==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 18-DEC-02 1NGY . COMPND 2 MOLECULE: MATURE METAL CHELATASE CATALYTIC ANTIBODY, LIGHT . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS, HOMO SAPIENS; . AUTHOR J.YIN,S.A.ANDRYSKI,A.B.BEUSCHER,R.C.STEVENS,P.G.SCHULTZ . 429 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19135.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 284 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 172 40.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 48 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 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 RESIDUES PER ALPHA HELIX . 0 1 0 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 . 5 4 5 2 5 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 . 1 0 5 0 2 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 E 0 0 124 0, 0.0 92,-0.1 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 11.4 5.2 67.0 35.8 2 2 A L - 0 0 11 1,-0.1 2,-0.2 24,-0.1 88,-0.1 0.970 360.0-150.4 75.6 78.3 6.9 70.3 36.7 3 3 A V - 0 0 65 22,-0.1 23,-1.3 94,-0.0 2,-0.7 -0.497 7.6-139.6 -83.7 150.6 7.1 72.1 33.3 4 4 A M E -A 25 0A 9 94,-0.4 96,-0.8 21,-0.2 2,-0.8 -0.918 12.0-156.0-112.3 105.1 9.8 74.5 32.3 5 5 A T E -A 24 0A 79 19,-2.0 19,-2.2 -2,-0.7 2,-0.5 -0.737 16.5-165.3 -84.1 112.8 8.4 77.5 30.4 6 6 A Q E -A 23 0A 14 -2,-0.8 17,-0.2 17,-0.2 -2,-0.0 -0.876 9.5-129.6-107.7 128.7 11.3 78.8 28.3 7 7 A T E +A 22 0A 81 15,-2.7 15,-3.1 -2,-0.5 2,-0.1 -0.949 68.7 26.4-132.4 151.6 11.3 82.2 26.6 8 8 A P - 0 0 52 0, 0.0 3,-0.1 0, 0.0 14,-0.0 0.676 56.9-156.7 -85.4 173.8 11.8 83.6 24.0 9 9 A K S S+ 0 0 120 1,-0.2 94,-2.8 93,-0.2 2,-0.3 0.869 82.8 16.2 -76.6 -36.0 11.2 80.9 21.4 10 10 A F E -d 103 0B 135 92,-0.2 2,-0.3 75,-0.0 -1,-0.2 -0.958 66.4-174.4-137.1 153.1 13.4 82.8 18.9 11 11 A M E -d 104 0B 44 92,-2.4 94,-3.5 -2,-0.3 2,-0.5 -0.989 11.7-157.2-149.6 139.8 16.0 85.5 19.2 12 12 A S E +d 105 0B 64 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.968 26.7 162.8-121.6 115.3 18.0 87.5 16.7 13 13 A T E -d 106 0B 11 92,-2.5 94,-3.3 -2,-0.5 2,-0.3 -0.841 31.9-125.7-128.8 164.2 21.2 89.1 17.9 14 14 A T E > -d 107 0B 49 -2,-0.3 3,-2.2 92,-0.2 64,-0.2 -0.806 46.6 -82.4-108.4 152.3 24.4 90.6 16.5 15 15 A V T 3 S+ 0 0 76 92,-0.5 64,-0.2 -2,-0.3 63,-0.1 -0.261 117.8 24.0 -53.4 133.3 27.9 89.4 17.4 16 16 A G T 3 S+ 0 0 27 62,-2.2 -1,-0.3 1,-0.4 63,-0.1 0.137 95.8 117.0 98.3 -20.9 29.0 91.1 20.6 17 17 A D < - 0 0 60 -3,-2.2 61,-1.8 61,-0.2 2,-0.4 -0.348 68.8-108.4 -77.9 162.3 25.5 91.8 21.9 18 18 A R - 0 0 175 59,-0.1 2,-0.4 -3,-0.1 58,-0.2 -0.759 31.2-167.1 -95.5 136.2 24.2 90.3 