==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 17-JUL-08 3DUR . COMPND 2 MOLECULE: ANTIBODY FV FRAGMENT SAG173-04; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR C.L.BROOKS,R.J.BLACKLER,S.GERSTENBRUCH,P.KOSMA,S.MULLER- . 466 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20049.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 314 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 182 39.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 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 . 43 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.5 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 . 1 1 1 2 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 8 8 2 4 8 4 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 . 3 0 3 1 1 3 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 0 168 0, 0.0 2,-0.5 0, 0.0 99,-0.1 0.000 360.0 360.0 360.0 86.9 9.2 -23.5 7.9 2 2 A I - 0 0 3 97,-0.3 2,-0.4 94,-0.0 94,-0.1 -0.781 360.0-140.2 -96.9 121.2 8.5 -21.8 11.3 3 3 A V - 0 0 87 -2,-0.5 23,-1.7 2,-0.0 2,-0.5 -0.734 14.7-157.5 -82.9 130.0 7.1 -24.0 14.1 4 4 A M E -A 25 0A 16 -2,-0.4 2,-0.4 99,-0.4 101,-0.2 -0.956 10.5-175.6-113.9 125.2 4.4 -22.3 16.2 5 5 A T E -A 24 0A 70 19,-2.6 19,-3.8 -2,-0.5 2,-0.4 -0.952 4.8-163.7-121.6 139.2 3.8 -23.5 19.8 6 6 A Q E -A 23 0A 23 -2,-0.4 17,-0.2 17,-0.2 -2,-0.0 -0.937 15.5-123.3-121.3 147.7 1.1 -22.3 22.2 7 7 A S E S+A 22 0A 72 15,-1.9 15,-3.7 -2,-0.4 2,-0.1 -0.998 80.8 21.1-142.8 137.9 0.7 -22.7 25.9 8 8 A P - 0 0 48 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.676 65.9-149.2 -79.5 172.1 -1.4 -23.9 27.6 9 9 A S S S+ 0 0 98 1,-0.3 99,-2.6 98,-0.2 2,-0.3 0.841 84.0 0.2 -72.2 -31.9 -3.3 -26.1 25.3 10 10 A S E +d 108 0B 51 97,-0.2 2,-0.3 81,-0.1 -1,-0.3 -0.988 66.7 176.3-147.6 155.6 -6.5 -25.4 27.4 11 11 A L E -d 109 0B 27 97,-2.6 99,-2.9 -2,-0.3 2,-0.4 -0.985 14.6-148.5-155.6 157.9 -7.4 -23.4 30.4 12 12 A A E +d 110 0B 34 -2,-0.3 2,-0.3 97,-0.2 99,-0.2 -0.986 20.7 164.5-128.9 137.8 -10.6 -22.5 32.4 13 13 A V E -d 111 0B 25 97,-1.9 99,-2.4 -2,-0.4 2,-0.2 -0.943 36.5-106.2-136.3 166.1 -11.4 -19.3 34.3 14 14 A S > - 0 0 52 -2,-0.3 3,-1.6 97,-0.2 70,-0.3 -0.557 52.3 -84.3 -79.7 157.0 -14.5 -17.7 35.7 15 15 A A T 3 S+ 0 0 65 97,-0.5 70,-0.2 1,-0.2 -1,-0.1 -0.327 115.6 29.3 -53.5 141.7 -16.0 -14.7 34.0 16 16 A G