==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 11-JUL-11 3STL . COMPND 2 MOLECULE: ANTIBODY FAB FRAGMENT HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR H.RAGHURAMAN,J.CORDERO-MORALES,V.JOGINI,E.PEROZO . 534 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25119.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 357 66.9 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 . 168 31.5 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 . 47 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 2 0 0 0 0 0 0 1 0 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 7 4 2 3 7 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 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 0 177 0, 0.0 2,-0.1 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 147.1 125.2 -121.7 21.3 2 2 A V - 0 0 99 1,-0.1 3,-0.2 22,-0.1 107,-0.1 -0.322 360.0-162.4 -54.9 119.9 128.2 -121.6 19.0 3 3 A Q S S+ 0 0 61 1,-0.2 22,-1.0 105,-0.1 2,-0.5 0.811 73.0 38.9 -78.8 -32.7 131.1 -123.0 21.1 4 4 A L E S-A 24 0A 3 104,-0.3 106,-0.6 20,-0.2 2,-0.6 -0.921 70.3-164.9-125.6 108.2 134.1 -121.7 19.1 5 5 A Q E +A 23 0A 104 18,-3.2 18,-2.1 -2,-0.5 104,-0.1 -0.812 12.0 173.2 -97.6 122.4 133.9 -118.2 17.6 6 6 A Q - 0 0 23 -2,-0.6 16,-0.1 16,-0.2 104,-0.1 -0.948 36.4-106.3-125.3 145.1 136.4 -117.1 15.0 7 7 A P - 0 0 44 0, 0.0 106,-0.1 0, 0.0 3,-0.1 -0.367 29.3-126.9 -65.9 148.2 136.6 -113.9 12.9 8 8 A G S S+ 0 0 32 104,-0.2 105,-2.3 1,-0.1 2,-0.3 0.827 75.3 0.6 -69.3 -34.1 135.5 -114.4 9.2 9 9 A A E -d 113 0B 9 103,-0.2 2,-0.3 196,-0.2 105,-0.2 -0.995 45.2-167.8-157.3 162.0 138.6 -112.9 7.5 10 10 A E E -d 114 0B 67 103,-1.9 105,-2.3 -2,-0.3 2,-0.4 -0.945 13.9-151.2-152.3 125.2 141.9 -111.3 7.7 11 11 A L E -d 115 0B 49 -2,-0.3 2,-0.4 103,-0.2 105,-0.2 -0.850 20.4-171.9 -98.0 134.3 143.9 -109.6 4.9 12 12 A V E -d 116 0B 7 103,-2.9 105,-1.7 -2,-0.4 6,-0.1 -0.994 19.9-133.5-133.8 131.7 147.7 -109.7 5.3 13 13 A K > - 0 0 127 -2,-0.4 3,-2.7 103,-0.2 73,-0.3 -0.604 46.7 -88.5 -79.1 138.2 150.5 -108.0 3.4 14 14 A P T 3 S+ 0 0 71 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.165 115.8 16.8 -48.5 133.0 153.4 -110.3 2.4 15 15 A G T 3 S+ 0 0 49 71,-3.3 70,-0.5 1,-0.3 72,-0.1 0.080 105.0 107.0 91.2 -25.0 155.9 -110.3 5.2 16 16 A A < - 0 0 42 -3,-2.7 70,-2.1 70,-0.2 -1,-0.3 -0.178 62.5-130.4 -77.2 176.7 153.5 -108.8 7.7 17 17 A S - 0 0 65 67,-0.2 2,-0.3 68,-0.2 67,-0.2 -0.866 