==== 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 CHEMOATTRACTANT 22-NOV-96 1DOL . COMPND 2 MOLECULE: MONOCYTE CHEMOATTRACTANT PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.LUBKOWSKI,G.BUJACZ,L.BOQUE,A.WLODAWER . 71 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5592.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 37 52.1 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 . 13 18.3 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 . 1 1.4 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-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 . 5 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 1 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 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 A M 0 0 232 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -88.9 47.6 21.8 16.2 2 1 A Q - 0 0 99 1,-0.1 4,-0.0 2,-0.0 0, 0.0 0.011 360.0-125.4 -61.4 164.8 47.5 24.3 19.2 3 2 A P S S- 0 0 129 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.844 82.8 -41.5 -77.4 -80.0 49.9 23.9 22.0 4 3 A D S > S+ 0 0 98 1,-0.1 3,-1.3 -3,-0.0 4,-0.2 -0.454 72.7 156.7-147.7 67.0 47.4 23.7 24.8 5 4 A A G > + 0 0 43 1,-0.3 3,-1.9 2,-0.2 -1,-0.1 0.574 55.8 95.0 -66.0 -9.6 44.8 26.3 24.1 6 5 A I G 3 S+ 0 0 126 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.826 89.0 42.8 -56.7 -27.8 42.4 24.2 26.3 7 6 A N G < S+ 0 0 138 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.2 0.484 92.5 107.1 -93.5 -6.3 43.4 26.4 29.3 8 7 A A S < S- 0 0 48 -3,-1.9 -3,-0.0 -4,-0.2 0, 0.0 -0.501 81.4-105.3 -71.5 142.8 43.1 29.6 27.2 9 8 A P - 0 0 126 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.342 31.1-138.8 -65.6 154.5 40.1 31.8 28.0 10 9 A V - 0 0 75 -3,-0.1 2,-0.4 26,-0.0 0, 0.0 -0.984 12.1-158.9-121.1 125.2 37.3 31.6 25.4 11 10 A T + 0 0 69 -2,-0.5 2,-0.3 26,-0.0 23,-0.2 -0.903 16.1 174.9-108.5 125.9 35.5 34.8 24.4 12 11 A a - 0 0 31 -2,-0.4 2,-0.4 24,-0.1 28,-0.1 -0.889 25.7-128.6-129.4 158.1 32.0 34.7 22.8 13 12 A b + 0 0 0 26,-0.5 26,-0.4 -2,-0.3 3,-0.1 -0.912 17.1 179.8-109.3 134.4 29.2 37.1 21.6 14 13 A Y S S+ 0 0 166 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.631 71.2 8.7-106.7 -13.7 25.6 36.6 22.7 15 14 A N S S- 0 0 129 39,-0.0 2,-0.3 0, 0.0 -1,-0.3 -0.934 73.5-124.5-156.6 163.3 23.9 39.5 21.0 16 15 A F - 0 0 45 -2,-0.3 38,-0.2 -3,-0.1 2,-0.1 -0.830 25.1-105.0-118.5 158.6 25.0 42.1 18.4 17 16 A T - 0 0 34 36,-2.7 38,-0.3 -2,-0.3 -1,-0.0 -0.366 19.5-155.9 -73.6 159.9 25.0 45.9 18.4 18 17 A N + 0 0 142 -2,-0.1 2,-0.5 2,-0.1 -1,-0.1 0.391 69.3 79.9-117.2 -5.0 22.3 47.5 16.2 19 18 A R S S- 0 0 186 0, 0.0 -2,-0.1 0, 0.0 2,-0.1 -0.922 79.4-125.2-111.7 