==== 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 TRANSFERASE 08-APR-05 1X1O . COMPND 2 MOLECULE: NICOTINATE-NUCLEOTIDE PYROPHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR K.SHIMIZU,N.KUNISHIMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS I . 830 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34500.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 597 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 69 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 9.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 53 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 303 36.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.6 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 3 0 3 3 1 0 6 11 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 RESIDUES PER ALPHA HELIX . 3 3 6 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 . 1 3 0 3 1 2 2 1 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 . 3 0 3 0 0 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 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 10 A W 0 0 129 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 151.3 -0.2 13.0 64.6 2 11 A Q - 0 0 136 1,-0.2 2,-0.2 136,-0.0 0, 0.0 0.957 360.0-109.5 -57.2 -58.8 -1.0 9.3 64.7 3 12 A G S S+ 0 0 43 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 -0.589 87.2 77.5 138.6 159.1 -0.9 8.7 68.5 4 13 A G S > S+ 0 0 41 -2,-0.2 4,-2.5 -3,-0.1 5,-0.2 0.113 70.1 102.2 96.6 -22.5 1.3 7.1 71.1 5 14 A L H > S+ 0 0 19 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.923 78.6 54.7 -59.5 -43.7 3.8 9.9 71.0 6 15 A E H > S+ 0 0 56 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.945 111.6 43.8 -53.9 -51.1 2.4 11.3 74.2 7 16 A E H > S+ 0 0 120 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.864 113.7 51.4 -63.3 -37.6 2.9 7.9 75.9 8 17 A A H X S+ 0 0 27 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.913 108.3 50.8 -67.4 -42.9 6.4 7.6 74.4 9 18 A L H X S+ 0 0 2 -4,-3.2 4,-2.2 1,-0.2 5,-0.2 0.907 109.4 51.1 -62.6 -40.3 7.5 11.0 75.5 10 19 A R H X S+ 0 0 60 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.930 111.4 48.0 -62.5 -43.6 6.4 10.2 79.1 11 20 A A H X S+ 0 0 34 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.896 112.0 48.7 -63.7 -42.1 8.3 7.0 79.0 12 21 A W H X S+ 0 0 23 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.845 111.3 49.4 -68.9 -32.5 11.5 8.7 77.7 13 22 A L H X S+ 0 0 5 -4,-2.2 4,-3.3 -5,-0.2 3,-0.4 0.914 111.0 50.9 -70.6 -38.7 11.3 11.4 80.3 14 23 A R H X S+ 0 0 108 