==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-APR-08 3CZD . COMPND 2 MOLECULE: GLUTAMINASE KIDNEY ISOFORM; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.KARLBERG,M.WELIN,J.ANDERSSON,C.H.ARROWSMITH,H.BERGLUND,R.D . 308 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12547.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 12.0 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 . 5 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 9 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 0 1 0 0 2 0 4 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 1 222 A P 0 0 197 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -66.0 11.9 4.1 -49.3 2 223 A D > + 0 0 97 1,-0.2 4,-1.8 2,-0.0 3,-0.3 -0.859 360.0 179.8-120.1 94.0 15.4 5.8 -49.4 3 224 A F H > S+ 0 0 45 -2,-0.6 4,-2.7 1,-0.2 -1,-0.2 0.867 78.9 56.5 -63.9 -39.4 17.7 3.9 -46.9 4 225 A M H > S+ 0 0 154 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.852 111.0 44.2 -65.3 -33.9 20.8 6.1 -47.5 5 226 A S H > S+ 0 0 51 -3,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.802 111.7 52.5 -79.8 -31.0 18.9 9.2 -46.6 6 227 A F H X S+ 0 0 38 -4,-1.8 4,-2.2 2,-0.2 3,-0.2 0.902 106.4 56.5 -63.1 -42.1 17.2 7.5 -43.6 7 228 A T H X S+ 0 0 18 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.835 102.4 54.1 -55.1 -40.5 20.8 6.6 -42.6 8 229 A S H X S+ 0 0 62 -4,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.838 108.2 49.9 -63.6 -39.4 21.9 10.3 -42.6 9 230 A H H X S+ 0 0 67 -4,-1.2 4,-2.7 -3,-0.2 -2,-0.2 0.907 107.0 53.5 -66.4 -44.8 19.1 11.2 -40.3 10 231 A I H X S+ 0 0 1 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.888 108.4 52.1 -53.8 -41.5 20.1 8.3 -37.9 11 232 A D H X S+ 0 0 50 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.851 109.9 47.4 -67.4 -38.3 23.6 9.8 -37.8 12 233 A E H X S+ 0 0 125 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.895 113.1 48.3 -65.7 -44.5 22.3 13.3 -36.9 13 234 A L H X S+ 0 0 15 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.936 111.9 50.7 -59.7 -47.4 20.1 11.8 -34.2 14 235 A Y H X S+ 0 0 13 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.919 110.6 50.0 -49.3 -48.2 23.1 9.9 -32.9 15 236 A E H X S+ 0 0 94 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.831 111.0 47.1 -69.7 -34.1 25.1 13.1 -32.9 16 237 A S H >< S+ 0 0 36 -4,-2.0 3,-0.8 2,-0.2 -1,-0.2 0.910 111.6 50.1 -72.7 -44.0 22.6 15.1 -31.0 17 238 