==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 12-MAR-09 3GM0 . COMPND 2 MOLECULE: ANTI-METHAMPHETAMINE SINGLE CHAIN FV; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.CELIKEL,E.C.PETERSON,M.OWENS,K.I.VARUGHESE . 237 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11381.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 146 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 37.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 19 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 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 RESIDUES PER ALPHA HELIX . 0 1 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 0 PARALLEL BRIDGES PER LADDER . 0 4 4 0 0 6 2 0 0 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 . 1 0 2 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 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 9 A E 0 0 151 0, 0.0 26,-2.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 0.3 1.3 3.5 31.7 2 10 A V E -A 26 0A 18 24,-0.2 2,-0.4 2,-0.0 24,-0.2 -0.929 360.0-173.6-156.9 128.7 2.7 0.4 30.1 3 11 A Q E -A 25 0A 133 22,-3.6 22,-3.1 -2,-0.3 2,-0.3 -0.971 3.7-165.7-129.0 142.6 6.2 -0.3 28.9 4 12 A L E -A 24 0A 13 104,-0.4 106,-0.7 -2,-0.4 2,-0.4 -0.956 4.3-173.4-130.5 147.4 7.6 -3.3 27.0 5 13 A Q E -A 23 0A 116 18,-1.4 18,-2.6 -2,-0.3 2,-0.3 -0.994 15.4-140.6-143.0 134.0 11.1 -4.5 26.3 6 14 A E E -A 22 0A 9 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.704 19.9-176.7 -95.2 144.6 12.4 -7.4 24.1 7 15 A S E +A 21 0A 54 14,-2.1 14,-2.4 -2,-0.3 105,-0.0 -0.998 24.3 93.3-144.1 137.7 15.2 -9.7 25.1 8 16 A G - 0 0 36 -2,-0.3 12,-0.1 12,-0.2 10,-0.0 -0.901 68.9 -33.9 162.0 171.9 17.0 -12.6 23.3 9 17 A P - 0 0 74 0, 0.0 3,-0.1 0, 0.0 10,-0.0 -0.108 37.0-150.8 -50.3 142.4 19.9 -13.7 21.1 10 18 A S S S+ 0 0 77 1,-0.2 105,-1.8 104,-0.2 2,-0.4 0.597 83.6 34.7 -91.8 -13.3 21.2 -11.3 18.5 11 19 A L E +d 115 0B 100 103,-0.2 2,-0.3 79,-0.0 105,-0.2 -0.998 65.1 177.5-144.6 137.2 22.3 -14.0 16.2 12 20 A V E -d 116 0B 5 103,-2.1 105,-3.2 -2,-0.4 3,-0.1 -0.958 25.1-123.6-136.9 153.1 20.9 -17.5 15.5 13 21 A K > - 0 0 145 -2,-0.3 3,-1.6 103,-0.3 72,-0.2 -0.743 43.7 -83.5 -99.0 148.7 21.9 -20.3 13.2 14 22 A P T 3 S+ 0 0 46 0, 0.0 2,-0.6 0, 0.0 72,-0.2 0.079 112.5 19.7 -44.1 155.7 19.6 -21.8 10.5 15 23 A S T 3 S+ 0 0 101 70,-1.8 69,-0.8 1,-0.2 71,-0.1 0.161 98.6 118.6 67.5 -23.8 17.1 -24.5 11.6 16 24 A Q S < S- 