15.3-162.9-129.8 164.2 151.9 -110.8 10.6 18 18 A V E - B 0 83A 13 65,-2.4 65,-3.0 -2,-0.3 2,-0.6 -0.984 14.2-139.6-145.7 153.5 148.5 -111.4 12.0 19 19 A K E - B 0 82A 99 -2,-0.3 63,-0.2 63,-0.2 2,-0.2 -0.929 18.9-158.1-120.3 108.5 146.9 -112.7 15.2 20 20 A L E - B 0 81A 3 61,-2.6 61,-2.4 -2,-0.6 2,-0.3 -0.568 9.2-152.9 -84.4 148.2 143.9 -115.0 14.8 21 21 A S E - B 0 80A 31 59,-0.2 2,-0.2 -2,-0.2 59,-0.2 -0.820 16.0-175.2-120.4 161.4 141.4 -115.4 17.7 22 22 A a E - B 0 79A 3 57,-1.3 57,-2.4 -2,-0.3 2,-0.5 -0.779 11.0-164.9-156.3 99.8 139.1 -118.2 18.8 23 23 A K E -AB 5 78A 98 -18,-2.1 -18,-3.2 -2,-0.2 55,-0.2 -0.804 9.6-154.3 -98.4 134.8 136.8 -117.6 21.8 24 24 A A E +A 4 0A 19 53,-2.5 2,-0.3 -2,-0.5 -20,-0.2 -0.533 16.1 173.6-101.4 166.7 135.1 -120.5 23.5 25 25 A S + 0 0 43 -22,-1.0 2,-0.1 -2,-0.2 52,-0.0 -0.878 44.9 60.2-155.7 177.3 131.9 -120.9 25.5 26 26 A G S S- 0 0 36 -2,-0.3 2,-0.2 2,-0.1 -2,-0.0 -0.423 104.5 -8.1 85.5-170.3 130.0 -123.9 26.9 27 27 A Y - 0 0 187 -2,-0.1 2,-0.5 1,-0.0 -2,-0.1 -0.406 65.5-168.7 -65.5 126.4 131.7 -126.3 29.3 28 28 A T - 0 0 83 -2,-0.2 2,-0.3 -4,-0.1 -2,-0.1 -0.973 6.2-171.7-118.8 126.8 135.4 -125.6 29.8 29 29 A F > - 0 0 107 -2,-0.5 3,-1.9 1,-0.1 25,-0.3 -0.795 38.1-114.8-117.2 160.9 137.6 -128.1 31.7 30 30 A T T 3 S+ 0 0 86 -2,-0.3 24,-0.2 1,-0.3 25,-0.1 0.733 115.9 58.3 -61.9 -21.5 141.2 -128.2 33.0 31 31 A S T 3 S+ 0 0 29 69,-0.1 -1,-0.3 23,-0.1 2,-0.2 0.299 79.4 122.6 -93.6 8.6 141.8 -131.0 30.4 32 32 A D < - 0 0 9 -3,-1.9 2,-0.4 68,-0.1 22,-0.3 -0.474 40.2-166.5 -77.2 143.0 140.8 -129.0 27.3 33 33 A W E -E 99 0B 0 66,-2.7 66,-2.8 -2,-0.2 2,-0.5 -0.968 10.8-146.9-124.1 140.1 143.2 -128.5 24.4 34 34 A I E -EF 98 51B 12 17,-2.7 17,-1.4 -2,-0.4 2,-0.3 -0.947 20.2-164.4-108.1 127.2 142.6 -126.0 21.6 35 35 A H E -EF 97 50B 0 62,-3.2 62,-2.0 -2,-0.5 2,-0.4 -0.710 10.6-148.0-108.6 161.8 143.9 -127.1 18.3 36 36 A W E -EF 96 49B 0 13,-1.9 12,-2.9 -2,-0.3 13,-1.1 -0.999 13.8-172.5-131.3 130.6 144.6 -125.2 15.1 37 37 A V E -EF 95 47B 0 58,-3.0 58,-3.2 -2,-0.4 2,-0.4 -0.988 11.5-147.0-128.6 134.6 144.2 -126.7 11.6 38 38 A K E -EF 94 46B 26 8,-2.8 8,-1.7 -2,-0.4 2,-0.5 -0.853 12.9-173.3-104.1 131.5 145.1 -125.2 8.3 39 39 A Q E -EF 93 45B 20 54,-2.8 54,-2.9 -2,-0.4 6,-0.1 -0.975 9.3-156.2-129.5 121.0 143.2 -125.9 5.1 40 40 A R > - 0 0 88 4,-0.6 3,-2.8 -2,-0.5 52,-0.1 -0.708 45.2 -83.1 -89.8 142.9 144.3 -124.7 1.7 41 41 A P T 3 S+ 0 0 106 