==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-NOV-07 3BHH . COMPND 2 MOLECULE: CALCIUM/CALMODULIN-DEPENDENT PROTEIN KINASE TYPE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.FILIPPAKOPOULOS,P.RELLOS,F.NIESEN,N.BURGESS,A.BULLOCK,G.BE . 1149 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48905.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 765 66.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 157 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 76 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 125 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 358 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.1 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 17 4 0 0 0 0 8 0 0 0 4 0 8 0 0 0 4 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 . 7 5 4 3 7 2 4 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 . 4 0 4 4 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 9 A S >> 0 0 73 0, 0.0 4,-2.2 0, 0.0 3,-2.2 0.000 360.0 360.0 360.0 -80.4 34.6 72.2 49.6 2 10 A M H 3> + 0 0 3 1,-0.3 4,-1.5 2,-0.2 69,-0.0 0.786 360.0 55.3 -51.7 -33.0 31.9 71.4 47.0 3 11 A T H 34 S+ 0 0 90 1,-0.2 -1,-0.3 2,-0.2 5,-0.1 0.394 117.1 36.2 -79.2 -2.3 29.4 72.6 49.7 4 12 A D H <4 S+ 0 0 74 -3,-2.2 -2,-0.2 3,-0.0 -1,-0.2 0.492 121.1 43.8-121.6 -17.7 31.4 75.9 49.8 5 13 A E H < S+ 0 0 100 -4,-2.2 18,-1.8 18,-0.1 19,-0.5 0.668 115.9 40.1-101.1 -25.2 32.3 76.3 46.1 6 14 A Y E < -A 22 0A 11 -4,-1.5 2,-0.4 -5,-0.3 16,-0.2 -0.797 63.8-143.0-117.7 160.5 28.8 75.3 44.5 7 15 A Q E -A 21 0A 94 14,-1.9 14,-2.1 -2,-0.3 2,-0.3 -0.999 22.6-141.5-120.0 130.2 25.1 76.0 45.2 8 16 A L E +A 20 0A 42 -2,-0.4 12,-0.2 12,-0.2 2,-0.1 -0.661 25.5 167.1 -91.8 140.3 22.8 73.1 44.5 9 17 A Y E - 0 0 94 10,-3.3 -1,-0.1 -2,-0.3 11,-0.0 -0.227 44.5 -12.8-126.1-142.5 19.3 73.6 43.0 10 18 A E E - 0 0 100 8,-0.2 9,-2.9 -2,-0.1 -1,-0.3 -0.207 68.8 -96.8 -75.3 154.0 16.7 71.1 41.4 11 19 A D E -A 18 0A 70 7,-0.3 7,-0.3 -3,-0.1 -1,-0.1 -0.478 44.7-144.4 -66.3 130.6 17.1 67.5 40.4 12 20 A I 0 0 41 5,-4.0 5,-0.2 -2,-0.2 -1,-0.1 -0.384 360.0 360.0 -99.4 166.3 17.7 67.2 36.6 13 21 A G 0 0 124 -2,-0.1 -1,-0.2 117,-0.0 -2,-0.0 0.981 360.0 360.0 54.4 360.0 16.7 64.6 33.9 14 ! 