==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MOTOR PROTEIN 08-JUN-08 2VVG . COMPND 2 MOLECULE: KINESIN-2; . SOURCE 2 ORGANISM_SCIENTIFIC: GIARDIA INTESTINALIS; . AUTHOR J.C.HOENG,J.LOEWE,S.C.DAWSON,W.Z.CANDE,M.S.SAGOLLA, . 613 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27691.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 436 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 120 19.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 5 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 . 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 . 46 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.4 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 0 6 0 2 1 1 0 0 0 0 7 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 0 2 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 . 9 1 2 8 0 0 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 0 0 0 0 0 0 2 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 D 0 0 109 0, 0.0 294,-2.7 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-161.2 -3.9 31.9 31.4 2 5 A N B -A 294 0A 53 292,-0.3 292,-0.3 1,-0.1 262,-0.2 -0.160 360.0 -99.0 -64.4 154.4 -6.3 30.9 28.6 3 6 A I - 0 0 3 290,-2.4 2,-0.3 287,-0.4 262,-0.2 -0.505 43.3-120.4 -68.9 139.1 -8.5 27.8 28.5 4 7 A K E -b 265 0B 89 260,-3.0 262,-2.9 -2,-0.2 2,-0.4 -0.627 29.2-164.4 -84.0 143.1 -6.9 25.2 26.4 5 8 A V E +b 266 0B 0 -2,-0.3 40,-2.4 260,-0.2 41,-0.9 -0.986 11.4 173.7-135.3 127.5 -8.8 23.9 23.4 6 9 A I E -bc 267 46B 2 260,-2.7 262,-3.1 -2,-0.4 2,-0.4 -0.890 18.4-144.1-125.6 159.2 -8.3 20.8 21.3 7 10 A V E -bc 268 47B 0 39,-1.6 41,-2.7 -2,-0.3 2,-0.5 -0.984 10.2-167.2-125.5 134.3 -10.3 19.3 18.5 8 11 A R E -bc 269 48B 16 260,-2.4 262,-2.5 -2,-0.4 2,-0.5 -0.984 2.0-165.1-124.8 123.2 -10.7 15.6 17.9 9 12 A C E -b 270 0B 4 39,-2.9 43,-0.3 -2,-0.5 262,-0.2 -0.922 13.6-150.4-106.6 126.0 -12.2 14.2 14.6 10 13 A R - 0 0 37 260,-1.8 40,-0.3 -2,-0.5 41,-0.1 -0.328 27.9 -89.0 -87.5 173.2 -13.2 10.6 14.7 11 14 A P - 0 0 68 0, 0.0 -1,-0.1 0, 0.0 262,-0.1 -0.395 56.5 -83.6 -76.3 162.9 -13.2 8.2 11.8 12 15 A L - 0 0 48 260,-0.1 2,-0.1 259,-0.1 11,-0.0 -0.429 54.0-135.9 -62.5 140.1 -16.4 7.9 9.7 13 16 A N > - 0 0 42 -3,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.242 25.1 -90.4 -91.4-174.5 -18.8 5.5 11.4 14 17 A A H > S+ 0 0 52 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.925 123.6 49.0 -61.5 -49.2 -20.9 2.7 10.0 15 18 A R H > S+ 0 0 145 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.944 114.8 44.7 -56.7 -51.1 -24.0 