==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 17-APR-13 4K7P . COMPND 2 MOLECULE: ANTIBODY RHUMAB6 FAB FRAGMENT LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.EIGENBROT,S.SHIA . 859 6 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37043.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 565 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 330 38.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 112 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 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 . 4 0 3 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 . 8 6 8 7 15 12 2 0 3 0 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 6 5 0 4 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 X D 0 0 116 0, 0.0 2,-0.5 0, 0.0 92,-0.0 0.000 360.0 360.0 360.0-171.3 -20.7 -4.4 50.5 2 2 X I - 0 0 7 92,-0.3 2,-0.5 90,-0.0 87,-0.1 -0.971 360.0-140.4-124.1 125.6 -19.2 -1.4 52.3 3 3 X Q - 0 0 50 -2,-0.5 2,-0.9 93,-0.1 23,-0.7 -0.733 3.9-155.1 -87.9 123.7 -17.9 1.7 50.6 4 4 X M E -Ab 25 98A 0 93,-0.7 2,-0.9 -2,-0.5 95,-0.7 -0.855 13.0-164.8 -92.8 98.8 -14.7 3.2 52.0 5 5 X T E -A 24 0A 58 19,-2.6 19,-1.7 -2,-0.9 2,-0.3 -0.788 10.9-161.1 -87.9 108.9 -15.0 6.8 50.8 6 6 X Q E -A 23 0A 9 -2,-0.9 17,-0.3 17,-0.2 93,-0.0 -0.672 10.6-119.0 -97.6 146.2 -11.6 8.3 51.3 7 7 X S E S+A 22 0A 62 15,-3.2 15,-2.6 -2,-0.3 2,-0.1 -0.998 76.7 16.7-145.5 135.3 -10.8 12.0 51.5 8 8 X P - 0 0 51 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.643 63.9-142.1 -86.2 177.2 -9.2 13.9 49.9 9 9 X S S S- 0 0 95 1,-0.2 93,-2.0 92,-0.1 2,-0.3 0.893 84.3 -12.7 -62.9 -41.2 -8.4 12.4 46.5 10 10 X S E -e 102 0B 68 91,-0.3 2,-0.3 74,-0.0 93,-0.2 -0.934 65.5-175.6-150.9 171.8 -4.9 13.9 46.7 11 11 X L E -e 103 0B 41 91,-1.8 93,-3.2 -2,-0.3 2,-0.4 -0.961 13.7-145.7-168.5 154.5 -2.9 16.5 48.6 12 12 X S E +e 104 0B 52 -2,-0.3 2,-0.3 91,-0.2 93,-0.2 -0.978 21.6 169.4-127.7 142.8 0.5 18.3 48.8 13 13 X A E -e 105 0B 10 91,-1.7 93,-2.4 -2,-0.4 3,-0.1 -0.995 31.6-108.3-153.1 149.4 2.4 19.4 51.9 14 14 X S E > -e 106 0B 44 -2,-0.3 3,-1.9 91,-0.2 63,-0.3 -0.271 50.8 -82.6 -72.5 159.8 5.8 20.7 52.9 15 15 X V T 3 S+ 0 0 77 91,-0.7 63,-0.2 1,-0.2 -1,-0.1 -0.481 120.0 27.6 -62.2 126.6 8.4 18.7 54.8 16 16 X G T 3 S+ 0 0 44 61,-1.9 -1,-0.2 1,-0.3 62,-0.1 0.219 91.5 134.0 103.4 -12.3 7.6 18.9 58.5 17 17 X D < - 0 0 73 -3,-1.9 60,-2.1 60,-0.2 2,-0.7 -0.234 60.5-118.8 -68.4 157.1 3.8 19.4 58.0 18 18 X R - 0 0 177 58,-0.2 2,-0.5 -3,-0.1 57,-0.2 -0.892 34.7-164.4 -98.8 111.5 1.1 17.6 59.9 19 19 X V E - C 0 74A 7 55,-2.8 55,-3.2 -2,-0.7 2,-0.5 -0.854 8.7-170.2-108.0 125.5 -0.9 15.7 57.3 20 20 X T E - C 0 73A 75 -2,-0.5 2,-0.5 53,-0.2 53,-0.2 -0.955 2.4-167.2-115.3 129.5 -4.4 14.2 58.0 21 21 X I E - C 0 72A 0 51,-2.8 51,-2.6 -2,-0.5 2,-0.3 -0.966 12.1-149.6-113.8 126.7 -6.2 11.8 55.7 22 22 X T E -AC 7 71A 55 -15,-2.6 -15,-3.2 -2,-0.5 2,-0.3 -0.680 12.8-175.5 -93.6 145.6 -9.9 11.0 56.3 23 23 X a E -AC 6 70A 0 47,-1.9 47,-2.5 -2,-0.3 2,-0.4 -0.989 8.6-157.0-135.7 145.1 -11.7 7.8 55.5 24 24 X R E -AC 5 69A 125 -19,-1.7 -19,-2.6 -2,-0.3 2,-0.3 -0.982 3.5-148.8-132.9 129.0 -15.4 7.1 55.8 25 25 X A E -A 4 0A 4 43,-2.1 -21,-0.2 -2,-0.4 4,-0.1 -0.687 15.4-141.1 -97.0 144.4 -17.4 3.9 56.2 26 26 X S S S+ 0 0 60 -23,-0.7 2,-0.3 -2,-0.3 -1,-0.1 0.683 92.9 32.6 -74.8 -19.0 -20.9 3.2 55.0 27 27 X S S S- 0 0 50 -24,-0.1 2,-0.2 41,-0.1 -1,-0.1 -0.962 101.6 -86.3-134.9 155.3 -21.5 1.2 58.2 28 29 X S + 0 0 91 -2,-0.3 2,-0.3 2,-0.0 40,-0.2 -0.410 51.4 172.0 -62.3 122.9 -20.3 1.5 61.8 29 30 X V - 0 0 8 38,-1.7 3,-0.1 -2,-0.2 -4,-0.1 -0.908 34.3-134.3-129.0 158.7 -17.0 -0.3 62.3 30 31 X S S S- 0 0 61 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.933 80.2 -1.6 -82.2 -49.0 -14.6 -0.3 65.3 31 32 X Y - 0 0 86 18,-0.1 59,-0.4 39,-0.0 2,-0.3 -0.973 58.3-146.9-141.3 159.2 -11.2 0.1 63.6 32 33 X L - 0 0 6 -2,-0.3 2,-0.3 18,-0.3 57,-0.2 -0.791 14.1-133.4-114.9 161.7 -9.6 0.6 60.2 33 34 X H E -F 88 0B 0 55,-2.5 55,-2.5 -2,-0.3 2,-0.4 -0.786 16.0-146.8-106.1 160.0 -6.3 -0.5 58.7 34 35 X W E -FG 87 47B 4 13,-3.2 12,-2.6 -2,-0.3 13,-2.0 -0.991 10.9-168.8-129.7 138.4 -4.0 1.7 56.7 35 36 X Y E -FG 86 45B 2 51,-2.7 51,-2.5 -2,-0.4 2,-0.5 -0.943 12.0-147.5-126.2 149.3 -1.7 0.8 53.8 36 37 X Q E -FG 85 44B 21 8,-3.3 8,-1.3 -2,-0.3 2,-0.7 -0.947 11.3-168.4-119.7 111.7 1.1 2.6 52.0 37 38 X Q E -FG 84 43B 16 47,-3.0 47,-2.2 -2,-0.5 3,-0.1 -0.877 6.2-159.2-104.2 107.5 1.6 1.9 48.3 38 39 X K > - 0 0 44 -2,-0.7 3,-1.4 4,-0.5 45,-0.1 -0.561 42.7 -79.7 -74.7 146.8 4.8 3.4 46.9 39 40 X P T 3 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.148 114.6 10.5 -51.4 136.6 4.8 3.7 43.0 40 41 X G T 3 S+ 0 0 92 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.697 115.8 89.7 66.5 22.8 5.5 0.5 41.1 41 42 X K S < S- 0 0 139 -3,-1.4 -1,-0.2 3,-0.0 3,-0.1 -0.904 80.6 -89.7-141.4 167.9 5.2 -1.6 44.2 42 43 X A - 0 0 21 -2,-0.3 -4,-0.5 1,-0.1 286,-0.1 -0.355 55.6 -84.1 -72.6 156.4 2.6 -3.6 46.2 43 44 X P E -G 37 0B 2 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 -0.393 46.9-148.5 -55.4 138.2 0.6 -2.0 49.1 44 45 X K E -G 36 0B 82 -8,-1.3 -8,-3.3 -3,-0.1 281,-0.1 -0.932 