==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 13-APR-10 3MJV . COMPND 2 MOLECULE: AMPHB; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES NODOSUS; . AUTHOR J.ZHENG,C.A.TAYLOR,S.K.PIASECKI,A.T.KEATINGE-CLAY . 951 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36296.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 685 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 128 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 4.8 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 . 4 0.4 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 . 66 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 112 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 303 31.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.7 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 4 1 1 3 4 4 2 3 1 2 2 4 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 8 6 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 PARALLEL BRIDGES PER LADDER . 0 6 0 2 0 0 2 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 . 4 0 0 0 0 0 0 0 0 0 0 0 0 2 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 -2 A S > 0 0 89 0, 0.0 4,-1.2 0, 0.0 209,-0.0 0.000 360.0 360.0 360.0 152.6 -20.7 6.7 7.4 2 -1 A H H > + 0 0 145 2,-0.2 4,-0.7 1,-0.2 3,-0.1 0.897 360.0 52.3 -66.9 -38.2 -22.7 7.4 4.3 3 0 A M H >> S+ 0 0 61 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.928 107.4 51.0 -69.1 -41.1 -19.5 8.7 2.6 4 1 A D H >4 S+ 0 0 29 1,-0.2 3,-1.8 2,-0.2 203,-0.3 0.881 103.7 61.0 -53.5 -37.0 -17.6 5.6 3.5 5 2 A A H 3< S+ 0 0 55 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.645 97.7 57.4 -78.1 -13.1 -20.4 3.5 2.1 6 3 A L H << S+ 0 0 7 -3,-1.3 439,-2.5 -4,-0.7 2,-0.4 0.667 91.7 89.3 -83.3 -12.7 -19.9 5.1 -1.4 7 4 A R E << +A 444 0A 0 -3,-1.8 200,-2.8 -4,-0.5 2,-0.3 -0.705 48.4 164.2-101.1 133.1 -16.2 4.0 -1.6 8 5 A Y E -AB 443 206A 8 435,-2.6 435,-1.9 -2,-0.4 2,-0.4 -0.881 15.3-157.3-134.5 157.1 -15.1 0.7 -3.0 9 6 A H E - B 0 205A 61 196,-2.8 196,-2.6 -2,-0.3 2,-0.3 -1.000 19.1-116.5-142.5 152.9 -11.9 -0.6 -4.2 10 7 A I E + B 0 204A 48 -2,-0.4 2,-0.3 194,-0.2 194,-0.2 -0.636 34.7 176.8 -81.1 133.1 -10.5 -3.3 -6.4 11 8 A E E - B 0 203A 62 192,-2.5 192,-2.8 -2,-0.3 2,-0.5 -0.870 24.7-133.7-129.0 166.0 -8.5 -6.1 -4.8 12 9 A W E - B 0 202A 36 -2,-0.3 2,-0.3 190,-0.2 190,-0.2 -0.970 25.7-171.3-127.6 118.6 -6.8 -9.2 -6.3 13 10 A N E - B 0 201A 53 188,-2.3 188,-2.5 -2,-0.5 -2,-0.0 -0.783 29.6 -98.0-114.8 150.8 -7.4 -12.4 -4.4 14 11 A R E - B 0 200A 111 -2,-0.3 186,-0.2 186,-0.2 2,-0.2 -0.265 41.4-171.7 -60.4 137.2 -5.8 -15.8 -4.8 15 12 A V - 0 0 10 184,-2.4 184,-0.4 1,-0.1 675,-0.1 -0.719 36.0 -60.7-121.4-177.3 -7.9 -18.4 -6.8 16 13 A A - 0 0 27 673,-0.3 675,-0.2 -2,-0.2 -1,-0.1 -0.243 51.0-108.7 -64.6 140.8 -7.5 -22.2 -7.4 17 14 A E - 0 0 96 673,-0.3 -1,-0.1 1,-0.1 161,-0.0 -0.590 46.3-120.9 -58.1 132.8 -4.5 -23.6 -9.2 18 15 A P - 0 0 25 0, 0.0 164,-0.1 0, 0.0 163,-0.1 -0.229 33.2 -83.0 -73.4 169.6 -5.9 -24.7 -12.6 19 16 A G - 0 0 54 162,-0.3 165,-0.1 166,-0.3 166,-0.1 -0.056 31.8-119.2 -63.5 172.8 -5.7 -28.2 -13.9 20 17 A T S S+ 