==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-JAN-06 2FSO . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.DISKIN,O.LIVNAH . 325 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17132.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 206 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 23 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 3 1 0 0 0 1 1 0 1 0 1 0 2 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 2 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 5 X R 0 0 149 0, 0.0 3,-0.0 0, 0.0 87,-0.0 0.000 360.0 360.0 360.0 129.4 41.5 14.3 25.4 2 6 X P - 0 0 68 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.281 360.0-102.5 -72.9 159.1 41.1 10.9 27.2 3 7 X T - 0 0 84 1,-0.0 15,-2.3 0, 0.0 16,-0.2 -0.722 41.3-155.5 -76.9 129.5 43.6 8.1 26.9 4 8 X F E -A 17 0A 25 -2,-0.5 2,-0.3 13,-0.3 11,-0.0 -0.610 6.8-157.5-101.3 160.2 42.2 5.4 24.5 5 9 X Y E -A 16 0A 57 11,-2.0 11,-2.0 -2,-0.2 2,-0.4 -0.943 12.6-133.0-131.3 159.7 43.1 1.8 24.3 6 10 X R E +A 15 0A 144 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.856 25.7 169.0-114.6 149.9 42.7 -0.6 21.4 7 11 X Q E -A 14 0A 80 7,-2.2 7,-2.6 -2,-0.4 2,-0.5 -0.968 37.0-113.8-160.1 138.0 41.1 -4.0 21.6 8 12 X E E +A 13 0A 144 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.700 47.9 157.2 -84.1 126.7 40.1 -6.4 18.9 9 13 X L E > +A 12 0A 18 3,-2.9 3,-2.3 -2,-0.5 -2,-0.1 -0.977 62.2 3.5-152.9 140.5 36.4 -6.9 19.0 10 14 X N T 3 S- 0 0 58 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.852 127.9 -62.7 41.2 43.7 34.0 -8.0 16.3 11 15 X K T 3 S+ 0 0 195 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.527 122.2 87.4 64.3 8.6 36.9 -8.6 14.0 12 16 X T E < S-A 9 0A 58 -3,-2.3 -3,-2.9 -5,-0.1 2,-0.8 -0.914 86.5-102.2-125.3 164.7 37.9 -4.9 14.0 13 17 X I E -A 8 0A 76 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.768 35.0-159.3 -87.5 106.8 40.1 -2.9 16.3 14 18 X W E -A 7 0A 2 -7,-2.6 -7,-2.2 -2,-0.8 2,-0.4 -0.637 2.9-163.9 -80.1 142.0 37.9 -0.8 18.6 15 19 X E E +A 6 0A 39 -2,-0.3 -9,-0.2 -9,-0.2 -11,-0.0 -0.955 21.7 159.9-133.0 108.9 39.7 2.2 20.1 16 20 X V E -A 5 0A 2 -11,-2.0 -11,-2.0 -2,-0.4 -2,-0.0 -0.930 46.5 -86.9-133.5 151.0 37.8 3.6 23.2 17 21 X P E > -A 4 0A 3 0, 0.0 3,-2.0 0, 0.0 -13,-0.3 -0.318 43.0-118.1 -53.1 144.4 38.5 5.9 26.2 18 22 X E T 3 S+ 0 0 102 -15,-2.3 20,-0.2 1,-0.3 -14,-0.1 0.740 107.1 78.5 -67.9 -17.7 39.8 3.8 29.1 19 23 X R T 3 S+ 0 0 68 -16,-0.2 19,-2.9 18,-0.1 2,-0.7 0.839 