25.1 19 19 A V E - B 0 75A 4 56,-2.9 56,-2.7 -2,-0.4 2,-0.4 -0.954 3.7-172.9-122.9 142.2 21.6 87.5 25.0 20 20 A S E - B 0 74A 64 -2,-0.4 2,-0.4 54,-0.2 54,-0.2 -0.999 3.4-167.4-137.8 135.3 19.5 86.2 27.9 21 21 A I E - B 0 73A 1 52,-2.7 52,-2.4 -2,-0.4 2,-0.4 -0.937 11.1-149.9-121.1 144.3 17.0 83.3 28.0 22 22 A T E -AB 7 72A 42 -15,-3.1 -15,-2.7 -2,-0.4 2,-0.4 -0.921 13.3-174.9-122.5 144.0 14.6 82.5 30.7 23 23 A a E -AB 6 71A 0 48,-3.0 48,-2.6 -2,-0.4 2,-0.5 -0.977 9.0-163.4-134.7 117.9 13.0 79.4 32.2 24 24 A K E -AB 5 70A 109 -19,-2.2 -19,-2.0 -2,-0.4 46,-0.2 -0.905 19.6-130.7-105.7 123.2 10.3 79.6 34.9 25 25 A A E -A 4 0A 10 44,-3.3 -21,-0.2 -2,-0.5 -22,-0.1 -0.401 3.8-139.3 -72.4 147.2 9.6 76.4 36.8 26 26 A S S S+ 0 0 64 -23,-1.3 -1,-0.1 -2,-0.1 -22,-0.1 0.793 96.3 5.8 -74.7 -30.6 6.1 75.1 37.3 27 27 A Q S S- 0 0 122 -24,-0.2 2,-0.2 41,-0.1 -2,-0.1 0.595 115.2 -69.7-113.7 -89.9 6.7 74.2 40.9 28 28 A N - 0 0 98 41,-0.1 2,-0.6 -4,-0.0 41,-0.2 -0.626 35.1-167.8-179.7 114.9 10.1 75.1 42.4 29 29 A V - 0 0 0 39,-2.2 39,-0.4 1,-0.2 -4,-0.1 -0.933 14.7-151.2-113.0 107.8 13.5 73.8 41.6 30 30 A G S S- 0 0 38 -2,-0.6 38,-1.6 37,-0.2 -1,-0.2 0.909 73.6 -45.0 -37.9 -81.3 16.1 74.9 44.2 31 31 A T S S+ 0 0 73 36,-0.2 2,-2.9 37,-0.0 -1,-0.2 0.338 100.6 117.1-138.1 -1.1 19.1 74.9 42.0 32 32 A P + 0 0 32 0, 0.0 59,-2.6 0, 0.0 2,-0.4 -0.358 47.0 126.5 -73.7 69.9 19.0 71.6 40.0 33 33 A V E -E 90 0B 0 -2,-2.9 18,-3.3 57,-0.2 2,-0.3 -0.988 35.5-175.4-128.7 136.6 18.7 73.4 36.7 34 34 A A E -E 89 0B 2 55,-2.4 55,-2.5 -2,-0.4 2,-0.4 -0.871 13.1-146.4-128.6 162.3 21.0 72.8 33.6 35 35 A W E -EF 88 48B 0 13,-2.6 12,-3.3 -2,-0.3 13,-1.9 -0.995 12.3-166.3-131.7 136.7 21.3 74.4 30.2 36 36 A Y E -EF 87 46B 7 51,-3.0 51,-2.2 -2,-0.4 2,-0.5 -0.897 11.7-144.9-123.0 151.5 22.3 72.7 27.0 37 37 A Q E -EF 86 45B 5 8,-2.6 8,-0.8 -2,-0.3 2,-0.6 -0.968 11.7-168.2-116.9 124.7 23.4 74.0 23.6 38 38 A Q E -E 85 0B 13 47,-3.3 47,-2.2 -2,-0.5 3,-0.1 -0.891 6.6-161.8-117.6 102.6 22.4 72.1 20.5 39 39 A K > - 0 0 38 -2,-0.6 3,-2.3 4,-0.4 45,-0.1 -0.396 45.6 -68.7 -76.7 157.3 24.2 73.2 17.3 40 40 A P T 3 S- 0 0 50 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.171 120.1 -0.6 -48.0 127.5 22.7 72.3 13.9 41 41 A G T 3 S+ 0 0 92 1,-0.2 2,-0.1 -3,-0.1 -2,-0.1 0.351 113.7 106.9 73.7 -9.1 22.8 68.6 13.2 42 42 A Q S < S- 0 0 98 -3,-2.3 -1,-0.2 1,-0.1 3,-0.1 -0.429 72.5-108.1 -97.0 173.3 24.6 68.0 16.6 43 43 A S - 0 0 27 1,-0.2 -4,-0.4 -2,-0.1 -6,-0.1 -0.616 52.0 -77.2 -95.7 159.8 23.3 66.5 19.8 44 44 A P - 0 0 3 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.154 46.8-153.0 -53.6 152.1 22.7 68.6 22.9 45 45 