T 3 S+ 0 0 53 68,-3.1 -1,-0.2 1,-0.3 69,-0.1 0.218 90.7 120.1 90.2 -15.4 -14.3 -11.5 35.1 17 17 A E < - 0 0 101 -3,-1.6 67,-3.1 66,-0.2 66,-0.7 -0.416 65.2-117.8 -76.8 157.7 -10.9 -13.0 35.8 18 18 A K E + B 0 82A 141 65,-0.2 2,-0.3 64,-0.2 64,-0.2 -0.819 37.3 179.8 -88.6 135.1 -7.7 -11.9 34.0 19 19 A V E - B 0 81A 18 62,-1.7 62,-2.4 -2,-0.4 2,-0.3 -0.982 12.7-163.4-135.1 152.6 -6.0 -14.6 31.9 20 20 A T E - B 0 80A 64 -2,-0.3 2,-0.3 60,-0.2 60,-0.2 -0.913 2.5-168.0-130.0 156.8 -2.9 -14.8 29.7 21 21 A M E - B 0 79A 2 58,-1.5 58,-1.8 -2,-0.3 2,-0.3 -0.960 16.7-128.2-144.4 156.3 -1.8 -17.4 27.1 22 22 A S E -AB 7 78A 59 -15,-3.7 -15,-1.9 -2,-0.3 2,-0.4 -0.772 14.5-170.2-116.1 148.7 1.6 -17.8 25.4 23 23 A a E -AB 6 77A 2 54,-2.4 54,-2.5 -2,-0.3 2,-0.4 -0.985 7.2-170.8-137.4 126.1 2.8 -18.2 21.8 24 24 A K E -AB 5 76A 81 -19,-3.8 -19,-2.6 -2,-0.4 2,-0.4 -0.944 5.8-158.2-119.5 136.2 6.3 -19.2 20.7 25 25 A S E -A 4 0A 0 50,-2.7 -21,-0.2 -2,-0.4 4,-0.1 -0.902 20.7-135.2-110.1 150.1 7.8 -19.1 17.2 26 26 A S S S+ 0 0 61 -23,-1.7 2,-0.3 -2,-0.4 -22,-0.1 0.668 94.1 29.1 -70.8 -19.7 10.8 -21.2 16.0 27 27 A Q S S- 0 0 95 -24,-0.2 2,-0.1 47,-0.1 -25,-0.0 -0.955 101.2 -86.8-139.6 150.7 12.3 -18.1 14.3 28 28 A S - 0 0 59 -2,-0.3 47,-0.2 1,-0.1 -2,-0.1 -0.374 27.2-160.4 -62.4 141.1 12.0 -14.4 15.0 29 29 A L + 0 0 0 45,-2.5 9,-2.9 -4,-0.1 2,-0.4 0.232 50.8 121.2-104.2 12.8 9.0 -12.7 13.4 30 30 A F E -J 37 0C 80 7,-0.2 2,-0.7 8,-0.1 7,-0.3 -0.664 51.9-151.4 -81.7 128.2 10.4 -9.2 13.6 31 30AA K E >> -J 36 0C 49 5,-3.4 4,-1.3 -2,-0.4 5,-1.0 -0.866 4.0-163.5-104.5 113.8 10.7 -7.5 10.2 32 30BA S T 45S+ 0 0 103 -2,-0.7 3,-0.2 1,-0.2 -1,-0.2 0.886 83.0 68.1 -67.4 -39.2 13.5 -4.9 10.3 33 30CA R T 45S+ 0 0 184 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.916 124.4 9.8 -45.1 -49.8 12.4 -3.1 7.2 34 30DA N T 45S- 0 0 34 -3,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.276 98.4-120.3-121.9 11.7 9.2 -1.8 9.0 35 30EA Q T <5 + 0 0 133 -4,-1.3 2,-0.3 -3,-0.2 -3,-0.2 0.800 67.0 133.2 54.9 36.7 9.9 -2.7 12.6 36 30FA K E < -J 31 0C 24 -5,-1.0 -5,-3.4 -7,-0.0 2,-0.5 -0.894 57.4-129.7-112.9 148.6 6.8 -4.9 12.9 37 31 A N E -J 30 0C 19 -2,-0.3 2,-2.0 19,-0.3 -7,-0.2 -0.869 20.8-139.4 -88.0 121.5 6.3 -8.4 14.4 38 32 A Y + 0 0 9 -9,-2.9 59,-2.0 -2,-0.5 60,-0.5 -0.507 61.0 122.0 -84.2 69.6 4.4 -10.5 11.8 39 33 A L