==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-MAR-11 2YEX . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE CHK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.A.READ,J.BREED,H.HAYE,E.MCCALL,A.VALLENTINE,A.WHITE . 269 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13394.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 69.5 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 . 50 18.6 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 . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 21 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 26.4 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+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 1 1 0 0 1 0 0 1 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 3 1 0 0 2 2 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 34 0, 0.0 4,-3.9 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -45.0 0.2 46.1 -6.9 2 3 A V H > + 0 0 114 2,-0.2 4,-1.3 1,-0.2 0, 0.0 0.941 360.0 28.2 -51.3 -65.5 -2.5 47.5 -9.3 3 4 A P H > S+ 0 0 86 0, 0.0 4,-1.4 0, 0.0 3,-0.3 0.907 121.2 58.2 -63.7 -35.9 -3.6 44.2 -11.1 4 5 A F H >> S+ 0 0 49 1,-0.2 4,-2.1 2,-0.2 3,-0.6 0.927 105.5 48.1 -55.7 -47.6 -2.6 42.3 -7.9 5 6 A V H 3< S+ 0 0 64 -4,-3.9 -1,-0.2 1,-0.2 -3,-0.2 0.738 104.6 60.2 -71.8 -21.4 -5.0 44.4 -5.8 6 7 A E H 3< S+ 0 0 146 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.883 118.4 29.8 -65.9 -36.5 -7.8 43.9 -8.3 7 8 A D H << S+ 0 0 92 -4,-1.4 21,-2.9 -3,-0.6 2,-0.4 0.649 119.3 56.2 -99.8 -19.6 -7.5 40.1 -7.7 8 9 A W E < S-A 27 0A 37 -4,-2.1 2,-0.6 19,-0.3 19,-0.2 -0.969 72.1-138.4-122.3 131.6 -6.3 40.0 -4.1 9 10 A D E -A 26 0A 69 17,-2.8 17,-2.3 -2,-0.4 2,-1.4 -0.778 8.8-147.2 -84.1 117.3 -8.0 41.5 -1.0 10 11 A L E -A 25 0A 57 -2,-0.6 15,-0.2 15,-0.2 3,-0.1 -0.743 28.8-179.1 -80.8 91.1 -5.4 43.2 1.3 11 12 A V E - 0 0 64 13,-1.9 2,-0.3 -2,-1.4 -1,-0.2 0.913 45.0 -32.1 -69.5 -48.8 -7.6 42.2 4.2 12 13 A Q E -A 24 0A 108 12,-0.8 12,-2.7 -3,-0.2 2,-0.3 -0.988 64.2 -83.3-167.4 162.3 -5.8 43.6 7.2 13 14 A T E -A 23 0A 67 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.615 28.9-173.0 -77.3 134.2 -2.4 44.4 8.8 14 15 A L E - 0 0 58 8,-3.2 2,-0.3 1,-0.4 9,-0.2 0.813 54.4 -69.0 -93.1 -44.0 -0.7 41.5 10.5 15 16 A G E -A 22 0A 25 7,-1.4 7,-3.0 2,-0.0 2,-0.5 -0.983 51.5 -65.2 177.8-167.6 2.2 43.4 12.0 16 17 A E E -A 21 0A 139 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.945 38.3-163.2-110.1 123.0 5.4 45.3 11.7 17 18 A G - 0 0 18 3,-3.2 3,-0.1 -2,-0.5 130,-0.0 -0.452 41.4 -93.6 -89.9 175.3 8.6 43.6 10.3 18 19 A A S S+ 0 0 50 1,-0.2 3,-0.1 -2,-0.2 -1,-0.1 0.920 125.4 22.6 -52.4 -47.5 12.2 45.0 10.7 19 20 A Y S S- 0 0 58 1,-0.2 21,-0.3 31,-0.1 2,-0.3 0.427 129.6 -12.2-105.7 -1.9 11.9 46.8 7.3 20 21 A G S S- 0 0 13 19,-0.2 -3,-3.2 -3,-0.1 -1,-0.2 -0.961 72.2 -71.1 176.9 168.0 8.1 47.1 6.7 21 22 A E E -AB 16 38A 74 17,-0.9 17,-3.1 -2,-0.3 2,-0.5 -0.462 41.1-140.9 -73.6 142.4 4.4 46.5 7.5 22 23 A V E -AB 15 37A 24 -7,-3.0 -8,-3.2 15,-0.2 -7,-1.4 -0.947 16.6-166.8-114.6 125.5 3.0 43.0 6.7 23 24 A Q E -AB 13 36A 23 13,-3.0 13,-3.0 -2,-0.5 2,-0.6 -0.822 23.5-122.3-106.3 148.7 -0.6 42.6 5.2 24 25 A L E -AB 12 35A 16 -12,-2.7 -13,-1.9 -2,-0.3 -12,-0.8 -0.851 31.6-167.0 -85.0 122.0 -2.8 39.5 4.8 25 26 A A E -AB 10 34A 0 9,-2.9 9,-2.4 -2,-0.6 2,-0.4 -0.953 4.7-170.3-113.2 131.9 -3.6 39.2 1.1 26 27 A V E -AB 9 33A 31 -17,-2.3 -17,-2.8 -2,-0.4 2,-0.3 -0.983 23.4-127.1-125.7 123.3 -6.4 36.8 -0.0 27 28 A N E > -A 8 0A 19 5,-2.6 4,-2.1 -2,-0.4 -19,-0.3 -0.504 16.4-141.8 -70.0 130.7 -7.0 35.9 -3.6 28 29 A R T 4 S+ 0 0 137 -21,-2.9 -1,-0.1 -2,-0.3 -20,-0.1 0.804 95.5 37.5 -65.9 -31.1 -10.7 36.5 -4.4 29 30 A V T 4 S+ 0 0 128 -22,-0.4 -1,-0.2 1,-0.1 -21,-0.1 0.921 131.0 23.4 -85.2 -50.7 -11.1 33.5 -6.6 30 31 A T T 4 S- 0 0 90 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.673 89.4-136.2 -92.1 -19.7 -8.9 30.8 -5.0 31 32 A E < + 0 0 149 -4,-2.1 -3,-0.1 1,-0.2 2,-0.1 0.563 45.0 160.5 64.1 14.9 -8.9 32.2 -1.4 32 33 A E - 0 0 101 -6,-0.1 -5,-2.6 -5,-0.1 2,-0.4 -0.415 30.8-142.2 -57.3 137.4 -5.2 31.5 -1.2 33 34 A A E +B 26 0A 35 -7,-0.2 52,-0.5 -3,-0.1 2,-0.3 -0.920 24.5 171.1-110.2 133.6 -3.7 33.5 1.7 34 35 A V E -BC 25 84A 7 -9,-2.4 -9,-2.9 -2,-0.4 2,-0.5 -0.954 31.2-125.4-133.6 152.0 -0.2 35.1 1.4 35 36 A A E -BC 24 83A 7 48,-3.0 48,-3.1 -2,-0.3 2,-0.6 -0.873 24.6-158.9 -96.9 131.2 1.6 37.6 3.7 36 37 A V E -BC 23 82A 2 -13,-3.0 -13,-3.0 -2,-0.5 2,-0.5 -0.944 2.4-157.4-117.6 116.2 2.8 40.7 1.9 37 38 A K E -BC 22 81A 4 44,-2.7 44,-2.5 -2,-0.6 2,-0.6 -0.835 8.9-157.2 -94.4 124.9 5.5 42.8 3.4 38 39 A I E -BC 21 80A 39 -17,-3.1 -17,-0.9 -2,-0.5 2,-0.6 -0.918 9.1-171.1-112.7 113.6 5.5 46.3 2.1 39 40 A V E - C 0 79A 0 40,-3.0 40,-2.6 -2,-0.6 2,-1.0 -0.929 15.3-151.3-115.4 114.7 8.8 48.1 2.4 40 41 A D E > - C 0 78A 73 -2,-0.6 3,-1.8 -21,-0.3 38,-0.2 -0.753 8.2-164.1 -83.8 104.2 9.1 51.9 1.7 41 42 A M G > S+ 0 0 22 36,-2.6 3,-0.8 -2,-1.0 6,-0.4 0.617 80.9 72.4 -69.5 -12.8 12.7 52.2 0.5 42 43 A K G 3 