==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-JAN-07 2E9N . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE CHK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.PARK . 269 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14096.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 16.4 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 0 0 1 0 0 1 1 0 0 0 0 0 0 1 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 . 2 4 0 1 1 1 1 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 . 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 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 A 0 0 148 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.9 -20.3 19.6 -41.7 2 3 A V > - 0 0 96 1,-0.1 3,-0.6 2,-0.1 2,-0.1 -0.327 360.0-123.8 -58.4 129.3 -16.7 18.6 -42.1 3 4 A P T 3 S+ 0 0 78 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.338 82.5 15.7 -74.9 156.7 -16.4 14.8 -43.0 4 5 A F T > S+ 0 0 114 1,-0.1 3,-1.7 -2,-0.1 24,-0.3 0.256 83.8 116.4 67.9 -10.5 -14.4 12.2 -41.0 5 6 A V T < + 0 0 44 -3,-0.6 23,-0.3 1,-0.3 24,-0.3 0.864 69.2 63.3 -55.4 -37.4 -14.0 14.4 -37.9 6 7 A E T 3 S+ 0 0 162 21,-0.1 2,-0.4 22,-0.1 -1,-0.3 0.754 85.3 99.2 -58.0 -25.3 -16.0 11.9 -35.9 7 8 A D < - 0 0 70 -3,-1.7 21,-2.9 20,-0.0 2,-0.5 -0.517 53.5-172.5 -74.0 123.4 -13.2 9.4 -36.6 8 9 A W E -A 27 0A 79 -2,-0.4 2,-0.5 19,-0.2 19,-0.2 -0.949 16.9-142.4-120.2 114.6 -10.6 8.8 -33.8 9 10 A D E -A 26 0A 94 17,-2.0 17,-2.3 -2,-0.5 2,-2.1 -0.614 16.4-135.0 -75.0 120.7 -7.6 6.7 -34.5 10 11 A L E +A 25 0A 105 -2,-0.5 15,-0.2 15,-0.2 -1,-0.1 -0.549 31.3 178.7 -78.3 81.9 -6.8 4.7 -31.4 11 12 A V E - 0 0 84 -2,-2.1 2,-0.3 13,-0.7 -1,-0.2 0.944 49.0 -30.7 -49.0 -68.4 -3.0 5.4 -31.5 12 13 A Q E -A 24 0A 106 12,-0.9 12,-4.5 -3,-0.2 2,-0.2 -0.973 65.6 -78.6-154.5 169.0 -1.8 3.5 -28.4 13 14 A T E -A 23 0A 63 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.480 29.5-172.5 -71.5 135.9 -2.4 2.3 -24.9 14 15 A L - 0 0 67 8,-4.2 9,-0.2 -2,-0.2 2,-0.2 0.858 66.9 -32.3 -95.2 -48.0 -2.1 4.8 -22.1 15 16 A G - 0 0 31 7,-1.0 -1,-0.1 2,-0.0 5,-0.1 -0.547 57.3-146.8 179.8 109.2 -2.4 2.7 -19.0 16 17 A E + 0 0 134 5,-0.2 2,-0.3 -2,-0.2 5,-0.3 -0.359 27.8 152.8 -79.5 159.8 -4.3 -0.5 -18.3 17 18 A G - 0 0 37 3,-2.7 -2,-0.0 -2,-0.1 3,-0.0 -0.894 60.5 -56.3-163.4-168.6 -5.8 -1.5 -15.0 18 19 A A S S+ 0 0 112 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.868 129.7 53.5 -51.8 -41.4 -8.6 -3.5 -13.2 19 20 A Y S S- 0 0 84 1,-0.1 21,-0.9 20,-0.1 2,-0.3 0.937 120.3-100.5 -59.7 -52.7 -11.2 -1.5 -15.3 20 21 A G E - B 0 39A 28 19,-0.1 -3,-2.7 -5,-0.1 2,-0.3 -0.791 60.0 -37.5 166.2-116.2 -9.7 -2.3 -18.7 21 22 A E E - B 0 38A 72 17,-0.6 17,-2.2 -5,-0.3 2,-0.5 -0.937 32.3-145.0-140.2 161.5 -7.5 -0.0 -20.7 22 23 A V E - B 0 37A 20 -2,-0.3 -8,-4.2 15,-0.2 -7,-1.0 -0.952 23.7-166.1-129.2 109.2 -7.1 3.6 -21.7 23 24 A Q E -AB 13 36A 23 13,-1.9 13,-2.9 -2,-0.5 2,-0.5 -0.647 22.2-119.4 -98.6 154.7 -6.0 4.3 -25.2 24 25 A L E -AB 12 35A 14 -12,-4.5 -12,-0.9 -2,-0.2 -13,-0.7 -0.793 31.7-163.3 -90.3 127.9 -4.7 7.5 -26.7 25 26 A A E -AB 10 34A 0 9,-2.7 9,-2.7 -2,-0.5 2,-0.5 -0.955 6.8-162.6-118.5 133.4 -6.9 8.7 -29.6 26 27 A V E -AB 9 33A 32 -17,-2.3 -17,-2.0 -2,-0.4 7,-0.2 -0.955 31.1-106.8-116.5 126.7 -5.9 11.2 -32.2 27 28 A N E > -A 8 0A 7 5,-2.0 4,-1.2 -2,-0.5 -19,-0.2 -0.199 17.6-140.2 -54.2 132.5 -8.5 12.9 -34.4 28 29 A R T 4 S+ 0 0 124 -21,-2.9 -23,-0.1 -24,-0.3 -1,-0.1 0.768 99.9 24.6 -64.1 -28.4 -8.6 11.7 -38.0 29 30 A V T 4 S+ 0 0 60 -22,-0.3 -1,-0.2 -24,-0.3 -24,-0.1 0.752 136.9 26.0-108.7 -33.2 -9.2 15.3 -39.4 30 31 A T T 4 S- 0 0 77 -25,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.555 88.4-134.7-107.7 -12.4 -7.8 17.7 -36.7 31 32 A E < + 0 0 151 -4,-1.2 2,-0.6 1,-0.3 -3,-0.1 0.709 45.0 163.4 63.5 20.5 -5.2 15.4 -35.1 32 33 A E - 0 0 100 -6,-0.1 -5,-2.0 1,-0.0 -1,-0.3 -0.608 32.3-136.9 -72.4 115.5 -6.5 16.5 -31.8 33 34 A A E +B 26 0A 38 -2,-0.6 52,-0.4 -7,-0.2 2,-0.3 -0.454 31.1 165.2 -77.2 148.6 -5.2 14.0 -29.3 34 35 A V E -B 25 0A 4 -9,-2.7 -9,-2.7 50,-0.1 2,-0.5 -0.932 34.1-112.7-151.8 173.7 -7.4 12.6 -26.5 35 36 A A E -BC 24 83A 9 48,-2.5 48,-2.9 -2,-0.3 2,-0.5 -0.965 25.5-166.2-119.4 126.0 -7.7 9.9 -23.9 36 37 A V E -BC 23 82A 3 -13,-2.9 -13,-1.9 -2,-0.5 2,-0.3 -0.947 4.6-156.5-118.0 125.1 -10.3 7.2 -24.1 37 38 A K E -BC 22 81A 20 44,-2.3 44,-2.1 -2,-0.5 2,-0.6 -0.762 5.8-150.3 -98.0 142.0 -11.2 4.8 -21.3 38 39 A I E -BC 21 80A 27 -17,-2.2 2,-0.9 -2,-0.3 -17,-0.6 -0.884 8.2-166.4-116.2 99.2 -12.8 1.5 -22.0 39 40 A V E -BC 20 79A 18 40,-1.6 40,-1.2 -2,-0.6 2,-0.8 -0.760 