==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN/METAL TRANSPORT 18-NOV-08 3FB7 . COMPND 2 MOLECULE: ANTIBODY FAB FRAGMENT HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR L.G.CUELLO,V.JOGINI,D.M CORTES,A.C.PAN,D.H.GAGNON,J.F.CORDER . 520 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23635.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 341 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 169 32.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.0 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 0.8 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 . 51 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 1 0 0 0 0 0 0 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 . 7 3 8 2 3 5 3 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 3 3 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 A Q 0 0 176 0, 0.0 2,-0.1 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 151.1 47.8 -44.8 21.3 2 2 A V - 0 0 104 1,-0.1 3,-0.1 24,-0.0 24,-0.1 -0.271 360.0-165.8 -53.8 122.6 50.9 -44.4 19.2 3 3 A Q + 0 0 64 1,-0.2 2,-0.5 105,-0.1 22,-0.3 0.783 67.1 41.9 -84.6 -35.0 54.0 -45.4 21.2 4 4 A L - 0 0 5 104,-0.3 2,-0.6 20,-0.2 106,-0.6 -0.964 66.3-161.9-122.1 120.2 57.1 -44.1 19.2 5 5 A Q B +A 23 0A 87 18,-2.4 18,-1.7 -2,-0.5 104,-0.1 -0.874 12.3 176.9-106.9 115.1 57.0 -40.6 17.6 6 6 A Q - 0 0 19 -2,-0.6 2,-0.2 16,-0.2 16,-0.1 -0.947 37.1-106.2-119.5 138.3 59.5 -39.8 14.9 7 7 A P - 0 0 41 0, 0.0 106,-0.1 0, 0.0 14,-0.1 -0.380 29.5-133.1 -58.8 120.5 59.8 -36.6 12.9 8 8 A G S S+ 0 0 31 104,-0.2 105,-2.9 -2,-0.2 2,-0.3 0.819 77.3 8.6 -46.7 -40.7 58.6 -37.4 9.4 9 9 A A E -d 113 0B 9 103,-0.2 2,-0.3 196,-0.1 105,-0.2 -0.954 49.0-175.4-146.0 165.0 61.5 -35.8 7.6 10 10 A E E -d 114 0B 68 103,-1.3 105,-1.7 -2,-0.3 2,-0.3 -0.822 15.5-151.9-161.5 116.5 65.0 -34.2 7.9 11 11 A L E -d 115 0B 48 -2,-0.3 2,-0.3 103,-0.2 105,-0.2 -0.666 18.2-179.0 -91.4 146.2 67.0 -32.6 5.1 12 12 A V E -d 116 0B 9 103,-2.3 105,-1.2 -2,-0.3 3,-0.1 -0.983 23.0-133.1-150.7 135.6 70.8 -32.6 5.3 13 13 A K > - 0 0 117 -2,-0.3 3,-3.1 103,-0.2 73,-0.3 -0.675 48.8 -84.3 -87.3 138.8 73.7 -31.3 3.2 14 14 A P T 3 S+ 0 0 74 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.084 119.0 20.5 -43.4 131.8 76.6 -33.6 2.5 15 15 A G T 3 S+ 0 0 50 71,-2.5 70,-0.5 1,-0.4 72,-0.1 0.094 104.8 109.4 93.1 -21.4 79.1 -33.5 5.3 16 16 A A < - 0 0 41 -3,-3.1 70,-2.3 70,-0.2 -1,-0.4 -0.133 59.0-136.2 -77.6 178.9 76.5 -32.1 7.6 17 17 A S - 0 0 63 67,-0.2 2,-0.3 68,-0.2 67,-0.2 -1.000 11.2-162.9-144.3 141.8 74.9 -34.0 10.6 18 18 A V E - B 0 83A 12 65,-1.5 65,-2.9 -2,-0.3 2,-0.7 -0.921 14.4-142.7-123.7 148.6 71.4 -34.4 12.0 19 19 A K E - B 0 82A 103 -2,-0.3 63,-0.3 63,-0.2 -2,-0.0 -0.881 23.1-159.1-112.8 98.4 70.2 -35.6 15.3 20 20 A L E - B 0 81A 2 61,-2.2 61,-1.3 -2,-0.7 2,-0.3 -0.204 8.5-152.3 -70.2 166.6 67.1 -37.7 14.9 21 21 A S E - B 0 80A 34 59,-0.2 2,-0.2 -14,-0.1 59,-0.2 -0.815 18.7-169.2-136.1 175.9 64.7 -38.3 17.8 22 22 A a E - B 0 79A 3 57,-0.6 57,-2.8 -2,-0.3 2,-0.5 -0.694 12.3-160.2-170.3 104.9 62.1 -40.8 19.0 23 23 A K E -AB 5 78A 99 -18,-1.7 -18,-2.4 55,-0.2 55,-0.2 -0.854 14.6-148.3-100.8 131.4 59.8 -40.0 21.9 24 24 A A + 0 0 26 53,-3.5 2,-0.3 -2,-0.5 -20,-0.2 -0.223 20.2 167.1 -89.0 178.0 58.2 -42.8 23.8 25 25 A S + 0 0 40 -22,-0.3 2,-0.3 2,-0.2 52,-0.0 -0.932 43.3 49.4-178.8 165.5 54.9 -43.4 25.6 26 26 A G S S+ 0 0 45 -2,-0.3 2,-0.2 -24,-0.1 -24,-0.0 -0.679 105.0 1.8 90.1-149.9 52.8 -46.2 27.1 27 27 A Y - 0 0 187 -2,-0.3 2,-0.3 -3,-0.0 -2,-0.2 -0.477 67.4-174.8 -75.3 142.6 54.5 -48.7 29.3 28 28 A T + 0 0 79 -2,-0.2 2,-0.3 -4,-0.1 -2,-0.0 -0.999 4.9 174.8-139.2 141.1 58.2 -48.3 30.2 29 29 A F > - 0 0 111 -2,-0.3 3,-0.7 1,-0.0 25,-0.2 -0.817 44.1-111.5-135.6 175.9 60.7 -50.5 32.1 30 30 A T T 3 S+ 0 0 78 -2,-0.3 24,-0.1 1,-0.2 -1,-0.0 0.504 114.7 64.2 -88.4 -3.8 64.4 -50.5 33.0 31 31 A S T 3 S+ 0 0 31 22,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.341 78.9 120.3 -97.6 6.3 64.7 -53.6 30.7 32 32 A D < - 0 0 13 -3,-0.7 22,-0.4 68,-0.1 2,-0.4 -0.552 42.3-167.9 -81.7 135.1 63.8 -51.6 27.6 33 33 A W E -E 99 0B 0 66,-2.8 66,-3.2 -2,-0.3 2,-0.5 -0.966 9.2-151.4-119.8 133.8 66.1 -51.2 24.6 34 34 A I E -EF 98 51B 16 17,-2.3 17,-1.5 -2,-0.4 2,-0.2 -0.930 18.3-167.0-106.7 124.6 65.5 -48.8 21.8 35 35 A H E -EF 97 50B 0 62,-1.9 62,-1.6 -2,-0.5 2,-0.4 -0.715 11.5-143.7-109.7 161.7 66.9 -49.8 18.4 36 36 A W E -EF 96 49B 1 13,-1.8 12,-2.5 -2,-0.2 13,-0.8 -0.987 12.7-167.3-128.8 128.7 67.5 -47.9 15.2 37 37 A V E -EF 95 47B 1 58,-3.2 58,-2.7 -2,-0.4 2,-0.2 -0.961 7.8-151.5-124.5 126.7 67.0 -49.4 11.7 38 38 A K E -EF 94 46B 26 8,-2.7 8,-2.4 -2,-0.5 2,-0.3 -0.620 14.5-179.6 -89.5 145.5 68.1 -48.0 8.4 39 39 A Q E -E 93 0B 21 54,-1.4 54,-2.5 -2,-0.2 6,-0.1 -0.800 12.5-156.9-153.0 106.9 66.3 -48.7 5.2 40 40 A R > - 0 