==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 18-MAY-12 4F9C . COMPND 2 MOLECULE: CELL DIVISION CYCLE 7-RELATED PROTEIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.HUGHES,P.CHEREPANOV . 394 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18709.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 256 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 2 1 2 1 1 2 0 1 1 0 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 . 2 2 0 2 3 1 0 0 1 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 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 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 41 A K > 0 0 202 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -50.9 19.4 32.1 72.0 2 42 A K H > + 0 0 133 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.772 360.0 56.9 -70.7 -29.3 16.0 31.8 73.7 3 43 A D H > S+ 0 0 67 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.904 104.5 50.8 -67.6 -42.0 15.5 28.7 71.5 4 44 A I H > S+ 0 0 26 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.947 110.8 48.9 -59.8 -48.7 18.7 27.2 73.0 5 45 A E H X S+ 0 0 112 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.907 111.0 49.8 -55.9 -46.0 17.4 27.9 76.5 6 46 A K H X S+ 0 0 80 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.834 108.2 53.8 -66.2 -33.4 14.0 26.4 75.8 7 47 A L H X S+ 0 0 2 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.955 107.9 48.9 -65.2 -51.5 15.5 23.2 74.3 8 48 A Y H < S+ 0 0 59 -4,-2.2 7,-0.3 1,-0.2 6,-0.2 0.891 113.2 49.1 -50.5 -43.8 17.6 22.6 77.5 9 49 A E H < S+ 0 0 133 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.836 111.1 49.0 -69.1 -35.4 14.4 23.1 79.5 10 50 A A H < S+ 0 0 19 -4,-1.8 79,-0.2 1,-0.3 -1,-0.2 0.838 125.9 26.5 -73.7 -36.0 12.4 20.7 77.3 11 51 A V S >< S- 0 0 0 -4,-2.3 3,-2.0 1,-0.1 4,-0.4 -0.748 72.1-178.7-128.9 82.3 15.1 18.0 77.5 12 52 A P G > S+ 0 0 52 0, 0.0 3,-1.8 0, 0.0 4,-0.4 0.828 76.4 67.8 -56.7 -36.9 17.0 18.5 80.8 13 53 A Q G > S+ 0 0 55 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.768 85.5 73.3 -54.2 -26.8 19.4 15.6 80.2 14 54 A L G X> S+ 0 0 0 -3,-2.0 4,-3.1 1,-0.3 3,-1.3 0.845 87.6 60.8 -56.8 -35.4 20.9 17.6 77.3 15 55 A S G <4 S+ 0 0 74 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 0.742 99.1 56.8 -69.0 -18.8 22.6 19.9 79.8 16 56 A N G <4 S+ 0 0 47 -3,-1.3 382,-2.4 -4,-0.4 -1,-0.3 0.639 122.9 23.0 -77.0 -16.1 24.6 17.0 81.2 17 57 A V T <4 S+ 0 0 10 -3,-1.3 21,-0.5 -4,-0.5 2,-0.4 0.725 112.2 55.0-123.6 -36.7 26.0 16.1 77.7 18 58 A F < - 0 0 6 -4,-3.1 2,-0.8 -5,-0.1 19,-0.2 -0.882 47.7-154.4-120.8 139.9 26.1 19.1 75.3 19 59 A K E -A 36 0A 151 17,-2.7 17,-2.1 -2,-0.4 2,-0.6 -0.905 