==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 15-AUG-11 3TEU . COMPND 2 MOLECULE: FIBCON; . SOURCE 2 SYNTHETIC: YES . AUTHOR J.LUO,S.JACOBS,A.TEPLYAKOV,G.OBMOLOVA,K.O'NEIL,G.GILLILAND . 98 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5670.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 52 53.1 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 . 38 38.8 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 . 2 2.0 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 . 6 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 5.1 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 . 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 . 0 1 0 1 2 1 0 1 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 1 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 1 A M 0 0 201 0, 0.0 2,-0.3 0, 0.0 80,-0.1 0.000 360.0 360.0 360.0 130.7 -7.7 3.8 -6.7 2 2 A L - 0 0 12 78,-0.3 2,-0.1 72,-0.1 72,-0.1 -0.646 360.0-125.4-129.5 135.2 -8.8 2.1 -3.9 3 3 A D - 0 0 68 -2,-0.3 78,-0.2 78,-0.2 71,-0.1 -0.390 38.5-109.3 -77.7 155.3 -10.7 2.7 -0.7 4 4 A A - 0 0 26 79,-0.1 22,-0.2 1,-0.1 -1,-0.1 -0.469 26.6-105.4 -78.9 152.8 -9.1 1.7 2.6 5 5 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.297 43.3-143.3 -61.5 165.7 -10.1 -1.1 4.9 6 6 A T E +A 23 0A 72 17,-2.3 17,-3.1 1,-0.2 78,-0.1 -0.840 55.7 32.5-132.7 165.2 -11.9 -0.0 8.1 7 7 A D E - 0 0 93 -2,-0.3 2,-0.4 15,-0.2 -1,-0.2 0.957 62.7-151.4 58.3 67.7 -12.4 -0.8 11.8 8 8 A L E - 0 0 31 14,-0.1 2,-0.5 77,-0.1 14,-0.2 -0.547 18.3-171.9 -70.2 122.2 -9.0 -2.0 13.0 9 9 A Q E -A 21 0A 93 12,-2.6 12,-2.5 -2,-0.4 2,-0.7 -0.981 20.8-148.5-122.7 132.9 -9.5 -4.4 15.9 10 10 A V E +A 20 0A 43 -2,-0.5 10,-0.2 10,-0.2 3,-0.1 -0.869 19.2 173.8 -97.4 117.3 -7.0 -5.9 18.1 11 11 A T E + 0 0 92 8,-1.6 2,-0.3 -2,-0.7 9,-0.1 0.600 65.4 15.5-100.1 -13.5 -8.3 -9.3 19.2 12 12 A N E -A 19 0A 82 7,-1.0 7,-2.8 2,-0.0 2,-0.3 -0.957 57.4-176.3-159.9 148.7 -5.2 -10.5 21.1 13 13 A V E +A 18 0A 48 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.989 7.8 165.5-149.8 134.2 -1.9 -9.1 22.5 14 14 A T - 0 0 51 3,-2.6 77,-2.1 -2,-0.3 