A A H >< S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.842 101.3 67.0 -60.5 -34.3 22.1 12.3 -28.3 18 239 A K H 3< S+ 0 0 108 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.798 91.6 58.9 -55.7 -35.4 25.9 12.2 -28.0 19 240 A K T << S+ 0 0 166 -3,-0.8 2,-1.1 -4,-0.6 -1,-0.3 0.529 83.5 95.8 -72.1 -5.5 26.0 15.7 -26.5 20 241 A Q < + 0 0 84 -3,-1.7 270,-0.1 -4,-0.2 -1,-0.1 -0.737 47.9 166.1 -93.4 94.6 23.8 14.4 -23.7 21 242 A S + 0 0 103 -2,-1.1 -1,-0.1 268,-0.1 -3,-0.1 0.288 29.9 115.1-102.0 8.4 26.3 13.5 -21.0 22 243 A G + 0 0 38 259,-0.1 267,-0.2 2,-0.0 268,-0.2 -0.080 42.1 62.7 -67.9 175.4 24.1 13.0 -17.9 23 244 A G - 0 0 48 266,-0.1 2,-0.4 265,-0.1 260,-0.2 -0.171 69.2 -95.3 100.1 173.0 23.5 9.8 -16.0 24 245 A K E -A 282 0A 115 258,-2.4 258,-2.6 256,-0.1 2,-0.2 -0.997 27.4-122.1-134.5 129.1 25.5 7.3 -13.9 25 246 A V E -A 281 0A 25 -2,-0.4 8,-0.1 256,-0.3 237,-0.1 -0.477 42.4-103.4 -65.8 134.6 27.1 4.0 -15.0 26 247 A A + 0 0 13 254,-0.5 9,-0.2 235,-0.5 -1,-0.1 -0.350 43.2 174.7 -61.4 144.0 25.7 1.1 -13.0 27 248 A D + 0 0 99 5,-0.1 -1,-0.1 6,-0.1 -2,-0.0 0.139 42.6 111.3-140.2 22.6 28.2 0.0 -10.3 28 249 A Y S S+ 0 0 97 1,-0.1 -2,-0.0 2,-0.0 3,-0.0 0.783 94.0 28.6 -77.7 -24.0 26.6 -2.7 -8.2 29 250 A I S >> S- 0 0 3 1,-0.1 4,-1.9 0, 0.0 3,-1.5 -0.970 85.5-124.2-125.3 150.9 29.0 -5.1 -9.8 30 251 A P H 3> S+ 0 0 81 0, 0.0 4,-1.9 0, 0.0 124,-0.1 0.793 107.5 66.9 -62.5 -27.9 32.6 -4.3 -11.1 31 252 A Q H 34 S+ 0 0 34 1,-0.2 123,-0.1 2,-0.2 4,-0.1 0.696 109.4 37.0 -67.6 -20.7 31.8 -5.7 -14.5 32 253 A L H X4 S+ 0 0 9 -3,-1.5 3,-1.4 2,-0.1 -1,-0.2 0.836 113.3 55.7 -91.7 -40.6 29.2 -2.8 -15.0 33 254 A A H 3< S+ 0 0 48 -4,-1.9 -2,-0.2 1,-0.3 -8,-0.1 0.717 95.2 69.7 -65.9 -28.4 31.3 -0.1 -13.3 34 255 A K T 3< S+ 0 0 155 -4,-1.9 -1,-0.3 -5,-0.1 -3,-0.1 0.662 77.7 105.3 -49.7 -35.8 34.3 -0.7 -15.6 35 256 A F S < S- 0 0 45 -3,-1.4 -10,-0.1 -9,-0.2 -3,-0.0 -0.326 75.2-115.1 -73.9 141.2 32.5 0.7 -18.6 36 257 A S > - 0 0 51 1,-0.1 3,-1.1 -2,-0.1 -1,-0.1 -0.491 12.4-141.0 -67.2 137.1 33.3 4.1 -20.1 37 258 A P T 3 S+ 0 0 66 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.693 99.3 62.7 -67.2 -18.5 30.4 6.7 -19.9 38 259 A D T 3 S+ 0 0 126 242,-0.1 2,-0.2 241,-0.1 -2,-0.0 0.456 72.2 115.0 -91.3 -3.8 31.3 7.9 -23.4 39 260 A L < + 0 0 31 -3,-1.1 2,-0.3 16,-0.1 16,-0.0 -0.528 39.3 162.4 -66.0 132.3 30.6 4.6 -25.1 40 261 A W + 0 0 1 -2,-0.2 16,-1.6 239,-0.2 