==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 28-JUL-11 3T65 . COMPND 2 MOLECULE: S25-2 FAB (IGG1K) HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR H.P.NGUYEN,N.O.SETO,C.R.MACKENZIE,L.BRADE,P.KOSMA,H.BRADE,S. . 441 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19914.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 286 64.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 174 39.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 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 RESIDUES PER ALPHA HELIX . 1 1 0 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 PARALLEL BRIDGES PER LADDER . 4 3 5 2 5 9 1 0 1 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 . 2 0 5 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 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 B E 0 0 182 0, 0.0 2,-0.4 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 124.0 -11.0 53.0 120.2 2 2 B V - 0 0 37 24,-0.1 2,-0.4 22,-0.1 24,-0.2 -0.645 360.0-174.2 -75.4 131.1 -7.5 51.6 120.4 3 3 B K E +A 25 0A 82 22,-2.4 22,-1.9 -2,-0.4 2,-0.4 -0.995 16.5 179.1-130.6 136.1 -5.3 52.7 117.5 4 4 B L E +A 24 0A 14 -2,-0.4 110,-0.5 108,-0.2 2,-0.4 -0.991 9.9 179.6-129.7 124.0 -1.7 51.8 116.6 5 5 B V E -A 23 0A 58 18,-2.2 18,-2.5 -2,-0.4 2,-0.2 -0.936 11.8-155.4-133.3 110.7 -0.3 53.3 113.5 6 6 B E E +A 22 0A 4 -2,-0.4 2,-0.3 16,-0.3 16,-0.2 -0.521 17.2 173.3 -78.8 151.5 3.2 52.6 112.2 7 7 B S E +A 21 0A 59 14,-2.3 14,-2.5 -2,-0.2 109,-0.1 -0.960 43.4 64.3-146.8 162.1 5.2 55.0 110.0 8 8 B G + 0 0 41 1,-0.3 11,-0.1 -2,-0.3 14,-0.0 0.251 60.3 137.4 110.9 -11.4 8.7 55.3 108.6 9 9 B G + 0 0 27 12,-0.1 -1,-0.3 87,-0.1 2,-0.3 -0.227 24.8 101.3 -62.6 155.7 8.9 52.3 106.3 10 10 B G - 0 0 20 107,-0.1 109,-2.5 106,-0.1 2,-0.4 -0.985 68.3 -29.0 161.9-161.2 10.4 52.7 102.9 11 11 B L E +e 119 0B 48 -2,-0.3 2,-0.3 107,-0.2 109,-0.2 -0.681 53.2 166.0 -90.1 131.2 13.5 52.0 100.8 12 12 B V E -e 120 0B 19 107,-2.4 109,-2.1 -2,-0.4 2,-0.2 -0.985 33.7-112.7-141.5 149.7 17.0 52.0 102.4 13 13 B Q > - 0 0 138 -2,-0.3 3,-2.3 107,-0.2 75,-0.2 -0.503 44.0 -88.3 -82.5 151.6 20.4 50.8 101.2 14 14 B S T 3 S+ 0 0 73 1,-0.3 75,-0.2 -2,-0.2 -1,-0.1 -0.333 118.1 27.6 -56.0 136.8 22.2 47.9 102.7 15 15 B G T 3 S+ 0 0 36 73,-3.2 72,-0.6 1,-0.3 -1,-0.3 0.175 102.0 116.4 94.0 -15.2 24.3 49.1 105.6 16 16 B G < - 0 0 22 -3,-2.3 72,-2.6 72,-0.2 -1,-0.3 -0.096 58.8-124.2 -82.5 179.1 22.0 52.0 106.2 17 17 B S + 0 0 62 69,-0.2 2,-0.3 70,-0.2 69,-0.2 -0.839 21.9 179.8-122.4 160.3 19.8 52.9 109.2 18 18 B L E - B 0 85A 37 67,-2.1 67,-2.8 -2,-0.3 2,-0.5 -0.949 14.8-148.7-160.2 138.7 16.1 53.6 109.5 19 19 B R E - B 0 