==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 14-MAY-06 2H0B . COMPND 2 MOLECULE: NEUREXIN-1-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR L.R.SHECKLER,L.HENRY,S.SUGITA,T.C.SUDHOF,G.RUDENKO . 727 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32010.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 498 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 334 45.9 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 14 1.9 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 . 72 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 3.4 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+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 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 RESIDUES PER ALPHA HELIX . 4 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 2 10 6 12 10 0 12 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 0 0 0 4 4 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 1 280 A E 0 0 121 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 113.5 -1.9 -9.4 66.4 2 281 A E - 0 0 108 150,-0.0 2,-0.6 164,-0.0 150,-0.0 -0.617 360.0-131.4 -88.1 162.5 -1.2 -6.0 64.9 3 282 A Y - 0 0 56 -2,-0.2 150,-1.4 2,-0.0 2,-0.4 -0.922 29.7-178.5-123.5 102.1 2.1 -5.3 63.1 4 283 A I E -A 152 0A 80 -2,-0.6 2,-0.4 148,-0.2 148,-0.2 -0.843 7.9-170.3-111.0 133.9 3.7 -2.1 64.4 5 284 A A E -A 151 0A 16 146,-2.5 146,-2.4 -2,-0.4 2,-0.5 -0.969 11.6-146.0-124.7 141.9 6.9 -0.6 63.2 6 285 A T E -A 150 0A 80 -2,-0.4 2,-0.4 144,-0.2 144,-0.2 -0.920 11.1-164.8-110.0 129.9 8.8 2.3 64.7 7 286 A F E -A 149 0A 4 142,-3.2 142,-1.7 -2,-0.5 123,-0.1 -0.931 11.8-171.3-116.5 140.4 10.8 4.8 62.6 8 287 A K E -A 148 0A 136 -2,-0.4 140,-0.2 140,-0.2 -1,-0.1 0.188 61.6 -85.4-117.6 11.2 13.3 7.1 64.1 9 288 A G S S+ 0 0 26 138,-1.2 137,-0.5 2,-0.2 139,-0.1 0.105 121.0 61.6 110.0 -22.4 14.0 9.3 61.0 10 289 A S S S+ 0 0 53 135,-0.1 171,-1.3 121,-0.1 2,-0.3 0.118 89.2 82.0-117.2 17.1 16.6 7.2 59.2 11 290 A E E +G 180 0B 46 136,-0.4 2,-0.3 119,-0.2 136,-0.2 -0.834 42.4 159.7-125.8 160.6 14.7 4.0 58.5 12 291 A Y E -G 179 0B 30 167,-2.0 167,-2.7 -2,-0.3 2,-0.4 -0.950 33.5-118.5-164.4 161.1 12.2 2.6 56.0 13 292 A F E -GH 178 129B 15 116,-2.4 116,-2.0 -2,-0.3 2,-0.4 -0.864 24.7-160.7-101.2 151.0 10.8 -0.7 54.6 14 293 A C E -GH 177 128B 9 163,-2.6 163,-2.1 -2,-0.4 2,-0.5 -0.944 3.6-166.3-139.8 104.8 11.3 -1.4 50.9 15 294 A Y E -GH 176 127B 18 112,-2.6 112,-2.6 -2,-0.4 2,-0.6 -0.867 22.9-129.7 -97.5 126.2 9.1 -4.0 49.1 16 295 A D E + H 0 126B 47 159,-2.6 3,-0.3 -2,-0.5 110,-0.2 -0.621 28.8 174.2 -84.0 116.3 10.4 -5.0 45.7 17 296 A L + 0 0 1 108,-1.8 108,-0.2 -2,-0.6 3,-0.2 0.348 50.4 103.6 -98.6 4.6 7.7 -4.7 42.9 18 297 A S S S+ 0 0 26 107,-0.5 -1,-0.2 1,-0.2 108,-0.1 0.804 88.7 35.7 -64.2 -32.0 10.0 -5.6 40.0 19 298 A Q S S+ 0 0 160 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.640 128.9 34.5 -97.8 -16.3 8.8 -9.1 39.6 20 299 A N S S- 0 0 83 -3,-0.2 -1,-0.2 -4,-0.2 -2,-0.1 -0.634 85.8-161.5-134.7 78.5 5.1 -8.5 40.5 21 300 A P - 0 0 32 0, 0.0 2,-0.4 0, 0.0 103,-0.3 -0.198 22.8-113.4 -59.3 143.7 4.3 -5.0 39.2 22 301 A I E +N 123 0C 4 101,-3.4 101,-2.5 2,-0.0 2,-0.2 -0.687 40.1 169.1 -71.4 130.1 1.3 -3.1 40.5 23 302 A Q E +N 122 0C 80 -2,-0.4 2,-0.4 99,-0.2 99,-0.2 -0.762 19.2 158.2-145.1 94.4 -1.2 -2.7 37.6 24 303 A S E -N 121 0C 4 97,-2.2 97,-3.2 -2,-0.2 3,-0.1 -0.967 40.6-176.8-137.8 128.4 -4.4 -1.4 39.2 25 304 A S S S+ 0 0 43 -2,-0.4 72,-2.6 1,-0.3 2,-0.3 0.386 90.8 24.0-100.4 0.7 -7.5 0.5 38.1 26 305 A S E S+B 96 0A 38 70,-0.2 133,-0.6 95,-0.1 -1,-0.3 -0.839 73.4 174.4-167.2 133.9 -8.8 0.6 41.7 27 306 A D E -BC 95 158A 12 68,-1.5 68,-2.5 -2,-0.3 2,-0.3 -0.838 17.8-152.8-134.0 161.7 -6.9 0.4 45.0 28 307 A E E -BC 94 157A 39 129,-2.3 129,-2.3 -2,-0.3 2,-0.4 -0.991 9.3-172.5-140.1 142.5 -7.3 0.7 48.7 29 308 A I E +BC 93 156A 4 64,-2.7 64,-3.3 -2,-0.3 2,-0.3 -0.997 7.5 173.4-131.2 129.8 -4.7 1.7 51.3 30 309 A T E +BC 92 155A 38 125,-2.0 125,-2.6 -2,-0.4 2,-0.3 -0.966 11.8 138.2-130.5 150.6 -5.1 1.5 55.1 31 310 A L E -B 91 0A 4 60,-1.6 60,-2.9 -2,-0.3 2,-0.3 -0.938 37.9-128.1-166.2 168.2 -2.7 2.1 57.9 32 311 A S E -BC 90 152A 11 120,-2.2 120,-2.5 -2,-0.3 2,-0.3 -0.979 24.9-164.9-123.1 151.3 -2.5 3.8 61.3 33 312 A F E -BC 89 151A 0 56,-2.5 56,-2.5 -2,-0.3 2,-0.3 -0.913 12.2-170.4-132.4 155.7 0.1 6.3 62.3 34 313 A K E + C 0 150A 55 116,-2.1 116,-2.6 -2,-0.3 2,-0.3 -0.950 25.9 143.1-146.8 125.3 1.4 7.9 65.5 35 314 A T E - C 0 149A 1 48,-0.5 51,-2.5 52,-0.4 52,-0.3 -0.995 47.5-152.3-159.9 158.6 3.9 10.8 65.6 36 315 A L S S+ 0 0 103 112,-0.6 2,-0.2 -2,-0.3 48,-0.1 0.472 75.7 96.9-105.5 -8.9 5.0 14.0 67.3 37 316 A Q - 0 0 91 111,-0.6 49,-0.1 1,-0.1 22,-0.1 -0.561 65.5-147.1 -92.4 145.7 6.5 15.3 64.0 38 317 A R S S+ 0 0 136 -2,-0.2 21,-2.7 1,-0.1 2,-0.4 0.730 85.2 41.0 -74.3 -29.9 4.8 17.7 61.6 39 318 A N + 0 0 49 18,-0.2 2,-0.2 19,-0.2 18,-0.2 -0.967 66.5 125.6-128.8 139.8 6.5 16.2 58.5 40 319 A G E -I 56 0B 0 16,-2.1 16,-2.6 -2,-0.4 2,-0.5 -0.821 51.2-108.5 173.9 144.7 7.2 12.6 57.5 41 320 A L E +Ij 55 146B 0 104,-1.2 106,-0.7 -2,-0.2 14,-0.3 -0.746 27.1 177.6 -85.5 122.4 6.8 10.2 54.7 42 321 A X E - 0 0 0 12,-2.3 88,-2.9 -2,-0.5 2,-0.3 0.899 65.2 -18.8 -87.0 -50.7 4.3 7.4 55.5 43 322 A L E +IK 54 129B 1 11,-2.4 11,-3.3 86,-0.2 2,-0.3 -0.999 55.6 179.2-159.2 153.1 4.4 5.6 52.2 44 323 A H