==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-NOV-04 1WBP . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE SPRK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.C.NGO,S.CHAKRABARTI,J.-H.DING,A.VELAZQUEZ-DONES,B.NOLEN, . 357 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17814.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 231 64.7 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 . 47 13.2 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 1 0.3 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 . 19 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 0 2 1 2 0 0 0 2 0 1 0 0 1 0 0 1 0 1 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 . 1 3 1 1 0 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 . 1 0 1 0 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 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 67 A Y 0 0 232 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-153.7 33.6 18.3 51.2 2 68 A H - 0 0 144 3,-0.0 0, 0.0 1,-0.0 0, 0.0 -0.147 360.0-170.0 174.4 75.6 33.3 16.0 48.1 3 69 A L S S+ 0 0 51 1,-0.0 2,-0.4 84,-0.0 85,-0.0 0.869 78.2 40.1 -38.7 -61.0 30.2 13.7 47.9 4 70 A V S S+ 0 0 14 40,-0.1 2,-0.3 4,-0.1 -1,-0.0 -0.798 71.3 161.1 -99.5 137.3 31.5 11.7 44.9 5 71 A K > - 0 0 109 -2,-0.4 3,-1.5 13,-0.0 11,-0.2 -0.984 45.6 -74.7-151.2 157.8 35.1 10.6 44.5 6 72 A I T 3 S+ 0 0 99 -2,-0.3 11,-0.2 1,-0.2 3,-0.1 -0.224 115.0 26.4 -56.8 138.7 37.2 8.1 42.6 7 73 A G T 3 S+ 0 0 45 9,-2.0 -1,-0.2 1,-0.2 10,-0.1 0.483 94.2 129.5 88.2 3.4 37.0 4.5 43.8 8 74 A D < - 0 0 40 -3,-1.5 8,-0.7 8,-0.1 2,-0.3 -0.161 47.8-142.0 -81.6 178.9 33.5 5.1 45.3 9 75 A L E -A 15 0A 93 6,-0.2 2,-0.3 -3,-0.1 6,-0.2 -0.982 15.3-171.3-145.8 134.8 30.4 3.0 44.8 10 76 A F E >> +A 14 0A 22 4,-1.1 4,-2.6 -2,-0.3 3,-2.2 -0.958 65.9 4.8-132.0 149.6 26.8 4.1 44.4 11 77 A N T 34 S- 0 0 81 -2,-0.3 -1,-0.1 1,-0.3 76,-0.0 0.822 120.1 -75.4 49.6 34.7 23.4 2.5 44.3 12 78 A G T 34 S+ 0 0 61 1,-0.1 -1,-0.3 -3,-0.1 3,-0.1 0.652 129.3 49.5 55.6 22.7 25.3 -0.7 45.0 13 79 A R T <4 S+ 0 0 37 -3,-2.2 21,-2.8 1,-0.1 2,-0.9 0.451 77.3 91.4-158.4 -17.6 26.7 -1.2 41.5 14 80 A Y E < -AB 10 33A 3 -4,-2.6 -4,-1.1 19,-0.2 2,-0.9 -0.748 48.3-170.5-100.8 99.0 28.4 2.0 40.1 15 81 A H E -AB 9 32A 74 17,-2.3 17,-2.5 -2,-0.9 -6,-0.2 -0.718 25.7-128.6 -86.6 102.7 32.1 2.1 40.9 16 82 A V E + B 0 31A 1 -2,-0.9 -9,-2.0 -8,-0.7 15,-0.3 -0.215 32.2 172.1 -58.8 135.4 33.4 5.5 39.9 17 83 A I E - 0 0 33 13,-3.1 2,-0.3 1,-0.4 14,-0.2 0.795 58.9 -30.5-107.9 -47.4 36.4 5.7 37.6 18 84 A R E - B 0 30A 82 12,-1.6 12,-4.2 -13,-0.1 -1,-0.4 -0.980 62.8 -87.7-167.7 167.7 36.8 9.4 36.6 19 85 A K E - B 0 29A 97 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.662 25.5-167.6 -87.6 140.2 35.0 12.7 36.0 20 86 A L E - 0 0 67 