0 0 96 -3,-1.6 69,-1.6 -2,-0.6 2,-0.7 -0.190 73.7-106.7 -66.5 167.1 17.6 -23.4 15.2 17 25 A T - 0 0 56 66,-0.2 66,-0.3 67,-0.1 2,-0.1 -0.857 26.4-142.2-105.2 105.9 14.5 -22.1 17.1 18 26 A L E - B 0 82A 2 64,-2.0 64,-2.7 -2,-0.7 2,-0.4 -0.415 22.5-174.2 -64.1 132.7 14.5 -18.3 17.6 19 27 A S E + B 0 81A 62 62,-0.2 2,-0.3 -2,-0.1 62,-0.2 -0.998 5.3 178.7-135.1 131.8 13.1 -17.4 21.0 20 28 A L E - B 0 80A 2 60,-2.4 60,-2.3 -2,-0.4 2,-0.4 -0.942 14.7-147.0-132.7 154.2 12.3 -13.9 22.4 21 29 A T E -AB 7 79A 36 -14,-2.4 -14,-2.1 -2,-0.3 2,-0.6 -0.953 1.2-157.0-123.7 142.0 10.9 -12.5 25.6 22 30 A a E -AB 6 78A 1 56,-2.1 56,-1.4 -2,-0.4 2,-0.7 -0.950 9.9-158.3-119.6 107.6 8.7 -9.4 26.1 23 31 A S E -AB 5 77A 40 -18,-2.6 -18,-1.4 -2,-0.6 2,-0.4 -0.785 12.1-159.4 -89.6 117.4 8.9 -8.0 29.6 24 32 A V E +A 4 0A 24 52,-1.8 2,-0.3 -2,-0.7 -20,-0.2 -0.836 12.5 177.9-103.0 133.3 5.9 -5.9 30.3 25 33 A T E +A 3 0A 78 -22,-3.1 -22,-3.6 -2,-0.4 2,-0.3 -0.979 33.5 51.9-134.5 146.4 5.7 -3.2 33.0 26 34 A G E S-A 2 0A 58 -2,-0.3 -24,-0.2 -24,-0.2 -2,-0.0 -0.885 86.8 -2.7 132.4-164.3 3.1 -0.8 34.2 27 35 A D S S- 0 0 113 -26,-2.3 2,-0.0 -2,-0.3 -2,-0.0 -0.243 73.6-108.0 -62.1 149.6 -0.5 -0.7 35.2 28 36 A S - 0 0 118 -26,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.318 35.7-140.0 -72.7 163.6 -2.5 -3.9 35.0 29 37 A V - 0 0 51 1,-0.1 3,-0.0 24,-0.0 -1,-0.0 -0.969 19.4-153.5-133.2 149.6 -5.1 -4.3 32.3 30 38 A T S S- 0 0 110 -2,-0.3 2,-0.3 0, 0.0 -1,-0.1 0.278 80.7 -9.2 -99.6 8.9 -8.6 -5.7 32.0 31 39 A S S S+ 0 0 22 22,-0.0 2,-0.2 2,-0.0 67,-0.0 -0.961 75.3 98.6-177.7-171.0 -8.4 -6.5 28.2 32 40 A G - 0 0 4 -2,-0.3 21,-1.8 65,-0.1 2,-0.3 -0.477 53.9 -80.1 108.2-176.7 -6.4 -6.1 25.0 33 41 A Y E -EF 52 98C 79 65,-2.1 65,-2.1 19,-0.2 2,-0.6 -0.983 17.1-147.8-136.5 145.8 -3.9 -7.8 22.8 34 42 A W E -EF 51 97C 45 17,-2.2 17,-1.5 -2,-0.3 2,-0.3 -0.958 27.6-171.5-114.5 114.7 -0.1 -8.4 22.8 35 43 A S E -EF 50 96C 13 61,-3.0 61,-2.5 -2,-0.6 2,-0.4 -0.697 20.2-143.9-108.4 159.2 1.3 -8.5 19.3 36 44 A W E +EF 49 95C 2 13,-2.0 12,-1.9 -2,-0.3 13,-1.1 -0.982 23.8 176.2-118.7 131.1 4.7 -9.4 17.9 37 45 A I E -EF 47 94C 2 57,-3.2 57,-3.2 -2,-0.4 2,-0.3 -0.999 10.2-158.5-138.8 132.9 5.8 -7.3 14.9 38 46 A R E -EF 46 93C 12 8,-2.2 8,-2.9 -2,-0.4 2,-0.4 -0.832 5.6-150.3-117.6 156.7 9.1 -7.5 13.0 39 47 A Q E -EF 45 92C 3 53,-2.7 53,-2.2 -2,-0.3 6,-0.2 -0.975 11.0-153.5-129.1 120.0 11.0 -5.2 10.8 40 48 A