==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 22-MAY-13 4KVC . COMPND 2 MOLECULE: IG HEAVY CHAIN V REGION MOPC 21, IGH PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR Z.WANG,M.G.ROSSMANN . 432 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19446.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 276 63.9 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 . 181 41.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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-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 . 36 8.3 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 . 10 2.3 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 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 0 0 PARALLEL BRIDGES PER LADDER . 3 3 6 3 4 6 3 1 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 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 H D 0 0 182 0, 0.0 2,-0.1 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0-171.4 1.2 -18.0 -11.6 2 2 H V - 0 0 31 24,-0.1 2,-0.4 22,-0.1 24,-0.2 -0.376 360.0-174.9 -65.3 131.9 2.0 -15.9 -14.6 3 3 H Q E -A 25 0A 111 22,-2.5 22,-2.0 -2,-0.1 2,-0.4 -0.995 15.2-179.4-137.8 133.5 5.5 -14.5 -14.5 4 4 H L E -A 24 0A 14 -2,-0.4 108,-0.5 106,-0.3 2,-0.4 -0.974 7.5-178.9-133.5 120.0 7.3 -12.0 -16.7 5 5 H V E -A 23 0A 63 18,-2.6 18,-3.5 -2,-0.4 2,-0.2 -0.972 7.3-162.3-126.2 127.8 10.9 -10.9 -16.0 6 6 H E E +A 22 0A 7 -2,-0.4 2,-0.3 16,-0.3 16,-0.2 -0.658 15.6 155.5-108.3 162.3 12.9 -8.5 -18.1 7 7 H S E +A 21 0A 66 14,-1.9 14,-2.8 -2,-0.2 107,-0.1 -0.954 37.5 87.3-164.6 176.8 16.6 -7.5 -18.5 8 8 H G + 0 0 27 1,-0.3 11,-0.2 -2,-0.3 14,-0.0 0.337 57.8 136.6 103.6 -5.9 19.0 -5.9 -21.0 9 9 H G + 0 0 21 12,-0.1 2,-0.3 85,-0.1 -1,-0.3 -0.133 21.2 108.7 -64.2 170.6 18.5 -2.3 -20.0 10 10 H G E -d 116 0B 24 105,-1.8 107,-2.3 104,-0.1 2,-0.4 -0.965 66.1 -41.0 153.6-166.9 21.3 0.1 -19.6 11 11 H L E +d 117 0B 43 -2,-0.3 2,-0.3 105,-0.2 107,-0.2 -0.804 51.4 175.3 -98.6 132.2 23.1 3.1 -21.2 12 12 H V E -d 118 0B 14 105,-2.4 107,-1.8 -2,-0.4 3,-0.1 -0.995 30.2-115.7-136.7 143.0 23.6 3.4 -25.0 13 13 H Q > - 0 0 119 -2,-0.3 3,-2.2 105,-0.2 73,-0.2 -0.436 47.7 -90.4 -69.0 148.1 25.0 6.1 -27.3 14 14 H P T 3 S+ 0 0 66 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.299 119.0 26.8 -56.1 143.0 22.6 7.7 -29.8 15 15 H G T 3 S+ 0 0 53 71,-3.5 70,-0.7 1,-0.2 72,-0.1 0.285 103.8 120.8 82.8 -12.9 22.6 5.7 -33.0 16 16 H G < - 0 0 20 -3,-2.2 70,-2.0 70,-0.2 69,-0.3 0.089 56.5-124.0 -71.4-172.4 23.6 2.7 -31.0 17 17 H S + 0 0 69 67,-0.2 2,-0.3 68,-0.2 67,-0.2 -0.948 25.0 170.3-135.9 155.0 21.9 -0.7 -30.6 18 18 H R E - B 0 83A 89 65,-2.9 65,-3.9 -2,-0.3 2,-0.5 -0.970 21.0-141.0-163.3 153.8 20.6 -2.9 -27.7 19 19 H K E - B 0 82A 96 -2,-0.3 2,-0.3 63,-0.2 63,-0.2 -0.972 14.0-161.2-121.9 125.5 18.5 -6.0 -27.1 20 20 H L E - B 0 81A 0 61,-2.4 61,-1.9 -2,-0.5 2,-0.4 -0.761 8.7-151.7-100.6 151.5 16.0 -6.4 -24.2 21 21 H S E -AB 7 80A 33 -14,-2.8 -14,-1.9 -2,-0.3 2,-0.4 -0.929 10.2-167.1-124.2 147.8 14.8 -9.8 -23.0 22 22 H a E -AB 6 79A 0 57,-2.4 57,-2.8 -2,-0.4 2,-0.3 -0.913 11.9-157.1-134.7 107.2 11.5 -10.8 -21.4 23 23 H A E -AB 5 78A 46 -18,-3.5 -18,-2.6 -2,-0.4 2,-0.3 -0.652 10.9-160.0 -83.2 136.8 11.4 -14.2 -19.7 24 24 H A E +A 4 0A 10 53,-2.5 2,-0.3 -2,-0.3 -20,-0.2 -0.897 16.8 158.8-116.2 148.5 8.0 -15.9 -19.3 25 25 H S E +A 3 0A 49 -22,-2.0 -22,-2.5 -2,-0.3 3,-0.1 -0.985 50.0 47.6-156.1 164.8 6.7 -18.7 -17.0 26 26 H G S S+ 0 0 58 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.1 0.600 103.3 61.5 77.7 10.3 3.5 -20.1 -15.5 27 27 H F S S- 0 0 30 -24,-0.1 2,-1.5 -26,-0.1 -1,-0.2 -0.980 98.7 -87.3-152.2 172.1 1.7 -20.1 -18.8 28 28 H T > - 0 0 89 -2,-0.3 3,-1.8 1,-0.2 4,-0.2 -0.657 43.6-170.6 -81.3 92.6 1.7 -21.5 -22.2 29 29 H F G > S+ 0 0 2 -2,-1.5 3,-2.3 1,-0.3 -1,-0.2 0.907 77.8 58.8 -50.0 -53.1 4.0 -18.8 -23.8 30 30 H S G 3 S+ 0 0 59 1,-0.3 -1,-0.3 44,-0.2 -2,-0.1 0.533 99.3 60.9 -62.8 -5.9 3.6 -19.9 -27.4 31 31 H S G < S+ 0 0 77 -3,-1.8 2,-0.4 2,-0.1 -1,-0.3 0.378 94.8 72.4-100.0 4.6 -0.2 -19.4 -27.2 32 32 H F S < S- 0 0 53 -3,-2.3 2,-0.1 21,-0.2 68,-0.1 -0.951 72.6-130.4-123.5 139.9 -0.2 -15.7 -26.4 33 33 H G E -E 99 0B 6 66,-0.6 66,-2.7 -2,-0.4 2,-0.3 -0.475 33.2-148.8 -69.3 155.5 0.6 -12.5 -28.4 34 34 H M E -EF 98 51B 0 17,-2.5 17,-2.2 64,-0.2 2,-0.3 -0.968 9.6-155.6-135.4 150.1 3.0 -10.2 -26.6 35 35 H H E -EF 97 50B 0 62,-3.0 62,-2.5 -2,-0.3 2,-0.4 -0.895 11.5-148.9-122.6 149.9 3.6 -6.5 -26.4 36 36 H W E +EF 96 49B 0 13,-2.2 12,-2.5 -2,-0.3 13,-1.8 -0.977 24.7 177.7-107.6 135.7 6.4 -4.1 -25.6 37 37 H V E -EF 95 47B 0 58,-2.9 58,-3.5 -2,-0.4 2,-0.3 -0.965 10.7-153.7-134.0 143.7 5.2 -0.8 -24.0 38 38 H R E -EF 94 46B 10 8,-2.9 8,-2.8 -2,-0.3 2,-0.4 -0.901 10.2-157.5-126.4 159.6 7.5 2.0 -22.8 39 39 H Q E -EF 93 45B 13 54,-2.3 54,-2.9 -2,-0.3 6,-0.2 -0.943 15.9-147.5-135.9 109.1 7.3 4.8 -20.3 40 40 H A E > - F 0 43B 31 4,-0.8 3,-0.6 3,-0.7 52,-0.2 -0.324 33.3-105.3 -73.0 158.7 9.5 7.9 -20.7 41 41 H P T 3 S+ 0 0 94 0, 0.0 2,-0.2 0, 0.0 3,-0.2 0.884 121.4 40.1 -51.7 -40.1 10.8 9.8 -17.6 42 42 H E T 3 S+ 0 0 174 1,-0.2 -3,-0.0 2,-0.0 50,-0.0 -0.705 114.3 140.1-144.6 96.3 8.2 12.4 -18.5 43 43 H K E < -F 40 0B 88 -3,-0.6 -3,-0.7 -2,-0.2 -1,-0.2 0.604 64.1-169.1-167.1-141.4 6.1 10.5 -19.3 44 44 H G E - 0 0 10 277,-0.2 -4,-0.8 -5,-0.2 2,-0.3 0.403 61.3 -72.5 63.7 158.5 3.0 8.4 -20.0 45 45 H L E -F 39 0B 12 275,-0.5 2,-0.4 -6,-0.2 274,-0.3 -0.655 45.5-168.3 -84.6 141.1 2.7 4.9 -21.4 46 46 H E E -F 38 0B 78 -8,-2.8 -8,-2.9 -2,-0.3 2,-0.2 -0.953 20.6-128.3-136.0 117.9 3.5 4.4 -25.1 47 47 H W E +F 37 0B 8 -2,-0.4 -10,-0.2 270,-0.3 3,-0.1 -0.412 30.0 173.8 -62.8 129.9 2.8 1.2 -27.1 48 48 H V E - 0 0 1 -12,-2.5 13,-2.4 1,-0.3 2,-0.3 0.858 50.3 -17.6-105.3 -49.3 6.0 0.0 -28.9 49 49 H A E -FG 36 60B 0 -13,-1.8 -13,-2.2 11,-0.2 2,-0.4 -0.998 43.9-152.2-163.2 154.2 5.4 -3.3 -30.6 50 50 H Y E -FG 35 59B 24 9,-2.4 9,-2.5 -2,-0.3 2,-0.4 -0.990 7.2-175.2-133.5 143.9 3.2 -6.5 -30.9 51 51 H I E -FG 34 58B 2 -17,-2.2 -17,-2.5 -2,-0.4 7,-0.2 -0.993 23.6-128.5-137.7 129.7 4.0 -10.0 -32.0 52 52 H S > - 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