8,-3.1 2,-0.2 1,-0.5 9,-0.2 0.380 60.5 -55.6-108.2 2.3 33.8 13.3 32.4 21 87 A G E - B 0 28A 25 7,-0.7 7,-2.3 2,-0.0 -1,-0.5 -0.635 51.9-116.9 138.4 162.6 32.9 17.0 32.7 22 88 A W E - B 0 27A 190 5,-0.2 5,-0.2 -2,-0.2 2,-0.1 -0.993 14.1-164.0-142.4 136.5 30.8 19.3 34.8 23 89 A G - 0 0 37 3,-1.4 -2,-0.0 -2,-0.4 5,-0.0 -0.389 40.8-105.8-101.3-176.3 27.9 21.6 34.2 24 90 A H S S+ 0 0 148 -2,-0.1 3,-0.1 1,-0.1 -1,-0.0 0.425 123.1 32.2 -89.3 1.6 26.5 24.4 36.5 25 91 A F S S+ 0 0 119 1,-0.2 21,-3.4 26,-0.0 2,-0.2 0.669 126.5 15.6-122.0 -43.9 23.7 22.0 37.3 26 92 A S - 0 0 19 19,-0.3 -3,-1.4 2,-0.0 2,-0.3 -0.524 56.1-142.6-123.8-171.5 25.2 18.5 37.2 27 93 A T E -B 22 0A 25 -5,-0.2 17,-3.6 -2,-0.2 2,-0.4 -0.933 17.3-145.2-155.7 135.4 28.4 16.6 37.2 28 94 A V E -BC 21 43A 37 -7,-2.3 -8,-3.1 -2,-0.3 -7,-0.7 -0.897 11.5-167.4-115.3 140.0 29.2 13.4 35.2 29 95 A W E -BC 19 42A 26 13,-2.0 13,-3.3 -2,-0.4 2,-0.8 -0.924 22.9-131.9-124.6 146.9 31.3 10.5 36.1 30 96 A L E +BC 18 41A 0 -12,-4.2 -13,-3.1 -2,-0.4 -12,-1.6 -0.856 44.1 165.3 -93.8 108.6 32.7 7.5 34.2 31 97 A S E -BC 16 40A 0 9,-1.7 9,-2.5 -2,-0.8 2,-0.4 -0.906 36.9-116.5-127.5 156.5 31.9 4.6 36.4 32 98 A W E -BC 15 39A 85 -17,-2.5 -17,-2.3 -2,-0.3 2,-0.9 -0.760 20.4-138.0 -92.5 134.3 31.8 0.8 35.9 33 99 A D E > -BC 14 38A 2 5,-3.1 5,-1.0 -2,-0.4 -19,-0.2 -0.815 13.7-168.1 -93.9 105.4 28.5 -1.0 36.3 34 100 A I T > 5S+ 0 0 89 -21,-2.8 3,-0.5 -2,-0.9 -1,-0.2 0.856 84.2 48.3 -60.3 -38.1 29.3 -4.1 38.2 35 101 A Q T 3 5S+ 0 0 136 1,-0.2 -1,-0.1 -22,-0.2 -2,-0.1 0.997 120.4 31.4 -67.0 -67.7 25.8 -5.6 37.4 36 102 A G T 3 5S- 0 0 34 2,-0.1 -1,-0.2 1,-0.1 -2,-0.2 0.081 101.5-133.1 -81.7 26.9 25.6 -5.1 33.7 37 103 A K T < 5 + 0 0 165 -3,-0.5 2,-0.3 1,-0.1 -3,-0.2 0.695 68.6 105.4 23.3 49.1 29.4 -5.5 33.4 38 104 A K E - 0 0 44 -23,-0.1 4,-1.8 44,-0.1 5,-0.2 0.147 66.4-116.8 -33.3 145.8 19.7 22.4 45.0 49 115 A E H > S+ 0 0 165 2,-0.2 4,-1.6 1,-0.2 -1,-0.1 0.947 108.7 40.2 -52.6 -62.8 15.9 22.3 45.4 50 116 A H H > S+ 0 0 112 1,-0.2 4,-2.5 2,-0.2 3,-0.5 0.937 111.8 55.1 -56.3 -54.5 14.8 23.4 41.9 51 117 A Y H > S+ 0 0 64 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.882 110.0 48.0 -46.4 -47.0 17.5 21.4 40.1 52 118 A T H X S+ 0 0 22 -4,-1.8 4,-1.1 2,-0.2 -1,-0.3 0.850 109.8 53.4 -64.4 -36.0 16.2 18.3 41.8 53 119 A E H X S+ 0 0 113 -4,-1.6 4,-1.0 -3,-0.5 3,-0.3 0.932 114.3 39.3 -66.8 -46.6 12.6 19.1 41.0 54 120 A T H X S+ 0 0 54 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.656 106.6 65.6 -78.0 -17.6 13.2 19.5 37.2 55 121 A A H X S+ 0 0 5 -4,-1.4 4,-0.9 -5,-0.3 -1,-0.2 0.854 99.2 54.4 -70.1 -34.1 15.6 16.5 37.2 56 122 A L H >X S+ 0 0 66 -4,-1.1 4,-1.9 -3,-0.3 3,-0.9 0.916 103.7 53.9 -63.2 -46.7 12.6 14.4 38.1 57 123 A D H 3X S+ 0 0 35 -4,-1.0 4,-2.3 1,-0.3 -1,-0.2 0.897 