F > - 0 0 50 4,-2.1 3,-2.7 -2,-0.4 4,-0.3 -0.371 41.0 -80.7 -85.7 163.8 13.4 -6.3 8.0 41 49 A P T 3 S+ 0 0 107 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.474 126.9 46.0 -62.2 136.1 16.4 -4.4 6.7 42 50 A G T 3 S- 0 0 74 1,-0.1 -2,-0.0 -2,-0.1 -3,-0.0 0.062 124.5-101.5 110.4 -19.8 14.8 -1.9 4.3 43 51 A N < + 0 0 76 -3,-2.7 2,-0.4 1,-0.2 -1,-0.1 0.710 65.9 157.8 75.8 27.3 12.3 -1.3 7.0 44 52 A K - 0 0 93 -4,-0.3 -4,-2.1 -3,-0.2 2,-0.4 -0.682 34.1-139.3 -80.6 131.8 9.3 -3.4 5.8 45 53 A L E -E 39 0C 3 183,-0.4 2,-0.5 -2,-0.4 182,-0.4 -0.802 15.2-164.8 -97.7 135.4 7.1 -4.2 8.8 46 54 A D E -E 38 0C 31 -8,-2.9 -8,-2.2 -2,-0.4 2,-0.6 -0.971 14.9-139.8-124.5 118.1 5.5 -7.6 9.1 47 55 A Y E +E 37 0C 9 -2,-0.5 -10,-0.2 178,-0.4 3,-0.1 -0.665 22.1 179.2 -78.1 117.4 2.6 -8.4 11.5 48 56 A M E - 0 0 0 -12,-1.9 12,-2.5 -2,-0.6 2,-0.3 0.865 42.9 -89.3 -88.6 -41.8 3.3 -11.8 13.1 49 57 A G E -EG 36 59C 0 -13,-1.1 -13,-2.0 10,-0.2 -1,-0.3 -0.971 34.7-120.8 157.8-169.0 0.3 -12.4 15.4 50 58 A Y E -EG 35 58C 28 8,-1.7 8,-1.6 -2,-0.3 2,-0.4 -0.946 5.8-137.6-157.4 175.6 -0.9 -11.8 18.9 51 59 A I E -EG 34 57C 8 -17,-1.5 -17,-2.2 -2,-0.3 6,-0.2 -0.973 31.8-142.6-142.6 122.9 -2.3 -13.3 22.2 52 60 A S E > -E 33 0C 11 4,-2.7 3,-2.0 -2,-0.4 -19,-0.2 -0.143 33.2 -89.8 -83.6-178.2 -5.2 -11.6 23.8 53 61 A Y T 3 S+ 0 0 110 -21,-1.8 -20,-0.1 1,-0.3 -1,-0.1 0.824 130.7 45.9 -56.6 -33.2 -6.2 -10.9 27.4 54 62 A R T 3 S- 0 0 188 -22,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.081 122.3-102.8-101.5 21.2 -8.0 -14.3 27.3 55 63 A G < + 0 0 21 -3,-2.0 -2,-0.1 1,-0.2 16,-0.1 0.302 69.3 149.3 78.8 -12.8 -5.2 -16.3 25.6 56 64 A S - 0 0 70 -5,-0.1 -4,-2.7 1,-0.0 2,-0.3 -0.325 30.9-158.3 -55.3 133.2 -6.8 -16.3 22.1 57 65 A T E -G 51 0C 65 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.809 15.9-171.9-116.9 159.6 -4.0 -16.4 19.6 58 66 A Y E -G 50 0C 47 -8,-1.6 -8,-1.7 -2,-0.3 2,-0.3 -0.941 7.1-164.2-150.5 127.0 -3.8 -15.4 15.9 59 67 A Y E -G 49 0C 44 -2,-0.3 -10,-0.2 -10,-0.2 -11,-0.1 -0.849 31.2-107.3-117.2 149.0 -1.0 -16.0 13.5 60 68 A N >> - 0 0 8 -12,-2.5 3,-3.7 -2,-0.3 4,-1.6 -0.601 35.0-128.1 -69.0 121.1 -0.1 -14.6 10.2 61 69 A P T 34 S+ 0 0 30 0, 0.0 4,-0.3 0, 0.0 63,-0.2 0.767 107.2 66.4 -40.3 -32.9 -0.9 -17.5 7.8 62 70 A S T 34 S+ 0 0 72 1,-0.2 62,-0.1 63,-0.2 63,-0.1 0.639 111.1 32.0 -68.5 -16.3 2.6 -17.1 6.4 63 71 A L T X> S+ 0 0 1 -3,-3.7 3,-2.7 -15,-0.2 4,-1.1 0.583 