==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-MAY-05 1ZLT . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE CHK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.C.LEE,K.NG,Y.WAN,N.GRAY,G.SPRAGGON . 272 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14076.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 67.3 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 . 49 18.0 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 . 20 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 25.4 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 1 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 3 1 0 1 1 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 0 138 0, 0.0 4,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 90.7 0.1 8.4 -13.3 2 3 A V > - 0 0 82 2,-0.1 3,-1.1 1,-0.1 27,-0.1 0.877 360.0-131.2 33.0 91.3 3.8 7.5 -13.3 3 4 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 -0.297 83.5 18.4 -65.7 152.3 3.8 3.7 -14.1 4 5 A F T > S+ 0 0 118 1,-0.1 3,-1.9 2,-0.0 24,-0.3 0.396 83.6 123.7 69.6 -1.4 5.9 1.3 -11.9 5 6 A V T < S+ 0 0 45 -3,-1.1 25,-0.1 1,-0.3 -1,-0.1 0.491 71.9 53.3 -69.7 -3.4 6.2 4.0 -9.1 6 7 A E T 3 S+ 0 0 169 21,-0.1 2,-0.5 23,-0.0 -1,-0.3 0.265 87.0 105.8-111.0 7.7 4.7 1.5 -6.6 7 8 A D < - 0 0 70 -3,-1.9 21,-3.3 -4,-0.0 22,-0.4 -0.793 47.2-176.3 -95.3 127.8 7.3 -1.2 -7.4 8 9 A W E -A 27 0A 69 -2,-0.5 2,-0.4 19,-0.2 19,-0.2 -0.974 16.6-146.3-125.1 136.5 10.0 -1.9 -5.0 9 10 A D E -A 26 0A 97 17,-2.6 17,-2.6 -2,-0.4 2,-0.8 -0.859 17.5-134.1 -99.9 133.2 12.9 -4.3 -5.3 10 11 A L E +A 25 0A 91 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.813 31.1 172.9 -87.0 114.9 14.1 -6.0 -2.1 11 12 A V E - 0 0 75 13,-2.6 2,-0.3 -2,-0.8 -1,-0.2 0.663 53.5 -6.0-102.2 -18.0 17.8 -5.7 -2.3 12 13 A Q E -A 24 0A 100 12,-0.9 12,-3.2 0, 0.0 2,-0.6 -0.971 64.4-103.1-171.9 156.5 19.1 -6.9 1.1 13 14 A T E -A 23 0A 80 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.765 28.7-178.8 -88.1 122.1 18.2 -8.1 4.5 14 15 A L E - 0 0 62 8,-2.4 2,-0.3 -2,-0.6 9,-0.2 0.725 51.7 -78.8 -92.7 -25.2 18.8 -5.4 7.1 15 16 A G E -A 22 0A 21 7,-1.6 7,-2.7 2,-0.0 2,-0.4 -0.997 46.7 -60.4 164.9-157.6 17.8 -7.3 10.2 16 17 A E E -A 21 0A 128 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.977 32.4-159.5-132.8 139.5 15.2 -8.8 12.5 17 18 A G - 0 0 22 3,-3.8 5,-0.0 -2,-0.4 114,-0.0 -0.369 43.1 -92.9-103.7-172.7 12.5 -7.1 14.5 18 19 A A S S+ 0 0 46 1,-0.2 3,-0.0 -2,-0.1 -1,-0.0 0.886 126.4 19.9 -70.4 -34.2 10.6 -8.3 17.5 19 20 A Y S S+ 0 0 75 1,-0.1 2,-0.3 28,-0.1 -1,-0.2 0.211 127.0 1.5-120.9 17.1 7.9 -9.6 15.2 20 21 A G S S- 0 0 12 19,-0.1 -3,-3.8 2,-0.0 2,-0.3 -0.998 71.5 -75.7-179.3 179.7 9.4 -9.9 11.7 21 22 A E E -AB 16 38A 91 17,-2.4 17,-4.0 -2,-0.3 2,-0.5 -0.774 37.8-141.8 -98.7 143.6 12.2 -9.7 9.1 22 23 A V E -AB 15 37A 22 -7,-2.7 -8,-2.4 -2,-0.3 -7,-1.6 -0.916 17.7-174.6-113.7 127.2 13.4 -6.4 7.7 23 24 A Q E -AB 13 36A 28 13,-3.1 13,-3.2 -2,-0.5 2,-0.6 -0.876 27.7-122.0-118.2 147.7 14.4 -5.8 4.1 24 25 A L E -AB 12 35A 6 -12,-3.2 -13,-2.6 -2,-0.3 -12,-0.9 -0.798 33.3-166.1 -88.1 123.0 15.8 -2.8 2.3 25 26 A A E -AB 10 34A 0 9,-3.2 9,-2.5 -2,-0.6 2,-0.4 -0.934 5.5-162.4-112.7 134.8 13.4 -1.9 -0.5 26 27 A V E -AB 9 33A 34 -17,-2.6 -17,-2.6 -2,-0.4 7,-0.2 -0.967 26.0-114.2-119.3 132.4 14.4 0.4 -3.4 27 28 A N E > -A 8 