102.7 57.6 -55.5 -43.2 10.6 15.7 35.1 58 124 A E H 3X S+ 0 0 20 -4,-1.5 4,-2.5 1,-0.2 -1,-0.3 0.787 108.0 48.3 -60.1 -26.9 13.5 14.7 32.8 59 125 A I H X S+ 0 0 1 -4,-2.3 4,-2.9 1,-0.2 3,-0.6 0.967 113.6 50.8 -58.2 -61.6 10.1 11.9 30.0 62 128 A L H 3X S+ 0 0 1 -4,-2.5 4,-1.0 1,-0.3 19,-0.4 0.798 110.0 53.0 -50.6 -32.1 13.2 9.7 29.6 63 129 A K H 3X S+ 0 0 77 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.894 107.6 49.7 -72.2 -39.0 11.1 6.8 31.0 64 130 A S H - 0 0 38 -5,-0.2 3,-1.3 -4,-0.2 -1,-0.2 -0.311 54.2-177.1 178.5 91.5 7.7 1.3 22.3 70 136 A P T 3 S+ 0 0 72 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.767 87.4 63.2 -66.5 -22.5 10.8 -0.8 22.7 71 137 A N T 3 S+ 0 0 145 4,-0.1 3,-0.0 2,-0.0 -2,-0.0 0.553 78.1 96.4 -79.4 -10.6 10.1 -2.4 19.3 72 138 A D X - 0 0 17 -3,-1.3 3,-0.8 1,-0.2 4,-0.2 -0.726 62.9-155.6 -84.1 124.8 10.6 0.8 17.4 73 139 A P G > S+ 0 0 94 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.671 91.4 71.0 -71.6 -17.2 14.1 1.0 16.0 74 140 A N G > S+ 0 0 22 1,-0.2 3,-3.0 2,-0.1 4,-0.2 0.838 79.1 79.5 -66.1 -31.2 13.8 4.7 15.9 75 141 A R G X S+ 0 0 48 -3,-0.8 3,-1.7 1,-0.3 -1,-0.2 0.805 80.5 65.2 -43.7 -39.8 14.0 4.6 19.7 76 142 A E G < S+ 0 0 80 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.1 0.475 84.0 76.3 -66.9 -2.4 17.8 4.2 19.5 77 143 A M G < S+ 0 0 20 -3,-3.0 114,-2.4 55,-0.1 2,-0.3 0.449 91.1 62.5 -87.9 -2.0 18.0 7.7 18.1 78 144 A V B < S-f 191 0B 0 -3,-1.7 2,-0.2 112,-0.3 114,-0.2 -0.935 99.8 -96.2-123.2 146.9 17.4 9.2 21.5 79 145 A V - 0 0 8 112,-2.5 2,-0.4 -2,-0.3 -2,-0.1 -0.431 43.4-141.3 -63.3 126.8 19.6 8.9 24.6 80 146 A Q - 0 0 17 -2,-0.2 2,-0.7 -4,-0.1 20,-0.6 -0.755 8.1-126.2 -94.7 138.6 18.1 6.1 26.7 81 147 A L E -E 99 0A 4 -19,-0.4 18,-0.2 -2,-0.4 3,-0.1 -0.757 23.4-174.8 -85.3 115.7 18.0 6.3 30.5 82 148 A L E - 0 0 58 16,-2.5 2,-0.3 -2,-0.7 -1,-0.2 0.945 62.7 -20.8 -74.8 -52.4 19.6 3.2 31.9 83 149 A D E -E 98 0A 33 15,-1.0 15,-3.0 2,-0.0 2,-0.3 -0.957 54.6-156.8-154.1 165.8 18.9 3.8 35.6 84 150 A D E +E 97 0A 46 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.976 23.8 136.2-146.0 155.4 18.0 6.5 38.1 85 151 A F E -E 96 0A 17 11,-1.9 11,-3.0 -2,-0.3 2,-0.3 -0.978 37.8 -99.4-177.6-175.7 18.3 7.0 41.9 86 152 A K E -E 95 0A 138 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.883 19.0-175.7-127.0 159.3 19.2 9.2 44.8 87 153 A I E -E 94 0A 19 7,-1.5 7,-3.2 -2,-0.3 2,-0.3 -0.966 17.3-143.2-150.6 137.0 22.2 9.8 47.1 88 154 A S E +E 93 0A 83 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.812 22.2 166.5-109.1 149.6 22.4 12.1 50.1 89 155 A G - 0 0 21 3,-2.0 -2,-0.0 -2,-0.3 0, 0.0 -0.600 61.5 -59.8-137.1-170.3 25.3 14.2 51.3 90 156 A V S S+ 0 0 97 -2,-0.2 3,-0.1 3,-0.0 -2,-0.0 0.912 131.1 45.3 -43.7 -47.0 25.9 17.0 53.7 91 157 A N S S- 0 0 99 