==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-JUN-11 3SI1 . COMPND 2 MOLECULE: GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.DAMBE,D.CARRILLO,C.PARTHIER,M.T.STUBBS . 323 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14160.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 205 63.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 4.0 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 . 2 0.6 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 . 34 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 20.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.8 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 0 2 1 0 0 1 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 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 0 PARALLEL BRIDGES PER LADDER . 3 0 0 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 36 A A > 0 0 125 0, 0.0 3,-0.6 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 156.8 -2.2 37.3 -44.5 2 37 A W G > + 0 0 14 1,-0.2 2,-4.2 2,-0.1 3,-3.1 0.899 360.0 101.9 -42.5 -75.2 -3.3 34.3 -42.4 3 38 A T G 3 S+ 0 0 40 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 0.262 92.9 43.9 -3.4 -24.6 -4.4 35.5 -38.8 4 39 A Q G X S+ 0 0 135 -2,-4.2 3,-1.0 -3,-0.6 -1,-0.3 0.523 92.7 79.0-105.5 -12.7 -8.1 35.2 -39.9 5 40 A E G X> S+ 0 0 89 -3,-3.1 3,-1.7 1,-0.2 4,-0.7 0.859 74.0 80.6 -61.8 -36.3 -7.8 31.8 -41.7 6 41 A K G >4 S+ 0 0 47 1,-0.3 3,-0.6 2,-0.2 -1,-0.2 0.754 87.5 58.8 -36.0 -39.2 -7.9 30.1 -38.2 7 42 A N G <4 S+ 0 0 97 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.1 -0.121 96.9 58.2 -93.4 32.9 -11.7 30.5 -38.4 8 43 A H G <4 S+ 0 0 126 -3,-1.7 -1,-0.2 2,-0.0 -2,-0.2 0.500 77.8 122.5-121.9 -22.3 -12.3 28.5 -41.6 9 44 A H << + 0 0 24 -4,-0.7 312,-0.1 -3,-0.6 -3,-0.0 -0.053 29.0 168.8 -55.7 135.7 -10.8 25.2 -40.4 10 45 A Q - 0 0 103 311,-0.2 220,-0.0 310,-0.1 -2,-0.0 -0.952 30.5-106.1-143.7 155.1 -12.8 22.0 -40.4 11 46 A P - 0 0 25 0, 0.0 2,-0.7 0, 0.0 310,-0.2 0.043 11.7-114.0 -90.2 177.0 -11.3 18.5 -39.9 12 47 A A - 0 0 29 308,-0.7 2,-0.4 305,-0.2 308,-0.3 -0.911 29.3-151.0-108.9 102.3 -10.4 15.2 -41.6 13 48 A H - 0 0 112 -2,-0.7 2,-0.1 306,-0.1 304,-0.0 -0.619 13.5-153.3 -69.7 130.8 -12.6 12.4 -40.3 14 49 A L - 0 0 40 -2,-0.4 2,-0.2 1,-0.1 -1,-0.1 -0.115 17.1-106.7 -87.1-173.1 -10.7 9.1 -40.6 15 50 A N > - 0 0 83 1,-0.1 4,-3.9 -2,-0.1 3,-0.2 -0.728 29.4 -96.2-120.4 170.0 -12.4 5.7 -40.9 16 51 A S H > S+ 0 0 59 -2,-0.2 4,-4.5 2,-0.2 5,-0.2 0.945 119.7 61.2 -45.0 -62.3 -13.0 2.7 -38.7 17 52 A S H > S+ 0 0 69 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.860 117.4 30.5 -36.1 -56.4 -10.0 0.9 -39.9 18 53 A S H > S+ 0 0 47 -3,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.976 116.3 60.2 -65.9 -54.8 -7.8 3.8 -38.6 19 54 A L H < S+ 0 0 19 -4,-3.9 -2,-0.2 1,-0.2 -3,-0.2 0.790 107.0 49.2 -41.6 -39.0 -10.3 4.5 -35.8 20 55 A Q H >X S+ 0 0 85 -4,-4.5 3,-2.4 -5,-0.2 4,-0.8 0.995 98.5 65.8 -59.2 -66.0 -9.6 1.0 -34.6 21 56 A Q H 3< S+ 0 0 120 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.535 110.0 33.6 -46.1 -24.4 -5.9 1.1 -34.7 22 57 A V T 3< S+ 0 0 38 -4,-1.0 -1,-0.3 2,-0.2 -2,-0.1 -0.071 101.6 68.9-129.9 37.1 -5.4 3.7 -31.9 23 58 A A T <4 S+ 0 0 11 -3,-2.4 -2,-0.2 289,-0.1 -1,-0.1 0.118 116.5 36.4-110.1 -7.7 -8.3 3.0 -29.6 24 59 A E S < S+ 0 0 139 -4,-0.8 2,-0.8 1,-0.1 -2,-0.2 0.366 102.8 76.5-118.3 -6.2 -6.0 0.1 -29.2 25 60 A G S S+ 0 0 22 -5,-0.3 2,-0.2 2,-0.0 -1,-0.1 -0.478 89.5 64.6-106.5 62.8 -2.9 2.2 -29.6 26 61 A T - 0 0 17 -2,-0.8 2,-0.3 -3,-0.1 286,-0.0 -0.838 60.1-163.2 179.3 135.6 -3.2 3.5 -26.0 27 62 A S >> - 0 0 52 -2,-0.2 4,-1.9 1,-0.1 3,-1.5 -0.819 7.1-162.7-141.7 99.7 -2.9 1.7 -22.6 28 63 A I H 3> S+ 0 0 17 -2,-0.3 4,-1.5 1,-0.3 280,-0.1 0.429 94.0 58.3 -64.6 0.2 -4.2 3.6 -19.6 29 64 A S H 3> S+ 0 0 96 2,-0.2 4,-1.5 3,-0.1 -1,-0.3 0.680 105.1 50.7 -93.7 -28.8 -2.2 1.2 -17.3 30 65 A E H <>>S+ 0 0 46 -3,-1.5 4,-1.8 2,-0.2 5,-0.6 0.890 114.4 44.8 -66.3 -41.1 0.9 2.4 -19.1 31 66 A M H >X>S+ 0 0 0 -4,-1.9 5,-2.0 2,-0.2 4,-1.6 0.996 109.1 55.4 -65.1 -58.9 -0.4 5.9 -18.4 32 67 A W H 3<>S+ 0 0 39 -4,-1.5 5,-2.4 1,-0.2 -1,-0.2 0.823 118.8 33.2 -30.2 -51.7 -1.3 5.2 -14.8 33 68 A Q H 3<5S+ 0 0 103 -4,-1.5 -1,-0.2 3,-0.2 -2,-0.2 0.630 126.2 29.5-101.0 -18.1 2.2 4.0 -14.1 34 69 A N H <<5S+ 0 0 63 -4,-1.8 -3,-0.2 -3,-0.7 -2,-0.1 0.772 130.7 23.0-104.7 -42.1 4.7 6.0 -16.2 35 70 A D T < S- 0 0 44 64,-0.3 3,-0.8 66,-0.2 6,-0.7 -0.278 76.5 -62.4 -57.3 164.5 2.2 23.8 -6.1 45 80 A P T 3 S+ 0 0 14 0, 0.0 2,-1.0 0, 0.0 -1,-0.2 0.178 115.4 25.4 -64.5 175.4 5.0 26.5 -6.3 46 81 A G T 3 S+ 0 0 69 39,-0.3 40,-0.1 1,-0.1 -3,-0.0 -0.018 95.7 