S+ 0 0 160 35,-0.3 -1,-0.3 1,-0.2 3,-0.1 0.554 74.1 85.0 -74.0 -7.5 12.6 56.0 1.0 43 44 A R G < S+ 0 0 101 -3,-1.8 2,-0.3 1,-0.2 -1,-0.2 0.728 106.4 6.8 -71.1 -17.8 12.7 55.5 4.8 44 45 A A X - 0 0 41 -3,-0.8 3,-1.7 -4,-0.2 -1,-0.2 -0.965 67.2-124.6-160.7 145.4 16.5 55.2 4.6 45 46 A V T 3 S+ 0 0 151 -2,-0.3 4,-0.3 1,-0.3 -1,-0.1 0.850 115.2 48.6 -59.9 -31.6 19.3 55.7 2.1 46 47 A D T 3> S+ 0 0 91 1,-0.2 4,-2.4 2,-0.1 -1,-0.3 0.426 83.4 97.2 -88.1 3.2 20.5 52.2 2.8 47 48 A C H <> S+ 0 0 11 -3,-1.7 4,-3.1 -6,-0.4 5,-0.3 0.898 77.2 55.9 -63.5 -41.6 17.1 50.6 2.6 48 49 A P H > S+ 0 0 63 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.941 113.8 41.1 -55.9 -44.4 17.5 49.4 -1.0 49 50 A E H > S+ 0 0 63 -4,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.891 115.2 51.7 -67.6 -40.1 20.6 47.5 -0.1 50 51 A N H X S+ 0 0 47 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.924 112.6 43.4 -64.6 -45.0 19.2 46.2 3.2 51 52 A I H X S+ 0 0 3 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.883 110.0 57.0 -72.6 -32.2 16.0 44.8 1.6 52 53 A K H X S+ 0 0 103 -4,-2.0 4,-2.6 -5,-0.3 -1,-0.2 0.901 108.5 48.7 -58.6 -41.5 18.0 43.3 -1.3 53 54 A K H X S+ 0 0 92 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.924 108.8 51.1 -67.5 -42.8 20.0 41.4 1.4 54 55 A E H X S+ 0 0 4 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.919 112.9 47.8 -58.6 -42.1 16.9 40.2 3.2 55 56 A I H X S+ 0 0 11 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.933 110.5 51.1 -62.7 -47.0 15.6 39.0 -0.2 56 57 A C H X S+ 0 0 79 -4,-2.6 4,-0.6 1,-0.2 -2,-0.2 0.914 112.0 46.1 -59.2 -43.6 19.0 37.3 -1.0 57 58 A I H >< S+ 0 0 4 -4,-2.8 3,-1.6 1,-0.2 4,-0.5 0.930 108.7 56.2 -66.5 -42.7 19.0 35.5 2.4 58 59 A N H >< S+ 0 0 6 -4,-2.4 3,-1.4 1,-0.3 11,-0.2 0.872 100.0 59.8 -55.2 -36.6 15.4 34.4 1.9 59 60 A K H 3< S+ 0 0 132 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.707 100.7 56.6 -68.3 -16.2 16.2 32.8 -1.4 60 61 A M T << S+ 0 0 82 -3,-1.6 2,-0.3 -4,-0.6 -1,-0.3 0.608 91.2 97.4 -82.2 -16.4 18.7 30.5 0.5 61 62 A L < + 0 0 27 -3,-1.4 8,-0.3 -4,-0.5 2,-0.2 -0.612 29.9 149.5 -94.7 137.7 16.1 29.1 2.9 62 63 A N + 0 0 144 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.640 28.8 123.0-159.9 94.8 14.0 25.9 2.8 63 64 A H > - 0 0 47 3,-0.3 3,-1.7 -2,-0.2 53,-0.0 -0.984 63.0-120.8-157.2 147.1 13.1 24.4 6.1 64 65 A E T 3 S+ 0 0 143 -2,-0.3 4,-0.1 1,-0.3 52,-0.1 0.614 113.3 49.9 -67.9 -14.2 9.9 23.3 7.8 65 66 A N T 3 S+ 0 0 9 50,-0.1 80,-2.7 79,-0.1 2,-0.4 0.021 98.2 