==== 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 HYDROLASE 16-NOV-07 3BEB . COMPND 2 MOLECULE: PENICILLIN-BINDING PROTEIN 5; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.HEILEMANN,A.J.POWELL,C.DAVIES . 354 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16942.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 84 23.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 0.3 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 . 22 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 0 0 0 1 1 0 0 1 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 1 1 3 1 1 2 2 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 . 4 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 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 4 A N 0 0 179 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -34.8 37.5 -32.0 4.4 2 5 A I > + 0 0 142 2,-0.2 3,-0.8 1,-0.1 0, 0.0 0.886 360.0 49.2 -72.0 -43.4 41.0 -30.6 5.3 3 6 A K T 3 S+ 0 0 110 1,-0.2 -1,-0.1 297,-0.0 298,-0.0 0.953 120.0 36.9 -57.9 -49.6 41.1 -28.5 2.1 4 7 A T T 3 S+ 0 0 77 2,-0.1 -1,-0.2 330,-0.0 -2,-0.2 0.174 87.7 137.6 -96.4 14.7 37.6 -27.1 2.7 5 8 A M < - 0 0 89 -3,-0.8 -3,-0.1 1,-0.0 0, 0.0 -0.280 44.9-147.1 -54.9 141.4 37.9 -26.8 6.5 6 9 A I - 0 0 156 292,-0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.984 23.8-126.5-110.7 119.3 36.5 -23.6 8.1 7 10 A P - 0 0 23 0, 0.0 2,-0.2 0, 0.0 252,-0.0 -0.306 20.0-119.2 -66.6 141.5 38.6 -22.8 11.3 8 11 A G - 0 0 63 1,-0.1 0, 0.0 -2,-0.0 0, 0.0 -0.570 27.4-121.3 -75.9 145.7 36.7 -22.4 14.5 9 12 A V - 0 0 68 -2,-0.2 3,-0.1 1,-0.1 243,-0.1 -0.724 28.8-118.0 -85.7 137.0 37.2 -18.9 16.0 10 13 A P - 0 0 43 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.290 34.6 -90.5 -67.9 162.2 38.7 -18.9 19.5 11 14 A Q - 0 0 159 2,-0.0 2,-0.5 240,-0.0 240,-0.1 -0.561 41.2-161.0 -69.7 132.5 36.8 -17.5 22.6 12 15 A I - 0 0 3 -2,-0.3 2,-1.3 2,-0.1 237,-0.0 -0.988 12.8-144.3-123.1 125.6 37.5 -13.9 23.1 13 16 A D + 0 0 66 -2,-0.5 227,-1.0 231,-0.1 228,-0.4 -0.728 66.9 91.9 -94.5 84.0 36.8 -12.4 26.5 14 17 A A E S-A 239 0A 0 -2,-1.3 225,-0.2 225,-0.2 224,-0.2 -0.919 82.2-114.9-167.4 156.3 35.6 -9.0 25.4 15 18 A E E S+ 0 0 75 222,-0.7 2,-0.3 223,-0.7 223,-0.2 0.766 96.7 6.7 -73.2 -29.5 32.2 -7.5 24.6 16 19 A S E +A 237 0A 1 221,-1.8 221,-2.3 17,-0.1 2,-0.3 -0.983 64.1 165.4-151.0 151.6 33.0 -7.0 20.9 17 20 A Y E -AB 236 31A 16 14,-1.8 14,-2.7 -2,-0.3 