1,-0.1 2,-0.1 -43,-0.0 -3,-0.1 0.854 117.3 -76.4 -62.6-108.8 23.4 19.2 51.6 92 158 A G S S- 0 0 30 -5,-0.1 -3,-2.0 1,-0.0 2,-0.4 -0.247 72.5 -37.0-133.4-137.1 20.3 17.2 50.7 93 159 A T E - E 0 88A 67 -46,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.828 50.1-152.6-101.0 138.2 19.5 14.5 48.2 94 160 A H E - E 0 87A 14 -7,-3.2 -7,-1.5 -2,-0.4 2,-0.4 -0.871 14.5-130.1-106.8 140.6 21.1 14.5 44.8 95 161 A I E - E 0 86A 6 -2,-0.4 -50,-2.3 -49,-0.2 2,-0.4 -0.732 22.4-158.4 -90.9 140.2 19.3 12.9 41.8 96 162 A C E -DE 44 85A 0 -11,-3.0 -11,-1.9 -2,-0.4 2,-0.4 -0.968 8.9-170.2-124.1 135.8 21.4 10.5 39.7 97 163 A M E -DE 43 84A 0 -54,-2.4 -54,-3.1 -2,-0.4 2,-0.5 -0.978 12.0-148.1-123.9 134.6 20.8 9.4 36.1 98 164 A V E +DE 42 83A 0 -15,-3.0 -16,-2.5 -2,-0.4 -15,-1.0 -0.909 23.2 170.9-107.6 126.1 22.7 6.7 34.4 99 165 A F E -DE 41 81A 29 -58,-2.8 -58,-3.4 -2,-0.5 -18,-0.1 -0.903 39.0 -99.1-130.1 157.8 23.4 6.9 30.7 100 166 A E - 0 0 57 -20,-0.6 2,-0.4 -2,-0.3 -60,-0.2 -0.180 59.5 -86.5 -63.6 167.1 25.5 5.0 28.2 101 167 A V - 0 0 13 -62,-0.4 56,-0.6 56,-0.1 2,-0.3 -0.677 54.0-168.2 -83.3 134.8 28.7 6.8 27.4 102 168 A L E -G 156 0B 42 -2,-0.4 54,-0.2 54,-0.2 3,-0.1 -0.806 13.5-129.4-121.4 162.8 28.4 9.4 24.7 103 169 A G E - 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0 0 109 -3,-0.4 -3,-0.2 1,-0.2 -2,-0.1 0.819 64.0 -58.8 68.9 33.3 35.9 26.5 11.8 115 181 A Y S > - 0 0 29 0, 0.0 4,-2.1 0, 0.0 3,-1.8 -0.327 42.3-123.3 -58.2 134.6 30.4 17.5 4.6 120 186 A L H 3> S+ 0 0 30 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.848 110.0 56.5 -51.0 -42.6 27.0 17.4 2.9 121 187 A P H 3> S+ 0 0 54 0, 0.0 4,-0.7 0, 0.0 -1,-0.3 0.747 111.0 47.1 -65.1 -17.5 26.9 13.5 2.8 122 188 A C H <> S+ 0 0 0 -3,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.865 106.2 55.1 -86.1 -45.5 27.4 13.6 6.6 123 189 A V H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.897 104.8 56.3 -54.2 -42.2 24.8 16.3 7.3 124 190 A K H X S+ 0 0 23 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.906 110.1 43.9 -57.2 -45.4 22.2 14.1 5.4 125 191 A K H X S+ 0 0 26 -4,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.920 113.2 49.6 -68.8 -45.1 22.9 11.1 7.7 126 192 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 3,-0.3 0.980 115.3 43.7 -57.2 -57.6 22.9 13.1 10.9 127 193 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.885 108.3 59.2 -56.2 -40.3 19.6 14.8 10.0 128 194 A Q H X S+ 0 0 57 -4,-2.2 4,-0.9 -5,-0.3 -1,-0.2 0.936 111.3 42.0 -54.7 -45.5 18.2 11.5 8.9 129 195 A Q H >X S+ 0 0 19 -4,-2.2 4,-2.2 -3,-0.3 3,-0.9 0.928 108.9 56.4 -67.9 -47.5 18.8 10.1 12.4 130 196 A V H 3X S+ 0 0 2 -4,-2.7 4,-2.2 1,-0.3 -1,-0.2 0.878 110.2 48.1 -52.4 -39.2 17.6 13.3 14.2 131 197 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.3 0.743 105.8 