32.1-151.5 -96.4 98.1 27.3 22.7 75.0 20 60 A I E +A 35 0A 16 -2,-0.8 15,-0.3 15,-0.3 3,-0.1 -0.638 21.7 173.8 -81.4 116.1 24.8 23.9 72.5 21 61 A E E - 0 0 90 13,-2.3 2,-0.3 -2,-0.6 14,-0.2 0.897 50.7 -16.6 -92.6 -47.2 26.4 26.7 70.5 22 62 A D E -A 34 0A 99 12,-1.4 12,-3.3 -18,-0.0 2,-0.6 -0.976 58.5-103.2-160.5 158.5 24.0 27.8 67.7 23 63 A K E +A 33 0A 54 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.863 35.0 175.5 -91.6 120.6 21.0 27.0 65.6 24 64 A I E + 0 0 58 8,-2.1 2,-0.3 -2,-0.6 9,-0.2 0.520 59.4 15.2-106.6 -8.5 22.2 25.8 62.2 25 65 A G E -A 32 0A 27 7,-1.7 7,-2.1 2,-0.0 2,-0.3 -0.987 53.7-174.9-161.2 156.8 19.0 24.7 60.4 26 66 A E E +A 31 0A 127 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.932 10.5 161.1-159.6 136.2 15.2 25.0 60.7 27 67 A G - 0 0 42 3,-2.8 3,-0.2 -2,-0.3 -2,-0.0 -0.717 56.6 -78.8-137.7-170.5 12.3 23.5 58.8 28 68 A T S S+ 0 0 113 -2,-0.2 3,-0.1 1,-0.2 0, 0.0 0.823 127.3 28.1 -62.2 -34.5 8.6 23.0 59.3 29 69 A F S S+ 0 0 45 1,-0.1 24,-2.8 23,-0.0 2,-0.3 0.413 123.4 20.1-115.4 1.0 9.1 19.9 61.5 30 70 A S E - B 0 52A 13 22,-0.3 -3,-2.8 -3,-0.2 2,-0.4 -0.995 50.5-141.6-162.5 158.6 12.5 20.4 63.2 31 71 A S E -AB 26 51A 14 20,-1.9 20,-2.7 -2,-0.3 2,-0.4 -0.993 20.2-150.7-124.4 139.8 15.3 22.7 64.3 32 72 A V E -AB 25 50A 32 -7,-2.1 -8,-2.1 -2,-0.4 -7,-1.7 -0.930 13.6-166.0-113.1 132.8 18.9 21.6 64.1 33 73 A Y E -AB 23 49A 6 16,-2.7 16,-2.8 -2,-0.4 2,-0.4 -0.903 20.3-127.5-118.5 145.1 21.6 22.9 66.5 34 74 A L E +AB 22 48A 16 -12,-3.3 -13,-2.3 -2,-0.3 -12,-1.4 -0.791 40.3 167.2 -84.6 131.7 25.4 22.9 66.6 35 75 A A E -AB 20 47A 0 12,-2.5 12,-3.4 -2,-0.4 2,-0.4 -0.959 30.3-132.4-143.0 158.8 26.7 21.5 69.9 36 76 A T E +AB 19 46A 23 -17,-2.1 -17,-2.7 -2,-0.3 2,-0.3 -0.905 27.8 171.8-111.0 142.2 29.9 20.3 71.4 37 77 A A E - B 0 45A 4 8,-2.1 8,-3.0 -2,-0.4 2,-0.5 -0.980 31.6-117.9-143.8 159.7 30.3 17.1 73.4 38 78 A Q E - B 0 44A 47 -21,-0.5 358,-3.0 358,-0.4 2,-0.3 -0.858 27.0-140.1 -97.9 125.2 33.0 15.0 75.0 39 79 A L B > -E 395 0B 17 4,-3.1 3,-1.3 -2,-0.5 356,-0.2 -0.648 11.5-135.2 -80.2 143.3 33.4 11.4 73.6 40 80 A Q T 3 S+ 0 0 122 354,-2.6 -1,-0.1 -2,-0.3 355,-0.1 0.882 107.5 65.4 -59.1 -38.0 34.2 8.6 76.1 41 81 A V T 3 S- 0 0 131 353,-0.5 -1,-0.2 1,-0.1 354,-0.1 0.599 125.2-100.0 -62.9 -14.3 36.7 7.4 73.5 42 82 A G S < S+ 0 0 41 -3,-1.3 -1,-0.1 1,-0.4 -3,-0.1 -0.415 84.8 101.7 132.4 -60.7 38.6 10.7 74.2 43 83 A P - 0 0 72 0, 0.0 -4,-3.1 0, 0.0 -1,-0.4 -0.135 64.7-126.4 -53.9 147.8 38.0 13.4 71.5 44 84 A E E -B 38 0A 132 -6,-0.2 2,-0.3 -4,-0.0 -6,-0.2 -0.682 38.1-163.4 -81.2 153.0 35.7 16.4 71.9 45 85 A E E -B 37 0A 54 -8,-3.0 -8,-2.1 -2,-0.3 2,-0.4 -1.000 23.2-121.3-147.6 142.7 