17.3-141.1 -90.8 104.4 -15.1 0.4 -19.1 40 41 A D E - C 0 78A 66 -2,-0.9 38,-0.2 -21,-0.9 37,-0.0 -0.504 7.5-160.3 -66.6 103.3 -15.8 -3.3 -19.7 41 42 A M + 0 0 33 36,-2.0 -1,-0.2 -2,-0.8 37,-0.1 0.409 39.3 152.2 -67.2 6.5 -19.5 -3.8 -18.7 42 43 A K + 0 0 104 35,-0.1 0, 0.0 5,-0.1 0, 0.0 0.147 48.4 13.2 -36.0 154.1 -18.7 -7.5 -18.4 43 44 A R S S- 0 0 185 1,-0.2 2,-0.1 2,-0.1 3,-0.1 0.303 78.3-116.1 54.8 166.0 -20.8 -9.5 -15.9 44 45 A A S S+ 0 0 87 1,-0.1 -1,-0.2 3,-0.1 -2,-0.1 -0.554 90.6 57.7-139.4 74.0 -24.0 -8.1 -14.3 45 46 A V S S+ 0 0 113 -2,-0.1 -1,-0.1 0, 0.0 -2,-0.1 0.258 114.1 22.8 179.8 16.0 -23.8 -7.7 -10.5 46 47 A D S S+ 0 0 74 -3,-0.1 -2,-0.1 0, 0.0 -3,-0.0 0.104 113.2 58.4 175.6 43.1 -20.9 -5.3 -9.9 47 48 A C S > S+ 0 0 9 -6,-0.1 4,-1.1 3,-0.0 -3,-0.1 0.449 84.4 69.7-147.6 -39.2 -20.3 -3.3 -13.0 48 49 A P H > S+ 0 0 47 0, 0.0 4,-1.1 0, 0.0 3,-0.5 0.976 104.8 32.8 -53.1 -77.4 -23.5 -1.3 -14.0 49 50 A E H > S+ 0 0 144 1,-0.2 4,-1.2 2,-0.2 5,-0.2 0.690 106.4 77.8 -58.1 -20.8 -24.0 1.5 -11.4 50 51 A N H >> S+ 0 0 87 1,-0.2 4,-1.3 2,-0.2 3,-0.6 0.970 103.0 30.5 -53.3 -63.3 -20.2 1.8 -11.0 51 52 A I H 3X S+ 0 0 4 -4,-1.1 4,-1.7 -3,-0.5 -1,-0.2 0.731 109.1 71.2 -72.2 -22.7 -19.5 3.8 -14.1 52 53 A K H 3X S+ 0 0 91 -4,-1.1 4,-1.3 2,-0.2 -1,-0.2 0.818 103.5 41.2 -64.4 -31.7 -22.9 5.5 -14.1 53 54 A K H X S+ 0 0 4 -4,-2.3 4,-1.7 1,-0.2 3,-1.5 0.922 107.4 50.4 -70.5 -42.4 -19.7 13.3 -11.6 58 59 A N H 3< S+ 0 0 4 -4,-1.3 11,-0.2 1,-0.3 -2,-0.2 0.872 100.1 64.5 -62.2 -36.5 -17.6 14.1 -14.6 59 60 A K T 3< S+ 0 0 117 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.600 107.4 44.2 -63.5 -10.5 -20.5 16.0 -16.2 60 61 A M T <4 S+ 0 0 92 -3,-1.5 -2,-0.2 -4,-0.2 -1,-0.2 0.854 92.2 92.1 -96.6 -53.9 -20.2 18.4 -13.3 61 62 A L < + 0 0 17 -4,-1.7 8,-0.2 1,-0.0 2,-0.0 0.067 37.6 154.2 -43.1 151.5 -16.5 19.0 -13.0 62 63 A N + 0 0 126 6,-0.1 2,-0.3 3,-0.0 6,-0.1 -0.288 21.4 121.6 175.0 88.2 -14.8 21.9 -14.9 63 64 A H > - 0 0 42 3,-0.4 3,-1.4 4,-0.1 53,-0.0 -0.978 66.2-114.1-155.8 148.6 -11.6 23.3 -13.5 64 65 A E T 3 S+ 0 0 124 -2,-0.3 4,-0.1 1,-0.3 52,-0.1 0.448 115.8 53.2 -68.9 2.1 -8.1 23.8 -15.0 65 66 A N T 3 S+ 0 0 8 50,-0.1 80,-1.8 79,-0.1 2,-0.3 -0.115 97.2 75.0-126.5 33.2 -6.7 21.3 -12.4 66 67 A V B < S-e 145 0B 2 -3,-1.4 -3,-0.4 78,-0.3 80,-0.2 -0.965 94.8 -99.4-146.0 124.6 -9.1 18.5 -13.2 67 68 A V - 0 0 11 78,-2.9 2,-0.3 -2,-0.3 -4,-0.1 -0.138 49.0-112.5 -44.2 136.3 -8.9 16.3 -16.2 68 69 A K - 0 0 109 -4,-0.1 16,-2.7 -6,-0.1 2,-0.5 -0.573 22.5-141.6 -81.7 137.6 -11.4 17.6 -18.7 69 70 A F E +D 83 0A 42 -2,-0.3 14,-0.2 -11,-0.2 3,-0.1 -0.857 24.1 169.6-101.3 129.1 -14.5 15.5 -19.7 70 71 A Y E - 0 0 98 12,-3.3 2,-0.3 -2,-0.5 13,-0.2 0.855 52.2 -56.7-102.1 -55.0 -15.7 15.5 -23.3 71 72 A G E -D 82 0A 22 11,-1.0 11,-3.1 2,-0.0 2,-0.4 -0.988 37.8-115.4-175.7 179.2 -18.3 12.8 -23.7 72 73 A H E -D 81 0A 47 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.989 14.0-159.7-142.1 132.1 -19.4 9.2 -23.4 73 74 A R E -D 80 0A 126 7,-2.4 7,-3.3 -2,-0.4 2,-0.3 -0.903 10.4-156.1-110.5 135.0 -20.4 6.6 -26.0 74 75 A R + 0 0 110 -2,-0.4 5,-0.2 5,-0.2 3,-0.1 -0.780 22.1 159.1-108.4 154.9 -22.4 3.5 -25.2 75 76 A E > - 0 0 101 -2,-0.3 3,-1.5 1,-0.1 2,-1.0 -0.338 66.5 -73.5-173.4 79.1 -22.5 0.2 -27.1 76 77 A G T 3 S- 0 0 72 1,-0.3 -1,-0.1 -35,-0.0 3,-0.0 -0.484 116.5 -10.8 66.5-100.5 -23.7 -2.9 -25.2 77 78 A N T 3 S+ 0 0 95 -2,-1.0 -36,-2.0 1,-0.1 2,-1.0 0.744 118.7 85.1-101.3 -33.6 -20.7 -3.6 -22.9 78 79 A I E < -C 40 0A 60 -3,-1.5 2,-0.4 -38,-0.2 -38,-0.2 -0.621 58.4-176.3 -78.4 101.7 -18.1 -1.3 -24.4 79 80 A Q E -C 39 0A 6 -40,-1.2 -40,-1.6 -2,-1.0 2,-0.6 -0.847 11.2-151.7 -99.5 132.6 -18.5 2.1 -22.8 80 81 A Y E -CD 38 73A 62 -7,-3.3 -7,-2.4 -2,-0.4 2,-0.5 -0.915 8.7-169.1-111.5 116.8 -16.3 4.9 -24.1 81 82 A L E -CD 37 72A 0 -44,-2.1 -44,-2.3 -2,-0.6 2,-0.7 -0.896 10.4-152.4-104.7 126.5 -15.3 7.8 -21.9 82 83 A F E +CD 36 71A 36 -11,-3.1 -12,-3.3 -2,-0.5 -11,-1.0 -0.873 25.8 164.4-104.3 110.8 -13.6 10.7 -23.6 83 84 A L E -CD 35 69A 24 -48,-2.9 -48,-2.5 -2,-0.7 -14,-0.2 -0.821 43.4 -77.9-123.7 160.7 -11.3 12.7 -21.3 84 85 A E - 0 0 21 -16,-2.7 2,-0.4 -2,-0.3 -50,-0.1 -0.180 45.5-123.6 -55.8 144.3 -8.5 15.2 -21.7 85 86 A Y - 0 0 61 -52,-0.4 2,-0.6 -60,-0.1 -1,-0.1 -0.763 18.0-159.1 -92.9 139.0 -5.1 13.8 -22.8 86 87 A C > + 0 0 12 -2,-0.4 3,-1.1 1,-0.1 51,-0.2 -0.846 13.1 179.5-121.4 94.0 -2.1 14.6 -20.6 87 88 A S T 3 S+ 0 0 59 -2,-0.6 51,-0.2 1,-0.2 -1,-0.1 0.693 75.1 77.5 -64.4 -18.3 1.1 14.3 -22.5 88 89 A G T 3 S- 0 0 18 49,-1.1 50,-0.3 1,-0.2 -1,-0.2 0.854 91.4-146.4 -61.3 -37.5 2.9 15.3 -19.3 89 90 A G E < -F 137 0B 30 -3,-1.1 48,-2.0 48,-1.1 2,-0.3 -0.630 36.9 -30.1 102.5-163.8 2.5 11.9 -17.7 90 91 A E E > -F 136 0B 76 -2,-0.2 3,-0.8 46,-0.2 46,-0.2 -0.672 43.0-132.7 -94.8 148.2 1.9 11.0 -14.1 91 92 A L G > S+ 0 0 1 44,-2.7 3,-2.6 41,-1.0 4,-0.3 0.871 107.5 70.8 -61.4 -33.6 3.3 13.0 -11.2 92 93 A F G > S+ 0 0 92 40,-1.0 3,-1.4 43,-0.3 -1,-0.3 0.873 93.8 52.6 -47.8 -45.2 4.4 9.7 -9.9 93 94 A D G < S+ 0 0 122 -3,-0.8 -1,-0.3 1,-0.3 -2,-0.2 0.305 100.6 61.0 -79.7 9.3 7.0 9.5 -12.7 94 95 A R G < S+ 0 0 87 -3,-2.6 2,-0.7 2,-0.1 -1,-0.3 0.274 84.9 94.8-111.6 2.8 8.4 12.9 -11.7 95 96 A I S < S- 0 0 26 -3,-1.4 6,-0.2 -4,-0.3 105,-0.1 -0.864 73.3-140.6-100.9 111.4 9.3 11.6 -8.3 96 97 A E B >> -H 100 0C 114 4,-2.9 4,-3.3 -2,-0.7 3,-2.0 -0.561 34.0-103.8 -71.4 123.5 12.9 10.4 -8.0 97 98 A P T 34 S- 0 0 93 0, 0.0 107,-0.2 0, 0.0 106,-0.1 -0.263 99.3 -5.1 -52.7 123.8 12.9 7.2 -5.9 98 99 A D T 34 S+ 0 0 98 105,-1.3 106,-0.2 1,-0.1 105,-0.1 0.327 135.6 60.6 73.8 -6.9 14.2 7.9 -2.4 99 100 A I T <4 S- 0 0 107 -3,-2.0 2,-0.6 104,-0.2 104,-0.3 0.732 77.4-163.9-115.7 -44.2 15.0 11.5 -3.4 100 101 A G B < -H 96 0C 2 -4,-3.3 -4,-2.9 102,-0.3 101,-0.2 -0.843 36.4 -68.0 97.4-120.8 11.8 13.2 -4.4 101 102 A M - 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0 0 112 -7,-2.0 24,-0.3 -2,-0.1 2,-0.1 -0.990 11.0-131.7-131.5 122.1 -23.2 13.4 4.5 162 163 A L - 0 0 74 -2,-0.4 2,-0.2 22,-0.1 22,-0.2 -0.459 25.3-134.8 -70.9 142.0 -20.9 11.4 6.7 163 164 A L B +K 183 0F 5 20,-3.2 20,-2.5 -2,-0.1 -1,-0.1 -0.611 32.3 168.3 -98.1 161.0 -19.2 8.6 4.9 164 165 A N + 0 0 104 18,-0.2 2,-0.4 -2,-0.2 -1,-0.1 0.325 47.2 108.8-143.5 -12.9 -18.7 5.0 6.2 165 166 A K - 0 0 96 1,-0.0 2,-0.6 2,-0.0 -2,-0.0 -0.579 62.9-138.6 -75.8 127.7 -17.5 3.3 2.9 166 167 A M + 0 0 110 -2,-0.4 2,-0.3 -3,-0.0 -1,-0.0 -0.771 42.7 134.1 -91.0 123.7 -13.9 2.3 3.0 167 168 A C + 0 0 24 -2,-0.6 2,-0.4 -39,-0.1 -17,-0.0 -0.982 21.3 70.1-164.2 157.2 -12.0 3.0 -0.2 168 169 A G S S- 0 0 32 -2,-0.3 2,-0.4 -39,-0.1 -39,-0.1 -0.993 85.4 -51.7 135.1-139.9 -8.8 4.4 -1.5 169 170 A T >> - 0 0 41 -2,-0.4 3,-2.4 -39,-0.1 4,-1.2 -0.960 46.3-124.1-143.4 117.3 -5.2 3.0 -1.2 170 171 A L T 34 S+ 0 0 93 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.683 106.5 49.8 -31.3 -47.8 -3.8 2.0 2.2 171 172 