2,-0.3 -0.957 9.8-171.5-159.9 158.2 35.8 -7.7 18.5 18 21 A I E -AB 235 30A 0 217,-1.4 217,-1.9 -2,-0.3 2,-0.4 -0.963 7.6-159.6-142.7 156.0 36.5 -7.7 14.8 19 22 A L E +AB 234 29A 0 10,-1.9 9,-3.1 -2,-0.3 10,-1.2 -0.927 20.2 175.8-138.6 114.8 39.5 -9.0 12.7 20 23 A I E -AB 233 27A 4 213,-2.6 213,-2.3 -2,-0.4 2,-0.5 -0.792 34.0-119.2-118.0 156.6 40.0 -7.6 9.2 21 24 A D E > -A 232 0A 0 5,-2.0 4,-1.8 -2,-0.3 211,-0.2 -0.852 25.0-145.0 -87.5 131.2 42.6 -8.0 6.5 22 25 A Y T 4 S+ 0 0 41 209,-2.6 -1,-0.1 -2,-0.5 210,-0.1 0.893 92.5 41.6 -69.2 -40.5 43.9 -4.5 5.8 23 26 A N T 4 S+ 0 0 52 208,-0.5 271,-0.2 1,-0.1 -1,-0.2 0.955 127.7 28.2 -73.7 -46.8 44.4 -4.8 2.1 24 27 A S T 4 S- 0 0 27 2,-0.1 -2,-0.2 269,-0.1 -1,-0.1 0.735 92.0-134.7 -88.5 -23.0 41.2 -6.7 1.2 25 28 A G < + 0 0 35 -4,-1.8 2,-0.2 1,-0.3 -3,-0.1 0.542 48.7 158.4 78.2 3.2 39.0 -5.4 3.9 26 29 A K - 0 0 87 1,-0.1 -5,-2.0 -6,-0.1 2,-0.6 -0.435 41.5-132.5 -59.7 128.5 37.8 -9.0 4.5 27 30 A V E +B 20 0A 45 -7,-0.2 -7,-0.2 -2,-0.2 3,-0.1 -0.789 26.1 177.5 -86.0 118.1 36.3 -9.7 7.9 28 31 A L E + 0 0 21 -9,-3.1 2,-0.3 -2,-0.6 -1,-0.2 0.772 68.8 0.3 -94.9 -29.7 37.8 -12.9 9.1 29 32 A A E +B 19 0A 7 -10,-1.2 -10,-1.9 -20,-0.0 -1,-0.4 -0.962 66.8 170.9-162.4 141.7 36.1 -13.0 12.5 30 33 A E E -B 18 0A 94 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.986 13.8-177.7-156.3 143.1 33.5 -10.8 14.4 31 34 A Q E S-B 17 0A 69 -14,-2.7 -14,-1.8 -2,-0.3 128,-0.1 -0.921 81.9 -21.4-143.4 119.1 31.3 -10.6 17.5 32 35 A N S S+ 0 0 90 -2,-0.3 3,-0.4 -16,-0.2 127,-0.4 0.869 80.4 160.9 58.6 40.6 29.0 -7.7 18.2 33 36 A A + 0 0 3 1,-0.2 127,-2.5 -16,-0.1 128,-0.4 0.464 67.4 41.9 -82.5 -1.5 31.1 -5.5 15.9 34 37 A D S S+ 0 0 65 125,-0.1 -1,-0.2 124,-0.1 3,-0.1 0.528 80.7 119.3-115.8 -13.9 28.5 -2.8 15.3 35 38 A V S S- 0 0 78 -3,-0.4 2,-0.4 1,-0.1 124,-0.4 -0.303 72.9-112.5 -53.4 131.6 27.1 -2.4 18.8 36 39 A R + 0 0 128 122,-0.1 2,-0.3 120,-0.1 122,-0.2 -0.558 47.1 168.5 -74.9 128.5 27.7 1.1 20.0 37 40 A R B -E 157 0B 44 120,-2.9 120,-2.0 -2,-0.4 180,-0.1 -0.934 44.7 -91.3-140.8 154.0 30.3 1.4 22.8 38 41 A D - 0 0 45 -2,-0.3 200,-0.2 118,-0.2 118,-0.1 -0.559 33.2-157.7 -64.8 119.3 32.3 4.0 24.6 39 42 A P > - 0 0 0 0, 0.0 3,-2.5 0, 0.0 4,-0.3 0.510 16.6-173.1 -82.1 -1.6 35.5 4.2 22.7 40 43 A A G > S- 0 0 6 1,-0.3 3,-1.5 2,-0.2 4,-0.1 -0.199 72.7 -7.1 46.0-132.2 37.5 5.8 25.6 41 44 A S G > S+ 0 0 30 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.554 