0A 3 5,-2.8 4,-1.1 -2,-0.4 -19,-0.2 -0.410 15.6-139.3 -66.0 134.1 11.8 2.0 -5.6 28 29 A R T 4 S+ 0 0 123 -21,-3.3 -1,-0.2 -24,-0.3 -23,-0.1 0.793 100.2 27.3 -62.2 -31.5 12.0 0.9 -9.1 29 30 A V T 4 S+ 0 0 62 -22,-0.4 -1,-0.1 -25,-0.3 -24,-0.1 0.882 133.4 26.9 -97.8 -53.6 11.4 4.4 -10.4 30 31 A T T 4 S- 0 0 85 -25,-0.1 -2,-0.1 2,-0.1 3,-0.1 0.684 87.2-135.4 -86.3 -20.2 12.7 6.9 -7.7 31 32 A E < + 0 0 155 -4,-1.1 2,-0.2 1,-0.3 -3,-0.1 0.704 47.3 161.2 68.9 19.1 15.3 4.6 -6.2 32 33 A E - 0 0 89 -6,-0.1 -5,-2.8 1,-0.0 2,-0.4 -0.530 32.7-137.9 -68.1 139.4 14.0 5.9 -2.9 33 34 A A E +B 26 0A 36 -7,-0.2 49,-0.5 -2,-0.2 2,-0.3 -0.884 30.2 163.6-108.7 131.7 15.1 3.4 -0.1 34 35 A V E -BC 25 81A 2 -9,-2.5 -9,-3.2 -2,-0.4 2,-0.4 -0.898 36.1-115.4-135.9 165.4 12.7 2.3 2.6 35 36 A A E -BC 24 80A 7 45,-3.3 45,-3.4 -2,-0.3 2,-0.5 -0.852 24.6-158.0-103.4 139.9 12.8 -0.6 5.1 36 37 A V E -BC 23 79A 5 -13,-3.2 -13,-3.1 -2,-0.4 2,-0.6 -0.973 3.7-154.5-122.3 120.5 10.1 -3.2 4.8 37 38 A K E -BC 22 78A 6 41,-2.8 41,-2.6 -2,-0.5 2,-0.5 -0.828 14.6-159.8 -91.1 126.3 9.3 -5.3 7.8 38 39 A I E -BC 21 77A 37 -17,-4.0 -17,-2.4 -2,-0.6 2,-0.5 -0.953 7.8-171.6-114.0 121.0 7.8 -8.5 6.6 39 40 A V E - C 0 76A 11 37,-3.0 37,-3.3 -2,-0.5 2,-1.3 -0.939 18.9-148.7-119.3 117.0 5.8 -10.6 9.0 40 41 A D E > - C 0 75A 83 -2,-0.5 3,-0.6 35,-0.2 4,-0.3 -0.664 13.2-159.3 -79.0 95.1 4.5 -14.2 8.3 41 42 A M T 3 + 0 0 15 -2,-1.3 -1,-0.2 33,-0.6 34,-0.1 0.527 68.7 104.4 -57.9 -3.6 1.3 -14.1 10.3 42 43 A K T 3 S+ 0 0 116 32,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.424 89.7 41.2 -60.0 8.1 1.3 -17.9 10.4 43 44 A R S < S- 0 0 217 -3,-0.6 -2,-0.2 1,-0.0 -1,-0.2 0.665 134.7 -8.8-115.3 -75.5 2.5 -17.2 14.0 44 48 A C > - 0 0 36 -4,-0.3 4,-1.0 -25,-0.1 -2,-0.1 -0.854 50.9-178.4-138.8 101.4 0.5 -14.3 15.6 45 49 A P T 4 S+ 0 0 62 0, 0.0 4,-0.1 0, 0.0 -4,-0.1 0.481 86.0 48.9 -71.3 -8.5 -1.8 -12.2 13.4 46 50 A E T > S+ 0 0 148 2,-0.1 4,-2.2 3,-0.1 3,-0.3 0.813 98.8 59.9-101.7 -43.2 -2.7 -9.9 16.3 47 51 A N H > S+ 0 0 52 1,-0.3 4,-1.5 2,-0.2 5,-0.1 0.898 110.4 46.2 -52.0 -42.7 0.6 -8.9 17.8 48 52 A I H X S+ 0 0 0 -4,-1.0 4,-2.1 1,-0.2 -1,-0.3 0.778 106.2 59.1 -73.0 -26.4 1.6 -7.4 14.5 49 53 A K H > S+ 0 0 85 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.914 105.3 49.4 -68.6 -41.3 -1.8 -5.6 14.2 50 54 A K H X S+ 0 0 96 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.910 109.2 51.9 -62.8 -43.4 -1.1 -3.8 17.4 51 55 A E H X S+ 0 0 2 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.921 110.7 47.5 -58.6 -47.8 2.4 -2.7 16.2 52 56 A I H X S+ 0 0 8 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.940 111.5 52.8 -59.7 -43.3 0.9 -1.3 13.0 53 57 A C H X S+ 0 0 77 -4,-2.4 4,-0.5 1,-0.2 -2,-0.2 0.892 110.3 46.0 -60.4 -43.6 -1.7 0.4 15.1 54 58 A I H >X S+ 0 0 4 -4,-2.6 3,-1.5 1,-0.2 4,-0.6 0.922 109.2 55.6 -66.8 -40.7 0.8 2.1 17.4 55 59 A N H >< S+ 0 0 4 -4,-2.6 3,-1.3 1,-0.3 11,-0.3 0.885 99.8 61.0 -58.7 -37.6 2.9 3.1 14.4 56 60 A K H 3< S+ 0 0 126 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.739 101.5 54.0 -63.3 -18.6 -0.1 4.9 12.9 57 61 A M H << S+ 0 0 87 -3,-1.5 2,-0.3 -4,-0.5 -1,-0.3 0.666 95.0 93.2 -88.1 -16.4 -0.2 7.1 15.9 58 62 A L << + 0 0 8 -3,-1.3 8,-0.4 -4,-0.6 2,-0.2 -0.618 31.9 153.4 -94.0 140.6 3.4 8.2 15.6 59 63 A N + 0 0 112 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.685 