==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 21-JUN-07 2QDK . COMPND 2 MOLECULE: URIDINE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR V.I.TIMOFEEV,B.P.PAVLYUK,A.A.LASHKOV,A.G.GABDOULKHAKOV, . 1467 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 47174.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1062 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 201 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 147 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 12 0.8 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 . 82 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 173 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 349 23.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 29 2.0 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 5 3 0 6 3 6 0 0 1 7 7 1 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 10 3 0 5 0 0 3 6 3 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 9 6 0 0 12 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 . 0 0 0 0 0 0 0 0 3 3 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 S 0 0 176 0, 0.0 2,-0.5 0, 0.0 9,-0.1 0.000 360.0 360.0 360.0 27.4 -20.8 40.8 61.8 2 3 A K + 0 0 180 7,-0.1 2,-0.3 2,-0.0 9,-0.1 -0.842 360.0 168.0 -79.1 130.2 -23.1 38.6 59.9 3 4 A S - 0 0 50 -2,-0.5 8,-0.2 1,-0.1 3,-0.0 -0.970 36.8-163.0-144.9 136.9 -21.4 35.2 59.7 4 5 A D S S+ 0 0 87 6,-2.9 2,-0.3 -2,-0.3 7,-0.2 0.533 83.1 48.1 -84.4 -9.0 -22.6 31.8 58.6 5 6 A V S S- 0 0 12 5,-0.6 4,-0.5 1,-0.1 5,-0.1 -0.884 82.7-119.3-135.7 160.8 -19.6 30.2 60.3 6 7 A F S S+ 0 0 74 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.0 0.840 99.7 16.8 -74.2 -35.7 -17.7 30.4 63.6 7 8 A H S S+ 0 0 18 68,-0.1 42,-0.2 1,-0.0 -1,-0.1 0.772 114.7 57.2-108.0 -33.5 -14.2 31.5 62.6 8 9 A L S S- 0 0 1 67,-0.1 43,-0.1 2,-0.1 -2,-0.1 0.685 84.6-136.4 -83.2 -20.0 -14.0 33.0 59.1 9 10 A G + 0 0 20 -4,-0.5 2,-0.3 1,-0.2 -7,-0.1 0.843 59.0 131.0 69.1 34.4 -16.6 35.8 59.5 10 11 A L - 0 0 0 -5,-0.1 -6,-2.9 -9,-0.1 -5,-0.6 -0.862 43.4-155.2-121.6 155.0 -18.1 34.9 56.1 11 12 A T > - 0 0 17 -2,-0.3 4,-0.6 -8,-0.2 3,-0.3 -0.793 34.9-110.0-118.6 166.0 -21.6 34.3 54.7 12 13 A K H >>>S+ 0 0 131 -2,-0.3 3,-1.5 1,-0.2 4,-0.7 0.905 119.6 59.0 -61.3 -40.1 -22.7 32.4 51.6 13 14 A N H >45S+ 0 0 119 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.864 96.5 62.2 -54.6 -40.2 -23.6 35.7 50.0 14 15 A D H 345S+ 0 0 41 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.2 0.750 99.2 55.8 -54.6 -30.5 -20.0 36.8 50.4 15 16 A L H X<5S- 0 0 2 -3,-1.5 3,-2.0 -4,-0.6 -1,-0.2 0.706 89.8-151.5 -79.8 -21.4 -18.9 34.0 48.1 16 17 A Q T <<5S- 