2,-0.3 -0.852 6.1 162.2-160.6 112.3 27.6 5.2 -27.4 41 262 A G E -CD 55 278B 0 237,-2.1 237,-2.7 14,-0.3 2,-0.4 -0.987 16.4-168.3-135.7 149.3 26.4 3.1 -30.4 42 263 A V E -CD 54 277B 1 12,-2.5 12,-1.9 -2,-0.3 2,-0.4 -0.991 9.0-174.2-132.2 125.2 23.3 2.7 -32.5 43 264 A S E -CD 53 276B 0 233,-2.4 233,-1.8 -2,-0.4 2,-0.4 -0.978 4.3-164.2-119.1 137.5 22.6 -0.2 -34.9 44 265 A V E +CD 52 275B 1 8,-3.2 8,-1.9 -2,-0.4 2,-0.3 -0.913 9.0 180.0-114.4 141.3 19.7 -0.5 -37.3 45 266 A C E -CD 51 274B 0 229,-2.4 229,-2.9 -2,-0.4 6,-0.2 -0.937 20.9-145.4-136.5 115.0 18.6 -3.6 -39.1 46 267 A T E > - D 0 273B 10 4,-2.9 3,-1.9 -2,-0.3 227,-0.3 -0.343 28.0-108.0 -76.0 164.9 15.5 -3.3 -41.4 47 268 A V T 3 S+ 0 0 22 225,-2.4 226,-0.1 1,-0.3 -1,-0.1 0.686 123.0 54.5 -62.7 -19.9 12.9 -5.9 -41.9 48 269 A D T 3 S- 0 0 133 224,-0.4 -1,-0.3 2,-0.1 225,-0.1 0.314 125.9-100.4 -96.4 6.0 14.4 -6.3 -45.4 49 270 A G S < S+ 0 0 22 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.568 70.1 148.2 90.4 10.5 17.9 -6.9 -44.1 50 271 A Q - 0 0 79 2,-0.0 -4,-2.9 1,-0.0 2,-0.4 -0.610 30.2-155.9 -81.1 142.8 19.5 -3.4 -44.6 51 272 A R E +C 45 0B 83 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.909 20.7 168.7-125.4 139.4 22.1 -2.5 -42.0 52 273 A H E -C 44 0B 36 -8,-1.9 -8,-3.2 -2,-0.4 2,-0.3 -0.946 7.0-178.2-149.2 135.1 23.5 0.7 -40.6 53 274 A S E -C 43 0B 39 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.955 4.1-176.9-127.5 148.4 25.7 1.3 -37.5 54 275 A T E -C 42 0B 27 -12,-1.9 -12,-2.5 -2,-0.3 2,-0.2 -0.963 54.6 -10.1-145.6 133.1 27.2 4.4 -35.9 55 276 A G E S+C 41 0B 40 -2,-0.3 2,-2.3 -14,-0.2 -14,-0.3 -0.524 120.0 0.2 86.1-144.1 29.6 4.6 -32.9 56 277 A D S > S+ 0 0 57 -16,-1.6 3,-0.7 -2,-0.2 145,-0.3 -0.345 77.5 139.9 -84.6 64.7 30.6 1.8 -30.6 57 278 A T T 3 + 0 0 10 -2,-2.3 145,-1.7 1,-0.2 146,-0.3 0.459 65.0 51.6 -92.2 -1.6 28.5 -0.9 -32.2 58 279 A K T 3 S+ 0 0 148 -3,-0.2 -1,-0.2 142,-0.2 -2,-0.1 0.158 79.7 106.9-118.6 15.4 31.1 -3.8 -32.0 59 280 A V S < S- 0 0 50 -3,-0.7 142,-0.3 1,-0.0 140,-0.1 -0.860 71.0-127.5 -96.1 116.3 31.8 -3.6 -28.3 60 281 A P + 0 0 37 0, 0.0 2,-0.3 0, 0.0 140,-0.2 -0.363 35.0 167.1 -68.5 146.4 30.2 -6.5 -26.4 61 282 A F E -G 199 0C 1 138,-2.5 138,-2.6 -2,-0.0 2,-0.3 -0.951 39.4 -90.2-147.5 164.2 28.0 -5.8 -23.4 62 283 A C E -G 198 0C 7 -2,-0.3 200,-0.3 136,-0.2 136,-0.3 -0.594 19.7-140.4 -83.0 134.3 25.5 -7.9 -21.4 63 284 A L > + 0 0 1 134,-3.0 3,-2.5 -2,-0.3 199,-0.2 0.882 40.4 165.7 -52.0 -41.0 21.8 -8.1 -22.4 64 285 A Q G > S- 0 0 0 131,-2.0 3,-2.0 133,-0.4 4,-0.2 -0.357 75.3 -2.3 50.5-129.4 20.9 -8.0 -18.7 65 286 A S G > S+ 0 0 0 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.654 122.8 78.5 -68.2 -10.9 17.1 -7.2 -18.6 66 287 A C G < S+ 0 0 1 -3,-2.5 4,-0.4 1,-0.2 -1,-0.3 0.710 85.3 63.5 -63.9 -21.0 17.1 -6.9 -22.4 67 288 A V G <> S+ 0 0 2 -3,-2.0 4,-2.4 1,-0.2 3,-0.3 0.690 81.8 83.5 -73.3 -20.5 17.0 -10.8 -22.4 68 289 A K H <> S+ 0 0 3 -3,-1.3 4,-1.9 -4,-0.2 -1,-0.2 0.878 91.3 43.3 -54.8 -50.8 13.6 -10.8 -20.6 69 290 A P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.827 113.1 55.2 -60.1 -32.6 11.4 -10.4 -23.7 70 291 A L H > S+ 0 0 1 -4,-0.4 4,-2.0 -3,-0.3 -2,-0.2 0.903 111.5 40.8 -72.2 -42.5 13.6 -12.9 -25.6 71 292 A K H X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.827 113.2 54.2 -77.0 -31.4 13.2 -15.7 -23.1 72 293 A Y H X S+ 0 0 3 -4,-1.9 4,-2.2 -5,-0.3 -2,-0.2 0.928 110.0 49.1 -59.2 -45.5 9.5 -14.9 -22.6 73 294 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 153,-0.2 0.891 109.0 51.4 -62.3 -44.9 9.2 -15.3 -26.5 74 295 A I H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.892 110.8 49.4 -54.8 -45.7 11.0 -18.6 -26.4 75 296 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.4 0.891 113.0 44.6 -66.1 -43.1 8.7 -19.9 -23.7 76 297 A V H X S+ 0 0 1 -4,-2.2 4,-2.3 3,-0.2 -1,-0.2 0.884 112.6 54.4 -67.9 -37.4 5.5 -18.8 -25.5 77 298 A N H < S+ 0 0 49 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.922 119.4 31.5 -58.5 -48.0 7.0 -20.3 -28.7 78 299 A D H < S+ 0 0 63 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.810 136.5 22.5 -81.5 -33.3 7.6 -23.7 -27.1 79 300 A L H < S- 0 0 65 -4,-2.7 4,-0.5 -5,-0.2 -3,-0.2 0.569 101.0-119.2-116.3 -15.7 4.7 -23.8 -24.6 80 301 A G X - 0 0 21 -4,-2.3 4,-2.0 -5,-0.4 5,-0.2 0.188 31.7 -81.0 82.8 153.7 1.9 -21.4 -25.9 81 302 A T H > S+ 0 0 32 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.837 123.4 53.6 -53.4 -43.1 0.3 -18.3 -24.3 82 303 A E H > S+ 0 0 126 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.910 109.3 45.0 -69.5 -45.8 -2.0 -20.2 -22.0 83 304 A Y H >4 S+ 0 0 45 -4,-0.5 3,-1.3 1,-0.2 4,-0.4 0.952 114.7 48.8 -61.8 -49.7 0.5 -22.4 -20.4 84 305 A V H >X S+ 0 0 0 -4,-2.0 3,-1.6 1,-0.2 4,-0.8 0.901 108.5 54.3 -58.7 -40.3 3.0 -19.5 -19.8 85 306 A H H 3< S+ 0 0 11 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.464 