==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JUN-02 1M2R . COMPND 2 MOLECULE: CASEIN KINASE II, ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ZEA MAYS; . AUTHOR E.DE MOLINER,S.MORO,S.SARNO,G.ZAGOTTO,G.ZANOTTI,L.A.PINNA, . 327 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15682.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 65.4 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 12.2 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 . 25 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 29.7 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 0 2 1 0 1 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 48 0, 0.0 178,-0.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 138.7 17.1 -10.8 -10.0 2 8 A K - 0 0 138 176,-0.1 202,-0.1 177,-0.1 5,-0.1 -0.976 360.0 -86.2-140.9 153.8 16.1 -7.1 -9.9 3 9 A A - 0 0 2 -2,-0.3 4,-0.2 200,-0.2 301,-0.1 -0.277 26.9-142.1 -58.1 141.3 14.1 -4.9 -7.5 4 10 A R S S+ 0 0 157 2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.633 86.4 30.4 -80.1 -15.0 10.3 -4.9 -8.2 5 11 A V S S+ 0 0 57 1,-0.1 200,-0.2 2,-0.0 -1,-0.1 -0.965 120.8 13.6-141.1 155.9 10.2 -1.2 -7.3 6 12 A Y S > S+ 0 0 65 -2,-0.3 3,-0.9 1,-0.1 4,-0.3 0.713 73.8 143.0 52.6 26.7 12.6 1.8 -7.6 7 13 A A T 3 S+ 0 0 22 1,-0.2 3,-0.2 -4,-0.2 4,-0.1 0.847 70.3 40.7 -64.9 -32.9 14.9 -0.2 -9.8 8 14 A D T 3> S+ 0 0 85 1,-0.2 4,-2.5 2,-0.1 3,-0.3 0.307 78.8 109.4-101.0 10.2 15.8 2.8 -12.0 9 15 A V H <> S+ 0 0 16 -3,-0.9 4,-0.6 1,-0.3 -1,-0.2 0.920 87.9 37.2 -51.2 -51.7 16.2 5.5 -9.4 10 16 A N H 4 S+ 0 0 2 166,-0.4 -1,-0.3 -4,-0.3 8,-0.2 0.704 112.0 60.8 -76.1 -18.5 19.9 5.8 -9.8 11 17 A V H 4 S+ 0 0 99 -3,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.911 108.7 43.3 -71.3 -41.9 19.7 5.3 -13.5 12 18 A L H < S+ 0 0 132 -4,-2.5 -1,-0.2 2,-0.1 -2,-0.2 0.551 103.8 81.5 -80.8 -9.5 17.6 8.4 -13.8 13 19 A R S < S- 0 0 76 -4,-0.6 5,-0.1 -5,-0.2 0, 0.0 -0.697 91.6 -89.2-101.0 153.0 19.7 10.5 -11.5 14 20 A P >> - 0 0 89 0, 0.0 3,-1.9 0, 0.0 4,-0.8 -0.152 37.4-113.7 -54.3 148.0 23.0 12.4 -12.2 15 21 A K H 3> S+ 0 0 124 1,-0.3 4,-2.0 2,-0.2 3,-0.4 0.846 114.2 64.0 -53.0 -36.9 26.2 10.4 -11.7 16 22 A E H 34 S+ 0 0 149 1,-0.2 -1,-0.3 2,-0.2 6,-0.0 0.711 92.3 64.4 -64.3 -19.1 27.2 12.7 -8.9 17 23 A Y H <4 S+ 0 0 27 -3,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.945 119.9 19.4 -67.8 -47.8 24.2 11.5 -6.8 18 24 A W H < S+ 0 0 71 -4,-0.8 2,-1.6 -3,-0.4 -2,-0.2 0.479 100.2 92.4-103.1 -4.5 