0 0 112 -3,-1.1 44,-0.4 -4,-0.7 -3,-0.1 0.862 75.2 -44.8 51.6 40.6 -21.2 35.0 45.2 17 18 A G T 3 - 0 0 24 1,-0.1 3,-1.9 40,-0.1 4,-0.5 -0.696 68.9-149.1 -91.0 124.8 0.2 33.3 55.3 27 28 A P G >> S+ 0 0 22 0, 0.0 3,-1.0 0, 0.0 4,-0.5 0.814 98.0 63.7 -58.0 -31.3 -2.6 35.9 55.6 28 29 A E G 34 S+ 0 0 110 1,-0.2 4,-0.5 2,-0.2 3,-0.1 0.674 96.6 57.7 -66.1 -19.6 -0.3 38.5 54.1 29 30 A R G <> S+ 0 0 9 -3,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.639 86.8 80.0 -84.9 -14.5 -0.1 36.5 50.8 30 31 A V H <> S+ 0 0 0 -3,-1.0 4,-2.6 -4,-0.5 5,-0.2 0.921 92.1 46.1 -63.0 -49.0 -3.9 36.6 50.3 31 32 A E H X S+ 0 0 105 -4,-0.5 4,-1.3 1,-0.2 -1,-0.2 0.865 111.8 53.8 -61.8 -37.2 -4.1 40.1 48.9 32 33 A K H 4 S+ 0 0 102 -4,-0.5 4,-0.2 2,-0.2 -1,-0.2 0.906 111.1 44.4 -65.6 -43.3 -1.1 39.4 46.6 33 34 A I H >< S+ 0 0 0 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.908 110.8 54.0 -67.7 -41.9 -2.8 36.3 45.1 34 35 A A H >< S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.3 -1,-0.2 0.809 97.8 66.7 -60.7 -27.9 -6.1 38.0 44.7 35 36 A A T 3< S+ 0 0 69 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.573 88.7 66.0 -75.5 -8.8 -4.3 40.8 42.8 36 37 A L T < S+ 0 0 77 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.515 102.7 56.7 -85.0 -5.1 -3.6 38.3 40.0 37 38 A M S < S- 0 0 12 -3,-1.7 2,-0.3 -4,-0.2 19,-0.2 -0.513 96.7 -74.5-116.8-171.5 -7.3 38.1 39.3 38 39 A D E S-C 55 0A 94 17,-2.8 17,-2.5 1,-0.2 -2,-0.1 -0.656 95.6 -13.6 -97.6 137.4 -10.2 40.5 38.4 39 40 A K E S- 0 0 167 -2,-0.3 -1,-0.2 15,-0.2 14,-0.1 0.833 78.0-166.3 48.2 50.4 -11.9 43.0 40.7 40 41 A P E - 0 0 48 0, 0.0 2,-0.3 0, 0.0 14,-0.2 -0.339 7.5-174.8 -67.0 146.0 -10.6 41.5 44.0 41 42 A V E -C 53 0A 59 12,-2.6 12,-2.5 -2,-0.0 2,-0.2 -0.998 27.1-115.9-140.9 141.8 -12.2 42.7 47.2 42 43 A K E -C 52 0A 118 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.561 28.6-179.9 -75.9 137.4 -11.3 42.0 50.8 43 44 A L E - 0 0 37 8,-3.2 2,-0.3 1,-0.4 9,-0.2 0.838 54.5 -32.2-103.9 -47.5 -14.0 40.0 52.7 44 45 A A E -C 51 0A 11 7,-1.5 7,-2.7 2,-0.0 -1,-0.4 -0.988 37.9-151.1-169.6 159.2 -12.8 39.6 56.3 45 46 A S E +C 50 0A 49 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.889 26.7 154.8-146.1 113.9 -9.8 39.1 58.5 46 47 A H E > -C 49 0A 77 3,-2.2 3,-2.8 -2,-0.3 -2,-0.0 -0.991 66.2 -37.0-141.7 133.1 -10.1 37.2 61.8 47 48 A R T 3 S- 0 0 53 -2,-0.3 20,-0.1 1,-0.3 713,-0.1 -0.276 126.8 -24.2 47.3-130.4 -7.3 35.4 63.7 48 49 A E T 3 S+ 0 0 1 18,-0.1 2,-0.9 1,-0.1 -1,-0.3 0.300 118.0 102.4 -91.3 13.1 -5.1 33.9 60.9 49 50 A F E < +C 46 0A 1 -3,-2.8 -3,-2.2 -42,-0.2 2,-0.5 -0.802 41.4 167.5-105.5 98.3 -7.9 33.8 58.5 50 51 