==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 22-MAY-07 2Q0X . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA BRUCEI; . AUTHOR E.A.MERRITT,STRUCTURAL GENOMICS OF PATHOGENIC PROTOZOA CONSO . 587 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22794.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 417 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 37 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 183 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.0 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 4 2 0 1 1 1 1 0 0 2 0 1 1 2 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 4 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 PARALLEL BRIDGES PER LADDER . 1 2 0 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 8 A S 0 0 174 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 113.2 58.2 33.2 139.6 2 9 A R - 0 0 101 46,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.964 360.0 -75.3-147.6 163.5 56.0 31.6 136.9 3 10 A P - 0 0 37 0, 0.0 303,-0.2 0, 0.0 3,-0.1 -0.222 36.9-120.6 -65.1 142.6 53.1 32.4 134.5 4 11 A E - 0 0 156 1,-0.1 300,-0.1 301,-0.1 47,-0.0 -0.313 53.1 -77.2 -61.1 156.9 49.5 32.8 135.4 5 12 A P - 0 0 27 0, 0.0 2,-0.4 0, 0.0 300,-0.2 -0.365 53.2-136.8 -57.3 141.2 47.2 30.4 133.6 6 13 A V E -A 304 0A 23 298,-2.5 298,-2.8 -3,-0.1 2,-0.2 -0.839 7.6-125.3-108.4 143.5 46.6 31.5 130.0 7 14 A Q E +A 303 0A 100 -2,-0.4 2,-0.3 296,-0.2 296,-0.2 -0.568 48.4 124.3 -83.3 145.9 43.3 31.6 128.1 8 15 A G E -A 302 0A 5 294,-1.8 294,-2.2 -2,-0.2 2,-0.4 -0.951 56.0 -84.4-177.5-174.5 42.9 29.9 124.7 9 16 A H E -AB 301 25A 66 16,-2.6 16,-2.7 -2,-0.3 2,-0.4 -0.937 33.8-157.2-117.5 134.6 40.9 27.3 122.9 10 17 A L E +AB 300 24A 0 290,-3.1 290,-2.3 -2,-0.4 2,-0.3 -0.917 21.0 152.8-113.3 135.2 41.5 23.6 123.0 11 18 A F E - B 0 23A 18 12,-2.1 12,-2.9 -2,-0.4 2,-0.3 -0.936 27.4-138.1-144.4 173.6 40.6 20.9 120.5 12 19 A T E - B 0 22A 5 -2,-0.3 2,-0.4 10,-0.2 327,-0.0 -0.955 7.2-156.8-127.0 149.6 41.7 17.6 119.3 13 20 A Y E - B 0 21A 15 8,-1.6 8,-2.4 -2,-0.3 2,-0.4 -0.981 30.3-106.7-124.7 146.3 42.0 16.1 115.8 14 21 A Y E + B 0 20A 109 -2,-0.4 6,-0.2 6,-0.2 -2,-0.0 -0.565 32.1 173.7 -77.6 123.6 41.9 12.4 115.0 15 22 A K E S- 0 0 39 4,-2.1 -1,-0.2 1,-0.6 5,-0.2 0.668 82.7 -28.2 -85.6 -25.5 45.2 10.7 114.0 16 23 A D E > S- B 0 19A 58 3,-1.1 2,-0.8 -3,-0.1 3,-0.7 -0.883 84.1 -78.2 172.7 155.6 43.5 7.4 114.2 17 24 A P T 3 S+ 0 0 92 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 