0 89 4,-0.5 3,-1.0 -2,-0.3 52,-0.1 -0.539 45.8 -82.7 -80.0 147.0 67.2 -47.4 1.8 41 41 A P T 3 S+ 0 0 111 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.212 115.5 10.0 -52.6 134.4 64.4 -47.3 -0.8 42 42 A G T 3 S+ 0 0 85 1,-0.2 2,-0.1 -3,-0.1 -2,-0.0 -0.211 114.6 88.5 90.7 -43.6 63.9 -50.6 -2.4 43 43 A H S < S- 0 0 125 -3,-1.0 -1,-0.2 -2,-0.5 278,-0.0 -0.284 75.4-104.2 -85.8 171.5 66.2 -52.5 -0.0 44 44 A G - 0 0 25 1,-0.2 -4,-0.5 276,-0.1 2,-0.2 0.039 47.6 -57.3 -84.1-166.8 65.5 -54.2 3.3 45 45 A L - 0 0 14 274,-0.3 2,-0.4 -6,-0.1 -6,-0.2 -0.493 41.2-166.8 -79.2 137.5 66.1 -53.4 7.0 46 46 A E E -F 38 0B 76 -8,-2.4 -8,-2.7 -2,-0.2 271,-0.1 -0.939 18.3-134.6-130.3 110.5 69.5 -52.8 8.5 47 47 A W E +F 37 0B 9 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.359 24.8 177.4 -58.9 135.4 70.1 -52.8 12.3 48 48 A I E - 0 0 13 -12,-2.5 13,-2.7 1,-0.4 2,-0.3 0.783 51.2 -52.9-109.6 -45.9 72.3 -49.8 13.2 49 49 A G E -FG 36 60B 0 -13,-0.8 -13,-1.8 11,-0.3 -1,-0.4 -0.978 43.8-127.8-178.5 179.9 72.6 -49.9 17.0 50 50 A E E -FG 35 59B 0 9,-2.7 9,-1.4 -2,-0.3 2,-0.3 -0.961 12.0-164.2-146.4 161.6 70.8 -50.1 20.3 51 51 A I E -FG 34 58B 1 -17,-1.5 -17,-2.3 -2,-0.3 7,-0.2 -0.998 17.0-145.5-150.3 148.0 70.7 -48.3 23.6 52 52 A I E >>> - G 0 57B 0 5,-2.3 4,-4.6 -2,-0.3 3,-1.1 -0.860 13.2-169.0-115.1 93.9 69.4 -49.0 27.2 53 53 A P T 345S+ 0 0 30 0, 0.0 21,-0.2 0, 0.0 2,-0.2 0.819 82.5 67.9 -50.8 -37.8 68.1 -45.6 28.5 54 54 A S T 345S+ 0 0 30 -22,-0.4 -24,-0.1 1,-0.2 -21,-0.0 0.094 126.6 10.7 -74.2 26.6 67.8 -47.0 32.1 55 55 A Y T <45S- 0 0 147 -3,-1.1 -1,-0.2 -2,-0.2 -25,-0.0 0.155 98.6-126.8-168.5 -36.9 71.6 -47.2 32.0 56 56 A G T <5 + 0 0 42 -4,-4.6 2,-0.1 1,-0.3 16,-0.1 0.338 56.0 141.5 95.0 -7.1 72.6 -45.3 28.9 57 57 A R E < -G 52 0B 95 -5,-0.5 -5,-2.3 -6,-0.1 2,-0.4 -0.422 26.9-172.0 -74.3 144.8 74.8 -47.9 27.3 58 58 A A E -G 51 0B 23 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.993 11.4-165.1-139.4 144.4 74.8 -48.4 23.5 59 59 A N E -G 50 0B 11 -9,-1.4 -9,-2.7 -2,-0.4 2,-0.3 -0.920 14.0-150.9-124.8 149.0 76.2 -50.8 21.1 60 60 A Y E -G 49 0B 47 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.3 -0.905 28.3 -93.6-125.9 153.8 76.5 -50.4 17.3 61 61 A N - 0 0 20 -13,-2.7 -12,-0.0 -2,-0.3 0, 0.0 -0.469 32.1-161.7 -64.3 116.9 76.6 -52.6 14.2 62 62 A E S S+ 0 0 137 -2,-0.4 -1,-0.2 1,-0.2 4,-0.1 0.557 80.6 66.2 -79.9 -11.0 80.3 -53.3 13.5 63 63 A K S S+ 0 0 