21.2-105.7-114.5 135.9 2.6 -2.1 52.3 45 46 X P E +G 35 0B 16 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.402 44.1 166.6 -57.4 133.9 1.0 -2.4 55.8 46 47 X L E + 0 0 1 -12,-2.6 8,-1.6 1,-0.4 2,-0.4 0.727 63.7 1.0-117.6 -56.1 1.2 1.0 57.5 47 48 X I E -GH 34 53B 2 -13,-2.0 -13,-3.2 6,-0.2 2,-0.4 -0.995 62.6-163.9-136.9 133.0 -1.1 0.8 60.5 48 49 X Y E > - H 0 52B 50 4,-2.9 4,-2.5 -2,-0.4 3,-0.2 -0.963 44.9 -40.5-119.5 143.0 -3.2 -2.1 61.7 49 50 X A T 4 S+ 0 0 0 -2,-0.4 2,-0.2 1,-0.3 -16,-0.1 0.027 123.2 11.6 -44.6 138.9 -6.1 -2.0 64.2 50 51 X P T 4 S- 0 0 55 0, 0.0 -18,-0.3 0, 0.0 -1,-0.3 -0.795 129.0 -65.0 -75.9 -43.5 -6.4 -0.4 66.7 51 52 X S T 4 S+ 0 0 61 -3,-0.2 2,-0.3 -2,-0.2 -2,-0.2 -0.002 75.8 147.8-160.2 40.7 -3.3 1.7 65.8 52 53 X N E < -H 48 0B 66 -4,-2.5 -4,-2.9 10,-0.1 2,-0.4 -0.654 45.6-125.9 -79.8 133.6 -0.2 -0.6 65.8 53 54 X L E -H 47 0B 78 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.657 23.6-125.2 -85.7 134.2 2.5 0.4 63.4 54 55 X A > - 0 0 9 -8,-1.6 3,-1.4 -2,-0.4 2,-0.1 -0.058 46.9 -59.8 -70.3 175.1 3.7 -2.2 60.9 55 56 X S T 3 S+ 0 0 106 1,-0.3 -1,-0.2 0, 0.0 0, 0.0 -0.335 123.9 7.5 -65.7 131.2 7.3 -3.3 60.4 56 57 X G T 3 S+ 0 0 75 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.132 94.9 134.2 85.4 -19.5 9.7 -0.6 59.3 57 58 X V < - 0 0 12 -3,-1.4 -1,-0.3 -12,-0.1 -4,-0.1 -0.483 53.1-131.7 -67.6 123.7 6.9 2.0 59.9 58 59 X P > - 0 0 47 0, 0.0 3,-0.9 0, 0.0 -4,-0.1 -0.210 23.2-104.6 -71.2 167.4 8.2 5.0 61.8 59 60 X S T 3 S+ 0 0 111 1,-0.2 16,-0.1 -6,-0.1 -2,-0.1 0.464 104.1 86.5 -75.5 -1.0 6.4 6.5 64.8 60 61 X R T 3 S+ 0 0 47 16,-0.1 15,-2.2 14,-0.1 2,-0.4 0.425 74.1 85.6 -80.9 3.8 5.1 9.5 62.8 61 62 X F E < +D 74 0A 7 -3,-0.9 2,-0.3 13,-0.2 13,-0.2 -0.911 53.2 168.9-112.8 130.4 2.0 7.5 61.7 62 63 X S E -D 73 0A 51 11,-1.6 11,-2.8 -2,-0.4 2,-0.5 -0.998 21.8-148.0-142.7 142.2 -1.2 7.2 63.8 63 64 X G E +D 72 0A 17 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.948 25.5 162.9-116.1 123.7 -4.7 5.8 63.2 64 65 X S E +D 71 0A 62 7,-2.3 7,-3.2 -2,-0.5 2,-0.2 -0.858 13.0 104.7-133.1 166.8 -7.8 7.3 64.9 65 66 X G E -D 70 0A 27 5,-0.3 5,-0.2 -2,-0.3 -33,-0.1 -0.471 31.2-156.4 134.0 155.6 -11.6 7.4 64.6 66 67 X S S S+ 0 0 102 3,-0.9 -37,-0.2 -2,-0.2 4,-0.1 0.718 72.7 16.0-124.3 -73.9 -14.7 5.9 66.2 67 68 X G S S- 0 0 33 2,-0.2 -38,-1.7 -39,-0.1 3,-0.1 0.987 127.1 -39.9 -78.9 -80.3 -18.0 5.6 64.4 68 69 X T S S+ 0 0 41 -40,-0.2 -43,-2.1 1,-0.1 2,-0.7 0.431 118.3 83.6-126.0 -12.6 -17.7 5.9 60.6 69 70 X D E +C 24 0A 97 -45,-0.2 -3,-0.9 -47,-0.1 2,-0.2 -0.863 55.1 168.0-106.9 110.6 -15.1 