87.9 75.1 -85.7 3.3 0.3 -17.3 -18.3 86 307 A R T << S+ 0 0 124 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.673 110.5 33.7 -66.6 -22.9 -0.8 -19.8 -15.7 87 308 A Y T <4 S+ 0 0 46 -3,-1.6 2,-0.3 -4,-0.4 -2,-0.2 0.673 124.7 31.9-109.4 -23.3 2.5 -18.7 -14.1 88 309 A V S < S- 0 0 0 -4,-0.8 -1,-0.3 17,-0.2 19,-0.2 -0.997 71.9-125.1-143.9 140.7 2.8 -15.0 -14.9 89 310 A G - 0 0 7 17,-2.8 18,-0.1 -2,-0.3 -2,-0.1 0.024 14.7-128.6 -74.3-174.3 0.5 -12.1 -15.6 90 311 A K S S+ 0 0 128 18,-0.2 18,-0.2 2,-0.1 17,-0.1 -0.037 70.0 62.7-132.8 33.1 0.2 -9.7 -18.5 91 312 A E S S- 0 0 122 16,-1.9 -2,-0.1 149,-0.0 145,-0.0 -0.996 78.1 -78.9-159.3 159.9 0.3 -6.2 -17.2 92 313 A P - 0 0 64 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.185 32.1-151.1 -59.5 145.3 2.1 -3.4 -15.4 93 314 A S - 0 0 22 147,-0.1 2,-0.3 8,-0.0 3,-0.2 -0.600 26.8-102.1 -94.7 171.9 2.6 -3.1 -11.7 94 315 A G S S+ 0 0 63 1,-0.3 2,-0.1 -2,-0.2 150,-0.0 -0.851 98.6 11.8-141.2 111.4 3.0 0.2 -9.7 95 316 A L 0 0 134 -2,-0.3 -1,-0.3 0, 0.0 148,-0.0 0.585 360.0 360.0-110.7 176.6 5.8 0.7 -9.0 96 317 A R 0 0 64 -3,-0.2 -2,-0.1 -2,-0.1 147,-0.1 0.653 360.0 360.0 -68.6 360.0 8.6 -1.5 -10.6 97 ! 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 98 321 A L 0 0 100 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 108.2 8.4 -7.3 -4.2 99 322 A F - 0 0 101 6,-0.0 8,-0.3 0, 0.0 2,-0.2 -0.951 360.0-123.1-160.8 174.9 4.9 -8.6 -4.5 100 323 A L - 0 0 13 -2,-0.3 72,-0.0 1,-0.2 4,-0.0 -0.715 31.8-100.2-119.8 169.1 2.5 -10.7 -6.6 101 324 A N > - 0 0 32 4,-3.6 3,-1.8 -2,-0.2 -1,-0.2 -0.085 53.9 -79.8 -79.6-172.3 -0.8 -9.9 -8.3 102 325 A E T 3 S+ 0 0 197 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.743 133.9 51.8 -66.1 -21.6 -4.2 -10.9 -6.9 103 326 A D T 3 S- 0 0 109 2,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.183 121.5-107.3 -92.8 16.3 -3.8 -14.5 -8.2 104 327 A D S < S+ 0 0 82 -3,-1.8 -2,-0.1 1,-0.2 3,-0.0 0.904 81.3 127.1 51.7 44.8 -0.3 -14.7 -6.5 105 328 A K S S- 0 0 53 -17,-0.0 -4,-3.6 -20,-0.0 -1,-0.2 -0.946 72.0 -97.1-118.0 148.4 1.5 -14.5 -9.9 106 329 A P - 0 0 0 0, 0.0 -17,-2.8 0, 0.0 -6,-0.1 -0.403 40.8-116.8 -57.7 144.5 4.2 -12.0 -10.8 107 330 A H S S- 0 0 26 -8,-0.3 -16,-1.9 -19,-0.2 -19,-0.1 0.832 80.3 -21.1 -61.3 -37.7 2.6 -9.1 -12.6 108 331 A N > - 0 0 0 -18,-0.2 3,-1.1 -20,-0.1 6,-0.4 -0.973 66.0 -97.2-163.5 165.4 4.4 -9.6 -15.9 109 332 A P T 3 S+ 0 0 1 0, 