33.3 16.4 68.9 46 86 A K E -B 36 0A 99 -2,-0.3 50,-1.6 -10,-0.2 2,-0.4 -0.682 36.3-167.5 -81.6 134.4 30.9 18.7 67.2 47 87 A I E -BC 35 95A 0 -12,-3.4 -12,-2.5 -2,-0.4 2,-0.5 -0.955 20.4-139.1-127.1 141.1 27.4 17.3 67.1 48 88 A A E -BC 34 94A 11 46,-2.9 46,-2.9 -2,-0.4 2,-0.6 -0.899 20.1-160.6 -94.0 125.2 24.2 18.2 65.3 49 89 A L E -BC 33 93A 0 -16,-2.8 -16,-2.7 -2,-0.5 2,-0.7 -0.942 0.5-160.0-109.9 120.3 21.1 18.1 67.5 50 90 A K E -BC 32 92A 8 42,-3.0 42,-2.8 -2,-0.6 2,-0.7 -0.892 0.7-162.0-106.8 110.1 17.8 17.8 65.8 51 91 A H E -BC 31 91A 30 -20,-2.7 -20,-1.9 -2,-0.7 2,-0.3 -0.836 14.3-146.4 -91.9 112.0 14.8 18.8 67.9 52 92 A L E -B 30 0A 5 38,-2.3 38,-0.5 -2,-0.7 -22,-0.3 -0.604 30.1 -96.2 -81.9 141.2 11.7 17.4 66.3 53 93 A I > - 0 0 32 -24,-2.8 3,-2.2 -2,-0.3 -1,-0.1 -0.359 33.3-127.0 -56.4 126.3 8.5 19.4 66.6 54 94 A P T 3 S+ 0 0 9 0, 0.0 -1,-0.2 0, 0.0 301,-0.1 0.395 103.8 71.8 -65.0 6.1 6.6 18.0 69.7 55 95 A T T 3 S+ 0 0 6 -26,-0.1 299,-1.6 2,-0.1 300,-0.6 0.383 71.4 117.4 -97.4 0.5 3.5 17.5 67.5 56 96 A S S < S- 0 0 2 -3,-2.2 297,-0.0 32,-0.2 -4,-0.0 -0.475 73.6-114.5 -66.6 133.8 5.1 14.7 65.6 57 97 A H > - 0 0 54 -2,-0.2 4,-2.3 1,-0.1 3,-0.5 -0.455 24.2-120.3 -64.1 140.9 3.3 11.3 66.0 58 98 A P H > S+ 0 0 1 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.840 115.1 54.9 -53.1 -36.2 5.5 8.8 67.8 59 99 A I H > S+ 0 0 48 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.879 107.6 49.6 -65.9 -38.9 5.4 6.5 64.8 60 100 A R H > S+ 0 0 21 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.919 113.1 46.7 -62.2 -46.8 6.7 9.4 62.6 61 101 A I H X S+ 0 0 4 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.943 115.2 46.9 -57.6 -48.6 9.5 10.0 65.1 62 102 A A H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.881 109.1 53.3 -66.0 -41.3 10.3 6.3 65.3 63 103 A A H X S+ 0 0 1 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.908 108.5 50.5 -61.1 -42.1 10.2 5.8 61.5 64 104 A E H X S+ 0 0 5 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.949 112.3 46.9 -59.5 -49.4 12.8 8.7 61.0 65 105 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.865 110.3 53.3 -57.6 -39.8 15.0 7.1 63.6 66 106 A Q H X S+ 0 0 36 -4,-2.4 4,-3.0 2,-0.2 5,-0.4 0.887 106.8 51.4 -67.3 -39.3 14.6 3.7 62.0 67 107 A C H X>S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 5,-1.3 0.944 113.2 46.3 -56.3 -49.1 15.7 5.1 58.6 68 108 A L H <5S+ 0 0 2 -4,-2.2 4,-0.4 3,-0.2 12,-0.3 0.898 117.5 42.6 -62.4 -43.3 18.8 6.6 60.3 69 109 A T H <5S+ 0 0 50 -4,-2.8 -2,-0.2 10,-0.2 -1,-0.2 0.918 124.4 32.9 -69.5 -45.1 19.6 3.4 62.1 70 110 A V H <5S+ 0 0 61 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.934 136.3 17.1 -82.5 -47.7 19.0 0.9 59.3 71 111 A A T <5S+ 0 0 0 -4,-2.1 3,-0.3 -5,-0.4 -3,-0.2 0.708 108.5 85.9 -98.9 -22.7 19.9 2.8 56.1 72 112 A G < + 0 0 11 -5,-1.3 7,-0.4 -4,-0.4 6,-0.2 -0.100 63.2 52.5 -81.0 173.5 22.1 5.7 57.5 73 113 A G S S+ 0 0 61 4,-1.7 2,-0.3 1,-0.1 -1,-0.2 0.583 100.8 71.2 82.4 14.7 25.8 6.0 58.4 74 114 A Q B > S+F 77 0C 106 3,-0.9 3,-1.3 -3,-0.3 -1,-0.1 -0.990 87.2 17.2-159.2 148.6 26.9 4.7 55.0 75 115 A D T 3 S- 0 0 83 -2,-0.3 52,-0.2 1,-0.3 3,-0.1 0.872 128.9 -51.6 53.6 46.6 27.0 5.8 51.3 76 116 A N T 3 S+ 0 0 37 1,-0.2 78,-3.5 76,-0.1 2,-0.5 0.665 108.3 127.7 65.4 18.8 26.5 9.5 52.0 77 117 A V B < -Fg 74 154C 4 -3,-1.3 -4,-1.7 76,-0.2 -3,-0.9 -0.951 63.9-118.1-106.8 124.4 23.5 8.9 54.1 78 118 A M - 0 0 13 76,-2.4 2,-0.2 -2,-0.5 -4,-0.1 -0.299 31.3-161.7 -57.2 136.8 23.5 10.5 57.5 79 119 A G - 0 0 10 -7,-0.4 2,-0.4 -6,-0.1 -10,-0.2 -0.466 15.4-109.6-109.8-172.7 23.4 8.1 60.5 80 120 A V - 0 0 27 -12,-0.3 14,-0.2 -2,-0.2 3,-0.1 -0.945 17.2-172.6-124.9 140.1 22.5 8.6 64.2 81 121 A K S S- 0 0 37 12,-2.8 311,-0.3 1,-0.4 2,-0.3 0.872 72.1 -30.4 -91.1 -53.8 24.7 8.5 67.3 82 122 A Y E -D 93 0A 50 11,-1.4 11,-3.0 309,-0.1 -1,-0.4 -0.929 51.0-133.5-155.8 178.0 22.0 8.7 69.9 83 123 A C E -D 92 0A 2 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.994 12.6-156.3-146.4 133.0 18.5 10.1 70.7 84 124 A F E -D 91 0A 14 7,-3.1 7,-2.9 -2,-0.3 2,-0.4 -0.916 12.6-174.9-115.5 135.2 17.2 11.9 73.8 85 125 A R E +D 90 0A 60 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.989 21.1 170.8-135.6 127.6 13.6 12.0 74.9 86 126 A K E > S-D 89 0A 90 3,-2.0 3,-2.3 -2,-0.4 2,-0.1 -0.954 73.8 -62.9-121.2 113.4 11.6 13.8 77.6 87 127 A N T 3 S- 0 0 56 -2,-0.4 290,-0.1 1,-0.3 286,-0.0 -0.284 122.3 -4.1 52.2-116.2 7.9 13.2 77.0 88 128 A D T 3 S+ 0 0 15 -2,-0.1 2,-0.7 -3,-0.1 -1,-0.3 0.483 115.7 92.7 -85.6 -4.9 6.9 14.7 73.6 89 129 A H E < + D 0 86A 31 -3,-2.3 -3,-2.0 -79,-0.2 2,-0.4 -0.836 52.5 178.3 -98.1 113.2 10.4 16.3 73.0 90 130 A V E - D 0 85A 1 -2,-0.7 -38,-2.3 -38,-0.5 2,-0.5 -0.952 7.8-170.1-115.7 133.6 12.7 14.1 71.0 91 131 A V E -CD 51 84A 0 -7,-2.9 -7,-3.1 -2,-0.4 2,-0.5 -0.981 9.5-153.1-128.0 118.0 16.2 15.2 70.1 92 132 A I E -CD 50 83A 0 -42,-2.8 -42,-3.0 -2,-0.5 2,-0.6 -0.812 8.9-148.7 -93.8 125.5 18.3 13.2 67.6 93 133 A A E +CD 49 82A 0 -11,-3.0 -12,-2.8 -2,-0.5 -11,-1.4 -0.846 26.1 167.2 -99.2 119.6 22.1 13.5 68.0 94 134 A M E -C 48 0A 17 -46,-2.9 -46,-2.9 -2,-0.6 -14,-0.1 -0.886 42.8 -86.1-128.5 158.0 24.1 13.1 64.7 95 135 A P E -C 47 0A 46 0, 0.0 2,-0.4 0, 0.0 -48,-0.2 -0.399 46.1-122.1 -61.2 139.4 27.6 13.8 63.6 96 136 A Y - 0 0 53 -50,-1.6 2,-0.5 -61,-0.1 -50,-0.1 -0.696 25.0-168.7 -81.1 131.5 28.2 17.4 