82.1 74.5 -54.6 -31.5 36.8 4.8 31.2 20 24 X Y E < S-B 37 0B 0 -3,-2.0 2,-0.3 17,-0.2 17,-0.2 -0.783 74.7-176.3 -91.0 116.7 34.8 2.2 29.2 21 25 X Q E +B 36 0B 69 15,-2.9 15,-2.4 -2,-0.7 -2,-0.0 -0.767 47.0 15.7-117.6 151.2 35.9 -1.2 30.5 22 26 X N E - 0 0 126 -2,-0.3 -1,-0.2 13,-0.2 2,-0.2 0.935 69.8-156.8 57.6 55.5 35.1 -4.8 29.6 23 27 X L E - 0 0 14 -3,-0.2 12,-0.2 12,-0.1 -1,-0.2 -0.487 13.0-176.2 -66.6 134.2 33.7 -4.4 26.2 24 28 X S E -B 34 0B 67 10,-2.0 10,-2.8 -2,-0.2 -15,-0.0 -0.962 29.1-115.1-138.4 112.4 31.5 -7.4 25.3 25 29 X P E +B 33 0B 63 0, 0.0 8,-0.3 0, 0.0 3,-0.1 -0.169 31.2 176.5 -52.0 137.1 29.8 -7.7 21.9 26 30 X V E - 0 0 94 6,-3.1 2,-0.2 1,-0.5 7,-0.2 0.340 56.2 -70.0-124.3 -1.1 26.1 -7.5 22.1 27 31 X G E B 32 0B 41 5,-0.9 5,-3.1 0, 0.0 -1,-0.5 -0.790 360.0 360.0 136.0 179.3 25.3 -7.7 18.4 28 32 X S 0 0 137 3,-0.3 3,-0.2 -2,-0.2 19,-0.0 -0.975 360.0 360.0-156.2 360.0 25.5 -5.8 15.1 29 ! 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 30 36 X G 0 0 46 0, 0.0 2,-0.3 0, 0.0 19,-0.2 0.000 360.0 360.0 360.0 169.0 27.1 -0.7 13.3 31 37 X S E - C 0 48B 19 17,-1.2 17,-2.3 -3,-0.2 2,-0.4 -0.670 360.0-147.6 -96.2 148.2 28.2 -3.2 15.9 32 38 X V E -BC 27 47B 31 -5,-3.1 -6,-3.1 -2,-0.3 -5,-0.9 -0.947 10.8-169.6-120.9 133.5 27.5 -2.8 19.6 33 39 X C E -BC 25 46B 0 13,-2.8 13,-3.8 -2,-0.4 2,-0.2 -0.979 21.0-131.9-113.7 139.0 29.4 -3.8 22.7 34 40 X A E +BC 24 45B 17 -10,-2.8 -10,-2.0 -2,-0.4 2,-0.3 -0.496 38.9 166.5 -70.1 146.5 28.2 -3.6 26.3 35 41 X A E - C 0 44B 9 9,-2.4 9,-2.7 -12,-0.2 2,-0.5 -0.970 37.4-111.7-154.5 170.2 30.7 -2.0 28.6 36 42 X F E -BC 21 43B 83 -15,-2.4 -15,-2.9 -2,-0.3 2,-1.0 -0.971 21.7-147.0-114.2 122.8 31.1 -0.5 32.0 37 43 X D E >> -BC 20 42B 1 5,-3.1 4,-2.3 -2,-0.5 5,-0.8 -0.751 11.0-170.1 -90.1 103.8 31.7 3.2 32.2 38 44 X T T 45S+ 0 0 76 -19,-2.9 -1,-0.2 -2,-1.0 -18,-0.1 0.724 80.9 61.0 -69.6 -20.0 33.9 3.7 35.2 39 45 X K T 45S+ 0 0 163 -20,-0.2 -1,-0.2 1,-0.2 -19,-0.1 0.911 122.8 19.8 -73.0 -38.5 33.5 7.4 35.3 40 46 X T T 45S- 0 0 42 -3,-0.3 -2,-0.2 2,-0.2 -1,-0.2 0.593 98.4-124.2-101.1 -16.8 29.7 7.3 35.8 41 47 X G T <5 + 0 0 42 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.660 65.8 136.4 70.5 18.8 29.4 3.8 37.2 42 48 X L E < -C 37 0B 38 -5,-0.8 -5,-3.1 59,-0.0 2,-0.5 -0.749 59.3-127.0 -96.7 146.8 26.8 2.9 34.4 43 49 X R E -C 36 0B 182 -2,-0.3 59,-2.5 -7,-0.2 2,-0.3 -0.762 44.9-179.7 -78.9 129.9 26.5 -0.1 32.2 44 50 X V E -CD 35 101B 0 -9,-2.7 -9,-2.4 -2,-0.5 