==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 27-APR-12 4EWH . COMPND 2 MOLECULE: ACTIVATED CDC42 KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.LIU,N.WALKER,Z.WANG . 549 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25261.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 365 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 16.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 31 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 152 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.6 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 0 2 2 0 4 2 0 0 0 2 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 6 0 4 2 0 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 2 0 0 0 0 0 0 0 1 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 1 117 B L 0 0 152 0, 0.0 2,-0.6 0, 0.0 277,-0.0 0.000 360.0 360.0 360.0 -44.2 55.8 25.6 -27.4 2 118 B T - 0 0 10 277,-0.3 277,-2.7 76,-0.0 76,-0.2 -0.913 360.0-165.3-108.1 114.2 55.3 23.7 -24.0 3 119 B C E -aB 78 278A 16 74,-2.1 76,-2.0 -2,-0.6 2,-0.6 -0.381 31.6-121.9 -98.6 159.8 58.2 24.4 -21.6 4 120 B L E -a 79 0A 13 273,-2.8 2,-0.3 74,-0.2 273,-0.3 -0.913 43.0-157.7 -87.2 125.4 59.8 23.3 -18.4 5 121 B I - 0 0 6 74,-3.3 76,-0.4 -2,-0.6 2,-0.4 -0.851 6.0-135.0-111.7 145.3 59.6 26.4 -16.3 6 122 B G > - 0 0 13 -2,-0.3 3,-4.2 74,-0.1 4,-0.4 -0.834 22.0-119.5-104.8 140.7 61.8 27.3 -13.3 7 123 B E G > S+ 0 0 88 -2,-0.4 3,-1.1 1,-0.3 -1,-0.1 0.763 115.4 62.4 -43.0 -31.8 60.5 28.7 -10.0 8 124 B K G 3 S+ 0 0 197 1,-0.2 -1,-0.3 3,-0.1 -3,-0.0 0.731 99.9 53.0 -65.7 -26.2 62.8 31.7 -10.8 9 125 B D G < S+ 0 0 67 -3,-4.2 21,-2.8 1,-0.1 2,-0.4 0.418 102.3 70.2 -91.9 5.2 60.8 32.5 -14.0 10 126 B L E < -C 29 0A 15 -3,-1.1 2,-0.5 -4,-0.4 19,-0.2 -0.967 57.5-165.3-136.2 121.0 57.4 32.6 -12.2 11 127 B R E -C 28 0A 96 17,-2.7 17,-1.9 -2,-0.4 2,-0.4 -0.892 19.3-139.3-107.5 123.6 55.9 35.0 -9.7 12 128 B L E +C 27 0A 67 -2,-0.5 15,-0.2 15,-0.2 3,-0.1 -0.647 24.4 175.0 -90.0 129.7 52.7 34.0 -7.8 13 129 B L E - 0 0 73 13,-2.9 -1,-0.1 -2,-0.4 2,-0.1 0.352 41.9 -24.3-104.3-131.8 49.8 36.4 -7.2 14 130 B E E - 0 0 88 1,-0.1 12,-2.5 11,-0.1 -1,-0.3 -0.437 68.6 -94.3 -87.1 161.8 46.3 36.2 -5.6 15 131 B K E -C 25 0A 113 10,-0.2 10,-0.3 1,-0.2 -1,-0.1 -0.539 31.8-175.6 -71.0 136.6 44.2 33.0 -5.2 16 132 B L E - 0 0 76 8,-2.9 2,-0.3 1,-0.4 9,-0.2 0.658 54.5 -87.3-102.3 -29.4 41.7 32.7 -8.1 17 133 B G E -C 24 0A 23 7,-1.7 7,-2.9 2,-0.0 2,-0.4 -0.996 56.9 -34.1 154.6-155.3 40.1 29.6 -6.6 18 134 B D E -C 23 0A 119 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.851 44.4-170.7-118.0 137.6 40.1 25.9 -6.2 19 135 B G E > -C 22 0A 28 3,-2.7 3,-0.7 -2,-0.4 135,-0.0 -0.572 45.2 -80.6-118.0 176.8 41.1 23.2 -8.7 20 136 B S T 3 S+ 0 0 68 1,-0.2 3,-0.1 -2,-0.2 134,-0.0 0.842 126.2 11.6 -43.7 -40.4 41.0 19.4 -9.2 21 137 B F T 3 S- 0 0 39 1,-0.2 24,-0.5 22,-0.1 2,-0.3 0.235 128.8 -30.1-132.3 16.1 44.2 19.0 -7.0 22 138 B G E < S-C 19 0A 15 -3,-0.7 -3,-2.7 22,-0.1 2,-0.2 -0.978 88.4 -27.8 159.5-168.9 45.0 22.2 -5.2 23 139 B V E -C 18 0A 32 -2,-0.3 20,-2.1 -5,-0.2 2,-0.6 -0.516 44.5-144.2 -79.9 141.9 44.7 26.0 -5.3 24 140 B V E -CD 17 42A 22 -7,-2.9 -8,-2.9 -2,-0.2 -7,-1.7 -0.909 24.4-177.6-101.9 123.9 44.7 27.9 -8.6 25 141 B R E -CD 15 41A 79 16,-2.6 16,-2.4 -2,-0.6 -10,-0.2 -0.879 26.6-116.4-120.1 149.0 46.5 31.3 -8.4 26 142 B R E + D 0 40A 72 -12,-2.5 -13,-2.9 -2,-0.3 2,-0.3 -0.425 45.3 168.7 -70.7 157.0 47.1 34.1 -10.9 27 143 B G E -CD 12 39A 0 12,-2.2 12,-2.2 -15,-0.2 2,-0.4 -0.983 37.4-117.4-159.2 179.4 50.7 34.8 -11.9 28 144 B E E -CD 11 38A 80 -17,-1.9 -17,-2.7 -2,-0.3 2,-0.4 -0.983 28.2-165.8-121.1 134.3 53.4 36.4 -14.1 29 145 B W E -CD 10 37A 18 8,-2.5 8,-3.0 -2,-0.4 2,-1.3 -0.988 20.1-139.5-128.2 129.9 55.7 34.3 -16.2 30 146 B D E - D 0 36A 54 -21,-2.8 6,-0.2 -2,-0.4 5,-0.1 -0.703 31.9-151.7 -85.5 92.8 58.9 35.3 -17.9 31 147 B A > - 0 0 10 4,-2.4 3,-3.0 -2,-1.3 -26,-0.0 -0.310 23.9-111.1 -72.1 156.0 58.5 33.5 -21.2 32 148 B P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.586 116.8 66.5 -66.9 -12.3 61.6 32.3 -23.1 33 149 B S T 3 S- 0 0 90 2,-0.2 3,-0.1 1,-0.0 -2,-0.1 0.534 119.6-110.1 -80.3 -6.5 60.8 34.9 -25.8 34 150 B G S < S+ 0 0 69 -3,-3.0 2,-0.1 1,-0.4 -3,-0.0 0.127 80.7 125.8 98.3 -20.2 61.5 37.6 -23.2 35 151 B K - 0 0 150 -5,-0.1 -4,-2.4 1,-0.1 2,-0.7 -0.426 58.1-135.1 -72.8 145.0 57.8 38.6 -22.9 36 152 B T E -D 30 0A 86 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.903 29.3-170.3-108.5 112.1 56.3 38.6 -19.4 37 153 B V E -D 29 0A 39 -8,-3.0 -8,-2.5 -2,-0.7 2,-0.3 -0.781 24.0-121.1-115.6 142.7 52.8 37.0 -19.5 38 154 B S E +D 28 0A 73 -2,-0.3 53,-0.6 -10,-0.2 2,-0.3 -0.654 42.6 170.7 -79.8 140.1 49.9 36.6 -17.1 39 155 B V E -DE 27 90A 0 -12,-2.2 -12,-2.2 -2,-0.3 2,-0.4 -0.862 36.6-117.7-141.4 162.8 49.0 33.0 -16.3 40 156 B A E -DE 26 89A 11 49,-2.2 49,-3.0 -2,-0.3 2,-0.4 -0.903 31.2-154.7-102.9 145.6 46.9 30.8 -14.1 41 157 B V E -DE 25 88A 0 -16,-2.4 -16,-2.6 -2,-0.4 2,-0.8 -0.987 5.8-155.9-128.4 125.6 49.0 28.4 -11.9 42 158 B K E -DE 24 87A 15 45,-2.5 45,-1.0 -2,-0.4 -18,-0.2 -0.786 17.2-152.6-111.8 95.6 47.7 25.1 -10.5 43 159 B C E - E 0 86A 21 -20,-2.1 2,-0.4 -2,-0.8 43,-0.2 -0.299 10.7-162.4 -74.2 141.2 49.5 24.0 -7.3 44 160 B L - 0 0 6 41,-2.0 41,-0.3 -22,-0.1 -22,-0.1 -0.988 8.4-178.9-115.3 129.9 50.0 20.5 -6.1 45 161 B K + 0 0 163 -24,-0.5 -23,-0.1 -2,-0.4 -2,-0.0 0.140 56.3 68.5-119.1 20.7 51.0 20.2 -2.3 46 162 B P S > S+ 0 0 29 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.807 83.5 41.3-112.1 -35.1 51.5 16.5 -1.3 47 163 B D T 4 + 0 0 29 2,-0.2 3,-0.2 3,-0.2 -3,-0.0 0.275 40.9 108.0-112.0-137.2 54.6 14.6 -2.9 48 164 B V T 4 S+ 0 0 26 1,-0.2 -1,-0.1 3,-0.2 287,-0.0 0.454 129.1 18.2 52.4 10.5 58.3 14.8 -3.8 49 165 B L T 4 S+ 0 0 148 2,-0.1 -2,-0.2 282,-0.0 -1,-0.2 0.109 130.3 24.4-154.3 -80.0 57.5 12.5 -0.7 50 166 B S S < S+ 0 0 92 -4,-1.1 -3,-0.2 -3,-0.2 0, 0.0 0.236 99.2 54.9-109.0 6.0 54.1 11.1 0.3 51 167 B Q > + 0 0 69 1,-0.1 4,-1.0 276,-0.1 -3,-0.2 -0.873 30.4 167.9-146.1 107.1 51.5 10.7 -2.7 52 168 B P H > S+ 0 0 40 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.598 86.5 58.4 -86.6 -13.7 51.8 8.8 -6.0 53 169 B E H > S+ 0 0 107 2,-0.2 4,-2.2 3,-0.2 5,-0.2 0.909 108.2 42.6 -75.5 -50.5 48.1 9.1 -6.6 54 170 B A H > S+ 0 0 17 2,-0.2 4,-2.8 1,-0.2 5,-0.1 0.966 118.2 46.7 -57.3 -55.1 48.0 12.9 -6.5 55 171 B M H X S+ 0 0 6 -4,-1.0 4,-3.0 1,-0.2 5,-0.3 0.893 109.8 54.2 -50.3 -49.2 51.2 13.1 -8.6 56 172 B D H X S+ 0 0 19 -4,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.917 110.4 45.9 -57.1 -45.4 49.9 10.5 -11.0 57 173 B D H X S+ 0 0 44 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.940 112.2 51.5 -59.8 -51.5 46.7 12.7 -11.6 58 174 B F H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.914 113.2 44.4 -49.6 -52.5 48.8 15.8 -11.9 59 175 B I H X S+ 0 0 3 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.935 112.0 53.1 -61.4 -46.3 51.1 14.1 -14.6 60 176 B R H X S+ 0 0 61 -4,-3.0 4,-1.5 -5,-0.3 -1,-0.2 0.817 108.6 49.8 -62.2 -30.6 48.1 12.7 -16.4 61 177 B E H X S+ 0 0 4 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.961 109.1 51.1 -72.0 -50.1 46.5 16.1 -16.6 62 178 B V H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.871 112.2 48.2 -38.5 -51.9 49.7 17.7 -18.0 63 179 B N H < S+ 0 0 33 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.831 110.6 50.1 -70.9 -35.2 49.8 15.0 -20.6 64 180 B A H < S+ 0 0 7 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.874 116.9 41.2 -63.7 -46.0 46.2 15.4 -21.5 65 181 B M H >< S+ 0 0 6 -4,-2.8 3,-1.9 -5,-0.1 11,-0.4 0.796 89.9 108.3 -73.3 -30.4 46.6 19.1 -21.9 66 182 B H T 3< S+ 0 0 34 -4,-2.4 3,-0.1 -5,-0.3 11,-0.1 -0.244 89.5 7.8 -57.2 127.7 50.0 18.8 -23.7 67 183 B S T 3 S+ 0 0 93 1,-0.2 2,-0.4 9,-0.2 -1,-0.2 0.156 87.8 136.5 97.2 -18.1 49.6 19.7 -27.3 68 184 B L < + 0 0 18 -3,-1.9 2,-0.4 -4,-0.1 8,-0.4 -0.506 22.9 173.2 -75.1 122.7 46.0 21.0 -27.3 69 185 B D + 0 0 120 -2,-0.4 2,-0.3 -3,-0.1 5,-0.1 -0.767 22.8 129.0-137.6 78.6 45.6 24.2 -29.3 70 186 B H > - 0 0 33 -2,-0.4 3,-1.8 3,-0.3 53,-0.0 -0.992 57.9-128.9-131.8 146.9 42.0 25.2 -29.6 71 187 B R T 3 S+ 0 0 136 -2,-0.3 4,-0.1 1,-0.3 52,-0.1 0.627 108.8 52.5 -72.5 -15.5 40.6 28.7 -28.8 72 188 B N T 3 S+ 0 0 1 79,-0.1 80,-2.6 47,-0.1 2,-0.4 0.038 99.6 74.9-104.3 22.0 37.8 27.3 -26.6 73 189 B L B < S-l 152 0B 2 -3,-1.8 -3,-0.3 78,-0.3 80,-0.2 -0.991 90.3-112.5-132.6 123.2 40.3 25.2 -24.5 74 190 B I - 0 0 7 78,-2.8 2,-0.2 -2,-0.4 -6,-0.1 -0.378 40.5-130.6 -50.1 120.8 42.6 26.8 -21.8 75 191 B R - 0 0 83 -2,-0.1 15,-2.5 -4,-0.1 2,-0.5 -0.564 7.9-130.9 -78.1 142.8 46.1 26.3 -23.3 76 192 B L E - F 0 89A 8 -8,-0.4 13,-0.3 -11,-0.4 -9,-0.2 -0.855 21.0-176.9 -91.2 126.0 48.9 24.8 -21.2 77 193 B Y E - 0 0 40 11,-2.5 -74,-2.1 -2,-0.5 2,-0.3 0.798 55.9 -58.1 -90.4 -37.8 52.2 26.9 -21.3 78 194 B G E -aF 3 88A 0 10,-1.7 10,-3.0 -76,-0.2 -1,-0.3 -0.973 46.1 -97.7 173.8-178.0 54.4 24.7 -19.2 79 195 B V E -aF 4 87A 0 -76,-2.0 -74,-3.3 -2,-0.3 2,-0.5 -0.858 12.5-143.2-127.1 153.7 55.2 22.9 -15.9 80 196 B V E - F 0 86A 0 6,-2.3 6,-1.7 -2,-0.3 -74,-0.1 -0.979 15.9-176.9-116.9 116.3 57.3 23.5 -12.8 81 197 B L + 0 0 3 -2,-0.5 4,-0.1 -76,-0.4 257,-0.1 0.470 52.7 97.7-102.2 -6.5 58.8 