==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 23-FEB-11 3QTU . COMPND 2 MOLECULE: CYCLIN-DEPENDENT KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.BETZI,R.ALAM,H.HAN,A.BECKER,E.SCHONBRUNN . 294 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15267.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 62.2 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 . 39 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 21 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 25.2 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 2 1 0 1 0 1 1 0 1 0 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 . 0 1 1 0 0 3 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 . 0 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 1 A M > 0 0 59 0, 0.0 3,-0.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 161.5 133.8 19.8 -49.0 2 2 A E T 3 + 0 0 178 1,-0.2 22,-0.0 3,-0.1 0, 0.0 0.736 360.0 63.0 -74.7 -23.6 134.0 23.5 -49.6 3 3 A N T 3 S+ 0 0 53 21,-0.1 21,-1.7 20,-0.1 22,-0.6 0.447 100.8 65.9 -81.1 -0.5 132.0 23.2 -52.8 4 4 A F E < -A 23 0A 31 -3,-0.9 2,-0.5 19,-0.2 19,-0.2 -0.880 66.9-146.1-125.4 156.7 129.0 21.9 -50.8 5 5 A Q E -A 22 0A 91 17,-1.5 17,-1.2 -2,-0.3 -3,-0.1 -0.914 25.2-132.3-122.3 102.0 126.6 23.4 -48.2 6 6 A K E +A 21 0A 109 -2,-0.5 15,-0.2 15,-0.2 3,-0.1 -0.294 26.4 178.0 -54.1 126.5 125.5 20.8 -45.6 7 7 A V E - 0 0 57 13,-3.2 2,-0.3 1,-0.4 14,-0.2 0.856 62.0 -28.3 -95.1 -55.5 121.7 21.1 -45.3 8 8 A E E -A 20 0A 123 12,-1.2 12,-3.1 0, 0.0 2,-0.5 -0.982 61.1-102.4-158.3 159.3 121.1 18.3 -42.8 9 9 A K E +A 19 0A 132 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.784 37.0 178.4 -88.2 127.4 122.5 15.0 -41.6 10 10 A I E + 0 0 89 8,-3.0 2,-0.2 -2,-0.5 9,-0.2 0.902 53.6 1.3 -91.3 -75.0 120.4 12.2 -43.1 11 11 A G E -A 18 0A 25 7,-0.6 7,-2.9 117,-0.0 -1,-0.3 -0.722 46.2-139.7-120.2 168.5 121.8 8.9 -42.0 12 12 A E + 0 0 64 -2,-0.2 5,-0.2 5,-0.2 3,-0.1 -0.414 40.3 175.7-119.0 50.8 124.6 7.3 -40.0 13 13 A G > - 0 0 24 1,-0.1 3,-1.0 2,-0.1 2,-0.3 0.039 42.0 -82.0 -53.4 166.5 125.5 4.5 -42.4 14 14 A T T 3 S+ 0 0 39 1,-0.2 141,-0.2 142,-0.1 -1,-0.1 -0.564 116.4 16.0 -74.8 136.1 128.4 2.2 -41.7 15 15 A Y T 3 S+ 0 0 36 -2,-0.3 21,-0.9 -3,-0.1 2,-0.3 0.190 132.4 12.3 86.4 -14.6 131.8 3.6 -42.7 16 16 A G E < S- B 0 35A 1 -3,-1.0 2,-0.3 19,-0.2 19,-0.2 -0.995 