0.185 128.3 38.8 -70.1 25.2 40.5 6.1 116.2 18 25 A Y T 3 S+ 0 0 77 -2,-0.8 2,-0.5 1,-0.3 544,-0.1 0.499 109.9 56.1-136.4 -31.1 42.7 5.6 119.4 19 26 A C E < -B 16 0A 21 -3,-0.7 -4,-2.1 317,-0.1 -3,-1.1 -0.956 59.3-176.2-112.3 120.8 45.0 8.6 119.4 20 27 A K E -B 14 0A 25 -2,-0.5 -6,-0.2 -6,-0.2 318,-0.1 -0.902 19.8-137.0-109.7 148.1 43.7 12.2 119.3 21 28 A I E -B 13 0A 4 -8,-2.4 -8,-1.6 -2,-0.4 2,-0.2 -0.926 13.9-138.2-110.5 115.6 46.1 15.1 119.1 22 29 A P E -B 12 0A 5 0, 0.0 45,-1.3 0, 0.0 2,-0.4 -0.547 17.4-170.6 -72.7 140.9 45.5 18.1 121.3 23 30 A V E -BC 11 66A 0 -12,-2.9 -12,-2.1 -2,-0.2 2,-0.6 -1.000 6.8-160.5-134.0 125.6 45.9 21.6 119.9 24 31 A F E -BC 10 65A 0 41,-2.5 41,-2.1 -2,-0.4 2,-0.4 -0.953 11.1-167.8-111.9 117.5 45.9 24.7 122.0 25 32 A M E -BC 9 64A 6 -16,-2.7 -16,-2.6 -2,-0.6 2,-0.4 -0.863 2.9-169.3-106.8 137.9 45.2 28.0 120.1 26 33 A M E + C 0 63A 9 37,-2.4 37,-2.3 -2,-0.4 -18,-0.1 -0.982 65.4 1.3-125.3 135.7 45.7 31.5 121.6 27 34 A N > + 0 0 43 -2,-0.4 3,-1.3 35,-0.2 32,-0.3 0.909 62.1 170.9 62.4 52.9 44.6 34.9 120.0 28 35 A M T 3 + 0 0 45 1,-0.3 -1,-0.1 -3,-0.1 34,-0.1 0.308 56.6 94.5 -81.6 6.8 42.9 33.6 116.9 29 36 A D T 3 S+ 0 0 116 32,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.792 72.8 84.0 -59.0 -29.7 41.6 37.1 116.2 30 37 A A S < S- 0 0 12 -3,-1.3 31,-0.1 1,-0.1 30,-0.1 -0.182 85.1-131.0 -68.8 168.7 44.7 37.3 114.0 31 38 A R S S+ 0 0 44 29,-0.4 70,-3.4 28,-0.1 71,-0.3 0.092 85.2 36.6-113.2 23.6 44.6 35.9 110.5 32 39 A R S S- 0 0 31 68,-0.3 30,-2.8 69,-0.2 2,-0.3 -0.952 72.1-145.0-164.8 160.2 47.8 33.9 110.6 33 40 A C E -de 62 103A 0 69,-2.0 71,-2.6 -2,-0.3 2,-0.5 -0.972 19.2-132.1-140.4 148.5 49.7 31.9 113.2 34 41 A V E -de 63 104A 0 28,-2.7 30,-3.1 -2,-0.3 2,-0.5 -0.886 33.0-157.9 -85.5 126.0 52.9 30.8 114.7 35 42 A L E -de 64 105A 0 69,-2.6 71,-3.3 -2,-0.5 2,-0.4 -0.959 4.6-158.0-112.3 122.4 52.7 27.0 115.1 36 43 A W E +de 65 106A 1 28,-2.8 30,-1.7 -2,-0.5 2,-0.3 -0.822 16.0 171.7-104.7 132.6 55.0 25.3 117.6 37 44 A V E + e 0 107A 0 69,-2.1 71,-1.6 -2,-0.4 2,-0.2 -0.989 15.4 177.3-132.9 143.0 56.1 21.7 117.7 38 45 A G - 0 0 1 28,-0.4 71,-0.1 -2,-0.3 30,-0.1 -0.465 32.4 -50.8-127.8-165.7 58.7 20.4 120.1 39 46 A G > - 0 0 1 -2,-0.2 3,-1.4 71,-0.1 29,-0.3 -0.178 57.0-101.9 -67.6 168.2 60.6 17.5 121.4 40 47 A Q T 3 S+ 0 0 1 139,-0.4 327,-0.4 1,-0.3 140,-0.1 0.783 123.7 45.3 -67.1 -27.9 59.0 14.3 122.5 41 48 A T T 3 S+ 0 0 27 138,-0.3 2,-0.5 325,-0.1 273,-0.3 0.222 91.6 103.1 -99.4 9.5 59.4 15.2 126.2 42 49 A E < - 0 0 24 -3,-1.4 26,-0.2 271,-0.1 -4,-0.2 -0.847 57.6-157.5 -95.6 130.8 58.3 18.8 125.7 43 50 A S > - 0 0 8 -2,-0.5 3,-1.3 1,-0.2 4,-0.1 -0.445 37.4 -68.8 -94.7 168.6 54.7 19.6 126.8 44 51 A L T 3 S+ 0 0 0 1,-0.3 -1,-0.2 -2,-0.1 23,-0.0 -0.351 129.0 18.0 -49.1 140.4 52.2 22.3 125.9 45 52 A L T 3 S+ 0 0 8 1,-0.1 -1,-0.3 -3,-0.1 6,-0.1 0.841 79.9 163.8 53.6 40.3 53.7 25.6 127.2 46 53 A S < + 0 0 21 -3,-1.3 2,-0.5 1,-0.1 -2,-0.1 0.837 65.8 50.7 -54.2 -38.5 57.1 23.9 127.5 47 54 A F S > S- 0 0 20 1,-0.1 3,-1.6 -4,-0.1 4,-0.3 -0.935 76.5-147.6-105.3 125.3 58.7 27.3 127.8 48 55 A D T > S+ 0 0 23 -2,-0.5 3,-2.0 1,-0.3 4,-0.5 0.887 97.9 66.6 -53.2 -40.9 57.2 29.7 130.3 49 56 A Y T 3> S+ 0 0 1 1,-0.3 4,-3.1 2,-0.2 3,-0.3 0.664 77.9 82.1 -60.9 -18.6 58.1 32.6 127.9 50 57 A F H <> S+ 0 0 0 -3,-1.6 4,-2.5 1,-0.2 -1,-0.3 0.771 87.2 57.2 -51.2 -31.9 55.5 31.3 125.4 51 58 A T H <> S+ 0 0 17 -3,-2.0 4,-1.8 -4,-0.3 -1,-0.2 0.914 111.3 41.2 -65.8 -42.1 52.9 33.1 127.5 52 59 A N H > S+ 0 0 74 -4,-0.5 4,-2.6 -3,-0.3 -2,-0.2 0.909 114.6 52.3 -71.8 -46.0 54.8 36.4 127.0 53 60 A L H X S+ 0 0 0 -4,-3.1 4,-2.7 2,-0.2 5,-0.2 0.948 111.5 45.7 -46.0 -59.1 55.5 35.5 123.3 54 61 A A H X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.888 112.8 52.0 -59.0 -39.7 51.8 34.9 122.6 55 62 A E H < S+ 0 0 130 -4,-1.8 3,-0.4 2,-0.2 -1,-0.2 0.914 111.7 45.0 -60.6 -47.5 50.9 38.1 124.5 56 63 A E H < S+ 0 0 117 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.878 113.3 51.1 -66.4 -38.3 53.4 40.2 122.4 57 64 A L H >X S+ 0 0 1 -4,-2.7 3,-2.5 -5,-0.2 4,-2.4 0.653 82.6 125.6 -67.8 -21.1 52.2 38.6 119.2 58 65 A Q T 3< S+ 0 0 112 -4,-1.0 4,-0.1 -3,-0.4 -30,-0.1 -0.138 74.8 18.8 -54.6 133.5 48.5 39.3 120.0 59 66 A G T 34 S+ 0 0 52 -32,-0.3 -1,-0.3 2,-0.1 -28,-0.1 0.166 131.3 49.1 91.3 -13.8 46.7 41.2 117.2 60 67 A D T <4 S+ 0 0 70 -3,-2.5 -29,-0.4 1,-0.4 2,-0.4 0.726 118.7 11.7-124.5 -56.3 49.4 40.2 114.7 61 68 A W < - 0 0 0 -4,-2.4 -1,-0.4 -7,-0.2 -28,-0.3 -0.996 66.1-134.7-127.0 138.2 50.0 36.4 115.0 62 69 A A E - d 0 33A 0 -30,-2.8 -28,-2.7 -2,-0.4 2,-0.5 -0.401 23.0-133.0 -71.7 162.6 48.0 33.8 116.8 63 70 A F E -Cd 26 34A 0 -37,-2.3 -37,-2.4 -30,-0.2 2,-0.4 -0.991 25.5-177.2-125.6 117.6 50.1 31.3 118.8 64 71 A V E -Cd 25 35A 0 -30,-3.1 -28,-2.8 -2,-0.5 2,-0.4 -0.961 5.4-168.3-122.0 138.8 49.2 27.6 118.3 65 72 A Q E -Cd 24 36A 0 -41,-2.1 -41,-2.5 -2,-0.4 2,-0.4 -0.981 4.5-178.5-128.9 135.3 50.8 24.6 120.1 66 73 A V E -C 23 0A 0 -30,-1.7 2,-0.6 -2,-0.4 -28,-0.4 -0.975 26.1-127.0-129.7 143.6 50.5 20.9 119.3 67 74 A E - 0 0 6 -45,-1.3 -24,-0.1 -2,-0.4 -27,-0.1 -0.848 33.2-113.7 -90.1 123.5 52.0 18.0 121.2 68 75 A V > - 0 0 3 -2,-0.6 3,-2.1 -29,-0.3 4,-0.2 -0.355 21.0-136.6 -50.5 122.9 54.0 15.6 118.9 69 76 A P G > S+ 0 0 12 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.808 102.8 60.9 -56.3 -36.4 52.0 12.3 118.8 70 77 A S G 3 S+ 0 0 1 1,-0.3 5,-0.1 9,-0.1 114,-0.1 0.515 87.7 74.9 -70.4 -8.0 55.3 10.3 119.2 71 78 A G G < S+ 0 0 0 -3,-2.1 296,-2.8 -32,-0.1 2,-0.3 0.619 90.0 76.6 -72.6 -14.7 55.8 12.1 122.5 72 79 A K B X S-P 366 0B 25 -3,-1.7 3,-1.1 294,-0.2 294,-0.2 -0.721 89.2-109.4-101.8 146.5 53.0 9.8 123.9 73 80 A I T 3 S+ 0 0 3 292,-2.4 -1,-0.1 261,-0.4 -2,-0.1 -0.370 104.9 30.4 -56.2 146.0 53.0 6.1 124.9 74 81 A G T 3 S+ 0 0 25 1,-0.1 -1,-0.2 -4,-0.1 -4,-0.1 0.566 76.8 130.7 78.3 12.9 51.1 4.0 122.4 75 82 A S S < S- 0 0 13 -3,-1.1 -2,-0.1 -5,-0.1 -5,-0.1 0.670 82.8 -98.0 -72.1 -17.4 51.8 6.2 119.4 76 83 A G - 0 0 55 1,-0.1 91,-0.1 2,-0.1 2,-0.1 -0.263 61.0 -82.6 159.6 -67.4 52.9 3.3 117.2 77 84 A P S S- 0 0 32 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.390 70.6-145.1 -79.9 142.4 55.8 4.0 117.9 78 85 A Q - 0 0 23 -2,-0.1 103,-0.1 1,-0.1 -2,-0.1 -0.575 5.3-144.0 -90.2 129.2 55.8 6.7 115.2 79 86 A D > - 0 0 48 -2,-0.3 4,-1.8 1,-0.1 3,-0.2 -0.143 36.9 -94.4 -75.0-179.4 58.8 7.7 113.0 80 87 A H H > S+ 0 0 6 104,-0.4 4,-2.3 103,-0.3 5,-0.1 0.798 119.2 58.8 -77.0 -28.9 59.4 11.3 112.0 81 88 A A H > S+ 0 0 33 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.868 109.5 45.3 -65.2 -36.8 57.7 11.2 108.6 82 89 A H H > S+ 0 0 94 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.894 111.4 50.5 -76.9 -41.0 54.4 10.2 110.2 83 90 A D H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.926 112.0 50.2 -53.5 -49.7 54.7 12.8 113.0 84 91 A A H X S+ 0 0 4 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.902 108.7 51.6 -53.6 -48.5 55.3 15.4 110.1 85 92 A E H X S+ 0 0 110 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.896 108.4 50.6 -57.2 -47.0 52.3 14.1 108.3 86 93 A D H X S+ 0 0 11 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.901 111.0 49.5 -57.5 -43.6 50.1 14.6 111.4 87 94 A V H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.888 108.3 53.5 -61.9 -38.9 51.5 18.1 111.7 88 95 A D H X S+ 0 0 15 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.874 105.0 54.4 -64.6 -38.7 50.7 18.8 108.0 89 96 A D