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 15 26 A S 0 0 92 0, 0.0 19,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 164.3 22.1 58.8 41.9 16 27 A V E - B 0 33A 80 17,-0.8 17,-2.3 -5,-0.0 2,-0.4 -0.464 360.0-154.9 -67.0 150.1 20.3 62.2 42.2 17 28 A V E - B 0 32A 46 -5,-0.2 -5,-4.0 15,-0.2 2,-0.4 -0.956 16.0-174.9-130.8 114.6 21.5 64.7 39.5 18 29 A R E -AB 11 31A 90 13,-2.4 13,-3.1 -2,-0.4 2,-0.3 -0.875 27.3-121.2-114.0 139.5 21.1 68.3 40.6 19 30 A R E + B 0 30A 56 -9,-2.9 -10,-3.3 -2,-0.4 2,-0.3 -0.584 42.2 178.0 -70.6 137.6 21.6 71.5 38.7 20 31 A C E -AB 8 29A 0 9,-2.3 9,-2.6 -2,-0.3 2,-0.4 -0.904 25.2-135.7-136.4 165.9 24.2 73.6 40.5 21 32 A V E -AB 7 28A 25 -14,-2.1 -14,-1.9 -2,-0.3 2,-0.8 -0.999 19.0-130.4-124.9 131.6 26.1 76.9 40.1 22 33 A K E >> -A 6 0A 18 5,-2.8 4,-3.2 -2,-0.4 3,-0.6 -0.753 22.9-150.1 -76.8 111.2 29.8 77.4 40.7 23 34 A L T 34 S+ 0 0 104 -18,-1.8 -1,-0.2 -2,-0.8 -17,-0.1 0.884 87.0 50.5 -53.3 -52.2 29.8 80.4 43.0 24 35 A C T 34 S+ 0 0 114 -19,-0.5 -1,-0.2 1,-0.2 -18,-0.1 0.829 125.7 26.1 -62.4 -31.8 33.2 82.0 42.0 25 36 A T T <4 S- 0 0 72 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.700 94.2-133.9-102.1 -25.4 32.5 81.9 38.2 26 37 A G < + 0 0 47 -4,-3.2 -3,-0.1 1,-0.3 2,-0.1 0.340 56.9 137.2 86.4 -2.9 28.7 82.0 38.1 27 38 A H - 0 0 117 -5,-0.4 -5,-2.8 -6,-0.1 -1,-0.3 -0.478 51.2-118.1 -86.3 152.2 28.4 79.2 35.6 28 39 A E E +B 21 0A 99 -7,-0.2 53,-0.9 -2,-0.1 2,-0.3 -0.530 33.0 173.7 -90.4 148.4 25.9 76.3 35.7 29 40 A Y E -BC 20 80A 23 -9,-2.6 -9,-2.3 51,-0.2 2,-0.5 -0.879 31.9-120.7-143.4 174.1 26.6 72.6 36.0 30 41 A A E -BC 19 79A 14 49,-3.1 49,-3.1 -2,-0.3 2,-0.5 -0.977 28.2-161.7-122.1 113.1 25.0 69.2 36.5 31 42 A A E -BC 18 78A 0 -13,-3.1 -13,-2.4 -2,-0.5 2,-0.6 -0.878 9.5-152.5-104.7 121.4 26.2 67.3 39.6 32 43 A K E -BC 17 77A 22 45,-2.5 45,-1.9 -2,-0.5 2,-0.6 -0.849 19.1-152.7 -85.5 118.3 25.7 63.5 40.0 33 44 A I E -BC 16 76A 21 -17,-2.3 -17,-0.8 -2,-0.6 2,-0.6 -0.862 11.5-169.8-104.4 114.2 25.5 63.0 43.7 34 45 A I E - C 0 75A 24 41,-2.8 41,-2.6 -2,-0.6 2,-0.5 -0.950 17.2-142.1-111.9 117.3 26.6 59.5 44.9 35 46 A N E + C 0 74A 98 -2,-0.6 39,-0.3 39,-0.2 38,-0.0 -0.683 24.5 174.3 -72.0 121.8 26.0 58.4 48.5 36 47 A T > + 0 0 24 37,-3.9 3,-0.8 -2,-0.5 38,-0.2 0.286 45.1 102.6-118.7 7.7 29.1 56.4 49.4 37 48 A K T 3 S+ 0 0 81 36,-0.8 -1,-0.1 1,-0.2 37,-0.1 0.969 95.7 23.8 -58.4 -56.4 28.6 55.6 53.1 38 49 A K T 3 S+ 0 0 104 35,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.120 88.0 146.6-103.0 25.6 27.5 52.0 52.8 39 50 A L < - 0 0 46 -3,-0.8 5,-0.1 1,-0.1 -3,-0.1 -0.431 44.2-131.5 -72.4 123.2 29.1 51.2 49.4 40 51 A S > - 0 0 58 -2,-0.3 4,-1.8 1,-0.1 3,-0.3 -0.182 28.9-105.9 -61.5 161.1 30.4 47.6 48.9 41 52 A A H > S+ 0 0 80 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.878 121.8 56.5 -60.7 -42.3 33.9 47.2 47.5 42 53 A R H > S+ 0 0 58 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.894 108.1 47.3 -52.6 -45.1 32.5 46.2 44.2 43 54 A D H > S+ 0 0 61 -3,-0.3 4,-1.4 1,-0.2 -2,-0.2 0.780 105.1 57.5 -77.5 -30.2 30.5 49.5 44.0 44 55 A H H X S+ 0 0 86 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.907 108.2 49.1 -58.9 -42.1 33.5 51.7 45.0 45 56 A Q H X S+ 0 0 88 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.842 109.1 53.3 -64.9 -35.7 35.3 50.2 41.9 46 57 A K H X S+ 0 0 89 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.808 112.2 43.8 -65.2 -35.7 32.3 50.9 39.7 47 58 A L H X S+ 0 0 18 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.881 111.9 50.7 -83.5 -42.8 32.3 54.5 40.8 48 59 A E H X S+ 0 0 52 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.904 113.0 50.9 -51.2 -44.8 36.0 55.0 40.5 49 60 A R H X S+ 0 0 44 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.870 107.8 49.1 -64.8 -44.3 35.6 53.5 37.0 50 61 A E H X S+ 0 0 13 -4,-1.6 4,-3.1 2,-0.2 -1,-0.2 0.892 112.6 49.0 -63.4 -40.6 32.8 55.8 36.0 51 62 A A H X S+ 0 0 15 -4,-2.2 4,-1.1 2,-0.2 -1,-0.2 0.821 113.2 47.4 -61.3 -41.3 34.8 58.8 37.1 52 63 A R H X S+ 0 0 123 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.872 113.4 47.9 -69.3 -44.0 37.8 57.5 35.2 53 64 A I H X S+ 0 0 0 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.972 110.9 50.6 -60.7 -56.4 35.7 56.8 32.1 54 65 A C H < S+ 0 0 10 -4,-3.1 11,-0.7 1,-0.2 -1,-0.2 0.754 111.0 49.2 -55.0 -30.3 34.1 60.3 32.2 55 66 A R H < S+ 0 0 59 -4,-1.1 -1,-0.2 1,-0.1 -2,-0.2 0.935 110.6 51.3 -71.2 -47.4 37.6 62.0 32.5 56 67 A L H < S+ 0 0 74 -4,-2.0 2,-1.1 1,-0.1 -2,-0.2 0.750 95.0 78.0 -55.8 -33.6 38.9 60.0 29.5 57 68 A L < + 0 0 3 -4,-1.6 2,-0.5 -5,-0.1 8,-0.3 -0.714 49.8 161.8 -95.5 97.0 36.1 60.8 27.1 58 69 A K + 0 0 113 -2,-1.1 2,-0.3 6,-0.1 5,-0.1 -0.951 22.3 138.2-114.0 112.8 36.4 64.4 25.7 59 70 A H > - 0 0 55 -2,-0.5 3,-1.9 3,-0.4 53,-0.1 -0.994 62.8-114.3-158.6 146.3 34.2 64.7 22.5 60 71 A S T 3 S+ 0 0 80 -2,-0.3 81,-0.1 1,-0.3 4,-0.1 0.648 116.8 41.6 -55.8 -20.1 31.9 67.2 20.8 61 72 A N T 3 S+ 0 0 15 82,-0.1 83,-2.1 47,-0.1 2,-0.4 -0.051 99.7 79.1-128.2 25.0 29.0 64.8 21.3 62 73 A I B < S-e 144 0B 6 -3,-1.9 -3,-0.4 81,-0.3 83,-0.2 -0.997 87.5-107.8-133.3 135.0 29.5 63.5 24.8 63 74 A V - 