7 49.6 -63.1 -52.6 1.5 5.4 -19.2 129 134 A L H X S+ 0 0 47 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.920 110.0 52.7 -50.8 -48.0 1.8 7.4 -22.5 130 135 A K H X S+ 0 0 140 -4,-3.4 4,-2.1 1,-0.2 -1,-0.2 0.916 107.8 48.9 -57.3 -49.2 2.9 4.2 -24.3 131 136 A A H X S+ 0 0 3 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.856 111.5 51.3 -61.3 -36.1 -0.2 2.2 -23.1 132 137 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.869 107.6 52.6 -63.8 -39.0 -2.4 5.1 -24.2 133 138 A K H X S+ 0 0 81 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.851 105.5 53.8 -70.4 -35.9 -0.7 5.1 -27.6 134 139 A V H X S+ 0 0 84 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.942 110.9 46.7 -60.7 -45.9 -1.4 1.4 -28.0 135 140 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.923 110.5 52.8 -58.3 -46.5 -5.1 2.1 -27.3 136 141 A D H X S+ 0 0 7 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.897 106.1 54.0 -54.9 -43.2 -5.0 5.0 -29.7 137 142 A N H X S+ 0 0 84 -4,-2.4 4,-0.8 2,-0.2 -1,-0.2 0.890 109.0 48.4 -56.8 -42.9 -3.6 2.6 -32.4 138 143 A Y H >< S+ 0 0 21 -4,-1.7 3,-0.8 1,-0.2 -2,-0.2 0.926 110.8 50.3 -64.9 -43.1 -6.6 0.2 -31.8 139 144 A L H 3< S+ 0 0 6 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.690 112.6 46.4 -70.6 -26.7 -9.1 3.1 -32.1 140 145 A T H 3< S+ 0 0 39 -4,-1.5 18,-2.3 -5,-0.2 -1,-0.2 0.515 91.5 95.4 -90.8 -8.3 -7.6 4.4 -35.4 141 146 A S S << S- 0 0 60 -4,-0.8 16,-0.1 -3,-0.8 15,-0.0 -0.770 85.2-112.4 -86.3 122.3 -7.4 0.9 -37.1 142 147 A P - 0 0 63 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.194 27.3-137.2 -50.5 134.4 -10.4 0.2 -39.3 143 148 A L > - 0 0 12 -4,-0.1 3,-1.3 1,-0.1 21,-0.0 -0.489 31.3 -98.8 -82.1 166.1 -12.6 -2.6 -38.0 144 149 A P G > S+ 0 0 92 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.811 122.8 63.7 -58.8 -32.3 -14.0 -5.2 -40.5 145 150 A E G 3 S+ 0 0 165 1,-0.3 20,-0.0 2,-0.0 0, 0.0 0.848 103.1 52.1 -52.3 -35.7 -17.3 -3.4 -40.7 146 151 A E G X S+ 0 0 25 -3,-1.3 3,-1.7 2,-0.0 -1,-0.3 0.194 79.5 156.6 -88.6 10.4 -15.3 -0.5 -42.2 147 152 A V T < S- 0 0 101 -3,-1.7 3,-0.1 1,-0.3 -4,-0.0 -0.102 71.1 -15.3 -48.7 128.4 -13.6 -2.6 -44.9 148 153 A D T 3 S+ 0 0 164 1,-0.1 2,-0.5 -6,-0.0 -1,-0.3 0.685 94.5 128.9 50.5 29.0 -12.3 -0.5 -47.9 149 154 A E < + 0 0 140 -3,-1.7 2,-0.3 2,-0.0 7,-0.1 -0.972 36.2 167.7-109.6 124.4 -14.4 2.7 -47.2 150 155 A T - 0 0 95 -2,-0.5 2,-0.5 5,-0.1 5,-0.1 -0.988 42.7-141.8-143.9 144.7 -12.1 5.9 -47.2 151 156 A S > - 0 0 68 -2,-0.3 3,-1.7 3,-0.3 6,-0.1 -0.887 33.2-131.7 -90.8 133.8 -11.8 9.6 -47.3 152 157 A A G > S+ 0 0 75 -2,-0.5 3,-0.6 1,-0.3 -1,-0.1 0.818 108.5 50.1 -59.3 -37.1 -8.9 10.6 -49.5 153 158 A E G 3 S+ 0 0 180 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.560 122.6 35.5 -74.9 -7.8 -7.4 13.0 -46.9 154 159 A D G X S+ 0 0 72 -3,-1.7 3,-1.3 3,-0.0 -3,-0.3 -0.106 78.5 171.3-139.4 43.4 -7.8 10.1 -44.3 155 160 A E T < + 0 0 133 -3,-0.6 3,-0.1 1,-0.2 -5,-0.1 -0.266 69.8 9.4 -62.7 133.9 -7.1 6.8 -46.0 156 161 A G T 3 S+ 0 0 52 1,-0.2 2,-0.4 -7,-0.1 -1,-0.2 0.742 98.3 122.1 74.6 23.9 -6.8 3.8 -43.7 157 162 A V < - 0 0 52 -3,-1.3 -1,-0.2 -6,-0.1 -6,-0.2 -0.988 60.8-124.2-121.9 129.9 -8.0 5.6 -40.7 158 163 A S - 0 0 0 -18,-2.3 -8,-0.0 -2,-0.4 -17,-0.0 -0.324 18.4-173.1 -67.4 147.2 -11.1 4.5 -38.7 159 164 A Q + 0 0 112 -2,-0.0 -1,-0.1 -13,-0.0 -19,-0.1 0.330 41.2 129.4-120.5 3.0 -13.9 7.0 -38.1 160 165 A R - 0 0 11 -21,-0.1 6,-0.1 1,-0.1 44,-0.0 -0.129 56.3-135.1 -55.1 156.3 -16.0 4.8 -35.6 161 166 A K S S+ 0 0 101 46,-0.1 46,-0.2 42,-0.0 5,-0.2 0.924 75.4 24.7 -82.4 -48.7 -17.1 6.3 -32.3 162 167 A F B > S-E 165 0C 2 3,-2.4 3,-0.8 45,-0.1 6,-0.1 -0.436 94.6 -78.9-116.0-178.1 -16.3 3.6 -29.8 163 168 A L T 3 S+ 0 0 1 1,-0.2 3,-0.1 -2,-0.1 5,-0.1 0.838 124.3 21.7 -44.0 -48.6 -14.0 0.5 -29.2 164 169 A D T 3 S- 0 0 15 3,-0.4 2,-0.3 1,-0.2 -70,-0.2 0.187 130.2 -56.1-116.1 8.8 -15.9 -2.0 -31.4 165 170 A G B < S-E 162 0C 19 -3,-0.8 -3,-2.4 -72,-0.1 -1,-0.2 -0.979 87.7 -39.2 142.8-152.2 -18.0 0.2 -33.8 166 171 A N S S+ 0 0 86 -2,-0.3 2,-0.3 -5,-0.2 -3,-0.1 0.439 113.1 72.9 -95.5 2.6 -20.5 3.0 -33.4 167 172 A E S S- 0 0 132 -5,-0.1 -3,-0.4 -76,-0.0 2,-0.2 -0.902 87.7-107.5-112.9 147.2 -22.4 1.5 -30.4 168 173 A L - 0 0 8 -2,-0.3 2,-0.2 -5,-0.1 -2,-0.1 -0.490 43.0-174.2 -68.8 132.2 -21.2 1.2 -26.8 169 174 A T > - 0 0 11 -2,-0.2 4,-2.1 -4,-0.1 -77,-0.2 -0.611 44.4 -91.1-115.5 179.7 -20.3 -2.4 -25.8 170 175 A L H > S+ 0 0 16 -79,-1.9 4,-2.2 1,-0.2 5,-0.2 0.876 125.6 62.9 -56.0 -38.9 -19.3 -4.3 -22.7 171 176 A A H > S+ 0 0 8 -80,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.906 105.4 44.3 -51.1 -51.1 -15.7 -3.4 -23.7 172 177 A D H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.899 108.7 57.2 -60.7 -45.7 -16.5 0.3 -23.3 173 178 A C H < S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.848 113.7 40.9 -55.2 -37.2 -18.4 -0.3 -19.9 174 179 A