==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIFREEZE PROTEIN 17-DEC-07 3BOG . COMPND 2 MOLECULE: 6.5 KDA GLYCINE-RICH ANTIFREEZE PROTEIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR B.L.PENTELUTE,KENT S.B.H.,Z.P.GATES,V.TERESHKO, . 324 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12383.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 55.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 8 2.5 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 . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 4.9 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+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 0 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 . 8 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A a 0 0 109 0, 0.0 28,-2.7 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 162.1 21.9 18.4 8.7 2 2 A K B -a 29 0A 97 26,-0.3 28,-0.2 52,-0.1 29,-0.1 -0.992 360.0-102.5-151.2 150.0 18.3 18.0 10.1 3 3 A G - 0 0 10 26,-2.4 29,-0.3 -2,-0.3 21,-0.2 -0.246 52.4 -81.1 -66.6 162.6 15.1 19.8 9.8 4 4 A A - 0 0 64 19,-0.3 18,-2.6 27,-0.2 27,-0.2 -0.311 47.5-116.1 -59.9 145.3 13.8 22.0 12.6 5 5 A D - 0 0 84 16,-0.2 28,-0.2 26,-0.2 2,-0.1 -0.539 30.3-106.0 -79.5 152.7 12.0 20.3 15.5 6 6 A G - 0 0 9 26,-2.8 29,-0.2 13,-0.3 15,-0.1 -0.468 44.7 -92.3 -71.9 147.2 8.4 20.9 16.2 7 7 A A - 0 0 74 13,-0.2 12,-2.5 -2,-0.1 27,-0.3 -0.351 41.4-114.9 -60.3 135.0 7.5 23.0 19.2 8 8 A H - 0 0 78 10,-0.2 28,-0.2 26,-0.2 10,-0.1 -0.509 32.1-115.5 -64.8 139.2 6.9 21.1 22.5 9 9 A G - 0 0 9 26,-3.5 2,-0.3 -2,-0.2 29,-0.2 -0.173 29.5-131.5 -68.7 167.8 3.4 21.4 23.8 10 10 A V - 0 0 92 27,-0.2 6,-2.7 7,-0.1 27,-0.3 -0.821 25.1 -85.7-127.7 160.3 2.7 23.1 27.1 11 11 A X + 0 0 53 -2,-0.3 2,-0.3 4,-0.2 28,-0.2 -0.279 68.1 104.4 -67.9 150.7 0.8 22.2 30.2 12 12 A G B > S-b 39 0B 18 26,-1.6 28,-2.2 32,-0.2 3,-0.5 -0.937 75.1 -39.6 174.0-151.3 -2.9 22.9 30.4 13 13 A b T 3 S+ 0 0 93 1,-0.9 2,-0.1 -2,-0.3 32,-0.1 -0.634 141.6 10.2-141.9 82.9 -6.4 21.4 30.3 14 14 A P T 3 S- 0 0 83 0, 0.0 -1,-0.9 0, 0.0 31,-0.2 0.465 104.6-119.4 -81.5 166.3 -5.7 19.5 28.1 15 15 A G < - 0 0 3 29,-2.6 -4,-0.2 -3,-0.5 32,-0.2 -0.380 43.9-104.2 -56.2 145.0 -1.9 19.7 27.7 16 16 A T - 0 0 66 -6,-2.7 21,-3.2 22,-0.2 30,-0.2 -0.366 33.8 -98.4 -84.3 157.4 -1.3 20.9 24.1 17 17 A A - 0 0 60 19,-0.2 31,-0.2 29,-0.1 2,-0.1 -0.461 34.0-116.6 -69.5 140.3 -0.2 18.7 21.2 18 18 A G - 0 0 8 29,-3.1 32,-0.2 16,-0.3 -10,-0.2 -0.482 37.0-112.4 -65.7 146.6 3.5 18.7 20.3 19 19 A A - 0 0 43 -12,-2.5 15,-2.9 30,-0.2 -13,-0.3 -0.528 31.7 -99.2 -83.1 149.4 4.0 20.0 16.7 20 20 A A - 0 0 64 13,-0.2 31,-0.2 -2,-0.2 -13,-0.2 -0.364 42.8-107.8 -63.1 144.5 5.2 17.7 13.9 21 21 A G - 0 0 9 29,-2.9 32,-0.2 10,-0.3 -16,-0.2 -0.336 39.0-101.7 -66.1 152.7 8.9 17.9 13.1 22 22 A S - 0 0 54 -18,-2.6 9,-3.1 10,-0.2 -19,-0.3 -0.438 37.6-102.8 -74.1 151.0 9.9 19.7 9.9 23 23 A V - 0 0 100 7,-0.2 -19,-0.3 29,-0.1 31,-0.2 -0.428 44.6-102.1 -64.1 145.5 10.8 17.7 6.8 24 24 A G - 0 0 6 29,-2.7 6,-0.2 4,-0.2 3,-0.1 -0.449 34.5-115.8 -61.8 142.3 14.5 17.5 6.2 25 25 A G > - 0 0 30 4,-0.3 3,-2.7 1,-0.2 30,-0.2 -0.226 62.0 -56.4 -60.7 167.2 15.9 19.8 3.5 26 26 A P T 3 S+ 0 0 132 0, 0.0 -1,-0.2 0, 0.0 30,-0.2 -0.302 133.7 10.6 -51.0 120.8 17.4 18.1 0.6 27 27 A G T 3 S+ 0 0 53 28,-3.0 2,-0.3 1,-0.3 29,-0.1 0.495 110.5 108.3 88.4 3.6 20.1 15.8 2.0 28 28 A a < - 0 0 18 -3,-2.7 27,-3.3 27,-0.1 29,-0.6 -0.770 68.3-110.3-116.7 158.6 19.1 16.2 5.6 29 29 A D B -a 2 0A 53 -28,-2.7 -26,-2.4 -2,-0.3 -4,-0.3 -0.350 44.9 -91.1 -77.0 162.1 17.4 14.1 8.3 30 30 A G - 0 0 3 29,-2.6 -7,-0.2 22,-0.2 32,-0.2 -0.364 39.1-111.5 -72.2 149.7 13.9 14.9 9.6 31 31 A G - 0 0 0 -9,-3.1 21,-3.2 22,-0.3 30,-0.3 -0.483 36.1-105.3 -75.4 155.2 13.1 17.1 12.5 32 32 A H - 0 0 41 -29,-0.3 -26,-2.8 19,-0.2 -10,-0.2 -0.542 31.3-113.1 -80.0 146.2 11.8 15.6 15.8 33 33 A G - 0 0 6 29,-3.2 -13,-0.2 16,-0.3 32,-0.2 -0.414 36.8-103.9 -71.2 150.2 8.2 16.1 16.8 34 34 A G - 0 0 0 -15,-2.9 15,-3.2 -27,-0.3 30,-0.3 -0.412 35.6-108.7 -69.2 150.6 7.5 18.2 19.9 35 35 A N - 0 0 5 13,-0.2 -26,-3.5 29,-0.2 31,-0.2 -0.403 38.0-104.5 -70.4 155.6 6.6 16.5 23.1 36 36 A G - 0 0 0 29,-2.7 196,-0.3 10,-0.3 -19,-0.2 -0.576 36.4-107.1 -80.0 147.2 3.0 16.7 24.3 37 37 A G - 0 0 3 -21,-3.2 9,-2.9 -27,-0.3 -22,-0.3 -0.399 33.9-110.5 -71.5 151.4 2.1 19.1 