56.7 -74.6 -23.5 14.3 12.9 12.4 132 198 A Q H S+ 0 0 0 -4,-2.0 5,-1.0 2,-0.2 4,-0.5 0.891 118.3 39.9 -58.3 -41.9 9.8 8.3 17.6 137 203 A L H X>S+ 0 0 0 -4,-2.5 4,-1.7 3,-0.2 5,-1.6 0.995 118.8 45.7 -68.4 -63.0 9.2 11.1 20.2 138 204 A H H <5S+ 0 0 11 -4,-2.9 -2,-0.2 4,-0.2 -3,-0.2 0.837 128.0 27.1 -44.4 -46.2 6.5 12.8 18.2 139 205 A T H <5S+ 0 0 74 -4,-3.3 -3,-0.2 -5,-0.4 -2,-0.1 0.963 130.9 26.9 -85.2 -73.6 4.7 9.6 17.4 140 206 A K H <5S+ 0 0 74 -4,-0.5 -3,-0.2 -5,-0.4 -2,-0.1 0.683 134.1 31.1 -68.2 -20.2 5.3 6.9 20.1 141 207 A C T < - 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0 0 62 -5,-0.2 4,-1.6 -2,-0.2 -6,-0.2 -0.281 30.0-110.6 -83.9 175.4 13.0 44.3 19.4 257 561 A R H > S+ 0 0 92 1,-0.2 4,-1.4 2,-0.2 -7,-0.1 0.791 119.8 59.2 -78.1 -27.6 15.1 41.3 18.7 258 562 A D H > S+ 0 0 52 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.854 103.9 51.0 -67.0 -34.1 11.9 39.4 18.2 259 563 A E H > S+ 0 0 2 2,-0.2 4,-3.1 1,-0.2 3,-0.5 0.972 109.5 47.5 -67.5 -53.9 10.8 41.7 15.5 260 564 A D H X S+ 0 0 6 -4,-1.6 4,-1.6 1,-0.3 -1,-0.2 0.789 107.9 58.7 -57.5 -27.6 14.1 41.4 13.5 261 565 A H H X S+ 0 0 0 -4,-1.4 4,-1.4 2,-0.2 -1,-0.3 0.914 110.9 40.8 -70.0 -38.8 13.7 37.6 13.9 262 566 A I H X S+ 0 0 0 -4,-1.6 4,-2.2 -3,-0.5 5,-0.2 0.931 110.8 57.0 -73.9 -42.5 10.3 37.7 12.2 263 567 A A H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.3 -1,-0.2 0.828 110.6 45.0 -55.4 -33.9 11.6 40.2 9.6 264 568 A L H X S+ 0 0 13 -4,-1.6 4,-1.2 -5,-0.2 -1,-0.3 0.828 108.5 57.0 -78.7 -32.9 14.3 37.8 8.7 265 569 A I H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.844 114.1 39.9 -64.3 -34.1 11.8 34.9 8.7 266 570 A I H X S+ 0 0 24 -4,-2.2 4,-3.7 2,-0.2 -2,-0.2 0.912 107.7 58.4 -81.0 -48.7 9.8 36.8 6.1 267 571 A E H < S+ 0 0 10 -4,-2.3 35,-3.4 -5,-0.2 -2,-0.2 0.792 119.3 36.3 -52.1 -25.2 12.7 38.1 4.0 268 572 A L H < S+ 0 0 13 -4,-1.2 36,-0.7 33,-0.2 -2,-0.2 0.836 136.4 16.5 -96.5 -41.7 13.5 34.4 3.6 269 573 A L H < S- 0 0 40 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.209 107.9-116.7-119.0 12.8 10.1 32.7 3.4 270 574 A G < - 0 0 34 -4,-3.7 -3,-0.1 32,-0.2 -1,-0.1 0.353 53.8 -17.2 71.5 158.8 7.9 35.7 2.6 271 575 A K S S- 0 0 139 1,-0.1 21,-0.1 -5,-0.1 3,-0.0 0.279 71.7-106.2 -28.2 146.2 4.9 37.5 4.3 272 576 A V - 0 0 4 19,-0.3 -1,-0.1 1,-0.1 -2,-0.0 -0.650 34.8-101.8 -89.5 135.0 3.0 35.8 7.1 273 577 A P > - 0 0 41 0, 0.0 4,-2.6 0, 0.0 3,-0.3 -0.204 22.7-137.8 -51.5 135.8 -0.5 34.4 6.6 274 578 A R H > S+ 0 0 172 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.848 104.2 59.4 -66.2 -32.4 -3.1 36.7 8.1 275 579 A K H > S+ 0 0 132 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.846 110.3 43.3 -64.9 -31.4 -5.0 33.8 9.5 276 580 A L H >> S+ 0 0 10 -3,-0.3 4,-1.4 2,-0.2 3,-0.9 0.942 110.8 54.0 -77.0 -51.2 -1.8 32.9 