==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 24-AUG-12 4GRH . COMPND 2 MOLECULE: AMINODEOXYCHORISMATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STENOTROPHOMONAS MALTOPHILIA; . AUTHOR A.BERA,V.ATANASOVA,J.E.LADNER,J.F.PARSONS . 438 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18387.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 288 65.8 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 . 125 28.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.1 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 . 22 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 18.7 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+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 1 1 1 0 2 1 0 0 0 0 1 0 1 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 . 1 2 4 5 4 4 0 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 0 0 0 0 0 0 0 0 1 1 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 -2 A G 0 0 135 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -8.5 -29.4 77.3 45.1 2 -1 A S - 0 0 127 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.488 360.0-108.6 -75.2 127.9 -26.9 78.1 48.0 3 0 A H - 0 0 136 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 -0.065 27.5-114.6 -57.1 133.1 -24.0 75.6 48.1 4 1 A G - 0 0 48 2,-0.0 2,-0.2 1,-0.0 -1,-0.1 -0.529 34.3-147.5 -63.4 125.5 -23.8 73.0 50.9 5 2 A T - 0 0 104 -2,-0.3 85,-0.1 86,-0.0 -1,-0.0 -0.511 10.1-154.5 -90.0 165.1 -20.7 73.7 53.1 6 3 A H - 0 0 97 -2,-0.2 148,-0.4 83,-0.1 85,-0.1 -0.315 17.7-177.7-138.3 54.4 -18.6 71.1 54.9 7 4 A A - 0 0 67 146,-0.1 2,-0.2 1,-0.1 147,-0.1 -0.215 29.4-116.1 -53.5 137.5 -17.0 72.8 57.9 8 5 A P - 0 0 37 0, 0.0 145,-0.2 0, 0.0 2,-0.2 -0.553 28.4-105.6 -76.0 143.7 -14.7 70.5 59.9 9 6 A L E -A 152 0A 40 143,-1.6 143,-2.0 -2,-0.2 2,-0.4 -0.514 38.4-169.0 -61.2 132.3 -15.5 69.7 63.6 10 7 A I E -A 151 0A 91 141,-0.2 141,-0.2 -2,-0.2 -1,-0.0 -0.885 6.9-175.5-134.6 105.7 -13.1 71.7 65.9 11 8 A H E -A 150 0A 79 139,-2.0 139,-1.7 -2,-0.4 -2,-0.0 -0.856 21.7-135.9-100.9 110.3 -13.0 70.9 69.6 12 9 A P E -A 149 0A 80 0, 0.0 137,-0.2 0, 0.0 135,-0.0 -0.356 29.1-126.2 -63.1 146.7 -10.8 73.0 71.9 13 10 A L - 0 0 20 135,-2.4 135,-0.4 1,-0.1 155,-0.1 -0.717 10.2-116.8-102.1 149.6 -8.8 70.8 74.3 14 11 A P S S- 0 0 87 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 0.907 90.7 -11.2 -38.6 -65.0 -8.5 71.0 78.2 15 12 A H S S- 0 0 93 1,-0.1 132,-0.1 132,-0.1 131,-0.0 -0.951 92.4 -66.1-142.6 157.4 -4.8 71.7 78.3 16 13 A P - 0 0 57 0, 0.0 2,-0.3 0, 0.0 131,-0.1 0.018 54.5-150.2 -35.4 140.0 -1.8 71.8 76.0 17 14 A I - 0 0 18 