27.1 38 38 A N - 0 0 3 192,-0.3 -26,-1.6 7,-0.2 2,-0.3 -0.544 30.1-123.0 -81.6 145.2 1.2 17.7 30.6 39 39 A G B -b 12 0B 2 29,-2.9 190,-0.3 -2,-0.2 -26,-0.2 -0.629 14.4-125.3 -87.5 142.8 -2.3 17.9 31.9 40 40 A N > - 0 0 36 -28,-2.2 3,-2.5 -2,-0.3 30,-0.3 -0.253 63.2 -55.0 -68.1 167.4 -3.4 19.5 35.1 41 41 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.242 132.0 13.1 -52.5 132.5 -5.4 17.3 37.5 42 42 A G T 3 S+ 0 0 65 1,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.375 109.1 109.1 85.7 -3.3 -8.4 15.8 35.7 43 43 A b < - 0 0 13 -3,-2.5 27,-3.0 -31,-0.1 -1,-0.2 -0.812 69.0-111.4-113.7 144.4 -7.1 16.9 32.3 44 44 A A - 0 0 36 -2,-0.3 -29,-2.6 25,-0.3 2,-0.2 -0.303 27.9-121.5 -67.0 151.0 -5.7 14.9 29.4 45 45 A G - 0 0 10 26,-2.9 -7,-0.2 22,-0.3 29,-0.2 -0.603 33.1-103.2 -82.8 155.1 -2.1 15.1 28.3 46 46 A G - 0 0 5 -9,-2.9 21,-2.8 -30,-0.2 27,-0.3 -0.434 30.6-109.7 -81.3 151.8 -1.1 16.1 24.8 47 47 A V - 0 0 56 19,-0.2 -29,-3.1 -32,-0.2 -10,-0.2 -0.437 33.5-111.3 -70.0 147.1 -0.1 13.9 21.9 48 48 A G - 0 0 4 26,-2.7 29,-0.2 16,-0.4 -13,-0.2 -0.550 37.7-106.9 -69.7 148.1 3.5 13.9 20.8 49 49 A G - 0 0 5 -15,-3.2 15,-2.9 -30,-0.3 -16,-0.3 -0.420 34.5-102.8 -73.4 151.2 4.1 15.4 17.3 50 50 A A - 0 0 41 13,-0.2 -29,-2.9 -32,-0.2 -16,-0.2 -0.427 39.6-109.3 -65.6 143.0 5.0 13.2 14.4 51 51 A G - 0 0 9 26,-3.0 29,-0.3 10,-0.3 -19,-0.2 -0.419 38.5-104.9 -63.8 151.6 8.6 13.2 13.3 52 52 A G - 0 0 5 -21,-3.2 9,-2.7 -30,-0.3 27,-0.3 -0.525 35.9-103.8 -77.0 148.0 9.4 14.9 10.1 53 53 A A - 0 0 37 -32,-0.2 -29,-2.7 7,-0.2 -22,-0.3 -0.337 41.9-101.9 -66.2 151.2 10.1 12.9 6.9 54 54 A S - 0 0 16 26,-2.4 -25,-0.2 -31,-0.2 6,-0.1 -0.269 17.1-126.8 -68.2 158.5 13.8 12.7 5.8 55 55 A G S S- 0 0 21 -27,-3.3 -28,-3.0 4,-0.2 -27,-0.1 -0.119 81.3 -59.1 -94.2 33.8 15.2 14.8 2.9 56 56 A G S S+ 0 0 70 -30,-0.2 -27,-0.1 -29,-0.1 -2,-0.1 0.286 117.3 101.2 110.9 -6.6 16.5 11.6 1.2 57 57 A T S S- 0 0 58 -29,-0.6 -28,-0.1 2,-0.2 3,-0.1 0.673 87.8-120.3 -82.0 -19.0 18.8 10.2 4.0 58 58 A G S S+ 0 0 41 1,-0.2 2,-0.7 22,-0.1 -29,-0.1 0.489 79.2 116.2 87.4 5.2 16.5 7.6 5.3 59 59 A V - 0 0 71 -31,-0.1 -29,-2.6 22,-0.1 -4,-0.2 -0.870 44.8-172.4-114.0 98.4 