62.5 97 137 A L - 0 0 26 -2,-0.4 2,-0.2 56,-0.0 48,-0.1 -0.982 20.9-132.5-120.1 119.2 29.5 17.9 59.0 98 138 A E + 0 0 107 -2,-0.5 2,-0.3 46,-0.1 -2,-0.0 -0.500 41.2 175.6 -65.1 136.9 30.7 21.4 58.2 99 139 A H - 0 0 71 -2,-0.2 47,-0.3 47,-0.1 2,-0.1 -0.984 29.2-104.9-153.3 155.8 29.1 22.3 54.9 100 140 A E - 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0 0 0 -4,-1.6 4,-2.1 -5,-0.4 -3,-0.2 0.336 14.0-114.8 98.6 135.5 6.5 21.7 27.7 236 433 A S H > S+ 0 0 2 20,-2.3 4,-2.8 2,-0.2 5,-0.2 0.946 115.2 47.5 -68.2 -48.1 2.7 21.8 28.4 237 434 A R H > S+ 0 0 143 19,-0.5 4,-2.7 1,-0.2 5,-0.2 0.932 113.2 49.2 -58.4 -48.4 1.8 19.1 25.7 238 435 A E H > S+ 0 0 87 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.920 113.5 46.6 -55.1 -46.2 4.5 16.8 27.0 239 436 A T H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.917 112.3 50.0 -64.9 -42.5 3.4 17.3 30.6 240 437 A I H X S+ 0 0 37 -4,-2.8 4,-1.4 2,-0.2 10,-0.2 0.914 112.4 48.0 -61.2 -45.1 -0.4 16.7 29.6 241 438 A Q H X S+ 0 0 103 -4,-2.7 4,-0.9 -5,-0.2 3,-0.4 0.944 113.7 46.3 -61.6 -50.1 0.6 13.5 27.7 242 439 A A H >X S+ 0 0 13 -4,-2.5 3,-0.6 1,-0.2 4,-0.5 0.881 106.6 58.2 -60.6 -40.6 2.7 12.1 30.6 243 440 A A H ><>S+ 0 0 1 -4,-2.4 5,-2.2 1,-0.2 3,-1.2 0.844 97.8 61.8 -61.9 -33.0 0.1 12.9 33.2 244 441 A K H ><5S+ 0 0 101 -4,-1.4 3,-2.0 -3,-0.4 -1,-0.2 0.876 94.8 61.6 -55.3 -41.2 -2.5 10.7 31.4 245 442 A T H <<5S+ 0 0 89 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.674 109.1 42.6 -64.3 -20.0 -0.2 7.7 31.9 246 443 A F T <<5S- 0 0 28 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.072 125.0 -97.9-115.0 24.8 -0.7 8.3 35.7 247 444 A G T < 5S+ 0 0 22 -3,-2.0 74,-2.7 1,-0.2 2,-0.4 0.758 81.0 126.0 77.9 28.3 -4.4 9.0 35.6 248 445 A K E < -J 320 0E 11 -5,-2.2 2,-0.6 72,-0.2 72,-0.2 -0.983 47.0-151.2-123.6 128.7 -4.4 12.8 35.7 249 446 A S E -J 319 0E 41 70,-3.6 70,-2.5 -2,-0.4 2,-0.5 -0.871 16.7-169.7 -96.6 115.5 -6.2 15.0 33.2 250 447 A I E -J 318 0E 4 -2,-0.6 2,-0.4 -10,-0.2 68,-0.2 -0.946 4.9-170.0-109.8 123.4 -4.3 18.4 32.9 251 448 A L E -J 317 0E 97 66,-2.8 66,-2.9 -2,-0.5 2,-0.4 -0.941 5.7-176.5-108.5 132.4 -5.9 21.3 31.0 252 449 A C E -J 316 0E 30 -2,-0.4 64,-0.2 64,-0.2 3,-0.1 -0.998 21.1-155.8-131.4 128.5 -3.8 24.4 30.2 253 450 A S S S+ 0 0 40 62,-2.2 2,-0.6 -2,-0.4 63,-0.1 0.811 85.4 52.9 -72.4 -31.8 -5.1 27.5 28.5 254 451 A K S S- 0 0 95 61,-0.4 2,-0.3 2,-0.0 -1,-0.2 -0.928 77.3-146.8-112.8 114.7 -1.6 28.6 27.2 255 452 A E - 0 0 133 -2,-0.6 -23,-0.0 -19,-0.1 -2,-0.0 -0.611 19.5-175.4 -76.4 132.2 0.4 26.1 25.2 256 453 A V - 0 0 27 -2,-0.3 -20,-2.3 -25,-0.1 -19,-0.5 -0.999 21.7-119.1-132.2 136.5 4.2 26.4 25.8 257 454 A P - 0 0 89 0, 0.0 -22,-0.4 0, 0.0 2,-0.2 -0.282 30.5-100.6 -71.6 156.4 6.9 24.4 23.9 258 455 A A - 0 0 45 -24,-0.3 2,-0.3 -23,-0.1 -24,-0.2 -0.510 42.5-125.8 -67.7 141.7 9.4 22.1 25.6 259 456 A Q - 0 0 55 -26,-3.0 2,-0.4 -2,-0.2 -1,-0.1 -0.747 14.3-114.8 -92.0 142.6 12.8 23.8 26.0 260 457 A D > - 0 0 77 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.638 28.2-144.4 -68.3 125.9 16.1 22.5 24.7 261 458 A L H > S+ 0 0 13 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.865 92.9 50.0 -70.6 -40.9 18.0 21.8 27.9 262 459 A R H > S+ 0 0 57 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.952 114.6 44.1 -59.6 -50.8 21.5 22.8 26.8 263 460 A K H > S+ 0 0 129 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.927 113.7 51.5 -64.5 -45.5 20.4 26.1 25.3 264 461 A L H X S+ 0 0 2 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.929 114.3 42.0 -49.9 -55.2 18.2 26.9 28.4 265 462 A C H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.901 115.2 50.0 -65.4 -43.5 21.1 26.2 30.8 266 463 A E H < S+ 0 0 83 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.910 112.3 46.5 -62.4 -44.8 23.7 28.1 28.7 267 464 A R H < S+ 0 0 158 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.890 115.0 47.4 -67.6 -36.9 21.6 31.2 28.3 268 465 A L H < 0 0 1 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.821 360.0 360.0 -67.2 -30.8 20.8 31.1 32.0 269 466 A R < 0 0 70 -4,-1.9 -3,-0.1 -58,-0.1 -57,-0.1 0.229 360.0 360.0-104.4 360.0 24.5 30.7 33.0 270 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 271 535 A W > 0 0 97 0, 0.0 3,-0.5 0, 0.0 -161,-0.0 0.000 360.0 360.0 360.0 -18.6 32.2 25.0 31.8 272 536 A N T 3 + 0 0 155 1,-0.2 0, 0.0 0, 0.0 0, 0.0 0.670 360.0 29.8 -77.2 -24.7 33.3 25.8 28.2 273 537 A E T 3 S+ 0 0 161 2,-0.0 -1,-0.2 0, 0.0 0, 0.0 -0.438 71.5 177.7-136.7 62.2 32.6 22.3 27.0 274 538 A V < - 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0 0 115 -311,-0.3 2,-0.7 -2,-0.2 -2,-0.1 -0.835 15.4-140.8-100.5 122.4 25.0 3.0 71.9 393 336 B F + 0 0 49 -2,-0.5 -311,-0.1 1,-0.1 -312,-0.0 -0.727 31.1 164.0 -80.5 116.4 25.6 6.0 74.2 394 337 B D + 0 0 54 -2,-0.7 -354,-2.6 2,-0.1 -353,-0.5 0.264 37.8 99.3-122.8 12.3 29.2 7.1 73.6 395 338 B F B S-E 39 0B 0 -356,-0.2 2,-0.4 -355,-0.1 -356,-0.2 -0.580 76.3-107.5 -91.4 159.4 29.3 10.6 75.1 396 339 B V - 0 0 39 -358,-3.0 2,-0.4 -2,-0.2 -358,-0.4 -0.760 33.9-151.0 -83.9 133.0 30.6 11.6 78.5 397 340 B E - 0 0 112 -2,-0.4 2,-0.3 -379,-0.0 -380,-0.2 -0.909 5.2-156.6-111.6 130.2 27.8 12.5 80.9 398 341 B Y 0 0 129 -382,-2.4 0, 0.0 -2,-0.4 0, 0.0 -0.720 360.0 360.0-104.8 157.4 28.2 15.1 83.8 399 342 B E 0 0 147 -2,-0.3 -1,-0.1 0, 0.0 0, 0.0 -0.479 360.0 360.0 -81.2 360.0 26.1 15.2 87.0