==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 18-DEC-08 3FL5 . COMPND 2 MOLECULE: CASEIN KINASE II SUBUNIT ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: ZEA MAYS; . AUTHOR M.MAZZORANA,C.FRANCHIN,R.BATTISTUTTA . 325 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15598.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 217 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 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 . 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 . 26 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 29.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.5 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 4 1 1 1 0 0 2 0 1 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 7 A S 0 0 47 0, 0.0 178,-0.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 150.1 18.0 -11.4 -8.6 2 8 A K - 0 0 133 176,-0.1 2,-0.1 177,-0.1 202,-0.1 -0.980 360.0 -88.2-148.1 161.5 16.8 -7.8 -8.6 3 9 A A - 0 0 2 -2,-0.3 4,-0.2 200,-0.1 301,-0.1 -0.443 22.6-145.8 -69.0 142.7 14.5 -5.5 -6.5 4 10 A R S S+ 0 0 156 -2,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.642 85.0 35.2 -82.7 -17.0 10.8 -5.3 -7.4 5 11 A V S S+ 0 0 55 1,-0.1 200,-0.2 2,-0.0 -1,-0.1 -0.971 120.9 8.2-136.5 150.1 10.7 -1.6 -6.5 6 12 A Y S > S+ 0 0 68 -2,-0.3 3,-1.2 1,-0.1 4,-0.3 0.699 74.1 142.6 57.2 24.0 13.0 1.4 -6.9 7 13 A A T 3 S+ 0 0 19 1,-0.2 3,-0.3 -4,-0.2 -1,-0.1 0.841 71.0 44.1 -61.1 -32.9 15.5 -0.7 -8.9 8 14 A D T 3> S+ 0 0 90 1,-0.2 4,-2.1 2,-0.1 -1,-0.2 0.179 78.7 106.2-102.7 13.7 16.4 2.2 -11.2 9 15 A V H <> S+ 0 0 15 -3,-1.2 4,-1.0 1,-0.2 -1,-0.2 0.951 90.2 35.6 -58.8 -52.9 16.7 5.0 -8.6 10 16 A N H 4 S+ 0 0 4 166,-0.5 -1,-0.2 -4,-0.3 8,-0.1 0.488 113.2 61.8 -81.6 -6.2 20.6 5.1 -8.9 11 17 A V H 4 S+ 0 0 98 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.868 111.1 37.1 -79.4 -41.3 20.4 4.4 -12.6 12 18 A L H < S+ 0 0 133 -4,-2.1 -2,-0.2 -3,-0.1 -3,-0.1 0.607 102.1 86.6 -88.5 -16.6 18.5 7.6 -13.3 13 19 A R S < S- 0 0 84 -4,-1.0 5,-0.1 -5,-0.2 -3,-0.0 -0.496 92.8 -86.1 -86.2 156.3 20.1 9.9 -10.8 14 20 A P >> - 0 0 74 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.267 38.7-117.6 -54.3 147.7 23.3 11.9 -11.5 15 21 A K H >> S+ 0 0 128 1,-0.3 4,-2.7 2,-0.2 3,-0.7 0.856 113.0 69.4 -56.9 -36.8 26.5 