==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JAN-08 3C2R . COMPND 2 MOLECULE: NICOTINATE-NUCLEOTIDE PYROPHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR E.DI LUCCIO,D.K.WILSON . 534 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24122.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 9.0 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 . 33 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 173 32.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.5 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 0 2 2 0 0 5 1 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 2 1 7 2 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 . 0 2 0 2 2 0 0 2 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 . 2 0 2 0 0 2 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 2 A P 0 0 186 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.1 -18.6 -19.3 50.7 2 3 A V > - 0 0 79 1,-0.1 3,-1.7 0, 0.0 4,-0.1 -0.954 360.0-145.9-116.6 125.5 -18.2 -15.6 49.8 3 4 A Y G > S+ 0 0 104 -2,-0.5 3,-3.2 1,-0.3 4,-0.3 0.883 95.5 65.6 -53.5 -46.5 -18.5 -14.4 46.2 4 5 A E G > S+ 0 0 81 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.690 86.3 74.6 -53.8 -17.1 -15.9 -11.6 46.5 5 6 A H G < S+ 0 0 142 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.532 78.2 75.0 -73.7 -3.8 -13.4 -14.4 47.0 6 7 A L G < S+ 0 0 103 -3,-3.2 -1,-0.3 -4,-0.1 -2,-0.2 0.767 83.6 79.2 -75.3 -26.0 -13.7 -15.1 43.3 7 8 A L S < S- 0 0 22 -3,-1.3 2,-0.0 -4,-0.3 4,-0.0 -0.699 91.4-116.5 -86.4 127.5 -11.6 -11.9 42.8 8 9 A P - 0 0 70 0, 0.0 -2,-0.1 0, 0.0 5,-0.1 -0.354 23.0-116.0 -64.6 140.7 -7.8 -12.4 43.3 9 10 A V S S+ 0 0 132 -4,-0.1 2,-0.3 1,-0.1 -2,-0.0 0.852 102.9 11.6 -44.2 -40.1 -6.3 -10.4 46.1 10 11 A N S S+ 0 0 109 4,-0.0 2,-0.3 3,-0.0 -1,-0.1 -0.980 87.1 102.3-139.1 154.8 -4.3 -8.6 43.4 11 12 A G S >> S- 0 0 32 -2,-0.3 3,-1.4 1,-0.1 4,-0.8 -0.947 80.3 -48.3 160.4-175.7 -4.6 -8.5 39.7 12 13 A A H 3> S+ 0 0 62 -2,-0.3 4,-1.9 1,-0.3 3,-0.1 0.741 117.1 72.3 -57.3 -28.1 -5.9 -6.4 36.7 13 14 A W H 3> S+ 0 0 20 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.844 97.1 51.0 -60.9 -29.1 -9.3 -5.8 38.3 14 15 A R H <> S+ 0 0 77 -3,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.875 107.2 50.9 -76.5 -34.3 -7.7 -3.4 40.8 15 16 A Q H X S+ 0 0 103 -4,-0.8 4,-2.6 1,-0.2 5,-0.2 0.837 104.0 62.4 -68.1 -31.0 -5.9 -1.4 38.1 16 17 A D H X S+ 0 0 41 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.942 101.8 49.1 -56.6 -48.7 -9.3 -1.2 36.4 17 18 A V H X S+ 0 0 0 -4,-1.4 4,-1.6 1,-0.2 3,-0.3 0.922 110.2 52.1 -56.9 -44.4 -10.6 0.7 39.4 18 19 A T H X S+ 0 0 43 -4,-1.7 4,-1.8 1,-0.3 -1,-0.2 0.897 108.9 48.8 -59.5 -42.6 -7.6 3.0 39.2 19 20 A N H X S+ 0 0 77 -4,-2.6 4,-1.4 1,-0.2 -1,-0.3 0.758 106.8 57.3 -69.9 -24.5 -8.2 3.7 35.5 20 21 A W H X S+ 0 0 14 -4,-1.7 4,-0.9 -3,-0.3 -1,-0.2 0.843 105.6 49.9 -74.2 -32.3 -11.8 4.4 36.3 21 22 A L H X S+ 0 0 22 -4,-1.6 4,-1.1 1,-0.2 3,-0.4 0.894 110.5 50.5 -69.4 -38.5 -10.7 7.1 38.7 22 23 A S H < S+ 0 0 70 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.809 102.0 60.9 -66.9 -33.5 -8.4 8.6 36.0 23 24 A E H < S+ 0 0 40 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.835 111.3 40.9 -61.7 -33.7 -11.3 8.6 33.6 24 25 A D H < S+ 0 0 0 -4,-0.9 414,-2.1 -3,-0.4 415,-0.2 0.636 122.3 37.5 -92.5 -17.6 -13.0 11.0 36.0 25 26 A V < + 0 0 33 -4,-1.1 -1,-0.2 413,-0.1 -2,-0.1 -0.580 60.7 163.4-133.9 73.5 -10.1 13.2 37.0 26 27 A P S S- 0 0 82 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.858 82.8 -12.5 -59.0 -34.7 -7.9 13.7 33.8 27 28 A S S S+ 0 0 69 1,-0.4 2,-0.3 -3,-0.1 -2,-0.1 0.495 121.4 0.1-128.4 -84.2 -6.2 16.6 35.5 28 29 A F - 0 0 142 411,-0.1 2,-0.6 438,-0.0 -1,-0.4 -0.792 46.8-137.2-118.6 161.4 -7.4 18.3 38.6 29 30 A D >> + 0 0 37 -2,-0.3 4,-1.5 1,-0.2 3,-0.8 -0.749 24.7 176.4-114.9 80.0 -10.2 17.9 41.1 30 31 A F H >> S+ 0 0 17 -2,-0.6 4,-1.8 408,-0.6 3,-0.8 0.920 79.9 55.1 -49.6 -50.9 -11.3 21.5 41.7 31 32 A G H 3> S+ 0 0 9 407,-0.4 4,-1.9 1,-0.3 -1,-0.3 0.847 105.9 53.4 -53.6 -35.0 -14.2 20.5 43.9 32 33 A G H <> S+ 0 0 4 -3,-0.8 4,-1.4 1,-0.2 -1,-0.3 0.830 105.3 54.7 -69.2 -34.5 -11.8 18.6 46.0 33 34 A Y H << S+ 0 0 130 -4,-1.5 -2,-0.2 -3,-0.8 -1,-0.2 0.852 111.4 43.0 -67.4 -35.7 -9.7 21.7 46.4 34 35 A V H < S+ 0 0 11 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.879 115.0 49.0 -77.6 -35.1 -12.5 23.7 47.7 35 36 A V H < S- 0 0 7 -4,-1.9 3,-0.5 -5,-0.2 -2,-0.2 0.703 93.9-167.0 -80.0 -21.6 -13.9 21.1 50.0 36 37 A G < - 0 0 29 -4,-1.4 63,-1.6 1,-0.2 64,-0.1 -0.045 34.5 -63.6 64.4-165.7 -10.5 20.3 51.6 37 38 A S S S+ 0 0 72 61,-0.2 2,-0.2 60,-0.1 -1,-0.2 -0.013 70.9 140.6-114.8 29.6 -9.5 17.3 53.7 38 39 A D - 0 0 110 -3,-0.5 60,-1.8 59,-0.2 58,-0.1 -0.523 61.1-101.8 -72.4 137.0 -11.6 17.5 56.9 39 40 A L E +A 97 0A 133 58,-0.2 2,-0.3 -2,-0.2 -1,-0.1 -0.303 51.3 174.6 -57.0 134.6 -12.8 14.2 58.1 40 41 A K E -A 96 0A 67 56,-2.5 56,-1.7 -3,-0.1 2,-0.3 -0.884 26.6-132.0-139.5 170.1 -16.4 13.6 57.3 41 42 A E E -A 95 0A 103 -2,-0.3 227,-2.7 54,-0.2 2,-0.3 -0.925 24.7-179.6-123.4 149.4 -19.1 10.9 57.5 42 43 A A E -AB 94 267A 1 52,-2.2 52,-2.6 -2,-0.3 2,-0.5 -0.989 21.2-134.6-148.9 155.0 -21.5 9.9 54.8 43 44 A N E -AB 93 266A 50 223,-2.5 223,-1.8 -2,-0.3 2,-0.7 -0.944 11.2-147.9-114.5 129.7 -24.3 7.5 54.1 44 45 A L E -AB 92 265A 1 48,-2.9 47,-3.1 -2,-0.5 48,-1.1 -0.875 25.8-161.2 -95.8 116.1 -24.5 5.3 51.0 45 46 A Y E -AB 90 264A 49 219,-3.2 219,-1.9 -2,-0.7 