3,-0.1 -0.645 57.1 -84.0-128.6-172.2 1.0 -10.7 24.2 15 15 A D S S+ 0 0 53 75,-0.2 75,-0.1 -2,-0.2 50,-0.1 0.779 128.1 20.9 -66.3 -24.1 4.5 -9.5 25.0 16 16 A T S S+ 0 0 68 48,-0.1 46,-2.6 1,-0.1 2,-0.3 0.292 119.8 49.6-129.4 5.6 5.7 -10.4 21.5 17 17 A S - 0 0 15 43,-0.2 -3,-2.6 44,-0.2 2,-0.3 -0.990 47.4-164.8-151.7 157.3 2.6 -10.6 19.2 18 18 A I E -AB 13 59A 2 41,-2.0 41,-2.9 -2,-0.3 2,-0.5 -0.991 9.8-154.8-139.2 137.4 -0.6 -8.8 18.2 19 19 A T E -AB 12 58A 23 -7,-2.8 -8,-1.6 -2,-0.3 -7,-1.0 -0.943 22.6-179.2-106.3 131.1 -3.6 -10.2 16.3 20 20 A V E -AB 10 57A 0 37,-2.6 37,-2.1 -2,-0.5 2,-0.3 -0.958 12.2-166.5-134.8 164.0 -5.6 -7.7 14.3 21 21 A S E -AB 9 56A 30 -12,-2.5 -12,-2.6 -2,-0.4 2,-0.3 -0.901 5.1-175.7-139.4 154.9 -8.5 -7.7 12.2 22 22 A W E - 0 0 8 33,-2.3 -15,-0.2 -2,-0.3 -14,-0.1 -0.953 27.7-112.1-151.9 167.8 -10.2 -5.3 9.8 23 23 A T E -A 6 0A 65 -17,-3.1 -17,-2.3 -2,-0.3 -15,-0.0 -0.861 42.3-111.7-102.6 134.6 -13.3 -4.8 7.6 24 24 A P - 0 0 66 0, 0.0 -20,-0.1 0, 0.0 -1,-0.0 -0.255 29.6-111.7 -62.1 156.9 -12.7 -4.9 3.8 25 25 A P - 0 0 13 0, 0.0 4,-0.1 0, 0.0 -21,-0.1 -0.219 30.7-105.6 -69.4 169.2 -13.1 -1.8 1.7 26 26 A S S S+ 0 0 120 -22,-0.2 3,-0.1 2,-0.1 -22,-0.0 0.833 93.6 90.9 -62.9 -31.2 -16.0 -1.5 -0.8 27 27 A A S S- 0 0 34 1,-0.1 2,-0.2 -23,-0.1 -25,-0.0 -0.282 90.5-100.3 -65.9 152.5 -13.7 -2.1 -3.8 28 28 A T - 0 0 113 2,-0.0 2,-0.3 48,-0.0 -1,-0.1 -0.519 53.0-165.5 -56.3 130.7 -12.8 -5.5 -5.4 29 29 A I - 0 0 31 -2,-0.2 47,-0.3 -4,-0.1 3,-0.1 -0.889 34.1-163.4-132.3 161.5 -9.4 -6.4 -4.0 30 30 A T S S- 0 0 64 45,-2.8 2,-0.3 -2,-0.3 46,-0.2 0.346 71.2 -27.4-122.5 1.8 -6.6 -8.8 -4.6 31 31 A G E -C 75 0B 4 44,-1.0 44,-2.5 20,-0.2 2,-0.3 -0.962 53.8-112.5 171.1 176.5 -4.6 -8.7 -1.3 32 32 A Y E -CD 74 50B 1 18,-2.0 18,-2.3 -2,-0.3 2,-0.4 -0.992 13.3-153.3-132.2 148.9 -3.6 -6.7 1.7 33 33 A R E -CD 73 49B 40 40,-2.4 40,-3.2 -2,-0.3 2,-0.4 -0.977 14.1-165.4-114.2 133.7 -0.2 -5.2 2.8 34 34 A I E -CD 72 48B 0 14,-2.8 14,-2.6 -2,-0.4 2,-0.3 -0.981 3.2-170.2-120.5 129.2 0.3 -4.7 6.5 35 35 A T E -CD 71 47B 8 36,-2.6 36,-2.3 -2,-0.4 2,-0.3 -0.867 3.7-176.4-114.3 155.0 