28.5 125.7-156.1 91.8 5.1 11.2 14.0 60 64 A H > - 0 0 34 3,-0.4 3,-2.1 -2,-0.2 53,-0.0 -0.992 60.8-123.1-153.0 145.2 8.5 12.3 15.4 61 65 A E T 3 S+ 0 0 124 -2,-0.3 4,-0.1 1,-0.3 52,-0.1 0.700 114.1 49.0 -60.8 -18.6 12.0 13.0 14.2 62 66 A N T 3 S+ 0 0 13 79,-0.1 80,-2.6 50,-0.1 2,-0.4 0.082 99.2 77.4-109.7 24.5 13.4 10.6 16.7 63 67 A V B < S-e 142 0B 2 -3,-2.1 -3,-0.4 78,-0.3 80,-0.2 -1.000 94.2-102.9-132.2 127.2 11.0 7.7 15.9 64 68 A V - 0 0 9 78,-2.7 2,-0.1 -2,-0.4 -2,-0.1 -0.281 48.6-114.7 -48.3 121.1 11.4 5.5 12.8 65 69 A K - 0 0 77 -4,-0.1 16,-2.7 1,-0.1 2,-0.6 -0.372 18.8-141.4 -67.9 139.1 8.7 6.8 10.4 66 70 A F E +D 80 0A 15 -8,-0.4 14,-0.2 -11,-0.3 3,-0.1 -0.896 21.0 176.6-100.6 119.7 5.8 4.5 9.5 67 71 A Y E - 0 0 114 12,-3.5 2,-0.3 -2,-0.6 13,-0.2 0.769 54.0 -69.4 -95.8 -30.7 4.9 4.9 5.8 68 72 A G E -D 79 0A 18 11,-1.2 11,-3.2 2,-0.0 -1,-0.4 -0.942 40.5-115.6 161.0 179.8 2.2 2.3 5.5 69 73 A H E -D 78 0A 69 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.989 13.7-167.2-147.7 154.6 1.3 -1.3 5.5 70 74 A R E -D 77 0A 110 7,-1.9 7,-2.7 -2,-0.3 2,-0.5 -0.998 13.2-144.8-145.4 140.0 -0.1 -4.0 3.2 71 75 A R E -D 76 0A 140 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.913 13.4-176.0-106.3 127.7 -1.4 -7.5 3.8 72 76 A E - 0 0 111 3,-3.0 2,-0.3 -2,-0.5 3,-0.3 -0.829 61.9 -65.0-125.7 91.9 -0.7 -10.1 1.1 73 77 A G S S- 0 0 60 -2,-0.5 -1,-0.0 1,-0.2 0, 0.0 -0.526 120.9 -10.2 67.8-125.2 -2.4 -13.3 2.0 74 78 A N S S+ 0 0 92 -2,-0.3 -33,-0.6 -3,-0.1 -32,-0.5 -0.158 121.0 93.2 -97.9 40.1 -0.7 -14.6 5.2 75 79 A I E -C 40 0A 42 -3,-0.3 -3,-3.0 -35,-0.2 2,-0.4 -0.946 59.4-156.1-137.6 115.8 2.1 -12.0 4.9 76 80 A Q E -CD 39 71A 4 -37,-3.3 -37,-3.0 -2,-0.4 2,-0.4 -0.740 8.8-160.1 -93.4 135.1 2.1 -8.6 6.6 77 81 A Y E -CD 38 70A 46 -7,-2.7 -7,-1.9 -2,-0.4 2,-0.5 -0.955 6.2-170.5-118.0 129.6 4.2 -5.7 5.1 78 82 A L E -CD 37 69A 0 -41,-2.6 -41,-2.8 -2,-0.4 2,-0.7 -0.966 12.6-150.4-121.0 116.4 5.3 -2.6 7.1 79 83 A F E +CD 36 68A 44 -11,-3.2 -12,-3.5 -2,-0.5 -11,-1.2 -0.779 29.7 172.6 -89.3 115.3 6.9 0.2 5.1 80 84 A L E -CD 35 66A 16 -45,-3.4 -45,-3.3 -2,-0.7 -14,-0.2 -0.829 39.9 -83.7-125.9 157.4 9.3 2.0 7.5 81 85 A E E -C 34 0A 29 -16,-2.7 2,-0.5 -2,-0.3 -47,-0.1 -0.364 44.8-129.2 -58.8 127.6 11.9 4.7 7.4 82 86 A Y - 0 0 67 -49,-0.5 2,-0.8 -2,-0.1 -1,-0.1 -0.712 16.6-160.2 -82.2 127.2 15.3 3.3 6.3 83 87 A C > - 0 0 9 -2,-0.5 3,-2.0 52,-0.1 51,-0.3 -0.848 4.6-170.7-110.3 93.1 18.1 4.2 8.7 84 88 A S T 3 S+ 0 0 53 -2,-0.8 51,-0.2 1,-0.3 -1,-0.1 0.671 77.0 71.9 -59.6 -18.5 21.3 3.7 6.7 85 89 A G T 3 S- 0 0 30 49,-1.8 -1,-0.3 1,-0.2 50,-0.2 0.616 95.0-142.6 -74.8 -12.5 23.4 4.3 9.8 86 90 A G E < -F 134 0B 31 -3,-2.0 48,-2.8 48,-0.7 2,-0.2 -0.337 41.2 -22.9 85.0-168.0 22.4 0.9 11.3 87 91 A E E > -F 133 0B 55 46,-0.2 3,-1.5 1,-0.1 46,-0.2 -0.568 48.7-130.5 -83.1 144.5 21.7 0.0 15.0 88 92 A L G >> S+ 0 0 0 44,-3.3 3,-2.5 41,-0.8 4,-0.5 0.840 106.6 74.1 -58.6 -30.9 23.2 2.1 17.8 89 93 A F G >4 S+ 0 0 91 40,-1.4 3,-0.8 43,-0.3 -1,-0.3 0.831 92.0 53.4 -49.4 -39.1 24.3 -1.3 19.1 90 94 A D G <4 S+ 0 0 116 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.439 100.9 58.8 -80.5 -0.3 27.0 -1.4 16.4 91 95 A R G <4 S+ 0 0 82 -3,-2.5 2,-0.6 -4,-0.2 -1,-0.2 0.405 86.3 91.0-104.3 -4.5 28.4 2.0 17.4 92 96 A I S << S- 0 0 23 -3,-0.8 6,-0.2 -4,-0.5 105,-0.1 -0.858 73.9-142.1 -94.3 119.7 29.1 0.7 20.9 93 97 A E B >> -H 97 0C 113 4,-2.6 4,-2.9 -2,-0.6 3,-2.8 -0.722 30.7-101.6 -86.2 120.7 32.6 -0.7 21.1 94 98 A P T 34 S- 0 0 109 0, 0.0 107,-0.2 0, 0.0 106,-0.1 -0.107 101.6 -4.8 -44.0 123.9 32.8 -3.8 23.4 95 99 A D T 34 S+ 0 0 87 105,-3.4 105,-0.2 1,-0.1 106,-0.1 0.359 134.3 59.4 68.5 1.1 34.2 -2.8 26.8 96 100 A I T <4 S- 0 0 97 -3,-2.8 2,-0.5 1,-0.2 104,-0.3 0.659 77.4-161.7-120.9 -41.4 35.0 0.8 25.7 97 101 A G B < -H 93 0C 1 -4,-2.9 -4,-2.6 102,-0.3 101,-0.3 -0.817 37.4 -68.8 93.3-127.8 31.7 2.4 24.7 98 102 A M - 0 0 20 99,-1.4 -6,-0.1 -2,-0.5 5,-0.1 -0.947 63.9 -57.4-157.0 169.1 32.0 5.5 22.5 99 103 A P >> - 0 0 77 0, 0.0 4,-2.3 0, 0.0 3,-0.7 -0.287 50.6-124.9 -56.1 133.7 33.2 9.1 22.9 100 104 A E H 3> S+ 0 0 45 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.872 109.0 56.1 -50.1 -42.2 31.2 10.8 25.7 101 105 A P H 3> S+ 0 0 37 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.891 108.6 47.3 -59.5 -39.9 30.0 13.7 23.4 102 106 A D H <> S+ 0 0 27 -3,-0.7 4,-2.8 2,-0.2 5,-0.2 0.932 112.4 49.7 -66.1 -45.7 28.5 11.1 20.9 103 107 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.903 110.4 50.7 -58.5 -42.9 26.9 9.3 23.8 104 108 A Q H X S+ 0 0 10 -4,-2.9 4,-2.7 -5,-0.2 -1,-0.2 0.929 111.4 47.6 -63.7 -44.4 25.4 12.6 25.1 105 109 A R H X S+ 0 0 50 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.949 113.2 47.0 -64.5 -43.8 24.0 13.5 21.7 106 110 A F H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.909 112.7 51.0 -63.4 -37.3 22.5 10.1 21.2 107 111 A F H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.894 107.3 53.0 -66.7 -39.4 21.1 10.3 24.7 108 112 A H H X S+ 0 0 56 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.912 113.2 44.3 -58.2 -43.1 19.6 13.7 24.0 109 113 A Q H X S+ 0 0 25 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.880 110.7 53.4 -72.4 -35.3 17.9 12.2 20.9 110 114 A L H X S+ 0 0 1 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.936 110.2 48.6 -62.6 -45.3 16.8 9.2 22.8 111 115 A M H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 5,-0.3 0.903 107.7 54.0 -59.9 -43.5 15.1 11.4 25.4 112 116 A A H X S+ 0 0 31 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.922 111.5 46.4 -56.6 -44.3 13.4 13.5 22.8 113 117 A G H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.922 114.1 46.5 -64.4 -46.6 11.9 10.3 21.3 114 118 A V H X S+ 0 0 1 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.887 109.8 53.3 -68.5 -36.7 10.8 9.0 24.7 115 119 A V H X S+ 0 0 52 -4,-3.1 4,-1.7 2,-0.2 -1,-0.2 0.913 110.7 48.9 -61.2 -41.7 9.3 12.3 25.8 116 120 A Y H X S+ 0 0 51 -4,-2.0 4,-1.2 -5,-0.3 -2,-0.2 0.961 113.2 45.5 -61.6 -51.4 7.3 12.3 22.6 117 121 A L H ><>S+ 0 0 1 -4,-2.4 5,-2.5 1,-0.2 3,-1.0 0.936 113.8 47.2 -58.7 -51.5 6.1 8.7 23.1 118 122 A H H ><5S+ 0 0 5 -4,-3.0 3,-1.3 1,-0.3 -1,-0.2 0.824 105.7 64.0 -61.2 -28.5 5.2 9.1 26.7 119 123 A G H 3<5S+ 0 0 52 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.809 106.2 40.7 -65.0 -34.6 3.5 12.3 25.7 120 124 A I T <<5S- 0 0 59 -4,-1.2 -1,-0.3 -3,-1.0 -2,-0.2 0.193 124.9-103.3-100.6 18.1 1.0 10.5 23.6 121 125 A G T < 5S+ 0 0 0 -3,-1.3 30,-2.8 1,-0.2 31,-1.1 0.758 77.4 131.4 73.1 30.3 0.7 7.8 26.2 122 126 A I E < -I 150 0D 0 -5,-2.5 2,-0.4 28,-0.3 -1,-0.2 -0.933 38.0-162.0-117.8 133.7 2.7 5.1 24.6 