72.1-101.2-176.3 171.4 130.3 7.1 -43.0 17 17 A V E - B 0 34A 7 17,-1.2 17,-2.3 -2,-0.3 2,-0.5 -0.823 31.2-137.9-107.2 147.9 127.6 9.7 -42.4 18 18 A V E -AB 11 33A 29 -7,-2.9 -8,-3.0 -2,-0.3 -7,-0.6 -0.915 21.2-173.5-111.1 132.1 125.2 10.8 -45.1 19 19 A Y E -AB 9 32A 36 13,-2.9 13,-3.5 -2,-0.5 2,-0.5 -0.896 27.4-128.8-123.0 153.1 124.2 14.4 -45.5 20 20 A K E +AB 8 31A 46 -12,-3.1 -13,-3.2 -2,-0.3 -12,-1.2 -0.851 47.1 168.8 -92.5 132.6 121.7 16.3 -47.7 21 21 A A E -AB 6 30A 0 9,-2.7 9,-2.8 -2,-0.5 2,-0.4 -0.962 33.2-129.1-146.3 163.1 123.8 19.0 -49.3 22 22 A R E -AB 5 29A 93 -17,-1.2 -17,-1.5 -2,-0.3 2,-1.2 -0.946 25.7-122.2-116.9 134.8 123.7 21.7 -52.1 23 23 A N E > -A 4 0A 21 5,-3.0 4,-4.9 -2,-0.4 5,-0.3 -0.627 20.0-154.1 -75.0 100.7 126.3 22.1 -54.8 24 24 A K T 4 S+ 0 0 94 -21,-1.7 -1,-0.2 -2,-1.2 -20,-0.1 0.787 93.6 47.4 -43.9 -32.5 127.3 25.7 -54.1 25 25 A L T 4 S+ 0 0 117 -22,-0.6 -1,-0.2 1,-0.1 -21,-0.1 0.973 129.4 16.8 -76.0 -59.4 128.3 25.8 -57.8 26 26 A T T 4 S- 0 0 92 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.637 90.4-132.4 -91.0 -18.0 125.3 24.3 -59.5 27 27 A G < + 0 0 41 -4,-4.9 2,-0.1 1,-0.3 -3,-0.1 0.534 55.2 148.7 76.9 2.8 122.8 24.6 -56.7 28 28 A E - 0 0 86 -5,-0.3 -5,-3.0 -6,-0.1 2,-0.5 -0.478 47.0-127.3 -71.7 142.9 121.8 21.0 -57.3 29 29 A V E +B 22 0A 65 -7,-0.2 50,-0.8 -2,-0.1 2,-0.3 -0.796 38.3 166.7 -94.9 130.3 120.7 19.1 -54.2 30 30 A V E -BC 21 78A 1 -9,-2.8 -9,-2.7 -2,-0.5 2,-0.5 -0.845 40.7-112.7-136.4 170.0 122.5 15.8 -53.5 31 31 A A E -BC 20 77A 14 46,-2.5 46,-3.2 -2,-0.3 2,-0.5 -0.926 36.7-161.7-103.9 131.8 123.0 13.1 -50.9 32 32 A L E -BC 19 76A 3 -13,-3.5 -13,-2.9 -2,-0.5 2,-0.5 -0.967 7.7-162.4-122.0 122.6 126.7 13.2 -49.8 33 33 A K E -BC 18 75A 13 42,-2.8 42,-2.5 -2,-0.5 2,-0.5 -0.903 6.6-159.7-105.7 129.6 128.4 10.3 -48.0 34 34 A K E -BC 17 74A 55 -17,-2.3 -17,-1.2 -2,-0.5 2,-0.4 -0.929 7.9-166.0-110.8 123.6 131.6 11.1 -46.1 35 35 A I E BC 16 73A 16 38,-3.4 38,-2.5 -2,-0.5 -19,-0.2 -0.921 360.0 360.0-116.2 137.9 134.0 8.3 -45.3 36 36 A R 0 0 128 -21,-0.9 36,-0.2 -2,-0.4 -2,-0.0 -0.144 360.0 360.0 49.0 360.0 137.0 8.2 -42.9 37 ! 