0.0 -37,-0.1 0, 0.0 9,-0.1 0.539 110.7 68.3 -65.3 -8.9 7.5 -11.3 -17.6 110 333 A M T 3 S+ 0 0 6 4,-0.1 2,-0.3 126,-0.1 133,-0.1 0.504 84.0 75.7 -96.8 -9.5 9.5 -8.0 -17.5 111 334 A V S <> S- 0 0 19 -3,-1.1 4,-2.5 1,-0.1 3,-0.4 -0.730 95.5-109.4 -93.3 155.1 9.9 -7.6 -13.8 112 335 A N H > S+ 0 0 16 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.892 117.3 54.9 -52.7 -46.0 12.5 -9.9 -12.1 113 336 A A H > S+ 0 0 8 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.900 112.9 42.9 -53.9 -45.4 9.9 -12.1 -10.3 114 337 A G H > S+ 0 0 0 -6,-0.4 4,-2.9 -3,-0.4 -1,-0.2 0.874 113.0 51.0 -70.8 -39.1 8.2 -12.8 -13.7 115 338 A A H X S+ 0 0 1 -4,-2.5 4,-2.4 -7,-0.2 -2,-0.2 0.884 108.9 52.4 -64.9 -37.8 11.5 -13.3 -15.5 116 339 A I H X S+ 0 0 0 -4,-2.9 4,-1.4 -5,-0.2 -2,-0.2 0.924 112.1 45.9 -63.1 -44.7 12.6 -15.8 -12.8 117 340 A V H X S+ 0 0 0 -4,-1.8 4,-0.6 -5,-0.2 3,-0.3 0.926 111.5 51.0 -62.0 -48.1 9.3 -17.7 -13.3 118 341 A V H >X S+ 0 0 1 -4,-2.9 3,-1.4 1,-0.2 4,-0.9 0.916 106.3 56.1 -54.3 -44.2 9.6 -17.6 -17.1 119 342 A T H >< S+ 0 0 0 -4,-2.4 3,-0.6 1,-0.3 -1,-0.2 0.871 102.5 56.4 -55.2 -39.2 13.1 -19.0 -16.7 120 343 A S H 3< S+ 0 0 2 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.621 104.1 54.4 -67.1 -14.8 11.6 -22.0 -14.7 121 344 A L H X< S+ 0 0 1 -3,-1.4 3,-0.6 -4,-0.6 2,-0.3 0.672 84.4 101.2 -92.7 -21.6 9.3 -22.8 -17.7 122 345 A I T << S- 0 0 1 -4,-0.9 -47,-0.1 -3,-0.6 9,-0.1 -0.515 100.4 -21.6 -77.4 130.7 12.0 -23.2 -20.4 123 346 A K T > S- 0 0 95 -2,-0.3 3,-1.1 1,-0.1 -1,-0.2 0.847 83.6-159.6 44.4 54.5 13.1 -26.6 -21.5 124 347 A Q T < + 0 0 81 -3,-0.6 -1,-0.1 1,-0.2 3,-0.1 -0.261 64.5 33.1 -66.7 148.0 12.0 -28.4 -18.3 125 348 A G T 3 S+ 0 0 85 1,-0.3 -1,-0.2 56,-0.1 2,-0.2 0.204 95.0 94.7 93.7 -18.0 13.6 -31.7 -17.3 126 349 A V S < S- 0 0 47 -3,-1.1 -1,-0.3 1,-0.1 2,-0.0 -0.605 81.6 -95.6 -96.2 166.8 17.1 -31.2 -18.8 127 350 A N >> - 0 0 97 -2,-0.2 4,-2.2 -3,-0.1 3,-0.6 -0.283 39.5-100.2 -77.3 168.5 20.1 -30.0 -16.8 128 351 A N H 3> S+ 0 0 39 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.859 120.0 58.2 -61.8 -36.8 21.2 -26.3 -16.7 129 352 A A H 3> S+ 0 0 61 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.863 110.5 43.5 -60.9 -37.5 24.0 -26.8 -19.3 130 353 A E H <> S+ 0 0 105 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.870 113.6 51.1 -75.3 -39.2 21.4 -28.2 -21.9 131 354 A K H X S+ 0 0 20 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.955 