123 127 A T E -I 149 0D 0 26,-2.7 26,-2.2 -2,-0.4 60,-0.1 -0.949 9.9-152.4-113.0 138.6 5.5 3.1 26.4 124 128 A H - 0 0 2 -2,-0.4 23,-0.2 24,-0.2 -1,-0.1 0.906 13.4-165.6 -74.7 -46.5 8.0 1.2 24.3 125 129 A R S S+ 0 0 28 57,-0.1 41,-0.1 23,-0.1 -1,-0.1 0.324 73.3 58.3 73.6 -2.0 8.9 -1.5 26.8 126 130 A D + 0 0 16 39,-0.1 2,-0.4 18,-0.1 5,-0.2 -0.111 61.1 161.2-148.3 48.1 12.0 -2.7 25.0 127 131 A I + 0 0 1 42,-0.1 39,-0.1 3,-0.1 66,-0.1 -0.575 21.0 133.0 -72.9 122.6 14.5 0.2 24.6 128 132 A K S > S- 0 0 37 -2,-0.4 3,-2.1 64,-0.0 4,-0.3 -0.950 70.5 -94.7-163.6 155.1 17.9 -1.2 24.0 129 133 A P G > S+ 0 0 0 0, 0.0 -40,-1.4 0, 0.0 3,-1.3 0.764 119.9 64.6 -47.5 -32.4 20.7 -0.3 21.4 130 134 A E G 3 S+ 0 0 58 1,-0.3 -3,-0.1 -42,-0.2 -40,-0.1 0.847 106.9 42.7 -60.9 -34.7 19.4 -3.0 19.0 131 135 A N G < S+ 0 0 15 -3,-2.1 12,-2.5 -5,-0.2 2,-0.6 0.283 95.7 87.0 -95.4 9.3 16.2 -1.1 18.6 132 136 A L E < - G 0 142B 0 -3,-1.3 -44,-3.3 -4,-0.3 -43,-0.3 -0.947 65.8-163.6-113.0 113.1 17.7 2.4 18.4 133 137 A L E -FG 87 141B 35 8,-3.0 8,-3.0 -2,-0.6 2,-0.4 -0.631 12.3-139.8-102.3 157.4 18.6 3.2 14.8 134 138 A L E -FG 86 140B 0 -48,-2.8 -49,-1.8 -51,-0.3 -48,-0.7 -0.919 11.9-150.8-115.4 133.4 20.8 5.8 13.1 135 139 A D > - 0 0 6 4,-2.1 3,-1.8 -2,-0.4 -52,-0.1 -0.200 47.4 -77.7 -87.1-171.2 19.9 7.6 9.9 136 140 A E T 3 S+ 0 0 128 1,-0.3 -53,-0.1 2,-0.1 -1,-0.0 0.702 134.0 47.2 -63.4 -20.6 22.5 8.9 7.5 137 141 A R T 3 S- 0 0 170 2,-0.1 -1,-0.3 132,-0.0 3,-0.1 0.085 121.9-104.6-105.8 21.2 23.4 11.9 9.7 138 142 A D < + 0 0 53 -3,-1.8 2,-0.4 1,-0.2 -2,-0.1 0.784 67.7 155.8 60.5 30.3 23.6 9.7 12.8 139 143 A N - 0 0 23 1,-0.0 -4,-2.1 -30,-0.0 2,-0.3 -0.703 42.4-122.5 -84.1 137.5 20.3 10.9 14.1 140 144 A L E - G 0 134B 1 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.667 27.8-172.0 -89.3 139.7 18.8 8.4 16.4 141 145 A K E - G 0 133B 19 -8,-3.0 -8,-3.0 -2,-0.3 2,-0.4 -0.991 22.1-129.2-131.8 129.5 15.4 6.9 15.8 142 146 A I E -eG 63 132B 1 -80,-2.6 -78,-2.7 -2,-0.4 2,-0.3 -0.639 36.9-176.3 -77.9 131.1 13.4 4.7 18.1 143 147 A S + 0 0 13 -12,-2.5 -12,-0.0 -2,-0.4 -78,-0.0 -0.781 36.1 44.7-126.4 168.9 12.3 1.6 16.3 144 148 A D - 0 0 14 -2,-0.3 3,-0.4 1,-0.1 -1,-0.2 0.985 38.4-175.4 65.2 92.1 10.2 -1.6 16.8 145 149 A F > + 0 0 1 1,-0.2 3,-0.5 2,-0.1 -91,-0.1 0.027 48.4 118.4-102.7 29.3 6.9 -1.1 18.5 146 150 A G T 3 S+ 0 0 10 1,-0.2 -1,-0.2 -20,-0.1 -95,-0.1 0.788 87.3 30.7 -65.4 -26.9 6.1 -4.8 18.6 147 151 A L T 3 S+ 0 0 33 -3,-0.4 -1,-0.2 -23,-0.2 -2,-0.1 0.379 96.2 119.0-112.1 2.8 6.0 -4.7 22.4 148 152 A A < + 0 0 1 -3,-0.5 2,-0.3 -22,-0.1 -24,-0.2 -0.228 38.6 179.2 -67.7 154.0 4.8 -1.1 22.8 149 153 A T E -I 123 0D 3 -26,-2.2 -26,-2.7 -95,-0.0 2,-0.5 -0.981 32.9-100.3-153.9 163.6 1.5 -0.4 24.5 150 154 A V E +I 122 0D 35 -2,-0.3 -28,-0.3 -28,-0.2 3,-0.1 -0.767 33.2 171.0 -87.4 127.1 -0.8 2.5 25.5 151 155 A F + 0 0 0 -30,-2.8 7,-2.7 -2,-0.5 2,-0.4 0.421 66.4 45.0-115.6 -3.5 -0.5 3.4 29.2 152 156 A R E +J 157 0E 63 -31,-1.1 2,-0.3 5,-0.2 -1,-0.3 -0.983 60.6 164.6-141.9 131.0 -2.5 6.6 29.2 153 157 A Y E > S+J 156 0E 171 3,-2.1 3,-1.6 -2,-0.4 -32,-0.0 -0.984 71.7 1.3-148.5 133.1 -5.9 7.0 27.6 154 158 A N T 3 S- 0 0 136 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.881 130.1 -62.7 54.0 37.7 -8.5 9.8 28.1 155 159 A N T 3 S+ 0 0 145 1,-0.2 2,-0.5 -3,-0.0 -1,-0.3 0.712 111.7 