==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 15-MAR-11 3AW8 . COMPND 2 MOLECULE: PHOSPHORIBOSYLAMINOIMIDAZOLE CARBOXYLASE, ATPASE . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR K.OKADA,S.TSUNODA,H.TAKA,S.BABA,M.KANAGAWA,N.NAKAGAWA,A.EBIH . 720 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27336.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 508 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 145 20.1 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 60 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 2 0 2 7 0 5 3 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 6 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 . 2 0 4 7 5 0 2 2 2 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 . 0 0 2 2 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 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 1 A M 0 0 78 0, 0.0 60,-2.6 0, 0.0 61,-0.9 0.000 360.0 360.0 360.0 125.1 24.7 34.8 -3.0 2 2 A I E -ab 25 62A 4 22,-2.6 24,-1.3 58,-0.2 2,-0.4 -0.658 360.0-152.7 -85.9 136.3 25.5 32.8 -6.1 3 3 A G E -ab 26 63A 0 59,-2.0 61,-2.6 -2,-0.3 2,-0.5 -0.895 7.4-161.0-109.0 138.0 23.2 33.4 -9.1 4 4 A I E -ab 27 64A 0 22,-2.8 24,-1.5 -2,-0.4 2,-0.7 -0.969 15.4-140.9-126.2 123.5 22.6 30.7 -11.7 5 5 A L E S+ab 28 65A 0 59,-2.5 61,-2.9 -2,-0.5 62,-1.5 -0.702 81.2 36.4 -78.2 115.3 21.3 31.1 -15.2 6 6 A G - 0 0 0 22,-2.3 23,-0.2 -2,-0.7 22,-0.0 0.315 63.8-143.8 110.0 123.8 19.1 28.1 -15.7 7 7 A G + 0 0 0 20,-0.1 29,-2.6 4,-0.1 30,-0.4 0.072 59.6 120.7-104.5 25.2 16.8 26.3 -13.2 8 8 A G S > S- 0 0 18 27,-0.2 4,-2.0 26,-0.2 3,-0.1 0.137 83.5 -80.6 -74.5-167.0 17.4 22.8 -14.5 9 9 A Q H > S+ 0 0 27 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.845 127.3 59.6 -69.3 -32.2 18.8 19.7 -12.6 10 10 A L H > S+ 0 0 14 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.901 110.0 43.9 -61.6 -37.9 22.4 20.8 -13.1 11 11 A G H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.879 109.6 56.2 -72.1 -38.0 21.5 24.0 -11.1 12 12 A R H X S+ 0 0 2 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.920 110.7 45.2 -58.6 -42.6 19.5 21.9 -8.6 13 13 A M H X S+ 0 0 7 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.853 107.5 56.3 -74.2 -31.8 22.6 19.9 -7.9 14 14 A L H X S+ 0 0 1 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.949 110.4 46.9 -61.1 -46.9 24.9 22.9 -7.8 15 15 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 3,-0.3 0.927 110.5 