==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-AUG-10 3OC9 . COMPND 2 MOLECULE: UDP-N-ACETYLGLUCOSAMINE PYROPHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTAMOEBA HISTOLYTICA; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 400 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20110.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 263 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 13.5 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 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 33 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 20.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 2 1 1 1 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 1 3 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 . 7 3 1 0 3 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 ANTIPARALLEL BRIDGES PER LADDER . 6 0 1 0 0 0 0 0 1 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 2 A T 0 0 150 0, 0.0 224,-0.4 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-162.6 47.3 90.9 7.4 2 3 A Y - 0 0 79 222,-0.1 222,-0.2 223,-0.1 220,-0.0 -0.425 360.0-169.5 -71.8 143.0 50.1 89.9 9.9 3 4 A Q B -A 223 0A 111 220,-2.0 220,-2.0 -2,-0.1 -1,-0.0 -0.940 28.5 -95.1-126.7 153.2 49.5 90.3 13.7 4 5 A P - 0 0 54 0, 0.0 2,-0.4 0, 0.0 218,-0.1 -0.223 31.8-130.4 -64.5 158.5 52.1 90.1 16.6 5 6 A V - 0 0 13 216,-0.3 2,-0.3 245,-0.3 247,-0.3 -0.938 16.0-134.2-112.0 129.1 52.5 86.8 18.7 6 7 A D - 0 0 135 -2,-0.4 2,-0.6 1,-0.0 313,-0.1 -0.635 18.5-121.7 -82.5 140.0 52.5 86.9 22.6 7 8 A I > - 0 0 8 -2,-0.3 3,-1.4 1,-0.2 4,-0.4 -0.717 19.9-152.0 -79.3 113.8 55.2 85.0 24.6 8 9 A T G >> S+ 0 0 31 -2,-0.6 4,-2.2 311,-0.6 3,-1.3 0.877 90.1 61.2 -59.0 -41.3 53.1 82.5 26.7 9 10 A T G 34 S+ 0 0 24 310,-1.3 -1,-0.3 1,-0.3 5,-0.2 0.563 88.2 73.8 -66.2 -10.1 55.8 82.4 29.5 10 11 A N G <4 S+ 0 0 101 -3,-1.4 -1,-0.3 1,-0.1 -2,-0.2 0.850 117.5 15.2 -66.9 -36.1 55.4 86.2 30.2 11 12 A T T <4 S+ 0 0 124 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.1 0.609 129.2 50.4-116.3 -21.2 52.0 85.6 31.9 12 13 A I S < S- 0 0 70 -4,-2.2 -1,-0.2 2,-0.0 -2,-0.0 -0.891 87.4-149.6-116.7 96.4 51.9 81.8 32.6 13 14 A P - 0 0 80 0, 0.0 2,-0.6 0, 0.0 -3,-0.1 -0.254 16.4-112.6 -72.9 153.2 55.2 81.2 34.3 14 15 A V - 0 0 54 -5,-0.2 2,-0.2 3,-0.0 179,-0.1 -0.778 48.8-176.1 -78.2 120.5 57.3 78.0 34.2 15 16 A T > - 0 0 54 -2,-0.6 4,-1.5 177,-0.1 3,-0.5 -0.663 43.6-101.8-117.3 169.8 57.1 76.6 37.8 16 17 A K H > S+ 0 0 122 1,-0.2 4,-2.3 -2,-0.2 5,-0.2 0.829 119.6 64.8 -60.2 -31.3 58.5 73.7 39.8 17 18 A E H > S+ 0 0 137 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.913 102.5 49.0 -55.5 -42.6 55.1 71.9 39.4 18 19 A H H > S+ 0 0 15 -3,-0.5 4,-1.9 2,-0.2 177,-0.2 0.915 108.4 52.9 -63.1 -46.1 55.9 71.8 35.6 19 20 A Y H X S+ 0 0 14 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.933 111.7 45.0 -55.3 -50.5 59.5 70.3 36.2 20 21 A Y H X S+ 0 0 102 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.841 109.3 54.6 -68.2 -32.1 58.2 67.5 38.4 21 22 A R H X S+ 0 0 86 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.863 107.2 53.6 -64.9 -35.2 55.3 66.6 36.0 22 23 A G H X S+ 0 0 0 -4,-1.9 4,-2.3 169,-0.2 -2,-0.2 0.931 107.5 48.7 -62.1 -48.1 58.0 66.3 33.3 23 24 A L H X S+ 0 0 5 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.880 110.4 53.0 -59.5 -39.3 60.0 63.8 35.4 24 25 A E H X S+ 0 0 56 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.932 110.0 46.5 -60.4 -48.5 56.8 61.8 36.0 25 26 A L H <>S+ 0 0 3 -4,-2.2 5,-2.2 2,-0.2 6,-0.2 0.892 112.3 50.0 -63.0 -41.1 56.0 61.6 32.2 26 27 A I H ><5S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.2 62,-0.3 0.937 109.3 53.0 -60.4 -46.2 59.7 60.5 31.4 27 28 A S H 3<5S+ 0 0 11 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.767 104.7 55.4 -60.3 -29.2 59.4 57.8 34.2 28 29 A Q T 3<5S- 0 0 85 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.374 117.8-110.5 -84.6 2.6 56.2 56.4 32.6 29 30 A G T < 5S+ 0 0 25 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.788 80.6 128.7 71.0 31.5 57.9 55.9 29.2 30 31 A K < + 0 0 68 -5,-2.2 144,-2.1 143,-0.2 145,-1.8 0.273 50.9 73.3-102.9 12.4 55.9 58.7 27.6 31 32 A T E +b 175 0A 1 57,-0.3 59,-0.8 -5,-0.3 2,-0.3 -0.880 49.2 179.8-129.2 158.3 58.7 60.8 26.0 32 33 A A E -bc 176 90A 0 143,-1.4 145,-2.1 -2,-0.3 2,-0.4 -0.981 21.3-130.4-150.1 160.0 61.3 60.6 23.1 33 34 A L E -bc 177 91A 0 57,-2.1 59,-2.6 -2,-0.3 2,-0.4 -0.916 17.4-167.2-110.5 139.2 64.1 62.6 21.4 34 35 A I E +bc 178 92A 5 143,-2.6 145,-1.8 -2,-0.4 59,-0.2 -0.993 19.6 153.9-125.6 122.1 64.3 63.3 17.5 35 36 A T E - c 0 93A 7 57,-2.1 59,-2.6 -2,-0.4 2,-0.3 -0.979 38.7-118.5-139.4 158.6 67.5 64.6 15.8 36 37 A P E - c 0 94A 43 0, 0.0 59,-0.2 0, 0.0 3,-0.1 -0.693 19.5-134.3 -86.5 153.1 69.3 64.6 12.5 37 38 A A - 0 0 3 57,-2.1 14,-2.0 -2,-0.3 15,-0.2 0.766 56.3-124.9 -71.7 -24.8 72.8 63.0 12.1 38 39 A G - 0 0 29 56,-0.4 -1,-0.2 12,-0.2 3,-0.1 -0.066 18.1 -75.8 104.7 160.1 73.7 66.2 10.3 39 40 A G S S- 0 0 58 1,-0.2 11,-1.8 10,-0.1 2,-0.1 -0.143 76.2 -61.3 -69.0-178.2 75.2 67.0 6.9 40 41 A Q B -J 49 0B 91 9,-0.2 2,-1.2 1,-0.1 3,-0.4 -0.453 44.3-125.3 -68.7 141.0 78.9 66.5 6.4 41 42 A G > > + 0 0 4 7,-2.5 5,-1.9 5,-0.4 3,-0.8 -0.177 64.9 135.3 -78.2 44.3 81.2 68.6 8.7 42 43 A S T 3 5 + 0 0 56 -2,-1.2 -1,-0.2 1,-0.3 5,-0.1 0.756 60.8 63.0 -69.6 -29.1 83.0 69.9 5.7 43 44 A R T 3 5S+ 0 0 177 -3,-0.4 291,-0.4 3,-0.1 -1,-0.3 0.812 111.6 46.3 -63.1 -30.9 83.0 73.6 6.8 44 45 A L T < 5S- 0 0 15 -3,-0.8 290,-0.1 2,-0.2 