E -E 96 0B 1 -2,-2.0 18,-2.7 57,-0.2 2,-0.3 -0.995 36.7-177.4-136.0 133.9 2.2 -12.2 14.4 40 34 A A E -E 95 0B 0 55,-2.3 55,-1.8 -2,-0.4 2,-0.4 -0.921 16.3-142.5-132.3 154.4 -1.6 -12.3 14.6 41 35 A W E -EF 94 54B 0 13,-2.2 12,-2.7 -2,-0.3 13,-1.5 -0.978 16.1-168.4-117.0 140.8 -4.2 -13.7 17.0 42 36 A Y E -EF 93 52B 0 51,-2.8 51,-2.5 -2,-0.4 2,-0.4 -0.928 9.7-148.5-128.2 145.7 -7.5 -15.2 15.9 43 37 A Q E -EF 92 51B 10 8,-2.5 8,-1.7 -2,-0.3 2,-0.5 -0.951 10.7-173.1-111.5 134.3 -10.5 -16.2 18.0 44 38 A Q E -E 91 0B 14 47,-2.8 47,-2.2 -2,-0.4 3,-0.1 -0.863 9.1-157.3-133.2 105.1 -12.8 -19.1 17.0 45 39 A K > - 0 0 62 -2,-0.5 3,-1.9 4,-0.4 45,-0.2 -0.339 44.7 -77.4 -70.9 154.9 -16.0 -19.6 19.0 46 40 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.298 116.9 4.5 -56.8 133.3 -17.4 -23.2 18.9 47 41 A G T 3 S+ 0 0 91 1,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.642 114.2 102.9 70.3 14.4 -19.3 -23.9 15.6 48 42 A Q S < S- 0 0 104 -3,-1.9 -1,-0.2 1,-0.0 3,-0.1 -0.804 76.2-102.1-127.5 160.5 -18.2 -20.5 14.2 49 43 A S - 0 0 21 -2,-0.3 -4,-0.4 1,-0.1 177,-0.1 -0.451 50.0 -90.0 -78.4 155.3 -15.6 -19.3 11.7 50 44 A P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.256 37.9-155.5 -58.8 158.9 -12.4 -17.7 13.0 51 45 A K E -F 43 0B 97 -8,-1.7 -8,-2.5 172,-0.1 2,-0.4 -1.000 20.3-116.4-135.5 132.3 -12.2 -13.9 13.5 52 46 A L E +F 42 0B 2 -2,-0.4 -10,-0.2 170,-0.3 3,-0.1 -0.587 35.1 169.8 -64.4 125.0 -9.0 -11.7 13.5 53 47 A L E + 0 0 2 -12,-2.7 8,-2.8 -2,-0.4 2,-0.3 0.836 63.3 4.2 -96.5 -50.5 -8.4 -10.1 17.0 54 48 A I E -FG 41 60B 0 -13,-1.5 -13,-2.2 6,-0.3 -1,-0.4 -0.986 57.8-170.7-145.3 143.6 -4.9 -8.6 16.7 55 49 A Y E >> S+ G 0 59B 6 4,-2.7 4,-2.4 -2,-0.3 3,-0.5 -0.885 71.3 30.2-136.4 161.4 -2.3 -8.2 14.1 56 50 A W T 34 S- 0 0 17 162,-0.4 2,-1.8 -2,-0.3 -19,-0.3 0.873 123.9 -77.1 53.7 38.9 1.4 -7.0 14.2 57 51 A A T 34 S+ 0 0 3 -18,-2.7 -1,-0.3 1,-0.2 21,-0.2 -0.087 126.0 25.3 72.6 -37.5 1.5 -8.4 17.7 58 52 A S T <4 S+ 0 0 72 -2,-1.8 2,-0.7 -3,-0.5 12,-0.2 0.405 84.8 108.1-140.9 -0.2 -0.4 -5.6 19.4 59 53 A T E < -G 55 0B 21 -4,-2.4 -4,-2.7 10,-0.1 2,-0.3 -0.764 61.9-136.7 -88.7 118.2 -2.7 -3.8 17.0 60 54 A R E -G 54 0B 95 -2,-0.7 -6,-0.3 -6,-0.2 3,-0.1 -0.548 22.7-116.2 -69.4 132.3 -6.3 -4.6 17.8 61 55 A E > - 0 0 25 -8,-2.8 3,-2.3 -2,-0.3 -1,-0.1 -0.269 48.1 -76.6 -62.8 150.1 -8.4 -5.2 