A T E -C 45 0A 16 -2,-0.9 15,-2.2 -5,-0.2 2,-0.4 -0.935 14.1-170.4-106.6 128.5 -7.8 36.6 55.9 51 52 A S E +CD 44 64A 1 -7,-2.7 -8,-3.2 -2,-0.5 -7,-1.5 -0.963 12.0 176.0-127.4 138.8 -10.2 36.2 52.9 52 53 A W E -CD 42 63A 34 11,-2.8 11,-2.5 -2,-0.4 2,-0.4 -0.906 17.1-144.5-126.5 160.4 -10.7 38.0 49.6 53 54 A R E +CD 41 62A 62 -12,-2.5 -12,-2.6 -2,-0.3 2,-0.3 -0.957 26.9 157.4-122.6 144.6 -13.0 37.3 46.6 54 55 A A E - D 0 61A 2 7,-2.3 7,-2.7 -2,-0.4 2,-0.4 -0.890 36.3-104.9-148.9 179.4 -12.1 37.9 43.0 55 56 A E E -CD 38 60A 73 -17,-2.5 -17,-2.8 -2,-0.3 2,-0.5 -0.944 20.3-170.4-115.1 140.4 -13.1 36.8 39.5 56 57 A L E > S- D 0 59A 10 3,-2.5 3,-1.9 -2,-0.4 -19,-0.1 -0.992 81.6 -20.9-126.2 117.7 -11.3 34.4 37.3 57 58 A D T 3 S- 0 0 89 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.865 131.1 -47.8 49.1 40.3 -12.6 34.2 33.7 58 59 A G T 3 S+ 0 0 55 1,-0.2 2,-0.4 -20,-0.0 -1,-0.3 0.429 117.0 105.5 89.3 -0.7 -15.9 35.6 34.9 59 60 A K E < S- D 0 56A 116 -3,-1.9 -3,-2.5 -41,-0.0 -1,-0.2 -0.921 72.5-110.0-121.6 140.6 -16.5 33.4 37.9 60 61 A A E - D 0 55A 21 -2,-0.4 -41,-0.6 -44,-0.4 -40,-0.4 -0.367 36.3-178.7 -69.0 141.8 -16.1 34.2 41.6 61 62 A V E - D 0 54A 0 -7,-2.7 -7,-2.3 -43,-0.2 2,-0.4 -0.983 17.1-137.2-139.2 146.1 -13.2 32.6 43.4 62 63 A I E -bD 21 53A 0 -42,-2.3 -40,-2.7 -2,-0.3 2,-0.4 -0.858 8.3-165.3-105.8 142.6 -12.1 32.8 47.1 63 64 A V E +bD 22 52A 0 -11,-2.5 -11,-2.8 -2,-0.4 2,-0.4 -0.998 22.1 166.5-119.9 125.1 -8.6 33.3 48.4 64 65 A C E - D 0 51A 1 -42,-2.2 -13,-0.2 -2,-0.4 2,-0.1 -0.991 31.1-126.0-144.9 128.8 -8.4 32.5 52.1 65 66 A S - 0 0 0 -15,-2.2 -40,-0.2 -2,-0.4 -39,-0.1 -0.396 11.1-164.7 -76.4 151.9 -5.4 31.9 54.4 66 67 A T - 0 0 0 -42,-1.9 10,-0.2 1,-0.2 -41,-0.2 0.596 30.6-134.7-104.1 -17.5 -5.2 28.8 56.6 67 68 A G - 0 0 0 -42,-1.6 2,-0.4 -43,-0.3 -1,-0.2 -0.226 47.9 -45.6 72.4-178.4 -2.5 29.8 59.0 68 69 A I S S+ 0 0 6 -2,-0.1 738,-0.5 4,-0.1 4,-0.4 -0.702 102.8 18.8 -88.3 132.0 0.4 27.4 59.8 69 70 A G S > S- 0 0 0 -2,-0.4 4,-1.9 736,-0.2 5,-0.2 0.109 86.5 -79.0 102.0 157.3 -0.5 23.8 60.5 70 71 A G H > S+ 0 0 0 126,-0.5 4,-3.0 1,-0.2 5,-0.2 0.867 117.8 61.0 -60.2 -40.9 -3.2 21.2 60.1 71 72 A P H > S+ 0 0 0 0, 0.0 4,-1.3 0, 0.0 824,-0.3 0.950 111.2 36.6 -57.7 -48.7 -5.4 22.4 63.0 72 73 A S H > S+ 0 0 0 730,-0.5 4,-2.1 -4,-0.4 -2,-0.2 0.876 116.7 55.5 -72.6 -31.0 -6.0 26.0 61.6 73 74 A T H X S+ 0 0 2 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.926 103.7 54.5 -60.6 -45.7 -6.2 24.5 58.0 74 75 A S H X S+ 0 0 3 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.845 107.8 49.7 -58.6 -35.4 -8.9 22.1 59.1 75 76 A I H X S+ 0 0 0 -4,-1.3 4,-2.6 -5,-0.2 5,-0.2 0.939 112.3 46.7 -67.7 -46.0 -11.0 25.0 60.4 76 77 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 -10,-0.2 5,-0.2 0.923 115.1 45.6 -62.8 -46.8 -10.6 27.0 57.2 77 78 A V H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.924 113.7 48.5 -64.6 -44.7 -11.4 24.1 55.0 78 79 A E H X S+ 0 0 6 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.956 115.4 44.4 -61.8 -46.5 -14.4 22.9 57.0 79 80 A E H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.895 112.3 50.4 -70.5 -37.7 -15.9 26.4 57.2 80 81 A L H X>S+ 0 0 0 -4,-2.7 5,-2.7 -5,-0.2 4,-0.8 0.885 109.9 52.9 -62.0 -39.6 -15.3 27.1 53.5 81 82 A A H ><5S+ 0 0 0 -4,-2.4 3,-0.8 3,-0.2 -2,-0.2 0.905 105.9 52.1 -60.4 -43.9 -17.0 23.8 52.7 82 83 A Q H 3<5S+ 0 0 47 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.875 108.7 52.9 -58.0 -33.6 -20.0 24.8 54.8 83 84 A L H 3<5S- 0 0 8 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.621 132.7 -90.1 -80.6 -15.8 -20.1 28.0 52.7 84 85 A G T <<5S+ 0 0 17 -3,-0.8 -3,-0.2 -4,-0.8 2,-0.2 0.338 75.3 143.5 126.4 -1.1 -20.1 26.1 49.4 85 86 A I < + 0 0 0 -5,-2.7 -1,-0.3 1,-0.1 -65,-0.2 -0.497 13.5 168.1 -71.5 135.4 -16.4 25.6 48.5 86 87 A R + 0 0 87 -67,-2.6 125,-2.6 1,-0.2 2,-0.4 0.475 60.7 53.4-121.2 -14.3 -15.8 22.2 46.8 87 88 A T E -ae 20 211A 8 -68,-1.5 -66,-2.8 123,-0.2 2,-0.4 -0.996 61.6-170.2-130.5 130.9 -12.3 22.6 45.4 88 89 A F E -ae 21 212A 0 123,-3.0 125,-2.1 -2,-0.4 2,-0.5 -0.971 5.2-171.1-124.8 127.4 -9.2 23.7 47.3 89 90 A L E -ae 22 213A 0 -68,-2.4 -66,-3.1 -2,-0.4 2,-0.4 -0.958 12.2-154.3-117.0 113.6 -5.8 24.7 45.9 90 91 A R E -ae 23 214A 9 123,-2.7 125,-2.4 -2,-0.5 2,-0.5 -0.709 6.5-167.7 -83.4 135.6 -3.0 25.2 48.4 91 92 A I E +ae 24 215A 1 -68,-0.6 -66,-0.6 -2,-0.4 125,-0.2 -0.987 24.4 158.4-121.0 119.6 -0.1 27.4 47.4 92 93 A G E - e 0 216A 3 123,-2.4 125,-1.9 -2,-0.5 2,-0.3 -0.689 40.9-114.8-130.8-178.4 2.9 27.2 49.7 93 94 A T E - e 0 217A 36 123,-0.2 2,-0.3 -2,-0.2 125,-0.2 -0.881 40.4-174.1-113.5 151.6 6.6 27.7 50.3 94 95 A T E - e 0 218A 5 123,-1.8 125,-2.0 -2,-0.3 126,-1.0 -0.982 31.7-127.4-151.6 159.5 8.8 24.8 50.9 95 96 A G E -Fe 194 220A 8 99,-1.2 99,-2.0 -2,-0.3 126,-0.2 -0.931 32.3-143.7-105.2 120.9 12.2 23.3 51.8 96 97 A A E -Fe 193 221A 0 124,-2.4 126,-2.7 -2,-0.6 127,-0.3 -0.537 14.5-170.1 -83.3 150.2 13.4 20.7 49.4 97 98 A I + 0 0 0 95,-2.6 96,-0.2 -2,-0.2 -1,-0.1 0.375 59.9 90.0-121.9 3.4 15.3 17.7 50.6 98 99 A Q S > S- 0 0 30 94,-0.8 3,-1.7 1,-0.1 125,-0.1 -0.865 72.7-137.2 -99.9 134.3 16.5 16.2 47.3 99 100 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.756 101.8 56.0 -60.5 -25.9 19.9 17.5 46.0 100 101 A H T 3 S+ 0 