9.9 -10.7 16 22 A E H 34 S+ 0 0 144 1,-0.2 -1,-0.3 2,-0.2 6,-0.1 0.709 90.7 63.3 -51.7 -25.6 27.3 12.4 -8.0 17 23 A Y H <4 S+ 0 0 24 -3,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.929 119.8 18.1 -68.7 -46.7 24.3 11.1 -6.0 18 24 A W H << S+ 0 0 71 -3,-0.7 2,-2.0 -4,-0.6 -2,-0.2 0.602 99.9 93.6-102.5 -16.4 25.7 7.5 -5.5 19 25 A D >< + 0 0 37 -4,-2.7 3,-1.0 1,-0.2 4,-0.1 -0.521 45.4 163.2 -82.6 77.0 29.4 8.0 -6.2 20 26 A Y G > + 0 0 22 -2,-2.0 3,-1.3 1,-0.2 -1,-0.2 0.717 63.8 68.7 -72.1 -25.1 30.4 8.6 -2.6 21 27 A E G 3 S+ 0 0 100 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.733 95.4 57.5 -64.3 -24.3 34.1 8.0 -3.2 22 28 A A G < S+ 0 0 68 -3,-1.0 -1,-0.3 -6,-0.1 -2,-0.2 0.490 84.0 113.4 -84.4 -6.4 34.2 11.3 -5.2 23 29 A L < - 0 0 27 -3,-1.3 2,-0.5 -4,-0.1 50,-0.1 -0.384 53.9-156.7 -63.7 140.1 32.9 13.2 -2.1 24 30 A T - 0 0 101 -2,-0.1 2,-0.1 49,-0.0 -2,-0.1 -0.976 20.3-128.4-122.4 117.4 35.2 15.7 -0.5 25 31 A V - 0 0 20 -2,-0.5 2,-0.9 1,-0.1 48,-0.0 -0.400 5.6-145.2 -71.7 131.5 34.3 16.4 3.1 26 32 A Q - 0 0 153 -2,-0.1 2,-0.4 69,-0.0 68,-0.4 -0.851 23.7-146.3 -94.0 98.4 33.9 20.0 4.3 27 33 A W - 0 0 75 -2,-0.9 68,-0.2 1,-0.1 3,-0.1 -0.547 14.8-158.4 -74.9 119.8 35.3 19.7 7.9 28 34 A G - 0 0 27 66,-3.3 2,-0.7 -2,-0.4 68,-0.3 0.158 39.0 -54.5 -80.3-160.6 33.5 22.1 10.3 29 35 A E > - 0 0 123 1,-0.2 3,-1.4 66,-0.1 4,-0.2 -0.737 37.0-162.9 -91.0 112.2 34.7 23.5 13.7 30 36 A Q G > S+ 0 0 72 -2,-0.7 3,-1.0 66,-0.3 -1,-0.2 0.835 91.3 56.1 -56.4 -36.7 35.8 20.8 16.2 31 37 A D G 3 S+ 0 0 129 1,-0.2 -1,-0.3 3,-0.0 22,-0.1 0.561 87.5 79.2 -77.1 -9.6 35.5 23.3 19.1 32 38 A D G < S+ 0 0 39 -3,-1.4 21,-2.0 1,-0.1 22,-0.5 0.629 92.4 53.2 -71.2 -16.7 31.8 24.1 18.3 33 39 A Y E < -A 52 0A 37 -3,-1.0 2,-0.4 -4,-0.2 19,-0.2 -0.970 66.6-165.4-133.3 118.6 30.6 20.9 20.0 34 40 A E E -A 51 0A 119 17,-2.1 17,-1.7 -2,-0.4 2,-0.3 -0.838 25.4-117.5-105.7 138.1 31.3 19.7 23.5 35 41 A V E +A 50 0A 76 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.562 31.4 174.0 -68.8 125.7 30.7 16.2 24.9 36 42 A V E - 0 0 83 13,-2.8 2,-0.3 -2,-0.3 14,-0.2 0.828 62.9 -19.1 -96.1 -49.7 28.2 16.2 27.8 37 43 A R E -A 49 0A 186 12,-1.8 12,-3.0 0, 0.0 -1,-0.3 -0.971 63.9-103.0-163.9 142.7 27.8 12.5 28.5 38 44 A K E +A 48 0A 123 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.508 