123,-0.1 2,-0.9 129,-0.1 154,-0.0 -0.864 15.5-118.4-126.5 161.7 -0.8 68.4 74.7 18 15 A D > - 0 0 45 -2,-0.3 4,-3.5 1,-0.2 5,-0.2 -0.805 25.2-177.4-104.4 95.7 2.5 66.7 73.6 19 16 A L H > S+ 0 0 8 -2,-0.9 4,-3.7 1,-0.2 5,-0.3 0.932 83.6 53.1 -64.2 -45.7 2.1 65.7 69.9 20 17 A L H > S+ 0 0 26 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.957 114.1 43.8 -48.8 -48.6 5.6 64.1 69.8 21 18 A A H > S+ 0 0 7 1,-0.2 4,-3.3 2,-0.2 -2,-0.2 0.961 111.2 54.3 -64.2 -50.2 4.6 62.0 72.8 22 19 A L H X S+ 0 0 15 -4,-3.5 4,-1.6 1,-0.2 -1,-0.2 0.896 112.1 43.7 -50.4 -45.5 1.2 61.3 71.4 23 20 A Q H < S+ 0 0 0 -4,-3.7 7,-0.3 2,-0.2 -1,-0.2 0.908 111.5 52.6 -66.8 -44.4 2.8 60.0 68.2 24 21 A Q H < S+ 0 0 75 -4,-3.1 -2,-0.2 -5,-0.3 -1,-0.2 0.890 107.6 55.6 -57.7 -36.3 5.4 58.0 70.0 25 22 A H H < S+ 0 0 107 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.881 129.7 7.5 -58.7 -46.4 2.5 56.5 72.0 26 23 A D >X + 0 0 49 -4,-1.6 4,-1.5 -5,-0.2 3,-1.3 -0.637 65.8 170.6-144.4 81.1 0.6 55.2 68.9 27 24 A P G >4 S+ 0 0 53 0, 0.0 3,-0.8 0, 0.0 220,-0.2 0.942 80.6 58.6 -66.8 -45.1 2.6 55.7 65.7 28 25 A A G 34 S+ 0 0 83 1,-0.3 24,-0.1 2,-0.1 22,-0.1 0.740 110.7 43.7 -44.0 -32.6 0.1 53.6 63.7 29 26 A R G <4 S+ 0 0 66 -3,-1.3 21,-2.2 1,-0.2 -1,-0.3 0.747 119.4 41.0 -92.1 -24.5 -2.6 56.1 64.6 30 27 A F << + 0 0 0 -4,-1.5 -1,-0.2 -3,-0.8 19,-0.2 -0.644 65.0 168.0-124.2 73.1 -0.5 59.3 64.1 31 28 A P + 0 0 1 0, 0.0 216,-2.9 0, 0.0 2,-0.4 0.658 62.2 36.0 -70.4 -8.7 1.6 58.8 60.9 32 29 A L E -BC 48 246A 0 16,-0.7 16,-2.6 214,-0.2 2,-0.4 -0.955 52.5-175.7-154.8 130.4 2.7 62.4 60.5 33 30 A L E -BC 47 245A 2 212,-2.2 212,-2.4 -2,-0.4 2,-0.4 -0.954 11.6-176.2-124.8 142.8 3.8 65.3 62.5 34 31 A M E -BC 46 244A 10 12,-2.4 12,-2.2 -2,-0.4 2,-0.4 -0.999 10.0-158.4-143.4 136.0 4.6 68.7 61.2 35 32 A E E +BC 45 243A 25 208,-3.0 208,-1.6 -2,-0.4 2,-0.3 -0.913 17.1 172.8-117.9 149.0 5.9 71.9 62.7 36 33 A S E -B 44 0A 20 8,-2.4 8,-2.3 -2,-0.4 2,-0.4 -0.901 29.1-134.9-147.2 160.5 5.5 75.3 61.3 37 34 A T E -B 43 0A 47 -2,-0.3 6,-0.2 6,-0.2 2,-0.0 -0.989 27.0-143.7-122.7 115.8 6.1 79.0 62.2 38 35 A A 0 0 37 4,-2.8 -2,-0.0 -2,-0.4 6,-0.0 -0.322 360.0 360.0 -70.2 159.5 3.2 81.3 61.2 39 36 A S 0 0 159 2,-0.1 -1,-0.1 -2,-0.0 0, 0.0 0.879 360.0 360.0 -88.2 360.0 3.8 84.9 59.9 40 ! 