11.5 277 581 A I H >< S+ 0 0 15 -4,-2.6 3,-0.9 1,-0.3 6,-0.3 0.910 105.6 52.0 -49.4 -52.1 -1.1 36.5 12.5 278 582 A V H 3< S+ 0 0 108 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.819 108.5 55.0 -55.8 -30.5 -4.6 37.0 14.0 279 583 A A H << S+ 0 0 58 -3,-0.9 2,-0.3 -4,-0.6 -1,-0.3 0.794 84.8 96.7 -73.7 -31.1 -3.9 33.8 15.9 280 584 A G << - 0 0 8 -4,-1.4 4,-0.4 -3,-0.9 -58,-0.3 -0.466 63.4-154.8 -65.6 124.2 -0.7 35.0 17.5 281 585 A K S S+ 0 0 132 -60,-2.5 -60,-0.2 -2,-0.3 -1,-0.2 0.640 96.8 39.1 -74.1 -14.3 -1.3 36.4 21.0 282 586 A Y S > S+ 0 0 77 -62,-2.5 3,-2.8 1,-0.1 4,-0.3 0.492 85.0 102.4-110.1 -8.4 1.7 38.7 20.8 283 587 A S G >> + 0 0 7 -63,-0.7 3,-2.9 1,-0.3 4,-2.8 0.828 67.5 71.9 -39.2 -47.7 1.2 39.7 17.1 284 588 A K G 34 S+ 0 0 150 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.584 91.7 59.4 -49.4 -15.1 -0.2 43.0 18.2 285 589 A E G <4 S+ 0 0 116 -3,-2.8 -1,-0.3 -65,-0.1 -2,-0.2 0.635 121.4 18.9 -91.6 -17.5 3.3 44.1 19.2 286 590 A F T <4 S+ 0 0 4 -3,-2.9 8,-2.3 -4,-0.3 2,-0.3 0.693 113.0 69.4-118.4 -43.8 4.9 43.7 15.8 287 591 A F B < -J 293 0D 6 -4,-2.8 6,-0.2 6,-0.2 -1,-0.1 -0.655 64.1-146.4 -91.8 138.2 2.2 43.6 13.2 288 592 A T - 0 0 32 4,-2.8 -1,-0.1 -2,-0.3 -2,-0.1 -0.119 41.1 -86.8 -83.5-176.1 -0.0 46.6 12.2 289 593 A K S S+ 0 0 145 1,-0.2 -2,-0.0 2,-0.1 -1,-0.0 0.918 128.6 52.9 -60.7 -45.6 -3.7 46.5 11.1 290 594 A K S S- 0 0 139 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.895 122.7-104.8 -57.0 -44.0 -2.7 45.8 7.5 291 595 A G S S+ 0 0 12 1,-0.3 2,-0.3 -14,-0.0 -19,-0.3 0.570 79.6 121.1 121.7 25.0 -0.6 42.9 8.5 292 596 A D - 0 0 75 -21,-0.1 -4,-2.8 -6,-0.0 -1,-0.3 -0.797 69.3 -93.3-116.9 158.5 2.9 44.4 8.2 293 597 A L B -J 287 0D 16 -2,-0.3 -6,-0.2 -6,-0.2 -7,-0.1 -0.500 30.8-157.1 -70.8 134.6 5.8 45.0 10.6 294 598 A K S S+ 0 0 75 -8,-2.3 -1,-0.1 -2,-0.2 -7,-0.1 0.976 84.1 32.6 -78.7 -59.1 5.7 48.4 12.2 295 599 A H S S+ 0 0 90 -9,-0.2 2,-0.8 1,-0.2 -40,-0.1 0.834 117.5 55.3 -71.9 -32.4 9.3 49.2 13.3 296 600 A I + 0 0 12 -10,-0.2 -3,-0.2 1,-0.2 -1,-0.2 -0.879 63.3 152.2-104.5 105.9 11.0 47.3 10.4 297 601 A T + 0 0 99 -2,-0.8 2,-1.5 1,-0.2 -1,-0.2 0.892 52.2 65.7 -98.1 -54.3 9.7 48.7 7.2 298 602 A K - 0 0 159 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.545 67.5-178.3 -78.4 85.1 12.3 48.3 4.4 299 603 A L - 0 0 50 -2,-1.5 -35,-0.0 -3,-0.1 -36,-0.0 -0.695 18.1-154.0 -88.1 134.9 12.6 44.5 4.0 300 604 A K - 0 0 103 -2,-0.4 55,-0.3 2,-0.0 -2,-0.0 -0.788 20.2-148.9-109.8 89.5 15.1 43.1 1.5 301 605 A P + 0 0 107 0, 0.0 2,-0.3 0, 0.0 -33,-0.2 -0.125 20.9 172.5 -60.5 150.2 13.8 39.6 0.5 302 606 A W - 0 0 48 -35,-3.4 2,-0.3 4,-0.0 -32,-0.2 -0.966 26.4-124.7-154.7 140.9 16.1 36.7 -0.5 303 607 A G > - 0 0 28 -2,-0.3 4,-3.0 1,-0.1 5,-0.2 -0.698 18.2-123.8 -96.6 146.6 15.1 33.1 -1.2 