50.7 -61.6 -45.2 22.7 24.3 -5.0 16 16 A L H < S+ 0 0 24 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.866 112.6 47.5 -61.7 -34.7 22.6 21.0 -3.1 17 17 A A H < S+ 0 0 20 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.759 113.3 50.6 -77.0 -22.4 26.4 20.8 -3.3 18 18 A G H ><>S+ 0 0 0 -4,-1.6 5,-1.8 -3,-0.3 3,-1.6 0.792 90.9 70.9 -87.2 -30.3 26.7 24.5 -2.1 19 19 A Y T ><5S+ 0 0 10 -4,-2.1 3,-2.5 1,-0.3 663,-0.2 0.870 92.1 60.3 -56.8 -36.9 24.5 24.6 1.0 20 20 A P T 3 5S+ 0 0 28 0, 0.0 662,-3.7 0, 0.0 -1,-0.3 0.776 103.3 53.3 -63.0 -20.1 27.0 22.5 3.0 21 21 A L B < 5S-e 682 0B 5 -3,-1.6 -2,-0.2 660,-0.2 660,-0.1 0.233 122.7-111.2 -94.1 11.6 29.4 25.3 2.3 22 22 A G T < 5 + 0 0 24 -3,-2.5 -3,-0.2 660,-0.6 2,-0.1 0.710 69.2 146.1 67.4 22.2 26.9 27.8 3.7 23 23 A L < - 0 0 32 -5,-1.8 2,-0.3 -8,-0.1 -1,-0.2 -0.282 39.0-138.1 -85.5 172.8 26.2 29.4 0.3 24 24 A S - 0 0 52 -2,-0.1 -22,-2.6 2,-0.0 2,-0.3 -0.927 15.6-157.1-129.7 155.1 23.0 30.8 -1.1 25 25 A F E -a 2 0A 6 -2,-0.3 16,-1.2 -24,-0.2 2,-0.3 -0.949 15.7-174.2-138.8 155.3 21.4 30.6 -4.5 26 26 A R E -ac 3 41A 15 -24,-1.3 -22,-2.8 -2,-0.3 2,-0.3 -0.971 17.1-158.9-144.4 128.3 19.0 32.3 -6.9 27 27 A F E -ac 4 42A 0 14,-3.7 16,-3.2 -2,-0.3 2,-0.4 -0.759 7.0-154.3-110.2 158.6 18.0 30.8 -10.2 28 28 A L E +ac 5 43A 0 -24,-1.5 -22,-2.3 -2,-0.3 16,-0.2 -0.998 29.8 146.4-128.9 130.7 16.5 32.3 -13.3 29 29 A D E - c 0 44A 25 14,-2.0 16,-1.5 -2,-0.4 17,-0.1 -0.931 49.7-130.3-164.1 141.8 14.4 30.2 -15.7 30 30 A P S S+ 0 0 48 0, 0.0 16,-0.2 0, 0.0 14,-0.1 0.608 89.4 79.0 -71.6 -11.8 11.4 30.9 -17.9 31 31 A S > - 0 0 47 14,-0.2 3,-2.0 1,-0.1 -24,-0.0 -0.876 67.8-152.1-105.9 123.6 9.5 27.9 -16.5 32 32 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 10,-0.1 0.692 97.9 60.2 -60.6 -18.9 7.8 28.2 -13.1 33 33 A E T 3 + 0 0 143 4,-0.0 291,-0.1 3,-0.0 5,-0.1 0.331 68.5 144.9 -92.7 5.2 8.3 24.4 -12.7 34 34 A A X - 0 0 12 -3,-2.0 3,-1.7 1,-0.2 4,-0.4 -0.210 52.1-135.4 -47.4 125.3 12.2 24.5 -12.9 35 35 A C G > S+ 0 0 3 1,-0.3 3,-0.9 2,-0.2 -27,-0.2 0.699 101.6 67.2 -61.4 -18.7 13.3 21.7 -10.6 36 36 A A G >> S+ 0 0 0 -29,-2.6 3,-2.5 1,-0.2 4,-1.1 0.836 87.6 69.5 -70.2 -27.8 15.9 24.0 -9.1 37 37 A G G <4 S+ 0 0 27 -3,-1.7 -1,-0.2 -30,-0.4 -2,-0.2 0.774 87.4 64.0 -58.8 -26.1 13.1 26.1 -7.7 38 38 A Q G <4 S+ 0 0 74 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.509 113.8 34.7 -75.7 0.1 12.3 23.2 -5.3 39 39 A V T <4 S+ 0 0 5 -3,-2.5 2,-0.3 