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 41 40 A Q 0 0 114 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 -92.7 2.0 84.3 65.3 42 41 A G + 0 0 13 199,-0.0 -4,-2.8 -6,-0.0 2,-0.1 -0.940 360.0 1.2 160.5-144.1 5.0 82.0 66.1 43 42 A R E +B 37 0A 85 -2,-0.3 100,-2.7 -6,-0.2 101,-1.2 -0.385 55.6 154.4 -80.9 146.8 5.3 78.2 66.4 44 43 A W E -BD 36 142A 50 -8,-2.3 -8,-2.4 98,-0.2 2,-0.3 -0.967 20.8-147.8-153.8 174.9 2.8 75.4 66.0 45 44 A S E -BD 35 141A 6 96,-1.7 96,-2.1 -2,-0.3 2,-0.4 -0.955 1.5-157.4-143.3 164.5 2.4 71.8 65.2 46 45 A L E -BD 34 140A 0 -12,-2.2 -12,-2.4 -2,-0.3 2,-0.5 -0.998 0.9-164.4-148.9 135.4 0.0 69.4 63.6 47 46 A L E -BD 33 139A 0 92,-3.1 92,-3.0 -2,-0.4 2,-0.3 -0.979 17.5-139.6-127.9 123.8 -0.4 65.7 64.0 48 47 A L E -BD 32 138A 0 -16,-2.6 -16,-0.7 -2,-0.5 2,-0.7 -0.563 10.1-141.2 -87.1 140.7 -2.5 63.8 61.5 49 48 A V E - D 0 137A 0 88,-2.9 88,-1.0 -2,-0.3 -19,-0.2 -0.880 13.2-148.6-108.0 114.7 -4.7 61.1 62.5 50 49 A A - 0 0 16 -21,-2.2 85,-0.2 -2,-0.7 52,-0.0 -0.369 15.1-168.4 -78.6 162.2 -5.0 58.0 60.4 51 50 A Q - 0 0 84 83,-1.6 84,-0.1 2,-0.3 -1,-0.1 0.365 54.8-100.6-132.4 -15.8 -8.1 55.8 60.0 52 51 A G S S+ 0 0 53 82,-0.7 2,-0.2 1,-0.4 83,-0.1 0.252 84.3 103.4 112.8 -11.3 -6.4 52.9 58.2 53 52 A D + 0 0 59 81,-0.2 81,-2.7 12,-0.1 -1,-0.4 -0.641 41.3 100.7 -87.5 159.9 -7.0 53.1 54.5 54 53 A G E -L 133 0B 11 79,-0.2 12,-0.8 -2,-0.2 2,-0.3 -0.978 54.8 -86.2 163.3-154.8 -4.6 54.3 51.9 55 54 A L E -LM 132 65B 15 77,-2.2 77,-2.5 -2,-0.3 2,-0.4 -0.956 22.0-165.6-140.7 157.0 -2.1 53.4 49.3 56 55 A R E -LM 131 64B 32 8,-2.1 8,-2.5 -2,-0.3 2,-0.7 -0.995 22.5-134.5-146.0 143.7 1.4 52.4 48.9 57 56 A L E -LM 130 63B 6 73,-2.6 72,-1.4 -2,-0.4 73,-1.0 -0.907 37.5-151.7 -93.2 115.1 3.8 52.2 46.1 58 57 A D > - 0 0 25 4,-2.7 3,-2.3 -2,-0.7 4,-0.2 -0.305 26.2-102.7 -89.8 164.6 5.5 48.8 46.7 59 58 A A T 3 S+ 0 0 37 67,-0.4 63,-0.1 1,-0.3 -1,-0.1 0.667 117.4 65.9 -63.3 -20.2 9.0 47.7 45.8 60 59 A D T 3 S- 0 0 87 2,-0.2 -1,-0.3 66,-0.1 3,-0.1 0.426 120.0-106.8 -80.7 7.7 7.7 45.6 42.9 61 60 A G S < S+ 0 0 46 -3,-2.3 2,-0.3 1,-0.3 -2,-0.2 0.687 84.1 114.0 80.9 19.4 6.5 48.9 41.2 62 61 A Q - 0 0 83 -4,-0.2 -4,-2.7 12,-0.0 2,-0.3 -0.916 62.2-126.7-124.4 150.3 2.8 48.3 41.9 63 62 A V E -MN 57 71B 0 8,-0.8 8,-1.9 10,-0.4 2,-0.3 -0.733 28.5-178.4 -91.6 145.8 0.4 50.2 44.1 64 63 A R E -MN 56 70B 43 -8,-2.5 -8,-2.1 -2,-0.3 6,-0.2 -0.963 14.6-138.5-139.3 157.3 -1.6 48.4 46.7 65 64 A D E > -M 55 0B 23 4,-1.4 3,-2.1 -2,-0.3 -10,-0.2 -0.359 45.4 -79.8-104.2-171.9 -4.3 49.4 49.2 66 65 A Q T 3 S+ 0 0 65 -12,-0.8 -11,-0.1 1,-0.3 -13,-0.1 0.787 132.2 53.3 -58.4 -29.1 -4.9 48.5 52.8 67 66 A H T 3 S- 0 0 129 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.060 117.8-115.9 -89.4 22.6 -6.6 45.2 51.6 68 67 A D < + 0 0 97 -3,-2.1 2,-0.4 1,-0.2 -2,-0.1 0.671 64.5 150.2 44.7 27.3 -3.4 44.5 49.6 69 68 A L - 0 0 107 1,-0.1 -4,-1.4 0, 0.0 2,-0.5 -0.716 