289,-0.0 -0.163 120.6 -86.2 -87.9-167.9 85.2 72.1 9.7 45 46 A G T 5S+ 0 0 83 -2,-0.1 2,-0.6 1,-0.1 -3,-0.2 0.252 96.0 111.5 -83.0 20.5 88.0 69.7 8.9 46 47 A F < - 0 0 41 -5,-1.9 2,-1.2 2,-0.1 -5,-0.4 -0.812 45.1-177.1-120.1 104.0 85.6 66.9 8.9 47 48 A E + 0 0 120 -2,-0.6 -7,-0.1 -7,-0.1 -1,-0.1 -0.366 67.9 76.0 -92.1 58.2 84.4 64.7 6.0 48 49 A H S S- 0 0 75 -2,-1.2 -7,-2.5 -9,-0.1 -2,-0.1 -0.933 98.9 -59.3-155.6 163.2 81.9 62.7 8.1 49 50 A P B > -J 40 0B 1 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.271 52.8-118.7 -55.9 139.8 78.4 63.2 9.6 50 51 A K G > S+ 0 0 20 -11,-1.8 3,-1.8 1,-0.3 13,-0.3 0.770 107.7 66.9 -54.8 -35.0 78.5 66.2 12.1 51 52 A G G 3 S+ 0 0 0 -14,-2.0 13,-2.6 1,-0.3 14,-0.3 0.738 94.5 60.3 -59.1 -22.8 77.5 64.1 15.1 52 53 A M G < S+ 0 0 24 -3,-2.0 -1,-0.3 -15,-0.2 2,-0.2 0.519 77.2 120.4 -82.9 -7.2 80.8 62.3 15.0 53 54 A F < - 0 0 34 -3,-1.8 10,-1.4 -4,-0.2 2,-0.7 -0.416 61.2-134.5 -65.7 128.6 82.9 65.6 15.4 54 55 A V E -K 62 0C 79 8,-0.2 8,-0.3 -2,-0.2 -1,-0.1 -0.761 13.2-138.5 -91.7 113.2 85.2 65.5 18.5 55 56 A L E -K 61 0C 3 6,-2.3 2,-2.2 -2,-0.7 6,-0.7 -0.511 17.5-126.6 -69.0 129.2 85.0 68.8 20.6 56 57 A P + 0 0 61 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.256 56.0 143.7 -80.6 60.4 88.5 69.8 21.7 57 58 A F S S- 0 0 13 -2,-2.2 316,-0.0 2,-0.2 289,-0.0 -0.233 72.4 -94.4 -78.7 176.1 87.7 70.1 25.5 58 59 A E S S+ 0 0 105 1,-0.3 -1,-0.1 -2,-0.0 340,-0.0 0.857 131.3 35.6 -60.1 -35.5 90.3 69.2 28.2 59 60 A I S S- 0 0 69 2,-0.0 -1,-0.3 -4,-0.0 2,-0.2 -0.935 103.0-137.7-114.2 101.4 88.4 65.8 28.1 60 61 A P + 0 0 81 0, 0.0 2,-0.3 0, 0.0 -6,-0.1 -0.439 31.0 166.4 -74.3 130.2 87.5 65.4 24.4 61 62 A K E -K 55 0C 15 -6,-0.7 -6,-2.3 -2,-0.2 -4,-0.1 -0.981 31.8-117.0-137.3 147.2 84.0 64.0 23.5 62 63 A S E > -K 54 0C 3 -2,-0.3 4,-1.9 -8,-0.3 -8,-0.2 -0.370 30.1-112.5 -74.8 162.1 81.9 63.8 20.3 63 64 A I H > S+ 0 0 7 -10,-1.4 4,-2.0 -13,-0.3 5,-0.2 0.922 120.9 52.4 -58.3 -46.6 78.6 65.7 19.8 64 65 A F H > S+ 0 0 2 -13,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.878 107.5 51.9 -57.3 -41.1 76.8 62.2 19.8 65 66 A Q H > S+ 0 0 47 -14,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.883 106.7 53.7 -63.0 -42.1 78.6 61.3 23.1 66 67 A M H X S+ 0 0 10 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.933 110.4 46.8 -53.8 -52.7 77.3 64.6 24.8 67 68 A T H X S+ 0 0 19 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.922 110.0 53.3 -58.6 -45.6 73.7 63.8 23.8 68 69 A S H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.916 109.7 48.8 -55.1 -44.1 74.0 60.1 25.0 69 70 A E H X S+ 0 0 22 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.873 108.4 52.3 -69.1 -38.3 75.3 61.3 28.5 70 71 A R H X S+ 0 0 18 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.909 