33.3 174.4 -67.9 131.0 28.3 9.0 26.9 39 45 A V E - 0 0 68 8,-2.4 2,-0.3 1,-0.3 9,-0.2 0.584 52.4 -73.7-116.3 -19.3 25.0 7.6 25.7 40 46 A G E -A 47 0A 26 7,-1.7 7,-2.4 2,-0.0 2,-0.3 -0.991 49.1 -69.6 166.6-149.2 26.2 4.5 24.0 41 47 A R E -A 46 0A 187 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.986 22.4-152.3-138.7 148.3 27.9 2.9 21.0 42 48 A G E > -A 45 0A 11 3,-0.9 3,-0.7 -2,-0.3 5,-0.1 -0.376 52.5 -78.0 -96.6-169.6 27.2 2.4 17.3 43 49 A K T 3 S+ 0 0 70 1,-0.2 126,-0.0 -2,-0.2 -2,-0.0 0.917 127.4 5.4 -56.3 -50.4 28.7 -0.5 15.2 44 50 A Y T 3 S+ 0 0 100 21,-0.1 21,-2.6 2,-0.0 2,-0.3 -0.323 124.8 65.2-129.3 49.2 32.1 1.1 14.9 45 51 A S E < -AB 42 64A 2 -3,-0.7 -3,-0.9 19,-0.3 2,-0.4 -0.979 67.9-122.0-161.5 163.1 31.8 4.2 17.1 46 52 A E E -AB 41 63A 76 17,-2.6 17,-2.9 -2,-0.3 2,-0.4 -0.979 33.5-152.3-116.7 137.3 31.3 5.8 20.5 47 53 A V E -AB 40 62A 23 -7,-2.4 -8,-2.4 -2,-0.4 -7,-1.7 -0.911 13.1-176.2-124.6 135.9 28.3 8.1 20.9 48 54 A F E -AB 38 61A 28 13,-3.1 13,-3.4 -2,-0.4 2,-0.4 -0.960 30.9-121.5-133.4 140.2 27.8 11.1 23.1 49 55 A E E +AB 37 60A 34 -12,-3.0 -13,-2.8 -2,-0.4 -12,-1.8 -0.679 50.6 175.9 -68.0 135.8 25.1 13.5 24.1 50 56 A G E -AB 35 59A 1 9,-3.0 9,-1.7 -2,-0.4 2,-0.3 -0.709 26.9-128.2-135.8-176.8 26.6 16.9 23.3 51 57 A I E -AB 34 58A 41 -17,-1.7 -17,-2.1 7,-0.3 2,-0.7 -0.998 17.2-129.5-140.5 139.6 26.0 20.6 23.1 52 58 A N E > -A 33 0A 25 5,-2.9 4,-2.3 -2,-0.3 3,-0.5 -0.844 20.4-155.9 -84.6 113.0 26.6 23.3 20.5 53 59 A V T 4 S+ 0 0 58 -21,-2.0 -1,-0.1 -2,-0.7 -20,-0.1 0.672 87.0 61.6 -69.3 -18.4 28.5 26.0 22.4 54 60 A N T 4 S+ 0 0 109 -22,-0.5 -1,-0.2 1,-0.1 -21,-0.1 0.892 127.7 6.3 -70.7 -43.0 27.4 28.7 20.0 55 61 A N T 4 S- 0 0 84 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.1 0.329 94.1-117.7-127.0 5.8 23.6 28.4 20.7 56 62 A N < + 0 0 120 -4,-2.3 2,-0.3 1,-0.2 -3,-0.2 0.618 60.4 153.8 63.0 16.2 23.4 25.9 23.6 57 63 A E - 0 0 122 -5,-0.5 -5,-2.9 1,-0.1 -1,-0.2 -0.552 45.9-117.0 -74.8 135.9 21.4 23.4 21.4 58 64 A K E +B 51 0A 109 -2,-0.3 51,-0.6 -7,-0.2 2,-0.3 -0.359 41.7 169.5 -66.0 151.6 21.7 19.7 22.3 59 65 A C E -BC 50 108A 4 -9,-1.7 -9,-3.0 49,-0.2 2,-0.5 -0.940 35.3-108.0-151.4 172.7 23.2 17.4 19.7 60 66 A I E -BC 49 107A 16 47,-2.2 47,-2.4 -2,-0.3 2,-0.6 -0.960 25.1-159.1-108.1 128.0 