16.5 9.2 8.8 60 60 A G - 0 0 23 -2,-0.7 -7,-0.2 19,-0.4 -28,-0.1 -0.445 31.1 -97.7 -78.3 159.9 13.1 10.5 9.8 61 61 A G - 0 0 2 -9,-2.7 18,-3.1 -30,-0.3 -10,-0.3 -0.331 42.2-100.9 -70.3 161.2 12.6 12.5 13.0 62 62 A R - 0 0 109 16,-0.2 -29,-3.2 -32,-0.2 -10,-0.2 -0.575 34.0-110.1 -77.8 146.6 11.5 10.9 16.2 63 63 A G - 0 0 11 13,-0.4 -13,-0.2 -2,-0.2 -1,-0.1 -0.500 42.3-104.0 -65.8 146.0 7.9 11.2 17.3 64 64 A G - 0 0 1 -15,-2.9 12,-2.4 -30,-0.3 2,-0.5 -0.249 34.1-102.8 -69.4 157.7 7.4 13.4 20.4 65 65 A K - 0 0 26 138,-0.3 -29,-2.7 -32,-0.2 10,-0.1 -0.707 39.8-115.8 -81.2 128.2 6.8 12.0 23.8 66 66 A G - 0 0 0 -2,-0.5 136,-0.3 -31,-0.2 -19,-0.2 -0.246 28.7-112.2 -63.8 147.3 3.2 12.2 25.0 67 67 A G - 0 0 0 -21,-2.8 6,-3.1 -30,-0.2 -22,-0.3 -0.454 28.2-117.8 -76.3 147.0 2.3 14.3 27.9 68 68 A S + 0 0 11 132,-0.3 -29,-2.9 4,-0.2 2,-0.3 -0.486 57.4 109.6 -80.3 163.6 1.1 12.7 31.2 69 69 A G S > S- 0 0 10 -31,-0.2 3,-0.6 -24,-0.1 -25,-0.3 -0.972 75.3 -31.9 165.3-157.2 -2.3 13.5 32.4 70 70 A T T 3 S+ 0 0 81 -27,-3.0 2,-0.1 1,-0.7 -2,-0.1 -0.817 144.2 8.6-129.4 82.3 -5.7 12.0 33.0 71 71 A P T 3 S- 0 0 52 0, 0.0 -26,-2.9 0, 0.0 -1,-0.7 0.606 101.6-124.8 -89.7 170.5 -5.2 10.3 30.6 72 72 A K < - 0 0 56 -3,-0.6 255,-0.5 -28,-0.2 -4,-0.2 -0.315 28.2-114.3 -64.7 146.5 -1.7 10.5 29.2 73 73 A G - 0 0 7 -6,-3.1 -7,-0.2 -27,-0.3 -27,-0.2 -0.421 30.0-106.7 -76.6 158.1 -1.2 11.4 25.5 74 74 A A - 0 0 10 251,-0.2 -26,-2.7 -29,-0.2 -7,-0.2 -0.461 32.9-106.5 -76.0 155.4 0.3 9.0 22.9 75 75 A D - 0 0 62 249,-0.2 249,-0.5 -28,-0.2 -10,-0.2 -0.490 43.3-105.0 -70.0 153.3 3.8 9.3 21.5 76 76 A G - 0 0 8 -12,-2.4 -13,-0.4 -27,-0.3 247,-0.2 -0.373 34.5 -97.2 -75.6 159.2 3.9 10.6 18.0 77 77 A A - 0 0 9 245,-0.3 -26,-3.0 -29,-0.2 -13,-0.2 -0.438 42.9-110.1 -62.9 147.2 4.7 8.5 14.9 78 78 A P - 0 0 61 0, 0.0 243,-0.5 0, 0.0 -16,-0.2 -0.470 41.5 -95.9 -72.9 157.2 8.3 8.6 13.7 79 79 A G - 0 0 8 -18,-3.1 -19,-0.4 -27,-0.3 241,-0.2 -0.388 42.7 -97.9 -72.8 150.4 9.0 10.4 10.4 80 80 A A 0 0 16 -29,-0.3 -26,-2.4 239,-0.2 -19,-0.2 -0.324 360.0 360.0 -65.4 147.9 9.1 8.5 7.2 81 81 A P 0 0 48 0, 0.0 236,-0.2 0, 0.0 -22,-0.1 -0.166 360.0 360.0 -66.1 360.0 12.6 7.6 5.9 82 !