124.0 67.7 -30.2 8.1 26.9 -4.1 47 82 A S S X S- 0 0 14 -2,-1.0 3,-1.4 -3,-0.8 4,-0.2 -0.429 77.0-128.5 -81.6 127.8 7.9 23.2 -3.3 48 83 A P T >> S+ 0 0 120 0, 0.0 4,-1.5 0, 0.0 3,-0.7 0.784 117.0 61.9 -19.9 -41.5 10.6 20.6 -3.8 49 84 A G H 3> S+ 0 0 8 -7,-0.4 4,-2.2 1,-0.2 2,-1.8 0.945 85.0 68.7 -58.9 -54.7 7.5 19.1 -5.5 50 85 A S H <4 S+ 0 0 11 -3,-1.4 -1,-0.2 -6,-0.7 -4,-0.1 0.188 110.8 38.5 -57.0 22.2 7.1 21.8 -8.2 51 86 A Y H <> S+ 0 0 124 -2,-1.8 4,-1.9 -3,-0.7 5,-0.6 0.461 103.1 60.8-135.3 -46.9 10.4 20.3 -9.6 52 87 A S H X S+ 0 0 60 -4,-1.5 4,-1.0 -3,-0.2 -2,-0.2 0.843 119.0 39.3 -53.8 -32.0 10.1 16.6 -9.2 53 88 A A H >X S+ 0 0 0 -4,-2.2 3,-1.4 2,-0.2 4,-1.1 0.880 114.3 46.9 -76.6 -91.2 7.2 17.2 -11.4 54 89 A R H >> S+ 0 0 30 1,-0.3 4,-1.1 2,-0.2 3,-0.8 0.657 119.4 43.2 -18.4 -67.7 8.4 19.9 -13.9 55 90 A Q H 3X S+ 0 0 88 -4,-1.9 4,-0.8 1,-0.2 5,-0.4 0.924 106.2 62.2 -48.5 -54.6 11.5 18.0 -14.4 56 91 A H H X S+ 0 0 30 -4,-1.1 3,-1.6 1,-0.3 4,-0.9 0.410 110.5 32.0 -10.0 -79.4 10.7 17.4 -19.6 59 94 A Q H 3X S+ 0 0 101 -4,-0.8 4,-3.1 1,-0.3 5,-0.3 0.859 107.5 72.3 -53.6 -34.4 12.3 14.1 -20.6 60 95 A R H << S+ 0 0 15 -3,-4.6 -1,-0.3 -4,-1.2 -2,-0.2 0.887 112.4 32.2 -48.5 -40.5 8.8 12.5 -20.6 61 96 A I H X< S+ 0 0 5 -3,-1.6 3,-4.2 -4,-0.6 -2,-0.2 0.886 120.7 43.3 -68.9 -94.1 8.5 14.5 -23.7 62 97 A Q H 3< S+ 0 0 101 -4,-0.9 -3,-0.2 1,-0.3 -2,-0.2 0.588 98.1 73.7 -32.8 -36.2 12.0 14.8 -25.3 63 98 A R T 3< S+ 0 0 141 -4,-3.1 -1,-0.3 -5,-0.2 -3,-0.1 0.766 85.0 103.0 -47.0 -23.9 12.7 11.1 -24.7 64 99 A L S < S- 0 0 22 -3,-4.2 4,-0.1 -5,-0.3 74,-0.1 -0.337 79.6-132.5 -71.4 143.7 10.2 10.8 -27.6 65 100 A Q S S+ 0 0 138 -2,-0.1 -1,-0.1 2,-0.1 -3,-0.1 0.665 84.1 81.9 -64.5 -24.0 11.1 10.1 -31.1 66 101 A A S S- 0 0 10 71,-0.2 76,-0.1 -5,-0.1 79,-0.1 0.228 95.1 -84.3 -72.2-149.3 8.9 13.0 -32.4 67 102 A E + 0 0 63 2,-0.0 27,-0.4 77,-0.0 -2,-0.1 0.049 51.9 163.3-123.7 25.4 9.9 16.6 -32.6 68 103 A W - 0 0 27 25,-0.1 2,-0.5 -4,-0.1 25,-0.2 -0.105 21.6-163.6 -75.0 148.5 9.5 18.8 -29.4 69 104 A V - 0 0 71 23,-1.7 2,-0.4 21,-0.1 -1,-0.1 -0.943 21.8-157.0-129.7 102.0 11.0 22.1 -28.5 70 105 A V - 0 0 47 -2,-0.5 2,-0.4 21,-0.1 21,-0.2 -0.718 13.9-179.2-109.3 124.8 10.7 22.8 -24.8 71 106 A E E -A 90 0A 93 19,-1.1 19,-2.0 -2,-0.4 2,-0.8 -0.946 17.8-150.0-126.4 132.1 10.7 26.1 -22.9 72 107 A V E -A 89 0A 51 -2,-0.4 2,-0.6 17,-0.2 17,-0.2 -0.781 10.6-162.6 -99.6 93.9 10.4 27.0 -19.1 73 108 A D E +A 88 0A 6 15,-2.0 15,-0.5 -2,-0.8 2,-0.3 -0.692 21.3 176.0 -75.7 127.4 8.8 30.4 -18.6 74 109 A T E +A 87 0A 68 -2,-0.6 2,-0.3 13,-0.2 13,-0.2 -0.996 4.7 154.6-138.1 134.7 9.7 31.4 -15.1 75 110 A F E -A 86 0A 32 11,-1.7 11,-2.4 -2,-0.3 2,-0.4 -0.892 35.5-104.1-157.0-178.2 9.1 34.6 -13.1 76 111 A L E +A 85 0A 124 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.898 40.1 169.5-124.8 134.3 8.6 36.3 -9.8 77 112 A S - 0 0 21 7,-2.5 2,-0.9 -2,-0.4 7,-0.1 -0.721 39.2 -80.9-143.1-172.8 5.4 37.4 -8.2 78 113 A R + 0 0 129 -2,-0.2 5,-0.2 5,-0.2 99,-0.1 -0.841 41.5 177.3 -95.2 99.1 3.1 38.7 -5.5 79 114 A T B > -H 82 0B 2 3,-3.8 3,-3.9 -2,-0.9 95,-0.1 -0.872 44.6-116.8 -95.5 139.4 2.1 35.9 -3.3 80 115 A P T 3 S+ 0 0 68 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.294 123.3 47.6 -55.0 14.3 -0.1 36.9 -0.2 81 116 A Y T 3 S- 0 0 116 1,-0.3 2,-0.4 3,-0.0 -3,-0.0 0.201 127.7 -87.3-133.9 5.7 3.0 35.6 1.6 82 117 A G B < S-H 79 0B 22 -3,-3.9 -3,-3.8 2,-0.0 2,-0.6 -0.946 75.7 -16.8 124.4-143.3 5.7 37.4 -0.4 83 118 A Y + 0 0 144 -2,-0.4 -5,-0.2 -5,-0.2 -1,-0.0 -0.535 62.1 167.7-115.9 70.4 7.7 36.9 -3.6 84 119 A R - 0 0 98 -2,-0.6 -7,-2.5 -8,-0.1 2,-0.2 -0.251 32.2-116.6 -68.0 159.7 7.5 33.2 -4.7 85 120 A S E -A 76 0A 56 -9,-0.2 2,-0.3 -11,-0.0 -39,-0.3 -0.562 22.6-150.2 -95.7 167.8 8.7 32.1 -8.1 86 121 A F E -A 75 0A 1 -11,-2.4 -11,-1.7 -2,-0.2 2,-0.1 -0.994 6.2-160.8-141.5 146.3 6.6 30.5 -10.9 87 122 A S E -A 74 0A 11 -2,-0.3 -13,-0.2 -13,-0.2 76,-0.1 -0.374 4.2-173.4-137.9 68.5 7.4 28.1 -13.8 88 123 A N E -A 73 0A 0 -15,-0.5 -15,-2.0 74,-0.2 2,-0.4 -0.261 20.2-141.3 -46.8 127.2 5.1 27.7 -16.8 89 124 A I E -AB 72 160A 2 71,-2.6 71,-2.0 -17,-0.2 2,-0.3 -0.814 13.4-166.8-102.5 138.5 6.1 24.8 -19.2 90 125 A I E -A 71 0A 9 -19,-2.0 -19,-1.1 -2,-0.4 69,-0.2 -0.613 4.6-175.6-136.6 74.3 5.9 25.0 -23.0 91 126 A S - 0 0 0 -2,-0.3 67,-1.8 -21,-0.2 2,-0.3 -0.334 15.3-176.8 -56.6 142.1 6.2 21.9 -25.2 92 127 A T B -C 157 0A 17 65,-0.2 -23,-1.7 -2,-0.1 2,-0.4 -0.884 23.9-164.6-156.6 115.0 6.2 22.7 -29.0 93 128 A L S S+ 0 0 0 63,-2.4 63,-0.5 -2,-0.3 -25,-0.1 -0.861 87.3 2.7 -94.2 138.4 6.3 20.7 -32.3 94 129 A N - 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