24.5 13.9 19.2 61 67 A I E -BC 48 106A 6 -13,-3.4 -13,-3.1 -2,-0.5 2,-0.7 -0.938 5.8-170.3-108.6 115.0 28.3 13.4 18.8 62 68 A K E -BC 47 105A 10 43,-3.0 43,-2.7 -2,-0.6 2,-0.7 -0.908 4.5-164.1-108.6 104.2 29.3 10.2 17.1 63 69 A I E -BC 46 104A 49 -17,-2.9 -17,-2.6 -2,-0.7 2,-0.2 -0.812 16.8-139.5 -93.4 117.8 33.0 9.7 17.3 64 70 A L E -B 45 0A 13 39,-2.0 -19,-0.3 -2,-0.7 3,-0.1 -0.530 7.2-126.8 -83.6 138.5 34.1 7.0 14.8 65 71 A K - 0 0 108 -21,-2.6 -1,-0.1 -2,-0.2 -21,-0.1 -0.465 56.9 -66.8 -72.8 155.5 36.6 4.3 15.5 66 72 A P S S+ 0 0 124 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.229 75.1 152.6 -57.0 122.4 39.5 4.2 13.0 67 73 A V - 0 0 47 -3,-0.1 5,-0.1 -2,-0.0 -3,-0.0 -0.956 46.5 -73.4-147.6 161.9 38.1 3.1 9.6 68 74 A K > - 0 0 144 -2,-0.3 4,-1.5 1,-0.1 3,-0.4 -0.161 38.2-120.5 -60.5 148.1 38.9 3.4 5.9 69 75 A K H > S+ 0 0 86 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.831 111.5 59.4 -56.9 -37.5 38.3 6.7 4.0 70 76 A K H > S+ 0 0 110 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.912 104.1 50.2 -57.7 -46.4 35.8 5.0 1.6 71 77 A K H > S+ 0 0 41 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.850 109.3 49.2 -66.1 -39.6 33.6 3.9 4.5 72 78 A I H X S+ 0 0 14 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.888 110.7 50.7 -69.4 -37.2 33.3 7.3 6.1 73 79 A K H X S+ 0 0 37 -4,-1.9 4,-2.8 2,-0.2 5,-0.3 0.887 108.0 54.7 -64.1 -40.2 32.4 8.9 2.8 74 80 A R H X S+ 0 0 33 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.947 110.9 43.6 -58.1 -51.4 29.7 6.3 2.3 75 81 A E H X S+ 0 0 9 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.927 115.6 48.1 -60.7 -47.4 28.0 7.1 5.6 76 82 A I H X S+ 0 0 3 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.909 113.4 46.3 -62.8 -46.7 28.3 10.9 5.1 77 83 A K H X S+ 0 0 37 -4,-2.8 4,-2.9 2,-0.2 -1,-0.2 0.922 112.8 49.1 -62.1 -47.2 26.9 10.8 1.6 78 84 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.3 -2,-0.2 0.927 112.8 49.5 -58.0 -43.2 24.0 8.5 2.5 79 85 A L H X S+ 0 0 1 -4,-2.5 4,-0.9 -5,-0.2 12,-0.4 0.843 111.9 47.1 -65.1 -36.6 23.2 10.8 5.4 80 86 A Q H < S+ 0 0 84 -4,-2.1 3,-0.3 2,-0.2 -2,-0.2 0.895 112.3 50.3 -71.0 -41.1 23.3 13.9 3.2 81 87 A N H < S+ 0 0 27 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.834 115.1 43.4 -61.2 -35.5 21.1 12.2 0.6 82 88 A L