==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 04-JAN-10 3L95 . COMPND 2 MOLECULE: ANTI-NRR1 FAB FRAGMENT LIGHT CHAIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.G.HYMOWITZ,G.P.DE LEON . 1308 8 26 25 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55420.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 874 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 395 30.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 152 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 139 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 2.1 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 5 0 8 0 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 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 . 12 10 11 10 12 14 3 0 2 2 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 10 0 4 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 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 D 0 0 163 0, 0.0 2,-0.3 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 89.0 -8.1 -16.1 23.3 2 2 A I - 0 0 4 93,-0.3 2,-0.5 91,-0.1 88,-0.1 -0.626 360.0-141.7 -75.2 132.9 -11.4 -17.9 23.6 3 3 A Q - 0 0 130 -2,-0.3 23,-1.4 94,-0.1 2,-0.6 -0.867 7.8-154.0-103.8 122.7 -12.3 -18.3 27.2 4 4 A M E -A 25 0A 9 -2,-0.5 2,-0.6 94,-0.5 96,-0.4 -0.888 9.2-167.2-101.6 117.5 -14.0 -21.6 28.3 5 5 A T E -A 24 0A 67 19,-2.5 19,-2.2 -2,-0.6 2,-0.2 -0.914 4.7-161.8-111.4 111.4 -16.1 -21.3 31.5 6 6 A Q E -A 23 0A 4 -2,-0.6 17,-0.2 17,-0.2 94,-0.1 -0.599 15.2-123.7 -88.4 151.3 -17.3 -24.5 33.1 7 7 A S E S+A 22 0A 52 15,-2.2 15,-2.8 -2,-0.2 2,-0.2 -0.979 79.8 25.6-151.1 140.6 -20.2 -24.8 35.6 8 8 A P - 0 0 55 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.683 66.8-151.1 -73.7 171.8 -20.5 -25.8 38.3 9 9 A S S S+ 0 0 87 1,-0.3 94,-1.7 -2,-0.2 2,-0.3 0.786 85.2 7.7 -72.9 -29.9 -17.0 -25.4 39.7 10 10 A S E S+d 103 0B 68 92,-0.2 2,-0.3 75,-0.0 -1,-0.3 -0.985 71.8 177.6-151.7 146.4 -17.7 -28.3 42.0 11 11 A L E -d 104 0B 28 92,-2.4 94,-3.1 -2,-0.3 2,-0.4 -0.979 18.4-141.5-150.1 161.6 -20.5 -30.8 42.4 12 12 A S E +d 105 0B 45 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.990 24.0 171.4-131.4 132.3 -21.5 -33.8 44.5 13 13 A A E -d 106 0B 7 92,-2.3 94,-2.7 -2,-0.4 2,-0.3 -0.969 