108.9 50.8 -63.4 -42.2 72.5 63.9 28.9 71 72 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.914 108.4 52.8 -61.0 -42.5 69.8 61.2 28.2 72 73 A L H X S+ 0 0 29 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.907 111.2 46.6 -57.3 -40.8 71.5 58.9 30.8 73 74 A R H X S+ 0 0 24 -4,-1.9 4,-2.3 303,-0.2 -2,-0.2 0.889 110.9 51.1 -71.0 -41.8 71.3 61.8 33.4 74 75 A L H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.902 109.4 51.0 -60.4 -43.4 67.6 62.6 32.6 75 76 A Q H X S+ 0 0 24 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.910 110.4 50.7 -58.9 -42.2 66.7 58.8 33.0 76 77 A E H X S+ 0 0 65 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.907 108.6 50.0 -63.0 -47.1 68.4 58.8 36.4 77 78 A L H X S+ 0 0 13 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.900 112.2 47.9 -59.4 -44.4 66.6 61.9 37.7 78 79 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 6,-0.3 0.867 111.6 50.9 -62.6 -40.1 63.2 60.5 36.7 79 80 A S H X S+ 0 0 36 -4,-1.9 4,-1.7 1,-0.2 5,-0.4 0.896 109.9 48.9 -66.1 -41.9 64.1 57.1 38.4 80 81 A E H < S+ 0 0 123 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.842 114.5 46.9 -66.3 -34.7 65.1 58.8 41.7 81 82 A Y H < S+ 0 0 101 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.926 123.2 29.9 -70.6 -47.9 61.9 60.9 41.7 82 83 A S H < S- 0 0 32 -4,-2.3 -2,-0.2 2,-0.1 -3,-0.2 0.574 95.1-129.2 -89.6 -16.1 59.4 58.0 40.9 83 84 A H < + 0 0 169 -4,-1.7 2,-0.4 1,-0.2 -3,-0.1 0.660 57.8 149.2 63.0 21.3 61.3 55.1 42.5 84 85 A Q - 0 0 111 -5,-0.4 -1,-0.2 -6,-0.3 -2,-0.1 -0.741 41.7-147.7 -87.7 126.8 60.8 53.3 39.1 85 86 A K S S+ 0 0 82 -2,-0.4 2,-0.6 1,-0.2 -1,-0.1 0.903 79.6 36.3 -66.5 -51.2 63.6 50.8 38.4 86 87 A N + 0 0 147 -59,-0.1 2,-0.4 -7,-0.0 -1,-0.2 -0.930 65.6 174.8-112.2 113.6 63.9 50.9 34.6 87 88 A V - 0 0 19 -2,-0.6 2,-0.4 -3,-0.1 -60,-0.1 -0.983 8.9-171.6-118.3 129.3 63.3 54.2 32.9 88 89 A M - 0 0 63 -2,-0.4 2,-0.6 -62,-0.3 -57,-0.3 -0.979 17.9-166.3-129.0 128.2 63.9 54.5 29.1 89 90 A I - 0 0 0 -2,-0.4 -57,-0.2 -59,-0.1 2,-0.1 -0.945 23.5-142.7-105.3 110.0 64.0 57.5 26.6 90 91 A H E -c 32 0A 19 -59,-0.8 -57,-2.1 -2,-0.6 2,-0.4 -0.479 12.2-152.7 -71.4 142.5 63.8 56.2 22.9 91 92 A W E -cd 33 120A 1 28,-2.6 30,-2.4 -59,-0.2 2,-0.5 -0.981 5.6-162.6-125.4 117.3 66.0 58.3 20.4 92 93 A F E -cd 34 121A 2 -59,-2.6 -57,-2.1 -2,-0.4 2,-0.6 -0.906 8.4-164.5-105.3 121.0 65.1 58.5 16.6 93 94 A L E -cd 35 122A 1 28,-2.2 30,-2.2 -2,-0.5 2,-0.4 -0.922 10.4-143.1-115.2 113.6 68.0 59.7 14.4 94 95 A M E +cd 36 123A 15 -59,-2.6 -57,-2.1 -2,-0.6 -56,-0.4 -0.625 38.0 141.0 -81.6 124.6 67.2 60.8 10.8 95 96 A T E - d 0 124A 6 28,-3.0 30,-2.2 -2,-0.4 2,-0.3 -0.444 37.7-116.2-135.4-154.6 69.8 59.9 8.2 96 97 A N >> - 0 0 21 28,-0.3 4,-1.9 -2,-0.2 3,-1.0 -0.923 35.2 -89.7-147.6 173.6 69.8 58.7 4.5 97 98 A E T 34 S+ 0 0 84 28,-0.4 4,-0.3 -2,-0.3 29,-0.1 0.789 120.7 55.4 -58.0 -29.5 70.8 55.7 2.3 98 99 A E T 34 S+ 0 0 132 1,-0.2 -1,-0.2 2,-0.1 4,-0.1 0.740 120.9 24.7 -76.3 -23.3 74.3 57.1 1.8 99 100 A T T <> S+ 0 0 19 -3,-1.0 4,-1.9 2,-0.1 5,-0.2 0.523 90.9 95.2-122.4 -8.8 75.3 57.5 5.5 100 101 A I H X S+ 0 0 43 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.860 86.6 49.7 -57.6 -41.6 73.1 55.0 7.5 101 102 A E H > S+ 0 0 147 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.923 109.8 51.3 -65.3 -43.1 75.7 52.1 7.6 102 103 A E H > S+ 0 0 68 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.893 111.9 46.7 -61.2 -41.2 78.5 54.4 8.8 103 104 A I H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 5,-0.2 0.928 110.9 51.0 -69.2 -44.0 76.4 55.9 11.7 104 105 A N H X S+ 0 0 77 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.914 111.5 48.6 -57.1 -44.2 75.2 52.4 12.9 105 106 A N H X S+ 0 0 84 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.863 106.2 57.8 -64.1 -37.6 78.8 51.2 13.0 106 107 A Y H X S+ 0 0 35 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.940 110.7 41.8 -60.3 -48.2 79.9 54.3 14.9 107 108 A F H ><>S+ 0 0 2 -4,-2.0 5,-2.6 1,-0.2 3,-0.6 0.920 113.8 52.3 -64.9 -45.0 77.4 53.6 17.8 108 109 A K H ><5S+ 0 0 105 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.920 108.7 48.1 -60.0 -47.5 78.1 49.7 17.9 109 110 A E H 3<5S+ 0 0 158 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.667 110.7 52.1 -75.9 -10.0 81.8 50.0 18.2 110 111 A H T X<5S- 0 0 94 -4,-0.8 3,-1.8 -3,-0.6 -1,-0.3 0.224 113.3-118.5 -99.8 14.7 81.5 52.5 21.0 111 112 A Q G X 5 - 0 0 139 -3,-1.6 3,-1.7 1,-0.3 -3,-0.2 0.854 62.6 -71.5 47.3 40.9 79.1 50.2 22.9 112 113 A Y G > - 0 0 41 1,-0.1 3,-1.7 -3,-0.1 4,-0.4 -0.758 17.4-130.7 -89.4 142.4 70.9 50.2 25.4 117 118 A S T 3 S+ 0 0 77 -2,-0.3 3,-0.5 1,-0.3 -1,-0.1 0.728 107.0 66.8 -58.0 -20.2 70.9 48.9 21.8 118 119 A E T 3 S+ 0 0 140 1,-0.2 -1,-0.3 3,-0.0 -28,-0.0 0.648 99.2 49.2 -78.0 -13.8 67.1 48.7 22.2 119 120 A Q S < S+ 0 0 5 -3,-1.7 -28,-2.6 -29,-0.1 2,-0.5 0.443 88.9 84.6-107.9 -3.1 66.7 52.5 22.4 120 121 A I E -d 91 0A 20 -3,-0.5 2,-0.4 -4,-0.4 -28,-0.2 -0.915 52.8-180.0-104.7 124.6 68.7 53.9 19.4 121 122 A H E -d 92 0A 49 -30,-2.4 -28,-2.2 -2,-0.5 2,-0.3 -0.835 9.8-167.7-134.3 97.8 66.8 54.0 16.0 122 123 A C E +d 93 0A 26 -2,-0.4 -28,-0.2 -30,-0.2 -30,-0.0 -0.646 15.7 177.3 -81.7 132.4 68.4 55.3 12.8 123 124 A F E -d 94 0A 6 -30,-2.2 -28,-3.0 -2,-0.3 2,-0.3 -0.995 22.9-121.0-136.8 145.2 65.9 55.8 9.9 124 125 A P E -d 95 0A 48 0, 0.0 -28,-0.3 0, 0.0 2,-0.2 -0.628 14.7-155.5 -92.1 144.7 66.3 57.2 6.3 125 126 A Q - 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