==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION/IMMUNE SYSTEM 10-JUL-13 4LMQ . COMPND 2 MOLECULE: STROMAL CELL-DERIVED FACTOR 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.ZHONG,J.WANG,B.LI,H.XIANG,M.ULTSCH,M.COONS,T WONG,N.Y.CHIA . 956 10 10 9 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42933.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 619 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 351 36.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 0.9 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 . 1 0.1 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 . 113 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 0.9 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 4 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 RESIDUES PER ALPHA HELIX . 1 2 1 1 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 PARALLEL BRIDGES PER LADDER . 7 14 11 8 9 14 2 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 7 4 1 3 0 1 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 11 D a 0 0 54 0, 0.0 2,-0.2 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0-106.7 28.1 -13.2 68.1 2 12 D R - 0 0 88 1,-0.3 2,-0.2 0, 0.0 0, 0.0 -0.579 360.0 -22.6-167.9-119.9 24.8 -14.7 69.0 3 13 D F - 0 0 75 -2,-0.2 2,-0.5 37,-0.0 -1,-0.3 -0.433 69.1-103.2 -98.1-178.4 22.3 -16.7 66.9 4 14 D F - 0 0 86 -2,-0.2 2,-0.2 -3,-0.1 35,-0.2 -0.944 21.6-127.3-117.1 124.1 22.1 -16.5 63.1 5 15 D E - 0 0 78 33,-2.3 35,-0.4 -2,-0.5 3,-0.4 -0.481 35.9-132.3 -61.7 129.9 19.4 -14.5 61.2 6 16 D S + 0 0 69 1,-0.2 -1,-0.1 -2,-0.2 33,-0.0 -0.658 68.4 5.2 -95.8 144.7 17.9 -17.0 58.7 7 17 D H S S+ 0 0 66 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.874 70.8 168.8 57.5 49.8 17.2 -16.5 55.0 8 18 D V - 0 0 7 -3,-0.4 -1,-0.2 775,-0.0 410,-0.2 -0.830 34.7-123.1 -91.9 121.9 18.7 -13.1 54.4 9 19 D A > - 0 0 0 409,-2.8 3,-0.7 -2,-0.6 834,-0.1 -0.280 9.3-132.1 -61.7 146.8 19.0 -12.2 50.7 10 20 D R G > S+ 0 0 49 833,-0.3 3,-1.8 1,-0.2 834,-0.2 0.869 106.1 59.6 -68.3 -37.2 22.5 -11.4 49.4 11 21 D A G 3 S+ 0 0 7 832,-1.6 -1,-0.2 1,-0.3 833,-0.1 0.627 98.2 61.2 -68.0 -12.9 21.2 -8.3 47.5 12 22 D N G < S+ 0 0 3 -3,-0.7 19,-2.1 406,-0.2 2,-0.7 0.374 84.6 94.8 -92.6 3.3 20.0 -6.9 50.9 13 23 D V E < -A 30 0A 9 -3,-1.8 17,-0.2 17,-0.2 3,-0.1 -0.858 47.9-177.5-104.1 113.8 23.6 -6.9 52.3 14 24 D K E - 0 0 107 15,-3.4 2,-0.3 -2,-0.7 265,-0.2 