H >< S+ 0 0 0 -4,-1.9 3,-3.0 -5,-0.2 2,-0.5 0.530 83.8 140.9 -95.1 -8.3 18.6 11.2 3.3 83 89 A X T 3< S+ 0 0 74 -4,-0.9 7,-0.1 1,-0.3 6,-0.1 -0.670 74.7 4.6 -73.1 124.0 18.5 14.5 5.2 84 90 A G T 3 S+ 0 0 43 -2,-0.5 -1,-0.3 1,-0.2 3,-0.1 -0.099 85.4 135.7-124.9 87.7 15.7 15.0 6.1 85 91 A G S X S- 0 0 8 -3,-3.0 3,-1.7 4,-0.2 -1,-0.2 -0.273 71.3 -59.5 -77.2 170.7 13.2 12.2 5.2 86 92 A P T 3 S- 0 0 59 0, 0.0 54,-0.2 0, 0.0 -1,-0.2 -0.336 118.1 -10.5 -62.1 121.4 10.6 10.9 7.6 87 93 A N T 3 S+ 0 0 22 1,-0.2 80,-3.0 -2,-0.2 2,-0.4 0.645 96.5 136.1 66.5 20.6 12.2 9.5 10.8 88 94 A I B < -e 167 0B 2 -3,-1.7 -1,-0.2 78,-0.2 -4,-0.1 -0.808 62.8-106.4 -93.4 138.6 15.8 9.6 9.6 89 95 A V - 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0 0 44 -4,-2.4 2,-0.4 -5,-0.2 -1,-0.1 -0.392 47.4 -39.4 72.6-142.0 19.0 -30.9 8.9 269 275 A R + 0 0 176 -2,-0.1 2,-0.3 -4,-0.1 -1,-0.0 -0.992 64.7 161.8-131.9 123.7 15.3 -31.6 8.3 270 276 A H - 0 0 52 -2,-0.4 -25,-1.7 -30,-0.1 -24,-0.6 -0.968 29.9-129.5-142.2 153.8 12.5 -29.7 9.9 271 277 A S - 0 0 88 -2,-0.3 -27,-0.3 -27,-0.2 2,-0.2 -0.645 41.9 -90.8 -96.2 159.6 8.8 -29.0 9.5 272 278 A R - 0 0 148 -2,-0.2 -29,-0.2 -29,-0.2 -30,-0.1 -0.493 33.3-144.3 -68.9 135.3 7.2 -25.5 9.5 273 279 A K - 0 0 68 -31,-3.5 5,-0.1 -2,-0.2 -1,-0.0 -0.920 22.3-123.6-104.0 108.7 6.1 -24.3 12.9 274 280 A P > - 0 0 69 0, 0.0 3,-1.4 0, 0.0 4,-0.2 -0.132 16.8-122.2 -47.5 142.3 2.9 -22.2 12.7 275 281 A W G > S+ 0 0 14 1,-0.3 3,-1.8 2,-0.2 4,-0.2 0.810 109.0 65.7 -58.6 -33.5 3.1 -18.7 14.1 276 282 A L G > S+ 0 0 107 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.713 85.9 71.3 -65.8 -22.8 0.3 -19.4 16.5 277 283 A K G < S+ 0 0 129 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.605 91.6 59.6 -68.2 -12.8 2.4 -22.0 18.3 278 284 A F G < S+ 0 0 18 -3,-1.8 -1,-0.3 -4,-0.2 2,-0.2 0.509 82.4 108.5 -91.1 -8.3 4.5 -19.1 19.7 279 285 A M < + 0 0 74 -3,-1.4 2,-0.3 -4,-0.2 -58,-0.1 -0.503 41.3 157.2 -71.2 135.8 1.5 -17.5 21.4 280 286 A N >> - 0 0 78 -2,-0.2 4,-1.8 -59,-0.0 3,-1.1 -0.888 57.3 -84.4-145.9 179.7 1.4 -17.7 25.2 281 287 A A T 34 S+ 0 0 88 1,-0.3 4,-0.2 -2,-0.3 -2,-0.0 0.695 124.0 56.7 -64.2 -20.8 -0.3 -15.9 28.2 282 288 A D T 34 S+ 0 0 111 1,-0.1 -1,-0.3 -61,-0.1 -60,-0.1 0.799 122.5 23.4 -77.0 -28.3 2.5 -13.3 28.3 283 289 A N T X> S+ 