1,-0.2 -2,-0.2 0.518 125.0 3.1-132.8 -9.2 15.7 23.9 -3.8 40 40 A G S < S- 0 0 19 -4,-1.1 2,-0.5 -3,-0.1 -1,-0.2 -0.896 94.0 -51.5-159.9-172.8 16.4 27.6 -3.9 41 41 A E E -c 26 0A 96 -16,-1.2 -14,-3.7 -2,-0.3 2,-0.5 -0.630 54.8-164.8 -76.1 121.9 15.0 31.1 -4.9 42 42 A L E -c 27 0A 38 -2,-0.5 2,-0.6 -16,-0.2 -14,-0.2 -0.947 11.2-160.0-116.6 124.6 13.7 30.9 -8.4 43 43 A V E -c 28 0A 20 -16,-3.2 -14,-2.0 -2,-0.5 2,-0.5 -0.907 16.5-143.4-102.1 119.0 13.0 33.9 -10.5 44 44 A V E +c 29 0A 65 -2,-0.6 2,-0.2 -16,-0.2 -16,-0.0 -0.721 48.0 108.4 -85.1 127.3 10.7 33.1 -13.4 45 45 A G - 0 0 11 -16,-1.5 -14,-0.2 -2,-0.5 2,-0.1 -0.861 67.8 -86.5 172.7 154.2 11.5 35.0 -16.6 46 46 A E > - 0 0 118 -2,-0.2 3,-1.3 -16,-0.2 7,-0.2 -0.438 35.9-126.3 -72.0 148.9 12.9 34.8 -20.1 47 47 A F T 3 S+ 0 0 10 1,-0.3 -1,-0.1 -2,-0.1 6,-0.0 0.742 112.2 50.8 -67.9 -22.8 16.6 35.2 -20.4 48 48 A L T 3 S+ 0 0 116 1,-0.0 2,-1.2 5,-0.0 -1,-0.3 0.338 81.4 102.1 -96.7 6.1 16.1 38.0 -22.9 49 49 A D <> - 0 0 75 -3,-1.3 4,-2.6 1,-0.2 3,-0.4 -0.782 60.1-162.9 -89.6 95.5 13.7 39.8 -20.7 50 50 A E H > S+ 0 0 108 -2,-1.2 4,-2.7 1,-0.2 5,-0.3 0.828 84.9 59.0 -50.3 -36.5 16.1 42.5 -19.5 51 51 A G H > S+ 0 0 37 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.956 109.8 40.1 -59.4 -52.7 13.7 43.3 -16.6 52 52 A A H > S+ 0 0 0 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.897 113.8 57.0 -63.6 -39.6 13.8 39.8 -15.2 53 53 A L H X S+ 0 0 5 -4,-2.6 4,-1.4 -7,-0.2 -2,-0.2 0.960 112.0 38.6 -56.2 -57.4 17.5 39.6 -15.9 54 54 A L H X S+ 0 0 44 -4,-2.7 4,-0.9 2,-0.2 -1,-0.2 0.829 114.0 55.2 -64.8 -34.8 18.5 42.7 -13.8 55 55 A R H >< S+ 0 0 142 -4,-2.1 3,-0.8 -5,-0.3 -1,-0.2 0.941 109.8 47.2 -63.0 -46.4 16.0 41.9 -11.1 56 56 A F H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.803 107.6 58.3 -65.2 -29.0 17.5 38.5 -10.6 57 57 A A H >< S+ 0 0 2 -4,-1.4 3,-1.6 -5,-0.2 -1,-0.2 0.708 76.3 119.1 -77.9 -17.7 21.0 40.0 -10.6 58 58 A E T << S- 0 0 115 -4,-0.9 3,-0.1 -3,-0.8 -3,-0.0 -0.169 87.1 -2.2 -54.0 132.8 20.5 42.3 -7.6 59 59 A G T 3 S+ 0 0 67 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.301 92.1 147.9 71.7 -11.8 22.8 41.6 -4.7 60 60 A L < - 0 0 16 -3,-1.6 -1,-0.2 1,-0.1 -58,-0.2 -0.221 42.8-153.2 -58.3 143.2 24.4 38.7 -6.4 61 61 A A S S- 0 0 57 -60,-2.6 2,-0.3 1,-0.4 -59,-0.2 0.871 76.8 -18.4 -82.0 -40.1 28.0 38.1 -5.5 62 62 A L E -b 2 0A 4 -61,-0.9 -59,-2.0 20,-0.1 2,-0.4 -0.956 62.8-129.9-157.8 167.9 28.7 36.4 -8.8 63 