0.970 69.5 -28.4 -70.4 -56.1 25.5 -3.6 52.0 15 25 D H E -A 29 0A 21 14,-0.6 14,-2.6 263,-0.1 2,-0.3 -0.969 61.4-111.4-153.8 166.5 28.7 -4.9 53.5 16 26 D L E -AB 28 277A 0 261,-2.0 261,-4.4 -2,-0.3 2,-0.4 -0.784 21.2-159.4-103.5 150.2 30.0 -7.5 56.0 17 27 D K E -AB 27 276A 26 10,-2.9 10,-2.6 -2,-0.3 2,-0.7 -0.957 1.9-159.8-133.5 113.6 31.6 -6.8 59.3 18 28 D I E -AB 26 275A 6 257,-2.3 257,-3.0 -2,-0.4 8,-0.2 -0.834 16.9-146.8 -94.2 117.5 33.8 -9.3 61.1 19 29 D L E - B 0 274A 39 6,-2.1 2,-1.0 -2,-0.7 6,-0.4 -0.467 20.4-111.1 -81.7 154.4 34.1 -8.6 64.8 20 30 D N - 0 0 28 253,-1.7 -1,-0.1 1,-0.1 -2,-0.0 -0.787 67.0 -72.6 -87.5 103.9 37.2 -9.2 66.9 21 31 D T 0 0 106 -2,-1.0 -1,-0.1 1,-0.1 253,-0.0 0.537 360.0 360.0 -0.3 85.9 36.2 -12.1 69.2 22 32 D P 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.861 360.0 360.0-100.5 360.0 33.8 -10.5 71.7 23 ! 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 24 36 D L 0 0 39 0, 0.0 2,-0.6 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 130.2 33.8 -16.5 63.2 25 37 D Q + 0 0 42 -6,-0.4 -6,-2.1 289,-0.2 2,-0.5 -0.879 360.0 175.8-116.2 97.0 31.8 -13.5 64.1 26 38 D I E -A 18 0A 1 -2,-0.6 13,-2.1 13,-0.5 2,-0.4 -0.890 9.1-174.9-109.1 129.0 30.1 -12.1 61.0 27 39 D V E -AC 17 38A 10 -10,-2.6 -10,-2.9 -2,-0.5 2,-0.5 -0.978 11.1-151.4-122.5 130.7 27.7 -9.2 61.0 28 40 D A E -AC 16 37A 0 9,-3.9 9,-2.9 -2,-0.4 2,-0.6 -0.869 8.8-140.7-105.5 132.1 25.8 -8.0 57.9 29 41 D R E -AC 15 36A 56 -14,-2.6 -15,-3.4 -2,-0.5 -14,-0.6 -0.812 24.4-141.5 -88.1 121.7 24.7 -4.4 57.3 30 42 D L E > -A 13 0A 0 5,-2.4 4,-0.8 -2,-0.6 -17,-0.2 -0.620 8.1-153.2 -92.1 143.8 21.3 -4.5 55.6 31 43 D K T 4 S+ 0 0 32 -19,-2.1 338,-0.4 -2,-0.3 337,-0.4 0.825 87.4 52.1 -86.1 -33.3 20.3 -2.0 52.9 32 44 D N T 4 S+ 0 0 1 -20,-0.3 316,-0.4 1,-0.2 336,-0.4 0.832 131.1 11.3 -77.9 -31.2 16.5 -1.8 53.3 33 45 D N T 4 S- 0 0 31 314,-0.1 -2,-0.2 2,-0.1 -1,-0.2 0.376 92.2-126.9-127.0 0.0 16.4 -1.1 57.0 34 46 D N < + 0 0 68 -4,-0.8 -3,-0.1 1,-0.2 2,-0.1 0.678 58.2 145.2 62.8 21.6 20.0 -0.3 57.9 35 47 D R - 0 0 137 -6,-0.0 -5,-2.4 1,-0.0 2,-0.6 -0.358 52.2-121.0 -81.1 165.9 20.1 -2.8 60.7 36 48 D Q E -C 29 0A 90 -7,-0.2 2,-0.4 -2,-0.1 -7,-0.2 -0.961 35.1-174.5-108.0 118.9 23.1 -4.9 61.8 37 49 D V E -C 28 0A 10 -9,-2.9 -9,-3.9 -2,-0.6 2,-0.5 -0.892 28.0-118.7-117.5 139.7 22.3 -8.6 61.5 38 50 D a E -C 27 0A 32 -2,-0.4 -33,-2.3 -11,-0.3 2,-0.3 -0.674 