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 38 41 A T 0 0 141 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.1 145.2 4.6 -38.9 39 42 A E + 0 0 167 1,-0.1 0, 0.0 2,-0.0 0, 0.0 -0.891 360.0 133.5-157.4-176.0 146.2 4.9 -42.6 40 43 A G - 0 0 64 -2,-0.3 3,-0.2 3,-0.0 -1,-0.1 0.036 63.1-110.5 150.9 -33.1 147.2 3.0 -45.7 41 44 A V - 0 0 88 1,-0.2 2,-2.6 2,-0.1 3,-0.3 0.923 18.0-133.1 73.1 94.8 145.1 4.4 -48.6 42 45 A P > + 0 0 43 0, 0.0 4,-2.9 0, 0.0 5,-0.2 -0.329 43.5 159.1 -74.7 59.7 142.5 1.9 -49.8 43 46 A S H > S+ 0 0 76 -2,-2.6 4,-1.6 -3,-0.2 5,-0.1 0.855 71.4 50.5 -52.1 -40.7 143.4 2.4 -53.5 44 47 A T H > S+ 0 0 76 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.938 112.1 45.6 -64.9 -47.9 141.9 -0.9 -54.5 45 48 A A H > S+ 0 0 1 103,-0.3 4,-2.7 1,-0.2 5,-0.2 0.965 110.8 54.3 -57.9 -53.1 138.6 -0.3 -52.7 46 49 A I H X S+ 0 0 28 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.828 105.4 54.0 -49.9 -38.1 138.5 3.2 -54.2 47 50 A R H X S+ 0 0 171 -4,-1.6 4,-1.2 -5,-0.2 -1,-0.2 0.949 110.2 46.4 -62.4 -49.8 138.9 1.8 -57.7 48 51 A E H >X S+ 0 0 30 -4,-1.9 4,-1.1 -3,-0.2 3,-0.9 0.934 110.6 51.1 -57.0 -54.0 135.9 -0.5 -57.2 49 52 A I H >< S+ 0 0 24 -4,-2.7 3,-1.0 1,-0.3 4,-0.3 0.914 108.5 54.0 -51.5 -45.8 133.7 2.2 -55.7 50 53 A S H >< S+ 0 0 36 -4,-2.2 3,-1.2 1,-0.3 -1,-0.3 0.766 98.6 62.4 -62.0 -28.8 134.6 4.3 -58.7 51 54 A L H X< S+ 0 0 115 -4,-1.2 3,-1.7 -3,-0.9 -1,-0.3 0.823 89.6 70.1 -66.4 -29.4 133.5 1.6 -61.1 52 55 A L G X< S+ 0 0 20 -4,-1.1 3,-1.9 -3,-1.0 11,-0.3 0.677 78.2 80.0 -61.8 -17.7 130.0 1.9 -59.7 53 56 A K G < S+ 0 0 55 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.797 87.2 56.8 -60.9 -28.8 129.7 5.3 -61.4 54 57 A E G < S+ 0 0 136 -3,-1.7 2,-1.3 -4,-0.2 -1,-0.3 0.469 77.3 110.1 -82.5 -0.5 128.9 3.6 -64.7 55 58 A L < + 0 0 16 -3,-1.9 2,-0.6 -4,-0.1 8,-0.3 -0.631 46.3 172.6 -77.3 96.7 126.0 1.8 -63.1 56 59 A N + 0 0 95 -2,-1.3 5,-0.1 6,-0.1 -2,-0.0 -0.912 14.4 129.4-115.1 111.5 123.0 3.5 -64.9 57 60 A H > - 0 0 41 -2,-0.6 3,-2.1 3,-0.4 54,-0.0 -0.982 62.1-117.3-155.9 144.8 119.5 2.2 -64.3 58 61 A P T 3 S+ 0 0 89 0, 0.0 80,-0.1 0, 0.0 4,-0.1 0.696 116.1 48.3 -57.8 -19.0 116.2 3.8 -63.3 59 62 A N T 3 S+ 0 0 6 80,-0.1 81,-2.8 48,-0.1 2,-0.4 0.135 98.0 78.7-110.2 18.6 116.1 1.6 -60.2 60 63 A I B < S-e 140 0B 7 -3,-2.1 -3,-0.4 79,-0.3 2,-0.2 -0.997 86.2-116.3-126.0 128.9 119.7 2.4 -59.0 61 64 A V - 0 0 8 79,-3.1 2,-0.3 -2,-0.4 81,-0.1 -0.473 39.7-114.5 -62.7 126.0 120.5 5.6 -57.2 62 65 A K - 0 0 101 -2,-0.2 16,-2.1 -4,-0.1 2,-0.9 -0.465 17.4-144.3 -69.8 