63 A V E +bd 3 84A 0 20,-2.1 22,-1.7 -2,-0.3 2,-0.2 -0.996 24.9 164.9-134.1 133.1 26.8 34.7 -11.7 64 64 A T E -b 4 0A 0 -61,-2.6 -59,-2.5 -2,-0.4 2,-0.3 -0.759 23.4-131.5-131.9 176.4 27.4 31.4 -13.3 65 65 A Y E +b 5 0A 1 20,-0.3 -59,-0.2 -61,-0.3 3,-0.1 -0.971 24.5 177.6-138.8 155.0 25.2 29.2 -15.7 66 66 A E + 0 0 13 -61,-2.9 2,-0.9 -2,-0.3 -60,-0.2 0.548 66.4 87.8-123.8 -23.6 23.9 25.7 -16.1 67 67 A F > - 0 0 79 -62,-1.5 3,-1.8 1,-0.2 -1,-0.1 -0.735 65.7-157.0 -82.2 106.6 21.7 25.9 -19.1 68 68 A E T 3 S+ 0 0 41 -2,-0.9 -1,-0.2 1,-0.3 -62,-0.0 0.705 88.6 49.3 -60.5 -24.6 24.2 25.4 -22.0 69 69 A N T 3 S+ 0 0 110 2,-0.1 -1,-0.3 -3,-0.0 3,-0.1 0.181 77.1 142.2-101.2 17.5 22.0 27.2 -24.6 70 70 A V < - 0 0 0 -3,-1.8 2,-0.2 1,-0.1 5,-0.1 -0.314 68.0 -94.0 -57.1 138.9 21.4 30.2 -22.5 71 71 A P >> - 0 0 30 0, 0.0 3,-1.3 0, 0.0 4,-1.2 -0.397 27.2-143.9 -57.8 119.6 21.5 33.4 -24.7 72 72 A V H 3> S+ 0 0 5 1,-0.3 4,-2.5 -2,-0.2 5,-0.2 0.763 98.7 69.2 -58.7 -22.0 25.0 34.7 -24.6 73 73 A E H 3> S+ 0 0 115 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.906 97.5 49.3 -61.7 -41.7 23.4 38.1 -24.7 74 74 A A H <> S+ 0 0 1 -3,-1.3 4,-1.0 2,-0.2 -1,-0.2 0.850 111.5 49.2 -66.9 -34.7 22.1 37.6 -21.1 75 75 A A H X S+ 0 0 0 -4,-1.2 4,-1.2 1,-0.2 3,-0.2 0.914 113.4 45.0 -71.5 -42.7 25.5 36.5 -19.9 76 76 A R H X S+ 0 0 101 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.811 105.4 62.5 -70.9 -29.8 27.3 39.5 -21.4 77 77 A R H X S+ 0 0 93 -4,-1.9 4,-0.5 -5,-0.2 -1,-0.2 0.860 112.0 36.8 -62.8 -36.3 24.7 41.9 -20.2 78 78 A L H X S+ 0 0 0 -4,-1.0 4,-2.6 -3,-0.2 -1,-0.2 0.678 95.3 86.3 -89.1 -19.9 25.5 41.0 -16.6 79 79 A E H < S+ 0 0 73 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.845 92.1 46.9 -50.1 -39.8 29.2 40.6 -17.1 80 80 A G H < S+ 0 0 76 -4,-0.8 -1,-0.2 -3,-0.2 -2,-0.2 0.968 113.5 47.7 -67.1 -51.1 29.7 44.3 -16.5 81 81 A R H < S+ 0 0 125 -4,-0.5 -2,-0.2 1,-0.1 -1,-0.2 0.870 124.8 0.2 -57.2 -49.4 27.6 44.5 -13.4 82 82 A L S < S- 0 0 17 -4,-2.6 -20,-0.1 -19,-0.0 -21,-0.1 -0.908 88.7 -73.5-140.7 169.2 29.0 41.4 -11.5 83 83 A P - 0 0 55 0, 0.0 -20,-2.1 0, 0.0 2,-0.4 -0.348 45.5-163.1 -62.4 145.0 31.7 38.7 -11.8 84 84 A L B -d 63 0A 12 -22,-0.2 -20,-0.2 -5,-0.1 4,-0.1 -0.973 6.2-143.1-136.9 119.5 30.7 36.0 -14.3 85 85 A Y S S+ 0 0 42 -22,-1.7 -20,-0.3 -2,-0.4 151,-0.1 -0.999 80.2 31.7-135.1 134.1 32.3 32.5 -14.5 86 86 A P S S- 0 0 0 0, 0.0 148,-0.1 0, 0.0 150,-0.1 0.600 106.1-104.2 -69.7 