35.0-153.1 -75.0 121.7 24.4 -11.6 62.6 39 51 D I - 0 0 2 -13,-2.1 -13,-0.5 -2,-0.5 -33,-0.1 -0.667 20.2-107.2 -97.8 150.5 25.0 -13.8 59.5 40 52 D D > - 0 0 26 -35,-0.4 3,-1.3 -2,-0.3 6,-0.2 -0.681 24.4-152.2 -77.1 120.3 25.7 -17.5 59.3 41 53 D P T 3 S+ 0 0 23 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.811 89.4 57.7 -64.2 -33.6 29.4 -18.1 58.6 42 54 D K T 3 S+ 0 0 150 4,-0.1 2,-0.1 5,-0.0 -2,-0.0 0.372 75.7 119.4 -87.2 6.4 29.0 -21.4 56.8 43 55 D L <> - 0 0 69 -3,-1.3 4,-1.5 1,-0.1 3,-0.5 -0.445 69.8-127.0 -65.6 145.7 26.6 -20.1 54.2 44 56 D K H > S+ 0 0 176 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.871 104.8 52.8 -66.5 -39.2 28.0 -20.6 50.7 45 57 D W H > S+ 0 0 26 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.706 106.0 54.5 -75.9 -19.0 27.6 -17.0 49.5 46 58 D I H > S+ 0 0 0 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.892 105.9 51.7 -75.3 -42.4 29.5 -15.7 52.5 47 59 D Q H X S+ 0 0 93 -4,-1.5 4,-0.6 1,-0.2 -2,-0.2 0.811 112.9 46.0 -63.1 -30.5 32.5 -17.9 51.8 48 60 D E H X S+ 0 0 98 -4,-1.3 4,-1.3 2,-0.2 -1,-0.2 0.779 109.6 54.5 -83.0 -28.4 32.5 -16.6 48.2 49 61 D Y H X S+ 0 0 6 -4,-1.1 4,-1.2 1,-0.2 -2,-0.2 0.897 106.6 50.8 -68.6 -43.1 32.1 -13.0 49.4 50 62 D L H X S+ 0 0 12 -4,-2.3 4,-1.6 1,-0.2 6,-0.2 0.750 106.5 56.3 -68.2 -25.6 35.2 -13.2 51.7 51 63 D E H <>S+ 0 0 48 -4,-0.6 5,-1.6 2,-0.2 -1,-0.2 0.876 103.0 53.1 -73.0 -39.2 37.2 -14.7 48.8 52 64 D K H ><5S+ 0 0 122 -4,-1.3 3,-0.7 4,-0.2 -2,-0.2 0.832 111.0 48.2 -64.2 -32.1 36.5 -11.7 46.5 53 65 D A H 3<5S+ 0 0 3 -4,-1.2 233,-0.5 1,-0.2 234,-0.2 0.869 107.9 52.3 -77.2 -38.3 37.7 -9.4 49.3 54 66 D L T 3<5S- 0 0 20 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.125 115.5-115.4 -84.6 20.9 40.9 -11.3 50.0 55 67 D N T < 5 0 0 111 -3,-0.7 -3,-0.2 1,-0.1 -4,-0.1 0.512 360.0 360.0 59.3 8.3 41.7 -11.1 46.3 56 68 D K < 0 0 152 -5,-1.6 -4,-0.2 -6,-0.2 -1,-0.1 0.914 360.0 360.0 -93.6 360.0 41.4 -14.9 46.0 57 !* 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 58 1 E E 0 0 191 0, 0.0 2,-0.5 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 137.5 53.4 19.3 77.3 59 2 E V - 0 0 22 24,-0.1 2,-0.4 22,-0.0 24,-0.2 -0.816 360.0-179.3 -98.3 129.9 51.7 16.1 78.4 60 3 E Q E -G 82 0B 98 22,-2.7 22,-1.7 -2,-0.5 2,-0.4 -0.994 11.0-176.3-134.3 132.5 51.0 15.6 82.1 61 4 E L E -G 81 0B 11 -2,-0.4 2,-0.5 106,-0.4 108,-0.4 -0.993 5.5-175.0-128.3 125.1 49.5 