3.1 -2.7 8.0 36 36 A Y E +CD 70 46B 32 10,-2.1 10,-2.4 -2,-0.3 34,-0.2 -0.989 12.3 149.3-150.1 140.9 4.2 -2.4 11.6 37 37 A T E -C 69 0B 18 32,-1.5 32,-3.0 -2,-0.3 2,-0.1 -0.967 47.8 -93.8-161.8 151.5 6.8 -0.4 13.5 38 38 A P E > -C 68 0B 27 0, 0.0 3,-2.0 0, 0.0 30,-0.3 -0.440 30.4-126.9 -64.3 146.3 7.2 1.1 16.9 39 39 A S T 3 S+ 0 0 62 28,-2.6 29,-0.1 1,-0.3 48,-0.0 0.851 115.5 51.0 -55.8 -35.6 6.1 4.7 17.3 40 40 A N T 3 S+ 0 0 128 27,-0.5 -1,-0.3 2,-0.0 28,-0.1 0.339 89.7 101.6 -84.7 7.2 9.6 5.3 18.7 41 41 A G S < S- 0 0 21 -3,-2.0 -4,-0.0 1,-0.1 0, 0.0 -0.422 98.2 -97.4 -82.7 161.1 11.3 3.6 15.7 42 42 A P - 0 0 142 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.631 66.7-106.6 -49.9 -10.4 12.9 6.0 12.9 43 43 A G S S+ 0 0 37 1,-0.3 -2,-0.0 -5,-0.2 -4,-0.0 0.520 80.6 136.6 89.3 16.7 9.6 5.1 11.4 44 44 A E - 0 0 161 1,-0.1 -1,-0.3 -8,-0.0 2,-0.1 -0.790 45.7-147.0 -93.8 110.2 10.8 2.7 8.8 45 45 A P - 0 0 57 0, 0.0 2,-0.3 0, 0.0 -8,-0.2 -0.304 12.6-122.7 -92.1 166.9 8.4 -0.2 9.0 46 46 A K E -D 36 0B 134 -10,-2.4 -10,-2.1 -2,-0.1 2,-0.3 -0.699 34.2-144.7 -83.3 151.5 8.5 -3.9 8.5 47 47 A E E +D 35 0B 120 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.947 19.8 178.3-130.0 145.9 6.0 -5.2 5.9 48 48 A L E -D 34 0B 51 -14,-2.6 -14,-2.8 -2,-0.3 2,-0.4 -0.944 12.3-153.1-135.1 151.0 3.8 -8.3 5.4 49 49 A T E -D 33 0B 99 -2,-0.3 -16,-0.2 -16,-0.2 -18,-0.0 -0.963 11.7-179.1-128.1 154.2 1.4 -9.3 2.7 50 50 A V E -D 32 0B 21 -18,-2.3 -18,-2.0 -2,-0.4 7,-0.0 -0.952 34.2 -95.0-140.1 157.6 -1.6 -11.6 2.8 51 51 A P > - 0 0 69 0, 0.0 3,-2.0 0, 0.0 -20,-0.2 -0.278 42.6-106.5 -67.6 164.4 -4.2 -12.9 0.4 52 52 A P T 3 S+ 0 0 52 0, 0.0 -21,-0.2 0, 0.0 -22,-0.1 0.754 118.0 67.6 -68.9 -20.7 -7.5 -11.0 0.1 53 53 A S T 3 S+ 0 0 105 -23,-0.1 2,-0.8 1,-0.1 -22,-0.0 0.633 83.6 87.0 -72.1 -12.1 -9.3 -13.8 2.0 54 54 A S < + 0 0 37 -3,-2.0 -4,-0.1 1,-0.1 -1,-0.1 -0.805 42.4 163.0 -92.0 112.5 -7.2 -12.8 5.1 55 55 A T S S+ 0 0 51 -2,-0.8 -33,-2.3 -31,-0.0 2,-0.3 0.197 70.3 44.5-110.0 12.3 -9.1 -10.1 7.0 56 56 A S E +B 21 0A 54 -35,-0.2 2,-0.3 2,-0.0 -35,-0.2 -0.970 63.8 179.9-141.7 158.3 -7.0 -10.8 10.1 57 57 A V E -B 20 0A 24 -37,-2.1 -37,-2.6 -2,-0.3 2,-0.5 -0.977 21.1-136.6-153.9 148.4 -3.2 -11.4 10.6 58 58 A T E -B 19 0A 69 -2,-0.3 2,-0.5 -39,-0.2 -39,-0.2 -0.942 15.9-154.6-109.4 128.0 -1.0 -12.1 13.6 59 59 A I E -B 18 0A 3 -41,-2.9 -41,-2.0 -2,-0.5 2,-0.2 -0.879 18.8-176.3-102.8 126.4 2.2 -10.3 13.8 60 60 A T + 0 0 93 -2,-0.5 -43,-0.2 -43,-0.2 -41,-0.0 -0.626 50.6 51.9-119.6 175.4 5.0 -12.0 15.9 61 61 A G S S+ 0 0 65 -45,-0.3 -44,-0.2 -2,-0.2 -1,-0.1 0.714 73.4 157.8 70.3 24.3 8.5 -11.3 17.0 62 62 A L - 0 0 7 -46,-2.6 -1,-0.2 -3,-0.2 -45,-0.0 -0.348 47.3-103.8 -84.4 157.8 7.6 -7.9 18.5 63 63 A T > - 0 0 75 -2,-0.1 3,-0.8 1,-0.1 27,-0.3 -0.665 42.0-115.5 -75.8 130.7 9.4 -6.0 21.2 64 64 A P T 3 S+ 0 0 37 0, 0.0 28,-0.2 0, 0.0 27,-0.1 -0.316 86.7 13.9 -65.9 145.0 7.8 -6.1 24.6 65 65 A G T 3 S+ 0 0 7 26,-1.5 2,-0.3 1,-0.2 27,-0.1 0.619 96.4 110.8 78.5 17.8 6.3 -3.0 26.2 66 66 A V < - 0 0 28 -3,-0.8 24,-2.2 25,-0.2 2,-0.5 -0.903 69.3-106.8-129.2 153.7 6.2 -0.6 23.3 67 67 A E E - E 0 89B 82 -2,-0.3 -28,-2.6 22,-0.3 -27,-0.5 -0.647 34.7-163.1 -77.6 125.1 3.6 1.1 21.2 68 68 A Y E -CE 38 88B 11 20,-2.9 20,-2.1 -2,-0.5 2,-0.5 -0.834 11.8-142.9-104.0 145.6 3.4 -0.3 17.6 69 69 A V E -CE 37 87B 31 -32,-3.0 -32,-1.5 -2,-0.4 2,-0.5 -0.943 16.8-163.6-107.1 125.3 1.7 1.4 14.7 70 70 A V E -CE 36 86B 2 16,-2.9 16,-2.3 -2,-0.5 2,-0.4 -0.946 4.8-171.3-113.2 127.8 -0.1 -1.0 12.4 71 71 A S E -CE 35 85B 14 -36,-2.3 -36,-2.6 -2,-0.5 2,-0.5 -0.987 4.5-163.0-125.3 127.0 -1.1 0.1 8.9 72 72 A V E -CE 34 84B 0 12,-2.6 12,-2.7 -2,-0.4 2,-0.4 -0.950 6.6-170.9-116.8 121.7 -3.3 -2.0 6.6 73 73 A Y E -C 33 0B 45 -40,-3.2 -40,-2.4 -2,-0.5 2,-0.3 -0.929 17.4-136.3-110.7 129.5 -3.4 -1.3 2.9 74 74 A A E -C 32 0B 0 -2,-0.4 7,-2.3 8,-0.4 2,-0.4 -0.637 22.9-152.6 -77.8 147.8 -5.9 -2.9 0.5 75 75 A L E +CF 31 80B 28 -44,-2.5 -45,-2.8 -2,-0.3 -44,-1.0 -0.920 21.4 179.7-122.3 145.7 -4.3 -4.0 -2.8 76 76 A K E > S- F 0 79B 66 3,-2.3 3,-1.6 -2,-0.4 2,-0.2 -0.832 72.0 -57.8-144.5 100.6 -5.9 -4.4 -6.3 77 77 A D T 3 S- 0 0 109 -2,-0.3 -1,-0.1 1,-0.3 -47,-0.1 -0.471 122.2 -16.8 54.2-127.6 -3.2 -5.5 -8.6 