H X S+ 0 0 79 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.855 108.3 49.7 -58.6 -39.4 47.1 17.6 108.6 90 97 A L H X S+ 0 0 0 -4,-1.4 4,-3.1 2,-0.2 5,-0.2 0.936 107.3 53.7 -67.2 -44.5 46.9 20.2 111.4 91 98 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.937 108.9 50.1 -52.8 -49.0 48.3 22.9 109.1 92 99 A G H X S+ 0 0 8 -4,-2.4 4,-2.5 2,-0.2 5,-0.4 0.891 110.5 49.1 -52.9 -46.6 45.5 22.0 106.7 93 100 A I H X>S+ 0 0 33 -4,-1.9 4,-2.9 1,-0.2 5,-0.6 0.932 111.6 49.0 -60.0 -47.7 42.9 22.3 109.4 94 101 A L H X5S+ 0 0 0 -4,-3.1 6,-1.6 3,-0.2 4,-1.2 0.900 112.5 48.2 -60.0 -42.5 44.2 25.7 110.5 95 102 A L H <5S+ 0 0 32 -4,-2.5 4,-0.3 -5,-0.2 5,-0.2 0.969 124.3 27.4 -64.9 -53.5 44.2 27.1 107.0 96 103 A R H <5S+ 0 0 177 -4,-2.5 3,-0.2 -5,-0.2 -2,-0.2 0.894 130.5 35.1 -82.0 -35.5 40.7 26.0 106.0 97 104 A D H <5S+ 0 0 82 -4,-2.9 -3,-0.2 -5,-0.4 -2,-0.1 0.722 122.7 37.0 -96.5 -18.8 38.9 25.9 109.4 98 105 A H S < - f 0 134A 1 -71,-1.6 3,-2.0 -2,-0.4 4,-0.2 -0.889 58.9 -16.9-116.1 155.6 62.3 23.5 119.3 109 116 A S G > S- 0 0 25 25,-0.6 3,-1.3 -2,-0.3 84,-0.2 -0.176 133.2 -8.8 57.5-136.3 64.5 20.4 120.1 110 117 A T G > S+ 0 0 0 1,-0.2 3,-1.0 69,-0.2 4,-0.5 0.489 118.1 86.6 -74.4 -0.6 63.8 17.3 118.1 111 118 A G G X> S+ 0 0 0 -3,-2.0 4,-1.2 1,-0.2 3,-1.0 0.785 75.5 70.5 -62.5 -28.7 60.6 19.0 116.7 112 119 A T H <> S+ 0 0 0 -3,-1.3 4,-1.7 1,-0.3 -1,-0.2 0.779 85.7 65.4 -59.3 -31.4 63.0 20.5 114.1 113 120 A Q H <> S+ 0 0 1 -3,-1.0 4,-1.3 78,-1.0 77,-0.3 0.844 102.3 49.0 -54.8 -39.6 63.3 17.0 112.5 114 121 A L H <> S+ 0 0 0 -3,-1.0 4,-2.8 -4,-0.5 -1,-0.2 0.833 105.0 57.8 -71.3 -34.2 59.6 17.3 111.7 115 122 A V H X S+ 0 0 0 -4,-1.2 4,-3.0 2,-0.2 -2,-0.2 0.908 105.4 48.4 -67.4 -41.1 60.0 20.7 110.1 116 123 A F H X S+ 0 0 4 -4,-1.7 4,-1.2 2,-0.2 -1,-0.2 0.919 115.2 45.9 -65.5 -42.3 62.6 19.6 107.5 117 124 A E H X S+ 0 0 34 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.900 114.4 48.9 -62.1 -45.4 60.4 16.6 106.6 118 125 A L H >X S+ 0 0 4 -4,-2.8 4,-2.7 1,-0.2 3,-0.5 0.951 107.5 53.9 -56.5 -55.7 57.3 18.9 106.4 119 126 A L H 3< S+ 0 0 14 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.736 112.5 43.7 -59.2 -27.3 59.0 21.5 104.3 120 127 A E H 3< S+ 0 0 79 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.776 129.6 24.0 -85.7 -26.6 60.0 19.0 101.6 121 128 A N H << S+ 0 0 101 -4,-1.5 -2,-0.2 -3,-0.5 -3,-0.2 0.383 83.1 134.2-121.6 0.8 56.7 17.1 101.5 122 129 A S >< - 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