A K E -F 37 0B 91 -8,-0.8 -8,-2.6 -3,-0.1 2,-0.1 -0.992 21.0-110.6-135.3 126.8 25.8 69.6 24.8 46 46 A L E +F 36 0B 7 -2,-0.4 -10,-0.2 269,-0.3 12,-0.1 -0.324 43.8 161.0 -57.4 122.1 26.0 70.4 28.6 47 47 A L E + 0 0 0 -12,-3.3 8,-1.6 1,-0.4 2,-0.3 0.802 62.3 7.5-107.7 -53.3 26.6 74.1 29.0 48 48 A I E +FG 35 54B 0 -13,-1.9 -13,-2.6 6,-0.2 -1,-0.4 -0.960 59.5 179.6-134.9 149.3 25.5 74.9 32.6 49 49 A Y E > + G 0 53B 88 4,-2.3 4,-2.3 -2,-0.3 3,-0.5 -0.964 66.8 32.6-144.9 160.2 24.4 72.9 35.7 50 50 A S T 4 S- 0 0 36 -2,-0.3 2,-1.6 1,-0.3 -16,-0.2 0.826 120.9 -82.4 61.4 27.9 23.4 73.6 39.2 51 51 A A T 4 S+ 0 0 4 -18,-3.3 -1,-0.3 1,-0.2 21,-0.2 -0.055 126.5 31.4 70.3 -36.0 21.9 76.8 37.8 52 52 A S T 4 S+ 0 0 75 -2,-1.6 12,-0.4 -3,-0.5 2,-0.2 0.497 89.4 102.8-130.5 -6.6 25.2 78.6 37.8 53 53 A N E < -G 49 0B 73 -4,-2.3 -4,-2.3 10,-0.1 2,-0.5 -0.582 59.2-140.4 -82.6 143.1 28.1 76.2 37.3 54 54 A R E -G 48 0B 107 -2,-0.2 -6,-0.2 -6,-0.2 3,-0.1 -0.907 17.6-124.3-107.7 123.5 29.8 75.9 33.9 55 55 A Y > - 0 0 45 -8,-1.6 3,-1.4 -2,-0.5 -1,-0.0 -0.174 49.5 -72.4 -58.8 156.0 30.7 72.5 32.5 56 56 A T T 3 S+ 0 0 108 1,-0.2 2,-0.3 3,-0.0 -1,-0.1 -0.121 118.6 15.1 -51.8 144.1 34.4 72.1 31.5 57 57 A G T 3 S+ 0 0 82 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.007 88.0 131.4 81.3 -32.6 35.5 73.9 28.4 58 58 A V < - 0 0 13 -3,-1.4 -1,-0.2 -2,-0.3 -4,-0.1 -0.378 61.8-117.8 -58.8 119.5 32.4 76.1 28.3 59 59 A P > - 0 0 40 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.169 17.4-112.1 -60.4 150.4 33.6 79.7 27.8 60 60 A D T 3 S+ 0 0 111 1,-0.3 16,-0.1 15,-0.0 -2,-0.1 0.618 106.1 85.0 -57.2 -15.4 33.0 82.4 30.3 61 61 A R T 3 S+ 0 0 48 14,-0.1 15,-2.0 16,-0.1 2,-0.5 0.776 81.6 72.0 -58.0 -27.4 30.7 84.1 27.8 62 62 A F E < +C 75 0A 3 -3,-2.1 2,-0.4 13,-0.2 13,-0.2 -0.820 62.5 168.8 -96.7 125.8 28.0 81.7 29.2 63 63 A T E -C 74 0A 55 11,-2.4 11,-3.0 -2,-0.5 2,-0.3 -1.000 15.1-158.4-137.7 136.6 26.7 82.4 32.7 64 64 A G E +C 73 0A 10 -12,-0.4 2,-0.3 -2,-0.4 9,-0.2 -0.790 19.0 157.5-112.8 158.6 23.7 80.9 34.4 65 65 A S E +C 72 0A 50 7,-1.7 7,-2.2 -2,-0.3 2,-0.1 -0.971 16.1 89.6-165.4 175.3 21.6 82.3 37.3 66 66 A G E -C 71 0A 35 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.170 38.8-147.3 106.9 157.5 18.3 82.2 39.2 67 67 A S E > +C 70 0A 87 3,-0.8 2,-2.0 -2,-0.1 3,-1.0 -0.980 63.4 18.3-156.4 161.2 16.9 80.2 42.0 68 68 A G T 3 S- 0 0 18 -38,-1.6 -39,-2.2 -39,-0.4 -41,-0.1 -0.519 131.8 -23.8 77.5 -81.0 13.6 78.8 43.2 69 69 A T T 3 S+ 0 0 40 -2,-2.0 -44,-3.3 -41,-0.2 2,-0.6 0.582 119.4 74.6-136.0 -31.6 11.6 79.0 40.0 70 70 A D E < +BC 24 67A 71 -3,-1.0 -3,-0.8 -46,-0.2 2,-0.3 -0.822 54.3 