20.2 -11.6 82 198 B T S S- 0 0 44 2,-0.2 4,-0.1 1,-0.1 -2,-0.1 -0.617 91.6 -57.9 -73.0 143.1 60.6 21.5 -8.5 83 199 B P S S+ 0 0 62 0, 0.0 2,-0.1 0, 0.0 -38,-0.1 -0.506 127.0 38.7 -74.3 140.0 58.4 20.9 -5.4 84 200 B P S S- 0 0 68 0, 0.0 -2,-0.2 0, 0.0 -39,-0.1 0.642 98.2-136.4 -78.7 155.5 55.8 21.9 -5.0 85 201 B M - 0 0 7 -41,-0.3 -41,-2.0 -4,-0.1 2,-0.3 -0.364 20.0-163.7 -80.1 156.0 54.8 21.3 -8.6 86 202 B K E -EF 43 80A 12 -6,-1.7 -6,-2.3 -43,-0.2 2,-0.5 -1.000 20.1-145.9-142.3 136.8 52.8 23.7 -10.8 87 203 B M E -EF 42 79A 0 -45,-1.0 -45,-2.5 -2,-0.3 2,-0.5 -0.908 22.1-157.1 -91.2 126.6 50.8 23.7 -14.1 88 204 B V E +EF 41 78A 0 -10,-3.0 -11,-2.5 -2,-0.5 -10,-1.7 -0.899 25.7 158.6-108.0 123.0 51.2 27.1 -15.9 89 205 B T E -EF 40 76A 6 -49,-3.0 -49,-2.2 -2,-0.5 -13,-0.2 -0.887 45.1 -66.9-139.8 166.9 48.4 28.0 -18.3 90 206 B E E -E 39 0A 36 -15,-2.5 2,-0.5 -2,-0.3 -51,-0.2 -0.232 53.3-123.8 -46.4 139.1 46.5 30.7 -20.2 91 207 B L - 0 0 24 -53,-0.6 -1,-0.1 -52,-0.1 -53,-0.1 -0.829 11.2-156.0 -93.0 128.2 44.6 33.0 -17.9 92 208 B A > - 0 0 14 -2,-0.5 3,-0.6 1,-0.1 53,-0.2 -0.954 14.7-160.9 -93.4 112.4 40.9 33.5 -18.4 93 209 B P T 3 S+ 0 0 78 0, 0.0 52,-0.2 0, 0.0 -1,-0.1 0.726 79.5 54.8 -67.4 -25.0 40.6 37.0 -16.7 94 210 B L T 3 S- 0 0 81 50,-1.5 51,-0.2 1,-0.2 2,-0.1 0.657 96.2-141.1 -91.4 -13.4 36.8 36.9 -16.1 95 211 B G E < -M 144 0B 28 49,-0.7 49,-2.6 -3,-0.6 2,-0.3 -0.421 48.7 -3.0 89.5-165.2 36.5 33.7 -14.1 96 212 B S E >> -M 143 0B 20 47,-0.2 4,-1.8 1,-0.2 3,-0.6 -0.452 48.5-141.7 -78.6 133.8 33.9 31.0 -14.1 97 213 B L H 3> S+ 0 0 0 45,-2.6 4,-2.8 42,-0.3 5,-0.2 0.856 103.2 62.3 -46.8 -40.8 30.9 31.2 -16.3 98 214 B L H 3> S+ 0 0 14 41,-0.8 4,-1.1 44,-0.5 -1,-0.2 0.888 102.8 46.5 -65.8 -40.9 29.0 29.6 -13.4 99 215 B D H <> S+ 0 0 94 -3,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.889 112.6 52.0 -62.7 -38.1 29.7 32.5 -11.0 100 216 B R H X S+ 0 0 56 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.967 106.4 51.7 -66.8 -52.1 28.7 35.0 -13.7 101 217 B L H < S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.789 113.5 46.7 -47.3 -32.2 25.4 33.3 -14.4 102 218 B R H < S+ 0 0 114 -4,-1.1 3,-0.4 -5,-0.2 -2,-0.2 0.930 112.7 44.9 -85.8 -46.6 24.5 33.4 -10.7 103 219 B K H < S+ 0 0 150 -4,-2.1 2,-0.6 1,-0.2 -2,-0.2 0.942 124.6 31.2 -51.8 -52.6 25.5 37.0 -9.9 104 220 B H < + 0 0 104 -4,-2.4 4,-0.3 -5,-0.2 -1,-0.2 -0.687 65.9 155.1-131.0 78.7 23.8 38.4 -12.9 105 221 B Q S > S+ 0 0 104 -2,-0.6 3,-2.4 -3,-0.4 -1,-0.2 0.990 72.5 43.7 -71.3 -84.5 20.8 36.7 -14.3 106 222 B G T 3 S+ 0 0 75 1,-0.3 -1,-0.1 104,-0.0 -2,-0.1 0.819 100.7 82.0 -23.5 -64.0 18.5 39.1 -16.3 107 223 B H T 3 S+ 0 0 88 2,-0.0 2,-0.6 -6,-0.0 -1,-0.3 0.476 74.8 78.1 -3.9 -47.2 21.8 40.4 -17.9 108 224 B F < - 0 0 5 -3,-2.4 2,-0.0 -4,-0.3 102,-0.0 -0.780 68.8-147.6 -96.8 120.6 22.2 37.6 -20.4 109 225 B L > - 0 0 117 -2,-0.6 4,-1.3 1,-0.1 3,-0.4 -0.294 33.7-108.9 -66.7 165.6 20.2 37.6 -23.6 110 226 B L H > S+ 0 0 70 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.771 120.9 62.3 -68.5 -23.6 19.3 34.2 -25.0 111 227 B G H > S+ 0 0 20 2,-0.2 4,-1.1 3,-0.1 -1,-0.2 0.776 97.8 51.9 -71.9 -32.3 21.9 35.1 -27.7 112 228 B T H >> S+ 0 0 27 -3,-0.4 4,-1.7 2,-0.2 3,-0.6 0.979 111.0 48.3 -64.9 -56.2 24.9 35.3 -25.3 113 229 B L H 3X S+ 0 0 0 -4,-1.3 4,-2.2 1,-0.2 -2,-0.2 0.884 111.1 48.8 -49.9 -48.4 24.2 31.9 -23.8 114 230 B S H 3X S+ 0 0 6 -4,-1.6 4,-2.0 1,-0.3 -1,-0.2 0.797 107.9 53.6 -71.4 -26.2 23.8 30.1 -27.2 115 231 B R H S+ 0 0 2 -4,-1.7 5,-2.8 2,-0.2 -2,-0.2 0.859 113.5 49.2 -66.1 -37.6 38.4 16.8 -28.1 128 244 B E H ><5S+ 0 0 46 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.939 110.8 50.0 -67.7 -46.2 36.2 14.3 -29.8 129 245 B S H 3<5S+ 0 0 86 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.700 110.3 49.9 -64.1 -26.9 38.3 14.6 -33.0 130 246 B K T 3<5S- 0 0 110 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.261 119.8-113.6 -92.0 10.6 41.5 14.1 -31.0 131 247 B R T < 5 + 0 0 86 -3,-1.6 30,-2.4 1,-0.2 2,-0.2 0.575 69.1 139.2 76.0 9.6 39.9 11.0 -29.4 132 248 B F E < -O 160 0C 32 -5,-2.8 2,-0.4 28,-0.2 28,-0.2 -0.583 41.1-153.3 -90.4 144.3 39.7 12.5 -25.8 133 249 B I E -O 159 0C 0 26,-3.0 26,-2.9 -2,-0.2 60,-0.1 -0.982 4.8-158.3-117.8 135.3 36.8 12.0 -23.5 134 250 B H - 0 0 0 -2,-0.4 23,-0.3 24,-0.2 -1,-0.1 0.869 8.6-171.8 -88.9 -43.4 36.5 14.8 -20.9 135 251 B R S S+ 0 0 0 57,-0.1 -1,-0.1 1,-0.1 23,-0.1 0.338 71.3 58.3 72.9 -2.1 34.4 13.1 -18.2 136 252 B D + 0 0 13 18,-0.1 2,-0.5 40,-0.1 -1,-0.1 -0.064 61.6 156.0-150.2 39.4 33.8 16.3 -16.1 137 253 B L + 0 0 0 43,-0.1 2,-0.3 3,-0.1 65,-0.1 -0.615 21.4 133.5 -82.8 117.3 32.0 18.8 -18.3 138 254 B A > - 0 0 0 -2,-0.5 3,-2.0 65,-0.1 -40,-0.1 -0.969 68.3 -99.8-157.4 159.3 30.1 21.3 -16.2 139 255 B A G > S+ 0 0 0 -2,-0.3 3,-1.9 1,-0.3 -41,-0.8 0.821 116.5 64.9 -58.1 -34.7 29.6 25.0 -15.9 140 256 B R G 3 S+ 0 0 84 1,-0.3 -1,-0.3 -43,-0.1 -41,-0.1 0.715 102.9 52.7 -55.3 -20.8 32.1 25.3 -13.0 141 257 B N G < S+ 0 0 21 -3,-2.0 12,-2.8 -45,-0.1 13,-0.7 0.332 88.9 94.3-101.2 11.0 34.6 24.3 -15.5 142 258 B L E < - N 0 152B 0 -3,-1.9 -45,-2.6 10,-0.2 -44,-0.5 -0.888 58.6-162.2-106.8 124.4 33.8 26.9 -18.2 143 259 B L E -MN 96 151B 41 8,-4.3 8,-3.3 -2,-0.5 2,-0.5 -0.837 15.1-135.4-108.9 149.9 35.8 30.0 -18.1 144 260 B L E +MN 95 150B 0 -49,-2.6 -50,-1.5 -2,-0.3 -49,-0.7 -0.924 19.8 175.1 -98.3 123.5 35.2 33.5 -19.6 145 261 B A E S- 0 0 16 4,-3.0 2,-0.3 -2,-0.5 -1,-0.2 0.802 80.4 -9.5 -88.7 -44.8 38.3 35.0 -21.3 146 262 B T E > S- N 0 149B 64 3,-1.1 3,-1.1 -53,-0.1 -1,-0.4 -0.870 86.0 -88.7-136.0 177.0 36.1 37.9 -22.5 147 263 B R T 3 S+ 0 0 108 -2,-0.3 3,-0.0 1,-0.2 0, 0.0 0.788 130.7 38.6 -56.7 -24.7 32.4 38.7 -22.4 148 264 B D T 3 S+ 0 0 99 1,-0.1 2,-0.5 -33,-0.0 -1,-0.2 0.416 108.2 71.2-101.5 -4.4 32.2 36.9 -26.0 149 265 B L E < - N 0 146B 36 -3,-1.1 -4,-3.0 2,-0.0 -3,-1.1 -0.938 53.6-176.0-133.4 116.0 34.7 34.0 -25.4 150 266 B V E - N 0 144B 2 -2,-0.5 2,-0.4 -6,-0.2 -6,-0.2 -0.844 5.0-168.6-109.9 141.7 34.3 30.9 -23.3 151 267 B K E - N 0 143B 17 -8,-3.3 -8,-4.3 -2,-0.4 2,-0.5 -0.991 29.8-122.1-130.0 137.7 36.9 28.3 -22.7 152 268 B I E -lN 73 142B 2 -80,-2.6 -78,-2.8 -2,-0.4 -10,-0.2 -0.704 37.1-176.7 -66.7 120.8 36.7 24.8 -21.1 153 269 B G + 0 0 13 -12,-2.8 2,-0.4 -2,-0.5 -11,-0.1 0.388 49.9 60.5-114.0 0.1 39.3 25.5 -18.4 154 270 B D + 0 0 13 -13,-0.7 -18,-0.1 1,-0.1 -1,-0.1 -0.996 35.6 164.8-132.4 146.4 39.7 22.2 -16.6 155 271 B F > + 0 0 3 -2,-0.4 3,-1.8 3,-0.1 -91,-0.1 -0.049 31.9 134.0-142.8 20.8 40.8 18.7 -17.8 156 272 B G T 3 S+ 0 0 16 1,-0.3 -95,-0.1 -20,-0.1 -21,-0.1 0.653 84.2 30.0 -48.1 -26.5 41.5 17.0 -14.5 157 273 B L T 3 S+ 0 0 25 -23,-0.3 -1,-0.3 -96,-0.1 2,-0.2 0.174 87.8 135.2-117.6 11.1 39.6 13.8 -15.5 158 274 B M < - 0 0 5 -3,-1.8 2,-0.4 -22,-0.1 -24,-0.2 -0.459 32.5-171.7 -72.5 130.7 40.3 13.9 -19.2 159 275 B R E -O 133 0C 57 -26,-2.9 -26,-3.0 -2,-0.2 2,-0.3 -0.982 25.4-127.1-123.9 134.9 41.3 10.6 -20.7 160 276 B A E -O 132 0C 53 -2,-0.4 -28,-0.2 -28,-0.2 -29,-0.1 -0.585 34.6-123.6 -57.9 123.1 42.5 9.6 -24.2 161 277 B L - 0 0 7 -30,-2.4 7,-0.1 -2,-0.3 4,-0.1 -0.602 34.9-107.9 -66.3 137.3 40.3 6.7 -25.5 162 278 B P > - 0 0 64 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 -0.118 34.2 -92.5 -63.1 166.1 42.5 3.6 -26.3 163 279 B Q T 3 S+ 0 0 166 1,-0.3 2,-0.8 3,-0.0 -2,-0.1 0.903 115.8 27.7 -45.0 -64.6 43.2 2.5 -29.8 164 280 B N T 3 S+ 0 0 148 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 -0.802 107.1 64.6-111.3 86.5 40.4 -0.0 -30.2 165 281 B D < - 0 0 80 -2,-0.8 3,-0.0 -3,-0.6 -4,-0.0 -0.887 54.7-145.9-178.9 173.5 37.5 0.9 -28.1 166 282 B D S S+ 0 0 85 -2,-0.2 2,-0.3 -5,-0.0 27,-0.3 0.247 80.7 61.7-131.6 5.6 34.8 3.5 -27.4 167 283 B H - 0 0 71 25,-0.1 2,-0.3 26,-0.1 25,-0.2 -0.917 53.4-164.8-123.8 159.7 34.6 3.3 -23.6 168 284 B X E -P 191 0D 27 23,-1.9 23,-2.0 -2,-0.3 2,-0.5 -0.965 20.2-141.9-130.4 137.0 37.0 3.9 -20.6 169 285 B V E -P 190 0D 91 -2,-0.3 21,-0.2 21,-0.2 2,-0.2 -0.940 19.6-129.2-109.0 125.0 36.0 2.6 -17.2 170 286 B M - 0 0 9 19,-2.3 -2,-0.0 -2,-0.5 20,-0.0 -0.455 19.9-112.3 -83.7 135.4 36.8 4.8 -14.2 171 287 B Q > - 0 0 102 -2,-0.2 3,-0.9 1,-0.1 -1,-0.1 -0.150 32.8-107.6 -64.1 158.7 38.7 3.6 -11.1 172 288 B E T 3 S+ 0 0 175 1,-0.2 -1,-0.1 3,-0.0 -2,-0.1 0.622 105.7 65.4 -71.1 -13.3 36.7 3.5 -7.9 173 289 B H T 3 S+ 0 0 113 2,-0.0 2,-0.5 0, 0.0 -1,-0.2 0.620 83.6 78.7 -91.8 -18.7 38.4 6.5 -6.0 174 290 B R < - 0 0 19 -3,-0.9 2,-0.4 -17,-0.0 -4,-0.0 -0.795 61.5-166.0 -85.8 132.9 37.3 9.3 -8.2 175 291 B K - 0 0 165 -2,-0.5 -2,-0.0 2,-0.0 -3,-0.0 -0.928 2.9-161.5-105.8 138.7 33.7 10.5 -7.7 176 292 B V - 0 0 8 -2,-0.4 2,-0.3 0, 0.0 -40,-0.1 -0.898 43.7 -91.2-104.1 148.6 32.2 12.8 -10.3 177 293 B P > - 0 0 56 0, 0.0 3,-1.3 0, 0.0 4,-0.4 -0.505 38.2-138.3 -58.7 120.7 29.2 14.7 -9.1 178 294 B F G > S+ 0 0 91 -2,-0.3 3,-1.3 1,-0.2 8,-0.1 0.750 90.2 74.1 -50.0 -36.4 26.4 12.3 -10.1 179 295 B A G 3 S+ 0 0 8 1,-0.3 -1,-0.2 35,-0.2 36,-0.1 0.738 99.9 43.0 -66.4 -17.2 24.0 15.0 -11.3 180 296 B W G < S+ 0 0 20 -3,-1.3 -1,-0.3 34,-0.1 2,-0.3 0.572 95.3 109.1 -96.1 -10.2 25.9 15.6 -14.6 181 297 B C < - 0 0 5 -3,-1.3 15,-0.1 -4,-0.4 5,-0.1 -0.485 69.5-120.2 -81.5 136.3 26.5 11.8 -15.3 182 298 B A > - 0 0 0 -2,-0.3 4,-2.2 