12.7 84.0 62 5 E V E -G 80 0B 80 18,-2.1 18,-1.8 -2,-0.4 2,-0.1 -0.920 8.0-158.0-128.1 108.0 48.9 12.9 87.8 63 6 E E E +G 79 0B 10 -2,-0.5 2,-0.3 16,-0.2 16,-0.2 -0.356 16.9 171.1 -78.0 161.8 47.6 9.9 89.8 64 7 E S E +G 78 0B 72 14,-1.0 14,-2.5 1,-0.1 107,-0.1 -0.974 40.2 62.2-166.2 153.9 45.8 10.2 93.2 65 8 E G + 0 0 38 -2,-0.3 2,-0.3 1,-0.3 11,-0.1 0.750 59.4 147.8 97.5 29.1 43.9 8.3 95.8 66 9 E G + 0 0 37 -3,-0.1 -1,-0.3 9,-0.1 2,-0.2 -0.691 16.5 102.3 -95.1 150.2 46.4 5.7 96.9 67 10 E G - 0 0 30 -2,-0.3 107,-3.3 105,-0.2 2,-0.4 -0.830 66.8 -36.7 179.5-139.9 46.6 4.2 100.4 68 11 E L E -k 174 0C 59 -2,-0.2 2,-0.4 105,-0.2 107,-0.2 -0.970 45.2-179.7-122.5 132.5 45.6 1.1 102.5 69 12 E V E -k 175 0C 19 105,-2.5 107,-0.6 -2,-0.4 3,-0.1 -0.994 27.0-122.3-132.6 134.0 42.5 -1.0 102.1 70 13 E Q > - 0 0 144 -2,-0.4 3,-2.6 105,-0.2 72,-0.2 -0.451 52.0 -80.9 -67.3 144.5 41.3 -4.1 104.0 71 14 E P T 3 S+ 0 0 66 0, 0.0 72,-0.2 0, 0.0 -1,-0.1 -0.220 121.0 21.4 -50.3 128.2 40.7 -7.3 101.8 72 15 E G T 3 S+ 0 0 48 70,-1.9 69,-0.7 1,-0.3 71,-0.1 0.091 102.3 116.8 96.0 -20.5 37.3 -7.1 100.1 73 16 E G < - 0 0 24 -3,-2.6 69,-1.5 68,-0.2 -1,-0.3 -0.033 62.0-113.7 -71.9 179.5 37.3 -3.3 100.5 74 17 E S + 0 0 66 66,-0.1 2,-0.3 67,-0.1 66,-0.2 -0.864 25.9 179.5-121.8 153.2 37.2 -0.7 97.7 75 18 E L E - H 0 139B 19 64,-2.0 64,-2.5 -2,-0.3 2,-0.5 -0.975 10.7-157.1-150.6 136.9 39.6 1.9 96.4 76 19 E R E - H 0 138B 124 -2,-0.3 2,-0.2 62,-0.2 62,-0.2 -0.961 7.8-157.6-122.6 121.7 39.3 4.4 93.5 77 20 E L E - H 0 137B 0 60,-1.7 60,-1.7 -2,-0.5 2,-0.4 -0.639 5.9-149.3 -95.0 152.0 42.2 6.0 91.8 78 21 E S E -GH 64 136B 32 -14,-2.5 -14,-1.0 -2,-0.2 2,-0.5 -0.977 7.4-167.7-124.6 133.5 42.1 9.2 89.8 79 22 E b E -GH 63 135B 0 56,-2.8 56,-2.2 -2,-0.4 2,-0.3 -0.815 8.4-161.8-124.5 92.3 44.3 10.1 86.8 80 23 E A E -GH 62 134B 43 -18,-1.8 -18,-2.1 -2,-0.5 2,-0.3 -0.570 12.4-156.3 -74.8 127.4 44.1 13.8 85.8 81 24 E A E +G 61 0B 13 52,-2.3 2,-0.3 -2,-0.3 -20,-0.2 -0.800 13.3 179.6-109.8 149.5 45.3 14.4 82.2 82 25 E S E +G 60 0B 57 -22,-1.7 -22,-2.7 -2,-0.3 3,-0.1 -0.991 56.3 32.7-151.0 135.6 46.7 17.6 80.6 83 26 E G S S+ 0 0 55 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.1 0.451 106.8 55.7 101.7 2.8 48.1 18.6 77.3 84 27 E F S S- 0 0 25 -24,-0.1 2,-0.4 5,-0.0 -1,-0.2 -0.982 88.0 -92.7-158.6 159.8 45.9 16.4 75.1 85 28 E S >> - 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