==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 28-OCT-00 1G4U . COMPND 2 MOLECULE: PROTEIN TYROSINE PHOSPHATASE SPTP; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR C.E.STEBBINS,J.E.GALAN . 540 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25007.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 385 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 29 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 1 1 0 2 3 2 3 2 1 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 2 1 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 PARALLEL BRIDGES PER LADDER . 1 1 0 1 0 1 1 0 1 1 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 0 0 1 0 0 1 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 1 167 S S > 0 0 85 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -20.2 -45.7 46.6 -55.9 2 168 S K H > + 0 0 111 2,-0.2 4,-0.8 1,-0.2 5,-0.1 0.878 360.0 49.3 -71.4 -36.7 -43.3 45.5 -53.2 3 169 S Q H > S+ 0 0 70 1,-0.2 4,-1.6 2,-0.2 3,-0.4 0.923 109.6 49.9 -71.1 -41.6 -41.1 48.6 -53.8 4 170 S P H > S+ 0 0 53 0, 0.0 4,-1.7 0, 0.0 -2,-0.2 0.916 110.8 47.8 -67.4 -35.1 -44.0 51.0 -53.6 5 171 S L H X S+ 0 0 7 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.713 106.4 60.0 -77.0 -11.3 -45.4 49.6 -50.3 6 172 S L H X S+ 0 0 17 -4,-0.8 4,-2.0 -3,-0.4 -1,-0.2 0.888 107.2 45.4 -75.2 -39.8 -41.9 49.8 -48.9 7 173 S D H X S+ 0 0 51 -4,-1.6 4,-1.9 2,-0.2 5,-0.2 0.791 107.5 57.6 -73.7 -28.3 -41.9 53.5 -49.6 8 174 S I H X S+ 0 0 23 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.935 109.4 46.8 -66.3 -42.3 -45.5 53.9 -48.1 9 175 S A H X S+ 0 0 5 -4,-1.5 4,-2.2 2,-0.2 5,-0.3 0.919 110.6 50.7 -65.9 -45.0 -44.0 52.4 -44.9 10 176 S L H X S+ 0 0 3 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.965 114.4 41.9 -58.5 -55.2 -40.9 54.6 -44.8 11 177 S K H X S+ 0 0 95 -4,-1.9 4,-0.8 1,-0.2 -1,-0.2 0.833 113.7 56.1 -62.8 -30.6 -42.7 57.9 -45.2 12 178 S G H X S+ 0 0 1 -4,-1.7 4,-2.2 -5,-0.2 5,-0.2 0.876 109.9 41.3 -69.5 -41.5 -45.4 56.8 -42.8 13 179 S L H X S+ 0 0 4 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.871 105.3 66.3 -73.4 -38.0 -43.1 56.0 -39.9 14 180 S K H < S+ 0 0 101 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.826 119.4 21.5 -53.5 -32.6 -41.0 59.1 -40.5 15 181 S R H < S+ 0 0 110 -4,-0.8 4,-0.5 -3,-0.2 -1,-0.2 0.715 122.0 54.2-109.6 -25.6 -44.0 61.2 -39.5 16 182 S T H >X S+ 0 0 0 -4,-2.2 4,-1.5 -5,-0.2 3,-1.1 0.956 103.2 57.4 -72.7 -48.8 -46.2 58.9 -37.5 17 183 S L H 3X S+ 0 0 2 -4,-1.6 4,-1.5 1,-0.3 -1,-0.1 0.814 100.6 52.5 -53.3 -45.3 -43.5 57.9 -34.9 18 184 S P H 3> S+ 0 0 55 0, 0.0 4,-0.5 0, 0.0 -1,-0.3 0.789 107.2 58.3 -66.3 -20.8 -42.6 61.4 -33.6 19 185 S Q H X4 S+ 0 0 94 -3,-1.1 3,-1.4 -4,-0.5 -2,-0.2 