84A 148 -2,-0.3 2,-0.3 65,-0.2 65,-0.2 -0.956 12.4-160.2-116.4 128.0 13.8 54.5 112.4 20 20 B L E - B 0 83A 1 63,-3.0 63,-2.2 -2,-0.5 2,-0.3 -0.737 4.8-155.9-100.9 152.8 10.2 53.5 112.6 21 21 B S E -AB 7 82A 34 -14,-2.5 -14,-2.3 -2,-0.3 2,-0.4 -0.883 7.6-160.7-124.5 159.2 7.5 55.0 114.7 22 22 B a E -AB 6 81A 0 59,-2.0 59,-2.7 -2,-0.3 2,-0.4 -0.887 10.5-156.1-142.3 106.5 4.2 53.8 116.1 23 23 B A E -AB 5 80A 35 -18,-2.5 -18,-2.2 -2,-0.4 2,-0.3 -0.686 18.3-169.1 -84.8 133.7 1.6 56.3 117.2 24 24 B T E +A 4 0A 8 55,-1.7 2,-0.3 -2,-0.4 -20,-0.2 -0.899 15.0 159.8-126.7 153.0 -0.8 55.0 119.7 25 25 B S E +A 3 0A 38 -22,-1.9 -22,-2.4 -2,-0.3 3,-0.1 -0.979 47.4 57.6-157.4 165.0 -4.1 56.2 121.3 26 26 B G S S+ 0 0 46 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.1 0.526 95.9 59.8 92.7 6.9 -7.1 54.8 123.2 27 27 B F S S- 0 0 33 -24,-0.1 2,-1.5 -26,-0.1 -1,-0.2 -0.974 97.3 -85.9-155.4 163.1 -5.4 53.2 126.1 28 28 B T > - 0 0 85 -2,-0.3 3,-1.9 1,-0.2 4,-0.3 -0.588 43.6-164.5 -76.6 92.9 -3.1 54.1 129.0 29 29 B F G > S+ 0 0 5 -2,-1.5 3,-2.0 1,-0.3 -1,-0.2 0.835 80.8 55.9 -48.8 -48.2 0.3 53.8 127.1 30 30 B T G 3 S+ 0 0 34 1,-0.3 24,-2.6 46,-0.2 25,-0.4 0.686 97.3 65.7 -67.2 -15.5 2.6 53.7 130.2 31 31 B D G < S+ 0 0 89 -3,-1.9 2,-0.4 22,-0.2 -1,-0.3 0.645 97.2 74.1 -75.1 -14.5 0.7 50.8 131.6 32 32 B Y S < S- 0 0 33 -3,-2.0 71,-0.2 -4,-0.3 2,-0.2 -0.839 70.6-136.6-116.5 138.1 1.8 48.6 128.7 33 33 B Y - 0 0 21 69,-3.3 68,-2.6 -2,-0.4 2,-0.4 -0.538 32.1-149.1 -64.5 149.2 4.8 46.8 127.4 34 34 B M E -FG 51 100C 0 17,-2.1 17,-2.0 66,-0.2 2,-0.3 -0.995 10.8-161.5-128.2 135.7 5.1 47.3 123.7 35 35 B S E -FG 50 99C 0 64,-2.8 64,-2.6 -2,-0.4 2,-0.4 -0.802 12.2-145.0-112.2 155.7 6.5 44.9 121.1 36 36 B W E +FG 49 98C 0 13,-2.1 12,-2.8 -2,-0.3 13,-1.2 -0.964 21.5 178.5-113.0 139.4 7.8 45.1 117.6 37 37 B V E -FG 47 97C 0 60,-2.6 60,-3.5 -2,-0.4 2,-0.3 -0.982 8.1-159.9-136.5 142.1 7.2 42.1 115.2 38 38 B R E -FG 46 96C 1 8,-2.6 8,-2.5 -2,-0.3 58,-0.2 -0.866 8.0-164.3-126.6 165.9 8.2 41.7 111.6 39 39 B Q E - G 0 95C 21 56,-1.9 56,-2.5 -2,-0.3 6,-0.2 -0.860 14.9-142.8-150.1 106.7 7.2 39.6 108.6 40 40 B P > - 0 0 36 0, 0.0 3,-2.6 0, 0.0 54,-0.2 -0.420 55.3 -73.9 -62.1 150.3 9.2 39.1 105.4 41 41 B P T 3 S- 0 0 95 0, 0.0 3,-0.1 0, 0.0 52,-0.0 -0.204 118.5 -1.3 -49.5 123.1 6.8 39.0 102.4 42 42 B G T 3 S+ 0 0 82 1,-0.2 2,-0.2 -3,-0.1 -3,-0.0 0.543 115.7 102.4 73.2 9.1 5.1 35.5 102.4 43 43 B K S < S- 0 0 136 -3,-2.6 -1,-0.2 1,-0.1 2,-0.1 -0.490 74.2 -74.1-116.4-175.8 6.9 34.4 105.5 44 44 B A - 0 0 33 -2,-0.2 2,-0.1 1,-0.1 -1,-0.1 -0.331 48.6 -95.2 -78.5 158.9 6.3 33.9 109.3 45 45 B L - 0 0 7 282,-0.3 2,-0.4 -6,-0.2 281,-0.2 -0.463 36.8-160.9 -64.1 142.8 6.0 36.5 112.0 46 46 B E E -F 38 0C 60 -8,-2.5 -8,-2.6 -2,-0.1 2,-0.3 -0.973 13.5-135.9-132.5 118.3 9.2 37.1 114.0 47 47 B W E -F 37 0C 11 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.559 22.6-179.5 -71.9 131.8 9.2 38.8 117.4 48 48 B L E - 0 0 2 -12,-2.8 15,-2.7 1,-0.4 2,-0.3 0.772 47.7 -58.5-102.8 -38.2 12.0 41.4 117.6 49 49 B G E -FH 36 62C 0 -13,-1.2 -13,-2.1 13,-0.3 -1,-0.4 -0.951 40.5-129.1 169.1 167.7 11.8 42.9 121.1 50 50 B F E -FH 35 61C 6 11,-2.1 11,-2.1 -2,-0.3 2,-0.4 -0.937 6.7-142.5-136.9 163.9 9.9 44.8 123.7 51 51 B I E -FH 34 60C 7 -17,-2.0 -17,-2.1 -2,-0.3 9,-0.2 -1.000 32.3-127.4-122.9 132.0 10.0 47.8 126.0 52 52 B R - 0 0 49 7,-3.3 -20,-0.1 -2,-0.4 51,-0.0 -0.122 24.5 -97.5 -75.6 171.0 8.5 47.3 129.4 53 52AB N > > - 0 0 8 -22,-0.2 5,-2.5 5,-0.1 3,-0.8 -0.141 42.0 -90.5 -79.4 180.0 5.9 49.5 131.1 54 52BB K G > 5S+ 0 0 140 -24,-2.6 3,-2.0 1,-0.3 -23,-0.1 0.891 124.1 59.5 -61.5 -41.0 6.5 52.2 133.7 55 52CB A G 3 5S+ 0 0 90 -25,-0.4 -1,-0.3 1,-0.3 -24,-0.1 0.808 110.0 44.2 -59.0 -28.9 6.1 49.8 136.6 56 52DB N G X 5S- 0 0 76 -3,-0.8 3,-1.0 3,-0.1 -1,-0.3 0.088 121.3-104.6-106.8 21.7 9.1 47.9 135.2 57 52EB G T < 5 - 0 0 50 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.621 53.0 -85.6 73.6 15.7 11.2 50.9 134.4 58 53 B Y T 3 > - 0 0 9 -15,-2.7 4,-2.0 -2,-0.3 3,-1.8 -0.443 38.0-117.4 -66.2 146.5 15.5 38.7 120.1 64 59 B P T 34 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -16,-0.1 0.823 111.9 71.8 -55.4 -26.0 19.1 37.3 119.6 65 60 B S T 34 S+ 0 0 51 1,-0.2 -17,-0.1 4,-0.0 -2,-0.0 0.728 117.8 13.0 -64.3 -22.2 18.4 37.9 115.9 66 61 B V T X> S+ 0 0 3 -3,-1.8 3,-2.4 -18,-0.2 4,-2.0 0.417 87.2 131.7-134.2 -4.7 18.6 41.7 116.3 67 62 B K B 3< S+c 70 0A 145 -4,-2.0 4,-0.1 1,-0.3 -18,-0.0 -0.309 79.7 20.5 -56.0 129.5 20.1 42.4 119.7 68 63 B G T 34 S+ 0 0 82 2,-0.5 -1,-0.3 1,-0.0 3,-0.1 0.253 125.0 56.6 96.5 -10.2 22.9 44.9 119.4 69 64 B R T <4 S+ 0 0 52 -3,-2.4 17,-1.3 1,-0.3 2,-0.4 0.621 100.1 51.6-125.2 -30.5 21.7 46.3 116.1 70 65 B F E < -cD 67 85A 2 -4,-2.0 -2,-0.5 15,-0.2 2,-0.4 -0.916 64.1-163.8-112.1 142.9 18.1 47.4 116.8 71 66 B T E - D 0 84A 67 13,-2.6 13,-3.3 -2,-0.4 2,-0.4 -0.992 4.4-154.3-128.7 132.3 17.0 49.7 119.6 72 67 B I E + D 0 83A 9 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.823 21.4 162.5-102.7 139.2 13.5 50.3 121.0 73 68 B S E - D 0 82A 59 9,-1.6 9,-3.0 -2,-0.4 2,-0.3 -0.932 18.7-148.5-145.4 173.0 12.4 53.5 122.8 74 69 B R E - D 0 81A 28 -2,-0.3 2,-0.7 7,-0.2 7,-0.2 -0.999 14.4-141.7-147.9 145.0 9.2 55.2 123.7 75 70 B D E >> - D 0 80A 36 5,-3.2 5,-1.7 -2,-0.3 4,-1.0 -0.938 17.8-174.0-105.5 107.6 