0 0 21 81,-2.6 2,-0.3 -2,-0.4 -6,-0.1 -0.448 43.6-125.8 -63.4 129.5 28.6 65.5 28.0 64 75 A R - 0 0 44 -2,-0.2 16,-2.8 -4,-0.1 2,-0.3 -0.616 7.8-127.3 -91.0 133.8 31.9 66.7 29.5 65 76 A L E -D 79 0A 28 -11,-0.7 14,-0.3 -2,-0.3 3,-0.1 -0.602 20.6-175.4 -73.5 130.2 33.0 66.1 33.1 66 77 A H E - 0 0 76 12,-3.7 2,-0.3 1,-0.4 13,-0.2 0.875 63.9 -18.7 -92.9 -49.5 34.1 69.3 34.8 67 78 A D E -D 78 0A 77 11,-1.7 11,-2.1 2,-0.0 2,-0.4 -0.944 46.9-139.4-150.2 171.2 35.3 67.9 38.1 68 79 A S E -D 77 0A 44 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.938 25.6-172.1-138.3 114.2 35.2 64.9 40.4 69 80 A I E -D 76 0A 19 7,-3.0 7,-2.3 -2,-0.4 2,-0.4 -0.927 9.0-161.7-121.3 111.4 34.9 65.7 44.1 70 81 A S E +D 75 0A 95 -2,-0.5 2,-0.2 5,-0.2 5,-0.2 -0.765 21.5 161.6 -88.5 131.7 35.1 63.2 46.9 71 82 A E - 0 0 53 3,-2.6 2,-0.6 -2,-0.4 3,-0.0 -0.801 51.6 -64.3-134.6 179.3 33.8 64.2 50.3 72 83 A E S S- 0 0 104 -2,-0.2 -35,-0.1 1,-0.2 3,-0.1 -0.598 121.1 -7.3 -74.5 113.6 32.7 62.4 53.6 73 84 A G S S+ 0 0 25 -2,-0.6 -37,-3.9 -37,-0.1 -36,-0.8 -0.023 128.4 66.3 94.2 -29.9 29.6 60.3 52.6 74 85 A F E -C 35 0A 78 -39,-0.3 -3,-2.6 -38,-0.2 2,-0.4 -0.940 54.8-160.9-132.9 147.2 29.3 61.7 49.1 75 86 A H E -CD 34 70A 23 -41,-2.6 -41,-2.8 -2,-0.3 2,-0.5 -0.936 15.7-155.4-118.1 145.3 31.0 61.8 45.7 76 87 A Y E -CD 33 69A 27 -7,-2.3 -7,-3.0 -2,-0.4 2,-0.7 -0.979 11.0-166.8-126.2 121.7 30.2 64.4 43.1 77 88 A L E -CD 32 68A 0 -45,-1.9 -45,-2.5 -2,-0.5 2,-0.6 -0.930 19.6-158.1 -98.0 108.6 30.7 64.0 39.4 78 89 A V E -CD 31 67A 0 -11,-2.1 -12,-3.7 -2,-0.7 -11,-1.7 -0.806 14.3-178.1 -94.4 118.2 30.3 67.6 38.1 79 90 A F E -CD 30 65A 27 -49,-3.1 -49,-3.1 -2,-0.6 -14,-0.2 -0.824 35.2 -91.6-112.0 155.1 29.4 67.8 34.4 80 91 A D E -C 29 0A 63 -16,-2.8 2,-0.4 -2,-0.3 -51,-0.2 -0.355 46.3-115.7 -54.0 135.6 28.8 70.7 32.0 81 92 A L - 0 0 43 -53,-0.9 2,-0.4 -61,-0.1 -53,-0.1 -0.700 27.1-166.3 -79.6 132.4 25.1 71.7 31.9 82 93 A V - 0 0 30 -2,-0.4 53,-0.2 1,-0.1 52,-0.2 -0.918 2.0-169.5-119.2 139.3 23.5 71.1 28.5 83 94 A T + 0 0 90 51,-2.2 52,-0.3 -2,-0.4 51,-0.2 0.412 59.2 88.8-126.3 2.5 20.2 72.9 28.3 84 95 A G S S- 0 0 16 49,-2.2 50,-0.2 1,-0.2 51,-0.1 0.459 80.3-140.1 -84.1 -7.0 18.4 71.8 25.1 85 96 A G E -F 133 0B 38 48,-0.5 48,-3.0 -3,-0.1 -1,-0.2 -0.176 47.1 -17.3 80.7-172.0 16.6 68.8 26.8 86 97 A E E > -F 132 0B 72 46,-0.2 4,-1.1 1,-0.1 3,-0.5 -0.488 58.0-129.7 -70.5 142.2 16.0 65.3 25.4 87 98 A L H > S+ 0 0 0 44,-2.3 4,-1.9 41,-0.4 