E +IK 53 128B 0 84,-2.3 84,-3.7 -2,-0.3 2,-0.3 -0.988 3.3 174.2-151.5 142.7 5.2 5.8 48.5 45 324 A T E +IK 52 127B 1 7,-2.2 7,-2.4 -2,-0.3 82,-0.2 -0.963 43.4 36.2-146.1 141.1 5.2 3.8 45.4 46 325 A G - 0 0 1 80,-0.6 2,-0.3 -2,-0.3 5,-0.2 -0.069 50.2-131.0 114.4 159.3 6.0 4.7 41.8 47 326 A K > + 0 0 96 3,-0.5 3,-1.7 91,-0.1 2,-0.2 -0.840 68.6 12.5-133.7 172.4 8.2 6.8 39.5 48 327 A S T 3 S- 0 0 66 -2,-0.3 20,-0.1 1,-0.2 3,-0.0 -0.424 129.6 -23.2 60.1-122.5 7.7 9.2 36.6 49 328 A A T 3 S+ 0 0 37 -2,-0.2 19,-1.0 1,-0.1 2,-0.6 0.367 122.9 77.9-106.9 4.5 4.1 10.1 36.3 50 329 A D E < + L 0 67B 7 -3,-1.7 -3,-0.5 17,-0.2 2,-0.3 -0.930 66.4 124.2-115.0 107.7 2.5 7.0 38.0 51 330 A Y E - L 0 66B 26 15,-1.7 15,-2.3 -2,-0.6 2,-0.4 -0.991 46.7-148.9-158.9 159.8 2.7 7.3 41.8 52 331 A V E -IL 45 65B 2 -7,-2.4 -7,-2.2 -2,-0.3 2,-0.4 -0.994 21.3-177.1-131.1 126.6 1.0 7.3 45.2 53 332 A N E -IL 44 64B 0 11,-2.6 11,-2.4 -2,-0.4 2,-0.4 -0.987 3.6-176.2-129.4 122.9 2.6 9.4 47.9 54 333 A L E +IL 43 63B 0 -11,-3.3 -11,-2.4 -2,-0.4 -12,-2.3 -0.983 21.3 141.5-122.2 128.6 1.3 9.5 51.5 55 334 A A E -IL 41 62B 0 7,-2.4 7,-3.4 -2,-0.4 2,-0.5 -0.962 53.0-108.9-155.1 157.2 2.8 11.9 54.1 56 335 A L E -IL 40 61B 1 -16,-2.6 -16,-2.1 -2,-0.3 2,-0.5 -0.905 38.5-171.7 -90.5 131.8 2.2 14.2 57.0 57 336 A K E > - L 0 60B 83 3,-3.1 3,-1.7 -2,-0.5 -18,-0.2 -0.944 68.7 -26.2-133.2 105.8 2.9 17.7 55.7 58 337 A N T 3 S- 0 0 118 -2,-0.5 -19,-0.2 1,-0.3 3,-0.1 0.898 127.7 -49.6 51.8 43.2 2.9 20.5 58.3 59 338 A G T 3 S+ 0 0 8 -21,-2.7 24,-0.5 1,-0.2 2,-0.3 0.284 118.8 106.0 83.9 -7.6 0.6 18.4 60.5 60 339 A A E < S-L 57 0B 7 -3,-1.7 -3,-3.1 -22,-0.2 2,-0.5 -0.787 76.8-110.9-103.5 148.5 -1.9 17.6 57.8 61 340 A V E -LM 56 76B 0 15,-2.1 15,-2.7 -2,-0.3 2,-0.4 -0.642 39.3-165.1 -76.2 124.5 -2.4 14.2 56.1 62 341 A S E -LM 55 75B 9 -7,-3.4 -7,-2.4 -2,-0.5 2,-0.4 -0.931 12.6-179.3-121.6 132.1 -1.3 14.6 52.5 63 342 A L E -LM 54 74B 1 11,-2.9 11,-3.1 -2,-0.4 2,-0.4 -0.999 1.8-177.3-132.3 130.9 -1.9 12.3 49.6 64 343 A V E +LM 53 73B 9 -11,-2.4 -11,-2.6 -2,-0.4 2,-0.4 -0.994 6.9 176.3-130.3 126.6 -0.8 12.7 46.0 65 344 A I E -LM 52 72B 4 7,-2.2 7,-2.7 -2,-0.4 2,-0.4 -0.998 7.8-179.2-132.2 135.4 -1.7 10.3 43.3 66 345 A N E -LM 51 71B 13 -15,-2.3 -15,-1.7 -2,-0.4 5,-0.2 -0.997 12.9-170.7-130.6 132.8 -1.0 10.4 39.6 67 346 A L E -L 50 0B 0 3,-0.6 53,-0.3 -2,-0.4 -17,-0.2 0.301 68.6 -82.0-104.2 6.8 -2.2 7.8 37.1 68 347 A G S S+ 0 0 24 -19,-1.0 -18,-0.1 50,-0.1 3,-0.1 0.266 122.1 70.1 114.8 -8.6 -0.1 9.1 34.2 69 348 A S S S- 0 0 19 1,-0.3 48,-0.1 46,-0.2 -19,-0.1 0.038 113.9 -39.2-125.6 27.0 -2.3 12.0 33.0 70 349 A G - 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