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.148 116.0 5.1 -47.1 133.1 141.5 -124.4 -1.0 42 42 A G T 3 S+ 0 0 86 1,-0.2 2,-0.1 -3,-0.1 -3,-0.0 0.302 117.1 95.4 74.2 -10.2 140.8 -127.8 -2.5 43 43 A H S < S- 0 0 131 -3,-2.8 -1,-0.2 1,-0.2 2,-0.1 -0.314 72.0 -93.9-103.5-172.1 143.2 -129.5 -0.1 44 44 A G - 0 0 24 1,-0.1 -4,-0.6 -3,-0.1 2,-0.4 -0.216 46.1 -70.8 -96.1-172.8 143.0 -131.4 3.1 45 45 A L E -F 39 0B 13 274,-0.4 2,-0.5 -6,-0.1 273,-0.2 -0.627 41.1-168.2 -83.0 129.9 143.3 -130.7 6.8 46 46 A E E -F 38 0B 74 -8,-1.7 -8,-2.8 -2,-0.4 2,-0.3 -0.976 19.4-130.9-122.8 123.4 146.8 -130.0 8.3 47 47 A W E +F 37 0B 7 -2,-0.5 -10,-0.2 -10,-0.2 3,-0.1 -0.544 26.1 175.9 -73.4 130.1 147.4 -130.0 12.0 48 48 A I E - 0 0 12 -12,-2.9 13,-2.7 1,-0.4 2,-0.3 0.851 50.4 -64.5 -99.9 -51.9 149.3 -126.9 13.1 49 49 A G E -FG 36 60B 0 -13,-1.1 -13,-1.9 11,-0.2 -1,-0.4 -0.987 38.7-123.4 179.3-177.3 149.5 -127.1 16.8 50 50 A E E -FG 35 59B 0 9,-2.2 9,-1.6 -2,-0.3 2,-0.3 -0.920 10.0-163.5-144.9 167.1 147.8 -127.2 20.2 51 51 A I E -FG 34 58B 2 -17,-1.4 -17,-2.7 -2,-0.3 7,-0.2 -0.985 16.7-140.6-154.4 144.2 147.7 -125.5 23.5 52 52 A I E >>> - G 0 57B 0 5,-2.3 4,-4.4 -2,-0.3 3,-1.1 -0.934 14.0-163.1-110.0 107.9 146.3 -126.3 26.9 53 53 A P T 345S+ 0 0 32 0, 0.0 21,-0.2 0, 0.0 -1,-0.2 0.918 84.0 62.0 -54.5 -52.0 144.8 -123.1 28.5 54 54 A S T 345S+ 0 0 39 -22,-0.3 -24,-0.1 -25,-0.3 -23,-0.1 0.688 126.3 17.9 -52.5 -18.9 144.7 -124.3 32.1 55 55 A Y T <45S- 0 0 144 -3,-1.1 -1,-0.2 2,-0.1 -25,-0.0 0.677 96.8-130.0-121.7 -41.2 148.4 -124.6 32.0 56 56 A G T <5 + 0 0 45 -4,-4.4 2,-0.3 1,-0.3 16,-0.1 0.510 54.7 138.2 101.5 4.6 149.6 -122.6 29.0 57 57 A R E < -G 52 0B 101 -5,-0.5 -5,-2.3 14,-0.1 2,-0.3 -0.616 30.8-165.8 -86.9 146.4 151.9 -125.1 27.2 58 58 A A E -G 51 0B 25 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.974 7.8-164.3-133.6 145.6 151.8 -125.4 23.4 59 59 A N E -G 50 0B 8 -9,-1.6 -9,-2.2 -2,-0.3 2,-0.3 -0.913 12.1-151.5-126.1 152.9 153.2 -128.0 20.9 60 60 A Y E -G 49 0B 42 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.928 27.9 -96.9-131.5 153.5 153.7 -127.7 17.2 61 61 A N - 0 0 23 -13,-2.7 3,-0.5 -2,-0.3 -12,-0.0 -0.485 33.2-160.4 -62.9 120.2 153.7 -129.8 14.0 62 62 A E S S+ 0 0 121 -2,-0.3 -1,-0.2 1,-0.2 4,-0.1 0.688 79.7 69.0 -80.0 -20.2 157.4 -130.5 13.5 63 63 A K S S+ 0 0 151 2,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.697 97.1 59.1 -73.5 -17.7 157.2 -131.4 9.8 