304 608 A L H > S+ 0 0 5 -36,-0.7 4,-2.1 -2,-0.3 5,-0.2 0.932 114.2 49.3 -46.2 -54.0 16.6 30.1 0.5 305 609 A F H > S+ 0 0 70 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.918 112.1 46.4 -52.9 -51.6 17.7 28.7 -2.9 306 610 A E H > S+ 0 0 97 1,-0.2 4,-3.9 2,-0.2 5,-0.4 0.900 109.4 55.4 -62.1 -38.8 19.3 31.9 -4.1 307 611 A V H X>S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 5,-1.7 0.925 105.8 50.8 -58.4 -49.3 21.1 32.4 -0.7 308 612 A L H <5S+ 0 0 0 -4,-2.1 6,-2.2 -5,-0.2 4,-0.4 0.949 121.4 34.3 -53.0 -51.8 22.8 28.9 -1.0 309 613 A V H <5S+ 0 0 39 -4,-1.9 4,-0.4 4,-0.3 -2,-0.2 0.934 125.2 38.2 -71.0 -51.0 24.0 29.7 -4.5 310 614 A E H <5S+ 0 0 110 -4,-3.9 -3,-0.2 -5,-0.2 -2,-0.2 0.875 131.6 22.6 -72.1 -40.8 24.7 33.5 -4.3 311 615 A K T <5S+ 0 0 29 -4,-2.5 48,-0.3 -5,-0.4 -3,-0.2 0.866 132.2 34.3 -94.7 -47.7 26.2 33.6 -0.8 312 616 A Y S - 0 0 58 -2,-0.3 4,-2.7 1,-0.1 3,-0.4 -0.372 30.4-116.5 -61.8 143.9 26.1 24.6 -7.2 316 620 A Q H > S+ 0 0 130 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.837 116.6 56.9 -51.4 -35.1 22.6 25.1 -8.5 317 621 A E H > S+ 0 0 151 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.937 111.8 39.3 -61.1 -50.4 22.1 21.4 -8.4 318 622 A E H > S+ 0 0 92 -3,-0.4 4,-2.3 2,-0.2 5,-0.2 0.906 113.5 52.5 -67.5 -48.2 23.0 21.1 -4.7 319 623 A A H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.873 108.9 54.3 -56.2 -38.9 21.2 24.2 -3.6 320 624 A A H X S+ 0 0 47 -4,-1.8 4,-2.1 -5,-0.3 -1,-0.2 0.866 108.2 45.7 -64.1 -44.2 18.0 22.9 -5.3 321 625 A G H X S+ 0 0 28 -4,-1.4 4,-0.7 2,-0.2 -2,-0.2 0.920 117.2 45.0 -68.1 -42.7 18.0 19.5 -3.6 322 626 A F H >X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 3,-1.0 0.944 113.9 48.3 -65.2 -50.6 18.6 21.1 -0.2 323 627 A T H 3X S+ 0 0 13 -4,-3.0 4,-1.6 1,-0.3 -1,-0.2 0.893 108.8 54.1 -57.8 -41.5 16.0 23.9 -0.7 324 628 A D H 3< S+ 0 0 104 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.739 114.4 44.0 -65.8 -18.5 13.5 21.3 -1.9 325 629 A F H << S+ 0 0 2 -3,-1.0 4,-0.3 -4,-0.7 -2,-0.2 0.868 115.5 43.5 -91.5 -41.7 14.1 19.6 1.4 326 630 A L H >X S+ 0 0 0 -4,-2.8 3,-2.5 1,-0.2 4,-0.6 0.944 99.2 64.4 -71.4 -55.1 14.2 22.4 3.9 327 631 A L G >< S+ 0 0 64 -4,-1.6 3,-1.5 1,-0.3 -1,-0.2 0.798 95.4 59.0 -42.5 -44.7 11.2 24.7 2.9 328 632 A P G >4 S+ 0 0 50 0, 0.0 10,-2.7 0, 0.0 3,-0.6 0.825 109.1 48.1 -57.6 -27.0 8.5 22.1 3.7 329 633 A M G <4 S+ 0 0 0 -3,-2.5 -2,-0.2 -4,-0.3 -95,-0.2 0.562 106.8 56.6 -87.5 -12.5 10.0 22.2 7.2 330 634 A L G << S+ 0 0 3 -3,-1.5 2,-0.3 -4,-0.6 -1,-0.2 -0.001 73.6 146.1-108.5 26.5 9.9 26.0 7.2 331 635 A E < - 0 0 64 -3,-0.6 6,-0.2 1,-0.2 -100,-0.1 -0.516 47.6-143.2 -65.0 121.8 6.2 26.1 6.5 332 636 A L S S+ 0 0 13 -2,-0.3 -1,-0.2 1,-0.2 3,-0.1 0.763 88.7 68.5 -59.5 -27.5 4.9 29.2 8.3 333 637 A I S >> S- 0 0 15 