A P T 34 S+ 0 0 30 0, 0.0 -1,-0.3 0, 0.0 36,-0.2 0.811 120.2 37.8 -71.4 -22.3 -0.7 4.2 2.2 172 173 A Y T <4 S+ 0 0 15 -3,-2.4 -2,-0.2 36,-0.1 23,-0.2 0.522 93.6 107.9-101.2 -8.1 -2.7 7.3 1.3 173 174 A V S < S- 0 0 10 -4,-1.2 -5,-0.1 -3,-0.1 16,-0.0 -0.339 72.2-112.8 -73.1 153.4 -5.8 6.6 3.3 174 175 A A > - 0 0 0 1,-0.1 3,-1.5 35,-0.1 4,-0.2 -0.616 20.9-120.3 -86.4 147.8 -6.5 8.6 6.5 175 176 A P G > S+ 0 0 7 0, 0.0 3,-1.7 0, 0.0 4,-0.4 0.767 106.9 62.7 -54.9 -37.2 -6.4 6.9 9.9 176 177 A E G 3> S+ 0 0 9 1,-0.3 4,-1.1 71,-0.3 3,-0.2 0.647 92.9 66.6 -69.3 -11.0 -10.1 7.6 10.9 177 178 A L G <4 S+ 0 0 9 -3,-1.5 -1,-0.3 1,-0.2 6,-0.0 0.575 106.2 41.3 -84.6 -9.0 -11.2 5.4 8.0 178 179 A L T <4 S+ 0 0 63 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.2 0.388 123.9 35.7-113.8 -1.5 -9.7 2.4 9.7 179 180 A K T 4 S+ 0 0 140 -4,-0.4 2,-0.3 -3,-0.2 -2,-0.2 0.408 109.0 60.2-132.2 -1.4 -10.8 3.2 13.3 180 181 A R < - 0 0 153 -4,-1.1 3,-0.1 -5,-0.1 -1,-0.1 -0.907 61.7-143.5-129.0 158.7 -14.3 4.8 12.8 181 182 A R S S+ 0 0 183 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.829 91.0 25.6 -86.8 -34.6 -17.6 3.7 11.4 182 183 A E + 0 0 78 -6,-0.0 2,-0.3 -18,-0.0 -18,-0.2 -0.959 68.7 170.4-132.5 150.1 -18.3 7.2 10.0 183 184 A F B -K 163 0F 14 -20,-2.5 -20,-3.2 -2,-0.3 2,-0.2 -0.999 36.2-100.3-159.1 153.9 -16.3 10.2 8.9 184 185 A H > - 0 0 82 -2,-0.3 4,-0.6 -22,-0.2 -22,-0.1 -0.489 28.8-144.0 -72.3 140.6 -16.2 13.6 7.2 185 186 A A H >> S+ 0 0 0 -24,-0.3 4,-1.3 -2,-0.2 3,-0.9 0.920 88.0 62.6 -75.9 -47.0 -15.0 13.5 3.6 186 187 A E H >> S+ 0 0 72 1,-0.2 4,-1.3 2,-0.2 3,-0.8 0.908 102.4 50.5 -46.9 -52.2 -13.1 16.8 3.3 187 188 A P H 3> S+ 0 0 29 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.798 103.8 59.7 -59.2 -30.2 -10.5 15.8 5.9 188 189 A V H S- 0 0 19 -2,-2.1 3,-2.5 1,-0.1 6,-0.3 -0.998 71.3-124.3-142.4 143.0 -2.3 2.3 12.2 212 213 A D T 3 S+ 0 0 97 -2,-0.3 6,-0.2 1,-0.3 -1,-0.1 0.756 108.2 70.8 -55.5 -28.5 -0.4 2.0 15.5 213 214 A S T 3 S+ 0 0 112 4,-0.1 2,-0.5 5,-0.0 -1,-0.3 0.678 87.1 84.8 -63.1 -14.6 0.5 -1.6 14.6 214 215 A C S <> S- 0 0 15 -3,-2.5 4,-1.8 1,-0.1 3,-0.4 -0.809 77.3-142.8 -96.4 124.7 2.7 0.0 12.0 215 216 A Q H >> S+ 0 0 111 -2,-0.5 4,-2.2 1,-0.2 3,-0.7 0.935 95.5 44.7 -43.5 -74.1 6.2 1.1 13.1 216 217 A E H 3> S+ 0 0 14 