64 64 A I S S- 0 0 53 -3,-0.5 2,-0.1 -16,-0.1 -4,-0.0 -0.790 97.8 -88.2-115.8 156.6 156.3 -127.9 8.7 65 65 A Q - 0 0 166 -2,-0.3 2,-1.0 1,-0.1 -4,-0.1 -0.364 49.3-117.3 -57.5 128.0 158.0 -124.5 8.9 66 66 A K + 0 0 122 1,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.587 55.2 147.6 -77.0 102.6 156.9 -122.9 12.3 67 67 A K + 0 0 55 -2,-1.0 17,-1.2 16,-0.0 2,-0.3 0.301 51.5 82.3-113.3 6.8 155.0 -119.8 11.5 68 68 A A E -C 83 0A 4 15,-0.2 2,-0.3 -20,-0.1 15,-0.2 -0.806 48.1-173.3-117.6 154.7 152.6 -120.0 14.5 69 69 A T E -C 82 0A 69 13,-0.6 13,-2.7 -2,-0.3 2,-0.3 -0.935 17.9-153.2-144.1 116.6 152.8 -119.0 18.2 70 70 A L E +C 81 0A 10 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.735 19.8 162.9-100.2 142.8 149.9 -120.1 20.5 71 71 A T E -C 80 0A 60 9,-1.9 9,-2.8 -2,-0.3 2,-0.4 -0.935 19.5-148.1-146.1 164.2 148.7 -118.4 23.6 72 72 A A E -C 79 0A 32 -2,-0.3 2,-0.8 7,-0.2 7,-0.2 -0.988 8.1-150.5-145.8 132.9 145.6 -118.4 25.8 73 73 A D E > > -C 78 0A 61 5,-2.9 5,-1.6 -2,-0.4 3,-0.5 -0.873 11.1-169.6-102.2 102.1 143.9 -115.9 27.9 74 74 A K G > 5S+ 0 0 125 -2,-0.8 3,-1.0 1,-0.2 -1,-0.2 0.870 81.6 59.9 -59.7 -39.4 142.1 -117.8 30.7 75 75 A S G 3 5S+ 0 0 112 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.825 116.6 29.7 -61.4 -34.9 140.2 -114.8 31.9 76 76 A S G < 5S- 0 0 61 -3,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.171 104.1-121.8-111.8 17.2 138.4 -114.2 28.6 77 77 A S T < 5 + 0 0 56 -3,-1.0 -53,-2.5 -4,-0.3 2,-0.4 0.825 65.0 140.1 45.8 42.9 138.3 -117.8 27.4 78 78 A T E < -BC 23 73A 14 -5,-1.6 -5,-2.9 -55,-0.2 2,-0.4 -0.953 39.6-160.4-122.6 132.7 140.2 -116.9 24.2 79 79 A A E -BC 22 72A 5 -57,-2.4 -57,-1.3 -2,-0.4 2,-0.3 -0.871 16.1-161.0-105.6 139.8 142.9 -118.8 22.4 80 80 A F E -BC 21 71A 50 -9,-2.8 -9,-1.9 -2,-0.4 2,-0.4 -0.910 12.5-160.3-124.2 151.2 145.2 -116.9 20.0 81 81 A M E -BC 20 70A 0 -61,-2.4 -61,-2.6 -2,-0.3 2,-0.6 -0.960 9.7-154.9-131.7 116.1 147.5 -117.9 17.1 82 82 A Q E -BC 19 69A 55 -13,-2.7 -13,-0.6 -2,-0.4 2,-0.4 -0.798 9.6-171.9 -93.3 116.5 150.2 -115.5 15.9 83 83 A L E -BC 18 68A 6 -65,-3.0 -65,-2.4 -2,-0.6 2,-0.3 -0.896 13.1-171.2-103.6 135.3 151.2 -116.0 12.3 84 84 A S + 0 0 57 -17,-1.2 -67,-0.2 -2,-0.4 -68,-0.1 -0.980 52.7 11.3-136.6 148.3 154.2 -114.0 11.2 85 85 A S S S- 0 0 76 -70,-0.5 -1,-0.2 -2,-0.3 -68,-0.2 0.963 81.9-170.5 56.8 57.1 156.2 -113.1 8.0 86 86 A L - 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