4.8 9.3 16 19 A E H 4>S+ 0 0 5 1,-0.2 5,-2.9 2,-0.2 -1,-0.2 0.888 114.0 49.6 -62.2 -41.3 -22.0 7.5 7.5 17 20 A T H ><5S+ 0 0 78 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.927 111.8 47.5 -65.2 -45.1 -19.9 5.0 5.5 18 21 A R H 3<5S+ 0 0 204 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.780 109.7 53.1 -68.3 -27.0 -23.0 3.1 4.3 19 22 A E T 3<5S- 0 0 126 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.281 115.8-117.4 -90.8 10.6 -24.8 6.3 3.3 20 23 A N T < 5 + 0 0 144 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.830 51.5 170.6 58.8 37.0 -21.7 7.2 1.2 21 24 A A < - 0 0 14 -5,-2.9 2,-0.3 -6,-0.1 -1,-0.2 -0.455 25.9-131.7 -74.2 151.1 -20.9 10.3 3.2 22 25 A L - 0 0 103 -2,-0.1 252,-1.7 250,-0.0 2,-0.7 -0.766 16.4-109.4-107.3 154.0 -17.6 11.9 2.4 23 26 A N B +L 273 0C 48 -2,-0.3 250,-0.2 250,-0.2 248,-0.0 -0.725 34.7 175.0 -81.6 115.1 -14.9 13.0 4.8 24 27 A I + 0 0 11 248,-2.9 13,-3.1 -2,-0.7 2,-0.5 0.207 48.3 97.0-104.7 13.1 -14.8 16.8 4.7 25 28 A I E +M 36 0D 15 247,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.909 43.6 175.9-112.9 128.6 -12.2 17.3 7.5 26 29 A R E -M 35 0D 106 9,-2.4 9,-3.5 -2,-0.5 2,-0.4 -0.955 10.4-164.1-124.7 143.1 -8.5 17.8 6.9 27 30 A M E -M 34 0D 38 -2,-0.4 2,-0.5 7,-0.2 7,-0.2 -0.976 21.0-162.3-133.4 146.6 -6.0 18.5 9.7 28 31 A D E > > -M 33 0D 77 5,-2.3 5,-2.3 -2,-0.4 3,-0.9 -0.888 13.8-176.2-122.0 91.0 -2.4 19.8 9.9 29 32 A E G > 5S+ 0 0 68 -2,-0.5 3,-0.7 1,-0.2 18,-0.2 0.815 78.6 63.4 -62.0 -29.5 -1.4 18.6 13.4 30 33 A A G 3 5S+ 0 0 106 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.831 115.7 30.7 -64.5 -31.4 2.0 20.4 13.1 31 34 A S G < 5S- 0 0 42 -3,-0.9 -1,-0.2 2,-0.1 -2,-0.2 0.272 109.6-121.0-108.7 8.9 0.2 23.7 12.9 32 35 A A T < 5 + 0 0 14 -3,-0.7 12,-2.5 -4,-0.4 2,-0.4 0.878 62.1 149.8 52.5 44.6 -2.8 22.6 15.1 33 36 A Q E < -MN 28 43D 63 -5,-2.3 -5,-2.3 10,-0.2 2,-0.4 -0.860 36.5-163.2-114.4 143.5 -5.2 23.4 12.3 34 37 A V E -MN 27 42D 0 8,-2.2 8,-2.6 -2,-0.4 2,-0.5 -0.988 11.6-161.3-121.0 130.3 -8.5 21.9 11.3 35 38 A I E -MN 26 41D 23 -9,-3.5 -9,-2.4 -2,-0.4 2,-0.7 -0.963 5.3-155.7-118.6 124.9 -9.8 22.5 7.8 36 39 A V E MN 25 40D 0 4,-3.1 4,-1.5 -2,-0.5 -11,-0.2 -0.885 360.0 360.0-102.4 113.6 -13.5 22.1 6.9 37 40 A D 0 0 90 -13,-3.1 -1,-0.2 -2,-0.7 -12,-0.1 0.903 360.0 360.0 -82.2 360.0 -14.0 21.5 3.2 38 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 39 55 A P 0 0 112 0, 0.0 2,-0.5 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 154.3 -12.3 26.0 3.1 40 56 A R E -N 36 0D 103 -4,-1.5 -4,-3.1 