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.737 110.9 56.5 -49.8 -30.2 6.8 4.3 11.2 217 218 A Y H 3> S+ 0 0 1 -3,-0.4 4,-1.9 -6,-0.3 -1,-0.3 0.927 108.9 44.2 -72.4 -42.8 3.3 5.5 12.0 218 219 A S H S+ 0 0 44 -4,-2.2 5,-2.3 2,-0.2 -2,-0.2 0.924 108.7 48.5 -64.7 -45.1 7.2 6.8 15.5 220 221 A W H ><5S+ 0 0 13 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.884 108.3 54.7 -61.7 -38.7 5.8 9.8 13.6 221 222 A K H 3<5S+ 0 0 66 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.843 107.4 50.5 -64.2 -30.2 3.1 10.2 16.2 222 223 A E T 3<5S- 0 0 117 -4,-1.4 -1,-0.3 -3,-0.1 -2,-0.2 0.447 118.4-120.3 -85.0 -0.2 5.9 10.3 18.7 223 224 A K T < 5 + 0 0 143 -3,-1.6 2,-2.3 1,-0.2 -3,-0.2 0.773 55.4 158.2 67.1 29.9 7.5 13.0 16.5 224 225 A K < + 0 0 63 -5,-2.3 4,-0.3 1,-0.2 6,-0.2 -0.461 9.5 152.0 -82.1 68.7 10.7 11.1 15.8 225 226 A T + 0 0 38 -2,-2.3 -1,-0.2 -3,-0.1 -5,-0.1 0.454 36.3 107.8 -78.5 -2.7 11.3 13.2 12.7 226 227 A Y S S- 0 0 137 -3,-0.2 2,-6.3 1,-0.1 4,-0.2 -0.351 95.4 -18.4 -74.7 159.6 15.1 12.7 13.0 227 228 A L S S+ 0 0 127 4,-0.1 4,-0.2 3,-0.1 -1,-0.1 0.064 113.8 101.8 38.9 -45.7 17.0 10.4 10.7 228 229 A N S > S- 0 0 39 -2,-6.3 3,-3.0 -4,-0.3 4,-0.3 0.124 103.4 -67.9 -51.7 174.6 13.7 8.8 9.7 229 230 A P G > S+ 0 0 21 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.672 133.6 62.0 -42.0 -27.4 12.0 9.6 6.3 230 231 A W G 3 S+ 0 0 4 1,-0.2 3,-0.5 -4,-0.2 -3,-0.1 0.472 83.0 82.5 -83.1 1.1 11.2 13.2 7.5 231 232 A K G < S+ 0 0 134 -3,-3.0 -1,-0.2 1,-0.2 -4,-0.1 0.786 87.0 54.9 -71.9 -30.0 14.9 13.8 7.8 232 233 A K S < S+ 0 0 80 -3,-0.9 2,-0.5 -4,-0.3 -1,-0.2 0.617 94.4 86.5 -78.5 -14.3 15.0 14.5 4.1 233 234 A I S S- 0 0 11 -3,-0.5 -31,-0.1 -4,-0.2 -35,-0.0 -0.754 81.5-121.9 -96.1 129.4 12.3 17.2 4.5 234 235 A D > - 0 0 79 -2,-0.5 4,-1.9 1,-0.1 5,-0.2 -0.301 26.8-112.5 -64.9 152.1 13.2 20.7 5.3 235 236 A S H > S+ 0 0 91 2,-0.2 4,-1.7 3,-0.2 5,-0.1 0.764 109.4 61.2 -57.6 -31.4 11.6 22.2 8.5 236 237 A A H >> S+ 0 0 8 2,-0.2 3,-1.3 1,-0.2 4,-1.1 0.998 115.0 30.2 -62.4 -68.7 9.4 24.7 6.7 237 238 A P H 3> S+ 0 0 0 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.788 116.3 63.8 -61.8 -20.1 7.3 22.2 4.6 238 239 A L H 3X S+ 0 0 17 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.832 95.8 57.2 -70.8 -30.3 7.8 19.8 7.5 239 240 A