121.3 58.5 29.3 -6.0 11.2 30.6 156 160 A R E < -J 153 0E 183 -3,-1.6 -3,-2.1 2,-0.0 2,-0.3 -0.987 57.7-137.1-120.2 123.9 -6.2 8.1 32.8 157 161 A E E -J 152 0E 70 -2,-0.5 2,-0.5 -5,-0.2 -5,-0.2 -0.618 11.0-152.9 -82.5 140.1 -3.0 6.1 33.5 158 162 A R - 0 0 117 -7,-2.7 24,-0.3 -2,-0.3 2,-0.2 -0.947 16.2-131.4-110.0 126.6 -3.2 2.3 33.4 159 163 A L - 0 0 65 -2,-0.5 2,-0.2 22,-0.1 22,-0.2 -0.563 24.1-131.2 -76.8 147.4 -0.7 0.5 35.5 160 164 A L B +K 180 0F 5 20,-3.0 20,-2.5 -2,-0.2 -1,-0.1 -0.602 32.9 167.1 -98.4 160.8 1.2 -2.3 33.7 161 165 A N + 0 0 84 18,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.391 40.9 112.9-146.4 -9.3 1.7 -5.9 34.9 162 166 A K - 0 0 94 1,-0.1 2,-0.6 0, 0.0 -2,-0.0 -0.543 68.1-127.6 -72.6 127.0 3.0 -7.8 31.8 163 167 A M + 0 0 121 -2,-0.3 2,-0.3 12,-0.0 -1,-0.1 -0.684 51.4 155.3 -75.2 120.0 6.6 -8.9 32.2 164 168 A C + 0 0 16 -2,-0.6 2,-0.3 2,-0.0 -39,-0.1 -0.968 19.3 44.0-147.2 155.9 8.1 -7.5 29.0 165 169 A G S S- 0 0 31 -2,-0.3 2,-0.4 -39,-0.1 -39,-0.1 -0.817 87.1 -49.6 115.2-153.2 11.4 -6.4 27.6 166 170 A T >> - 0 0 33 -2,-0.3 3,-2.1 -39,-0.1 4,-1.0 -0.988 47.8-125.1-135.8 120.7 15.0 -7.7 27.8 167 171 A L G >4 S+ 0 0 84 -2,-0.4 3,-0.6 1,-0.3 -1,-0.1 0.736 106.4 50.1 -37.9 -50.0 16.5 -8.7 31.1 168 172 A P G 34 S+ 0 0 28 0, 0.0 -1,-0.3 0, 0.0 36,-0.2 0.835 119.6 39.6 -61.4 -27.8 19.6 -6.6 31.1 169 173 A Y G <4 S+ 0 0 15 -3,-2.1 -2,-0.2 36,-0.1 23,-0.2 0.478 92.8 108.6 -98.4 -8.7 17.5 -3.5 30.3 170 174 A V S << S- 0 0 10 -4,-1.0 -5,-0.1 -3,-0.6 16,-0.1 -0.452 71.1-114.7 -81.8 145.3 14.5 -4.2 32.4 171 175 A A >> - 0 0 0 -2,-0.2 3,-1.2 1,-0.1 4,-0.6 -0.479 24.6-119.7 -73.4 146.1 13.7 -2.2 35.5 172 176 A P H >> S+ 0 0 1 0, 0.0 4,-1.2 0, 0.0 3,-1.0 0.786 107.5 67.3 -59.1 -27.9 13.8 -4.1 38.9 173 177 A E H 3> S+ 0 0 4 1,-0.3 4,-2.6 2,-0.2 3,-0.3 0.856 91.2 62.5 -65.4 -29.3 10.1 -3.4 39.6 174 178 A L H <4 S+ 0 0 9 -3,-1.2 -1,-0.3 1,-0.2 6,-0.0 0.839 108.4 44.0 -61.5 -29.9 9.1 -5.7 36.7 175 179 A L H << S+ 0 0 54 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.668 126.5 26.4 -89.2 -18.7 10.8 -8.5 38.6 176 180 A K H < S+ 0 0 96 -4,-1.2 2,-0.4 -3,-0.3 -2,-0.2 0.550 109.5 61.5-125.3 -1.1 9.5 -7.8 42.1 177 181 A R < - 0 0 163 -4,-2.6 -1,-0.1 -5,-0.2 3,-0.1 -0.941 63.8-141.6-124.5 146.1 6.1 -6.0 41.9 178 182 A R S S+ 0 0 179 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.890 89.4 25.7 -71.5 -38.6 2.9 -7.2 40.4 179 183 A E S S+ 0 0 87 -18,-0.0 2,-0.3 -6,-0.0 -18,-0.2 -0.939 70.7 172.0-126.5 151.8 1.9 -3.8 38.9 180 184 A F B -K 160 0F 12 -20,-2.5 -20,-3.0 -2,-0.3 2,-0.2 -0.997 36.7 -96.6-158.0 155.4 4.0 -0.8 37.9 181 185 A H > - 0 0 79 -2,-0.3 4,-0.6 -22,-0.2 -22,-0.1 -0.505 31.3-139.3 -70.9 142.0 4.0 2.6 36.3 182 186 A A H >> S+ 0 0 0 -24,-0.3 4,-1.2 -2,-0.2 3,-0.8 0.924 89.5 58.9 -69.3 -49.0 5.0 2.5 32.6 183 187 A E H >> S+ 0 0 67 1,-0.2 4,-2.1 2,-0.2 3,-0.6 0.882 100.2 52.5 -53.9 -51.7 7.2 5.6 32.3 184 188 A P H 3> S+ 0 0 26 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.814 104.4 60.7 -58.5 -25.9 9.9 4.8 35.0 185 189 A V H S- 0 0 20 -2,-1.7 3,-1.9 1,-0.1 7,-0.3 -0.919 72.7-120.4-127.5 152.2 17.8 -8.7 41.1 209 213 A D T 3 S+ 0 0 88 -2,-0.3 6,-0.2 1,-0.3 -1,-0.1 0.776 113.3 67.9 -63.7 -23.8 19.7 -9.0 44.5 210 214 A S T 3 S+ 0 0 107 4,-0.1 2,-0.8 1,-0.1 -1,-0.3 0.716 85.7 84.6 -65.7 -19.8 20.7 -12.5 43.4 