0 0 151 161,-0.1 2,-0.4 2,-0.1 -1,-0.1 0.515 81.5 90.6 -97.4 -6.2 -2.7 -29.7 -15.6 21 18 A A - 0 0 69 160,-0.1 163,-0.2 1,-0.1 -2,-0.1 -0.753 69.3-133.5 -96.5 137.2 -4.3 -30.6 -19.0 22 19 A R - 0 0 98 -2,-0.4 159,-0.1 1,-0.2 -1,-0.1 -0.272 49.6 -67.5 -77.5 170.7 -4.2 -28.2 -21.9 23 20 A P - 0 0 5 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 -0.329 39.4-143.6 -59.8 136.0 -7.4 -27.6 -23.9 24 21 A A S S+ 0 0 111 160,-0.1 -2,-0.1 -3,-0.1 160,-0.0 0.938 80.5 59.7 -67.1 -45.8 -8.4 -30.7 -25.9 25 22 A G S S- 0 0 40 1,-0.1 2,-0.3 54,-0.0 54,-0.1 -0.074 102.2 -77.2 -76.3-179.7 -9.8 -28.8 -28.9 26 23 A R - 0 0 101 52,-0.4 54,-2.7 50,-0.1 55,-0.6 -0.606 39.5-141.6 -89.6 132.5 -7.7 -26.4 -31.1 27 24 A L E -c 81 0A 1 -2,-0.3 26,-2.5 21,-0.2 2,-0.6 -0.608 4.6-145.1 -87.1 151.2 -6.8 -22.9 -30.1 28 25 A L E -cd 82 53A 0 53,-2.2 55,-3.4 -2,-0.2 2,-0.5 -0.975 14.6-160.5-111.8 116.1 -6.8 -19.9 -32.4 29 26 A A E -cd 83 54A 0 24,-3.3 26,-2.9 -2,-0.6 2,-0.5 -0.877 2.5-154.8 -99.2 133.5 -4.1 -17.4 -31.6 30 27 A V E -cd 84 55A 0 53,-2.6 55,-3.2 -2,-0.5 2,-0.4 -0.926 15.3-173.8-111.8 125.6 -4.4 -13.9 -33.0 31 28 A I E - d 0 56A 7 24,-2.6 26,-2.9 -2,-0.5 55,-0.1 -0.913 28.5-132.4-121.4 140.1 -1.1 -11.9 -33.4 32 29 A S > - 0 0 1 3,-0.4 3,-2.3 -2,-0.4 26,-0.1 -0.887 27.1-148.0 -88.7 112.2 -0.4 -8.3 -34.4 33 30 A P T 3 S+ 0 0 40 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.753 92.2 46.4 -69.8 -22.2 2.2 -8.9 -37.0 34 31 A D T 3 S+ 0 0 139 1,-0.2 3,-0.1 2,-0.1 24,-0.0 0.425 118.8 44.9 -85.9 -1.4 4.3 -5.7 -36.5 35 32 A H S < S+ 0 0 53 -3,-2.3 -3,-0.4 1,-0.1 -1,-0.2 -0.312 76.4 108.0-140.6 57.7 4.2 -6.3 -32.7 36 33 A A + 0 0 31 -3,-0.5 -1,-0.1 1,-0.1 -2,-0.1 0.278 57.6 81.9-117.4 8.2 4.9 -10.0 -32.2 37 34 A G + 0 0 66 -3,-0.1 -1,-0.1 4,-0.1 -2,-0.0 0.506 53.6 116.2 -97.7 -7.2 8.4 -9.7 -30.8 38 35 A A S >> S- 0 0 35 -3,-0.2 4,-2.0 1,-0.1 3,-0.9 -0.345 72.9-118.7 -64.6 145.1 7.8 -9.0 -27.1 39 36 A P H 3> S+ 0 0 102 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.894 113.4 51.4 -51.8 -43.7 9.2 -11.8 -24.8 40 37 A W H 3> S+ 0 0 17 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.836 106.4 55.4 -65.7 -28.9 5.8 -12.5 -23.4 41 38 A V H <> S+ 0 0 1 -3,-0.9 4,-2.8 2,-0.2 5,-0.2 0.946 110.7 43.9 -65.2 -48.4 4.3 -12.8 -26.8 42 39 A T H X S+ 0 0 76 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.896 113.0 53.6 -65.3 -33.2 6.8 -15.5 -27.9 43 40 A A H X S+ 0 0 24 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.914 110.2 46.5 -67.3 -37.5 6.4 -17.2 -24.5 44 41 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.935 111.4 49.8 -67.5 -47.7 2.7 -17.4 -24.9 45 42 A L H X S+ 0 0 16 -4,-2.8 4,-0.8 2,-0.2 -2,-0.2 0.910 112.0 50.6 -58.8 -38.6 2.9 -18.7 -28.5 46 43 A D H >< S+ 0 0 138 -4,-2.5 3,-1.0 -5,-0.2 -2,-0.2 0.950 110.4 49.4 -64.0 -38.8 5.4 -21.3 -27.2 47 44 A A H 3< S+ 0 0 26 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.828 104.0 58.1 -73.8 -28.9 3.0 -22.3 -24.4 48 45 A L H 3< S- 0 0 1 -4,-2.3 -1,-0.3 -5,-0.1 4,-0.2 0.728 107.7-134.3 -73.9 -17.7 0.0 -22.7 -26.8 49 46 A G X< - 0 0 14 -3,-1.0 3,-1.4 -4,-0.8 -1,-0.1 0.164 21.7 -77.0 82.9 162.3 2.0 -25.3 -28.8 50 47 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.696 120.8 66.9 -80.7 -10.7 2.6 -25.8 -32.5 51 48 A D T 3 S+ 0 0 101 -3,-0.2 -2,-0.1 2,-0.1 2,-0.0 0.644 77.1 106.3 -72.3 -22.0 -0.8 -27.3 -33.2 52 49 A T S < S- 0 0 10 -3,-1.4 2,-0.3 -4,-0.2 -24,-0.2 -0.360 75.9-123.7 -60.6 134.7 -2.4 -23.9 -32.4 53 50 A V E -d 28 0A 19 -26,-2.5 -24,-3.3 -2,-0.0 2,-0.4 -0.662 24.2-144.4 -80.6 143.7 -3.7 -22.1 -35.5 54 51 A R E -d 29 0A 129 -2,-0.3 2,-0.5 -26,-0.2 -24,-0.2 -0.917 14.6-171.7-118.8 128.4 -2.2 -18.6 -36.0 55 52 A F E -d 30 0A 13 -26,-2.9 -24,-2.6 -2,-0.4 2,-0.7 -0.993 13.2-150.2-118.6 117.2 -4.1 -15.6 -37.4 56 53 A E E -d 31 0A 122 -2,-0.5 2,-1.0 -26,-0.2 -24,-0.2 -0.834 10.3-148.7 -85.9 114.6 -2.1 -12.4 -38.2 57 54 A A - 0 0 0 -26,-2.9 2,-0.4 -2,-0.7 48,-0.1 -0.715 20.0-161.3 -86.7 99.8 -4.5 -9.5 -37.8 58 55 A K - 0 0 160 -2,-1.0 3,-0.4 -26,-0.1 7,-0.1 -0.738 46.9 -37.8 -95.8 131.7 -3.1 -7.1 -40.4 59 56 A G S S- 0 0 42 -2,-0.4 2,-0.2 1,-0.2 -2,-0.0 -0.294 95.3 -60.8 63.9-142.6 -4.0 -3.4 -40.2 60 57 A T S S+ 0 0 43 48,-0.0 2,-0.5 -2,-0.0 -1,-0.2 -0.625 76.2 139.6-141.5 81.3 -7.6 -2.5 -39.2 61 58 A D > - 0 0 81 -3,-0.4 4,-2.7 1,-0.2 5,-0.2 -0.861 26.1-174.9-136.3 91.0 -10.0 -4.0 -41.7 62 59 A R H > S+ 0 0 74 -2,-0.5 4,-3.0 1,-0.2 -1,-0.2 0.905 86.7 47.8 -47.9 -52.1 -13.1 -5.6 -40.2 63 60 A A H > S+ 0 0 73 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.900 111.9 48.7 -65.8 -39.3 -14.4 -7.0 -43.5 64 61 A A H > S+ 0 0 32 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.943 113.8 47.0 -66.5 -40.7 -11.1 -8.5 -44.5 65 62 A W H X S+ 0 0 2 -4,-2.7 4,-3.2 1,-0.2 5,-0.3 0.896 106.8 56.2 -70.8 -39.5 -10.7 -10.2 -41.2 66 63 A A H X S+ 0 0 16 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.936 110.6 46.8 -52.8 -42.0 -14.2 -11.5 -41.2 67 64 A A H X S+ 0 0 68 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.929 114.0 46.5 -63.1 -45.8 -13.5 -13.2 -44.5 68 65 A Q H X S+ 0 0 85 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.932 113.6 48.3 -66.8 -40.0 -10.2 -14.6 -43.3 69 66 A L H X S+ 0 0 0 -4,-3.2 4,-2.6 2,-0.2 -1,-0.2 0.868 107.5 54.8 -66.3 -40.4 -11.7 -15.8 -40.1 70 67 A A H X S+ 0 0 29 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.927 108.4 50.6 -61.0 -40.4 -14.6 -17.5 -41.8 71 68 A Q H X S+ 0 0 99 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.928 110.3 48.2 -61.2 -45.8 -12.2 -19.4 -43.9 72 69 A L H X S+ 0 0 37 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.904 111.4 49.3 -59.2 -43.2 -10.2 -20.6 -40.9 73 70 A R H X S+ 0 0 81 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.800 109.1 54.4 -73.3 -21.4 -13.4 -21.7 -39.0 74 71 A E H < S+ 0 0 123 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.980 113.1 42.3 -70.9 -51.6 -14.5 -23.6 -42.2 75 72 A D H < S+ 0 0 100 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.788 125.7 31.1 -65.6 -39.1 -11.3 -25.5 -42.4 76 73 A E H < S- 0 0 85 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.752 92.3-141.8 -94.7 -24.9 -10.9 -26.2 -38.7 77 74 A G < - 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