128.0 123.0 7.5 -59.5 63 66 A L E -D 77 0A 9 -8,-0.3 14,-0.2 -11,-0.3 3,-0.1 -0.834 19.4-177.0 -92.2 107.6 126.5 7.9 -58.1 64 67 A L E - 0 0 34 12,-2.4 2,-0.3 -2,-0.9 13,-0.2 0.834 58.2 -4.3 -76.6 -36.7 127.5 11.3 -59.4 65 68 A D E -D 76 0A 86 11,-1.4 11,-3.0 2,-0.0 2,-0.5 -0.988 44.8-151.4-161.1 150.1 131.1 11.5 -58.1 66 69 A V E -D 75 0A 30 -2,-0.3 2,-0.6 9,-0.2 9,-0.2 -0.943 24.6-170.5-125.2 104.8 133.7 9.8 -56.0 67 70 A I E -D 74 0A 40 7,-3.0 7,-2.7 -2,-0.5 2,-0.6 -0.873 9.2-169.2-107.2 116.1 136.1 12.3 -54.5 68 71 A H E +D 73 0A 97 -2,-0.6 2,-0.3 5,-0.2 5,-0.2 -0.886 33.9 129.2 -99.7 118.4 139.3 11.3 -52.7 69 72 A T E > +D 72 0A 51 3,-2.6 3,-0.7 -2,-0.6 -2,-0.1 -0.908 56.4 13.6-171.4 142.0 140.9 14.2 -50.8 70 73 A E T 3 S- 0 0 142 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.894 124.9 -60.4 58.4 44.1 142.2 15.2 -47.4 71 74 A N T 3 S+ 0 0 126 1,-0.2 2,-0.3 -3,-0.0 -1,-0.2 0.827 119.2 106.4 54.2 33.5 142.3 11.6 -46.2 72 75 A K E < - D 0 69A 57 -3,-0.7 -3,-2.6 -36,-0.2 2,-0.5 -0.976 61.1-144.6-139.8 149.6 138.5 11.5 -46.7 73 76 A L E -CD 35 68A 14 -38,-2.5 -38,-3.4 -2,-0.3 2,-0.5 -0.981 15.1-166.7-119.9 126.0 136.4 9.8 -49.3 74 77 A Y E -CD 34 67A 16 -7,-2.7 -7,-3.0 -2,-0.5 2,-0.5 -0.944 5.2-165.6-115.1 129.8 133.2 11.6 -50.6 75 78 A L E -CD 33 66A 7 -42,-2.5 -42,-2.8 -2,-0.5 2,-0.6 -0.966 9.4-156.7-113.8 123.6 130.5 9.9 -52.6 76 79 A V E -CD 32 65A 5 -11,-3.0 -12,-2.4 -2,-0.5 -11,-1.4 -0.901 16.5-179.6-105.8 119.0 128.0 12.2 -54.2 77 80 A F E -CD 31 63A 23 -46,-3.2 -46,-2.5 -2,-0.6 -14,-0.2 -0.826 36.7 -99.3-117.1 156.6 124.6 10.7 -55.1 78 81 A E E -C 30 0A 56 -16,-2.1 2,-0.3 -2,-0.3 -48,-0.2 -0.480 52.1-115.5 -66.8 141.6 121.5 12.0 -56.7 79 82 A F - 0 0 37 -50,-0.8 2,-0.3 -2,-0.1 -1,-0.1 -0.644 30.5-173.1 -88.9 137.2 119.1 12.9 -53.9 80 83 A L - 0 0 16 -2,-0.3 53,-0.1 53,-0.1 3,-0.0 -0.921 25.8-127.6-121.3 151.7 115.8 11.2 -53.2 81 84 A H S S+ 0 0 103 51,-0.3 2,-0.3 -2,-0.3 52,-0.1 0.625 77.6 14.7 -81.2 -14.0 113.3 12.4 -50.6 82 85 A Q E -F 132 0B 12 50,-1.1 50,-2.9 4,-0.0 2,-0.2 -0.995 61.7-134.7-156.7 151.1 112.5 9.4 -48.4 83 86 A D E > -F 131 0B 38 -2,-0.3 4,-2.0 48,-0.2 48,-0.3 -0.673 32.4-110.8-103.7 166.2 113.7 5.9 -47.7 84 87 A L H > S+ 0 0 0 46,-2.7 4,-2.9 43,-1.1 5,-0.2 0.778 113.8 63.1 -65.2 -27.4 111.6 2.8 -47.4 85 88 A K H > S+ 0 0 80 42,-0.8 4,-2.2 45,-0.3 -1,-0.2 0.942 108.0 41.2 -62.3 -47.5 112.2 2.5 -43.6 86 89 A K H > S+ 0 0 117 -3,-0.2 4,-3.0 2,-0.2 5,-0.2 0.918 114.9 51.7 -66.1 -43.8 110.5 5.9 -43.0 87 90 A F H X S+ 0 0 11 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.916 110.7 47.9 -60.6 -44.4 107.7 5.1 -45.5 88 91 A M H < S+ 0 0 19 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.922 112.6 49.0 -63.2 -41.3 107.1 1.7 -43.8 89 92 A D H >< S+ 0 0 100 -4,-2.2 3,-1.3 1,-0.2 4,-0.2 0.927 111.9 48.9 -63.4 -42.1 107.0 3.4 -40.4 90 93 A A H 3< S+ 0 0 75 -4,-3.0 3,-0.3 1,-0.3 -1,-0.2 0.748 113.8 47.2 -68.1 -23.1 104.6 6.0 -41.7 91 94 A S T 3X S+ 0 0 15 -4,-1.5 4,-4.0 -5,-0.2 -1,-0.3 0.282 80.0 108.0-101.6 11.0 102.4 3.3 -43.2 92 95 A A T <4 S+ 0 0 48 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.1 0.795 78.1 48.1 -58.8 -33.9 102.4 1.2 -40.0 93 96 A L T 4 S+ 0 0 168 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.880 129.8 19.4 -76.8 -37.1 98.8 1.9 -39.1 94 97 A T T 4 S- 0 0 110 -4,-0.2 -2,-0.2 -3,-0.1 -1,-0.1 0.719 100.9-132.7-104.2 -29.0 97.4 1.3 -42.5 95 98 A G < - 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0 0 69 -28,-2.5 2,-0.2 -2,-0.1 -1,-0.1 -0.498 31.3 -92.3 -86.0 158.7 106.9 -23.8 -39.9 244 247 A D > - 0 0 90 -2,-0.2 3,-1.0 1,-0.1 4,-0.5 -0.503 32.4-136.9 -67.9 137.2 104.0 -23.7 -42.2 245 248 A F G >> S+ 0 0 34 1,-0.2 3,-1.4 2,-0.2 4,-1.2 0.817 97.1 71.0 -67.9 -32.6 104.4 -20.7 -44.6 246 249 A S G 34 S+ 0 0 64 1,-0.3 -1,-0.2 2,-0.2 6,-0.1 0.710 98.6 53.6 -56.5 -19.7 100.8 -19.5 -44.4 247 250 A K G <4 S+ 0 0 132 -3,-1.0 -1,-0.3 2,-0.1 -2,-0.2 0.739 101.4 61.3 -85.6 -27.1 101.7 -18.5 -40.9 248 251 A V T <4 S+ 0 0 24 -3,-1.4 -2,-0.2 -4,-0.5 -1,-0.1 0.918 118.5 14.2 -69.3 -50.7 104.8 -16.5 -42.0 249 252 A V S >< S- 0 0 0 -4,-1.2 3,-2.8 3,-0.1 -1,-0.2 -0.291 85.9-162.8-125.6 52.2 103.2 -13.8 -44.3 250 253 A P T 3 S+ 0 0 72 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.541 71.1 21.1 -71.7 146.6 99.5 -13.7 -43.8 251 254 A P T 3 S+ 0 0 121 0, 0.0 -4,-0.0 0, 0.0 -5,-0.0 -0.747 88.0 121.7-102.9 36.1 97.5 -12.4 -45.6 252 255 A L < - 0 0 11 -3,-2.8 -3,-0.1 1,-0.1 5,-0.0 -0.312 65.9-113.8 -56.2 138.3 99.8 -12.5 -48.7 253 256 A D > - 0 0 56 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.154 29.5 -97.9 -69.4 170.1 98.1 -14.5 -51.5 254 257 A E H > S+ 0 0 115 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.809 