2,-0.0 2,-0.4 -0.703 360.0-164.9 -83.1 128.1 -12.8 27.3 6.6 41 57 A T E -N 35 0D 47 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.918 8.3-172.2-120.1 140.5 -9.7 26.8 8.7 42 58 A F E -N 34 0D 4 -8,-2.6 -8,-2.2 -2,-0.4 2,-0.4 -0.942 11.7-148.1-128.5 151.3 -9.3 27.0 12.5 43 59 A T E +N 33 0D 64 -2,-0.3 -10,-0.2 -10,-0.2 2,-0.2 -0.980 24.8 163.7-122.6 129.6 -6.3 27.0 14.8 44 60 A F - 0 0 11 -12,-2.5 -38,-0.2 -2,-0.4 3,-0.1 -0.557 54.6 -88.2-127.3-168.5 -6.4 25.5 18.3 45 61 A D S S- 0 0 82 -40,-2.4 2,-0.3 1,-0.3 -39,-0.2 0.815 107.5 -11.5 -76.8 -28.4 -3.9 24.3 20.9 46 62 A A E -c 6 0B 19 -41,-0.9 -39,-1.6 -14,-0.2 2,-0.4 -0.954 61.5-153.4-165.8 149.1 -3.9 20.8 19.3 47 63 A V E -c 7 0B 4 -2,-0.3 2,-0.4 -18,-0.2 -39,-0.2 -0.978 6.1-161.9-130.7 145.6 -5.8 18.8 16.8 48 64 A Y E -c 8 0B 22 -41,-2.7 -39,-2.9 -2,-0.4 2,-0.1 -0.992 8.2-160.2-130.7 124.8 -6.3 15.1 16.5 49 65 A D > - 0 0 42 -2,-0.4 3,-2.2 -41,-0.2 -23,-0.0 -0.175 45.7 -75.5 -92.2-170.9 -7.5 13.3 13.4 50 66 A Q T 3 S+ 0 0 36 1,-0.3 410,-0.2 -40,-0.3 -40,-0.1 0.615 126.7 62.1 -62.0 -12.4 -9.0 9.8 12.9 51 67 A T T 3 S+ 0 0 16 -41,-0.1 411,-1.2 410,-0.1 -1,-0.3 0.459 82.0 105.5 -92.6 -1.4 -5.6 8.2 13.4 52 68 A S < - 0 0 12 -3,-2.2 2,-0.3 -43,-0.3 408,-0.1 -0.554 57.0-151.4 -82.2 143.9 -5.3 9.5 17.0 53 69 A C > - 0 0 43 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.749 26.6-110.7-111.9 160.5 -5.7 7.1 19.9 54 70 A N H > S+ 0 0 3 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.876 115.8 53.6 -54.9 -43.0 -6.9 7.8 23.4 55 71 A Y H > S+ 0 0 121 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.920 108.2 48.8 -61.5 -44.7 -3.5 7.2 24.9 56 72 A G H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.890 110.6 50.0 -63.7 -40.6 -1.8 9.7 22.7 57 73 A I H X>S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-1.5 0.895 110.8 51.4 -66.0 -38.0 -4.3 12.4 23.4 58 74 A F H <>S+ 0 0 6 -4,-2.1 5,-3.5 -5,-0.2 -2,-0.2 0.966 110.5 46.5 -63.2 -51.0 -3.9 11.8 27.1 59 75 A Q H <5S+ 0 0 66 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.887 123.0 34.7 -59.2 -40.1 -0.1 12.0 27.1 60 76 A A H <5S+ 0 0 63 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.867 135.8 9.8 -85.0 -39.5 -0.1 15.2 25.0 61 77 A S T <5S+ 0 0 12 -4,-2.9 4,-0.4 -5,-0.3 -3,-0.2 0.803 127.2 39.1-112.9 -41.1 -3.2 17.1 26.1 62 78 A F T >>> S+ 0 0 63 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.839 104.8 52.3 -55.6 -33.3 -0.8 18.3 32.1 65 81 A L H <> S+ 0 0 12 -3,-1.4 4,-1.2 -4,-0.4 -2,-0.2 0.828 109.9 47.9 -72.6 -31.4 -4.2 19.0 33.6 66 