78 78 A N T 3 S+ 0 0 169 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.3 -0.083 121.1 98.6 -94.8 27.9 -0.4 -2.9 -8.5 79 79 A Q E < -F 76 0B 68 -3,-1.6 -3,-2.3 -78,-0.0 2,-0.3 -0.907 54.1-166.7-105.3 150.9 -2.8 -0.4 -6.9 80 80 A E E -F 75 0B 88 -2,-0.3 -78,-0.3 -5,-0.2 -5,-0.2 -0.989 13.3-133.3-133.7 145.0 -2.9 0.4 -3.1 81 81 A S - 0 0 6 -7,-2.3 -78,-0.2 -2,-0.3 3,-0.1 -0.367 40.4 -87.9 -76.0 166.4 -5.4 2.2 -0.8 82 82 A P - 0 0 84 0, 0.0 -8,-0.4 0, 0.0 2,-0.2 -0.384 64.6 -93.9 -60.5 157.1 -4.5 4.7 1.8 83 83 A P - 0 0 50 0, 0.0 2,-0.5 0, 0.0 -10,-0.2 -0.502 16.5-131.7 -82.7 151.4 -3.9 2.8 5.0 84 84 A L E -E 72 0B 27 -12,-2.7 -12,-2.6 -2,-0.2 2,-0.4 -0.875 38.6-161.5 -85.1 124.3 -6.1 1.9 7.9 85 85 A V E +E 71 0B 79 -2,-0.5 2,-0.3 -14,-0.2 -14,-0.2 -0.956 21.8 153.9-122.5 132.8 -4.0 2.9 10.9 86 86 A G E -E 70 0B 19 -16,-2.3 -16,-2.9 -2,-0.4 2,-0.3 -0.927 27.0-132.5-144.9 168.8 -4.2 1.9 14.6 87 87 A T E +E 69 0B 78 -2,-0.3 2,-0.3 -18,-0.2 -18,-0.2 -0.901 18.7 174.7-124.5 156.0 -1.9 1.5 17.5 88 88 A Q E -E 68 0B 56 -20,-2.1 -20,-2.9 -2,-0.3 2,-0.4 -0.917 22.9-138.6-160.1 131.2 -1.2 -1.1 20.2 89 89 A T E -E 67 0B 65 -2,-0.3 -22,-0.3 -22,-0.3 2,-0.1 -0.764 27.1-129.3 -89.5 131.7 1.3 -1.5 23.0 90 90 A T - 0 0 4 -24,-2.2 3,-0.3 -2,-0.4 -75,-0.2 -0.379 30.9 -97.9 -71.9 159.4 2.7 -5.0 23.5 91 91 A G S S+ 0 0 25 -77,-2.1 -26,-1.5 -74,-0.2 -25,-0.2 -0.164 90.6 51.4 -67.2 167.0 2.7 -6.6 26.9 92 92 A G > + 0 0 13 -28,-0.2 3,-1.8 -27,-0.1 -1,-0.2 0.615 49.2 147.8 90.0 14.3 5.5 -6.8 29.4 93 93 A H T 3 S+ 0 0 133 -3,-0.3 -2,-0.1 1,-0.3 -3,-0.0 0.864 83.8 33.4 -49.2 -44.5 6.7 -3.2 29.8 94 94 A H T 3 S+ 0 0 169 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.284 105.9 89.8-100.2 13.5 7.7 -3.7 33.5 95 95 A H S < S- 0 0 130 -3,-1.8 2,-0.1 1,-0.0 0, 0.0 -0.781 73.9-117.7-110.4 151.9 8.7 -7.4 33.2 96 96 A H - 0 0 152 -2,-0.3 2,-0.4 2,-0.0 -2,-0.1 -0.393 22.0-148.8 -75.0 161.2 12.1 -9.1 32.4 97 97 A H 0 0 72 -2,-0.1 -1,-0.0 -33,-0.0 -5,-0.0 -0.933 360.0 360.0-136.4 115.9 12.5 -11.2 29.4 98 98 A H 0 0 237 -2,-0.4 -1,-0.0 0, 0.0 -2,-0.0 0.803 360.0 360.0 57.9 360.0 14.9 -14.1 29.4