==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 07-MAY-10 3MXV . COMPND 2 MOLECULE: FAB FRAGMENT OF ANTI-SHH 5E1 MOUSE/HUMAN CHIMERA, . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS, HOMO SAPIENS; . AUTHOR S.G.HYMOWITZ,H.R.MAUN . 432 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19462.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 287 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 179 41.4 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 . 1 0.2 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 . 44 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 3.0 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 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 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 4 5 5 4 3 8 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 . 0 0 5 0 1 0 0 0 0 0 0 0 1 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 L D 0 0 131 0, 0.0 2,-0.4 0, 0.0 93,-0.1 0.000 360.0 360.0 360.0 152.7 40.8 -10.1 5.9 2 2 L I - 0 0 10 93,-0.4 2,-0.5 91,-0.1 88,-0.1 -0.604 360.0-145.1 -77.3 125.6 43.4 -7.3 6.0 3 3 L V - 0 0 90 -2,-0.4 23,-1.8 94,-0.0 2,-0.5 -0.815 6.4-154.3 -97.0 129.4 43.5 -5.5 9.4 4 4 L M E -A 25 0A 13 -2,-0.5 2,-0.6 94,-0.4 96,-0.4 -0.922 7.2-162.2-106.8 118.9 44.2 -1.7 9.4 5 5 L T E -A 24 0A 76 19,-3.3 19,-2.8 -2,-0.5 2,-0.4 -0.912 5.6-163.6-107.6 117.1 45.7 -0.3 12.6 6 6 L Q E -A 23 0A 6 -2,-0.6 17,-0.2 17,-0.2 94,-0.0 -0.807 11.7-132.2-102.0 138.7 45.5 3.5 13.2 7 7 L T E S+A 22 0A 62 15,-2.2 15,-2.6 -2,-0.4 2,-0.1 -0.982 73.1 23.0-139.4 146.6 47.6 5.5 15.7 8 8 L P - 0 0 53 0, 0.0 3,-0.1 0, 0.0 14,-0.1 0.780 61.8-154.0 -76.5 177.0 47.1 7.5 17.8 9 9 L K S S+ 0 0 126 1,-0.3 94,-2.6 93,-0.1 2,-0.3 0.844 83.1 14.4 -76.2 -35.0 43.4 7.0 18.7 10 10 L F E -d 103 0B 127 92,-0.2 2,-0.3 75,-0.0 -1,-0.3 -0.980 64.7-175.3-138.9 146.9 43.3 10.7 19.8 11 11 L L E -d 104 0B 29 92,-2.2 94,-3.1 -2,-0.3 2,-0.5 -0.992 12.6-153.4-144.8 144.3 45.4 13.8 19.3 12 12 L L E +d 105 0B 94 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.972 26.1 168.1-115.9 124.7 45.1 17.3 20.7 13 13 L V E -d 106 0B 14 92,-2.5 94,-2.6 -2,-0.5 2,-0.3 -0.987 31.6-123.8-142.2 141.0 46.7 20.0 18.6 14 14 L S E > -d 107 0B 35 -2,-0.3 3,-2.1 92,-0.2 64,-0.2 -0.652 46.0 -90.1 -80.7 144.8 46.7 23.9 18.4 15 15 L A T 3 S+ 0 0 58 92,-0.7 64,-0.2 -2,-0.3 -1,-0.1 -0.196 115.3 30.4 -48.0 140.3 45.6 25.6 15.2 16 16 L G T 3 S+ 0 0 44 62,-3.6 -1,-0.3 1,-0.3 63,-0.1 0.183 100.0 110.5 89.4 -16.5 48.6 26.3 12.9 17 17 L D S < S- 0 0 91 -3,-2.1 61,-3.3 61,-0.2 -1,-0.3 -0.349 71.8 -96.2 -90.4 170.8 50.4 23.1 14.2 18 18 L K - 0 0 136 59,-0.2 2,-0.4 -3,-0.1 58,-0.2 -0.623 26.5-160.3 -90.8 143.2 51.2 19.8 12.4 19 19 L V E - B 0 75A 3 56,-2.5 56,-2.3 -2,-0.3 2,-0.5 -0.991 6.1-172.3-119.0 129.6 49.1 16.6 12.6 20 20 L T E - B 0 74A 65 -2,-0.4 2,-0.4 54,-0.2 54,-0.2 -0.980 3.6-176.7-124.9 120.9 50.6 13.3 11.7 21 21 L I E - B 0 73A 0 52,-3.5 52,-3.2 -2,-0.5 2,-0.4 -0.928 9.1-154.8-115.5 137.7 48.4 10.2 11.6 22 22 L T E -AB 7 72A 44 -15,-2.6 -15,-2.2 -2,-0.4 2,-0.4 -0.913 7.8-169.1-117.5 142.4 49.7 6.6 10.9 23 23 L a E -AB 6 71A 0 48,-2.4 48,-2.9 -2,-0.4 2,-0.5 -0.997 5.3-166.3-128.4 129.4 48.0 3.6 9.4 24 24 L K E -AB 5 70A 114 -19,-2.8 -19,-3.3 -2,-0.4 2,-0.3 -0.969 9.2-147.7-120.4 124.9 49.5 0.1 9.4 25 25 L A E -A 4 0A 7 44,-2.3 -21,-0.2 -2,-0.5 4,-0.1 -0.649 18.6-130.3 -90.9 147.4 48.2 -2.8 7.3 26 26 L S S S+ 0 0 68 -23,-1.8 2,-0.3 -2,-0.3 -1,-0.1 0.707 94.5 4.1 -67.5 -23.0 48.3 -6.5 8.4 27 27 L Q S S- 0 0 104 -24,-0.2 2,-0.1 41,-0.1 -2,-0.0 -0.921 106.7 -59.8-148.8 173.8 49.9 -7.3 5.0 28 28 L S + 0 0 61 -2,-0.3 41,-0.2 1,-0.1 3,-0.1 -0.346 41.0 177.5 -62.3 133.1 51.0 -5.4 1.9 29 29 L V > - 0 0 0 39,-2.3 3,-2.2 1,-0.4 62,-0.2 0.047 30.5-140.6-123.1 22.8 48.3 -3.3 0.3 30 30 L S T 3 - 0 0 22 1,-0.3 38,-2.3 37,-0.1 -1,-0.4 -0.264 65.3 -41.1 54.6-133.1 50.4 -1.7 -2.4 31 31 L N T 3 S+ 0 0 53 36,-0.2 2,-2.0 -3,-0.1 -1,-0.3 0.095 104.9 120.7-106.3 19.2 49.3 1.9 -2.9 32 32 L D < + 0 0 32 -3,-2.2 59,-2.1 18,-0.2 2,-0.4 -0.458 42.4 123.2 -84.4 65.3 45.7 0.9 -2.5 33 33 L L E -E 90 0B 0 -2,-2.0 18,-3.2 57,-0.2 2,-0.3 -0.997 39.3-169.3-136.3 135.7 45.1 3.1 0.5 34 34 L T E -E 89 0B 0 55,-2.7 55,-2.0 -2,-0.4 2,-0.4 -0.886 9.1-151.0-123.9 146.4 42.5 5.9 1.0 35 35 L W E -EF 88 48B 0 13,-2.4 12,-2.4 -2,-0.3 13,-1.6 -0.986 14.5-170.8-118.5 131.8 42.1 8.5 3.8 36 36 L Y E -EF 87 46B 0 51,-2.9 51,-2.0 -2,-0.4 2,-0.4 -0.862 14.3-146.6-115.9 156.1 38.7 10.0 4.8 37 37 L Q E -EF 86 45B 7 8,-2.4 8,-2.5 -2,-0.3 2,-0.5 -0.979 14.0-168.9-116.1 130.3 37.7 12.9 7.0 38 38 L Q E -E 85 0B 23 47,-2.5 47,-2.7 -2,-0.4 3,-0.1 -0.938 1.9-165.3-125.5 112.0 34.5 12.6 9.0 39 39 L K > - 0 0 53 -2,-0.5 3,-2.1 4,-0.4 45,-0.1 -0.606 45.3 -72.8 -89.8 154.9 33.1 15.7 10.8 40 40 L P T 3 S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.166 118.3 6.3 -52.3 132.4 30.4 15.3 13.4 41 41 L G T 3 S+ 0 0 94 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.532 112.1 103.1 74.5 9.4 27.0 14.4 11.9 42 42 L Q S < S- 0 0 112 -3,-2.1 -1,-0.2 1,-0.0 3,-0.1 -0.810 74.5-106.4-121.2 160.7 28.4 14.0 8.4 43 43 L S - 0 0 26 -2,-0.3 -4,-0.4 1,-0.1 -6,-0.1 -0.419 55.9 -82.8 -71.6 157.3 29.3 11.2 6.0 44 44 L P - 0 0 5 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.319 43.8-142.1 -61.2 151.4 33.0 10.5 5.5 45 45 L K E -F 37 0B 112 -8,-2.5 -8,-2.4 -3,-0.1 2,-0.3 -0.980 14.6-120.6-120.9 126.3 34.7 12.7 2.9 46 46 L L E +F 36 0B 4 -2,-0.4 -10,-0.2 274,-0.3 3,-0.1 -0.490 42.8 155.2 -66.3 126.9 37.4 11.4 0.6 47 47 L L E + 0 0 2 -12,-2.4 8,-2.6 1,-0.3 2,-0.4 0.730 61.4 25.0-116.1 -47.4 40.7 13.3 0.9 48 48 L I E +FG 35 54B 0 -13,-1.6 -13,-2.4 6,-0.2 -1,-0.3 -0.988 60.0 177.6-131.0 131.7 43.5 11.0 -0.3 49 49 L Y E >> + G 0 53B 34 4,-2.4 4,-2.3 -2,-0.4 3,-0.6 -0.913 67.7 26.9-133.2 160.5 43.5 8.1 -2.7 50 50 L Y T 34 S- 0 0 65 -2,-0.3 2,-1.2 1,-0.2 -16,-0.2 0.849 123.5 -79.1 49.9 36.3 46.2 5.8 -4.1 51 51 L A T 34 S+ 0 0 1 -18,-3.2 -1,-0.2 1,-0.2 21,-0.2 -0.081 126.3 29.3 76.7 -35.2 48.1 6.6 -0.8 52 52 L S T <4 S+ 0 0 70 -2,-1.2 2,-0.5 -3,-0.6 12,-0.3 0.383 87.3 106.1-140.7 -1.1 49.4 10.0 -1.9 53 53 L N E < -G 49 0B 70 -4,-2.3 -4,-2.4 10,-0.1 2,-0.4 -0.778 62.2-132.0 -92.8 127.6 47.0 11.6 -4.4 54 54 L R E -G 48 0B 104 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.626 25.2-127.6 -72.3 129.7 44.8 14.5 -3.2 55 55 L Y > - 0 0 31 -8,-2.6 3,-1.7 -2,-0.4 -1,-0.1 -0.245 49.2 -60.6 -68.0 165.9 41.2 14.1 -4.4 56 56 L T T 3 S+ 0 0 102 1,-0.2 -1,-0.2 -2,-0.0 0, 0.0 -0.204 121.0 3.1 -54.5 133.9 39.5 16.9 -6.3 57 57 L G T 3 S+ 0 0 79 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.441 89.2 144.2 70.8 1.3 39.2 20.2 -4.4 58 58 L V < - 0 0 12 -3,-1.7 -1,-0.2 -11,-0.1 -4,-0.1 -0.614 54.7-110.7 -74.7 124.2 41.1 19.0 -1.4 59 59 L P > - 0 0 47 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.073 20.7-115.9 -54.0 153.6 43.4 21.7 0.2 60 60 L D T 3 S+ 0 0 124 1,-0.3 16,-0.1 -6,-0.0 -2,-0.1 0.710 106.9 74.1 -66.2 -25.3 47.2 21.5 -0.0 61 61 L R T 3 S+ 0 0 35 16,-0.1 15,-2.4 14,-0.1 2,-0.5 0.728 84.7 79.9 -60.6 -22.2 47.6 21.2 3.7 62 62 L F E < +C 75 0A 5 -3,-1.3 2,-0.3 13,-0.2 13,-0.2 -0.790 60.9 160.2 -92.4 122.8 46.3 17.6 3.5 63 63 L T E -C 74 0A 49 11,-2.2 11,-2.3 -2,-0.5 2,-0.3 -0.923 21.4-162.2-135.5 162.5 48.9 15.0 2.3 64 64 L G E +C 73 0A 9 -12,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.985 12.5 170.4-140.0 149.8 49.4 11.2 2.3 65 65 L S E +C 72 0A 61 7,-2.0 7,-2.6 -2,-0.3 2,-0.1 -0.951 23.2 85.0-149.3 169.5 52.4 9.0 1.8 66 66 L G E -C 71 0A 32 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.409 39.1-143.7 120.8 164.5 53.5 5.4 2.1 67 67 L Y E > +C 70 0A 156 3,-0.7 2,-0.9 -2,-0.1 3,-0.6 -0.919 68.2 8.6-163.5 137.2 53.5 2.1 0.2 68 68 L G T 3 S- 0 0 9 -38,-2.3 -39,-2.3 -2,-0.3 -41,-0.1 -0.796 127.7 -20.9 96.3-103.1 53.1 -1.5 1.4 69 69 L T T 3 S+ 0 0 49 -2,-0.9 -44,-2.3 -41,-0.2 2,-0.6 0.665 118.8 71.4-115.9 -25.8 52.1 -1.6 5.1 70 70 L D E < +BC 24 67A 