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.859 101.6 62.3 -63.6 -37.0 10.8 8.7 82.9 15 24 A E H < S+ 0 0 29 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.899 117.7 28.4 -54.8 -41.3 13.9 6.9 81.6 16 25 A D H < S+ 0 0 3 -4,-1.2 417,-2.7 -3,-0.4 418,-0.6 0.832 127.4 40.6 -91.1 -37.8 16.0 10.0 82.5 17 26 A L H >< S+ 0 0 0 -4,-3.3 3,-2.3 415,-0.2 -3,-0.2 0.808 71.4 164.3 -85.9 -32.6 14.1 11.5 85.4 18 27 A G T 3< S- 0 0 15 -4,-2.1 -1,-0.1 -5,-0.3 3,-0.1 -0.193 78.2 -9.7 50.9-135.8 13.1 8.4 87.5 19 28 A Q T 3 S- 0 0 45 1,-0.2 -1,-0.3 415,-0.0 2,-0.2 0.628 130.2 -57.8 -67.5 -14.5 12.0 9.4 91.0 20 29 A G < - 0 0 3 -3,-2.3 2,-1.7 -6,-0.1 -1,-0.2 -0.686 57.7 -71.4 148.2 158.9 13.3 12.9 90.3 21 30 A D > - 0 0 7 -2,-0.2 4,-2.1 1,-0.2 5,-0.2 -0.615 48.1-174.8 -78.9 86.0 16.2 15.2 89.4 22 31 A L H > S+ 0 0 31 -2,-1.7 4,-1.5 411,-1.4 -1,-0.2 0.879 75.8 53.0 -50.9 -49.9 18.1 14.8 92.6 23 32 A T H > S+ 0 0 0 410,-0.6 4,-1.6 413,-0.4 3,-0.4 0.934 112.0 44.0 -56.0 -50.6 20.8 17.4 91.8 24 33 A S H > S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.852 110.4 55.2 -65.4 -34.3 18.4 20.2 91.0 25 34 A L H < S+ 0 0 60 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.786 108.3 52.1 -68.5 -25.4 16.2 19.4 94.0 26 35 A L H < S+ 0 0 10 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.874 127.8 13.3 -78.4 -39.2 19.3 19.8 96.2 27 36 A V H < S+ 0 0 0 -4,-1.6 -2,-0.2 -5,-0.1 -3,-0.2 0.570 106.5 82.0-118.2 -10.1 20.5 23.2 94.9 28 37 A V S < S- 0 0 2 -4,-2.7 -1,-0.1 -5,-0.3 419,-0.1 -0.871 75.7-125.4-105.2 119.2 17.7 24.8 92.9 29 38 A P > - 0 0 46 0, 0.0 3,-1.2 0, 0.0 60,-0.3 -0.293 18.3-125.8 -58.1 137.8 14.9 26.6 94.8 30 39 A E T 3 S+ 0 0 90 1,-0.3 59,-0.2 -5,-0.1 58,-0.0 0.854 110.5 40.7 -53.4 -39.2 11.4 25.4 93.9 31 40 A D T 3 S+ 0 0 130 56,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.478 82.9 122.3 -91.3 -3.9 10.3 29.0 93.1 32 41 A L < - 0 0 50 -3,-1.2 56,-2.3 55,-0.1 57,-0.4 -0.443 58.2-137.8 -63.0 122.7 13.5 30.1 91.3 33 42 A E E -A 87 0A 127 -2,-0.3 2,-0.3 54,-0.2 -1,-0.1 -0.559 15.6-154.2 -84.5 146.9 12.5 31.2 87.8 34 43 A G E -A 86 0A 0 52,-3.4 52,-1.8 -2,-0.2 2,-0.4 -0.888 10.7-169.3-121.9 153.3 14.6 30.2 84.8 35 44 A E E +AB 85 276A 62 241,-2.4 241,-1.9 -2,-0.3 240,-1.8 -0.971 20.5 157.5-142.1 121.1 15.1 31.8 81.4 36 45 A A E -AB 84 274A 0 48,-2.6 48,-2.8 -2,-0.4 2,-0.3 -0.935 25.8-148.4-142.7 164.9 16.9 30.1 78.6 37 46 A V E -AB 83 273A 0 236,-2.3 236,-3.6 -2,-0.3 2,-0.6 -0.984 18.9-130.0-134.2 144.6 17.2 30.0 74.8 38 47 A I E -AB 82 272A 0 44,-2.9 43,-2.3 -2,-0.3 44,-1.0 -0.870 