2,-0.5 -0.887 32.4-124.7-133.6 160.1 26.5 1.3 28.6 45 51 X A E -CD 34 100B 13 55,-2.9 55,-2.1 -2,-0.3 2,-0.5 -0.922 22.3-158.7-100.9 130.1 26.2 0.2 25.0 46 52 X V E -CD 33 99B 0 -13,-3.8 -13,-2.8 -2,-0.5 2,-0.6 -0.968 6.8-162.9-110.5 121.8 29.1 1.4 22.8 47 53 X K E -CD 32 98B 56 51,-3.1 51,-2.8 -2,-0.5 2,-0.7 -0.938 6.2-159.8-109.8 117.3 28.2 1.5 19.1 48 54 X K E -CD 31 97B 24 -17,-2.3 -17,-1.2 -2,-0.6 49,-0.2 -0.885 27.8-125.2 -89.6 116.6 31.1 1.6 16.6 49 55 X L - 0 0 11 47,-2.6 2,-0.6 -2,-0.7 47,-0.3 -0.404 18.4-129.2 -64.8 136.2 29.5 2.9 13.4 50 56 X S S S- 0 0 68 1,-0.2 4,-0.1 -2,-0.1 -1,-0.1 -0.816 78.8 -22.9 -86.3 122.2 30.1 0.7 10.4 51 57 X R S > S+ 0 0 154 -2,-0.6 3,-1.6 1,-0.1 4,-0.3 0.849 76.5 178.5 47.6 51.7 31.5 2.5 7.3 52 58 X P T 3 S+ 0 0 6 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.709 76.4 27.2 -61.8 -24.9 30.2 5.9 8.5 53 59 X F T 3 S+ 0 0 23 41,-0.3 -2,-0.1 1,-0.1 260,-0.1 -0.077 81.8 117.8-127.9 32.0 31.6 7.9 5.6 54 60 X Q S < S+ 0 0 110 -3,-1.6 2,-0.3 -4,-0.1 -1,-0.1 0.824 86.7 1.1 -70.9 -32.6 31.7 5.3 2.8 55 61 X S S > S- 0 0 35 -4,-0.3 4,-2.6 -3,-0.1 5,-0.2 -0.876 82.1 -96.0-147.5 168.6 29.3 7.1 0.6 56 62 X I H > S+ 0 0 83 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.911 126.5 48.9 -58.2 -42.0 27.2 10.3 0.6 57 63 X I H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.894 111.7 47.4 -66.2 -44.8 24.3 8.2 1.9 58 64 X H H > S+ 0 0 40 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.906 113.6 49.3 -58.7 -44.8 26.3 6.6 4.7 59 65 X A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.902 111.8 46.2 -64.0 -45.4 27.7 10.0 5.6 60 66 X K H X S+ 0 0 30 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.842 112.4 52.5 -64.1 -39.1 24.3 11.7 5.8 61 67 X R H X S+ 0 0 119 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.882 108.3 49.8 -64.0 -41.4 23.0 8.8 7.7 62 68 X T H X S+ 0 0 6 -4,-2.2 4,-2.5 -10,-0.4 -2,-0.2 0.947 112.8 47.1 -61.6 -44.5 25.8 9.1 10.2 63 69 X Y H X S+ 0 0 15 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.934 111.7 51.1 -67.0 -44.1 25.2 12.8 10.6 64 70 X R H X S+ 0 0 69 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.907 110.0 49.0 -53.5 -47.2 21.4 12.2 11.0 65 71 X E H X S+ 0 0 49 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.923 114.3 45.0 -69.6 -39.7 21.9 9.6 13.7 66 72 X L H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.924 113.2 50.0 -67.2 -44.8 24.3 11.8 15.6 67 73 X R H X S+ 0 0 34 -4,-2.9 4,-1.6 -5,-0.2 -2,-0.2 0.910 113.3 46.8 -57.2 -41.7 22.1 14.8 15.3 68 74 X L H X S+ 0 0 49 -4,-2.6 4,-1.5 -5,-0.2 -2,-0.2 0.956 113.4 46.6 -68.4 -49.2 19.1 12.9 16.5 69 75 X L H < S+ 0 0 25 -4,-2.4 11,-0.8 1,-0.2 -1,-0.2 0.865 110.8 53.0 -64.1 -36.7 20.8 11.3 19.5 70 76 X K H < S+ 0 0 34 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.854 109.5 50.4 -66.2 -33.0 22.3 14.6 20.5 71 77 X H H < S+ 0 0 36 -4,-1.6 2,-0.8 -5,-0.2 225,-0.3 0.851 87.5 92.0 -70.4 -34.0 18.9 16.2 20.5 72 78 X M < + 0 0 19 -4,-1.5 8,-0.4 6,-0.1 2,-0.3 -0.517 40.9 156.1 -79.6 106.8 17.1 13.6 22.6 73 79 X K + 0 0 161 -2,-0.8 2,-0.3 6,-0.1 5,-0.1 -0.742 30.3 110.1-131.9 81.0 17.2 14.7 26.2 74 80 X H > - 0 0 19 3,-0.5 3,-1.7 -2,-0.3 52,-0.0 -0.982 69.9-120.2-155.3 141.4 14.3 13.0 28.0 75 81 X E T 3 S+ 0 0 112 -2,-0.3 4,-0.1 1,-0.3 51,-0.1 0.705 112.9 45.9 -55.8 -31.1 13.9 10.3 30.6 76 82 X N T 3 S+ 0 0 6 78,-0.1 79,-2.5 46,-0.1 2,-0.4 0.087 105.0 70.8-103.3 16.0 11.8 8.1 28.3 77 83 X V B < S-f 155 0C 7 -3,-1.7 -3,-0.5 77,-0.3 79,-0.2 -0.999 89.1-105.4-132.0 139.7 13.9 8.4 25.2 78 84 X I - 0 0 17 77,-2.8 2,-0.2 -2,-0.4 -6,-0.1 -0.292 46.2-174.7 -59.9 133.9 17.3 7.0 24.5 79 85 X G - 0 0 15 -4,-0.1 2,-0.7 -6,-0.1 22,-0.4 -0.765 29.6 -93.2-123.8-176.7 20.0 9.6 24.7 80 86 X L + 0 0 11 -11,-0.8 20,-0.2 -8,-0.4 3,-0.1 -0.834 28.4 176.3-101.7 110.9 23.7 10.1 24.1 81 87 X L S S- 0 0 21 18,-2.7 2,-0.3 -2,-0.7 19,-0.2 0.812 75.0 -12.9 -75.7 -36.4 25.8 9.6 27.1 82 88 X D E -E 99 0B 22 17,-1.3 17,-2.8 243,-0.1 2,-0.3 -0.984 52.5-162.0-162.2 151.7 29.0 10.1 25.0 83 89 X V E +E 98 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.951 26.5 165.8-141.3 134.2 30.2 10.3 21.5 84 90 X F E -E 97 0B 12 13,-2.1 13,-2.6 -2,-0.3 237,-0.0 -0.978 25.9-164.5-147.4 162.0 33.8 10.0 20.6 85 91 X T - 0 0 16 -2,-0.3 11,-0.1 11,-0.2 -69,-0.1 -0.996 25.1-139.5-140.4 141.8 36.5 9.4 18.0 86 92 X P S S+ 0 0 17 0, 0.0 -82,-0.1 0, 0.0 -1,-0.1 0.718 74.9 111.3 -66.3 -20.9 40.1 8.5 18.4 87 93 X A - 0 0 13 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.285 55.2-161.3 -54.9 134.4 40.8 11.0 15.6 88 94 X R S S+ 0 0 158 1,-0.1 2,-0.3 -87,-0.0 -1,-0.1 0.508 75.0 18.9 -94.4 -8.7 42.7 14.1 16.8 89 95 X S S S- 0 0 25 1,-0.1 4,-0.5 0, 0.0 3,-0.3 -0.969 83.1-103.3-148.8 168.9 41.7 16.2 13.8 90 96 X L S > S+ 0 0 59 -2,-0.3 3,-1.2 1,-0.2 -1,-0.1 0.887 119.1 60.8 -59.2 -37.5 39.1 16.3 11.0 91 97 X E T 3 S+ 0 0 164 1,-0.3 -1,-0.2 -3,-0.1 -4,-0.0 0.895 109.8 39.6 -59.4 -40.1 41.8 15.0 