211 215 A C S <> S- 0 0 11 -3,-1.9 4,-2.1 1,-0.2 3,-0.4 -0.763 71.3-157.1 -88.6 112.6 22.7 -10.6 40.8 212 216 A Q H > S+ 0 0 101 -2,-0.8 4,-2.8 1,-0.2 5,-0.2 0.876 90.5 52.5 -58.8 -44.3 26.0 -9.6 42.4 213 217 A E H > S+ 0 0 91 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.868 111.1 51.0 -59.6 -34.5 26.9 -6.8 40.1 214 218 A Y H > S+ 0 0 1 -3,-0.4 4,-2.3 -6,-0.2 -2,-0.2 0.910 110.2 45.6 -71.0 -42.4 23.5 -5.3 40.8 215 219 A S H X S+ 0 0 17 -4,-2.1 4,-2.0 -7,-0.3 5,-0.2 0.934 110.2 57.6 -65.6 -38.7 23.8 -5.5 44.6 216 220 A D H <>S+ 0 0 21 -4,-2.8 5,-2.4 -5,-0.2 4,-0.3 0.902 107.4 47.1 -56.3 -40.0 27.3 -4.0 44.1 217 221 A W H ><5S+ 0 0 10 -4,-1.7 3,-2.0 1,-0.2 -1,-0.2 0.947 109.3 52.3 -68.0 -45.0 25.7 -1.1 42.4 218 222 A K H 3<5S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.803 107.9 53.3 -62.2 -23.7 23.1 -0.7 45.1 219 223 A E T 3<5S- 0 0 108 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.548 117.4-119.2 -85.1 -8.8 26.0 -0.7 47.6 220 224 A K T < 5 + 0 0 140 -3,-2.0 2,-2.2 -4,-0.3 -3,-0.2 0.727 55.7 158.1 77.3 26.3 27.5 2.1 45.5 221 225 A K > < + 0 0 58 -5,-2.4 3,-1.3 1,-0.2 -1,-0.2 -0.404 7.6 152.3 -78.9 63.7 30.7 0.3 44.6 222 226 A T T 3 + 0 0 38 -2,-2.2 -1,-0.2 1,-0.3 -5,-0.1 0.460 53.8 83.7 -76.5 -0.2 31.4 2.5 41.5 223 227 A Y T 3 S+ 0 0 152 -3,-0.1 -1,-0.3 4,-0.1 2,-0.2 0.525 85.8 75.3 -78.2 -4.1 35.1 1.8 41.8 224 228 A L S <> S- 0 0 58 -3,-1.3 4,-1.5 1,-0.1 3,-0.4 -0.653 93.1 -54.5-103.1 160.9 34.3 -1.3 39.9 225 229 A N T 4 S+ 0 0 73 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 -0.461 113.5 23.8 -72.7 151.7 33.5 -1.7 36.2 226 230 A P T >4 S+ 0 0 3 0, 0.0 3,-1.8 0, 0.0 4,-0.3 -0.993 125.2 49.4 -82.8 -11.6 31.5 -0.6 34.3 227 231 A W G >4 S+ 0 0 8 -3,-0.4 3,-1.7 1,-0.3 -2,-0.2 0.774 100.7 63.7 -58.1 -33.7 31.2 2.5 36.5 228 232 A K G 3< S+ 0 0 118 -4,-1.5 -1,-0.3 1,-0.3 -3,-0.1 0.717 99.2 56.5 -65.7 -18.9 34.9 3.2 36.9 229 233 A K G < S+ 0 0 69 -3,-1.8 2,-0.4 -5,-0.2 -1,-0.3 0.517 95.4 84.5 -86.0 -7.7 35.0 3.8 33.1 230 234 A I S < S- 0 0 12 -3,-1.7 -31,-0.1 -4,-0.3 -35,-0.0 -0.827 83.1-117.6-104.8 133.4 32.4 6.5 33.4 231 235 A D > - 0 0 76 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.257 29.3-108.9 -65.4 153.5 33.1 10.0 34.2 232 236 A S H > S+ 0 0 89 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.838 112.1 54.6 -51.4 -45.2 31.7 11.5 37.4 233 237 A A H > S+ 0 0 22 1,-0.2 4,-1.4 2,-0.2 27,-0.4 0.964 114.8 37.3 -60.6 -56.1 29.2 13.9 35.7 234 238 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.846 114.7 57.4 -67.4 -23.8 27.4 11.2 33.6 235 239 A L H X S+ 0 0 20 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.889 101.4 56.3 -68.4 -34.0 27.8 8.7 36.5 236 240 A A H X S+ 0 0 47 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.880 107.8 48.3 -62.9 -39.4 25.9 11.2 38.7 237 241 A L H >X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 3,-1.0 0.923 109.4 52.6 -66.5 -44.6 23.1 11.1 36.2 238 242 A L H 3X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.3 -2,-0.2 0.861 102.7 58.0 -60.4 -31.9 23.2 7.3 36.2 239 243 A H H 3< S+ 0 0 60 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.785 110.5 45.3 -68.0 -24.4 22.9 7.3 40.0 240 244 A K H << S+ 0 0 84 -3,-1.0 10,-2.0 -4,-0.8 3,-0.3 0.803 118.3 40.9 -85.9 -33.0 19.6 9.2 39.5 241 245 A I H < S+ 0 0 0 -4,-2.2 2,-2.2 1,-0.2 -2,-0.2 0.932 