28.3-120.8-141.8 152.8 -23.3 -36.8 43.2 14 14 A S > - 0 0 46 -2,-0.3 3,-2.1 92,-0.2 64,-0.3 -0.659 44.9 -90.6 -91.2 151.6 -24.3 -40.3 44.4 15 15 A V T 3 S+ 0 0 81 92,-0.3 64,-0.2 -2,-0.3 3,-0.1 -0.440 116.2 27.3 -61.9 127.0 -23.2 -43.5 42.6 16 16 A G T 3 S+ 0 0 40 62,-2.2 -1,-0.3 1,-0.4 63,-0.1 0.202 95.1 124.6 102.0 -12.4 -25.7 -44.4 39.9 17 17 A D < - 0 0 81 -3,-2.1 61,-2.4 60,-0.1 2,-0.6 -0.329 66.6-112.4 -77.5 161.4 -26.9 -40.8 39.4 18 18 A R - 0 0 174 59,-0.2 2,-0.3 -3,-0.1 58,-0.2 -0.865 37.9-168.6 -95.3 117.3 -27.1 -38.9 36.1 19 19 A V E - B 0 75A 10 56,-2.2 56,-2.1 -2,-0.6 2,-0.4 -0.838 7.5-168.3-110.9 144.3 -24.5 -36.0 36.2 20 20 A T E - B 0 74A 66 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.998 2.4-170.1-135.3 131.6 -24.2 -33.1 33.8 21 21 A I E - B 0 73A 1 52,-2.6 52,-2.7 -2,-0.4 2,-0.3 -0.971 13.1-148.6-119.7 136.7 -21.3 -30.5 33.5 22 22 A T E -AB 7 72A 34 -15,-2.8 -15,-2.2 -2,-0.4 2,-0.4 -0.759 12.2-173.8-108.2 149.3 -21.5 -27.4 31.3 23 23 A a E -AB 6 71A 0 48,-2.6 48,-2.9 -2,-0.3 2,-0.5 -0.984 8.0-162.9-136.9 128.4 -18.8 -25.6 29.4 24 24 A R E -AB 5 70A 129 -19,-2.2 -19,-2.5 -2,-0.4 2,-0.3 -0.963 10.7-143.1-116.3 125.6 -19.5 -22.3 27.6 25 25 A A E -A 4 0A 9 44,-2.0 -21,-0.2 -2,-0.5 4,-0.1 -0.655 17.6-131.4 -80.7 141.4 -17.2 -20.9 25.0 26 26 A S S S+ 0 0 60 -23,-1.4 2,-0.3 -2,-0.3 -1,-0.1 0.703 92.2 6.8 -66.7 -19.1 -16.9 -17.0 25.0 27 27 A Q S S- 0 0 113 41,-0.1 -1,-0.1 -24,-0.1 41,-0.1 -0.959 107.6 -53.8-151.6 173.5 -17.5 -17.3 21.3 28 28 A D + 0 0 67 -2,-0.3 41,-0.2 1,-0.1 3,-0.1 -0.183 46.2 164.1 -49.7 124.4 -18.5 -19.8 18.5 29 29 A V > - 0 0 0 39,-2.3 3,-2.5 1,-0.3 62,-0.2 -0.009 32.5-150.2-128.1 27.4 -16.2 -22.8 18.5 30 30 A S T 3 - 0 0 20 1,-0.3 38,-2.2 37,-0.1 -1,-0.3 -0.148 66.0 -36.9 30.1-107.9 -18.6 -24.9 16.4 31 31 A T T 3 S+ 0 0 38 36,-0.2 2,-2.2 -3,-0.1 -1,-0.3 0.151 99.3 122.4-123.3 17.7 -17.9 -28.5 17.6 32 32 A A < + 0 0 13 -3,-2.5 59,-2.6 18,-0.1 60,-0.5 -0.420 45.5 126.7 -79.2 65.7 -14.1 -28.2 18.1 33 33 A V E -E 90 0B 0 -2,-2.2 18,-2.8 57,-0.2 17,-0.3 -0.968 37.3-172.5-129.6 137.2 -14.4 -29.3 21.8 34 34 A A E -E 89 0B 0 55,-2.6 55,-2.4 -2,-0.4 2,-0.4 -0.955 10.1-150.0-125.5 150.7 -12.6 -32.0 23.9 35 35 A W E -EF 88 48B 0 13,-2.5 12,-3.0 -2,-0.3 