84.9 121.6-111.0 -20.3 4.2 -18.2 9.7 64 72 A K T 3< S+ 0 0 119 -4,-1.6 3,-0.2 1,-0.3 -2,-0.1 0.544 75.7 41.1 -9.2 -63.5 1.4 -20.6 10.7 65 73 A S T 34 S+ 0 0 67 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.808 121.3 39.7 -69.1 -30.7 3.5 -23.8 11.0 66 74 A R T <4 S+ 0 0 33 -3,-2.7 17,-1.7 16,-0.1 2,-0.2 0.565 99.4 83.2 -98.3 -10.5 6.6 -22.2 12.7 67 75 A I E < +C 82 0A 10 -4,-1.1 2,-0.3 15,-0.2 15,-0.2 -0.610 38.1 165.7-104.3 158.3 5.1 -19.7 15.2 68 76 A S E -C 81 0A 25 13,-1.0 13,-1.2 -2,-0.2 2,-0.5 -0.888 14.6-161.5-164.0 130.9 3.7 -19.8 18.7 69 77 A I E +C 80 0A 3 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.990 17.6 179.2-121.0 124.1 3.0 -16.9 21.1 70 78 A T E -C 79 0A 73 9,-0.8 9,-3.7 -2,-0.5 2,-0.2 -0.902 15.0-144.0-126.9 153.8 2.5 -17.8 24.7 71 79 A R E -C 78 0A 111 -2,-0.3 7,-0.2 7,-0.3 2,-0.2 -0.683 8.0-165.6-111.4 165.7 1.9 -15.7 27.9 72 80 A D E > > +C 77 0A 48 5,-2.2 5,-1.9 -2,-0.2 3,-0.6 -0.672 9.6 178.8-151.3 84.3 3.1 -16.0 31.5 73 81 A T G > 5S+ 0 0 101 1,-0.2 3,-2.9 3,-0.2 -1,-0.1 0.917 74.4 65.7 -57.9 -48.5 0.9 -13.8 33.6 74 82 A S G 3 5S+ 0 0 103 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.839 117.6 27.6 -43.9 -41.6 2.6 -14.7 37.0 75 83 A K G < 5S- 0 0 121 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.149 110.7-119.6-109.7 19.9 5.7 -13.0 35.7 76 84 A N T < 5 + 0 0 101 -3,-2.9 -52,-1.8 1,-0.2 2,-0.3 0.902 67.8 126.6 41.7 62.1 4.0 -10.6 33.4 77 85 A Q E < -BC 23 72A 42 -5,-1.9 -5,-2.2 -54,-0.2 2,-0.3 -0.961 42.8-159.7-142.6 158.5 5.7 -11.7 30.2 78 86 A V E -BC 22 71A 8 -56,-1.4 -56,-2.1 -2,-0.3 2,-0.3 -0.966 21.0-141.8-135.3 149.2 4.7 -12.9 26.7 79 87 A Y E -BC 21 70A 46 -9,-3.7 -9,-0.8 -2,-0.3 2,-0.4 -0.833 12.4-151.2-125.4 158.8 6.9 -15.0 24.3 80 88 A L E +BC 20 69A 2 -60,-2.3 -60,-2.4 -2,-0.3 2,-0.4 -0.970 16.4 177.7-120.9 133.9 7.9 -15.5 20.7 81 89 A Q E +BC 19 68A 76 -13,-1.2 -13,-1.0 -2,-0.4 2,-0.4 -0.995 1.4 174.9-137.6 128.4 9.0 -18.8 19.4 82 90 A L E -BC 18 67A 0 -64,-2.7 -64,-2.0 -2,-0.4 3,-0.3 -0.933 12.4-157.6-141.9 115.1 9.9 -19.4 15.7 83 91 A K + 0 0 85 -17,-1.7 -66,-0.2 -2,-0.4 -67,-0.1 -0.527 67.6 25.3 -93.0 156.7 11.3 -22.6 14.4 84 92 A S S S- 0 0 77 -69,-0.8 -1,-0.2 -68,-0.3 -67,-0.1 0.897 79.7-167.1 62.1 45.4 13.3 -23.3 11.2 85 93 A V + 0 0 3 -69,-1.6 -70,-1.8 -3,-0.3 2,-0.3 -0.176 10.6 176.9 -62.5 153.6 14.8 -19.8 10.9 86 94 A S > - 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