0.946 103.3 48.1 -71.9 -47.7 -46.3 61.9 -33.0 20 186 S L H >< S+ 0 0 0 -4,-1.5 3,-1.4 1,-0.3 -1,-0.2 0.831 105.4 62.7 -61.9 -28.2 -46.6 58.9 -30.7 21 187 S E H 3< S+ 0 0 36 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.712 101.6 50.9 -67.7 -21.4 -43.5 60.2 -28.8 22 188 S Q T << S+ 0 0 159 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.231 81.5 130.2-100.6 13.5 -45.4 63.4 -27.9 23 189 S M < - 0 0 10 -3,-1.4 2,-0.3 81,-0.1 3,-0.1 -0.366 36.3-167.7 -68.2 144.5 -48.5 61.6 -26.4 24 190 S D > - 0 0 111 1,-0.1 4,-1.7 -2,-0.0 5,-0.2 -0.972 28.2-120.0-128.5 146.6 -49.8 62.7 -22.9 25 191 S G H > S+ 0 0 15 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.917 107.9 44.1 -52.1 -51.6 -52.3 60.8 -20.9 26 192 S N H > S+ 0 0 114 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.910 113.4 48.5 -63.5 -46.0 -55.0 63.5 -20.6 27 193 S S H 4 S+ 0 0 67 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.797 116.8 47.6 -64.0 -29.2 -54.9 64.6 -24.2 28 194 S L H >X S+ 0 0 3 -4,-1.7 4,-1.9 2,-0.2 3,-1.5 0.929 103.6 54.9 -79.1 -49.3 -55.1 60.9 -25.1 29 195 S R H 3< S+ 0 0 78 -4,-3.1 4,-0.2 1,-0.3 -2,-0.2 0.882 114.7 46.3 -51.0 -36.2 -58.0 59.8 -22.9 30 196 S E T 3< S+ 0 0 128 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.585 125.6 27.6 -80.8 -18.1 -59.9 62.6 -24.6 31 197 S N T <> S+ 0 0 52 -3,-1.5 4,-1.9 -4,-0.3 3,-0.5 0.274 79.1 113.6-132.3 13.8 -58.8 61.8 -28.2 32 198 S F H X S+ 0 0 6 -4,-1.9 4,-1.9 1,-0.2 -3,-0.1 0.895 77.5 55.8 -53.6 -46.1 -58.1 58.0 -28.4 33 199 S Q H 4 S+ 0 0 65 1,-0.2 -1,-0.2 -4,-0.2 7,-0.1 0.854 108.9 47.1 -57.5 -38.9 -61.0 57.3 -30.7 34 200 S E H >4 S+ 0 0 80 -3,-0.5 3,-1.5 1,-0.2 6,-0.4 0.917 111.8 50.0 -69.1 -43.9 -59.7 59.8 -33.3 35 201 S M H 3< S+ 0 0 37 -4,-1.9 8,-2.1 1,-0.3 7,-0.7 0.779 112.4 49.2 -64.5 -27.6 -56.1 58.5 -33.0 36 202 S A T 3< S+ 0 0 0 -4,-1.9 48,-0.4 6,-0.2 2,-0.3 0.041 109.9 56.7-101.3 23.1 -57.4 55.0 -33.6 37 203 S S S X S- 0 0 33 -3,-1.5 3,-2.1 46,-0.2 338,-0.2 -0.974 99.4 -9.0-149.7 162.7 -59.6 55.7 -36.6 38 204 S G T 3 S- 0 0 18 336,-2.2 384,-0.1 -2,-0.3 337,-0.1 -0.270 126.8 -17.0 55.4-123.4 -59.4 57.1 -40.1 39 205 S N T 3 S+ 0 0 80 384,-0.1 -1,-0.2 335,-0.1 -4,-0.1 0.063 97.7 136.8-100.5 21.7 -56.0 58.8 -40.8 40 206 S G <> - 0 0 11 -3,-2.1 4,-2.7 -6,-0.4 5,-0.3 -0.350 64.3-112.0 -69.1 153.5 -55.0 59.0 -37.1 41 207 S P H > S+ 0 0 24 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.809 110.3 49.6 -53.9 -43.8 -51.4 58.1 -36.0 42 208 S L H > S+ 0 0 4 -7,-0.7 4,-1.8 2,-0.2 -6,-0.2 0.957 119.5 35.4 -65.3 -51.7 -52.1 55.0 -34.0 43 209 S R H > S+ 0 0 31 -8,-2.1 4,-2.1 2,-0.2 5,-0.2 0.956 118.8 51.0 -67.3 -47.2 -54.3 53.3 -36.6 44 210 S S H X S+ 0 0 1 -4,-2.7 4,-1.9 -9,-0.4 -1,-0.2 0.889 109.3 52.4 -57.7 -39.7 -52.2 54.6 -39.6 45 211 S L H X S+ 0 0 0 -4,-2.1 4,-1.7 -5,-0.3 -1,-0.2 0.922 108.0 49.3 -64.1 -44.8 -49.0 53.3 -37.9 46 212 S M H X S+ 0 0 9 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.864 109.9 52.8 -62.8 -34.9 -50.3 49.8 -37.4 47 213 S T H X S+ 0 0 2 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.905 106.0 52.5 -67.0 -42.1 -51.5 49.6 -41.1 48 214 S N H >< S+ 0 0 1 -4,-1.9 3,-1.0 1,-0.2 4,-0.4 0.875 106.7 53.2 -60.9 -41.9 -48.0 50.7 -42.4 49 215 S L H >< S+ 0 0 9 -4,-1.7 3,-1.3 1,-0.2 4,-0.4 0.856 97.4 65.4 -65.0 -31.1 -46.4 47.9 -40.4 50 216 S Q H >< S+ 0 0 58 -4,-1.3 3,-1.5 1,-0.3 4,-0.4 0.771 85.0 77.3 -60.6 -24.5 -48.7 45.3 -41.9 51 217 S N G X< S+ 0 0 0 -3,-1.0 3,-1.5 -4,-0.6 -1,-0.3 0.863 87.1 57.1 -52.2 -40.5 -47.0 46.1 -45.3 52 218 S L G X S+ 0 0 4 -3,-1.3 3,-0.9 -4,-0.4 -1,-0.3 0.689 92.5 68.4 -68.3 -17.8 -44.0 44.0 -44.3 53 219 S N G < S+ 0 0 93 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.660 95.0 58.1 -75.9 -14.6 -46.2 40.9 -43.8 54 220 S K G < S+ 0 0 70 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.2 0.541 93.0 75.8 -89.1 -9.9 -46.8 40.9 -47.6 55 221 S I X - 0 0 9 -3,-0.9 3,-2.5 -4,-0.2 -1,-0.1 -0.811 59.5-167.0-110.5 95.1 -43.0 40.6 -48.4 56 222 S P G > S+ 0 0 106 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.766 88.4 62.0 -46.9 -31.0 -41.5 37.1 -47.9 57 223 S E G 3 S+ 0 0 109 1,-0.3 3,-0.4 2,-0.1 4,-0.2 0.740 93.6 62.4 -69.8 -23.7 -38.0 38.6 -48.2 58 224 S A G <> + 0 0 3 -3,-2.5 4,-2.8 -6,-0.2 3,-0.3 0.183 66.8 127.5 -88.8 19.3 -38.5 40.8 -45.2 59 225 S K H <> S+ 0 0 114 -3,-1.1 4,-2.3 1,-0.2 5,-0.2 0.867 71.1 47.1 -39.9 -56.3 -39.0 37.7 -43.0 60 226 S Q H > S+ 0 0 29 -3,-0.4 4,-1.4 71,-0.3 -1,-0.2 0.918 114.5 45.6 -57.0 -47.5 -36.3 38.8 -40.5 61 227 S L H > S+ 0 0 3 -3,-0.3 4,-2.1 70,-0.3 -1,-0.2 0.842 111.5 54.6 -66.0 -33.2 -37.6 42.3 -40.1 62 228 S N H X S+ 0 0 23 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.887 104.6 51.2 -69.7 -40.3 -41.2 41.0 -39.9 63 229 S D H X S+ 0 0 41 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.885 110.2 52.7 -63.1 -36.6 -40.5 38.7 -36.9 64 230 S Y H X S+ 0 0 4 -4,-1.4 4,-1.7 -5,-0.2 -2,-0.2 0.939 111.8 43.5 -61.2 -51.3 -38.9 41.7 -35.2 65 231 S V H X S+ 0 0 6 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.938 109.7 56.1 -61.7 -50.8 -42.0 43.8 -35.7 66 232 S T H X S+ 0 0 59 -4,-2.8 4,-0.5 1,-0.2 -1,-0.2 0.882 105.7 53.0 -51.1 -42.2 -44.4 41.0 -34.7 67 233 S T H >< S+ 0 0 23 -4,-1.8 3,-1.1 -5,-0.2 -1,-0.2 0.956 110.7 46.1 -60.3 -49.5 -42.5 40.8 -31.4 68 234 S L H >< S+ 0 0 0 -4,-1.7 3,-1.2 1,-0.2 10,-0.2 0.902 111.4 51.2 -60.0 -42.7 -42.9 44.5 -30.6 69 235 S T H 3< S+ 0 0 17 -4,-2.7 10,-2.0 1,-0.2 -1,-0.2 0.484 104.8 58.0 -78.1 0.7 -46.6 