2,-0.6 -0.819 19.7-145.5-107.2 141.9 -28.2 4.9 50.2 46 47 A C E -AB 89 263A 0 43,-2.1 43,-1.4 -2,-0.4 217,-0.2 -0.884 17.2-175.6 -97.2 123.5 -30.0 2.3 48.1 47 48 A K + 0 0 86 215,-3.1 2,-0.3 -2,-0.6 216,-0.2 0.383 59.6 42.4-104.1 3.5 -33.0 4.1 46.5 48 49 A Q S S- 0 0 84 214,-0.6 31,-0.1 41,-0.1 -1,-0.1 -0.997 88.4 -94.5-150.2 146.7 -34.8 1.3 44.6 49 50 A D S S+ 0 0 81 -2,-0.3 2,-0.3 31,-0.1 31,-0.2 -0.301 70.7 98.4 -62.0 139.4 -35.7 -2.3 45.3 50 51 A G E S-D 79 0B 2 29,-2.4 29,-2.5 27,-0.1 2,-0.5 -0.883 74.2 -60.8 160.1 169.9 -33.3 -4.9 44.1 51 52 A M E -D 78 0B 14 65,-0.4 69,-0.3 -2,-0.3 27,-0.2 -0.667 51.5-123.2 -82.5 123.5 -30.4 -7.2 45.0 52 53 A L + 0 0 1 25,-2.3 24,-2.4 -2,-0.5 2,-0.3 -0.462 44.7 158.5 -67.1 128.5 -27.2 -5.4 46.2 53 54 A C + 0 0 0 59,-0.3 63,-0.6 -2,-0.2 62,-0.2 -0.995 37.6 55.0-152.8 156.4 -24.2 -6.2 44.1 54 55 A G > + 0 0 0 -2,-0.3 4,-2.4 61,-0.2 5,-0.2 0.619 59.2 142.2 95.7 18.3 -20.7 -4.8 43.3 55 56 A V H > + 0 0 14 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.910 68.6 46.3 -60.0 -48.9 -19.5 -4.6 46.9 56 57 A P H > S+ 0 0 9 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.855 114.9 49.2 -67.0 -27.5 -15.9 -5.7 46.4 57 58 A F H > S+ 0 0 3 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.890 113.1 45.2 -75.3 -39.7 -15.5 -3.4 43.4 58 59 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.873 112.1 54.4 -68.5 -36.3 -17.0 -0.4 45.3 59 60 A Q H X S+ 0 0 43 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.855 104.4 53.0 -65.6 -35.9 -14.8 -1.4 48.2 60 61 A E H X S+ 0 0 12 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.853 107.8 52.1 -68.2 -33.6 -11.7 -1.3 46.1 61 62 A V H X S+ 0 0 0 -4,-1.3 4,-1.1 2,-0.2 -2,-0.2 0.919 110.9 47.1 -67.0 -42.0 -12.7 2.3 45.0 62 63 A F H <>S+ 0 0 2 -4,-2.1 5,-2.0 1,-0.2 -2,-0.2 0.869 110.6 53.3 -67.3 -35.1 -13.0 3.3 48.6 63 64 A N H ><5S+ 0 0 78 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.940 107.8 48.7 -63.8 -48.8 -9.7 1.7 49.4 64 65 A Q H 3<5S+ 0 0 55 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.736 110.2 52.3 -64.6 -22.9 -7.8 3.6 46.7 65 66 A C T 3<5S- 0 0 9 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.221 116.8-118.9 -95.6 12.8 -9.3 6.8 47.9 66 67 A E T < 5 + 0 0 140 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.922 63.1 142.4 49.0 59.7 -8.1 6.0 51.4 67 68 A L < - 0 0 7 -5,-2.0 2,-0.4 29,-0.1 29,-0.2 -0.779 49.3-126.2-122.2 164.5 -11.5 5.8 53.1 68 69 A Q E -C 95 0A 111 27,-2.6 27,-2.4 -2,-0.3 2,-0.4 -0.943 28.9-167.4-112.0 135.3 -13.0 3.6 55.8 69 70 A V E -C 94 0A 27 -2,-0.4 2,-0.6 25,-0.2 25,-0.2 -0.982 16.8-161.4-130.7 138.6 -16.3 1.9 55.0 70 71 A E E -C 93 0A 103 23,-2.8 23,-2.4 -2,-0.4 2,-0.4 -0.920 15.9-155.2-117.6 103.5 -18.9 0.0 