1,-0.1 3,-2.2 -117,-0.0 4,-2.1 -0.816 78.8-149.1 -99.9 100.1 1.7 27.3 9.2 334 638 A P T 34 S+ 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.732 95.9 52.6 -34.3 -40.5 2.6 24.5 11.7 335 639 A E T 34 S+ 0 0 154 1,-0.2 4,-0.0 -3,-0.1 -3,-0.0 0.845 112.9 44.4 -71.7 -31.4 -0.2 22.2 10.5 336 640 A K T <4 S+ 0 0 133 -3,-2.2 -1,-0.2 2,-0.1 3,-0.1 0.881 93.1 103.3 -77.7 -38.4 1.0 22.6 6.9 337 641 A R S < S- 0 0 6 -4,-2.1 -8,-0.2 -6,-0.2 -10,-0.1 0.006 84.9 -92.2 -45.2 146.6 4.7 22.1 7.9 338 642 A A - 0 0 11 -10,-2.7 2,-0.1 -11,-0.1 -1,-0.1 -0.246 37.3-126.9 -65.2 148.6 6.2 18.7 7.2 339 643 A T > - 0 0 58 -3,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.425 22.9-111.1 -89.4 169.8 6.2 16.0 9.8 340 644 A A H > S+ 0 0 2 2,-0.2 4,-1.2 1,-0.2 -205,-0.2 0.916 121.3 48.5 -66.5 -41.7 9.3 14.1 10.9 341 645 A A H >> S+ 0 0 34 1,-0.2 4,-0.7 2,-0.2 3,-0.6 0.939 110.1 50.6 -63.5 -47.4 7.9 11.0 9.2 342 646 A E H >4 S+ 0 0 89 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.878 107.4 54.4 -58.9 -39.0 7.2 12.8 6.0 343 647 A C H >< S+ 0 0 6 -4,-2.0 3,-0.8 1,-0.2 6,-0.3 0.800 100.1 61.2 -66.5 -28.2 10.7 14.3 5.9 344 648 A L H << S+ 0 0 43 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.733 100.5 53.9 -71.4 -21.5 12.2 10.8 6.2 345 649 A R T << S+ 0 0 176 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.562 83.7 110.5 -88.5 -9.2 10.6 9.8 2.9 346 650 A H S X S- 0 0 30 -3,-0.8 3,-0.7 -4,-0.4 4,-0.2 -0.402 71.2-133.5 -66.5 140.4 12.2 12.8 1.1 347 651 A P G > S+ 0 0 75 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.686 93.6 79.9 -69.2 -20.3 14.9 11.7 -1.4 348 652 A W G > S+ 0 0 14 1,-0.3 3,-1.0 -27,-0.1 -224,-0.1 0.903 88.6 58.4 -55.0 -39.5 17.4 14.3 -0.3 349 653 A L G < S+ 0 0 1 -3,-0.7 -1,-0.3 -6,-0.3 -221,-0.1 0.669 106.5 47.2 -64.8 -19.9 18.3 12.1 2.6 350 654 A N G < 0 0 102 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.1 -0.257 360.0 360.0-120.0 48.3 19.3 9.2 0.4 351 655 A S < 0 0 123 -3,-1.0 -1,-0.3 -230,-0.0 -2,-0.0 -0.067 360.0 360.0 34.3 360.0 21.5 10.8 -2.2 352 !* 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 0.0 353 3 B R 0 0 97 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-135.3 21.0 45.1 9.0 354 4 B E - 0 0 75 1,-0.2 2,-1.3 2,-0.1 -90,-0.1 0.289 360.0 -38.7 48.0-168.9 19.4 42.4 6.8 355 5 B R - 0 0 34 -55,-0.3 -1,-0.2 1,-0.0 -108,-0.0 -0.702 69.3-122.2 -87.9 94.6 21.0 39.1 5.9 356 6 B S - 0 0 72 -2,-1.3 2,-2.0 -3,-0.2 -2,-0.1 -0.065 18.6-144.0 -36.6 108.5 24.6 40.1 5.3 357 7 B P S S+ 0 0 94 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.409 74.8 61.6 -80.0 60.9 25.1 38.9 1.7 358 8 B T 0 0 100 -2,-2.0 -47,-0.1 1,-0.1 -46,-0.1 -0.800 360.0 360.0 178.8 137.8 28.7 37.8 2.4 359 9 B R 0 0 128 -48,-0.3 -1,-0.1 -2,-0.2 -47,-0.1 0.949 360.0 360.0 -89.8 360.0 30.5 35.4 4.6