44.6 -31.6 70 236 S N T << S+ 0 0 74 -3,-1.1 -1,-0.2 -4,-0.5 2,-0.2 0.357 77.3 115.8-108.3 4.6 -47.4 41.6 -29.3 71 237 S I S < S- 0 0 2 -3,-1.2 7,-2.3 -4,-0.2 2,-0.3 -0.517 74.4-111.8 -74.4 139.5 -46.0 43.3 -26.1 72 238 S Q B +A 77 0A 84 89,-1.9 5,-0.2 5,-0.2 -1,-0.1 -0.579 44.2 163.5 -75.8 129.6 -48.8 43.9 -23.5 73 239 S V S S- 0 0 10 3,-2.7 -1,-0.2 -2,-0.3 4,-0.1 0.768 73.9 -5.7-113.7 -54.4 -49.5 47.6 -23.0 74 240 S G S S- 0 0 18 2,-0.7 4,-0.1 29,-0.1 -2,-0.1 0.539 126.1 -50.1-101.3 -97.3 -52.8 48.0 -21.2 75 241 S V S S+ 0 0 85 2,-0.1 2,-0.3 -3,-0.0 -3,-0.1 -0.051 126.4 62.6-125.7 24.1 -54.5 44.6 -20.8 76 242 S A S S- 0 0 8 -5,-0.1 -3,-2.7 11,-0.0 -2,-0.7 -0.917 95.0 -82.3-144.8 166.6 -54.0 43.9 -24.5 77 243 S R B > -A 72 0A 84 -2,-0.3 3,-2.5 -5,-0.2 4,-0.3 -0.462 46.6-113.2 -69.3 144.4 -51.2 43.5 -27.2 78 244 S F G > S+ 0 0 2 -7,-2.3 3,-2.1 1,-0.3 -8,-0.2 0.829 114.0 66.6 -47.1 -37.4 -49.9 46.8 -28.5 79 245 S S G > S+ 0 0 16 -10,-2.0 3,-1.0 1,-0.3 -1,-0.3 0.696 89.5 63.9 -61.5 -21.6 -51.4 46.0 -31.9 80 246 S Q G X S+ 0 0 12 -3,-2.5 3,-0.7 1,-0.2 8,-0.4 0.497 85.0 75.2 -83.6 -1.5 -55.0 46.3 -30.5 81 247 S W G < S+ 0 0 3 -3,-2.1 -1,-0.2 -4,-0.3 -2,-0.2 0.351 80.1 75.1 -84.7 3.1 -54.3 50.0 -29.7 82 248 S G G < S+ 0 0 0 -3,-1.0 2,-0.3 -39,-0.1 -1,-0.2 0.405 91.1 62.4 -96.9 5.7 -54.8 50.7 -33.5 83 249 S T < - 0 0 29 -3,-0.7 3,-0.3 -46,-0.0 6,-0.3 -0.915 68.6-132.1-133.5 158.8 -58.5 50.3 -33.4 84 250 S C S S+ 0 0 23 -48,-0.4 3,-0.1 -2,-0.3 4,-0.1 -0.546 79.0 29.0-102.9 166.9 -61.7 51.8 -32.0 85 251 S G S S+ 0 0 57 1,-0.2 -1,-0.2 -2,-0.2 2,-0.1 0.557 99.4 90.4 63.7 12.5 -64.8 50.3 -30.2 86 252 S G S > S- 0 0 19 -3,-0.3 4,-2.0 -6,-0.1 5,-0.2 -0.195 95.9 -51.9-116.3-149.1 -63.0 47.3 -28.8 87 253 S E H > S+ 0 0 82 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.854 127.7 50.5 -61.7 -39.8 -61.1 46.2 -25.7 88 254 S V H > S+ 0 0 4 -8,-0.4 4,-3.6 2,-0.2 5,-0.3 0.971 109.2 50.7 -65.6 -50.4 -58.7 49.1 -25.5 89 255 S E H > S+ 0 0 23 -6,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.917 112.1 48.3 -52.3 -46.1 -61.4 51.8 -25.9 90 256 S R H X S+ 0 0 166 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.931 115.5 44.9 -60.2 -44.6 -63.4 50.2 -23.0 91 257 S W H >X S+ 0 0 26 -4,-2.3 4,-0.7 -5,-0.2 3,-0.5 0.954 111.8 50.4 -63.8 -51.6 -60.2 50.0 -20.9 92 258 S V H >< S+ 0 0 2 -4,-3.6 3,-0.8 1,-0.2 -1,-0.2 0.867 103.4 61.6 -55.4 -41.7 -59.1 53.6 -21.6 93 259 S D H 3< S+ 0 0 82 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.894 118.6 25.5 -53.3 -46.5 -62.5 55.0 -20.8 94 260 S K H << S+ 0 0 154 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.257 90.6 126.0-105.2 12.1 -62.4 53.8 -17.2 95 261 S A << - 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