14.7 62 56 A S T 3 S+ 0 0 73 1,-0.3 -1,-0.2 3,-0.0 189,-0.0 -0.274 120.7 16.6 -50.7 131.1 -11.2 -2.7 14.0 63 57 A G T 3 S+ 0 0 76 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.327 88.3 136.3 89.1 -9.3 -14.1 -3.5 16.4 64 58 A V < - 0 0 15 -3,-2.3 -1,-0.3 -11,-0.1 -4,-0.1 -0.591 60.1-112.5 -82.2 127.5 -12.2 -5.6 18.8 65 59 A P > - 0 0 45 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.197 20.9-120.1 -53.6 143.3 -13.0 -4.9 22.5 66 60 A D T 3 S+ 0 0 125 1,-0.3 16,-0.1 15,-0.0 -2,-0.1 0.595 102.0 84.4 -66.9 -4.5 -10.1 -3.3 24.5 67 61 A R T 3 S+ 0 0 47 14,-0.1 15,-2.7 16,-0.1 2,-0.5 0.743 79.4 79.1 -57.9 -31.4 -10.2 -6.4 26.9 68 62 A F E < +C 81 0A 4 -3,-1.8 2,-0.4 13,-0.2 13,-0.2 -0.743 61.1 171.8 -87.3 126.4 -8.0 -8.0 24.4 69 63 A T E -C 80 0A 53 11,-2.3 11,-2.6 -2,-0.5 2,-0.3 -0.973 15.7-159.7-139.0 124.6 -4.3 -7.0 24.4 70 64 A G E +C 79 0A 4 -2,-0.4 2,-0.3 -12,-0.2 9,-0.2 -0.787 21.1 163.2-101.7 142.4 -1.5 -8.6 22.5 71 65 A S E +C 78 0A 48 7,-2.5 7,-2.7 -2,-0.3 2,-0.2 -0.917 22.6 73.9-149.2 172.7 2.2 -8.2 23.6 72 66 A G E -C 77 0A 37 -2,-0.3 2,-0.3 5,-0.3 5,-0.3 -0.448 47.8-143.7 106.6 178.5 5.6 -9.7 23.0 73 67 A S E > +C 76 0A 72 3,-1.7 3,-1.9 -2,-0.2 2,-0.8 -0.954 58.5 17.6-168.9 167.0 8.0 -9.6 20.1 74 68 A G T 3 S- 0 0 15 -2,-0.3 -45,-2.5 1,-0.3 -47,-0.1 -0.499 129.4 -15.9 67.9-106.0 10.5 -11.7 18.3 75 69 A T T 3 S+ 0 0 40 -2,-0.8 -50,-2.7 -47,-0.2 2,-0.4 0.413 126.3 64.7-109.7 -6.7 9.9 -15.3 19.1 76 70 A D E < +BC 24 73A 87 -3,-1.9 -3,-1.7 -52,-0.2 2,-0.3 -0.979 56.2 164.4-134.8 122.6 7.6 -14.9 22.2 77 71 A F E -BC 23 72A 2 -54,-2.5 -54,-2.4 -2,-0.4 2,-0.3 -0.886 15.8-157.1-133.2 158.8 4.2 -13.4 22.4 78 72 A T E -BC 22 71A 38 -7,-2.7 -7,-2.5 -2,-0.3 2,-0.5 -0.996 8.2-153.7-141.9 146.0 1.2 -13.3 24.8 79 73 A L E -BC 21 70A 0 -58,-1.8 -58,-1.5 -2,-0.3 2,-0.4 -0.984 18.9-169.0-113.9 125.6 -2.5 -12.6 24.5 80 74 A T E -BC 20 69A 16 -11,-2.6 -11,-2.3 -2,-0.5 2,-0.6 -0.947 12.2-157.7-117.0 139.2 -4.1 -11.2 27.7 81 75 A I E -BC 19 68A 0 -62,-2.4 -62,-1.7 -2,-0.4 2,-1.5 -0.964 11.5-152.3-113.7 112.4 -7.8 -10.9 28.3 82 76 A N E S-B 18 0A 76 -15,-2.7 -64,-0.2 -2,-0.6 -65,-0.1 -0.633 80.7 -2.2 -89.0 85.9 -8.5 -8.3 30.9 83 77 A G S S- 0 0 19 -2,-1.5 -1,-0.3 -66,-0.7 -65,-0.2 0.857 88.4-126.3 98.9 73.5 -11.8 -9.5 32.5 84 78 A V - 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