==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 07-NOV-12 4HWE . COMPND 2 MOLECULE: FAB HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.XU . 423 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19311.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 269 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 168 39.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 37 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.8 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+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 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 RESIDUES PER ALPHA HELIX . 0 0 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 0 PARALLEL BRIDGES PER LADDER . 4 5 3 4 6 5 2 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 . 0 0 5 1 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 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 2 H E 0 0 200 0, 0.0 2,-0.4 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 -19.3 -0.9 22.0 39.6 2 3 H V + 0 0 29 24,-0.2 2,-0.3 22,-0.1 24,-0.2 -0.610 360.0 171.2 -72.5 128.7 1.4 20.7 36.7 3 4 H Q E -A 25 0A 112 22,-2.4 22,-1.6 -2,-0.4 2,-0.4 -0.998 32.0-160.9-148.6 147.6 4.6 22.7 36.7 4 5 H L E -A 24 0A 8 104,-0.4 106,-0.6 -2,-0.3 2,-0.5 -1.000 16.5-167.5-124.0 117.2 8.1 22.7 35.1 5 6 H V E -A 23 0A 67 18,-2.4 18,-2.9 -2,-0.4 2,-0.2 -0.966 7.0-157.9-115.0 114.8 10.7 24.7 37.0 6 7 H Q E -A 22 0A 9 -2,-0.5 16,-0.2 16,-0.2 89,-0.0 -0.584 21.9-101.4 -92.9 157.2 13.9 25.4 35.2 7 8 H S - 0 0 31 14,-1.9 -1,-0.1 -2,-0.2 3,-0.1 -0.125 52.0 -77.3 -70.0 168.7 17.3 26.3 36.7 8 9 H G - 0 0 51 1,-0.2 -1,-0.1 104,-0.1 13,-0.1 -0.113 56.6 -68.1 -72.2 166.4 18.7 29.9 36.8 9 10 H A - 0 0 79 102,-0.1 2,-0.4 1,-0.1 105,-0.2 -0.112 48.2-147.9 -50.8 140.8 20.3 32.3 34.3 10 11 H E E -d 114 0B 50 103,-3.1 105,-3.0 -3,-0.1 2,-0.5 -0.986 16.6-173.9-123.1 126.1 23.7 31.3 33.0 11 12 H V E +d 115 0B 77 -2,-0.4 2,-0.3 103,-0.2 105,-0.2 -0.988 27.6 166.0-113.9 116.2 26.5 33.7 32.0 12 13 H K E -d 116 0B 52 103,-2.9 105,-2.5 -2,-0.5 6,-0.0 -0.865 34.9-121.8-132.8 165.5 29.4 31.6 30.5 13 14 H K > - 0 0 76 -2,-0.3 3,-1.7 103,-0.2 73,-0.2 -0.776 46.5 -88.5-101.5 150.7 32.6 31.9 28.4 14 15 H P T 3 S+ 0 0 59 0, 0.0 73,-0.2 0, 0.0 3,-0.1 -0.319 114.0 29.2 -59.5 139.7 33.1 30.1 25.1 15 16 H G T 3 S+ 0 0 48 71,-3.2 2,-0.2 1,-0.4 72,-0.1 0.187 91.5 123.4 94.8 -14.1 34.6 26.6 