94 -3,-0.6 -3,-0.7 -46,-0.2 2,-0.3 -0.859 57.7 173.3-108.2 113.5 53.1 1.8 6.6 71 71 L F E -BC 23 66A 0 -48,-2.9 -48,-2.4 -2,-0.6 2,-0.4 -0.888 15.0-156.3-124.5 151.3 51.1 4.9 5.7 72 72 L T E -BC 22 65A 37 -7,-2.6 -7,-2.0 -2,-0.3 2,-0.4 -0.986 3.7-167.1-132.9 126.6 51.2 8.5 6.9 73 73 L F E -BC 21 64A 0 -52,-3.2 -52,-3.5 -2,-0.4 2,-0.4 -0.961 17.7-169.6-111.2 133.3 48.5 11.2 6.7 74 74 L T E -BC 20 63A 18 -11,-2.3 -11,-2.2 -2,-0.4 2,-0.6 -0.972 26.7-165.7-128.5 134.1 49.6 14.8 7.5 75 75 L I E -BC 19 62A 0 -56,-2.3 -56,-2.5 -2,-0.4 3,-0.4 -0.979 17.8-164.3-107.4 111.1 47.8 18.1 8.1 76 76 L S S S+ 0 0 61 -15,-2.4 2,-0.4 -2,-0.6 -1,-0.2 0.939 81.3 11.5 -64.9 -46.6 50.8 20.4 7.6 77 77 L T S S- 0 0 61 -59,-0.1 -1,-0.3 -3,-0.1 -59,-0.2 -0.853 87.8-144.0-134.8 93.7 49.1 23.4 9.3 78 78 L V - 0 0 1 -61,-3.3 -62,-3.6 -3,-0.4 2,-0.3 -0.254 11.4-153.4 -65.5 141.8 45.9 22.3 11.1 79 79 L Q > - 0 0 72 -64,-0.2 3,-2.2 -63,-0.1 4,-0.2 -0.827 28.3-110.8-111.8 156.3 42.9 24.7 11.0 80 80 L A G > S+ 0 0 19 -2,-0.3 3,-1.1 1,-0.3 26,-0.1 0.832 118.2 56.7 -53.5 -36.3 40.1 24.9 13.6 81 81 L E G 3 S+ 0 0 70 1,-0.2 -1,-0.3 88,-0.1 88,-0.1 0.545 87.4 80.3 -73.6 -6.8 37.6 23.5 11.1 82 82 L D G < + 0 0 1 -3,-2.2 -1,-0.2 86,-0.1 22,-0.2 0.452 58.9 126.0 -81.6 -0.4 39.8 20.4 10.6 83 83 L L < + 0 0 12 -3,-1.1 2,-0.3 -4,-0.2 22,-0.2 -0.403 39.3 107.6 -60.1 130.3 38.4 18.8 13.8 84 84 L A E S- H 0 104B 5 20,-1.0 20,-2.9 -45,-0.1 2,-0.5 -0.961 74.1 -84.1 175.9 167.8 37.1 15.4 12.7 85 85 L V E -EH 38 103B 41 -47,-2.7 -47,-2.5 -2,-0.3 2,-0.4 -0.936 42.4-153.2 -97.6 127.6 37.8 11.7 12.8 86 86 L Y E -EH 37 102B 0 16,-2.7 16,-1.8 -2,-0.5 2,-0.4 -0.869 11.8-167.3-103.3 133.6 40.2 10.6 10.1 87 87 L F E -E 36 0B 6 -51,-2.0 -51,-2.9 -2,-0.4 2,-0.3 -0.949 13.3-149.8-120.6 141.0 40.1 7.1 8.7 88 88 L a E -E 35 0B 0 -2,-0.4 11,-2.9 -53,-0.2 2,-0.3 -0.747 18.0-172.3 -96.7 157.0 42.3 5.0 6.5 89 89 L Q E -EI 34 98B 0 -55,-2.0 -55,-2.7 -2,-0.3 2,-0.3 -0.959 12.5-146.6-150.7 129.2 40.9 2.3 4.2 90 90 L Q E +EI 33 97B 0 7,-2.5 7,-1.2 -2,-0.3 -57,-0.2 -0.743 14.5 178.7 -95.5 145.9 42.5 -0.4 2.1 91 91 L D + 0 0 18 -59,-2.1 226,-0.4 -2,-0.3 -58,-0.1 -0.120 58.9 94.6-133.6 37.7 41.1 -1.6 -1.2 92 92 L Y S S+ 0 0 127 -60,-0.3 2,-0.3 1,-0.2 -59,-0.1 0.870 88.4 31.8 -90.3 -48.7 43.8 -4.1 -2.2 93 93 L G S S- 0 0 22 2,-0.2 -1,-0.2 4,-0.1 4,-0.1 -0.828 99.9 -75.8-112.4 149.2 42.2 -7.3 -0.8 94 94 L S S S+ 0 0 95 -2,-0.3 -3,-0.1 -3,-0.1 3,-0.0 -0.729 109.3 40.8 -88.2 138.2 38.5 -8.2 -0.5 95 95 L P S S- 0 0 5 0, 0.0 -93,-0.4 0, 0.0 -2,-0.2 0.597 90.7-127.0 -74.5 153.6 36.7 -7.1 1.6 96 96 L P - 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