25.5 7.9 -6.6 19 25 A D >< + 0 0 31 -4,-2.0 3,-1.4 -5,-0.2 4,-0.3 -0.562 46.4 165.8 -91.5 73.5 29.2 8.4 -7.3 20 26 A Y G > + 0 0 17 -2,-1.6 3,-1.0 1,-0.3 -1,-0.2 0.680 65.3 69.4 -62.1 -22.0 30.2 8.8 -3.7 21 27 A E G 3 S+ 0 0 113 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.815 94.0 56.5 -68.3 -28.1 33.9 8.2 -4.5 22 28 A A G < S+ 0 0 62 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.562 82.9 122.4 -78.6 -7.8 33.9 11.6 -6.3 23 29 A L < - 0 0 23 -3,-1.0 2,-0.6 -4,-0.3 50,-0.1 -0.310 46.9-163.3 -60.2 131.1 32.7 13.2 -3.1 24 30 A T - 0 0 105 -2,-0.0 2,-0.2 49,-0.0 -2,-0.1 -0.985 21.1-133.0-117.0 116.2 35.0 15.9 -1.7 25 31 A V - 0 0 21 -2,-0.6 2,-0.8 1,-0.0 48,-0.0 -0.482 5.8-147.6 -74.5 137.4 34.1 16.6 1.9 26 32 A Q - 0 0 154 -2,-0.2 68,-0.3 69,-0.0 2,-0.1 -0.907 26.9-144.8-105.5 105.1 33.6 20.2 3.2 27 33 A W - 0 0 88 -2,-0.8 68,-0.2 1,-0.1 2,-0.1 -0.351 11.2-156.1 -76.8 148.7 34.8 20.1 6.8 28 34 A G - 0 0 22 66,-2.8 2,-0.6 -2,-0.1 68,-0.4 -0.262 37.9 -73.8-103.8-164.8 33.4 22.0 9.7 29 35 A E > - 0 0 119 1,-0.1 3,-1.8 66,-0.1 4,-0.3 -0.866 28.2-157.7-103.9 117.6 35.0 23.0 13.0 30 36 A Q G > S+ 0 0 54 -2,-0.6 3,-1.7 1,-0.3 -1,-0.1 0.831 91.5 64.7 -56.2 -38.7 35.6 20.3 15.6 31 37 A D G 3 S+ 0 0 92 1,-0.3 -1,-0.3 3,-0.0 22,-0.2 0.546 84.0 77.4 -65.8 -8.1 35.7 22.8 18.5 32 38 A D G < S+ 0 0 30 -3,-1.8 21,-1.7 20,-0.1 22,-0.5 0.760 97.3 48.7 -71.9 -25.1 32.1 23.7 17.7 33 39 A Y E < -A 52 0A 26 -3,-1.7 2,-0.4 -4,-0.3 19,-0.2 -0.916 67.4-164.0-122.2 145.2 31.0 20.5 19.5 34 40 A E E -A 51 0A 109 17,-2.2 17,-1.5 -2,-0.4 2,-0.2 -0.989 26.9-113.9-132.6 135.7 31.9 19.0 22.8 35 41 A V E +A 50 0A 78 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.450 32.5 173.5 -64.3 126.2 31.4 15.5 24.2 36 42 A V E - 0 0 79 13,-2.7 2,-0.3 1,-0.4 14,-0.2 0.820 66.6 -22.4 -99.4 -48.1 29.0 15.6 27.2 37 43 A R E -A 49 0A 131 12,-1.6 12,-3.5 0, 0.0 -1,-0.4 -0.918 66.5-105.0-166.9 141.3 28.7 11.9 27.8 38 44 A K E +A 48 0A 73 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.422 37.1 165.2 -69.6 138.0 29.2 8.6 25.9 39 45 A V E + 0 0 53 8,-2.9 2,-0.3 1,-0.3 9,-0.2 0.566 59.2 26.5-127.0 -25.3 26.0 6.9 24.8 40 46 A G E -A 47 0A 20 7,-2.5 7,-2.6 2,-0.0 -1,-0.3 -0.967 51.6-173.8-144.1 158.1 27.0 4.4 22.2 41 47 A R E +A 46 0A 161 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.976 12.7 159.3-152.6 136.3 30.0 2.2 21.1 42 48 A G - 0 0 36 3,-2.4 3,-0.4 -2,-0.3 -2,-0.0 -0.886 53.1-103.4-146.8 174.6 30.6 -0.0 18.2 43 49 A K S S+ 0 0 178 -2,-0.3 3,-0.1 1,-0.2 0, 0.0 0.513 122.8 44.8 -81.8 -2.7 33.5 -1.5 16.4 44 50 A Y S S- 0 0 127 1,-0.3 21,-1.5 20,-0.1 2,-0.3 0.422 126.3 -10.5-117.1 -3.5 33.0 1.1 13.6 45 51 A S E - B 0 64A 8 -3,-0.4 -3,-2.4 19,-0.3 2,-0.4 -0.955 55.0-121.8 177.7 164.5 32.5 4.2 15.7 46 52 A E E -AB 41 63A 60 17,-2.5 17,-2.7 -2,-0.3 2,-0.5 -0.959 26.0-149.9-121.4 140.8 31.9 5.7 19.2 47 53 A V E -AB 40 62A 32 -7,-2.6 -8,-2.9 -2,-0.4 -7,-2.5 -0.956 13.8-177.3-120.3 127.8 28.8 7.8 19.9 48 54 A F E -AB 38 61A 24 13,-3.1 13,-3.2 -2,-0.5 2,-0.3 -0.937 30.0-125.9-122.7 142.9 28.6 10.7 22.4 49 55 A E E +AB 37 60A 31 -12,-3.5 -13,-2.7 -2,-0.4 -12,-1.6 -0.685 49.9 178.2 -76.4 138.6 25.8 12.9 23.4 50 56 A G E -AB 35 59A 1 9,-3.6 9,-1.8 -2,-0.3 2,-0.3 -0.746 28.0-128.8-136.0-173.8 27.2 16.3 22.8 51 57 A I E -AB 34 58A 40 -17,-1.5 -17,-2.2 7,-0.2 2,-0.9 -0.997 18.7-128.8-141.9 140.1 26.6 20.0 22.9 52 58 A N E >>> -AB 33 57A 23 5,-3.0 4,-1.9 -2,-0.3 3,-1.3 -0.833 21.2-157.8 -87.3 108.6 27.1 22.8 20.3 53 59 A V T 345S+ 0 0 65 -21,-1.7 -1,-0.1 -2,-0.9 -20,-0.1 0.455 85.0 68.2 -71.1 1.3 29.1 25.3 22.4 54 60 A N T 345S+ 0 0 109 -22,-0.5 -1,-0.2 3,-0.1 -21,-0.1 0.726 126.0 1.1 -89.0 -24.9 28.0 28.1 20.1 55 61 A N T <45S- 0 0 79 -3,-1.3 -2,-0.2 2,-0.1 3,-0.1 0.295 94.7-108.3-146.9 11.8 24.3 27.9 21.2 56 62 A N T <5 + 0 0 132 -4,-1.9 2,-0.3 1,-0.2 -3,-0.2 0.682 65.4 153.4 65.8 18.4 23.9 25.2 23.9 57 63 A E E < -B 52 0A 119 -5,-0.7 -5,-3.0 1,-0.1 -1,-0.2 -0.628 43.6-123.5 -82.4 134.7 22.1 23.0 21.4 58 64 A K E +B 51 0A 110 -2,-0.3 51,-0.6 -7,-0.2 2,-0.3 -0.406 39.8 160.8 -75.3 153.7 22.2 19.3 22.0 59 65 A C E -BC 50 108A 4 -9,-1.8 -9,-3.6 49,-0.2 2,-0.4 -0.944 37.3-110.4-159.1 174.8 23.6 17.0 19.4 60 66 A I E -BC 49 107A 24 47,-2.3 47,-2.8 -2,-0.3 2,-0.5 -0.966 22.4-156.1-118.6 135.4 25.1 13.5 18.8 61 67 A I E -BC 48 106A 10 -13,-3.2 -13,-3.1 -2,-0.4 2,-0.7 -0.963 5.7-168.8-115.2 117.2 28.7 13.1 17.9 62 68 A K E -BC 47 105A 14 43,-3.0 43,-2.8 -2,-0.5 2,-0.7 -0.902 5.9-162.7-109.8 104.2 29.6 9.9 16.1 63 69 A I E -BC 46 104A 19 -17,-2.7 -17,-2.5 -2,-0.7 41,-0.2 -0.792 14.3-142.5 -90.1 114.6 33.4 9.5 15.9 64 70 A L E -B 45 0A 9 39,-1.9 -19,-0.3 -2,-0.7 33,-0.1 -0.413 10.5-125.2 -76.4 149.3 34.3 6.9 13.3 65 71 A K - 0 0 75 -21,-1.5 2,-0.1 1,-0.1 -1,-0.1 -0.634 50.8 -72.5 -89.2 154.1 37.1 4.5 13.8 66 72 A P S S+ 0 0 119 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.252 74.3 148.0 -51.6 115.4 39.9 4.4 11.1 67 73 A V - 0 0 61 -2,-0.1 5,-0.1 -3,-0.0 -3,-0.0 -0.935 54.5 -57.3-143.7 164.8 38.4 2.7 8.0 68 74 A K >> - 0 0 161 -2,-0.3 4,-1.4 1,-0.1 3,-0.6 -0.120 43.9-128.0 -48.9 134.1 38.8 3.0 4.3 69 75 A K H 3> S+ 0 0 152 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.863 108.0 58.8 -49.7 -43.0 38.2 6.5 2.9 70 76 A K H 3> S+ 0 0 102 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.885 101.2 53.4 -57.3 -44.2 35.8 5.1 0.3 71 77 A K H <> S+ 0 0 39 -3,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.870 111.6 45.6 -61.1 -38.6 33.5 3.6 3.0 72 78 A I H X S+ 0 0 17 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.845 108.9 53.4 -76.8 -33.0 33.2 6.9 4.8 73 79 A K H X S+ 0 0 33 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.875 108.7 54.0 -66.0 -34.7 32.5 8.9 1.6 74 80 A R H X S+ 0 0 30 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.936 110.0 44.5 -63.6 -47.7 29.8 6.4 0.9 75 81 A E H X S+ 0 0 6 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.919 115.7 47.1 -64.6 -44.4 28.1 7.0 4.3 76 82 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.930 112.7 49.6 -63.8 -44.0 28.4 10.7 4.1 77 83 A K H X S+ 0 0 31 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.920 113.2 46.1 -60.8 -44.7 27.1 10.8 0.5 78 84 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.903 112.3 51.0 -65.7 -40.9 24.1 8.6 1.5 79 85 A L H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 12,-0.3 0.901 112.4 46.5 -63.4 -41.0 23.4 10.7 4.6 80 86 A Q H < S+ 0 0 85 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.882 112.2 51.0 -68.3 -38.3 23.5 13.9 2.5 81 87 A N H < S+ 0 0 28 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.845 117.5 38.8 -66.8 -35.1 21.2 12.3 -0.2 82 88 A L H >< S+ 0 0 0 -4,-2.1 3,-2.8 -5,-0.1 -2,-0.2 0.630 81.9 126.0 -91.5 -17.0 18.7 11.2 2.5 83 89 A C T 3< S+ 0 0 55 -4,-1.6 7,-0.1 1,-0.3 6,-0.1 -0.169 75.6 27.0 -47.4 127.0 18.8 14.3 4.7 84 90 A G T 3 S+ 0 0 51 1,-0.4 -1,-0.3 4,-0.3 3,-0.1 0.075 89.1 128.8 106.0 -22.9 15.2 15.6 5.1 85 91 A G S X S- 0 0 2 -3,-2.8 3,-1.6 1,-0.1 -1,-0.4 -0.267 74.6 -78.8 -64.2 153.1 13.5 12.3 4.6 86 92 A P T 3 S- 0 0 57 0, 0.0 54,-0.2 0, 0.0 -1,-0.1 -0.325 107.7 -11.0 -59.8 124.1 10.9 11.1 7.1 87 93 A N T 3 S+ 0 0 18 1,-0.2 80,-2.7 -2,-0.1 2,-0.4 0.686 96.7 132.9 61.4 24.1 12.5 9.7 10.3 88 94 A I B < -e 167 0B 0 -3,-1.6 -4,-0.3 78,-0.2 -1,-0.2 -0.882 67.2-103.3-104.1 134.9 16.0 9.5 8.8 89 95 A V - 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0 0 11 -6,-0.1 -5,-2.7 1,-0.1 -1,-0.2 -0.326 55.9 -95.6 -66.9 146.1 39.1 10.5 11.9 103 109 A P E - D 0 96A 24 0, 0.0 -39,-1.9 0, 0.0 2,-0.5 -0.380 37.6-157.5 -64.1 141.6 35.9 12.0 10.5 104 110 A S E -CD 63 95A 3 -9,-3.5 -9,-2.7 -41,-0.2 2,-0.5 -0.991 6.4-145.9-121.1 125.4 33.3 12.8 13.2 105 111 A L E -CD 62 94A 0 -43,-2.8 -43,-3.0 -2,-0.5 2,-0.5 -0.812 7.2-150.5 -97.1 132.4 29.7 13.0 12.1 106 112 A I E -CD 61 93A 0 -13,-3.0 -14,-3.0 -2,-0.5 -13,-1.3 -0.880 21.6-179.0-103.5 127.9 27.4 15.5 13.9 107 113 A F E -CD 60 91A 11 -47,-2.8 -47,-2.3 -2,-0.5 -16,-0.2 -0.831 36.3 -86.5-126.5 164.7 23.7 14.6 14.1 108 114 A E E -C 59 0A 30 -18,-1.4 -49,-0.2 -2,-0.3 2,-0.1 -0.332 59.3-104.5 -59.8 144.6 20.5 16.0 15.4 109 115 A Y - 0 0 32 -51,-0.6 2,-0.4 -50,-0.1 -1,-0.1 -0.485 37.0-173.1 -78.8 149.6 20.1 14.8 19.0 110 116 A V - 0 0 14 -2,-0.1 2,-1.6 -51,-0.1 48,-0.1 -0.982 23.7-139.6-143.5 128.6 17.7 12.0 20.0 111 117 A N - 0 0 76 -2,-0.4 49,-0.3 46,-0.1 50,-0.3 -0.509 39.6-179.1 -89.0 68.6 16.9 11.0 23.5 112 118 A N - 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0 0 44 -4,-1.4 2,-0.4 -5,-0.2 -1,-0.2 -0.241 46.7 -54.4 59.9-143.3 18.2 -30.8 7.4 269 275 A R + 0 0 215 -4,-0.1 2,-0.4 2,-0.0 -1,-0.1 -0.985 58.5 174.2-139.1 125.1 14.5 -31.1 6.7 270 276 A H - 0 0 56 -2,-0.4 -25,-2.4 -30,-0.1 -24,-0.6 -0.992 27.6-130.4-137.7 139.5 11.8 -29.2 8.8 271 277 A S - 0 0 103 -2,-0.4 -27,-0.3 -27,-0.2 2,-0.1 -0.549 46.7 -91.7 -81.1 151.9 8.1 -28.8 8.6 272 278 A R - 0 0 118 -29,-0.2 -29,-0.2 -2,-0.2 -1,-0.1 -0.373 33.4-138.2 -65.8 141.6 6.9 -25.2 8.9 273 279 A K - 0 0 80 -31,-2.9 5,-0.1 -2,-0.1 -1,-0.1 -0.896 22.9-121.9-105.1 108.0 6.1 -24.0 12.4 274 280 A P > - 0 0 51 0, 0.0 3,-1.9 0, 0.0 4,-0.3 -0.136 18.4-123.0 -48.0 137.1 2.8 -21.8 12.4 275 281 A W G > S+ 0 0 7 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.812 109.3 64.7 -53.0 -35.2 3.4 -18.3 13.8 276 282 A L G > S+ 0 0 106 1,-0.3 3,-1.9 2,-0.2 -1,-0.3 0.750 85.0 73.1 -62.4 -24.2 0.8 -18.9 16.5 277 283 A K G < S+ 0 0 144 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.665 91.2 60.0 -64.2 -14.5 3.0 -21.6 18.0 278 284 A F G < S+ 0 0 23 -3,-1.9 2,-0.3 -4,-0.3 -1,-0.3 0.523 81.1 105.1 -89.8 -8.3 5.2 -18.8 19.2 279 285 A M < + 0 0 74 -3,-1.9 2,-0.2 -4,-0.2 -58,-0.1 -0.587 43.3 151.9 -77.3 132.0 2.4 -17.2 21.3 280 286 A N >> - 0 0 83 -2,-0.3 4,-1.4 -59,-0.1 3,-0.8 -0.793 61.8 -77.6-143.4-174.2 2.7 -17.7 25.0 281 287 A A T 34 S+ 0 0 92 -2,-0.2 4,-0.2 1,-0.2 -2,-0.0 0.726 124.2 58.3 -65.3 -21.4 1.7 -15.9 28.2 282 288 A D T 34 S+ 0 0 