25.5 16 17 H E < - 0 0 78 -3,-1.7 70,-2.8 69,-0.1 -1,-0.4 -0.501 61.7-121.7 -77.4 148.1 33.0 26.1 29.0 17 18 H S - 0 0 81 68,-0.2 2,-0.3 -2,-0.2 67,-0.2 -0.463 30.3-168.5 -84.3 159.4 30.8 23.1 29.7 18 19 H L E - B 0 83A 12 65,-2.3 65,-2.3 -2,-0.1 2,-0.4 -0.932 17.6-171.8-155.1 136.1 27.2 23.6 30.9 19 20 H K E - B 0 82A 104 -2,-0.3 2,-0.3 63,-0.2 63,-0.2 -0.985 12.4-173.1-128.7 118.5 24.3 21.6 32.3 20 21 H I E - B 0 81A 0 61,-2.9 61,-2.0 -2,-0.4 2,-0.3 -0.809 12.2-143.1-109.9 153.2 20.7 23.1 32.8 21 22 H S E - B 0 80A 33 -2,-0.3 -14,-1.9 59,-0.2 2,-0.3 -0.783 16.9-164.8-125.7 161.5 17.8 21.5 34.5 22 23 H a E -AB 6 79A 0 57,-1.9 57,-2.1 -2,-0.3 2,-0.5 -0.932 14.1-162.5-144.8 106.8 14.0 21.1 34.4 23 24 H K E -AB 5 78A 111 -18,-2.9 -18,-2.4 -2,-0.3 2,-0.3 -0.859 7.6-153.1 -98.7 129.8 12.1 19.8 37.4 24 25 H G E +A 4 0A 4 53,-2.8 2,-0.3 -2,-0.5 -20,-0.2 -0.717 19.9 162.1 -99.0 149.8 8.5 18.4 37.0 25 26 H S E +A 3 0A 55 -22,-1.6 -22,-2.4 -2,-0.3 3,-0.1 -0.967 50.3 47.1-156.8 160.6 5.7 18.3 39.7 26 27 H G S S+ 0 0 35 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.2 0.462 107.4 50.0 83.8 5.9 1.9 17.9 39.9 27 28 H Y S S- 0 0 41 -24,-0.1 2,-1.0 -26,-0.1 -1,-0.2 -0.931 102.4 -73.1-159.0 172.9 1.9 14.9 37.5 28 29 H S > - 0 0 61 -2,-0.3 3,-1.7 1,-0.2 4,-0.3 -0.709 40.0-164.2 -82.6 99.9 3.5 11.5 36.8 29 30 H F G > S+ 0 0 10 -2,-1.0 3,-0.6 1,-0.3 25,-0.2 0.737 86.5 53.9 -54.1 -35.7 6.9 12.5 35.5 30 31 H T G 3 S+ 0 0 57 1,-0.2 -1,-0.3 23,-0.2 24,-0.1 0.281 99.8 63.8 -86.7 5.2 7.6 9.0 34.1 31 32 H S G < S+ 0 0 53 -3,-1.7 2,-0.3 2,-0.1 70,-0.3 0.431 102.8 48.4-105.5 -5.2 4.3 9.0 32.1 32 33 H Y S < S- 0 0 62 -3,-0.6 22,-0.3 -4,-0.3 2,-0.1 -0.917 77.9-116.1-135.3 158.4 5.3 12.0 29.8 33 34 H W E -E 99 0B 42 66,-2.9 66,-2.4 -2,-0.3 2,-0.4 -0.444 21.2-138.1 -85.6 166.8 8.2 13.2 27.6 34 35 H I E -EF 98 51B 0 17,-2.4 17,-1.6 64,-0.2 2,-0.3 -0.996 18.6-160.7-125.6 123.2 10.2 16.3 28.2 35 36 H G E -EF 97 50B 0 62,-3.1 62,-1.7 -2,-0.4 2,-0.4 -0.712 8.1-146.0-101.6 156.3 11.2 18.5 25.2 36 37 H W E -EF 96 49B 0 13,-2.2 12,-2.8 -2,-0.3 13,-1.1 -0.992 17.0-174.1-123.7 128.0 13.9 21.1 24.9 37 38 H V E -EF 95 47B 0 58,-3.3 58,-2.8 -2,-0.4 2,-0.4 -0.979 10.1-152.3-126.1 132.8 13.3 24.2 22.8 38 39 H R E -EF 94 46B 32 8,-2.4 8,-1.9 -2,-0.4 2,-0.4 -0.868 8.1-173.0-106.1 141.2 15.9 26.9 21.9 39 40 H Q E -E 93 0B 26 54,-2.6 54,-2.1 -2,-0.4 6,-0.1 -0.888 13.8-153.4-136.4 101.4 