13,-0.2 5,-0.2 -0.256 35.6-105.9 -58.6 153.8 24.9 9.7 -18.0 183 299 B P H >> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 3,-1.2 0.957 121.2 49.5 -47.0 -64.2 22.9 6.7 -16.7 184 300 B E H >> S+ 0 0 19 1,-0.3 4,-2.2 70,-0.2 3,-1.2 0.870 108.0 53.7 -39.1 -61.8 25.7 4.2 -17.7 185 301 B S H 3> S+ 0 0 7 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.843 111.9 45.2 -47.7 -40.0 28.3 6.3 -16.0 186 302 B L H << S+ 0 0 33 -4,-2.2 -1,-0.3 -3,-1.2 -2,-0.2 0.877 118.1 44.2 -67.8 -36.1 26.2 6.1 -12.9 187 303 B K H << S+ 0 0 101 -4,-2.3 -2,-0.2 -3,-1.2 -3,-0.2 0.975 137.5 0.2 -75.5 -60.4 25.6 2.3 -13.3 188 304 B T H < S- 0 0 76 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 -0.040 91.9-106.9-132.0 37.6 29.0 1.0 -14.2 189 305 B R < + 0 0 82 -4,-1.9 -19,-2.3 -5,-0.4 2,-0.4 0.732 66.0 155.2 47.9 29.4 31.5 3.9 -14.4 190 306 B T E -P 169 0D 25 -6,-0.3 2,-0.4 -21,-0.2 -21,-0.2 -0.770 20.0-175.4 -86.1 133.6 31.5 3.7 -18.1 191 307 B F E +P 168 0D 7 -23,-2.0 -23,-1.9 -2,-0.4 2,-0.3 -0.988 12.9 150.3-139.3 137.6 32.4 6.9 -20.0 192 308 B S >> - 0 0 12 -2,-0.4 3,-2.1 -25,-0.2 4,-1.3 -0.847 63.2 -84.1-156.2 171.4 32.4 7.5 -23.9 193 309 B H H 3> S+ 0 0 37 1,-0.3 4,-2.1 -27,-0.3 5,-0.1 0.757 128.1 60.8 -56.9 -31.4 31.9 10.5 -26.2 194 310 B A H 34 S+ 0 0 21 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.654 100.4 51.2 -72.5 -19.1 28.3 9.9 -25.8 195 311 B S H <> S+ 0 0 0 -3,-2.1 4,-1.8 2,-0.2 3,-0.4 0.798 107.4 53.4 -90.7 -23.0 28.4 10.4 -22.1 196 312 B D H X S+ 0 0 1 -4,-1.3 4,-2.8 1,-0.2 5,-0.2 0.945 103.9 57.1 -67.1 -47.2 30.2 13.7 -22.6 197 313 B T H X S+ 0 0 1 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.720 106.3 50.0 -43.5 -32.0 27.3 14.6 -24.9 198 314 B W H > S+ 0 0 7 -3,-0.4 4,-0.9 -4,-0.4 -1,-0.2 0.896 109.7 49.7 -79.9 -44.1 25.0 14.0 -21.9 199 315 B M H >X S+ 0 0 2 -4,-1.8 4,-2.4 2,-0.2 3,-0.7 0.876 107.1 54.2 -59.1 -46.4 27.1 16.2 -19.7 200 316 B F H 3X S+ 0 0 0 -4,-2.8 4,-4.1 1,-0.2 5,-0.2 0.947 105.2 56.0 -51.6 -49.2 27.0 19.0 -22.3 201 317 B G H 3X S+ 0 0 0 -4,-1.2 4,-0.9 1,-0.2 -1,-0.2 0.780 110.9 42.7 -55.4 -29.8 23.2 18.7 -22.2 202 318 B V H S+ 0 0 2 -4,-1.9 5,-3.3 2,-0.2 3,-0.4 0.839 108.9 51.9 -64.2 -41.3 22.9 25.1 -16.1 207 323 B M H ><5S+ 0 0 0 -4,-2.3 3,-1.9 3,-0.2 -2,-0.2 0.972 110.7 46.2 -55.9 -52.5 23.5 27.9 -18.6 208 324 B F T 3<5S+ 0 0 5 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.398 112.4 48.8 -84.6 2.2 19.8 28.4 -19.3 209 325 B T T 3 5S- 0 0 15 -4,-0.4 -1,-0.3 -3,-0.4 3,-0.2 0.102 114.1-118.3-112.0 9.5 18.7 28.4 -15.6 210 326 B Y T < 5S- 0 0 42 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.877 81.7 -30.2 48.6 42.1 21.5 30.9 -14.9 211 327 B G S - 0 0 92 -4,-0.1 3,-1.4 1,-0.0 -1,-0.1 -0.800 30.9-121.7 -91.9 121.4 22.1 23.0 -9.4 214 330 B P T 3 S- 0 0 0 0, 0.0 -35,-0.2 0, 0.0 3,-0.1 -0.352 88.6 -6.7 -69.0 138.8 20.8 20.0 -11.3 215 331 B W T > S- 0 0 31 1,-0.1 3,-1.6 -36,-0.1 8,-0.1 0.764 89.5-161.4 39.5 45.4 18.9 17.5 -9.1 216 332 B I T < + 0 0 116 -3,-1.4 -1,-0.1 1,-0.2 3,-0.1 -0.109 67.7 16.8 -45.5 137.6 19.8 19.5 -6.0 217 333 B G T 3 S+ 0 0 