52.2-114.4 -84.2 134.1 -5.2 44.7 46.3 70 69 A V E -N 64 0B 68 -2,-0.4 -6,-0.2 -6,-0.2 -1,-0.1 -0.553 26.0-157.3 -64.9 113.9 -3.2 45.9 43.4 71 70 A Q E -N 63 0B 51 -8,-1.9 -8,-0.8 -2,-0.5 7,-0.1 -0.858 25.5-117.7 -86.5 130.3 -4.6 49.3 42.1 72 71 A P + 0 0 86 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 -0.179 69.5 22.8 -67.0 162.1 -3.6 49.8 38.5 73 72 A G S S- 0 0 43 4,-0.1 -10,-0.4 5,-0.1 2,-0.1 -0.307 99.7 -35.1 80.5-162.4 -1.3 52.6 37.2 74 73 A T > - 0 0 36 -12,-0.1 4,-2.6 -2,-0.1 5,-0.3 -0.348 61.7-100.7 -89.2 169.2 1.2 54.8 38.9 75 74 A F H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.889 123.9 52.0 -57.8 -39.7 1.1 56.0 42.6 76 75 A L H > S+ 0 0 12 2,-0.2 4,-2.3 1,-0.2 267,-0.3 0.908 108.8 49.9 -73.4 -34.8 -0.1 59.4 41.4 77 76 A Q H > S+ 0 0 97 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.965 113.9 45.8 -61.5 -47.0 -3.0 57.9 39.3 78 77 A A H X S+ 0 0 4 -4,-2.6 4,-2.1 1,-0.3 -2,-0.2 0.897 111.7 51.3 -66.4 -37.2 -4.1 55.8 42.2 79 78 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.3 0.903 109.2 51.3 -63.9 -39.7 -3.8 58.8 44.5 80 79 A D H X S+ 0 0 29 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.933 108.6 51.3 -62.9 -40.8 -5.9 60.8 42.0 81 80 A R H X S+ 0 0 104 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.900 111.5 47.9 -63.9 -35.7 -8.7 58.1 41.9 82 81 A A H X S+ 0 0 28 -4,-2.1 4,-0.9 -5,-0.2 -1,-0.2 0.869 112.5 48.1 -75.3 -37.7 -8.8 58.0 45.7 83 82 A W H >< S+ 0 0 9 -4,-2.3 3,-0.8 -5,-0.2 4,-0.4 0.941 110.6 50.2 -64.4 -45.0 -9.0 61.8 45.9 84 83 A Q H >< S+ 0 0 104 -4,-2.9 3,-2.5 1,-0.2 -2,-0.2 0.980 105.1 60.9 -55.3 -52.4 -11.8 62.0 43.2 85 84 A H H 3< S+ 0 0 159 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.753 121.3 22.0 -46.4 -29.6 -13.7 59.3 45.2 86 85 A E T << S+ 0 0 61 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.204 90.6 150.8-128.1 24.0 -13.9 61.6 48.2 87 86 A R < - 0 0 73 -3,-2.5 2,-0.3 -4,-0.4 301,-0.2 -0.151 25.5-162.9 -57.9 139.0 -13.4 64.9 46.6 88 87 A L - 0 0 37 299,-2.3 2,-0.2 298,-0.1 -2,-0.1 -0.898 21.1-114.2-117.3 158.8 -15.0 68.0 48.2 89 88 A S - 0 0 68 -2,-0.3 2,-0.4 1,-0.1 -83,-0.1 -0.590 42.2 -98.7 -83.6 151.0 -15.6 71.4 46.7 90 89 A H - 0 0 56 -2,-0.2 -1,-0.1 298,-0.2 299,-0.0 -0.566 25.2-162.3 -79.1 129.1 -13.7 74.3 48.2 91 90 A D - 0 0 70 -2,-0.4 -1,-0.1 2,-0.2 3,-0.1 0.378 39.2-120.2 -88.6 -2.2 -15.6 76.4 50.8 92 91 A G S S+ 0 0 53 1,-0.2 2,-0.5 2,-0.0 -2,-0.1 0.581 73.6 115.8 78.3 10.4 -13.1 79.3 50.4 93 92 A S + 0 0 71 1,-0.0 -1,-0.2 3,-0.0 -2,-0.2 -0.943 30.4 168.9-116.4 131.2 -12.0 79.4 54.0 94 93 A H + 0 0 81 -2,-0.5 -1,-0.0 1,-0.1 -2,-0.0 -0.383 36.7 119.0-134.7 64.9 -8.5 78.7 55.3 95 94 A S S S+ 0 0 110 1,-0.2 -1,-0.1 2,-0.0 -2,-0.0 0.930 85.5 52.3 -70.4 -53.0 -7.9 79.6 58.9 96 95 A L S S- 0 0 28 1,-0.1 -1,-0.2 -3,-0.1 -3,-0.0 -0.666 75.2-159.2 -90.4 116.2 -7.1 75.9 59.3 97 96 A P S S+ 0 0 34 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.834 78.7 42.3 -74.3 -30.2 -4.5 74.6 56.9 98 97 A F + 0 0 0 1,-0.1 40,-0.1 287,-0.0 3,-0.1 -0.959 53.6 164.3-119.2 141.1 -5.4 70.9 57.2 99 98 A R - 0 0 34 -2,-0.4 -1,-0.1 1,-0.2 2,-0.1 0.312 62.8 -67.7-136.1 1.3 -9.0 69.7 57.3 100 99 A G S S+ 0 0 1 37,-0.1 287,-1.7 2,-0.1 -1,-0.2 0.021 81.0 102.2 117.9 136.7 -8.7 66.0 56.6 101 100 A G E S-OP 135 386B 0 34,-2.2 34,-2.4 285,-0.2 2,-0.3 -0.663 72.8 -14.9 167.2 -96.2 -7.7 63.9 53.7 102 101 A W E -OP 134 385B 5 283,-2.2 283,-2.0 32,-0.3 2,-0.4 -0.994 38.2-139.7-139.5 146.5 -4.4 62.2 53.4 103 102 A A E -OP 133 384B 0 30,-2.6 30,-2.7 -2,-0.3 2,-0.4 -0.863 34.6-160.2 -91.5 136.2 -0.8 62.2 54.8 104 103 A L E +OP 132 383B 0 279,-3.6 279,-1.7 -2,-0.4 2,-0.4 -0.942 20.5 178.7-122.0 149.9 1.6 61.8 52.0 105 104 A M E -OP 131 382B 0 26,-2.2 26,-2.2 -2,-0.4 2,-0.5 -0.972 9.1-178.5-143.0 124.2 5.2 60.7 51.8 106 105 A L E -OP 130 381B 0 275,-4.1 275,-2.7 -2,-0.4 24,-0.2 -0.974 16.0-145.3-127.9 131.0 7.0 60.4 48.6 107 106 A D > - 0 0 0 22,-2.0 3,-2.2 -2,-0.5 4,-0.2 -0.491 34.0-107.7 -81.1 163.0 10.6 59.3 48.0 108 107 A Y G > S+ 0 0 15 268,-2.6 3,-2.1 1,-0.3 4,-0.1 0.769 115.0 73.1 -53.7 -35.6 12.6 60.9 45.3 109 108 A E G > S+ 0 0 19 1,-0.3 3,-1.5 267,-0.2 4,-0.3 0.592 72.9 82.6 -67.0 -13.3 12.3 57.7 43.3 110 109 A V G X> S+ 0 0 0 -3,-2.2 3,-2.1 1,-0.3 4,-0.7 0.826 77.2 78.2 -51.1 -26.2 8.5 58.5 42.6 111 110 A A H X> S+ 0 0 2 -3,-2.1 4,-3.2 1,-0.3 3,-0.6 0.751 78.7 63.2 -63.8 -27.1 10.1 60.7 39.9 112 111 A S H <4 S+ 0 0 16 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.732 99.8 54.9 -74.5 -16.1 10.7 57.7 37.6 113 112 A Q H <4 S+ 0 0 50 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.730 113.3 42.7 -75.8 -24.0 6.9 57.2 37.4 114 113 A I H << S+ 0 0 34 -4,-0.7 -2,-0.2 -3,-0.6 -3,-0.1 0.894 129.4 25.8 -89.5 -43.9 6.7 60.9 36.3 115 114 A E S >< S- 0 0 53 -4,-3.2 3,-2.8 1,-0.1 -1,-0.3 -0.777 71.6-173.4-119.6 88.7 9.6 60.8 33.9 116 115 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.586 73.8 83.2 -73.1 0.1 9.9 57.2 32.8 117 116 A V T 3 S+ 0 0 85 2,-0.1 -5,-0.1 -3,-0.1 -4,-0.1 0.779 79.9 83.0 -61.3 -21.6 13.1 58.0 30.9 118 117 A L S < S- 0 0 14 -3,-2.8 247,-0.1 -7,-0.2 -3,-0.0 -0.696 95.4-108.2 -86.7 135.0 14.7 57.6 34.4 119 118 A P - 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