170.0 33.0 30.8 -16.8 87 87 A P >> - 0 0 25 0, 0.0 3,-1.2 0, 0.0 4,-0.7 -0.300 22.9-115.9 -63.9 147.9 33.7 33.8 -19.2 88 88 A A H 3> S+ 0 0 0 1,-0.3 4,-1.9 2,-0.2 3,-0.4 0.764 112.2 69.7 -54.5 -27.8 31.0 34.6 -21.8 89 89 A K H 3> S+ 0 0 90 1,-0.2 4,-2.9 2,-0.2 -1,-0.3 0.917 90.9 58.9 -57.7 -45.2 33.5 33.7 -24.5 90 90 A A H <> S+ 0 0 0 -3,-1.2 4,-2.6 1,-0.2 -1,-0.2 0.855 105.7 48.9 -52.9 -39.8 33.3 30.0 -23.5 91 91 A L H X S+ 0 0 0 -4,-0.7 4,-1.8 -3,-0.4 -1,-0.2 0.928 110.3 51.8 -65.2 -45.3 29.6 30.1 -24.3 92 92 A E H < S+ 0 0 59 -4,-1.9 3,-0.5 2,-0.2 4,-0.3 0.960 113.8 42.5 -54.6 -56.9 30.3 31.7 -27.6 93 93 A V H >< S+ 0 0 0 -4,-2.9 3,-1.2 1,-0.2 -2,-0.2 0.939 116.7 47.5 -56.1 -51.5 32.8 29.0 -28.6 94 94 A A H 3< S+ 0 0 8 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.658 103.8 61.1 -68.4 -18.9 30.7 26.1 -27.3 95 95 A Q T 3< S+ 0 0 43 -4,-1.8 2,-0.4 -3,-0.5 -1,-0.2 0.423 98.8 59.9 -91.5 2.9 27.4 27.3 -28.9 96 96 A D <> - 0 0 10 -3,-1.2 4,-2.5 -4,-0.3 44,-0.2 -0.942 68.8-152.7-133.3 112.8 28.7 27.1 -32.5 97 97 A R H > S+ 0 0 48 42,-2.7 4,-2.5 -2,-0.4 5,-0.2 0.849 98.8 44.1 -50.9 -42.4 30.0 23.7 -33.9 98 98 A L H > S+ 0 0 26 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.948 113.6 49.0 -68.7 -48.9 32.4 25.3 -36.3 99 99 A R H > S+ 0 0 90 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.821 113.0 52.0 -58.8 -29.5 33.6 27.9 -33.8 100 100 A E H X S+ 0 0 4 -4,-2.5 4,-2.0 2,-0.2 5,-0.2 0.959 111.6 42.4 -71.6 -54.0 34.1 24.9 -31.5 101 101 A K H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.910 114.7 49.8 -60.4 -47.0 36.1 22.8 -33.9 102 102 A T H X S+ 0 0 55 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.922 108.7 54.5 -60.3 -43.8 38.3 25.6 -35.2 103 103 A F H X S+ 0 0 33 -4,-1.5 4,-0.6 -5,-0.3 -2,-0.2 0.936 115.9 35.9 -55.5 -52.2 39.1 26.7 -31.6 104 104 A F H >X>S+ 0 0 0 -4,-2.0 5,-2.1 1,-0.2 3,-1.0 0.881 114.1 57.3 -70.8 -37.1 40.3 23.3 -30.5 105 105 A Q H ><5S+ 0 0 110 -4,-3.1 3,-0.5 1,-0.3 -1,-0.2 0.863 107.1 51.4 -59.9 -32.5 41.9 22.7 -33.9 106 106 A G H 3<5S+ 0 0 67 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.652 102.4 58.2 -78.2 -16.7 43.8 25.9 -33.2 107 107 A L H <<5S- 0 0 40 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.576 121.8-104.2 -87.3 -10.9 45.0 24.6 -29.8 108 108 A G T <<5S+ 0 0 52 -4,-0.8 -3,-0.2 -3,-0.5 -2,-0.1 0.692 76.0 136.6 95.9 22.1 46.6 21.7 -31.5 109 109 A V < - 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