124 1,-0.2 -1,-0.2 2,-0.1 -3,-0.1 0.752 119.9 23.4 -81.0 -24.7 4.5 -13.4 27.9 283 289 A N T X> S+ 0 0 0 -3,-0.8 3,-2.6 -5,-0.1 4,-1.4 0.394 85.7 106.6-123.0 2.3 3.5 -12.1 24.4 284 290 A Q T 3< S+ 0 0 128 -4,-1.4 -3,-0.1 1,-0.3 -2,-0.1 0.808 76.7 61.9 -53.5 -32.1 -0.2 -12.8 24.2 285 291 A H T 34 S+ 0 0 109 -4,-0.2 -1,-0.3 1,-0.2 -161,-0.2 0.647 112.9 37.2 -69.8 -12.3 -1.0 -9.1 24.7 286 292 A L T <4 S+ 0 0 4 -3,-2.6 2,-0.7 -66,-0.3 -2,-0.2 0.602 93.6 91.1-113.2 -19.0 1.0 -8.4 21.5 287 293 A V < + 0 0 17 -4,-1.4 -1,-0.0 -67,-0.1 -163,-0.0 -0.742 49.5 157.3 -87.7 114.8 0.1 -11.3 19.2 288 294 A S > - 0 0 22 -2,-0.7 4,-2.4 1,-0.1 5,-0.2 -0.894 54.3-108.7-130.3 159.3 -2.9 -10.5 17.0 289 295 A P H > S+ 0 0 114 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.860 120.6 50.9 -58.0 -36.3 -4.1 -12.0 13.7 290 296 A E H > S+ 0 0 78 2,-0.2 4,-2.2 1,-0.2 27,-0.2 0.895 109.4 50.5 -68.8 -39.4 -3.2 -8.7 11.9 291 297 A A H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.922 112.7 46.7 -63.0 -45.1 0.3 -8.7 13.4 292 298 A I H X S+ 0 0 26 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.905 111.1 51.2 -63.5 -43.8 0.8 -12.3 12.3 293 299 A D H X S+ 0 0 59 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.897 113.1 45.9 -61.3 -42.0 -0.5 -11.6 8.8 294 300 A F H < S+ 0 0 0 -4,-2.2 4,-0.5 2,-0.2 3,-0.5 0.946 113.9 47.8 -66.1 -48.3 1.9 -8.7 8.4 295 301 A L H >X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 3,-1.6 0.914 108.4 56.1 -58.0 -43.6 4.8 -10.6 9.8 296 302 A D H 3< S+ 0 0 38 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.805 104.5 52.1 -59.7 -33.3 4.1 -13.5 7.5 297 303 A K T 3< S+ 0 0 66 -4,-1.2 10,-1.7 -3,-0.5 -1,-0.3 0.512 112.5 46.3 -82.5 -5.6 4.2 -11.3 4.4 298 304 A L T <4 S+ 0 0 0 -3,-1.6 2,-1.6 -4,-0.5 -2,-0.2 0.805 101.7 63.6-100.3 -43.8 7.7 -9.9 5.5 299 305 A L < + 0 0 1 -4,-2.4 2,-0.4 -86,-0.1 -1,-0.2 -0.564 69.4 135.4 -88.1 77.3 9.4 -13.2 6.4 300 306 A R - 0 0 74 -2,-1.6 6,-0.1 -3,-0.2 5,-0.1 -0.955 55.8-136.5-120.5 138.4 9.4 -14.9 3.0 301 307 A Y S S+ 0 0 14 -2,-0.4 2,-0.6 1,-0.1 -106,-0.2 0.963 92.7 73.1 -56.9 -52.8 12.5 -16.8 1.7 302 308 A D S >> S- 0 0 6 1,-0.2 3,-1.9 -55,-0.1 4,-0.7 -0.529 72.7-156.1 -68.5 110.3 12.0 -15.2 -1.8 303 309 A H T 34 S+ 0 0 2 -2,-0.6 3,-0.5 1,-0.3 -1,-0.2 0.781 93.4 60.8 -57.6 -27.3 12.9 -11.6 -1.5 304 310 A Q T 34 S+ 0 0 48 1,-0.2 -1,-0.3 -301,-0.1 -2,-0.1 0.652 101.0 54.2 -74.9 -15.4 10.7 -10.9 -4.5 305 311 A E T <4 S+ 0 0 99 -3,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.621 