112.7 46.9 -58.2 -49.6 18.9 -25.4 -21.0 132 355 A F H X S+ 0 0 29 -4,-3.3 4,-2.7 1,-0.2 -2,-0.2 0.907 112.4 48.3 -58.9 -48.2 21.6 -22.8 -21.5 133 356 A D H X S+ 0 0 79 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.854 109.6 54.6 -60.2 -40.0 22.8 -24.3 -24.8 134 357 A Y H X S+ 0 0 54 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.961 112.1 41.8 -58.4 -52.9 19.2 -24.4 -26.0 135 358 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.907 112.3 55.3 -63.1 -40.9 18.6 -20.7 -25.3 136 359 A M H X S+ 0 0 25 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.906 108.9 47.8 -58.6 -41.5 22.1 -19.8 -26.7 137 360 A Q H X S+ 0 0 107 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.847 110.0 53.3 -67.2 -32.9 21.2 -21.6 -30.0 138 361 A F H X S+ 0 0 18 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.911 108.4 48.5 -68.0 -43.1 17.8 -19.8 -30.0 139 362 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.867 106.4 57.9 -67.0 -35.2 19.5 -16.4 -29.7 140 363 A N H <>S+ 0 0 44 -4,-2.0 5,-3.3 2,-0.2 6,-0.3 0.924 107.8 47.1 -56.2 -48.2 21.9 -17.3 -32.5 141 364 A K H ><5S+ 0 0 84 -4,-1.9 3,-0.9 3,-0.2 -2,-0.2 0.883 111.9 50.2 -58.0 -41.8 18.8 -17.9 -34.8 142 365 A M H 3<5S+ 0 0 0 -4,-1.9 68,-0.3 1,-0.2 -1,-0.2 0.849 115.0 44.0 -65.6 -34.7 17.3 -14.5 -33.6 143 366 A A T ><5S- 0 0 0 -4,-2.1 3,-1.2 3,-0.1 -1,-0.2 0.295 111.9-116.8 -92.4 5.0 20.6 -12.8 -34.4 144 367 A G T < 5S- 0 0 11 -3,-0.9 -3,-0.2 -4,-0.3 -4,-0.1 0.906 74.7 -57.2 54.5 43.4 21.2 -14.6 -37.8 145 368 A N T 3 + 0 0 17 45,-2.9 4,-2.2 -2,-0.4 5,-0.1 -0.862 13.8 179.6-100.7 104.4 30.4 -13.1 -19.5 152 375 A N H > S+ 0 0 91 -2,-0.8 4,-2.9 2,-0.2 5,-0.2 0.898 84.1 55.9 -68.6 -40.5 31.5 -15.5 -16.8 153 376 A A H > S+ 0 0 48 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.890 109.8 46.3 -55.9 -42.6 32.8 -12.6 -14.7 154 377 A T H > S+ 0 0 7 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.942 112.2 51.2 -66.2 -45.5 29.3 -11.0 -14.8 155 378 A F H X S+ 0 0 11 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.936 111.6 46.5 -56.8 -51.1 27.6 -14.3 -14.0 156 379 A Q H X S+ 0 0 66 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.900 117.2 41.9 -61.8 -44.6 29.8 -15.0 -11.0 157 380 A S H X S+ 0 0 21 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.895 112.4 55.6 -67.5 -40.8 29.4 -11.4 -9.5 158 381 A E H X S+ 0 0 2 -4,-2.9 4,-0.7 -5,-0.2 -2,-0.2 0.924 