==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM/TRANSPORT PROTEIN 09-APR-05 2BOB . COMPND 2 MOLECULE: ANTIBODY FAB FRAGMENT HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.J.LENAEUS,M.VAMVOUKA,P.J.FOCIA,A.GROSS . 534 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25003.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 349 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 166 31.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 4 0.7 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 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.3 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 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 2 6 5 3 3 7 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 1 4 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 1 A Q 0 0 174 0, 0.0 2,-0.3 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 169.5 198.9 202.0 21.4 2 2 A V - 0 0 99 1,-0.1 3,-0.1 22,-0.0 107,-0.1 -0.588 360.0-168.6 -74.1 139.6 198.5 205.3 19.3 3 3 A Q + 0 0 42 -2,-0.3 22,-1.0 1,-0.2 2,-0.5 0.783 66.0 44.4-108.2 -35.5 199.3 208.3 21.4 4 4 A L E -A 24 0A 6 104,-0.3 2,-0.6 20,-0.2 106,-0.4 -0.973 66.7-164.3-116.6 126.0 198.2 211.4 19.5 5 5 A Q E +A 23 0A 113 18,-1.9 18,-2.3 -2,-0.5 104,-0.1 -0.936 11.8 173.1-114.8 113.0 194.8 211.3 17.8 6 6 A Q - 0 0 24 -2,-0.6 16,-0.1 16,-0.2 104,-0.1 -0.933 38.1-105.0-114.0 141.8 193.9 213.9 15.2 7 7 A P - 0 0 44 0, 0.0 106,-0.1 0, 0.0 3,-0.1 -0.335 31.4-123.8 -51.6 142.1 190.8 214.0 13.0 8 8 A G S S- 0 0 32 104,-0.2 105,-2.7 1,-0.1 2,-0.3 0.886 77.5 -6.2 -60.6 -44.1 191.5 212.9 9.5 9 9 A A E -d 113 0B 10 103,-0.3 2,-0.3 196,-0.1 105,-0.2 -0.960 46.4-160.0-152.6 164.3 190.2 216.0 7.7 10 10 A E E -d 114 0B 63 103,-2.0 105,-2.2 -2,-0.3 2,-0.4 -0.851 11.5-153.4-151.5 114.7 188.5 219.4 7.8 11 11 A L E -d 115 0B 48 -2,-0.3 2,-0.3 103,-0.2 105,-0.2 -0.728 22.7-177.1 -82.2 136.5 186.9 221.3 5.0 12 12 A V E -d 116 0B 8 103,-2.5 105,-1.5 -2,-0.4 3,-0.1 -0.985 22.0-127.4-137.4 144.4 186.9 225.1 5.6 13 13 A K > - 0 0 88 -2,-0.3 3,-2.4 103,-0.2 73,-0.3 -0.689 44.8 -85.6 -89.3 143.1 185.5 228.0 3.6 14 14 A P T 3 S+ 0 0 79 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.221 120.4 15.3 -42.8 128.8 187.7 231.0 2.6 15 15 A G T 3 S+ 0 0 47 71,-2.5 70,-0.6 1,-0.3 72,-0.1 -0.008 105.2 112.8 88.1 -30.1 187.6 233.4 5.6 16 16 A A < - 0 0 39 -3,-2.4 70,-1.9 69,-0.2 2,-0.3 0.002 58.6-136.6 -62.2 177.2 186.2 230.7 7.9 17 17 A S - 0 0 65 67,-0.2 2,-0.3 68,-0.2 67,-0.2 -0.999 12.1-160.6-143.5 142.7 188.2 229.3 10.8 18 18 A V E - B 0 83A 14 65,-1.8 65,-1.5 -2,-0.3 2,-0.5 -0.850 12.1-143.6-123.9 157.3 188.6 225.7 12.0 19 19 A K E - B 0 82A 115 -2,-0.3 63,-0.2 63,-0.2 2,-0.2 -0.943 19.7-160.1-123.8 102.0 189.8 224.3 15.4 20 20 A L E - B 0 81A 2 61,-2.4 61,-1.9 -2,-0.5 2,-0.3 -0.529 8.8-148.1 -81.4 154.6 191.9 221.1 15.0 21 21 A S E - B 0 80A 33 59,-0.2 2,-0.3 -2,-0.2 59,-0.2 -0.811 15.0-167.2-124.0 163.4 192.3 218.8 17.9 22 22 A a E - B 0 79A 2 57,-0.9 57,-2.6 -2,-0.3 2,-0.5 -0.825 12.7-158.3-156.3 104.0 195.0 216.5 19.1 23 23 A K E -AB 5 78A 84 -18,-2.3 -18,-1.9 -2,-0.3 55,-0.2 -0.781 12.7-151.2-102.4 121.8 194.1 214.0 21.8 24 24 A A E +A 4 0A 13 53,-2.9 2,-0.3 -2,-0.5 -20,-0.2 -0.541 20.2 164.0 -99.2 154.7 196.9 212.6 23.9 25 25 A S + 0 0 45 -22,-1.0 2,-0.1 -2,-0.2 52,-0.0 -0.951 40.3 49.1-157.1 173.1 197.5 209.3 25.8 26 26 A G S S+ 0 0 34 -2,-0.3 2,-0.2 2,-0.0 -24,-0.0 -0.458 104.5 5.7 81.6-166.2 200.3 207.3 27.3 27 27 A Y - 0 0 178 -2,-0.1 2,-0.4 1,-0.0 -2,-0.1 -0.288 69.0-166.0 -56.7 111.4 202.8 208.9 29.7 28 28 A T - 0 0 93 -2,-0.2 2,-0.3 -4,-0.1 -1,-0.0 -0.832 7.9-179.6 -89.0 137.5 201.8 212.4 30.5 29 29 A F > - 0 0 97 -2,-0.4 3,-1.2 1,-0.0 25,-0.2 -0.946 34.9-132.5-124.8 153.3 204.3 214.7 32.2 30 30 A T T 3 S+ 0 0 88 -2,-0.3 24,-0.2 1,-0.3 -1,-0.0 0.630 111.4 65.4 -73.5 -16.1 203.6 218.3 33.2 31 31 A S T 3 S+ 0 0 31 22,-0.1 2,-0.3 69,-0.1 -1,-0.3 0.349 81.1 118.3 -80.5 3.7 207.0 218.9 31.5 32 32 A D < - 0 0 8 -3,-1.2 22,-0.4 68,-0.1 2,-0.4 -0.550 47.3-163.0 -76.7 136.0 205.4 217.8 28.2 33 33 A W E -E 99 0B 0 66,-3.1 66,-2.6 -2,-0.3 2,-0.4 -0.916 6.9-149.5-110.6 145.0 205.1 220.2 25.2 34 34 A I E -EF 98 51B 12 17,-2.7 17,-1.9 -2,-0.4 2,-0.3 -0.964 16.7-163.1-112.1 131.5 202.8 219.7 22.3 35 35 A H E -EF 97 50B 0 62,-2.2 62,-2.0 -2,-0.4 2,-0.4 -0.770 10.2-146.1-114.4 159.2 203.9 221.0 18.9 36 36 A W E -EF 96 49B 1 13,-2.0 12,-2.6 -2,-0.3 13,-1.0 -0.990 