N H X S+ 0 0 28 -4,-2.2 4,-0.8 -5,-0.1 -2,-0.2 0.958 122.4 37.7 -72.2 -54.2 -15.1 -1.9 -18.6 175 180 A L H >X S+ 0 0 6 -4,-2.5 4,-2.6 -5,-0.2 3,-0.5 0.894 106.2 61.1 -70.0 -47.1 -12.6 0.6 -20.0 176 181 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.885 101.2 51.7 -56.2 -47.2 -14.3 4.0 -19.8 177 182 A P H 3> S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.871 114.2 47.4 -57.2 -33.9 -14.7 4.1 -15.9 178 183 A K H - 0 0 40 0, 0.0 3,-2.4 0, 0.0 7,-0.2 -0.389 17.5-139.3 -64.0 125.3 -2.1 14.2 -25.2 196 201 A E T 3 S+ 0 0 120 1,-0.3 6,-0.1 -2,-0.2 -2,-0.1 0.604 98.1 77.2 -53.1 -10.9 -4.8 15.6 -27.6 197 202 A A T 3 S+ 0 0 76 1,-0.2 2,-1.5 2,-0.1 -1,-0.3 0.524 70.8 81.8 -82.9 -10.4 -2.5 14.1 -30.3 198 203 A F <> + 0 0 26 -3,-2.4 4,-2.8 1,-0.2 -1,-0.2 -0.737 65.7 173.4 -83.7 79.1 -3.8 10.7 -29.5 199 204 A R H > + 0 0 136 -2,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.756 69.2 56.2 -71.9 -22.6 -6.7 11.7 -31.7 200 205 A G H > S+ 0 0 2 2,-0.2 4,-2.5 -3,-0.2 -1,-0.2 0.943 113.0 40.5 -68.8 -51.6 -8.3 8.2 -31.6 201 206 A V H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.902 114.4 55.2 -55.8 -43.4 -8.4 8.3 -27.7 202 207 A F H X S+ 0 0 78 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.901 110.6 43.1 -63.0 -39.2 -9.5 11.9 -27.9 203 208 A R H X S+ 0 0 63 -4,-1.6 4,-2.6 2,-0.2 5,-0.3 0.952 111.5 56.7 -74.5 -48.6 -12.5 11.1 -30.1 204 209 A Y H X S+ 0 0 1 -4,-2.5 4,-1.8 1,-0.2 3,-0.3 0.933 111.7 40.1 -37.5 -65.2 -13.3 8.1 -28.0 205 210 A L H X S+ 0 0 8 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.802 113.0 55.8 -69.1 -27.5 -13.6 10.1 -24.8 206 211 A S H X S+ 0 0 55 -4,-1.8 4,-1.4 -5,-0.3 -1,-0.2 0.890 112.5 41.8 -65.7 -40.1 -15.4 13.0 -26.5 207 212 A N H < S+ 0 0 49 -4,-2.6 -2,-0.2 -3,-0.3 -1,-0.2 0.763 112.7 54.4 -79.2 -26.7 -18.0 10.7 -27.8 208 213 A A H >< S+ 0 0 0 -4,-1.8 3,-1.5 -5,-0.3 7,-0.5 0.938 108.6 48.8 -70.5 -44.7 -18.1 8.9 -24.4 209 214 A Y H 3< S+ 0 0 81 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.797 103.7 59.3 -67.4 -34.2 -18.8 12.2 -22.6 210 215 A A T 3< S+ 0 0 84 -4,-1.4 2,-0.5 -5,-0.1 -1,-0.3 0.548 93.8 84.5 -66.3 -8.9 -21.6 13.2 -25.0 211 216 A R S X> S- 0 0 69 -3,-1.5 4,-2.0 -4,-0.2 3,-1.4 -0.865 71.7-148.0-104.3 119.6 -23.4 9.9 -24.0 212 217 A E H 3> S+ 0 0 120 -2,-0.5 4,-2.1 1,-0.3 5,-0.2 0.815 94.9 68.6 -57.7 -26.9 -25.6 10.0 -20.8 213 218 A E H 34 S+ 0 0 28 1,-0.2 -1,-0.3 2,-0.2 -183,-0.1 0.849 113.4 29.5 -60.9 -34.3 -24.8 6.3 -20.1 214 219 A F H X4 S+ 0 0 0 -3,-1.4 3,-1.5 -6,-0.4 4,-0.4 0.930 123.4 45.4 -82.9 -59.9 -21.2 7.3 -19.4 215 220 A A H >< S+ 0 0 48 -4,-2.0 3,-1.3 -7,-0.5 -3,-0.2 0.894 112.1 51.2 -55.4 -45.5 -21.5 10.9 -18.0 216 221 A S T 3< S+ 0 0 68 -4,-2.1 -1,-0.3 1,-0.3 -3,-0.1 0.506 108.6 49.5 -74.3 -7.8 -24.5 10.2 -15.7 217 222 A T T < S+ 0 0 1 -3,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.260 85.1 113.2-116.6 3.5 -22.9 7.2 -13.9 218 223 A C < - 0 0 30 -3,-1.3 3,-0.1 -4,-0.4 -202,-0.1 -0.666 69.1-126.6 -70.8 126.7 -19.6 9.0 -13.2 219 224 A P - 0 0 9 0, 0.0 -202,-0.1 0, 0.0 -2,-0.1 -0.351 47.4 -79.5 -61.5 160.3 -18.9 9.7 -9.6 220 225 A D >> - 0 0 95 -204,-0.4 4,-1.7 1,-0.1 3,-1.1 -0.352 37.8-116.4 -61.6 141.1 -18.2 13.4 -8.9 221 226 A D H 3> S+ 0 0 89 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.879 116.7 57.7 -40.8 -45.8 -14.7 14.6 -9.8 222 227 A E H 3> S+ 0 0 120 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.828 103.0 51.3 -58.6 -41.1 -14.2 15.4 -6.1 223 228 A E H <> S+ 0 0 9 -3,-1.1 4,-2.5 2,-0.2 -205,-0.2 0.937 111.4 46.6 -62.6 -51.4 -15.0 11.8 -5.0 224 229 A I H X S+ 0 0 0 -4,-1.7 4,-1.0 1,-0.2 -2,-0.2 0.914 115.6 47.6 -53.8 -46.3 -12.4 10.3 -7.5 225 230 A E H < S+ 0 0 43 -4,-2.6 4,-0.4 -5,-0.2 -2,-0.2 0.839 111.7 49.2 -66.7 -33.8 -9.9 13.0 -6.3 226 231 A L H >< S+ 0 0 78 -4,-2.3 3,-1.1 1,-0.2 4,-0.4 0.916 105.7 57.8 -72.8 -39.3 -10.6 12.3 -2.6 227 232 A A H 3< S+ 0 0 59 -4,-2.5 3,-0.2 1,-0.2 4,-0.2 0.792 114.5 37.7 -55.0 -32.8 -10.2 8.6 -3.1 228 233 A Y T 3X S+ 0 0 23 -4,-1.0 4,-3.3 -3,-0.2 5,-0.3 0.366 86.1 99.3-103.2 0.8 -6.7 9.0 -4.4 229 234 A E H <> S+ 0 0 94 -3,-1.1 4,-1.0 -4,-0.4 -1,-0.2 0.751 81.5 51.2 -71.9 -23.0 -5.4 11.9 -2.2 230 235 A Q H 4 S+ 0 0 152 -4,-0.4 4,-0.3 -3,-0.2 -1,-0.2 0.941 120.0 32.3 -79.5 -46.8 -3.5 9.7 0.1 231 236 A V H >4 S+ 0 0 56 -4,-0.2 3,-0.8 1,-0.2 4,-0.4 0.872 119.3 52.1 -76.7 -35.3 -1.5 7.7 -2.5 232 237 A A H >< S+ 0 0 2 -4,-3.3 3,-0.7 1,-0.2 -3,-0.2 0.858 104.2 55.2 -72.4 -32.4 -1.3 10.6 -5.1 233 238 A K T 3< S+ 0 0 108 -4,-1.0 -1,-0.2 -5,-0.3 -2,-0.1 0.543 85.2 87.0 -71.9 -13.6 0.2 13.2 -2.6 234 239 A A T < + 0 0 48 -3,-0.8 2,-0.6 -4,-0.3 -1,-0.2 0.859 65.2 91.8 -62.3 -37.7 3.1 10.9 -1.6 235 240 A L < 0 0 33 -3,-0.7 -119,-0.1 -120,-0.4 -118,-0.1 -0.452 360.0 360.0 -65.0 109.1 5.3 12.1 -4.5 236 241 A K 0 0 199 -2,-0.6 -1,-0.1 -120,-0.5 -2,-0.1 0.388 360.0 360.0-119.9 360.0 7.5 15.0 -3.4