0 114 2,-0.1 2,-0.7 1,-0.0 -3,-0.0 0.281 84.6 93.6 -92.0 5.7 18.6 17.8 42.4 101 102 A I < - 0 0 2 -3,-1.7 2,-0.2 91,-0.1 -5,-0.1 -0.891 67.5-153.7-105.2 108.6 15.7 20.1 43.3 102 103 A N > - 0 0 84 -2,-0.7 3,-2.4 1,-0.1 116,-0.2 -0.472 24.5 -97.3 -86.7 149.2 16.8 23.7 42.9 103 104 A V T 3 S+ 0 0 38 1,-0.3 116,-0.2 -2,-0.2 -1,-0.1 -0.382 115.8 40.2 -55.2 137.9 15.6 26.9 44.6 104 105 A G T 3 S+ 0 0 28 114,-2.3 45,-0.3 1,-0.4 -1,-0.3 0.151 89.3 123.6 98.0 -18.0 13.1 28.4 42.2 105 106 A D < - 0 0 11 -3,-2.4 113,-2.5 113,-0.1 2,-0.4 -0.326 57.4-132.1 -70.7 160.3 11.6 25.0 41.3 106 107 A V E -gH 150 217A 0 43,-2.7 45,-2.0 111,-0.2 2,-0.5 -0.963 15.4-154.9-117.0 129.6 7.9 24.3 41.7 107 108 A L E -gH 151 216A 0 109,-3.0 109,-2.0 -2,-0.4 2,-0.5 -0.908 4.4-163.5-106.0 129.7 6.7 21.1 43.4 108 109 A V E -gH 152 215A 0 43,-2.8 45,-2.1 -2,-0.5 2,-0.6 -0.951 19.3-140.1-108.3 126.4 3.3 19.6 42.8 109 110 A T E -g 153 0A 0 105,-2.0 105,-0.5 -2,-0.5 45,-0.2 -0.771 23.0-179.3 -94.9 123.9 2.3 17.1 45.5 110 111 A T E S- 0 0 15 43,-2.3 21,-2.9 -2,-0.6 2,-0.3 0.806 75.4 -20.7 -83.2 -32.8 0.5 13.9 44.5 111 112 A A E -gI 154 130A 0 42,-0.7 44,-1.8 19,-0.3 2,-0.4 -0.968 67.2-123.4-168.5 163.8 0.2 12.7 48.2 112 113 A S E -gI 155 129A 0 17,-2.3 17,-0.6 -2,-0.3 2,-0.4 -0.919 17.7-118.0-127.8 147.4 1.8 13.4 51.5 113 114 A V E -g 156 0A 0 42,-2.7 44,-2.4 -2,-0.4 2,-1.5 -0.646 39.2-127.4 -70.4 129.2 3.5 11.5 54.3 114 115 A R E +g 157 0A 2 992,-2.4 44,-0.1 -2,-0.4 -1,-0.1 -0.596 52.9 147.0 -92.6 82.5 1.3 12.0 57.3 115 116 A L E +g 158 0A 2 42,-1.9 44,-2.1 -2,-1.5 45,-0.2 -0.134 55.0 84.9-102.1 33.4 3.6 13.4 60.0 116 117 A D S S- 0 0 8 42,-0.3 42,-0.1 43,-0.1 81,-0.0 -0.510 71.0-138.5-120.1-176.0 0.7 15.5 61.4 117 118 A G S > S+ 0 0 3 -2,-0.2 3,-0.8 776,-0.1 4,-0.3 0.656 88.3 67.4-118.2 -29.8 -2.1 14.8 63.8 118 119 A A G > S+ 0 0 0 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.806 89.8 65.9 -67.4 -32.3 -5.2 16.5 62.4 119 120 A S G >> S+ 0 0 0 1,-0.3 3,-2.0 2,-0.2 4,-1.7 0.875 94.1 61.1 -56.6 -33.4 -5.4 14.1 59.4 120 121 A L G <4 S+ 0 0 42 -3,-0.8 -1,-0.3 1,-0.3 -2,-0.2 0.629 91.4 67.4 -69.6 -13.3 -6.2 11.3 61.9 121 122 A H G <4 S+ 0 0 1 -3,-1.8 789,-0.7 -4,-0.3 -1,-0.3 0.538 111.7 33.2 -80.0 -5.9 -9.3 13.3 62.9 122 123 A F T <4 S+ 0 0 14 -3,-2.0 -2,-0.2 1,-0.4 -1,-0.1 0.658 131.5 3.3-117.0 -30.6 -10.7 12.5 59.5 123 124 A A S < S- 0 0 0 -4,-1.7 -1,-0.4 787,-0.1 81,-0.0 -0.975 77.5 -99.1-159.3 145.1 -9.3 9.1 58.5 124 125 A P > - 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0 0 35 -126,-0.8 2,-0.4 -118,-0.1 -1,-0.2 -0.978 61.7-125.9-173.6 166.5 -14.9 -20.6 89.2 712 222 C N - 0 0 2 