57.1 71 72 A W E -C 92 0A 59 -2,-0.6 21,-0.3 21,-0.2 20,-0.1 -0.656 7.7-167.3 -81.4 130.4 -21.2 -2.2 55.0 72 73 A L S S+ 0 0 77 19,-2.5 2,-0.4 -2,-0.4 20,-0.2 0.610 70.0 42.4 -91.4 -15.6 -24.6 -2.9 56.5 73 74 A F S S- 0 0 69 18,-0.7 -1,-0.1 4,-0.0 3,-0.1 -0.990 82.3-115.9-134.7 144.0 -25.7 -5.7 54.2 74 75 A K > - 0 0 170 -2,-0.4 3,-1.6 1,-0.1 -22,-0.2 -0.376 50.6 -87.6 -69.9 154.4 -23.9 -8.7 52.8 75 76 A E T 3 S+ 0 0 38 1,-0.3 -22,-0.2 -24,-0.1 -72,-0.1 -0.427 117.4 35.2 -64.2 135.5 -23.6 -8.7 49.0 76 77 A G T 3 S+ 0 0 27 -24,-2.4 2,-0.3 1,-0.3 -1,-0.3 0.417 80.0 146.7 100.1 -1.2 -26.6 -10.3 47.5 77 78 A S < - 0 0 34 -3,-1.6 -25,-2.3 -25,-0.2 2,-1.1 -0.549 54.0-123.5 -72.1 127.8 -29.1 -8.9 50.1 78 79 A F E -D 51 0B 129 -2,-0.3 -27,-0.3 -27,-0.2 2,-0.2 -0.606 33.2-158.2 -74.4 102.9 -32.5 -8.2 48.5 79 80 A L E -D 50 0B 3 -29,-2.5 -29,-2.4 -2,-1.1 12,-0.0 -0.588 13.8-171.6 -84.5 145.0 -32.9 -4.5 49.5 80 81 A E > - 0 0 97 -2,-0.2 2,-1.8 -31,-0.2 3,-0.7 -0.668 9.9-174.7-139.3 82.3 -36.3 -2.9 49.6 81 82 A P T 3 + 0 0 9 0, 0.0 5,-0.1 0, 0.0 -32,-0.1 0.043 49.6 122.2 -65.9 32.9 -36.3 0.9 50.0 82 83 A S T 3 + 0 0 84 -2,-1.8 2,-0.4 5,-0.1 4,-0.1 0.917 39.9 91.1 -62.2 -48.3 -40.1 0.7 50.3 83 84 A K < - 0 0 74 -3,-0.7 5,-0.4 1,-0.2 -3,-0.0 -0.624 64.6-167.6 -62.4 122.4 -40.3 2.3 53.8 84 85 A N + 0 0 135 -2,-0.4 3,-0.4 3,-0.3 -1,-0.2 -0.190 59.7 112.9 -77.8 -12.7 -40.7 5.7 52.1 85 86 A D S S- 0 0 144 3,-0.1 2,-0.4 0, 0.0 -2,-0.1 0.690 122.2 -17.5 -58.3 -11.4 -40.1 7.2 55.6 86 87 A S S S- 0 0 56 -5,-0.1 2,-0.0 -4,-0.1 0, 0.0 -0.399 89.6-127.2-170.4 165.0 -37.2 8.1 53.4 87 88 A G S S+ 0 0 25 -3,-0.4 2,-0.3 -2,-0.4 -3,-0.3 -0.764 79.9 84.4-103.6 66.6 -37.5 5.6 50.5 88 89 A K - 0 0 58 -5,-0.4 2,-0.4 -8,-0.1 -41,-0.2 -0.970 64.0-142.8-165.5 156.5 -33.9 4.5 51.0 89 90 A I E -A 46 0A 27 -43,-1.4 -43,-2.1 -2,-0.3 2,-0.5 -0.997 26.8-120.5-131.1 127.4 -31.8 2.1 53.1 90 91 A V E +A 45 0A 45 -2,-0.4 -45,-0.2 -45,-0.2 3,-0.1 -0.549 33.0 175.2 -69.3 117.2 -28.4 2.9 54.3 91 92 A V E + 0 0 0 -47,-3.1 -19,-2.5 -2,-0.5 -18,-0.7 0.604 63.3 10.1 -98.1 -15.4 -26.2 0.2 52.8 92 93 A A E -AC 44 71A 0 -48,-1.1 -48,-2.9 -21,-0.3 2,-0.5 -0.963 57.6-138.3-166.2 146.0 -22.9 1.6 54.1 93 94 A K E -AC 43 70A 64 -23,-2.4 -23,-2.8 -2,-0.3 2,-0.4 -0.939 27.2-165.3-107.5 123.2 -21.3 4.2 56.4 94 95 A I E +AC 42 69A 0 -52,-2.6 -52,-2.2 -2,-0.5 2,-0.3 -0.903 8.7 179.9-115.0 140.3 -18.3 6.0 55.0 95 96 A T E +AC 41 68A 31 -27,-2.4 -27,-2.6 -2,-0.4 -54,-0.2 -0.994 27.4 85.4-139.0 143.3 -15.7 8.1 56.8 96 97 A G E S-A 40 0A 0 -56,-1.7 -56,-2.5 -2,-0.3 -29,-0.1 -0.954 74.4 -17.7 158.0-174.9 -12.6 10.0 55.6 97 98 A P E >> -A 39 0A 30 0, 0.0 4,-2.0 0, 0.0 3,-0.6 -0.293 61.6-121.7 -57.0 137.4 -11.2 13.2 54.2 