7.9 58.8 124.2 76 71 B N T 45S+ 0 0 52 -2,-0.7 -46,-0.2 1,-0.2 -1,-0.1 0.550 79.5 60.0 -82.6 -7.5 5.6 58.5 127.2 77 72 B S T 45S+ 0 0 105 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.778 120.6 24.2 -86.1 -28.5 4.4 62.1 126.8 78 73 B Q T 45S- 0 0 126 -3,-0.3 -54,-0.3 2,-0.1 -2,-0.2 0.398 104.7-119.7-116.1 -1.4 2.9 61.6 123.3 79 74 B S T <5 + 0 0 32 -4,-1.0 -55,-1.7 1,-0.2 2,-0.4 0.896 60.9 146.8 62.4 46.0 2.4 57.8 123.5 80 75 B I E < -BD 23 75A 28 -5,-1.7 -5,-3.2 -57,-0.2 2,-0.4 -0.930 35.5-153.2-116.7 136.3 4.7 57.0 120.6 81 76 B L E -BD 22 74A 0 -59,-2.7 -59,-2.0 -2,-0.4 2,-0.3 -0.852 13.7-160.8-104.6 143.9 6.8 53.8 120.2 82 77 B Y E -BD 21 73A 61 -9,-3.0 -9,-1.6 -2,-0.4 2,-0.4 -0.918 14.9-165.9-126.5 151.0 10.1 53.8 118.2 83 78 B L E -BD 20 72A 0 -63,-2.2 -63,-3.0 -2,-0.3 2,-0.6 -0.946 9.8-162.3-133.5 111.6 12.3 51.2 116.6 84 79 B Q E -BD 19 71A 39 -13,-3.3 -13,-2.6 -2,-0.4 2,-0.4 -0.860 10.3-166.4 -92.4 122.8 15.8 52.2 115.5 85 80 B M E -BD 18 70A 0 -67,-2.8 -67,-2.1 -2,-0.6 2,-0.3 -0.932 5.6-172.8-113.7 132.7 17.4 49.8 113.0 86 81 B N + 0 0 48 -17,-1.3 -69,-0.2 -2,-0.4 -70,-0.1 -0.828 59.3 14.9-123.0 161.3 21.0 49.8 112.1 87 82 B T S S- 0 0 70 -72,-0.6 -1,-0.2 -2,-0.3 -71,-0.2 0.899 83.3-158.2 45.3 54.3 23.3 48.1 109.6 88 82AB L - 0 0 0 -72,-2.6 -73,-3.2 -75,-0.2 2,-0.3 -0.258 13.7-173.2 -67.1 144.9 20.3 46.9 107.6 89 83 B R > - 0 0 123 -75,-0.2 3,-2.6 -74,-0.1 4,-0.3 -0.866 42.6 -93.5-132.2 170.4 20.6 44.0 105.2 90 84 B A G > S+ 0 0 73 1,-0.3 3,-2.1 -2,-0.3 30,-0.3 0.839 121.1 63.8 -54.0 -34.9 18.3 42.3 102.7 91 85 B E G 3 S+ 0 0 124 1,-0.3 -1,-0.3 -51,-0.0 -3,-0.0 0.634 92.9 64.7 -65.0 -13.5 17.0 39.9 105.3 92 86 B D G < S+ 0 0 0 -3,-2.6 2,-0.4 2,-0.0 -1,-0.3 0.518 71.1 115.2 -87.3 -5.9 15.6 42.9 107.2 93 87 B S < + 0 0 28 -3,-2.1 2,-0.3 -4,-0.3 26,-0.2 -0.535 49.0 110.9 -66.1 122.3 13.2 43.6 104.3 94 88 B A E S- I 0 118C 0 24,-1.4 24,-3.0 -2,-0.4 2,-0.5 -0.976 74.3 -82.3-177.1 162.6 9.8 43.0 105.9 95 89 B T E -GI 39 117C 33 -56,-2.5 -56,-1.9 -2,-0.3 2,-0.5 -0.822 45.6-148.3 -82.0 128.4 6.5 44.5 107.2 96 90 B Y E -GI 38 116C 0 20,-2.9 20,-2.1 -2,-0.5 2,-0.4 -0.896 14.9-170.6-105.4 125.7 7.1 45.8 110.7 97 91 B Y E -G 37 0C 11 -60,-3.5 -60,-2.6 -2,-0.5 2,-0.4 -0.912 15.3-148.2-113.4 136.9 4.3 45.8 113.2 98 92 B a E -G 36 0C 0 -2,-0.4 15,-2.3 -62,-0.2 2,-0.4 -0.833 22.6-170.2 -94.1 146.4 4.0 47.4 116.6 99 93 B A E -GJ 35 112C 0 -64,-2.6 -64,-2.8 -2,-0.4 2,-0.3 -1.000 26.6-118.9-137.5 137.2 1.8 45.4 119.0 100 94 B R E +G 34 0C 16 11,-2.4 10,-0.5 -2,-0.4 11,-0.4 -0.586 44.8 178.6 -72.0 134.5 0.5 46.2 122.4 101 95 B D - 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