172.6 -98.5 121.5 13.0 81.6 37.7 71 71 A F E -BC 23 66A 0 -48,-2.6 -48,-3.0 -2,-0.6 2,-0.3 -0.936 9.4-167.3-127.0 149.1 16.3 80.9 35.8 72 72 A T E -BC 22 65A 39 -7,-2.2 -7,-1.7 -2,-0.3 2,-0.5 -0.989 12.5-153.0-138.9 145.7 18.2 82.7 33.1 73 73 A L E -BC 21 64A 1 -52,-2.4 -52,-2.7 -2,-0.3 2,-0.4 -0.960 18.4-165.4-114.6 130.9 21.1 81.9 30.7 74 74 A T E -BC 20 63A 36 -11,-3.0 -11,-2.4 -2,-0.5 2,-0.5 -0.978 12.0-171.2-125.2 132.3 23.2 84.8 29.6 75 75 A I E -BC 19 62A 1 -56,-2.7 -56,-2.9 -2,-0.4 3,-0.3 -0.982 11.8-174.7-119.1 115.0 25.6 84.9 26.7 76 76 A S + 0 0 57 -15,-2.0 2,-3.3 -2,-0.5 -1,-0.2 0.886 69.4 31.4 -76.8-101.0 27.6 88.1 26.6 77 77 A N S S- 0 0 86 -59,-0.1 -1,-0.2 -62,-0.1 -60,-0.2 -0.288 90.4-143.8 -61.1 71.6 30.0 88.8 23.7 78 78 A M - 0 0 0 -2,-3.3 -62,-2.2 -61,-1.8 -61,-0.2 -0.137 18.9-162.5 -44.4 115.5 27.8 86.8 21.3 79 79 A Q > - 0 0 55 -64,-0.2 3,-1.5 -63,-0.1 4,-0.1 -0.649 28.7-114.5-101.7 159.9 30.0 85.0 18.8 80 80 A S G > S+ 0 0 25 1,-0.3 3,-1.9 -2,-0.2 89,-0.1 0.924 115.2 56.4 -55.4 -50.3 29.0 83.5 15.5 81 81 A E G 3 S+ 0 0 100 1,-0.3 -1,-0.3 88,-0.1 87,-0.1 0.532 92.2 74.1 -63.0 -6.4 29.7 79.9 16.6 82 82 A D G < + 0 0 5 -3,-1.5 -1,-0.3 86,-0.1 2,-0.3 0.428 65.9 117.0 -87.2 0.5 27.2 80.5 19.4 83 83 A L < + 0 0 2 -3,-1.9 2,-0.3 85,-0.2 22,-0.2 -0.542 46.0 96.4 -70.6 131.6 24.2 80.3 17.1 84 84 A A E S- H 0 104B 5 20,-0.9 20,-2.8 -2,-0.3 2,-0.4 -0.978 76.2 -66.4 174.3-172.7 22.1 77.3 18.0 85 85 A D E -EH 38 103B 42 -47,-2.2 -47,-3.3 -2,-0.3 2,-0.4 -0.885 45.1-155.6-103.6 134.0 19.1 76.0 19.9 86 86 A Y E -EH 37 102B 0 16,-2.6 16,-2.0 -2,-0.4 2,-0.4 -0.918 9.2-171.7-115.5 140.4 19.3 76.3 23.7 87 87 A F E -E 36 0B 7 -51,-2.2 -51,-3.0 -2,-0.4 2,-0.3 -0.988 10.7-151.7-131.3 137.8 17.4 74.2 26.2 88 88 A a E -E 35 0B 0 -2,-0.4 11,-3.4 -53,-0.2 2,-0.3 -0.689 18.6-157.1-100.5 161.7 17.1 74.5 30.0 89 89 A Q E -EI 34 98B 3 -55,-2.5 -55,-2.4 9,-0.3 2,-0.5 -1.000 15.2-146.2-146.5 144.0 16.5 71.5 32.1 90 90 A Q E +EI 33 97B 0 7,-3.2 7,-1.8 -2,-0.3 -57,-0.2 -0.931 23.8 162.9-107.5 119.4 15.0 70.6 35.5 91 91 A Y + 0 0 88 -59,-2.6 -58,-0.1 -2,-0.5 3,-0.1 -0.131 50.0 95.3-128.6 38.4 16.7 67.7 37.3 92 92 A S S S+ 0 0 54 -60,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.802 94.5 18.8 -93.1 -36.3 15.5 68.2 40.9 93 93 A S S S- 0 0 45 -61,-0.2 -1,-0.2 2,-0.2 4,-0.2 -0.905 94.5 -68.8-133.3 160.6 12.5 65.8 40.5 94 94 A Y S S+ 0 0 121 -2,-0.3 2,-0.1 2,-0.1 -3,-0.1 -0.738 103.5 47.2 -96.9 145.3 11.4 62.9 38.3 95 95 A P S S- 0 0 27 0, 0.0 -2,-0.2 0, 0.0 -5,-0.1 0.488 92.5-125.6 -77.7 147.4 10.6 62.8 35.5 96 96 A L - 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