3,-0.3 0.857 106.5 53.7 -53.6 -45.3 16.3 64.9 21.6 88 99 A F H > S+ 0 0 1 43,-0.3 4,-1.0 40,-0.3 -1,-0.2 0.760 106.2 52.1 -68.9 -29.6 12.9 63.1 21.3 89 100 A E H 4 S+ 0 0 106 -3,-0.5 4,-0.3 2,-0.2 -1,-0.2 0.737 110.9 48.7 -76.9 -25.1 11.1 65.9 23.1 90 101 A D H >< S+ 0 0 54 -4,-1.1 3,-0.7 -3,-0.3 4,-0.2 0.836 105.4 57.8 -76.7 -39.9 12.7 68.5 20.6 91 102 A I H >< S+ 0 0 0 -4,-1.9 3,-1.2 1,-0.2 -2,-0.2 0.856 102.2 53.9 -60.6 -40.4 11.8 66.5 17.5 92 103 A V T 3< S+ 0 0 33 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.721 105.7 55.8 -68.1 -17.6 8.1 66.5 18.4 93 104 A A T < S+ 0 0 83 -3,-0.7 -1,-0.2 -4,-0.3 2,-0.2 0.444 88.6 103.3 -93.5 -1.7 8.3 70.4 18.6 94 105 A R < - 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0 0 25 -2,-0.3 4,-1.7 1,-0.1 3,-0.3 -0.207 16.4-124.8 -62.4 151.3 83.9 43.0 38.8 1098 243 D P H > S+ 0 0 93 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.800 110.0 62.3 -63.3 -27.6 83.4 40.9 42.0 1099 244 D E H > S+ 0 0 79 2,-0.2 4,-1.5 34,-0.2 27,-0.2 0.803 103.7 47.1 -70.0 -35.4 80.0 42.5 42.4 1100 245 D A H > S+ 0 0 0 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.922 113.1 48.4 -65.6 -51.2 78.8 41.1 39.1 1101 246 D K H X S+ 0 0 44 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.847 108.5 56.4 -55.4 -39.3 80.1 37.6 40.0 1102 247 D N H X S+ 0 0 80 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.913 108.4 46.4 -56.2 -46.9 78.4 38.1 43.5 1103 248 D L H X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 3,-0.3 0.883 110.2 51.4 -66.5 -44.0 75.0 38.6 41.8 1104 249 D I H X S+ 0 0 0 -4,-2.2 4,-3.1 1,-0.2 3,-0.3 0.922 108.8 54.1 -56.5 -45.9 75.4 35.6 39.4 1105 250 D N H < S+ 0 0 69 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.777 107.6 48.6 -56.6 -35.2 76.2 33.5 42.4 1106 251 D Q H < S+ 0 0 70 -4,-1.1 10,-1.8 -3,-0.3 3,-0.4 0.774 116.2 42.8 -79.7 -28.9 73.0 34.6 44.2 1107 252 D M H < S+ 0 0 0 -4,-1.6 -2,-0.2 -3,-0.3 2,-0.2 0.868 111.5 53.4 -81.2 -44.0 70.9 33.8 41.2 1108 253 D L S < S+ 0 0 5 -4,-3.1 2,-0.4 -5,-0.2 -1,-0.2 -0.156 78.1 135.0 -86.9 37.3 72.6 30.5 40.3 1109 254 D T - 0 0 40 -3,-0.4 6,-0.1 -2,-0.2 -25,-0.1 -0.753 52.5-144.4 -82.4 130.6 72.1 29.2 43.8 1110 255 D I S S+ 0 0 55 -2,-0.4 -71,-0.2 -27,-0.1 -1,-0.1 0.866 83.7 73.1 -68.0 -43.8 70.8 25.6 43.7 1111 256 D N S >> S- 0 0 83 1,-0.2 3,-1.5 -73,-0.1 4,-1.0 -0.701 72.3-156.2 -78.1 109.2 68.5 25.8 46.8 1112 257 D P T 34 S+ 0 0 26 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.605 