80.6-111.5 28.9 10.6 25.7 10.8 66 67 A V B < S-e 145 0B 5 -3,-1.7 -3,-0.3 78,-0.3 80,-0.2 -0.999 89.8-104.9-133.7 131.4 11.3 28.8 8.6 67 68 A V - 0 0 8 78,-2.5 2,-0.1 -2,-0.4 -2,-0.1 -0.321 45.1-116.2 -53.1 126.5 8.7 31.1 7.0 68 69 A K - 0 0 37 -4,-0.1 16,-2.5 -6,-0.1 2,-0.5 -0.421 20.1-144.3 -70.5 143.2 8.5 30.3 3.3 69 70 A F E +D 83 0A 40 -8,-0.3 14,-0.2 -11,-0.2 3,-0.1 -0.936 18.6 177.9-110.3 124.7 9.5 33.0 0.8 70 71 A Y E - 0 0 126 12,-3.0 2,-0.3 -2,-0.5 13,-0.2 0.768 52.1 -76.2 -96.0 -33.3 7.6 33.1 -2.5 71 72 A G E -D 82 0A 19 11,-1.2 11,-2.9 2,-0.0 -1,-0.3 -0.982 38.1-125.6 158.1-169.6 9.1 36.0 -4.3 72 73 A H E -D 81 0A 73 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.982 12.2-172.7-161.8 158.4 9.2 39.8 -4.5 73 74 A R E -D 80 0A 143 7,-1.9 7,-2.6 -2,-0.3 2,-0.4 -0.963 20.6-124.4-158.7 161.6 8.9 42.7 -6.8 74 75 A R E -D 79 0A 143 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.836 14.6-174.9-106.3 140.5 9.4 46.5 -6.9 75 76 A E E > -D 78 0A 65 3,-2.9 3,-2.1 -2,-0.4 2,-0.2 -0.904 68.1 -58.3-129.2 100.7 6.9 49.2 -7.7 76 77 A G T 3 S- 0 0 47 -2,-0.4 -1,-0.0 1,-0.3 0, 0.0 -0.447 121.3 -15.0 63.9-125.1 8.6 52.6 -7.7 77 78 A N T 3 S+ 0 0 93 -2,-0.2 -36,-2.6 -3,-0.1 2,-0.5 0.354 120.1 93.7 -92.8 8.1 10.2 53.1 -4.3 78 79 A I E < -CD 40 75A 40 -3,-2.1 -3,-2.9 -38,-0.2 2,-0.4 -0.878 58.2-158.7-106.1 130.0 8.2 50.3 -2.7 79 80 A Q E -CD 39 74A 17 -40,-2.6 -40,-3.0 -2,-0.5 2,-0.5 -0.901 7.7-158.1-102.8 134.6 9.5 46.7 -2.4 80 81 A Y E -CD 38 73A 42 -7,-2.6 -7,-1.9 -2,-0.4 2,-0.4 -0.964 4.9-167.6-114.9 124.3 6.9 43.9 -1.9 81 82 A L E -CD 37 72A 0 -44,-2.5 -44,-2.7 -2,-0.5 2,-0.6 -0.950 11.4-147.5-110.7 136.8 7.9 40.6 -0.4 82 83 A F E +CD 36 71A 38 -11,-2.9 -12,-3.0 -2,-0.4 -11,-1.2 -0.924 27.7 171.5-112.1 117.9 5.6 37.6 -0.6 83 84 A L E -CD 35 69A 18 -48,-3.1 -48,-3.0 -2,-0.6 -14,-0.2 -0.825 39.5 -80.1-128.1 156.7 5.8 35.3 2.4 84 85 A E E -C 34 0A 36 -16,-2.5 2,-0.7 -2,-0.3 -50,-0.2 -0.369 42.0-128.1 -55.3 133.0 4.0 32.3 3.9 85 86 A Y - 0 0 71 -52,-0.5 2,-0.9 -2,-0.1 -52,-0.1 -0.780 19.0-156.2 -85.9 116.3 0.9 33.3 5.8 86 87 A C > - 0 0 9 -2,-0.7 3,-1.7 1,-0.1 51,-0.3 -0.817 7.3-169.7 -99.3 97.8 1.3 31.6 9.2 87 88 A S T 3 S+ 0 0 62 -2,-0.9 51,-0.2 1,-0.3 -1,-0.1 0.566 75.9 69.4 -77.3 -10.2 -2.3 31.3 10.4 88 89 A G T 3 S- 0 0 19 49,-2.3 -1,-0.3 1,-0.2 50,-0.2 0.489 95.9-145.5 -78.4 -9.2 -1.5 30.3 13.9 89 90 A G E < -F 137 0B 31 -3,-1.7 48,-1.9 48,-0.7 2,-0.3 -0.281 38.9 -18.6 80.9-160.5 -0.1 33.8 14.6 90 91 A E E > -F 136 0B 53 46,-0.2 