86.9 103.6 -91.1 -18.1 7.7 -12.1 -2.6 306 312 A R S < S- 0 0 4 -4,-0.7 -8,-0.2 -3,-0.5 -9,-0.1 -0.261 82.4 -98.9 -66.8 152.5 8.2 -9.8 0.4 307 313 A L - 0 0 26 -10,-1.7 2,-0.2 -13,-0.2 -1,-0.1 -0.387 36.8-125.1 -66.3 148.7 6.0 -6.7 1.0 308 314 A T > - 0 0 27 1,-0.1 4,-3.1 -3,-0.1 5,-0.2 -0.576 28.0-106.5 -88.1 161.2 7.7 -3.5 -0.2 309 315 A A H > S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 -170,-0.2 0.897 123.1 52.2 -55.3 -41.0 7.9 -0.8 2.4 310 316 A L H > S+ 0 0 95 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.914 112.1 44.3 -61.7 -45.5 5.2 1.1 0.6 311 317 A E H >4 S+ 0 0 83 1,-0.2 3,-1.3 2,-0.2 4,-0.4 0.919 109.9 56.9 -64.9 -44.9 2.9 -1.9 0.6 312 318 A A H >< S+ 0 0 0 -4,-3.1 3,-1.6 1,-0.3 6,-0.2 0.892 99.7 58.2 -54.1 -43.7 3.7 -2.7 4.2 313 319 A M H 3< S+ 0 0 23 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.748 104.9 52.0 -60.9 -23.1 2.6 0.8 5.3 314 320 A T T << S+ 0 0 88 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.469 78.7 122.5 -93.4 -2.7 -0.9 0.1 3.9 315 321 A H S X S- 0 0 11 -3,-1.6 3,-2.2 -4,-0.4 4,-0.2 -0.329 75.0-118.5 -60.5 138.0 -1.4 -3.2 5.7 316 322 A P G > S+ 0 0 68 0, 0.0 3,-2.1 0, 0.0 4,-0.3 0.731 107.4 79.1 -50.8 -23.2 -4.6 -3.1 7.9 317 323 A Y G 3 S+ 0 0 3 1,-0.3 3,-0.3 -27,-0.2 4,-0.2 0.855 99.4 40.7 -54.0 -35.4 -2.4 -3.7 10.9 318 324 A F G <> S+ 0 0 0 -3,-2.2 4,-2.5 -6,-0.2 -1,-0.3 0.250 80.3 115.4 -97.6 12.4 -1.5 0.0 10.8 319 325 A Q H <> S+ 0 0 117 -3,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.851 78.5 45.8 -54.1 -39.4 -5.0 1.2 10.0 320 326 A Q H > S+ 0 0 114 -3,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.874 110.6 53.9 -71.4 -35.7 -5.4 3.1 13.3 321 327 A V H > S+ 0 0 4 -3,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.925 113.1 43.6 -63.2 -41.6 -2.0 4.7 12.9 322 328 A R H X S+ 0 0 57 -4,-2.5 4,-2.7 2,-0.2 3,-0.4 0.927 112.9 51.1 -68.3 -45.0 -2.9 5.9 9.5 323 329 A A H < S+ 0 0 51 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.876 107.2 54.1 -59.6 -39.1 -6.4 7.1 10.6 324 330 A A H >< S+ 0 0 51 -4,-2.5 3,-0.5 1,-0.2 -1,-0.2 0.819 111.9 44.9 -65.0 -30.9 -4.8 9.0 13.5 325 331 A E H 3< S+ 0 0 94 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.889 108.7 56.2 -78.0 -41.5 -2.5 10.8 11.0 326 332 A N T 3< 0 0 136 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.234 360.0 360.0 -74.9 11.6 -5.4 11.4 8.5 327 333 A S < 0 0 150 -3,-0.5 -3,-0.0 -5,-0.1 0, 0.0 -0.792 360.0 360.0-135.7 360.0 -7.3 13.3 11.3