89.5 60.8 -64.6 -18.4 65.5 27.9 45.5 1113 258 D A T 34 S+ 0 0 90 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.742 110.4 41.6 -76.7 -26.9 64.6 29.0 49.0 1114 259 D K T <4 S+ 0 0 85 -3,-1.5 -1,-0.2 2,-0.1 -4,-0.1 0.586 93.1 110.8 -94.0 -15.6 68.0 30.6 49.4 1115 260 D R S < S- 0 0 12 -4,-1.0 -8,-0.2 -6,-0.1 -9,-0.1 -0.308 77.6-103.1 -60.4 146.4 68.0 32.0 45.8 1116 261 D I - 0 0 15 -10,-1.8 2,-0.2 -13,-0.1 -1,-0.1 -0.335 34.1-133.9 -69.5 145.6 67.7 35.8 45.4 1117 262 D T > - 0 0 76 1,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.515 25.3-105.3 -95.8 169.1 64.3 37.2 44.3 1118 263 D A H > S+ 0 0 3 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.892 120.3 54.6 -58.7 -39.3 63.7 39.8 41.6 1119 264 D H H 4 S+ 0 0 113 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.903 111.6 41.2 -65.2 -47.1 63.0 42.4 44.3 1120 265 D E H >4 S+ 0 0 98 2,-0.2 3,-0.8 1,-0.2 4,-0.2 0.850 110.8 57.3 -67.2 -39.6 66.3 41.8 46.2 1121 266 D A H >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.2 6,-0.3 0.825 102.9 55.0 -63.0 -31.0 68.3 41.6 42.9 1122 267 D L T 3< S+ 0 0 27 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.653 105.0 54.6 -76.7 -16.5 67.1 45.0 41.9 1123 268 D K T < S+ 0 0 83 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.410 83.0 113.4 -90.8 -3.0 68.5 46.3 45.2 1124 269 D H S X> S- 0 0 14 -3,-0.9 4,-2.8 -4,-0.2 3,-1.5 -0.533 73.8-129.2 -72.4 132.3 71.9 44.8 44.4 1125 270 D P H 3> S+ 0 0 52 0, 0.0 4,-2.0 0, 0.0 8,-0.3 0.741 106.1 59.9 -56.8 -28.9 74.5 47.6 43.9 1126 271 D W H 34 S+ 0 0 0 -27,-0.2 8,-0.1 2,-0.2 7,-0.1 0.805 117.2 34.6 -66.8 -29.4 75.7 46.3 40.5 1127 272 D V H X4 S+ 0 0 1 -3,-1.5 3,-0.8 -6,-0.3 -1,-0.1 0.918 130.3 29.6 -87.2 -58.2 72.1 46.8 39.3 1128 273 D C H 3< S+ 0 0 65 -4,-2.8 -2,-0.2 1,-0.2 3,-0.1 0.596 128.8 38.3 -88.6 -10.4 71.0 49.9 41.2 1129 274 D Q T >X S+ 0 0 103 -4,-2.0 4,-2.3 -5,-0.4 3,-1.7 -0.193 75.0 140.4-127.1 41.9 74.3 51.7 41.6 1130 275 D R H <> + 0 0 59 -3,-0.8 4,-1.8 1,-0.3 -2,-0.1 0.767 60.4 63.3 -50.3 -40.9 75.6 50.7 38.1 1131 276 D S H 34 S+ 0 0 118 1,-0.2 -1,-0.3 2,-0.2 5,-0.1 0.694 119.9 24.9 -66.6 -22.1 77.3 54.1 37.4 1132 277 D T H <4 S+ 0 0 112 -3,-1.7 -2,-0.2 -7,-0.2 -1,-0.2 0.602 131.5 37.1-110.5 -26.7 79.7 53.6 40.3 1133 278 D V H < S+ 0 0 29 -4,-2.3 2,-0.3 -8,-0.3 -34,-0.2 0.761 99.4 74.7-101.9 -33.3 79.8 49.8 40.7 1134 279 D A S < S- 0 0 11 -4,-1.8 2,-0.2 -5,-0.3 -168,-0.1 -0.681 87.7-108.0 -92.0 139.2 