13,-1.6 -0.974 12.8-170.2-123.1 140.1 -13.2 -33.3 27.4 36 36 A Y E -EF 87 46B 0 51,-2.5 51,-2.0 -2,-0.4 2,-0.4 -0.900 12.7-144.7-128.5 149.3 -10.6 -34.7 29.7 37 37 A Q E -EF 86 45B 23 8,-2.7 8,-2.1 -2,-0.3 2,-0.4 -0.955 16.3-173.7-117.0 134.0 -10.7 -36.5 33.1 38 38 A Q E -E 85 0B 10 47,-2.9 47,-2.7 -2,-0.4 5,-0.1 -0.979 12.0-156.9-131.9 124.4 -8.0 -36.1 35.7 39 39 A K > - 0 0 44 4,-0.5 3,-2.5 -2,-0.4 45,-0.1 -0.743 41.7 -98.1 -92.1 149.4 -7.7 -37.9 39.0 40 40 A P T 3 S+ 0 0 75 0, 0.0 -1,-0.1 0, 0.0 44,-0.0 0.746 116.0 25.0 -40.7 -60.1 -5.6 -36.0 41.7 41 41 A G T 3 S+ 0 0 79 2,-0.1 2,-0.2 -3,-0.0 -3,-0.0 0.168 114.3 88.0 -93.5 20.2 -2.1 -37.5 41.4 42 42 A K S < S- 0 0 79 -3,-2.5 281,-0.1 1,-0.1 282,-0.0 -0.737 80.4 -95.8-127.9 162.4 -2.5 -38.6 37.8 43 43 A A - 0 0 23 -2,-0.2 -4,-0.5 279,-0.2 281,-0.1 -0.429 50.4-104.0 -67.1 143.0 -2.2 -37.6 34.2 44 44 A P - 0 0 3 0, 0.0 2,-0.4 0, 0.0 278,-0.3 -0.264 34.2-145.5 -60.4 160.5 -5.3 -36.3 32.5 45 45 A K E -F 37 0B 110 -8,-2.1 -8,-2.7 276,-0.1 2,-0.2 -0.999 14.7-117.2-133.5 131.5 -7.2 -38.7 30.1 46 46 A L E +F 36 0B 8 -2,-0.4 -10,-0.2 274,-0.3 3,-0.1 -0.460 38.0 163.9 -61.8 131.1 -9.0 -37.9 26.9 47 47 A L E + 0 0 5 -12,-3.0 8,-2.5 1,-0.4 2,-0.4 0.722 61.7 12.4-110.0 -50.5 -12.8 -38.8 27.1 48 48 A I E -FG 35 54B 0 -13,-1.6 -13,-2.5 6,-0.2 -1,-0.4 -0.980 57.9-172.2-136.7 141.4 -14.5 -37.0 24.3 49 49 A Y E > + G 0 53B 6 4,-2.3 4,-2.1 -2,-0.4 -15,-0.2 -0.940 69.3 23.8-132.1 157.3 -13.4 -35.1 21.2 50 50 A S T 4 S- 0 0 22 -17,-0.3 2,-1.9 -2,-0.3 -16,-0.2 0.828 119.2 -78.5 59.0 36.5 -15.3 -33.0 18.7 51 51 A A T 4 S+ 0 0 3 -18,-2.8 -1,-0.2 1,-0.2 21,-0.1 -0.326 126.7 28.5 78.3 -52.3 -18.1 -32.3 21.2 52 52 A S T 4 S+ 0 0 67 -2,-1.9 2,-0.5 -3,-0.2 12,-0.3 0.391 88.2 107.8-124.2 -0.2 -19.9 -35.6 20.9 53 53 A F E < -G 49 0B 62 -4,-2.1 -4,-2.3 10,-0.1 2,-0.4 -0.733 58.4-138.2 -95.0 128.4 -17.4 -38.4 19.9 54 54 A L E -G 48 0B 63 -2,-0.5 -6,-0.2 -6,-0.2 2,-0.2 -0.648 22.3-125.4 -82.0 129.9 -16.4 -41.0 22.5 55 55 A Y > - 0 0 23 -8,-2.5 3,-2.2 -2,-0.4 -1,-0.1 -0.481 38.9 -85.2 -76.7 145.0 -12.7 -41.8 22.4 56 56 A S T 3 S+ 0 0 60 1,-0.3 -1,-0.1 -2,-0.2 397,-0.0 -0.272 116.6 21.6 -53.2 126.3 -11.6 -45.5 22.0 57 57 A G T 3 S+ 0 0 79 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.031 