31.7-160.3 -95.8 120.8 17.9 27.1 72.4 39 48 A L E -AB 80 271A 27 232,-2.9 232,-2.2 -2,-0.6 2,-0.7 -0.849 18.4-132.2-107.8 139.9 20.8 28.1 70.1 40 49 A A E - B 0 270A 0 39,-2.3 38,-2.9 -2,-0.4 39,-0.3 -0.787 16.6-168.8 -86.2 116.2 21.7 26.7 66.8 41 50 A K S S+ 0 0 97 228,-2.9 2,-0.3 -2,-0.7 229,-0.2 0.567 75.8 18.0 -82.6 -9.6 25.5 26.2 67.0 42 51 A E S S- 0 0 62 227,-0.7 33,-0.1 34,-0.1 37,-0.1 -0.956 96.5 -88.0-151.4 161.7 25.6 25.5 63.3 43 52 A G + 0 0 38 -2,-0.3 2,-0.3 34,-0.1 33,-0.2 -0.417 65.5 115.1 -74.1 152.6 23.3 26.1 60.4 44 53 A G E -D 75 0B 5 31,-1.9 31,-2.9 -2,-0.1 2,-0.5 -0.978 62.4 -60.7 170.6-176.9 20.7 23.5 59.5 45 54 A V E -D 74 0B 0 61,-0.4 65,-0.4 -2,-0.3 2,-0.4 -0.828 44.5-134.6 -99.0 128.4 17.0 22.6 59.3 46 55 A L + 0 0 0 27,-2.2 26,-2.0 -2,-0.5 2,-0.3 -0.618 32.9 160.3 -80.3 130.1 14.8 22.7 62.4 47 56 A A + 0 0 0 55,-0.4 59,-0.4 -2,-0.4 58,-0.2 -0.987 54.5 35.6-150.5 140.3 12.5 19.8 63.1 48 57 A G > + 0 0 1 -2,-0.3 4,-2.7 57,-0.2 3,-0.3 0.584 64.0 137.4 95.4 12.7 10.8 18.6 66.3 49 58 A L H > S+ 0 0 6 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.905 77.7 45.2 -57.2 -43.4 10.2 22.1 67.8 50 59 A W H > S+ 0 0 89 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.738 110.4 55.5 -73.2 -22.2 6.7 21.1 68.9 51 60 A V H > S+ 0 0 0 -3,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.917 108.2 47.4 -74.0 -43.6 8.1 17.8 70.3 52 61 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.870 108.7 56.3 -63.9 -35.6 10.6 19.7 72.4 53 62 A E H X S+ 0 0 87 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.948 107.8 47.7 -61.0 -46.2 7.7 22.0 73.5 54 63 A R H X S+ 0 0 93 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.867 107.6 55.1 -63.9 -37.8 5.8 18.9 74.8 55 64 A V H X S+ 0 0 1 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.930 108.7 47.7 -63.1 -43.6 8.7 17.4 76.6 56 65 A F H X S+ 0 0 1 -4,-2.0 4,-2.1 1,-0.2 7,-0.3 0.905 110.4 53.2 -62.9 -38.9 9.2 20.6 78.6 57 66 A A H < S+ 0 0 26 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.837 107.6 51.1 -64.6 -33.0 5.5 20.7 79.4 58 67 A L H < S+ 0 0 19 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.817 108.6 51.1 -73.5 -30.8 5.7 17.1 80.7 59 68 A A H < S- 0 0 8 -4,-1.6 498,-0.3 1,-0.3 -2,-0.2 0.891 139.8 -12.8 -71.6 -39.9 8.6 18.0 83.0 60 69 A D >< - 0 0 19 -4,-2.1 3,-1.8 -5,-0.2 -1,-0.3 -0.776 57.1-149.2-165.0 114.3 6.6 21.0 84.3 61 70 A P T 3 S+ 0 0 113 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.624 95.9 67.4 -62.3 -13.6 3.4 22.4 82.8 62 71 A R T 3 S+ 0 0 141 -5,-0.1 2,-0.1 2,-0.1 -5,-0.1 0.653 77.4 103.0 -81.1 -16.7 4.3 25.9 84.1 63 72 A T < - 0 0 15 -3,-1.8 2,-0.6 -7,-0.3 23,-0.2 -0.430 65.8-143.7 -68.9 140.7 7.2 26.1 81.7 64 73 A A E -C 85 0A 42 21,-2.5 21,-2.1 -2,-0.1 2,-0.6 -0.925 10.6-164.8-112.8 113.5 6.6 28.3 78.7 65 74 A F E -C 84 0A 17 -2,-0.6 19,-0.2 19,-0.2 -12,-0.0 -0.862 7.5-173.6 -98.8 118.6 8.2 27.1 75.4 66 75 A T E -C 83 0A 66 17,-3.8 17,-2.8 -2,-0.6 2,-0.1 -0.913 15.2-144.3-118.4 108.1 8.3 29.9 72.7 67 76 A P E -C 82 0A 57 0, 0.0 15,-0.3 0, 0.0 14,-0.1 -0.442 10.9-170.5 -66.8 138.5 9.4 29.0 69.2 68 77 A L S S+ 0 0 79 13,-2.6 2,-0.3 -2,-0.1 14,-0.2 0.525 71.1 35.3-106.1 -15.5 11.4 31.8 67.5 69 78 A V S S- 0 0 33 12,-1.1 2,-0.1 10,-0.1 3,-0.1 -0.899 92.4 -91.4-131.4 167.5 11.4 30.2 64.1 70 79 A A > - 0 0 69 -2,-0.3 3,-2.0 1,-0.1 -24,-0.2 -0.454 46.4 -97.1 -76.6 153.3 9.1 28.1 62.0 71 80 A E T 3 S+ 0 0 60 1,-0.3 -24,-0.2 -2,-0.1 -1,-0.1 -0.487 114.1 20.0 -65.5 129.7 9.1 24.3 62.1 72 81 A G T 3 S+ 0 0 13 -26,-2.0 -1,-0.3 1,-0.3 2,-0.2 0.440 92.0 141.1 88.7 -1.0 11.2 23.1 59.1 73 82 A A < - 0 0 30 -3,-2.0 -27,-2.2 -28,-0.1 2,-0.5 -0.547 51.7-130.2 -78.3 138.9 12.9 26.5 58.7 74 83 A R E -D 45 0B 125 -2,-0.2 2,-0.3 -29,-0.2 -29,-0.3 -0.775 31.3-167.9 -87.6 129.0 16.6 26.5 57.8 75 84 A V E -D 44 0B 13 -31,-2.9 -31,-1.9 -2,-0.5 2,-0.2 -0.826 16.9-121.5-118.8 158.3 18.5 28.7 60.2 76 85 A A > - 0 0 67 -2,-0.3 3,-1.6 -33,-0.2 -36,-0.2 -0.499 48.3 -75.8 -91.2 164.6 22.0 30.1 60.2 77 86 A E T 3 S+ 0 0 143 1,-0.2 -36,-0.2 -2,-0.2 -1,-0.2 -0.249 119.5 30.1 -56.5 147.5 24.6 29.5 63.0 78 87 A G T 3 S+ 0 0 54 -38,-2.9 2,-0.3 1,-0.3 -1,-0.2 0.414 83.9 144.9 82.4 -2.2 23.9 31.6 66.1 79 88 A T < - 0 0 40 -3,-1.6 -39,-2.3 -39,-0.3 2,-0.8 -0.545 49.5-135.7 -74.3 128.2 20.1 31.6 65.5 80 89 A E E -A 39 0A 77 -2,-0.3 -41,-0.2 -41,-0.2 3,-0.1 -0.761 25.3-179.4 -83.1 113.3 18.0 31.5 68.7 81 90 A V E + 0 0 0 -43,-2.3 -13,-2.6 -2,-0.8 -12,-1.1 0.644 59.3 3.5 -90.9 -17.0 15.4 28.9 67.7 82 91 A A E -AC 38 67A 0 -44,-1.0 -44,-2.9 -15,-0.3 2,-0.4 -0.976 55.4-142.0-167.0 152.4 13.3 29.0 70.9 83 92 A R E -AC 37 66A 65 -17,-2.8 -17,-3.8 -2,-0.3 2,-0.4 -0.960 14.4-167.6-120.8 138.5 12.9 30.5 74.3 84 93 A V E +AC 36 65A 0 -48,-2.8 -48,-2.6 -2,-0.4 2,-0.4 -0.986 11.1 170.5-129.7 122.6 11.9 28.7 77.5 85 94 A R E +AC 35 64A 68 -21,-2.1 -21,-2.5 -2,-0.4 -50,-0.2 -0.996 29.7 75.8-137.2 134.4 10.9 30.4 80.7 86 95 A G E S-A 34 0A 10 -52,-1.8 -52,-3.4 -2,-0.4 -23,-0.1 -0.965 85.3 -0.3 162.5-162.1 9.4 29.0 83.9 87 96 A P E >> -A 33 0A 17 0, 0.0 4,-1.7 0, 0.0 3,-0.5 -0.312 61.6-139.6 -53.7 122.1 