8.7 60.4 70 71 X F E -CD 23 65A 5 -47,-2.5 -47,-1.9 -2,-0.7 2,-0.3 -0.702 15.6-152.0-118.1 168.2 -11.5 7.7 60.8 71 72 X T E -CD 22 64A 34 -7,-3.2 -7,-2.3 -2,-0.2 2,-0.5 -0.998 13.4-151.9-145.0 141.6 -8.1 9.4 60.2 72 73 X L E -CD 21 63A 0 -51,-2.6 -51,-2.8 -2,-0.3 2,-0.5 -0.973 24.3-161.3-105.4 128.5 -4.5 8.7 59.3 73 74 X T E -CD 20 62A 20 -11,-2.8 -11,-1.6 -2,-0.5 2,-0.8 -0.956 15.6-168.8-117.4 120.8 -2.2 11.3 60.8 74 75 X I E -CD 19 61A 0 -55,-3.2 -55,-2.8 -2,-0.5 3,-0.3 -0.914 10.5-166.8-100.1 103.5 1.4 11.9 59.6 75 76 X S S S+ 0 0 46 -15,-2.2 2,-0.4 -2,-0.8 -1,-0.2 0.885 76.6 16.9 -60.5 -45.1 2.8 14.1 62.3 76 77 X S S S- 0 0 51 -16,-0.2 -1,-0.3 -58,-0.1 -58,-0.2 -0.887 83.5-138.1-137.0 102.2 5.9 15.2 60.4 77 78 X L - 0 0 0 -60,-2.1 -61,-1.9 -2,-0.4 -60,-0.2 -0.367 19.0-166.3 -69.3 130.5 6.0 14.7 56.7 78 79 X Q > - 0 0 73 -63,-0.2 3,-2.4 -2,-0.1 4,-0.2 -0.835 34.5-109.6-113.3 154.7 9.2 13.4 55.1 79 80 X P G > S+ 0 0 21 0, 0.0 3,-0.8 0, 0.0 26,-0.1 0.746 118.0 56.8 -51.8 -29.5 10.2 13.3 51.4 80 81 X E G 3 S+ 0 0 70 1,-0.2 87,-0.1 88,-0.1 88,-0.1 0.241 84.9 81.7 -90.2 12.0 9.9 9.5 51.3 81 82 X D G < + 0 0 2 -3,-2.4 2,-0.4 86,-0.1 -1,-0.2 0.447 59.9 121.9 -92.9 -2.5 6.2 9.7 52.5 82 83 X F < + 0 0 6 -3,-0.8 2,-0.3 -4,-0.2 22,-0.2 -0.488 44.2 97.6 -61.1 118.9 5.1 10.3 48.9 83 84 X A E S- I 0 103B 2 20,-0.8 20,-2.4 -2,-0.4 2,-0.5 -0.969 76.8 -78.1 178.8 176.3 2.7 7.5 48.1 84 85 X T E -FI 37 102B 30 -47,-2.2 -47,-3.0 -2,-0.3 2,-0.5 -0.892 41.8-152.1 -97.5 130.9 -0.9 6.5 47.9 85 86 X Y E -FI 36 101B 0 16,-1.9 16,-1.1 -2,-0.5 2,-0.5 -0.895 8.5-164.3-108.4 131.1 -2.5 5.6 51.2 86 87 X Y E -F 35 0B 8 -51,-2.5 -51,-2.7 -2,-0.5 2,-0.3 -0.960 8.3-151.6-119.1 126.7 -5.4 3.2 51.5 87 88 X a E -F 34 0B 0 -2,-0.5 11,-1.9 -53,-0.2 2,-0.4 -0.663 19.3-159.1 -84.3 149.4 -7.8 2.7 54.4 88 89 X Q E -FJ 33 97B 0 -55,-2.5 -55,-2.5 -2,-0.3 2,-0.3 -0.998 12.9-151.2-134.7 137.5 -9.2 -0.8 54.8 89 90 X Q E + J 0 96B 1 7,-2.6 7,-0.6 -2,-0.4 -57,-0.1 -0.756 17.0 171.1 -95.6 152.1 -12.3 -2.2 56.6 90 91 X W + 0 0 15 -59,-0.4 -1,-0.1 -2,-0.3 -58,-0.1 0.389 58.0 82.2-142.2 -4.7 -12.1 -5.8 57.9 91 92 X A S S+ 0 0 57 -60,-0.2 2,-0.2 3,-0.1 -59,-0.0 0.863 90.9 52.7 -72.4 -36.9 -15.2 -6.4 60.0 92 93 X F S S- 0 0 88 2,-0.2 4,-0.1 4,-0.1 -90,-0.0 -0.555 92.0 -84.3-102.6 161.7 -17.4 -7.2 57.0 93 94 X N S S+ 0 0 127 -2,-0.2 -3,-0.1 2,-0.1 -2,-0.0 -0.956 107.9 34.1-106.8 126.1 -17.4 -9.5 54.0 94 95 X P S S- 0 0 9 0, 0.0 -92,-0.3 0, 0.0 2,-0.2 0.546 92.9-124.2 -85.5 165.2 -16.0 -8.7 51.6 95 96 X P - 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