82 A I H S+ 0 0 3 -4,-1.5 5,-2.6 -5,-0.3 4,-0.4 0.899 104.7 47.6 -63.2 -41.0 -1.9 20.4 37.7 69 85 A V H ><5S+ 0 0 1 -4,-1.2 3,-1.4 1,-0.2 -1,-0.2 0.898 107.0 56.5 -67.4 -39.1 -4.3 18.9 40.3 70 86 A L H 3<5S+ 0 0 28 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.742 106.7 52.6 -62.3 -22.4 -1.5 16.9 41.8 71 87 A E T 3<5S- 0 0 117 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.536 131.0 -92.4 -89.8 -11.0 0.2 20.2 42.3 72 88 A G T < 5S+ 0 0 3 -3,-1.4 228,-2.5 -4,-0.4 134,-0.4 0.507 85.1 125.9 112.2 5.6 -2.7 21.8 44.1 73 89 A F < - 0 0 27 -5,-2.6 -1,-0.4 226,-0.2 2,-0.4 -0.575 61.9-118.5 -91.7 158.8 -4.5 23.4 41.2 74 90 A N - 0 0 14 224,-0.3 189,-2.7 133,-0.2 2,-0.3 -0.786 37.8-171.1 -91.4 141.4 -8.2 22.9 40.2 75 91 A S E -de 209 263B 0 133,-2.4 135,-2.4 -2,-0.4 2,-0.4 -0.997 12.9-170.5-139.1 143.7 -8.5 21.4 36.8 76 92 A T E -de 210 264B 2 187,-2.4 189,-2.5 -2,-0.3 2,-0.5 -0.998 4.9-174.6-135.9 135.0 -11.4 20.7 34.4 77 93 A I E -de 211 265B 0 133,-2.5 135,-3.0 -2,-0.4 2,-0.4 -0.997 14.2-178.4-125.2 122.4 -11.5 18.7 31.2 78 94 A F E -de 212 266B 5 187,-2.2 189,-3.2 -2,-0.5 2,-0.5 -0.983 19.5-144.2-129.1 139.2 -14.8 18.8 29.3 79 95 A A E -de 213 267B 0 133,-2.2 135,-1.8 -2,-0.4 2,-0.3 -0.865 23.3-178.2 -99.4 130.7 -15.9 17.1 26.0 80 96 A Y E + e 0 268B 12 187,-2.8 189,-2.9 -2,-0.5 2,-0.2 -0.970 23.7 91.8-131.1 142.7 -18.2 19.1 23.8 81 97 A G - 0 0 0 134,-0.4 136,-1.2 -2,-0.3 137,-0.2 -0.816 68.7 -51.2 153.4 167.0 -19.8 18.2 20.5 82 98 A Q S > S- 0 0 18 187,-0.4 3,-2.4 134,-0.3 4,-0.3 -0.191 71.3 -80.1 -65.4 156.9 -22.8 16.8 18.7 83 99 A T T 3 S+ 0 0 61 1,-0.3 -1,-0.1 2,-0.1 132,-0.0 -0.322 120.5 21.2 -56.7 134.3 -24.3 13.5 19.7 84 100 A G T 3 S+ 0 0 47 -3,-0.1 -1,-0.3 186,-0.0 -2,-0.1 0.328 90.3 111.4 88.1 -6.8 -22.3 10.7 18.1 85 101 A A S < S- 0 0 1 -3,-2.4 -75,-0.4 184,-0.1 185,-0.3 0.818 95.7 -91.9 -69.3 -32.8 -19.2 12.9 17.6 86 102 A G S > S+ 0 0 14 -4,-0.3 4,-2.0 183,-0.2 5,-0.2 0.581 79.6 132.6 130.5 19.8 -17.1 11.0 20.2 87 103 A K H > S+ 0 0 15 -5,-0.3 4,-2.8 2,-0.2 5,-0.2 0.947 82.6 40.0 -63.3 -50.3 -17.4 12.7 23.6 88 104 A T H >>S+ 0 0 68 2,-0.2 4,-3.1 1,-0.2 5,-1.5 0.874 114.5 52.9 -68.9 -36.5 -18.0 9.5 25.6 89 105 A W H 45S+ 0 0 95 3,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.895 114.0 44.4 -64.8 -38.1 -15.5 7.5 23.6 90 106 A T H <5S+ 0 0 0 -4,-2.0 10,-2.8 1,-0.1 -2,-0.2 0.912 120.6 38.1 -72.6 -43.7 -12.9 10.2 24.4 91 107 A M H <5S+ 0 0 1 -4,-2.8 10,-3.1 8,-0.3 -2,-0.2 0.871 138.6 10.8 -78.0 -35.6 -13.8 10.6 28.1 92 108 A G T <5S+ 0 0 4 -4,-3.1 