79.6 48.3 37.2 1135 280 D S - 0 0 28 -2,-0.3 -169,-1.8 1,-0.1 -170,-0.5 -0.447 16.8-158.0 -69.0 134.6 82.7 48.5 35.0 1136 281 D M + 0 0 66 -171,-0.2 2,-0.4 -2,-0.2 -1,-0.1 0.185 54.9 125.5 -92.6 10.0 82.5 51.0 32.0 1137 282 D M - 0 0 136 -42,-0.1 -172,-0.4 1,-0.1 -171,-0.1 -0.584 66.6-115.7 -76.0 126.7 85.3 49.0 30.3 1138 283 D H - 0 0 70 -2,-0.4 2,-0.4 -174,-0.1 -174,-0.2 -0.330 20.4-153.9 -61.5 140.4 84.6 47.7 26.7 1139 284 D R >> + 0 0 23 -176,-2.5 4,-1.6 1,-0.2 3,-0.8 -0.598 21.3 169.3-122.3 68.9 84.5 43.9 26.4 1140 285 D Q H 3> S+ 0 0 106 -2,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.800 77.2 56.5 -50.3 -36.0 85.5 43.1 22.9 1141 286 D E H 3> S+ 0 0 66 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.874 103.5 54.2 -67.9 -37.7 85.9 39.3 23.6 1142 287 D T H <> S+ 0 0 4 -3,-0.8 4,-2.9 2,-0.2 5,-0.2 0.960 108.4 49.4 -57.8 -50.3 82.2 39.1 24.9 1143 288 D V H X S+ 0 0 10 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.879 111.6 48.9 -54.0 -43.0 81.0 40.6 21.7 1144 289 D E H X S+ 0 0 55 -4,-1.7 4,-1.1 2,-0.2 -1,-0.2 0.818 113.1 46.8 -70.8 -32.9 83.0 38.1 19.6 1145 290 D C H X S+ 0 0 44 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.891 108.7 54.3 -72.9 -44.4 81.7 35.1 21.7 1146 291 D L H X S+ 0 0 0 -4,-2.9 4,-3.5 1,-0.2 5,-0.3 0.892 104.4 56.1 -53.5 -44.6 78.2 36.3 21.5 1147 292 D K H X S+ 0 0 62 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.919 111.8 42.3 -51.0 -48.1 78.6 36.4 17.7 1148 293 D K H X S+ 0 0 90 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.822 115.3 51.1 -71.3 -32.2 79.7 32.7 17.9 1149 294 D F H X S+ 0 0 33 -4,-2.6 4,-2.0 -84,-0.3 -2,-0.2 0.934 110.7 47.0 -65.4 -52.1 76.8 32.0 20.4 1150 295 D N H X S+ 0 0 25 -4,-3.5 4,-1.9 2,-0.2 -2,-0.2 0.869 113.0 50.3 -60.1 -40.6 74.2 33.6 18.2 1151 296 D A H < S+ 0 0 64 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.948 110.5 49.2 -62.6 -46.7 75.6 31.6 15.2 1152 297 D R H >< S+ 0 0 68 -4,-2.2 3,-0.6 1,-0.2 -2,-0.2 0.837 112.8 47.5 -58.6 -39.0 75.4 28.3 17.1 1153 298 D R H 3< S+ 0 0 37 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.857 105.9 55.9 -77.5 -38.3 71.8 28.9 18.3 1154 299 D K T 3< S+ 0 0 91 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.379 97.8 66.6 -75.6 4.2 70.5 29.9 14.8 1155 300 D L < 0 0 85 -3,-0.6 -1,-0.3 -4,-0.2 -2,-0.1 -0.357 360.0 360.0-109.8 48.2 71.8 26.5 13.6 1156 301 D K 0 0 127 -3,-0.5 0, 0.0 0, 0.0 0, 0.0 -0.902 360.0 360.0-176.0 360.0 69.2 24.8 15.8