14.6-170.1-128.9 128.1 202.1 221.7 15.6 37 37 A V E -EF 95 47B 0 58,-3.0 58,-3.0 -2,-0.4 2,-0.4 -0.965 10.2-147.5-127.4 133.2 203.7 221.3 12.2 38 38 A K E -EF 94 46B 25 8,-2.8 8,-1.2 -2,-0.4 2,-0.4 -0.811 13.5-178.7-102.6 133.4 202.4 222.3 8.8 39 39 A Q E -EF 93 45B 18 54,-2.3 54,-2.7 -2,-0.4 6,-0.1 -0.911 11.6-157.5-135.1 105.2 203.1 220.4 5.6 40 40 A R - 0 0 70 4,-0.5 2,-0.3 -2,-0.4 3,-0.3 -0.561 45.8 -85.7 -74.6 147.9 201.8 221.6 2.2 41 41 A P S S+ 0 0 115 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.393 117.0 6.8 -62.7 114.4 201.5 218.9 -0.4 42 42 A G S S+ 0 0 83 1,-0.5 -2,-0.0 -2,-0.3 0, 0.0 -0.374 114.9 91.2 106.7 -50.8 205.0 218.7 -2.0 43 43 A H S S- 0 0 133 -3,-0.3 -1,-0.5 -2,-0.2 2,-0.1 -0.060 74.9-115.8 -64.1 173.9 206.7 221.1 0.4 44 44 A G - 0 0 24 1,-0.2 -4,-0.5 -3,-0.1 2,-0.2 -0.073 45.9 -47.8 -98.9-156.5 208.4 219.9 3.6 45 45 A L E -F 39 0B 15 274,-0.3 2,-0.4 -6,-0.1 -6,-0.2 -0.504 44.5-172.7 -88.1 144.8 207.8 220.5 7.4 46 46 A E E -F 38 0B 60 -8,-1.2 -8,-2.8 -2,-0.2 2,-0.2 -0.952 21.3-131.9-143.0 116.2 207.2 223.8 9.0 47 47 A W E +F 37 0B 6 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.456 25.1 175.2 -68.7 131.2 207.1 224.5 12.7 48 48 A I E - 0 0 15 -12,-2.6 13,-3.8 1,-0.4 2,-0.3 0.826 51.6 -59.9-102.0 -51.5 204.0 226.6 13.7 49 49 A G E -FG 36 60B 0 -13,-1.0 -13,-2.0 11,-0.3 -1,-0.4 -0.984 40.1-121.5 176.5 178.4 204.1 226.7 17.5 50 50 A E E -FG 35 59B 0 9,-2.6 9,-2.1 -2,-0.3 2,-0.3 -0.928 10.8-164.6-140.9 156.8 204.1 225.0 20.8 51 51 A I E -FG 34 58B 1 -17,-1.9 -17,-2.7 -2,-0.3 7,-0.2 -0.995 18.3-145.5-142.3 144.6 202.2 224.8 24.0 52 52 A I E >>> - G 0 57B 0 5,-2.1 4,-2.5 -2,-0.3 5,-0.7 -0.947 20.4-161.9-103.7 104.8 202.9 223.4 27.5 53 53 A P T 345S+ 0 0 37 0, 0.0 2,-1.7 0, 0.0 21,-0.2 0.873 81.7 67.3 -60.6 -39.8 199.4 222.3 28.4 54 54 A S T 345S+ 0 0 30 -22,-0.4 -24,-0.1 1,-0.2 -21,-0.0 0.029 123.4 16.7 -70.3 35.9 200.0 222.0 32.2 55 55 A Y T <45S- 0 0 154 -2,-1.7 -1,-0.2 -3,-0.6 3,-0.1 0.254 97.1-125.7-179.3 -32.2 200.4 225.9 32.1 56 56 A G T <5 + 0 0 43 -4,-2.5 2,-0.4 1,-0.3 -2,-0.1 0.510 54.7 148.9 84.9 5.7 198.8 227.1 28.9 57 57 A R E < -G 52 0B 91 -5,-0.7 -5,-2.1 14,-0.0 2,-0.4 -0.613 24.9-171.7 -78.5 125.1 201.9 229.0 27.7 58 58 A A E -G 51 0B 20 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.960 11.2-166.2-121.5 138.7 202.1 229.0 23.9 59 59 A N E -G 50 0B 12 -9,-2.1 -9,-2.6 -2,-0.4 2,-0.4 -0.930 12.4-152.0-120.6 150.2 204.9 230.2 21.6 60 60 A Y E -G 49 0B 50 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.3 -0.917 27.9-102.1-128.1 143.6 204.6 230.7 17.9 61 61 A N > - 0 0 19 -13,-3.8 3,-0.5 -2,-0.4 -12,-0.0 -0.513 35.3-169.4 -53.6 108.2 206.7 230.7 14.8 62 62 A E T 3 S+ 0 0 119 -2,-0.6 -1,-0.2 1,-0.2 4,-0.1 0.656 72.7 76.9 -81.5 -19.0 207.2 234.5 14.3 63 63 A K T 3 S+ 0 0 149 2,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.698 96.3 54.5 -63.9 -20.9 208.8 234.2 10.8 64 64 A I S < S- 0 0 57 -3,-0.5 2,-0.1 -16,-0.1 3,-0.0 -0.803 101.7 -80.3-120.1 160.3 205.3 233.5 9.3 65 65 A Q - 0 0 150 -2,-0.3 2,-0.9 1,-0.1 3,-0.2 -0.307 52.5-116.7 -54.5 122.5 201.8 235.2 9.3 66 66 A K + 0 0 118 1,-0.2 -1,-0.1 -4,-0.1 -4,-0.1 -0.567 57.0 145.1 -71.7 103.8 200.1 234.3 12.5 67 67 A K + 0 0 36 -2,-0.9 17,-1.6 16,-0.0 2,-0.2 0.525 52.1 81.7-103.4 -16.9 197.0 232.3 11.7 68 68 A A - 0 0 4 15,-0.2 2,-0.4 -3,-0.2 15,-0.2 -0.630 48.4-172.2-104.9 151.7 197.1 230.0 14.8 69 69 A T - 0 0 59 13,-0.4 13,-1.9 -2,-0.2 2,-0.4 -0.972 19.0-148.9-136.1 121.3 196.1 230.1 18.4 70 70 A L E +C 81 0A 9 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.731 26.0 153.5 -98.8 139.0 197.1 227.3 20.8 71 71 A T E -C 80 0A 58 9,-1.7 9,-2.9 -2,-0.4 2,-0.3 -0.949 19.1-158.8-149.8 161.9 195.1 226.1 23.8 72 72 A A E -C 79 0A 35 -2,-0.3 2,-0.6 7,-0.3 7,-0.2 -0.969 17.5-136.4-144.9 161.5 194.8 222.9 25.7 73 73 A D E >> -C 78 0A 70 5,-2.1 5,-1.4 -2,-0.3 4,-0.8 -0.957 14.7-158.8-122.5 105.3 192.4 221.2 28.0 74 74 A K T 45S+ 0 0 156 -2,-0.6 -1,-0.1 1,-0.2 -20,-0.1 0.806 86.8 51.2 -55.3 -35.3 194.3 219.7 30.9 75 75 A S T 45S+ 0 0 110 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.901 117.5 33.8 -77.7 -46.8 191.5 217.2 31.8 76 76 A S T 45S- 0 0 40 2,-0.1 -52,-0.2 -3,-0.1 -1,-0.2 0.437 103.3-132.4 -82.4 0.2 190.8 215.6 28.4 77 77 A S T <5 + 0 0 41 -4,-0.8 -53,-2.9 1,-0.2 2,-0.4 0.922 57.4 143.6 38.4 58.0 194.6 216.0 27.6 78 78 A T E < -BC 23 73A 12 -5,-1.4 -5,-2.1 -55,-0.2 2,-0.4 -0.989 41.2-150.5-125.1 130.7 193.7 217.5 24.3 