107.2 59.4 -78.4 -47.9 18.3 7.0 36.8 242 246 A L S < S+ 0 0 5 -4,-2.9 2,-0.5 -5,-0.2 -1,-0.2 -0.279 73.5 140.2 -84.4 59.0 19.3 3.5 38.0 243 247 A V - 0 0 40 -2,-2.2 6,-0.2 -3,-0.3 -3,-0.1 -0.843 50.5-141.8-103.5 130.9 17.3 3.8 41.3 244 248 A E S S+ 0 0 56 -2,-0.5 -71,-0.2 1,-0.1 -1,-0.1 0.906 86.4 72.5 -61.1 -43.7 15.5 0.7 42.4 245 249 A N S >> S- 0 0 87 1,-0.2 3,-1.5 -73,-0.1 4,-1.2 -0.640 72.2-155.0 -76.7 109.1 12.4 2.5 43.8 246 250 A P T 34 S+ 0 0 31 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.748 93.0 58.0 -55.2 -25.1 10.5 3.6 40.6 247 251 A S T 34 S+ 0 0 102 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.782 110.4 41.0 -77.8 -24.0 8.9 6.3 42.6 248 252 A A T <4 S+ 0 0 65 -3,-1.5 -1,-0.2 2,-0.1 3,-0.1 0.555 91.2 112.9 -97.8 -10.4 12.2 7.9 43.6 249 253 A R S < S- 0 0 8 -4,-1.2 -8,-0.2 -6,-0.2 -9,-0.1 -0.332 80.3 -98.3 -63.4 142.7 13.7 7.4 40.1 250 254 A I - 0 0 21 -10,-2.0 2,-0.2 -13,-0.1 -1,-0.1 -0.246 37.1-136.6 -61.8 145.8 14.4 10.6 38.2 251 255 A T >> - 0 0 71 -3,-0.1 4,-1.9 1,-0.1 3,-0.5 -0.616 23.8-106.2 -99.0 166.2 11.8 11.6 35.7 252 256 A I H 3> S+ 0 0 12 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.928 117.7 59.3 -62.2 -44.6 12.5 12.8 32.2 253 257 A P H 34 S+ 0 0 79 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.865 112.7 42.6 -52.8 -30.7 11.7 16.4 33.0 254 258 A D H X4 S+ 0 0 80 -3,-0.5 3,-1.3 2,-0.2 4,-0.5 0.794 105.5 60.0 -86.1 -28.4 14.4 16.3 35.6 255 259 A I H >< S+ 0 0 0 -4,-1.9 3,-1.9 1,-0.3 6,-0.2 0.930 100.8 58.9 -60.9 -39.5 16.9 14.4 33.5 256 260 A K T 3< S+ 0 0 91 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.660 104.7 49.9 -62.7 -15.6 16.7 17.4 31.2 257 261 A K T < S+ 0 0 150 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.449 85.3 121.5-100.1 -4.0 17.8 19.5 34.2 258 262 A D <> - 0 0 5 -3,-1.9 4,-1.4 -4,-0.5 5,-0.1 -0.275 68.5-126.4 -64.1 145.0 20.8 17.3 35.0 259 263 A R T 4 S+ 0 0 192 1,-0.2 3,-0.4 2,-0.2 4,-0.2 0.912 108.8 44.2 -58.3 -47.9 24.3 18.8 34.9 260 264 A W T >4 S+ 0 0 0 -27,-0.4 3,-1.7 1,-0.2 -1,-0.2 0.910 107.7 59.3 -65.8 -40.4 25.8 16.3 32.5 261 265 A Y T 34 S+ 0 0 24 1,-0.3 -1,-0.2 -6,-0.2 -2,-0.2 0.839 113.5 38.7 -55.8 -30.7 22.8 16.4 30.3 262 266 A N T 3< S+ 0 0 100 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.249 86.5 119.5-106.8 12.5 23.3 20.1 29.8 263 267 A K < - 0 0 83 -3,-1.7 2,-0.3 -4,-0.2 -3,-0.0 -0.658 69.8-118.8 -83.3 126.5 27.1 20.2 29.6 264 268 A P + 0 0 126 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.477 62.2 130.9 -64.8 123.5 28.6 21.5 26.3 265 269 A L + 0 0 52 -2,-0.3 2,-0.4 1,-0.3 -163,-0.1 0.557 46.3 65.9-137.4 -51.7 30.6 18.6 24.9 266 270 A K - 0 0 93 -165,-0.2 -1,-0.3 -166,-0.1 2,-0.2 -0.759 63.8-143.3 -95.5 126.7 29.8 17.9 21.2 267 271 A K - 0 0 182 -2,-0.4 3,-0.1 1,-0.1 -1,-0.0 -0.507 37.1 -97.2 -78.7 152.8 30.6 20.2 18.4 268 272 A G - 0 0 69 1,-0.2 -1,-0.1 -2,-0.2 3,-0.1 -0.196 59.6 -68.9 -65.2 164.8 28.0 20.3 15.6 269 273 A A - 0 0 94 1,-0.1 -1,-0.2 -3,-0.1 -132,-0.0 -0.323 65.5 -95.8 -57.9 134.7 28.7 18.2 12.5 270 274 A K - 0 0 207 -3,-0.1 -1,-0.1 1,-0.1 0, 0.0 -0.129 40.9-155.3 -51.5 144.1 31.6 19.5 10.5 271 275 A R 0 0 218 -3,-0.1 -1,-0.1 1,-0.0 -3,-0.0 -0.875 360.0 360.0-121.5 155.3 30.7 21.8 7.6 272 276 A P 0 0 179 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.368 360.0 360.0 -63.3 360.0 32.7 22.5 4.4