161 2,-0.1 -1,-0.2 0, 0.0 3,-0.1 0.970 98.7 55.4 -72.4 -55.7 79.8 -54.4 9.9 64 64 A I S S- 0 0 41 1,-0.1 2,-0.3 -16,-0.1 -4,-0.0 -0.236 103.1 -90.3 -73.2 163.1 78.6 -51.0 8.6 65 65 A Q - 0 0 157 1,-0.1 2,-0.7 2,-0.0 -1,-0.1 -0.584 45.6-110.8 -76.7 135.5 80.6 -47.8 9.1 66 66 A K + 0 0 112 -2,-0.3 -1,-0.1 1,-0.2 -4,-0.0 -0.547 55.5 148.7 -73.3 113.6 79.8 -46.0 12.3 67 67 A K + 0 0 67 -2,-0.7 17,-1.7 16,-0.0 2,-0.3 0.170 54.3 72.5-125.0 11.2 78.0 -42.8 11.4 68 68 A A E -C 83 0A 4 15,-0.2 2,-0.3 -20,-0.1 15,-0.2 -0.885 50.4-166.4-132.3 162.3 75.8 -42.7 14.5 69 69 A T E -C 82 0A 73 13,-0.9 13,-1.6 -2,-0.3 2,-0.2 -0.863 20.9-147.6-147.7 106.4 75.9 -42.0 18.3 70 70 A L E +C 81 0A 9 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.491 22.8 163.9 -82.5 146.4 72.9 -43.0 20.5 71 71 A T E -C 80 0A 56 9,-1.9 9,-3.5 -2,-0.2 2,-0.3 -0.954 15.8-156.2-150.5 159.0 71.8 -41.1 23.6 72 72 A A E -C 79 0A 35 -2,-0.3 2,-0.2 7,-0.3 7,-0.2 -0.893 11.9-145.5-137.0 168.1 68.6 -41.1 25.7 73 73 A D E >>> -C 78 0A 66 5,-1.3 4,-1.2 -2,-0.3 5,-1.0 -0.677 10.1-161.2-140.4 82.7 66.8 -38.7 28.0 74 74 A K G >45S+ 0 0 115 -21,-0.2 3,-0.5 -2,-0.2 -1,-0.1 0.717 85.3 51.3 -27.3 -56.2 65.1 -40.6 30.8 75 75 A S G 345S+ 0 0 108 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.924 117.6 34.6 -54.8 -57.4 62.7 -37.7 31.9 76 76 A S G <45S- 0 0 58 -3,-0.7 -1,-0.2 2,-0.1 -2,-0.2 0.439 103.3-128.4 -80.6 -2.1 61.2 -36.9 28.4 77 77 A S T <<5 + 0 0 44 -4,-1.2 -53,-3.5 -3,-0.5 2,-0.4 0.903 60.4 142.8 53.3 45.5 61.4 -40.5 27.4 78 78 A T E < -BC 23 73A 21 -5,-1.0 -5,-1.3 -55,-0.2 2,-0.4 -0.966 39.0-157.7-123.9 130.1 63.2 -39.5 24.2 79 79 A A E -BC 22 72A 6 -57,-2.8 -57,-0.6 -2,-0.4 2,-0.4 -0.831 12.4-154.4-102.7 141.6 66.0 -41.4 22.4 80 80 A F E -BC 21 71A 46 -9,-3.5 -9,-1.9 -2,-0.4 2,-0.6 -0.960 9.2-164.4-122.8 129.9 68.4 -39.5 20.1 81 81 A M E -BC 20 70A 0 -61,-1.3 -61,-2.2 -2,-0.4 2,-0.7 -0.951 10.6-157.5-111.4 119.3 70.4 -40.8 17.2 82 82 A Q E -BC 19 69A 51 -13,-1.6 -13,-0.9 -2,-0.6 2,-0.6 -0.854 7.2-170.2 -97.7 113.8 73.2 -38.5 16.0 83 83 A L E -BC 18 68A 3 -65,-2.9 -65,-1.5 -2,-0.7 2,-0.3 -0.922 12.7-162.5-104.3 120.8 74.2 -39.1 12.4 84 84 A S + 0 0 59 -17,-1.7 -67,-0.2 -2,-0.6 -68,-0.1 -0.770 54.3 4.0-110.3 154.6 77.3 -37.2 11.4 85 85 A S S S- 0 0 67 -70,-0.5 -1,-0.2 -2,-0.3 -68,-0.2 0.939 81.0-160.1 40.8 77.9 79.0 -36.3 8.1 86 86 A L - 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