117.4 85.8 -70.1 -13.4 41.0 6.7 24.3 42 45 A L G X S+ 0 0 0 -3,-2.5 3,-1.7 1,-0.2 4,-0.3 0.725 73.6 77.6 -59.5 -17.7 40.4 5.1 20.9 43 46 A T G X> S+ 0 0 0 -3,-1.5 3,-2.0 -4,-0.3 4,-1.1 0.887 80.6 67.2 -58.0 -37.5 38.8 8.5 20.1 44 47 A K H <> S+ 0 0 3 -3,-1.4 4,-2.0 104,-0.4 -1,-0.3 0.475 83.0 73.7 -63.9 -4.5 42.4 9.9 19.7 45 48 A M H <> S+ 0 0 0 -3,-1.7 4,-1.0 2,-0.2 -1,-0.3 0.763 101.7 42.3 -72.7 -28.9 42.8 7.7 16.6 46 49 A M H <> S+ 0 0 0 -3,-2.0 4,-2.4 -4,-0.3 -2,-0.2 0.824 111.7 53.7 -85.5 -36.6 40.5 10.1 14.8 47 50 A T H X S+ 0 0 0 -4,-1.1 4,-2.2 1,-0.2 -2,-0.2 0.951 111.6 46.8 -53.6 -52.9 42.2 13.1 16.4 48 51 A S H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.842 110.2 53.7 -54.0 -40.5 45.4 11.6 15.0 49 52 A Y H X S+ 0 0 6 -4,-1.0 4,-1.8 2,-0.2 -2,-0.2 0.877 108.3 47.5 -69.9 -41.7 43.8 11.0 11.6 50 53 A V H X S+ 0 0 4 -4,-2.4 4,-2.3 2,-0.2 3,-0.3 0.972 113.3 49.1 -62.2 -53.9 42.6 14.7 11.2 51 54 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.916 112.7 47.5 -49.8 -51.6 46.1 15.9 12.2 52 55 A G H X S+ 0 0 5 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.806 109.9 52.5 -64.9 -31.8 47.7 13.6 9.7 53 56 A Q H X S+ 0 0 33 -4,-1.8 4,-0.8 -3,-0.3 -1,-0.2 0.822 110.8 48.7 -69.4 -34.1 45.3 14.6 7.0 54 57 A A H <>S+ 0 0 17 -4,-2.3 5,-2.2 2,-0.2 3,-0.4 0.916 112.2 46.8 -67.7 -45.7 46.2 18.2 7.8 55 58 A M H ><5S+ 0 0 39 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.862 109.2 55.5 -65.3 -36.4 50.0 17.5 7.7 56 59 A K H 3<5S+ 0 0 136 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.750 105.4 52.5 -63.2 -28.2 49.6 15.6 4.4 57 60 A A T 3<5S- 0 0 72 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.2 0.360 119.5-114.7 -89.6 3.6 47.9 18.7 2.9 58 61 A G T < 5S+ 0 0 61 -3,-1.2 -3,-0.2 2,-0.2 -2,-0.1 0.602 73.8 136.3 77.4 15.9 51.0 20.7 4.0 59 62 A K S - 0 0 133 -2,-0.3 3,-1.5 -3,-0.1 35,-0.4 -0.804 28.6-112.9-123.7 155.6 55.2 20.6 9.8 62 65 A E T 3 S+ 0 0 64 -2,-0.3 35,-3.4 1,-0.3 34,-0.3 0.804 118.3 51.9 -53.8 -32.2 56.5 18.4 12.7 63 66 A T T 3 S+ 0 0 107 33,-0.2 -1,-0.3 32,-0.2 2,-0.0 0.548 82.5 113.0 -88.2 -10.5 59.0 21.2 13.5 64 67 A D S < S- 0 0 46 -3,-1.5 32,-2.2 31,-0.1 2,-0.5 -0.346 70.3-120.3 -59.9 143.3 56.4 24.0 13.7 65 68 A L E -F 95 0C 92 30,-0.2 2,-0.5 31,-0.1 -1,-0.1 -0.778 20.4-157.5 -95.3 123.6 56.0 25.5 17.2 66 69 A V E -F 94 0C 2 28,-3.6 28,-2.7 -2,-0.5 2,-0.4 -0.891 11.6-142.2 -99.7 126.8 52.5 25.2 18.8 