112.9 41.8 -57.2 -44.9 25.6 -11.4 -10.4 159 382 A R H < S+ 0 0 78 -4,-2.3 3,-0.3 -5,-0.2 -1,-0.2 0.891 114.9 49.8 -73.5 -37.9 25.1 -14.6 -8.4 160 383 A E H < S+ 0 0 158 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.805 122.0 33.5 -67.8 -32.6 27.4 -13.5 -5.4 161 384 A S H < S+ 0 0 48 -4,-2.3 2,-1.3 -5,-0.1 3,-0.3 0.387 87.0 104.0-107.0 4.1 25.7 -10.2 -5.1 162 385 A G X + 0 0 6 -4,-0.7 4,-1.9 -3,-0.3 3,-0.3 -0.279 30.1 143.0 -90.0 53.3 22.1 -11.0 -6.0 163 386 A D H > S+ 0 0 125 -2,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.876 72.6 53.0 -56.9 -42.9 20.6 -11.0 -2.5 164 387 A R H > S+ 0 0 135 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.868 108.0 49.9 -59.7 -42.5 17.3 -9.4 -3.8 165 388 A N H > S+ 0 0 6 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.843 109.7 51.0 -68.6 -35.6 16.9 -12.1 -6.5 166 389 A F H X S+ 0 0 56 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.868 109.0 51.5 -64.3 -40.3 17.4 -14.8 -3.9 167 390 A A H X S+ 0 0 54 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.918 111.7 47.3 -61.6 -45.8 14.8 -13.2 -1.7 168 391 A I H X S+ 0 0 1 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.932 110.5 52.7 -59.0 -49.3 12.4 -13.1 -4.7 169 392 A G H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.919 112.0 43.8 -52.5 -50.0 13.2 -16.8 -5.5 170 393 A Y H X S+ 0 0 124 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.819 113.2 53.3 -67.4 -33.4 12.4 -18.0 -2.0 171 394 A Y H X S+ 0 0 74 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.890 109.7 46.7 -66.9 -43.8 9.3 -15.9 -1.9 172 395 A L H <>S+ 0 0 0 -4,-2.8 5,-2.7 2,-0.2 6,-0.4 0.848 111.1 53.5 -64.4 -37.2 8.1 -17.4 -5.2 173 396 A K H ><5S+ 0 0 113 -4,-2.0 3,-1.4 -5,-0.2 -2,-0.2 0.951 108.6 49.3 -62.7 -47.8 8.9 -20.8 -3.8 174 397 A E H 3<5S+ 0 0 132 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.812 112.0 47.5 -62.3 -33.5 6.8 -20.1 -0.7 175 398 A K T 3<5S- 0 0 73 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.341 112.4-118.6 -91.3 5.6 3.8 -18.9 -2.8 176 399 A K T < 5 + 0 0 183 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.829 62.5 148.3 66.0 39.0 4.0 -21.9 -5.1 177 400 A C < + 0 0 7 -5,-2.7 -4,-0.1 -6,-0.1 -1,-0.1 0.600 45.6 80.2 -82.5 -11.3 4.7 -19.9 -8.2 178 401 A F S S- 0 0 27 -6,-0.4 3,-0.1 -5,-0.1 4,-0.1 -0.633 88.6 -96.4 -98.4 151.7 6.9 -22.5 -10.0 179 402 A P > - 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