10.5 27.1 87.0 88 97 A L H 3> S+ 0 0 2 -56,-2.3 4,-2.9 1,-0.2 5,-0.3 0.862 101.0 59.6 -53.4 -38.3 14.2 26.4 86.5 89 98 A R H 3> S+ 0 0 66 -57,-0.4 4,-2.2 -60,-0.3 -1,-0.2 0.926 105.5 47.6 -56.7 -46.7 13.8 22.9 87.9 90 99 A G H <> S+ 0 0 2 -3,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.855 111.8 50.8 -63.3 -35.7 11.3 22.1 85.2 91 100 A I H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.941 112.6 44.7 -67.5 -46.4 13.6 23.5 82.5 92 101 A L H X S+ 0 0 8 -4,-2.9 4,-0.5 1,-0.2 -2,-0.2 0.825 111.1 56.1 -67.1 -31.0 16.6 21.5 83.8 93 102 A A H < S+ 0 0 1 -4,-2.2 4,-0.3 -5,-0.3 -1,-0.2 0.838 116.8 33.3 -70.2 -34.9 14.5 18.4 84.1 94 103 A G H X S+ 0 0 0 -4,-1.6 4,-2.6 -3,-0.2 5,-0.3 0.636 95.0 90.2 -96.9 -14.4 13.3 18.5 80.4 95 104 A E H X S+ 0 0 35 -4,-1.8 4,-2.7 1,-0.2 5,-0.3 0.897 85.2 48.2 -46.5 -59.5 16.5 19.9 78.8 96 105 A R H X S+ 0 0 42 -4,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.902 117.7 38.9 -53.9 -50.8 18.3 16.7 78.0 97 106 A L H > S+ 0 0 10 -4,-0.3 4,-2.4 2,-0.2 5,-0.3 0.926 115.2 53.3 -68.5 -44.2 15.4 14.8 76.4 98 107 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.944 115.6 39.2 -54.9 -52.6 14.1 17.9 74.6 99 108 A L H X S+ 0 0 3 -4,-2.7 4,-3.4 -5,-0.3 5,-0.3 0.866 110.7 58.7 -67.6 -38.1 17.5 18.7 73.0 100 109 A N H X S+ 0 0 18 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.942 114.2 38.4 -56.8 -46.7 18.3 15.0 72.3 101 110 A L H X S+ 0 0 1 -4,-2.4 4,-2.9 2,-0.2 5,-0.4 0.929 116.5 50.7 -69.5 -46.7 15.1 14.8 70.2 102 111 A L H X S+ 0 0 1 -4,-2.7 4,-2.3 -5,-0.3 -55,-0.4 0.925 113.8 45.3 -58.4 -44.9 15.5 18.3 68.7 103 112 A Q H X S+ 0 0 12 -4,-3.4 165,-2.3 2,-0.2 4,-2.1 0.904 114.8 48.1 -65.4 -42.4 19.1 17.6 67.7 104 113 A R H X S+ 0 0 41 -4,-2.0 4,-1.8 -5,-0.3 -2,-0.2 0.957 116.8 39.7 -64.1 -52.9 18.2 14.1 66.3 105 114 A L H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.894 115.6 51.6 -67.0 -39.6 15.2 15.2 64.2 106 115 A S H X S+ 0 0 0 -4,-2.3 4,-2.8 -59,-0.4 -61,-0.4 0.911 108.0 54.1 -62.8 -40.4 16.8 18.4 63.0 107 116 A G H X S+ 0 0 4 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.889 110.4 45.6 -59.9 -41.5 19.9 16.4 62.0 108 117 A I H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.939 113.5 48.6 -67.1 -46.9 17.7 14.1 59.9 109 118 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.891 111.1 52.3 -61.0 -37.8 15.7 17.0 58.4 110 119 A T H X S+ 0 0 36 -4,-2.8 4,-1.7 -65,-0.4 -1,-0.2 0.929 112.1 42.8 -64.7 -47.7 19.0 18.8 57.6 111 120 A L H X S+ 0 0 43 -4,-2.0 4,-2.0 2,-0.2 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