8.7 92 98 X E T 3 S+ 0 0 96 -3,-0.3 2,-0.7 -6,-0.0 -1,-0.3 0.417 86.4 126.3 -84.3 -1.8 42.2 11.7 10.7 93 99 X F < + 0 0 0 -3,-1.2 3,-0.1 -4,-0.5 224,-0.1 -0.483 16.3 127.5 -76.7 107.7 38.5 11.4 11.3 94 100 X N + 0 0 98 -2,-0.7 2,-0.3 1,-0.2 -41,-0.3 0.579 57.5 52.6-123.8 -31.7 37.3 8.0 10.2 95 101 X D - 0 0 51 -3,-0.2 2,-0.4 -43,-0.1 -8,-0.3 -0.884 52.8-165.3-127.2 147.8 35.4 6.4 13.1 96 102 X V - 0 0 1 -2,-0.3 -47,-2.6 -47,-0.3 2,-0.4 -0.999 4.9-166.7-134.9 127.0 32.5 7.4 15.3 97 103 X Y E -DE 48 84B 0 -13,-2.6 -13,-2.1 -2,-0.4 2,-0.4 -0.966 5.2-159.1-114.6 136.9 31.5 5.7 18.5 98 104 X L E -DE 47 83B 4 -51,-2.8 -51,-3.1 -2,-0.4 2,-0.4 -0.918 4.0-158.3-115.6 135.8 28.1 6.3 20.2 99 105 X V E +DE 46 82B 0 -17,-2.8 -18,-2.7 -2,-0.4 -17,-1.3 -0.959 19.8 158.9-119.0 128.1 27.5 5.6 23.9 100 106 X T E -D 45 0B 24 -55,-2.1 -55,-2.9 -2,-0.4 -20,-0.1 -0.904 50.1 -70.9-137.1 166.1 24.1 5.1 25.4 101 107 X H E -D 44 0B 53 -22,-0.4 2,-0.8 -2,-0.3 -57,-0.3 -0.354 52.9-114.3 -52.8 136.0 22.6 3.5 28.5 102 108 X L - 0 0 49 -59,-2.5 2,-0.5 -67,-0.1 -59,-0.2 -0.715 31.0-150.7 -80.2 114.2 22.9 -0.3 28.3 103 109 X M - 0 0 47 -2,-0.8 45,-0.1 1,-0.1 3,-0.1 -0.795 7.5-162.6 -94.0 125.1 19.3 -1.3 28.1 104 110 X G + 0 0 59 -2,-0.5 2,-0.3 43,-0.2 44,-0.1 0.699 64.4 7.2 -90.1 -24.9 18.9 -4.7 29.7 105 111 X A E -G 147 0C 54 42,-0.9 42,-2.5 38,-0.0 2,-0.2 -0.973 58.8-152.9-150.4 163.7 15.5 -5.8 28.4 106 112 X D E -G 146 0C 62 -2,-0.3 40,-0.2 40,-0.3 37,-0.2 -0.739 39.0 -99.7-126.7 178.9 12.8 -4.7 25.9 107 113 X L 0 0 32 38,-1.6 36,-0.2 35,-1.5 39,-0.1 0.520 360.0 360.0 -79.0 -6.2 9.1 -5.2 25.7 108 114 X N 0 0 141 34,-0.5 -2,-0.3 37,-0.3 33,-0.0 -0.361 360.0 360.0 -69.4 360.0 9.7 -8.0 23.1 109 ! 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 0.0 110 121 X K 0 0 189 0, 0.0 82,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 164.4 -0.0 -10.7 29.8 111 122 X L - 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0 0 2 -4,-1.8 -1,-0.2 26,-0.4 -2,-0.1 -0.011 34.4 -62.5 84.7 165.2 -14.0 -1.1 10.0 216 241 X T S S- 0 0 20 24,-2.1 26,-0.1 1,-0.2 50,-0.1 -0.518 75.7 -72.9 -77.8 156.4 -13.8 0.1 6.5 217 242 X P - 0 0 14 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.204 49.4-139.4 -54.5 136.7 -13.5 3.8 5.9 218 243 X G > - 0 0 36 -3,-0.1 4,-2.3 21,-0.0 5,-0.1 -0.245 33.9 -87.7 -82.8-178.0 -16.6 5.9 6.4 219 244 X A H > S+ 0 0 81 1,-0.2 4,-1.3 2,-0.2 -1,-0.0 0.835 124.2 53.9 -63.2 -39.8 -17.8 8.8 4.3 220 245 X E H 4 S+ 0 0 99 