0 0 0 -3,-1.1 3,-2.2 -62,-0.1 4,-1.3 0.388 87.3 103.8-123.0 -1.6 1.9 -12.2 24.6 284 290 A Q T 3< S+ 0 0 125 -4,-1.8 3,-0.2 1,-0.3 -3,-0.1 0.831 78.5 61.0 -52.0 -39.8 -1.8 -13.2 23.8 285 291 A H T 34 S+ 0 0 103 -4,-0.2 -1,-0.3 1,-0.2 -161,-0.2 0.524 111.1 41.3 -65.6 -7.6 -2.9 -9.6 24.1 286 292 A L T <4 S+ 0 0 2 -3,-2.2 2,-0.7 -66,-0.3 -1,-0.2 0.611 94.7 86.9-113.2 -24.6 -0.5 -8.7 21.2 287 293 A V < + 0 0 18 -4,-1.3 -1,-0.1 -3,-0.2 -163,-0.0 -0.748 50.7 157.0 -89.7 113.9 -1.0 -11.7 18.9 288 294 A S > - 0 0 27 -2,-0.7 4,-2.4 1,-0.0 5,-0.2 -0.898 55.2-108.3-127.5 157.6 -3.9 -11.2 16.4 289 295 A P H > S+ 0 0 112 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.785 122.1 53.1 -54.5 -30.7 -4.7 -12.8 13.0 290 296 A E H > S+ 0 0 80 2,-0.2 4,-2.2 1,-0.2 27,-0.2 0.882 108.4 49.3 -71.0 -40.1 -3.8 -9.4 11.4 291 297 A A H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.912 114.4 45.6 -61.4 -45.1 -0.5 -9.3 13.2 292 298 A I H X S+ 0 0 29 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.859 110.4 52.3 -67.7 -39.7 0.3 -12.9 12.1 293 299 A D H X S+ 0 0 58 -4,-2.0 4,-1.3 -5,-0.2 -2,-0.2 0.922 114.3 44.6 -62.8 -42.1 -0.9 -12.2 8.5 294 300 A F H X S+ 0 0 0 -4,-2.2 4,-0.5 2,-0.2 3,-0.4 0.949 114.9 46.6 -64.8 -53.0 1.5 -9.3 8.4 295 301 A L H >X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 3,-1.5 0.901 108.6 57.2 -54.4 -45.6 4.4 -11.2 10.1 296 302 A D H 3< S+ 0 0 31 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.838 104.9 50.5 -57.0 -38.1 3.9 -14.1 7.7 297 303 A K H 3< S+ 0 0 67 -4,-1.3 10,-1.6 -3,-0.4 -1,-0.3 0.532 113.8 46.7 -79.7 -8.5 4.3 -11.9 4.6 298 304 A L H << S+ 0 0 0 -3,-1.5 2,-1.9 -4,-0.5 -2,-0.2 0.849 100.6 62.4 -96.3 -49.7 7.6 -10.5 6.1 299 305 A L S < S+ 0 0 3 -4,-2.5 2,-0.4 -86,-0.1 -1,-0.2 -0.550 71.8 136.5 -84.7 77.6 9.4 -13.6 7.3 300 306 A R - 0 0 70 -2,-1.9 6,-0.2 -3,-0.2 5,-0.1 -0.987 55.9-138.1-122.3 132.7 9.8 -15.4 3.9 301 307 A Y S S+ 0 0 14 -2,-0.4 2,-0.6 -107,-0.1 -106,-0.2 0.923 91.7 74.3 -47.9 -52.4 13.0 -17.1 2.8 302 308 A D S >> S- 0 0 8 1,-0.2 3,-1.4 -55,-0.1 4,-0.8 -0.583 71.6-156.9 -73.5 113.4 12.6 -15.6 -0.7 303 309 A H T 34 S+ 0 0 2 -2,-0.6 3,-0.4 1,-0.3 -1,-0.2 0.805 93.7 59.6 -60.4 -31.4 13.5 -11.9 -0.6 304 310 A Q T 34 S+ 0 0 56 1,-0.2 -1,-0.3 -301,-0.1 -2,-0.1 0.684 101.3 54.8 -68.3 -22.2 11.3 -11.4 -3.7 305 311 A E T <4 S+ 0 0 105 -3,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.704 87.2 103.1 -84.3 -22.2 8.2 -12.7 -1.9 306 312 A R S < S- 0 0 4 -4,-0.8 -8,-0.2 -3,-0.4 2,-0.1 -0.231 81.5-100.9 -63.7 147.0 8.5 -10.3 1.1 307 313 A L - 0 0 26 -10,-1.6 -1,-0.1 -13,-0.2 2,-0.1 -0.432 35.2-125.2 -60.9 139.5 6.2 -7.2 1.4 308 314 A T > - 0 0 25 -2,-0.1 4,-2.2 1,-0.1 5,-0.1 -0.356 27.6-106.9 -74.4 165.8 7.9 -4.0 0.4 309 315 A A H > S+ 0 0 3 2,-0.2 4,-1.7 1,-0.2 -170,-0.2 0.875 121.4 51.9 -65.7 -34.8 7.8 -1.2 2.9 310 316 A L H > S+ 0 0 95 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.879 111.4 46.4 -68.9 -41.4 5.1 0.7 1.0 311 317 A E H >4 S+ 0 0 83 1,-0.2 3,-0.8 2,-0.2 4,-0.5 0.888 109.4 56.0 -62.5 -43.7 2.9 -2.4 0.8 312 318 A A H >< S+ 0 0 0 -4,-2.2 3,-1.2 1,-0.2 6,-0.3 0.865 100.3 57.7 -60.0 -40.2 3.4 -3.0 4.5 313 319 A M H 3< S+ 0 0 27 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.767 106.6 49.7 -63.8 -27.1 2.2 0.4 5.5 314 320 A T T << S+ 0 0 92 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.480 79.7 121.0 -92.7 -5.2 -1.2 -0.3 3.8 315 321 A H S X S- 0 0 11 -3,-1.2 3,-2.1 -4,-0.5 4,-0.2 -0.346 77.4-117.4 -57.3 137.7 -1.7 -3.7 5.4 316 322 A P G > S+ 0 0 68 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.681 108.8 78.6 -55.6 -17.9 -5.0 -3.6 7.4 317 323 A Y G 3 S+ 0 0 2 1,-0.3 3,-0.4 -27,-0.2 4,-0.2 0.880 97.9 41.8 -52.5 -40.3 -2.9 -4.2 10.6 318 324 A F G X> S+ 0 0 0 -3,-2.1 4,-2.5 -6,-0.3 3,-0.6 0.306 81.5 115.9 -94.0 9.5 -2.0 -0.5 10.5 319 325 A Q H <> S+ 0 0 118 -3,-1.4 4,-2.6 1,-0.3 -1,-0.2 0.861 77.0 44.8 -47.4 -50.6 -5.5 0.7 9.6 320 326 A Q H 3> S+ 0 0 118 -3,-0.4 4,-1.8 -4,-0.3 -1,-0.3 0.824 111.3 54.3 -66.4 -33.0 -6.1 2.6 12.9 321 327 A V H <> S+ 0 0 4 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.924 111.5 44.6 -66.9 -44.7 -2.6 4.2 12.7 322 328 A R H < S+ 0 0 72 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.939 112.1 52.1 -60.4 -49.6 -3.4 5.5 9.2 323 329 A A H < S+ 0 0 81 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.823 114.1 43.0 -62.0 -33.0 -6.8 6.7 10.2 324 330 A A H < 0 0 78 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.820 360.0 360.0 -77.1 -33.6 -5.4 8.6 13.1 325 331 A E < 0 0 136 -4,-2.0 -3,-0.0 -5,-0.2 0, 0.0 -0.376 360.0 360.0 -72.4 360.0 -2.5 9.9 11.0