128.5 24.0 50.8 15.6 20 19 A K - 0 0 145 -2,-0.5 2,-0.4 1,-0.1 -2,-0.1 -0.379 26.3-132.8 -64.8 153.5 26.7 51.2 12.9 21 20 A I - 0 0 23 -2,-0.1 2,-0.1 1,-0.0 5,-0.1 -0.893 16.7-109.5-116.7 141.5 30.1 52.5 14.1 22 21 A S >> - 0 0 43 -2,-0.4 3,-1.6 1,-0.1 4,-0.7 -0.356 17.7-134.3 -63.6 139.8 32.2 55.2 12.5 23 22 A V G >4 S+ 0 0 57 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.879 106.0 66.6 -63.5 -30.5 35.4 54.0 10.8 24 23 A Q G 34 S+ 0 0 142 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.636 105.3 42.8 -63.7 -15.8 37.1 57.0 12.6 25 24 A R G <4 S+ 0 0 132 -3,-1.6 22,-2.9 21,-0.0 2,-0.3 0.553 89.4 96.9-109.0 -9.0 36.4 55.3 16.0 26 25 A L E << +A 46 0A 9 -3,-0.9 20,-0.2 -4,-0.7 3,-0.1 -0.648 39.7 174.4 -83.9 131.6 37.3 51.7 15.3 27 26 A A E - 0 0 59 18,-2.9 2,-0.3 1,-0.4 19,-0.2 0.733 60.9 -25.1-105.1 -31.8 40.8 50.7 16.4 28 27 A S E -A 45 0A 49 17,-1.7 17,-2.1 2,-0.0 -1,-0.4 -0.937 51.5-150.5-164.7-177.7 40.7 47.0 15.7 29 28 A Y E -A 44 0A 67 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.954 1.4-163.4-159.0 168.6 38.7 43.8 15.3 30 29 A R E -A 43 0A 95 13,-0.9 13,-2.2 -2,-0.3 2,-0.3 -0.945 24.5-119.9-160.2 140.2 38.9 40.0 15.8 31 30 A R E -A 42 0A 156 -2,-0.3 2,-0.6 11,-0.2 11,-0.2 -0.696 19.6-144.9 -87.0 135.7 36.7 37.2 14.4 32 31 A I E +A 41 0A 10 9,-3.0 9,-1.4 -2,-0.3 -20,-0.1 -0.930 39.7 142.5-102.8 116.9 34.9 34.9 17.0 33 32 A T + 0 0 94 -2,-0.6 -1,-0.1 7,-0.2 4,-0.1 0.569 14.0 135.0-130.3 -17.2 34.7 31.3 15.8 34 33 A S > - 0 0 42 -23,-0.2 3,-2.9 1,-0.2 5,-0.1 -0.066 57.5-132.8 -41.2 126.3 35.2 28.9 18.8 35 34 A S T 3 S+ 0 0 116 1,-0.3 -1,-0.2 3,-0.0 5,-0.0 0.459 103.5 76.6 -61.6 -4.4 32.6 26.2 18.5 36 35 A K T 3 S+ 0 0 147 -25,-0.1 -1,-0.3 3,-0.0 -2,-0.1 0.560 82.3 85.6 -83.3 -6.5 32.0 26.9 22.1 37 36 A a S < S- 0 0 13 -3,-2.9 3,-0.1 -4,-0.1 -23,-0.1 -0.665 86.2-125.3 -96.7 147.8 30.2 30.1 21.1 38 37 A P S S- 0 0 75 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.891 89.0 -19.2 -56.2 -34.1 26.5 30.2 20.2 39 38 A K S S- 0 0 82 -26,-0.4 -26,-0.5 -5,-0.1 -5,-0.1 -0.986 79.0 -71.9-166.0 168.5 27.6 31.8 16.8 40 39 A E + 0 0 126 -2,-0.3 2,-0.3 -3,-0.1 -7,-0.2 -0.246 54.3 161.3 -63.9 153.4 30.2 33.6 14.7 41 40 A A E -A 32 0A 2 -9,-1.4 -9,-3.0 14,-0.1 2,-0.4 -0.964 35.7-125.2-164.7 173.2 30.9 37.2 15.5 42 41 A V E -AB 31 54A 4 12,-1.5 12,-2.9 -2,-0.3 2,-0.6 -0.961 17.5-151.4-130.9 138.3 33.2 40.1 15.2 43 42 A I E -AB 30 53A 8 -13,-2.2 -13,-0.9 -2,-0.4 2,-0.5 -0.988 10.4-159.1-114.0 115.6 34.4 42.1 18.2 44 43 A F E -AB 29 52A 1 8,-2.8 8,-3.0 -2,-0.6 2,-0.6 -0.850 4.8-151.6 -94.4 128.7 35.3 45.7 17.4 45 44 A K E -AB 28 51A 90 -17,-2.1 -18,-2.9 -2,-0.5 -17,-1.7 -0.934 21.1-143.6 -98.9 125.3 37.6 47.4 19.8 46 45 A T E > -A 26 0A 21 4,-3.1 3,-2.2 -2,-0.6 -20,-0.2 -0.452 22.1-109.1 -89.2 162.8 36.9 51.1 19.8 47 46 A I T 3 S+ 0 0 103 -22,-2.9 -21,-0.1 1,-0.3 -1,-0.1 0.750 122.9 53.4 -57.9 -29.5 39.1 54.2 20.1 48 47 A V T 3 S- 0 0 121 -23,-0.3 -1,-0.3 2,-0.1 -22,-0.1 0.212 125.5-107.5 -93.5 17.5 37.8 54.7 23.6 49 48 A A S < S+ 0 0 70 -3,-2.2 2,-0.4 1,-0.2 -2,-0.2 0.909 71.7 141.1 57.2 52.1 38.7 51.1 24.4 50 49 A K - 0 0 137 -4,-0.1 -4,-3.1 2,-0.0 2,-0.5 -0.925 44.4-137.4-117.6 142.4 35.2 49.6 24.4 51 50 A E E -B 45 0A 111 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.907 22.1-171.9-106.4 126.5 34.6 46.2 22.9 52 51 A I E -B 44 0A 34 -8,-3.0 -8,-2.8 -2,-0.5 2,-0.5 -0.919 19.8-132.4-123.0 140.7 31.5 45.7 20.9 53 52 A b E -B 43 0A 35 -2,-0.4 -36,-2.7 -10,-0.2 2,-0.3 -0.776 31.0-177.8 -88.8 124.8 29.8 42.5 19.3 54 53 A A E -B 42 0A 0 -12,-2.9 -12,-1.5 -2,-0.5 -36,-0.1 -0.918 31.3-104.0-130.1 150.7 28.8 42.8 15.7 55 54 A D > - 0 0 43 -2,-0.3 3,-1.9 -38,-0.3 6,-0.2 -0.503 18.0-149.4 -69.1 117.6 27.1 40.7 13.1 56 55 A P T 3 S+ 0 0 36 0, 0.0 6,-0.2 0, 0.0 -1,-0.2 0.897 95.5 62.2 -53.7 -35.8 29.5 39.2 10.6 57 56 A K T 3 S+ 0 0 176 4,-0.1 2,-0.3 5,-0.0 -2,-0.0 0.568 80.9 97.9 -65.6 -15.3 26.6 39.3 8.0 58 57 A Q <> - 0 0 69 -3,-1.9 4,-2.4 1,-0.1 5,-0.2 -0.601 68.5-139.4 -84.4 137.3 26.1 43.1 8.0 59 58 A K H > S+ 0 0 150 -2,-0.3 4,-3.4 2,-0.2 5,-0.3 0.901 103.5 55.2 -58.3 -44.9 27.7 45.3 5.3 60 59 A W H > S+ 0 0 30 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.932 110.1 49.8 -55.2 -40.5 28.7 48.1 7.6 61 60 A V H > S+ 0 0 1 1,-0.2 4,-1.1 2,-0.2 3,-0.4 0.947 112.9 44.1 -61.4 -53.1 30.5 45.4 9.6 62 61 A Q H X S+ 0 0 99 -4,-2.4 4,-2.0 1,-0.3 3,-0.4 0.863 112.2 52.3 -61.7 -41.1 32.3 43.9 6.5 63 62 A D H X S+ 0 0 56 -4,-3.4 4,-2.1 1,-0.2 -1,-0.3 0.792 104.0 58.6 -66.0 -27.7 33.2 47.4 5.2 64 63 A S H X S+ 0 0 3 -4,-1.5 4,-1.7 -3,-0.4 -1,-0.2 0.802 104.0 51.4 -71.7 -27.0 34.7 48.2 8.6 65 64 A M H X S+ 0 0 7 -4,-1.1 4,-3.0 -3,-0.4 6,-0.3 0.957 106.6 54.0 -68.8 -53.3 37.0 45.2 8.1 66 65 A D H <>S+ 0 0 72 -4,-2.0 5,-2.2 1,-0.2 -2,-0.2 0.908 109.8 46.7 -46.9 -49.8 38.0 46.5 4.7 67 66 A H H ><5S+ 0 0 79 -4,-2.1 3,-1.2 1,-0.2 -1,-0.2 0.883 113.4 47.6 -64.8 -38.2 39.0 49.9 6.2 68 67 A L H 3<5S+ 0 0 26 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.871 104.6 59.4 -70.4 -34.3 40.9 48.3 9.1 69 68 A D T 3<5S- 0 0 88 -4,-3.0 -1,-0.3 -5,-0.1 -2,-0.2 0.389 125.3-109.0 -72.0 6.1 42.7 46.0 6.7 70 69 A K T < 5 0 0 170 -3,-1.2 -3,-0.2 1,-0.2 -2,-0.1 0.409 360.0 360.0 76.9 5.7 43.8 49.3 5.1 71 70 A Q < 0 0 152 -5,-2.2 -1,-0.2 -6,-0.3 -4,-0.1 0.474 360.0 360.0 42.4 360.0 41.6 48.7 2.1