91.0 123.6 102.9 -23.9 -11.6 -47.2 25.4 58 58 A V < - 0 0 22 -3,-2.2 -1,-0.3 -11,-0.1 -11,-0.1 -0.552 67.8-109.6 -74.8 129.7 -13.9 -44.7 27.2 59 59 A P > - 0 0 50 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.142 20.9-118.5 -60.4 154.0 -17.0 -46.3 28.7 60 60 A S T 3 S+ 0 0 111 1,-0.3 16,-0.1 -6,-0.0 -2,-0.1 0.681 103.0 78.7 -71.5 -20.8 -20.5 -45.7 27.2 61 61 A R T 3 S+ 0 0 51 16,-0.1 15,-2.9 14,-0.1 2,-0.3 0.644 84.0 81.5 -63.0 -15.5 -21.9 -44.0 30.3 62 62 A F E < +C 75 0A 5 -3,-1.4 2,-0.3 13,-0.2 13,-0.2 -0.689 57.7 157.1 -85.4 144.8 -20.0 -40.9 29.1 63 63 A S E -C 74 0A 53 11,-1.7 11,-3.0 -2,-0.3 2,-0.3 -0.976 20.2-160.0-158.5 163.9 -21.4 -38.6 26.4 64 64 A G E +C 73 0A 8 -12,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.977 13.3 165.1-144.0 154.9 -21.1 -35.1 25.2 65 65 A S E +C 72 0A 61 7,-1.7 7,-2.3 -2,-0.3 2,-0.1 -0.952 21.6 90.4-157.9 174.6 -23.1 -32.7 23.1 66 66 A G - 0 0 34 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.131 37.4-149.4 113.8 154.1 -23.6 -29.1 22.1 67 67 A S + 0 0 59 3,-0.5 2,-0.9 -2,-0.1 3,-0.4 -0.974 64.0 22.4-157.2 151.5 -22.3 -26.8 19.4 68 68 A G S S- 0 0 14 -38,-2.2 -39,-2.3 -2,-0.3 -41,-0.1 -0.860 129.4 -22.5 96.3-100.8 -21.5 -23.2 19.1 69 69 A T S S+ 0 0 58 -2,-0.9 -44,-2.0 -41,-0.2 2,-0.5 0.412 120.1 71.8-126.7 -2.9 -21.0 -21.9 22.6 70 70 A D E +B 24 0A 60 -3,-0.4 -3,-0.5 -46,-0.2 2,-0.4 -0.976 54.0 174.2-128.1 119.8 -22.7 -24.3 25.0 71 71 A F E -B 23 0A 0 -48,-2.9 -48,-2.6 -2,-0.5 2,-0.4 -0.973 11.6-159.4-131.3 139.0 -21.4 -27.8 25.6 72 72 A T E -BC 22 65A 30 -7,-2.3 -7,-1.7 -2,-0.4 2,-0.5 -0.937 6.9-157.6-120.5 138.4 -22.5 -30.5 28.0 73 73 A L E -BC 21 64A 1 -52,-2.7 -52,-2.6 -2,-0.4 2,-0.5 -0.976 20.6-166.9-110.0 129.9 -20.7 -33.5 29.5 74 74 A T E -BC 20 63A 8 -11,-3.0 -11,-1.7 -2,-0.5 2,-0.6 -0.963 21.6-168.7-125.0 126.8 -23.0 -36.2 30.7 75 75 A I E -BC 19 62A 1 -56,-2.1 -56,-2.2 -2,-0.5 3,-0.3 -0.981 12.5-161.9-103.6 119.6 -22.3 -39.3 32.8 76 76 A S S S+ 0 0 57 -15,-2.9 2,-0.2 -2,-0.6 -14,-0.1 0.713 81.4 12.5 -78.6 -22.0 -25.6 -41.3 32.5 77 77 A S S S- 0 0 42 -16,-0.3 -1,-0.3 -59,-0.1 -59,-0.2 -0.756 83.9-133.3-157.5 104.7 -24.8 -43.4 35.6 78 78 A L - 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