A H > S- 0 0 88 1,-0.2 3,-2.4 3,-0.1 4,-0.6 -0.413 74.5-153.3 -59.2 105.9 -7.9 13.4 15.0 249 250 A P T 34 S+ 0 0 37 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 0.759 93.3 60.9 -53.3 -26.6 -9.6 14.6 11.8 250 251 A S T 34 S+ 0 0 108 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.1 0.675 109.9 39.9 -76.1 -17.9 -11.3 17.3 13.8 251 252 A A T <4 S+ 0 0 63 -3,-2.4 2,-0.2 -5,-0.1 -1,-0.2 0.356 92.4 112.2-109.4 1.6 -8.0 18.8 14.7 252 253 A R S < S- 0 0 11 -4,-0.6 -8,-0.2 -3,-0.4 -7,-0.1 -0.561 79.8 -97.3 -76.8 138.8 -6.5 18.2 11.3 253 254 A I - 0 0 24 -10,-1.8 2,-0.3 -2,-0.2 -1,-0.1 -0.136 35.3-130.8 -57.0 146.3 -5.8 21.4 9.4 254 255 A T >> - 0 0 70 1,-0.1 3,-1.1 -3,-0.1 4,-1.0 -0.709 19.7-115.5 -98.6 153.6 -8.3 22.6 6.8 255 256 A I H >> S+ 0 0 10 -2,-0.3 3,-2.3 1,-0.3 4,-1.8 0.945 116.2 59.4 -51.2 -51.1 -7.4 23.6 3.3 256 257 A P H 34 S+ 0 0 89 0, 0.0 -1,-0.3 0, 0.0 4,-0.2 0.817 109.4 45.9 -49.0 -31.1 -8.5 27.2 4.0 257 258 A D H <4 S+ 0 0 96 -3,-1.1 -2,-0.2 1,-0.2 4,-0.2 0.598 104.0 61.5 -87.3 -14.0 -5.9 27.2 6.7 258 259 A I H X< S+ 0 0 2 -3,-2.3 3,-1.4 -4,-1.0 6,-0.2 0.825 94.0 62.6 -78.6 -33.7 -3.2 25.6 4.5 259 260 A K T 3< S+ 0 0 81 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.734 105.4 49.6 -61.1 -20.7 -3.4 28.6 2.1 260 261 A K T 3 S+ 0 0 169 -5,-0.3 -1,-0.3 -4,-0.2 -2,-0.2 0.525 84.6 119.9 -95.2 -8.7 -2.2 30.6 5.2 261 262 A D <> - 0 0 6 -3,-1.4 4,-1.1 -4,-0.2 3,-0.2 -0.268 69.0-124.5 -60.3 141.2 0.7 28.2 6.1 262 263 A R T >4 S+ 0 0 145 1,-0.2 3,-1.3 2,-0.2 4,-0.1 0.941 108.3 43.3 -50.1 -62.8 4.2 29.7 6.1 263 264 A W G >4 S+ 0 0 1 -27,-0.3 3,-1.0 1,-0.3 -1,-0.2 0.788 106.3 65.0 -57.5 -28.8 5.9 27.3 3.6 264 265 A Y G 34 S+ 0 0 19 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.811 111.0 34.8 -66.2 -29.7 2.8 27.5 1.4 265 266 A N G << S+ 0 0 104 -3,-1.3 -1,-0.2 -4,-1.1 -2,-0.2 0.133 87.1 123.4-112.1 21.8 3.4 31.2 0.6 266 267 A K < - 0 0 48 -3,-1.0 -3,-0.0 -4,-0.1 -159,-0.0 -0.735 69.8-111.2 -86.4 118.7 7.2 31.1 0.7 267 268 A P S S- 0 0 110 0, 0.0 2,-3.2 0, 0.0 -1,-0.1 -0.221 80.1 -31.4 -53.9 129.1 8.6 32.5 -2.6 268 269 A L 0 0 99 1,-0.3 -161,-0.2 -164,-0.1 -160,-0.1 -0.318 360.0 360.0 60.0 -70.8 10.3 29.8 -4.8 269 270 A K 0 0 102 -2,-3.2 -1,-0.3 -162,-0.1 -162,-0.2 0.863 360.0 360.0 -36.4 360.0 11.4 27.9 -1.7