* 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 83 1 B c 0 0 115 0, 0.0 28,-2.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 161.2 17.3 0.9 -21.0 84 2 B K B -c 111 0C 89 26,-0.3 28,-0.2 52,-0.1 29,-0.1 -0.994 360.0-100.1-149.8 150.9 13.7 0.8 -19.7 85 3 B G - 0 0 8 26,-2.8 29,-0.3 -2,-0.3 21,-0.2 -0.338 53.1 -90.2 -62.3 155.1 10.7 3.1 -19.5 86 4 B A - 0 0 63 19,-0.2 18,-2.8 27,-0.2 27,-0.2 -0.330 43.7-111.4 -66.2 148.9 10.1 4.9 -16.2 87 5 B D - 0 0 66 16,-0.2 28,-0.2 26,-0.2 2,-0.2 -0.393 34.1-103.8 -75.9 158.5 7.9 3.2 -13.6 88 6 B G - 0 0 10 26,-3.2 29,-0.3 13,-0.3 15,-0.2 -0.545 38.5 -97.4 -81.5 150.4 4.5 4.5 -12.7 89 7 B A - 0 0 70 13,-0.2 12,-2.6 -2,-0.2 27,-0.3 -0.360 39.6-114.6 -62.2 140.2 3.8 6.4 -9.5 90 8 B H - 0 0 44 10,-0.2 28,-0.2 26,-0.2 -1,-0.1 -0.524 31.7-111.3 -71.3 144.9 2.4 4.4 -6.7 91 9 B G - 0 0 6 26,-3.5 2,-0.2 7,-0.2 29,-0.2 -0.159 32.9-130.1 -65.0 170.0 -1.1 5.3 -5.5 92 10 B V - 0 0 93 27,-0.2 6,-2.4 7,-0.1 27,-0.2 -0.719 30.1 -70.9-122.8 166.8 -1.7 6.9 -2.1 93 11 B X + 0 0 56 -2,-0.2 2,-0.3 4,-0.2 28,-0.2 -0.231 68.7 115.9 -54.1 141.7 -4.0 6.4 0.9 94 12 B G B > -d 121 0D 20 26,-1.4 28,-2.3 32,-0.1 3,-0.5 -0.961 69.4 -63.4-177.8-160.5 -7.6 7.0 0.6 95 13 B d T 3 S+ 0 0 96 1,-1.0 2,-0.1 -2,-0.3 32,-0.1 -0.597 138.4 13.2-145.4 75.4 -11.2 5.7 0.8 96 14 B P T 3 S- 0 0 80 0, 0.0 -1,-1.0 0, 0.0 31,-0.2 0.390 110.2-115.6 -83.3 167.9 -10.6 4.0 -1.6 97 15 B G < - 0 0 5 29,-2.6 32,-0.2 -3,-0.5 -4,-0.2 -0.251 42.4-102.9 -51.7 148.1 -6.9 4.0 -2.1 98 16 B T - 0 0 64 -6,-2.4 21,-3.4 22,-0.2 30,-0.3 -0.378 36.6 -94.4 -80.4 159.8 -6.0 5.7 -5.4 99 17 B A - 0 0 64 19,-0.2 31,-0.2 29,-0.1 2,-0.1 -0.456 34.9-119.0 -69.2 139.3 -5.0 3.9 -8.6 100 18 B G - 0 0 8 29,-2.7 32,-0.2 16,-0.3 -10,-0.2 -0.463 35.9-109.9 -65.6 149.4 -1.3 3.3 -9.4 101 19 B A - 0 0 45 -12,-2.6 15,-3.1 30,-0.2 30,-0.3 -0.512 34.0 -99.0 -81.8 153.3 -0.2 5.0 -12.6 102 20 B A - 0 0 64 13,-0.2 -13,-0.2 -2,-0.2 31,-0.2 -0.362 39.6-109.5 -64.8 147.2 0.7 3.0 -15.7 103 21 B G - 0 0 8 29,-2.9 -16,-0.2 10,-0.3 32,-0.2 -0.403 41.5 -95.8 -68.4 153.1 4.3 2.3 -16.4 104 22 B S - 0 0 56 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