123.1 55.0 -61.8 -34.6 99.5 -17.8 -52.8 255 258 A D H > S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 27,-0.3 0.928 112.3 45.0 -64.1 -44.1 101.4 -16.3 -55.7 256 259 A G H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.915 114.2 47.4 -64.9 -43.8 103.1 -14.0 -53.3 257 260 A R H X S+ 0 0 59 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.881 110.9 53.2 -64.6 -38.4 103.9 -16.8 -50.8 258 261 A S H X S+ 0 0 41 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.921 111.2 45.3 -61.3 -47.2 105.2 -18.9 -53.6 259 262 A L H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 3,-0.3 0.933 112.4 51.2 -64.4 -44.3 107.5 -16.2 -54.8 260 263 A L H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 3,-0.3 0.922 105.8 55.3 -60.7 -41.3 108.7 -15.5 -51.3 261 264 A S H < S+ 0 0 31 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.861 108.1 48.9 -61.4 -33.7 109.5 -19.1 -50.6 262 265 A Q H >< S+ 0 0 65 -4,-1.4 10,-2.2 -3,-0.3 3,-0.7 0.795 108.9 52.6 -76.1 -27.1 111.7 -19.2 -53.7 263 266 A M H 3< S+ 0 0 0 -4,-1.6 -76,-0.2 -3,-0.3 -1,-0.2 0.695 111.5 49.3 -77.1 -19.0 113.5 -16.0 -52.6 264 267 A L T 3< S+ 0 0 2 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.123 74.3 137.2-109.4 21.8 114.1 -17.7 -49.2 265 268 A H < - 0 0 69 -3,-0.7 6,-0.2 1,-0.1 -3,-0.1 -0.430 52.9-137.0 -65.7 139.9 115.5 -21.1 -50.3 266 269 A Y S S+ 0 0 15 -50,-0.1 -97,-0.2 -2,-0.1 -1,-0.1 0.938 86.1 76.7 -63.7 -49.3 118.5 -22.0 -48.1 267 270 A D S >> S- 0 0 16 -44,-0.5 3,-2.2 1,-0.2 4,-1.9 -0.545 74.5-147.9 -69.8 115.8 120.6 -23.3 -50.9 268 271 A P T 34 S+ 0 0 28 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.803 100.0 55.5 -51.5 -33.0 122.1 -20.3 -52.8 269 272 A N T 34 S+ 0 0 149 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.669 110.8 42.8 -76.1 -18.3 121.9 -22.4 -56.0 270 273 A K T <4 S+ 0 0 96 -3,-2.2 -1,-0.2 2,-0.1 3,-0.1 0.671 88.9 105.9 -99.2 -20.7 118.2 -23.1 -55.5 271 274 A R S < S- 0 0 13 -4,-1.9 -8,-0.2 -6,-0.2 -9,-0.1 -0.329 83.1-102.6 -59.9 137.2 117.3 -19.5 -54.5 272 275 A I - 0 0 21 -10,-2.2 2,-0.1 -13,-0.2 -1,-0.1 -0.272 32.0-125.2 -65.2 145.9 115.5 -17.8 -57.4 273 276 A S > - 0 0 62 1,-0.1 4,-2.1 -3,-0.1 5,-0.2 -0.451 22.2-113.3 -84.4 164.1 117.4 -15.2 -59.5 274 277 A A H > S+ 0 0 4 2,-0.2 4,-1.9 1,-0.2 -161,-0.2 0.934 117.9 53.2 -63.7 -43.1 116.2 -11.7 -60.0 