79 79 A A E -BC 22 72A 3 -57,-2.6 -57,-0.9 -2,-0.4 2,-0.5 -0.837 12.2-156.0-100.2 137.3 195.5 220.3 22.5 80 80 A F E -BC 21 71A 46 -9,-2.9 -9,-1.7 -2,-0.4 2,-0.5 -0.941 7.8-162.6-116.8 128.3 193.6 222.6 20.1 81 81 A M E -BC 20 70A 0 -61,-1.9 -61,-2.4 -2,-0.5 2,-0.7 -0.956 9.9-157.0-105.4 132.5 195.0 224.6 17.3 82 82 A Q E -B 19 0A 48 -13,-1.9 2,-0.4 -2,-0.5 -13,-0.4 -0.865 9.6-172.6-113.6 92.3 192.7 227.4 16.1 83 83 A L E -B 18 0A 5 -65,-1.5 -65,-1.8 -2,-0.7 2,-0.3 -0.767 15.2-172.5 -85.3 132.8 193.5 228.3 12.5 84 84 A S + 0 0 46 -17,-1.6 -67,-0.2 -2,-0.4 -68,-0.1 -0.912 48.9 13.0-137.5 158.5 191.5 231.4 11.4 85 85 A S S S- 0 0 82 -70,-0.6 -1,-0.2 -2,-0.3 -68,-0.2 0.941 84.2-170.7 41.6 62.3 190.7 233.6 8.4 86 86 A L - 0 0 3 -70,-1.9 -71,-2.5 -73,-0.3 2,-0.2 -0.323 19.0-175.3 -84.3 158.0 192.1 230.9 6.1 87 87 A T > - 0 0 60 -73,-0.2 3,-2.3 -72,-0.1 4,-0.2 -0.791 51.6 -82.1-135.8-178.8 192.9 231.0 2.4 88 88 A S G > S+ 0 0 81 1,-0.3 3,-1.9 -2,-0.2 28,-0.1 0.823 124.8 71.3 -57.5 -34.6 194.2 228.4 -0.1 89 89 A E G 3 S+ 0 0 120 1,-0.2 -1,-0.3 -49,-0.0 -3,-0.0 0.783 95.3 53.8 -44.0 -33.9 197.6 229.2 1.2 90 90 A D G < S+ 0 0 8 -3,-2.3 2,-0.5 2,-0.0 -1,-0.2 0.443 74.8 116.9 -92.3 -1.0 196.6 227.4 4.4 91 91 A S < + 0 0 26 -3,-1.9 2,-0.3 -4,-0.2 24,-0.2 -0.584 47.5 108.6 -67.8 120.4 195.5 224.1 2.8 92 92 A A E S- H 0 114B 6 22,-1.5 22,-2.3 -2,-0.5 2,-0.5 -0.970 73.5 -81.7-173.9 170.9 197.9 221.5 4.2 93 93 A V E -EH 39 113B 32 -54,-2.7 -54,-2.3 -2,-0.3 2,-0.6 -0.879 40.7-154.3 -90.4 131.9 198.4 218.5 6.5 94 94 A Y E -EH 38 112B 4 18,-2.0 18,-1.5 -2,-0.5 2,-0.3 -0.944 10.4-167.8-111.0 113.8 198.8 219.7 10.1 95 95 A Y E -E 37 0B 12 -58,-3.0 -58,-3.0 -2,-0.6 2,-0.4 -0.698 7.4-156.4 -91.3 149.6 200.7 217.3 12.4 96 96 A a E -E 36 0B 0 -2,-0.3 13,-3.7 -60,-0.2 2,-0.3 -0.947 17.4-178.8-117.4 147.6 200.8 217.6 16.2 97 97 A A E -EI 35 108B 0 -62,-2.0 -62,-2.2 -2,-0.4 2,-0.4 -0.878 21.9-122.4-136.9 168.1 203.7 216.0 18.0 98 98 A R E -EI 34 107B 3 9,-2.1 8,-1.0 -2,-0.3 9,-0.8 -0.980 20.4-174.4-123.7 134.6 204.9 215.5 21.6 99 99 A E E -E 33 0B 0 -66,-2.6 -66,-3.1 -2,-0.4 6,-0.1 -0.975 22.4-146.6-125.8 132.1 208.2 216.7 23.0 100 100 A R - 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