2,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.886 112.2 43.1 -66.1 -40.3 -15.8 11.4 6.1 221 246 X L H >4 S+ 0 0 24 1,-0.2 3,-1.8 2,-0.2 -2,-0.2 0.874 107.9 60.8 -74.7 -34.9 -12.5 9.6 5.7 222 247 X L H >< S+ 0 0 34 -4,-2.3 3,-1.4 1,-0.3 -1,-0.2 0.836 95.0 63.3 -60.4 -31.4 -13.3 8.8 2.1 223 248 X K T 3< S+ 0 0 180 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.668 101.3 52.3 -63.7 -20.7 -13.5 12.5 1.4 224 249 X K T < S+ 0 0 79 -3,-1.8 2,-0.8 -4,-0.3 -1,-0.3 0.284 82.5 102.7-102.8 8.2 -9.8 12.8 2.2 225 250 X I < + 0 0 8 -3,-1.4 6,-0.1 1,-0.2 -1,-0.0 -0.845 41.6 178.5-101.0 107.7 -8.6 10.1 -0.1 226 251 X S + 0 0 113 -2,-0.8 2,-0.4 4,-0.0 -1,-0.2 0.767 51.2 101.2 -76.8 -32.1 -7.0 11.6 -3.2 227 252 X S > - 0 0 49 1,-0.2 4,-2.6 2,-0.1 5,-0.2 -0.418 56.2-160.9 -65.2 118.7 -6.0 8.3 -4.8 228 253 X E H > S+ 0 0 134 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.924 93.4 49.1 -63.0 -44.0 -8.4 7.2 -7.5 229 254 X S H > S+ 0 0 89 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.906 113.1 47.4 -65.2 -38.5 -7.2 3.6 -7.3 230 255 X A H > S+ 0 0 31 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.924 112.4 48.4 -68.5 -43.9 -7.6 3.5 -3.5 231 256 X R H X S+ 0 0 70 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.916 110.9 49.7 -63.6 -42.1 -11.0 5.0 -3.5 232 257 X N H X S+ 0 0 71 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.925 113.5 46.1 -66.5 -41.4 -12.3 2.7 -6.1 233 258 X Y H X S+ 0 0 148 -4,-2.0 4,-0.5 -5,-0.2 3,-0.4 0.926 113.4 49.8 -63.4 -44.5 -11.0 -0.3 -4.3 234 259 X I H >< S+ 0 0 27 -4,-2.8 3,-1.7 1,-0.2 -2,-0.2 0.941 108.5 50.1 -64.6 -46.9 -12.3 0.9 -0.9 235 260 X Q H 3< S+ 0 0 125 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.758 105.1 59.7 -69.7 -16.1 -15.8 1.7 -2.1 236 261 X S H 3< S+ 0 0 88 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.606 87.9 102.6 -79.4 -13.6 -16.0 -1.8 -3.7 237 262 X L S << S- 0 0 47 -3,-1.7 2,-0.7 -4,-0.5 -21,-0.0 -0.449 88.4-104.0 -72.1 141.6 -15.5 -3.4 -0.3 238 263 X T - 0 0 117 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 -0.577 47.8-115.6 -58.5 108.4 -18.2 -4.9 1.8 239 264 X Q - 0 0 139 -2,-0.7 -1,-0.1 -4,-0.1 -21,-0.0 -0.364 37.9-172.3 -53.8 109.8 -18.7 -2.1 4.3 240 265 X M - 0 0 110 -2,-0.3 -24,-2.1 -29,-0.1 2,-0.1 -0.911 16.9-129.2-107.8 136.7 -17.8 -3.5 7.8 241 266 X P - 0 0 96 0, 0.0 -26,-0.4 0, 0.0 2,-0.1 -0.369 32.9 -86.9 -80.1 160.5 -18.4 -1.5 10.9 242 267 X K - 0 0 102 -28,-0.3 -28,-0.2 -26,-0.1 2,-0.1 -0.422 49.1-119.2 -57.0 135.7 -16.0 -0.7 13.7 243 268 X M - 0 0 79 -30,-2.8 2,-0.7 -2,-0.1 -1,-0.1 -0.490 27.7-103.4 -75.9 155.6 -16.0 -3.5 16.2 244 269 X N >> - 0 0 82 1,-0.2 3,-1.5 -2,-0.1 4,-0.8 -0.721 27.3-157.3 -78.4 112.1 -16.9 -2.7 19.8 245 270 X F H >> S+ 0 0 0 -2,-0.7 4,-3.2 1,-0.3 3,-0.7 0.841 90.4 67.5 -65.6 -29.4 -13.6 -2.6 21.6 246 271 X A H 34 S+ 0 0 51 1,-0.3 5,-0.3 2,-0.2 -1,-0.3 0.796 106.5 42.0 -56.1 -28.8 -15.4 -3.3 24.9 247 272 X N H <4 S+ 0 0 111 -3,-1.5 3,-0.3 3,-0.1 -1,-0.3 0.526 114.1 51.0 -96.5 -9.9 -16.3 -6.7 23.4 248 273 X V H << S+ 0 0 51 -4,-0.8 2,-1.4 -3,-0.7 -2,-0.2 0.860 110.0 48.6 -84.8 -48.6 -12.8 -7.3 21.9 249 274 X F S >< S- 0 0 7 -4,-3.2 3,-1.8 -5,-0.1 -1,-0.2 -0.548 86.8-162.5 -97.6 76.2 -10.9 -6.5 25.1 250 275 X I T 3 + 0 0 127 -2,-1.4 -3,-0.1 1,-0.3 3,-0.1 -0.334 68.9 1.3 -67.1 124.8 -12.8 -8.6 27.5 251 276 X G T 3 S+ 0 0 81 -5,-0.3 -1,-0.3 1,-0.3 2,-0.1 0.487 94.7 140.7 79.4 4.3 -12.4 -7.8 31.1 252 277 X A < - 0 0 27 -3,-1.8 -1,-0.3 -6,-0.2 -3,-0.0 -0.444 68.3 -85.7 -73.6 154.5 -10.1 -4.9 30.5 253 278 X N >> - 0 0 44 1,-0.2 4,-2.0 -2,-0.1 3,-0.8 -0.382 38.3-132.3 -48.7 123.3 -10.2 -1.7 32.5 254 279 X P H 3> S+ 0 0 98 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.789 107.2 58.0 -58.6 -30.7 -12.9 0.4 30.6 255 280 X L H 3> S+ 0 0 69 2,-0.2 4,-2.1 1,-0.2 27,-0.2 0.835 105.9 49.5 -62.1 -37.2 -10.5 3.4 30.7 256 281 X A H <> S+ 0 0 0 -3,-0.8 4,-2.7 2,-0.2 -1,-0.2 0.905 111.2 49.1 -67.9 -41.3 -7.9 1.3 28.8 257 282 X V H X S+ 0 0 13 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.918 110.6 50.3 -64.6 -40.7 -10.6 0.3 26.3 258 283 X D H X S+ 0 0 62 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.895 111.0 48.9 -66.2 -39.7 -11.6 3.9 25.9 259 284 X L H >X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 3,-0.6 0.931 109.5 52.4 -63.3 -44.2 -8.0 4.9 25.3 260 285 X L H 3X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.3 3,-0.4 0.909 106.8 53.6 -60.2 -39.3 -7.5 2.1 22.8 261 286 X E H 3< S+ 0 0 40 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.825 109.4 48.7 -61.9 -33.6 -10.6 3.4 20.9 262 287 X K H << S+ 0 0 88 -4,-1.1 10,-2.3 -3,-0.6 3,-0.3 0.699 116.6 42.0 -81.9 -21.7 -9.0 6.8 20.7 263 288 X M H < S+ 0 0 0 -4,-1.5 2,-0.9 -3,-0.4 -2,-0.2 0.843 108.0 56.0 -88.9 -41.7 -5.7 5.5 19.5 264 289 X L S < S+ 0 0 2 -4,-2.7 2,-0.4 -5,-0.2 -1,-0.2 -0.313 71.7 139.5 -95.5 50.9 -6.8 2.9 16.9 265 290 X V - 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