14.9 30.5 21.1 40 41 H M > - 0 0 54 4,-0.5 3,-2.8 -2,-0.4 52,-0.2 -0.345 45.5 -70.9 -70.4 154.2 17.8 32.7 19.9 41 42 H P T 3 S- 0 0 92 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.289 121.4 -2.3 -54.2 126.9 17.5 36.5 20.5 42 43 H G T 3 S+ 0 0 88 1,-0.2 2,-0.2 -3,-0.1 -2,-0.1 0.557 116.2 113.5 67.9 13.5 14.9 37.9 18.2 43 44 H K < - 0 0 133 -3,-2.8 -1,-0.2 1,-0.2 2,-0.0 -0.542 64.5-106.1-112.5 175.2 14.3 34.4 16.7 44 45 H G - 0 0 26 -2,-0.2 -4,-0.5 1,-0.1 2,-0.3 -0.020 51.0 -65.5 -83.1-167.5 11.6 31.7 16.5 45 46 H L - 0 0 12 266,-0.4 2,-0.4 -6,-0.1 265,-0.2 -0.694 40.3-165.0 -92.5 135.8 11.3 28.3 18.2 46 47 H E E -F 38 0B 56 -8,-1.9 -8,-2.4 -2,-0.3 2,-0.6 -0.988 16.9-138.2-125.3 124.7 13.6 25.4 17.6 47 48 H W E +F 37 0B 15 -2,-0.4 -10,-0.2 261,-0.4 17,-0.1 -0.721 26.2 173.8 -82.3 114.6 12.9 21.8 18.6 48 49 H M E - 0 0 1 -12,-2.8 13,-2.5 -2,-0.6 2,-0.3 0.898 50.8 -60.8 -90.1 -51.9 16.1 20.4 20.0 49 50 H G E -FG 36 60B 0 -13,-1.1 -13,-2.2 11,-0.3 -1,-0.3 -0.972 39.0-119.9 176.0 173.4 15.1 17.0 21.3 50 51 H V E -FG 35 59B 6 9,-2.5 9,-2.3 -2,-0.3 2,-0.3 -0.913 12.1-164.7-132.6 153.8 12.9 14.9 23.7 51 52 H I E -FG 34 58B 1 -17,-1.6 -17,-2.4 -2,-0.3 7,-0.2 -0.991 17.6-144.2-138.6 138.7 13.5 12.4 26.5 52 53 H Y E >>> - G 0 57B 47 5,-2.4 4,-2.0 -2,-0.3 3,-1.4 -0.911 16.6-161.8 -98.2 98.5 11.0 9.9 28.0 53 54 H P T 345S+ 0 0 4 0, 0.0 21,-0.3 0, 0.0 -23,-0.2 0.756 81.5 72.7 -55.1 -25.4 12.2 10.0 31.7 54 55 H G T 345S+ 0 0 17 -22,-0.3 -24,-0.1 -25,-0.2 -23,-0.1 0.808 125.9 1.3 -56.1 -36.6 10.4 6.7 32.5 55 56 H D T <45S- 0 0 111 -3,-1.4 -1,-0.2 2,-0.1 -25,-0.0 0.294 99.6-111.9-136.9 5.0 13.1 4.7 30.5 56 57 H S T <5 + 0 0 63 -4,-2.0 2,-0.4 1,-0.2 16,-0.1 0.680 53.3 166.7 65.8 25.6 15.5 7.4 29.3 57 58 H Y E < -G 52 0B 142 -5,-0.9 -5,-2.4 14,-0.0 2,-0.4 -0.578 15.6-169.7 -69.0 124.3 14.6 7.1 25.6 58 59 H T E -G 51 0B 47 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -0.973 16.9-177.3-130.4 135.9 16.0 10.2 23.8 59 60 H R E -G 50 0B 96 -9,-2.3 -9,-2.5 -2,-0.4 2,-0.4 -0.994 7.9-162.2-131.4 129.6 15.6 11.6 20.3 60 61 H Y E -G 49 0B 46 -2,-0.4 -11,-0.3 -11,-0.2 5,-0.1 -0.926 24.9-116.8-113.2 143.5 17.4 14.6 18.9 61 62 H S >> - 0 0 4 -13,-2.5 3,-1.8 -2,-0.4 4,-1.4 -0.428 40.5-100.5 -72.8 152.5 16.3 16.6 15.8 62 63 H P T 34 S+ 0 0 56 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.855 121.8 50.2 -44.0 -47.0 18.8 16.4 12.9 63 64 H S T 34 S+ 0 0 