67 70 A T E -F 93 0C 87 -2,-0.5 2,-0.4 26,-0.2 26,-0.2 -0.760 20.0-127.1 -91.9 128.8 51.9 27.8 21.5 68 71 A I - 0 0 4 24,-2.6 23,-3.1 -2,-0.4 24,-0.2 -0.618 24.9-159.1 -83.8 128.4 49.9 26.3 24.4 69 72 A G > - 0 0 30 -2,-0.4 3,-1.5 21,-0.2 23,-0.1 -0.502 35.9 -93.0 -97.1 173.5 46.7 28.2 25.5 70 73 A N G > S+ 0 0 111 1,-0.3 3,-1.0 2,-0.2 6,-0.1 0.738 121.8 61.1 -51.3 -30.2 44.7 28.2 28.7 71 74 A D G 3 S+ 0 0 50 1,-0.2 -1,-0.3 42,-0.1 42,-0.1 0.750 104.8 48.0 -74.9 -22.7 42.4 25.5 27.3 72 75 A A G < S+ 0 0 0 -3,-1.5 2,-0.9 41,-0.1 -1,-0.2 0.022 78.9 123.9-103.9 21.8 45.3 23.0 27.0 73 76 A W X> - 0 0 85 -3,-1.0 3,-1.7 1,-0.2 4,-0.5 -0.776 52.2-154.9 -88.3 107.1 46.6 23.7 30.5 74 77 A A G >4 S+ 0 0 5 14,-1.8 3,-0.6 -2,-0.9 6,-0.2 0.864 91.3 33.8 -52.2 -47.0 46.7 20.3 32.1 75 78 A T G 34 S+ 0 0 88 13,-0.4 -1,-0.3 1,-0.2 14,-0.1 0.177 110.3 65.9-100.6 16.2 46.3 21.5 35.7 76 79 A G G <4 S+ 0 0 29 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.391 98.0 57.3-108.7 -0.6 44.1 24.4 34.8 77 80 A N X< - 0 0 45 -3,-0.6 3,-2.7 -4,-0.5 -1,-0.2 -0.857 63.1-162.7-137.4 94.9 41.2 22.2 33.7 78 81 A P G > S+ 0 0 114 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.605 85.4 80.0 -59.0 -7.9 39.8 19.7 36.2 79 82 A V G 3 S+ 0 0 60 1,-0.3 72,-0.1 71,-0.0 -5,-0.1 0.813 88.8 58.3 -62.6 -28.9 38.2 17.8 33.2 80 83 A F G X S+ 0 0 5 -3,-2.7 3,-1.9 -6,-0.2 -1,-0.3 0.463 78.0 134.3 -77.8 -4.7 41.7 16.4 32.8 81 84 A K T < S+ 0 0 184 -3,-1.6 3,-0.1 1,-0.3 -6,-0.0 -0.260 79.0 1.4 -55.4 121.8 41.7 14.9 36.4 82 85 A G T 3 S+ 0 0 87 1,-0.3 -1,-0.3 -2,-0.1 2,-0.1 0.276 107.8 118.7 87.1 -8.9 43.0 11.3 36.4 83 86 A S S < S- 0 0 29 -3,-1.9 -1,-0.3 1,-0.1 2,-0.1 -0.408 76.5 -86.3 -94.5 162.7 43.7 11.3 32.7 84 87 A S + 0 0 25 23,-0.2 25,-2.2 -2,-0.1 26,-0.3 -0.456 58.0 174.8 -66.1 136.9 46.9 10.8 30.6 85 88 A L - 0 0 18 23,-0.3 23,-0.1 24,-0.2 -1,-0.0 -0.988 44.9-150.4-146.9 148.2 48.6 14.2 30.3 86 89 A M - 0 0 12 -2,-0.3 -1,-0.1 21,-0.0 -2,-0.0 0.634 51.5-122.6 -85.0 -18.9 51.8 15.9 28.9 87 90 A F - 0 0 105 1,-0.2 2,-0.2 -3,-0.1 -14,-0.1 0.922 41.4-175.2 69.3 53.0 51.4 18.5 31.6 88 91 A L - 0 0 1 -16,-0.2 -14,-1.8 4,-0.0 -13,-0.4 -0.502 8.9-161.1 -74.0 144.9 51.3 21.4 29.2 89 92 A K > - 0 0 97 -16,-0.2 3,-1.3 -2,-0.2 -21,-0.3 -0.921 32.2 -87.8-121.1 151.2 51.2 24.9 30.6 90 93 A P T 3 S+ 0 0 51 0, 0.0 -21,-0.2 0, 0.0 3,-0.1 -0.146 109.4 26.2 -55.7 152.3 50.1 28.1 28.7 91 94 A G T 3 S+ 0 0 53 -23,-3.1 2,-0.1 1,-0.3 -22,-0.1 0.466 86.8 135.2 71.1 -0.3 52.6 30.1 26.7 92 95 A M < - 0 0 45 -3,-1.3 -24,-2.6 -24,-0.2 2,-0.5 -0.480 48.5-145.2 -66.9 150.6 54.7 26.9 26.2 93 96 A Q E -F 67 0C 124 -26,-0.2 -26,-0.2 -2,-0.1 -28,-0.0 -0.898 22.6-179.8-127.0 99.4 55.9 26.5 22.6 94 97 A V E -F 66 0C 5 -28,-2.7 -28,-3.6 -2,-0.5 5,-0.0 -0.816 30.6-114.6-105.5 134.7 56.1 22.8 21.7 95 98 A P E > -F 65 0C 33 0, 0.0 4,-1.4 0, 0.0 3,-0.3 -0.342 26.7-121.8 -56.5 147.9 57.1 21.4 18.3 96 99 A V H > S+ 0 0 0 -32,-2.2 4,-2.5 -35,-0.4 5,-0.3 0.912 112.6 63.7 -55.0 -41.0 54.3 19.7 16.5 97 100 A S H 4 S+ 0 0 31 -35,-3.4 4,-0.4 1,-0.3 -1,-0.2 0.868 104.6 44.8 -52.7 -43.7 56.4 16.5 16.6 98 101 A Q H > S+ 0 0 56 -3,-0.3 4,-1.8 -36,-0.3 -1,-0.3 0.817 113.0 49.9 -70.1 -36.5 56.3 16.4 20.4 99 102 A L H X S+ 0 0 0 -4,-1.4 4,-1.8 -3,-0.2 -2,-0.2 0.868 109.2 49.2 -72.9 -36.4 52.6 17.1 20.7 100 103 A I H X S+ 0 0 0 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.593 110.1 53.0 -80.1 -10.1 51.4 14.4 18.2 101 104 A R H >>S+ 0 0 41 -4,-0.4 4,-2.0 -5,-0.3 5,-1.3 0.842 105.2 54.3 -86.6 -41.8 53.6 11.9 20.0 102 105 A G H <5S+ 0 0 0 -4,-1.8 6,-2.7 3,-0.2 4,-0.5 0.908 113.8 43.0 -49.8 -46.4 52.0 12.9 23.2 103 106 A I H X5S+ 0 0 0 -4,-1.8 4,-0.8 4,-0.3 -2,-0.2 0.952 124.0 34.0 -64.8 -51.0 48.6 12.1 21.5 104 107 A N H <5S+ 0 0 3 -4,-1.5 -3,-0.2 2,-0.2 -2,-0.2 0.961 129.4 28.1 -76.6 -59.6 49.7 8.9 19.8 105 108 A L T <5S+ 0 0 3 -4,-2.0 90,-1.3 -5,-0.1 -3,-0.2 0.901 139.8 21.5 -66.4 -44.0 52.2 7.2 22.2 106 109 A Q T 4 S+ 0 0 6 -25,-2.2 4,-1.0 -2,-0.3 3,-0.5 0.767 88.1 58.7 -75.8 -30.7 44.5 14.8 26.4 110 113 A D H > S+ 0 0 0 -26,-0.3 4,-1.5 1,-0.2 3,-0.5 0.886 102.6 54.5 -64.4 -37.5 46.1 18.2 27.0 111 114 A A H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.703 101.1 62.3 -66.4 -18.7 48.1 17.7 23.8 112 115 A C H > S+ 0 0 0 -3,-0.5 4,-1.7 -4,-0.4 -1,-0.2 0.852 104.0 45.1 -75.7 -38.6 44.8 17.1 22.0 113 116 A V H X S+ 0 0 1 -4,-1.0 4,-1.8 -3,-0.5 -2,-0.2 0.837 111.2 54.4 -73.1 -36.2 43.4 20.5 22.7 114 117 A A H X S+ 0 0 5 -4,-1.5 4,-0.7 1,-0.2 -2,-0.2 0.885 113.3 41.7 -64.5 -39.6 46.7 22.1 21.7 115 118 A M H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 5,-0.2 0.776 110.7 55.7 -81.2 -34.2 46.7 20.4 18.4 116 119 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 6,-0.5 0.865 110.8 44.1 -61.4 -46.5 42.9 21.0 17.6 117 120 A D H < S+ 0 0 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