7,-2.2 -5,-0.2 -3,-0.2 0.794 76.6 172.4-111.3 -41.6 -14.4 7.0 28.9 93 109 A G B < -O 98 0E 19 -5,-1.5 2,-0.3 5,-0.3 -3,-0.1 -0.336 43.0 -78.8 62.7-147.5 -13.3 4.8 26.0 94 110 A N - 0 0 70 3,-1.3 3,-0.0 -5,-0.1 0, 0.0 -0.851 42.1 -86.1-141.6 177.3 -13.4 1.1 26.8 95 111 A K S S+ 0 0 188 -2,-0.3 -1,-0.0 1,-0.2 -2,-0.0 0.871 127.5 47.4 -56.0 -39.6 -11.4 -1.5 28.6 96 112 A E S S+ 0 0 170 1,-0.3 -1,-0.2 -3,-0.0 -3,-0.0 0.873 129.9 20.9 -71.3 -37.7 -9.2 -2.1 25.6 97 113 A E S S- 0 0 52 -43,-0.0 -3,-1.3 -5,-0.0 -1,-0.3 -0.675 86.7-153.1-134.4 80.1 -8.6 1.6 24.9 98 114 A P B -O 93 0E 31 0, 0.0 -5,-0.3 0, 0.0 -6,-0.1 -0.114 11.5-137.4 -51.5 144.7 -9.3 3.6 28.1 99 115 A G > - 0 0 0 -7,-2.2 4,-2.2 -8,-0.1 -8,-0.3 -0.123 39.8 -71.1 -92.1-166.4 -10.4 7.2 27.7 100 116 A A H > S+ 0 0 2 -10,-2.8 4,-2.1 1,-0.2 -9,-0.2 0.852 126.1 54.1 -56.5 -41.8 -9.4 10.3 29.6 101 117 A I H > S+ 0 0 6 -10,-3.1 4,-2.0 2,-0.2 -1,-0.2 0.975 114.0 37.0 -62.4 -58.7 -11.2 9.4 32.8 102 118 A P H > S+ 0 0 7 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.876 116.6 54.8 -64.1 -32.3 -9.6 6.0 33.4 103 119 A N H X S+ 0 0 21 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.877 107.7 50.3 -65.6 -35.3 -6.3 7.3 32.1 104 120 A S H X S+ 0 0 0 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.889 107.9 53.1 -68.4 -39.0 -6.5 10.1 34.6 105 121 A F H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 5,-0.2 0.940 111.7 45.1 -60.0 -48.6 -7.1 7.6 37.4 106 122 A K H X S+ 0 0 81 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.922 114.8 47.8 -62.6 -45.0 -4.1 5.5 36.5 107 123 A H H X S+ 0 0 39 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.907 108.2 54.7 -64.2 -42.8 -1.9 8.6 36.1 108 124 A L H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.916 114.8 38.7 -57.1 -48.2 -3.0 10.1 39.4 109 125 A F H X S+ 0 0 10 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.784 110.9 57.5 -77.6 -26.7 -2.1 7.1 41.4 110 126 A D H X S+ 0 0 109 -4,-2.0 4,-0.9 -5,-0.2 -2,-0.2 0.915 111.7 45.2 -66.5 -39.3 1.1 6.3 39.5 111 127 A A H < S+ 0 0 29 -4,-2.3 3,-0.4 2,-0.2 4,-0.4 0.920 113.2 48.6 -67.5 -45.7 2.2 9.8 40.5 112 128 A I H >< S+ 0 0 18 -4,-2.1 3,-1.5 1,-0.2 -2,-0.2 0.910 109.1 53.4 -62.6 -41.7 1.1 9.4 44.1 113 129 A N H 3< S+ 0 0 124 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.760 106.9 53.3 -65.4 -22.6 2.9 6.0 44.3 114 130 A S T 3< S+ 0 0 99 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.488 88.9 111.2 -89.6 -2.4 6.0 7.7 43.1 115 131 A S < - 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