98 99 A A H 3> S+ 0 0 3 -60,-1.8 4,-1.9 1,-0.3 -61,-0.2 0.877 110.9 48.6 -49.2 -47.3 -13.9 15.3 52.6 99 100 A K H 3> S+ 0 0 85 -63,-1.6 4,-1.7 1,-0.2 -1,-0.3 0.839 108.3 55.8 -65.2 -32.2 -12.3 15.4 49.2 100 101 A N H <> S+ 0 0 13 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.927 107.0 48.2 -67.5 -42.7 -11.7 11.7 49.2 101 102 A I H X S+ 0 0 1 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.965 113.7 46.6 -61.1 -51.3 -15.4 10.9 49.8 102 103 A L H X S+ 0 0 14 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.788 112.5 50.9 -63.1 -27.8 -16.5 13.2 47.0 103 104 A L H X S+ 0 0 42 -4,-1.7 4,-0.5 -5,-0.2 -1,-0.2 0.886 113.3 43.9 -76.3 -39.9 -13.9 11.9 44.6 104 105 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 5,-0.3 0.766 97.3 84.2 -74.9 -25.9 -14.9 8.2 45.2 105 106 A E H X S+ 0 0 30 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.823 89.7 37.6 -45.9 -58.5 -18.6 9.0 45.0 106 107 A R H X S+ 0 0 29 -4,-0.5 4,-2.9 -3,-0.2 5,-0.3 0.967 118.4 48.5 -62.6 -54.2 -19.6 8.9 41.4 107 108 A T H X S+ 0 0 6 -4,-0.5 4,-1.4 1,-0.2 -2,-0.2 0.901 113.8 46.7 -53.5 -46.6 -17.3 6.1 40.4 108 109 A A H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.873 113.5 48.7 -66.0 -38.1 -18.5 3.9 43.2 109 110 A L H X S+ 0 0 3 -4,-1.8 4,-3.1 -5,-0.3 5,-0.3 0.901 107.0 54.2 -69.5 -41.9 -22.1 4.6 42.6 110 111 A N H X S+ 0 0 3 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.853 111.6 48.4 -60.2 -32.2 -21.8 3.9 38.9 111 112 A I H X S+ 0 0 0 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187 A T H > S+ 0 0 35 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.878 107.9 47.6 -73.1 -38.5 -17.1 -34.5 13.6 187 188 A N H > S+ 0 0 66 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.895 113.4 48.8 -68.6 -39.4 -14.1 -32.9 11.8 188 189 A A H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.934 113.9 45.1 -64.8 -47.2 -14.9 -29.5 13.5 189 190 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.3 -2,-0.2 0.862 111.1 54.1 -65.4 -35.8 -15.1 -31.2 17.0 190 191 A K H X S+ 0 0 130 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.913 113.0 43.6 -63.6 -42.3 -11.9 -33.2 16.2 191 192 A N H X S+ 0 0 57 -4,-2.2 4,-1.0 2,-0.2 -2,-0.2 0.940 113.7 48.8 -67.7 -49.9 -10.1 -30.0 15.4 192 193 A A H >X S+ 0 0 0 -4,-3.0 4,-2.9 1,-0.2 3,-0.9 0.927 113.6 48.7 -56.2 -44.2 -11.5 -28.0 18.4 193 194 A R H 3X S+ 0 0 65 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.841 101.2 64.5 -65.1 -33.3 -10.5 -31.0 20.6 194 195 A A H 3< S+ 0 0 72 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.762 117.5 25.9 -62.1 -25.4 -7.0 -31.1 19.0 195 196 A V H << S+ 0 0 57 -4,-1.0 -2,-0.2 -3,-0.9 -1,-0.2 0.797 122.7 46.2-108.0 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