275 278 A K H > S+ 0 0 173 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.924 112.2 43.3 -57.4 -47.1 115.6 -12.4 -63.7 276 279 A A H >4 S+ 0 0 46 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.848 109.2 57.8 -69.2 -33.4 113.5 -15.4 -63.0 277 280 A A H >< S+ 0 0 0 -4,-2.1 3,-1.6 1,-0.2 -1,-0.2 0.867 97.5 61.8 -65.2 -34.6 111.6 -13.7 -60.2 278 281 A L H 3< S+ 0 0 41 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.795 104.0 50.2 -61.8 -25.9 110.5 -11.0 -62.6 279 282 A A T << S+ 0 0 81 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.459 82.5 121.8 -91.2 -1.9 108.7 -13.7 -64.6 280 283 A H S X S- 0 0 17 -3,-1.6 3,-2.1 -4,-0.3 4,-0.1 -0.276 74.6-118.7 -61.5 143.8 106.9 -15.1 -61.5 281 284 A P G > S+ 0 0 69 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.680 105.9 80.8 -60.3 -13.6 103.1 -15.1 -61.9 282 285 A F G 3 S+ 0 0 0 -27,-0.3 3,-0.5 1,-0.3 -26,-0.1 0.839 92.5 51.2 -60.0 -28.1 102.9 -12.8 -58.8 283 286 A F G X S+ 0 0 11 -3,-2.1 3,-1.7 -6,-0.2 -1,-0.3 0.332 75.0 107.4 -93.7 9.0 103.7 -10.0 -61.2 284 287 A Q T < S+ 0 0 173 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.876 91.8 30.1 -51.2 -43.3 101.0 -10.8 -63.8 285 288 A D T 3 S+ 0 0 104 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 0.014 86.7 149.0-109.6 27.4 98.9 -7.8 -62.7 286 289 A V < + 0 0 41 -3,-1.7 2,-0.2 -184,-0.1 -186,-0.1 -0.350 16.5 170.5 -65.7 140.8 101.7 -5.4 -61.6 287 290 A T - 0 0 81 -188,-0.4 -2,-0.0 -2,-0.1 -1,-0.0 -0.735 37.7-109.2-135.2-177.9 101.1 -1.7 -62.1 288 291 A K - 0 0 129 -2,-0.2 -188,-0.1 -185,-0.0 -151,-0.1 -0.687 37.0-175.8-124.6 81.0 102.9 1.5 -61.0 289 292 A P - 0 0 35 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.278 26.6-119.8 -69.7 159.5 100.8 3.3 -58.3 290 293 A V - 0 0 111 -154,-0.0 -155,-0.1 3,-0.0 2,-0.1 -0.865 29.9-129.4-100.1 132.3 101.9 6.7 -56.9 291 294 A P - 0 0 14 0, 0.0 2,-1.0 0, 0.0 -155,-0.1 -0.441 13.4-118.2 -81.4 159.6 102.6 6.7 -53.2 292 295 A H - 0 0 174 -2,-0.1 2,-0.5 2,-0.0 -158,-0.0 -0.832 43.1-173.5 -93.6 102.8 101.2 9.2 -50.7 293 296 A L - 0 0 26 -2,-1.0 2,-0.7 -159,-0.1 -159,-0.0 -0.878 20.7-157.6-106.9 130.0 104.4 10.7 -49.5 294 297 A R 0 0 217 -2,-0.5 -2,-0.0 1,-0.2 -204,-0.0 -0.911 360.0 360.0-103.6 109.7 104.6 13.2 -46.6 295 298 A L 0 0 134 -2,-0.7 -1,-0.2 -213,-0.0 0, 0.0 0.827 360.0 360.0-104.1 360.0 107.8 15.2 -47.0