73 1,-0.2 -1,-0.2 -3,-0.1 2,-0.1 0.085 98.4 114.5 94.1 -25.0 19.5 17.5 -2.8 218 334 B L < - 0 0 58 -3,-1.6 -1,-0.2 1,-0.1 2,-0.2 -0.428 56.2-137.9 -90.6 150.8 19.4 14.1 -4.4 219 335 B N > - 0 0 84 -2,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.540 38.1 -85.1 -94.4 171.7 22.1 11.4 -4.0 220 336 B G H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.754 126.3 42.1 -36.0 -38.8 23.6 9.1 -6.6 221 337 B S H > S+ 0 0 90 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.887 110.7 53.8 -86.9 -45.0 20.8 6.4 -6.4 222 338 B Q H > S+ 0 0 89 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.919 112.1 47.7 -49.9 -44.7 18.0 8.8 -6.2 223 339 B I H X S+ 0 0 4 -4,-2.6 4,-3.9 1,-0.2 5,-0.4 0.956 110.7 49.1 -68.2 -50.8 19.5 10.3 -9.4 224 340 B L H X>S+ 0 0 42 -4,-2.0 4,-3.8 2,-0.2 5,-0.9 0.912 109.1 53.6 -47.6 -45.6 19.9 7.0 -11.2 225 341 B H H X>S+ 0 0 98 -4,-3.2 5,-3.1 3,-0.2 4,-1.0 0.977 114.1 42.7 -61.7 -51.8 16.3 6.0 -10.3 226 342 B K H <5S+ 0 0 64 -4,-2.2 6,-2.0 1,-0.2 5,-0.5 0.953 125.3 32.7 -53.4 -55.0 15.0 9.2 -11.9 227 343 B I H <5S+ 0 0 2 -4,-3.9 -1,-0.2 4,-0.2 -2,-0.2 0.800 132.3 28.5 -83.8 -22.2 17.2 9.1 -14.9 228 344 B D H <5S+ 0 0 25 -4,-3.8 -3,-0.2 -5,-0.4 -2,-0.1 0.896 129.0 26.3 -99.5 -52.0 17.4 5.3 -15.4 229 345 B K T < - 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0 0 6 0, 0.0 3,-3.1 0, 0.0 -28,-0.1 -0.492 37.6 -91.7 -61.8 134.7 100.2 4.3 -12.9 513 354 A E T 3 S+ 0 0 180 1,-0.3 0, 0.0 -2,-0.2 0, 0.0 -0.271 115.1 7.3 -46.7 113.5 102.9 2.8 -15.1 514 355 A D T 3 S+ 0 0 126 1,-0.3 -1,-0.3 -3,-0.1 -30,-0.0 0.459 89.0 139.9 87.7 7.0 104.1 5.7 -17.2 515 356 A C < - 0 0 1 -3,-3.1 -1,-0.3 1,-0.0 2,-0.1 -0.705 56.3-120.8 -75.3 122.8 102.2 8.5 -15.4 516 357 A P >> - 0 0 39 0, 0.0 4,-2.0 0, 0.0 3,-1.0 -0.389 16.7-120.4 -60.5 142.2 104.5 11.5 -15.1 517 358 A Q H 3> S+ 0 0 114 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.836 113.4 69.0 -49.9 -40.4 105.1 12.6 -11.5 518 359 A D H 3> S+ 0 0 82 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.914 106.6 35.1 -35.6 -58.7 103.6 15.8 -12.6 519 360 A I H <> S+ 0 0 10 -3,-1.0 4,-1.6 2,-0.2 3,-0.3 0.860 113.2 56.3 -78.7 -41.8 100.2 14.2 -13.0 520 361 A Y H X S+ 0 0 37 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.869 101.0 61.4 -57.8 -37.5 100.4 11.8 -10.0 521 362 A N H X S+ 0 0 68 -4,-2.9 4,-2.6 -5,-0.3 -1,-0.2 0.942 100.4 52.8 -54.4 -44.6 101.0 14.8 -7.9 522 363 A V H X S+ 0 0 2 -4,-0.9 4,-1.5 -3,-0.3 -2,-0.2 0.930 107.5 51.5 -58.7 -43.9 97.6 16.1 -8.9 523 364 A M H >X S+ 0 0 0 -4,-1.6 4,-1.3 2,-0.2 3,-0.9 0.955 109.2 51.4 -52.4 -49.3 96.0 12.9 -7.8 524 365 A V H >< S+ 0 0 55 -4,-2.5 3,-1.1 1,-0.3 -2,-0.2 0.924 106.1 52.2 -58.6 -52.4 97.8 13.1 -4.5 525 366 A Q H >< S+ 0 0 68 -4,-2.6 3,-0.8 1,-0.3 -1,-0.3 0.791 108.4 54.1 -48.3 -33.8 96.6 16.6 -3.9 526 367 A C H << S+ 0 0 0 -4,-1.5 -1,-0.3 -3,-0.9 -2,-0.2 0.780 106.3 54.1 -73.8 -26.7 93.0 15.2 -4.6 527 368 A W T << + 0 0 4 -4,-1.3 -1,-0.2 -3,-1.1 -2,-0.2 0.080 70.0 142.6 -99.6 24.4 93.5 12.6 -1.9 528 369 A A < - 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