3,-1.4 1,-0.1 46,-0.2 -0.651 46.2-133.8 -90.5 143.0 2.8 34.8 16.8 91 92 A L G > S+ 0 0 0 44,-3.2 3,-2.6 41,-0.8 4,-0.4 0.856 104.9 73.6 -56.7 -35.4 4.3 32.7 19.6 92 93 A F G > S+ 0 0 93 40,-1.2 3,-1.3 43,-0.3 -1,-0.3 0.861 90.9 56.2 -43.7 -41.7 4.1 35.9 21.6 93 94 A D G < S+ 0 0 111 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.454 97.4 61.1 -82.1 2.7 0.3 35.4 21.8 94 95 A R G < S+ 0 0 80 -3,-2.6 2,-0.7 -4,-0.2 -1,-0.3 0.388 87.8 89.7 -96.5 -2.7 0.6 31.9 23.3 95 96 A I S < S- 0 0 26 -3,-1.3 6,-0.2 -4,-0.4 105,-0.1 -0.875 71.7-147.2-101.2 111.1 2.4 33.4 26.3 96 97 A E B >> -H 100 0C 114 4,-2.8 4,-3.0 -2,-0.7 3,-2.5 -0.662 35.7-102.2 -75.8 124.2 0.1 34.5 29.2 97 98 A P T 34 S- 0 0 103 0, 0.0 107,-0.2 0, 0.0 106,-0.1 -0.188 101.3 -0.9 -53.4 132.7 1.7 37.5 30.8 98 99 A D T 34 S+ 0 0 106 105,-2.6 105,-0.2 1,-0.1 106,-0.1 0.413 134.7 59.2 65.1 6.2 3.4 36.6 34.1 99 100 A I T <4 S- 0 0 99 -3,-2.5 2,-0.4 104,-0.2 104,-0.3 0.702 78.0-162.2-125.4 -46.2 2.4 33.0 33.7 100 101 A G B < -H 96 0C 2 -4,-3.0 -4,-2.8 102,-0.3 101,-0.2 -0.837 36.2 -68.8 96.0-133.3 3.8 31.6 30.4 101 102 A M - 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0 0 77 -2,-0.5 4,-2.3 1,-0.1 5,-0.2 -0.237 28.1-113.1 -57.0 148.0 10.8 24.1 37.5 235 236 A S H > S+ 0 0 95 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.778 110.2 60.4 -57.7 -31.8 14.3 23.1 38.4 236 237 A A H > S+ 0 0 21 2,-0.2 4,-1.1 1,-0.2 27,-0.4 0.981 112.9 33.2 -66.3 -55.8 14.7 20.8 35.3 237 238 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.857 115.5 60.6 -68.7 -27.9 14.2 23.5 32.6 238 239 A L H X S+ 0 0 13 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.888 98.8 57.2 -62.0 -36.1 15.9 26.0 34.9 239 240 A A H X S+ 0 0 46 -4,-1.9 4,-0.9 -3,-0.3 -1,-0.2 0.882 106.9 48.7 -61.1 -37.9 19.0 23.7 34.8 240 241 A L H >X S+ 0 0 0 -4,-1.1 4,-1.8 2,-0.2 3,-0.8 0.929 109.7 51.6 -64.4 -45.7 19.0 24.1 31.0 241 242 A L H 3X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.3 -2,-0.2 0.871 103.1 59.1 -61.0 -34.1 18.6 27.9 31.4 242 243 A H H 3< S+ 0 0 66 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.827 109.8 44.2 -61.2 -31.3 21.6 27.9 33.7 243 244 A K H << S+ 0 0 80 -4,-0.9 10,-2.1 -3,-0.8 3,-0.3 0.767 118.0 43.1 -84.0 -29.0 23.6 26.4 30.8 244 245 A I H < S+ 0 0 0 -4,-1.8 2,-1.5 1,-0.2 -2,-0.2 0.898 106.7 57.6 -80.5 -47.8 22.3 28.7 28.1 245 246 A L S < S+ 0 0 5 -4,-2.9 2,-0.5 -5,-0.2 -1,-0.2 -0.322 73.7 142.4 -89.3 55.4 22.4 32.1 30.0 246 247 A V - 0 0 39 -2,-1.5 6,-0.1 -3,-0.3 -3,-0.1 -0.830 