85 1,-0.2 -15,-0.1 3,-0.0 -2,-0.0 0.678 116.0 43.6 -68.9 -15.1 20.4 19.9 13.6 64 65 H F T X> S+ 0 0 10 -3,-1.8 3,-2.0 -16,-0.2 4,-0.9 0.604 81.1 118.7-105.1 -12.1 20.9 19.0 17.3 65 66 H Q T 3< S+ 0 0 91 -4,-1.4 4,-0.1 -3,-0.5 -16,-0.0 -0.295 91.6 1.5 -58.2 128.2 22.2 15.4 17.0 66 67 H G T 34 S+ 0 0 78 2,-0.4 -1,-0.3 1,-0.1 3,-0.1 0.460 116.6 85.9 69.0 5.8 25.8 15.2 18.5 67 68 H Q T <4 S+ 0 0 112 -3,-2.0 2,-0.3 1,-0.3 17,-0.2 0.657 97.4 15.8-102.1 -24.3 25.7 19.0 19.5 68 69 H V < - 0 0 8 -4,-0.9 2,-0.4 15,-0.1 -2,-0.4 -0.936 68.0-131.2-151.9 154.2 23.9 18.6 22.9 69 70 H T E -C 82 0A 71 13,-2.1 13,-1.9 -2,-0.3 2,-0.4 -0.989 16.2-163.9-119.3 126.1 23.1 15.8 25.5 70 71 H I E +C 81 0A 4 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.902 22.0 156.5-110.6 133.5 19.6 15.4 26.9 71 72 H S E -C 80 0A 32 9,-1.7 9,-3.5 -2,-0.4 2,-0.3 -0.934 24.0-147.7-150.1 170.6 19.2 13.3 30.0 72 73 H A E -C 79 0A 20 -2,-0.3 2,-0.4 7,-0.3 7,-0.3 -0.978 12.2-156.0-144.4 153.3 17.0 12.7 33.0 73 74 H D E > > -C 78 0A 63 5,-3.2 5,-2.1 -2,-0.3 3,-1.2 -0.906 14.4-173.9-126.3 96.4 17.1 11.6 36.7 74 75 H K G > 5S+ 0 0 115 -2,-0.4 3,-0.9 -21,-0.3 -45,-0.1 0.713 77.0 71.1 -66.8 -20.9 13.7 10.2 37.5 75 76 H S G 3 5S+ 0 0 100 1,-0.2 -1,-0.2 3,-0.1 0, 0.0 0.701 114.3 27.9 -68.1 -19.3 14.4 9.8 41.2 76 77 H I G < 5S- 0 0 74 -3,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.111 109.9-116.9-124.9 15.7 14.3 13.6 41.5 77 78 H S T < 5 + 0 0 39 -3,-0.9 -53,-2.8 1,-0.2 2,-0.4 0.840 69.2 139.6 47.8 43.7 11.8 14.3 38.5 78 79 H T E < -BC 23 73A 9 -5,-2.1 -5,-3.2 -55,-0.2 2,-0.3 -0.936 36.2-169.4-121.2 137.1 14.6 16.3 36.7 79 80 H A E -BC 22 72A 0 -57,-2.1 -57,-1.9 -2,-0.4 2,-0.3 -0.887 16.5-152.1-118.5 151.0 15.6 16.4 32.9 80 81 H Y E -BC 21 71A 39 -9,-3.5 -9,-1.7 -2,-0.3 2,-0.4 -0.905 17.0-161.0-129.5 156.3 18.8 18.0 31.7 81 82 H L E +BC 20 70A 0 -61,-2.0 -61,-2.9 -2,-0.3 2,-0.3 -0.993 27.2 178.5-133.0 127.1 20.2 19.8 28.6 82 83 H Q E -BC 19 69A 61 -13,-1.9 -13,-2.1 -2,-0.4 2,-0.4 -0.975 24.1-159.0-140.6 153.1 24.0 20.0 28.4 83 84 H W E -B 18 0A 9 -65,-2.3 -65,-2.3 -2,-0.3 3,-0.2 -0.982 10.5-156.7-126.7 136.4 26.9 21.2 26.2 84 85 H S S S+ 0 0 110 -2,-0.4 2,-0.2 1,-0.2 -1,-0.1 0.774 91.6 16.5 -82.8 -28.4 30.4 19.9 26.4 85 86 H S S S- 0 0 58 -68,-0.1 -1,-0.2 -67,-0.1 -68,-0.2 -0.743 80.0-144.2-151.1 96.7 31.8 23.1 24.8 86 87 H L - 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