49.0-141.5 -96.9 128.0 26.1 31.9 30.7 247 248 A E S S+ 0 0 93 -2,-0.5 -71,-0.2 4,-0.1 -1,-0.1 0.896 86.3 68.5 -62.6 -46.7 27.9 35.2 30.4 248 249 A N S >> S- 0 0 94 1,-0.2 3,-1.2 -73,-0.1 4,-0.9 -0.661 73.4-154.1 -76.6 113.2 31.1 34.0 28.7 249 250 A P T 34 S+ 0 0 32 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.774 92.4 60.8 -62.6 -24.5 30.0 32.9 25.2 250 251 A S T 34 S+ 0 0 106 1,-0.2 -2,-0.0 -3,-0.0 -3,-0.0 0.852 110.3 40.9 -68.8 -29.8 32.9 30.5 25.0 251 252 A A T <4 S+ 0 0 70 -3,-1.2 -1,-0.2 2,-0.1 3,-0.1 0.495 91.9 113.3 -92.8 -9.2 31.5 28.6 28.1 252 253 A R S < S- 0 0 10 -4,-0.9 -8,-0.2 -3,-0.3 -9,-0.1 -0.355 78.9 -97.3 -66.1 144.6 27.9 28.8 26.9 253 254 A I - 0 0 20 -10,-2.1 2,-0.2 -13,-0.1 -1,-0.1 -0.297 36.8-138.7 -62.4 142.4 26.2 25.6 26.0 254 255 A T > - 0 0 72 -3,-0.1 4,-2.2 1,-0.1 3,-0.4 -0.578 25.4-104.6 -94.7 165.8 26.1 24.8 22.2 255 256 A I H > S+ 0 0 13 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.923 119.1 57.6 -62.7 -39.0 23.1 23.4 20.4 256 257 A P H 4 S+ 0 0 88 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.892 111.3 44.2 -58.8 -31.1 24.5 19.9 20.2 257 258 A D H >4 S+ 0 0 71 -3,-0.4 3,-1.1 1,-0.2 4,-0.4 0.823 105.0 60.4 -84.1 -28.2 24.8 19.9 24.0 258 259 A I H >< S+ 0 0 1 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.907 99.2 60.5 -55.0 -40.3 21.3 21.4 24.4 259 260 A K T 3< S+ 0 0 78 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.703 103.6 49.7 -61.0 -22.0 20.2 18.2 22.6 260 261 A K T < S+ 0 0 160 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.428 84.1 121.8 -93.6 -3.2 21.7 16.1 25.4 261 262 A D <> - 0 0 5 -3,-1.8 4,-1.8 -4,-0.4 5,-0.1 -0.319 65.7-130.3 -68.2 143.0 20.0 18.1 28.3 262 263 A R T 4 S+ 0 0 202 1,-0.2 4,-0.4 2,-0.2 -1,-0.1 0.919 106.7 43.7 -59.7 -50.2 17.8 16.2 30.7 263 264 A W T >4 S+ 0 0 1 -27,-0.4 3,-1.5 1,-0.2 -1,-0.2 0.916 108.5 58.3 -63.8 -42.6 14.8 18.6 30.4 264 265 A Y T 34 S+ 0 0 14 1,-0.3 -1,-0.2 -6,-0.2 -2,-0.2 0.898 116.8 35.7 -52.1 -40.1 15.1 18.8 26.7 265 266 A N T 3< S+ 0 0 98 -4,-1.8 -1,-0.3 -3,-0.1 -2,-0.2 0.352 91.6 123.8 -95.2 7.6 14.7 15.0 26.5 266 267 A K < - 0 0 79 -3,-1.5 2,-0.5 -4,-0.4 -3,-0.1 -0.502 62.7-126.9 -78.0 129.1 12.2 14.7 29.4 267 268 A P - 0 0 124 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.589 36.2-171.2 -72.0 119.6 8.9 13.0 28.8 268 269 A L 0 0 42 -2,-0.5 0, 0.0 1,-0.2 0, 0.0 -0.679 360.0 360.0-107.4 167.3 6.2 15.4 30.0 269 270 A K 0 0 132 -2,-0.2 -1,-0.2 0, 0.0 0, 0.0 -0.081 360.0 360.0 -49.6 360.0 2.4 15.1 30.5