3,-0.3 -124,-0.2 -2,-0.3 -28,-0.0 -0.988 8.4-148.8-134.4 124.8 -16.6 -19.7 85.8 713 223 C R S > S+ 0 0 50 -126,-2.5 3,-1.2 -2,-0.4 2,-0.3 0.914 99.2 63.1 -57.1 -43.5 -17.5 -16.2 84.6 714 224 C T T 3 S+ 0 0 53 -127,-0.5 -127,-0.1 1,-0.3 -125,-0.1 -0.667 115.3 22.5 -70.9 141.0 -20.3 -18.0 82.8 715 225 C Q T 3 0 0 115 -2,-0.3 -3,-0.3 1,-0.2 -1,-0.3 0.850 360.0 360.0 58.7 35.9 -22.3 -19.4 85.7 716 226 C Q < 0 0 177 -3,-1.2 -3,-0.3 -5,-0.1 -1,-0.2 -0.580 360.0 360.0 132.7 360.0 -20.9 -16.8 88.0 717 ! 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 0.0 718 237 C T > 0 0 76 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 2.9 -8.7 -29.5 93.1 719 238 C E H > + 0 0 80 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.898 360.0 51.1 -63.2 -40.0 -6.2 -26.8 93.9 720 239 C S H > S+ 0 0 69 1,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.837 103.6 58.0 -61.9 -35.2 -4.3 -29.8 95.1 721 240 C H H > S+ 0 0 82 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.900 108.8 43.4 -65.3 -41.7 -5.0 -31.5 91.7 722 241 C A H X S+ 0 0 2 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.906 115.4 50.5 -66.8 -41.3 -3.3 -28.7 89.8 723 242 C V H X S+ 0 0 19 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.904 108.0 52.1 -61.9 -43.4 -0.5 -28.7 92.4 724 243 C K H X S+ 0 0 101 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.897 110.4 49.6 -59.8 -40.4 -0.1 -32.5 92.1 725 244 C I H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.922 108.5 51.1 -65.3 -45.7 0.2 -32.1 88.3 726 245 C V H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.902 112.6 46.1 -63.1 -41.3 2.8 -29.3 88.5 727 246 C V H X S+ 0 0 13 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.918 113.8 48.0 -66.7 -43.0 5.0 -31.4 90.8 728 247 C E H X S+ 0 0 54 -4,-2.1 4,-1.0 -5,-0.2 -2,-0.2 0.878 111.2 51.1 -66.3 -35.6 4.7 -34.5 88.7 729 248 C A H >X S+ 0 0 0 -4,-2.7 4,-0.6 1,-0.2 3,-0.5 0.903 105.2 57.6 -64.7 -39.7 5.5 -32.5 85.6 730 249 C A H >X S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 4,-0.7 0.852 99.3 58.4 -58.3 -39.2 8.6 -31.2 87.4 731 250 C R H >< S+ 0 0 105 -4,-1.6 3,-0.5 1,-0.2 -1,-0.2 0.873 106.2 49.5 -54.4 -39.0 9.8 -34.8 87.9 732 251 C R H << S+ 0 0 111 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.585 110.4 50.4 -80.0 -11.0 9.8 -35.2 84.2 733 252 C L H << 0 0 17 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.471 360.0 360.0-108.2 -3.6 11.7 -32.0 83.5 734 253 C L << 0 0 79 -4,-0.7 -182,-0.0 -3,-0.5 -3,-0.0 -0.255 360.0 360.0 -72.2 360.0 14.6 -32.6 85.9 735 !* 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 0.0 736 3 D K 0 0 236 0, 0.0 2,-0.3 0, 0.0 9,-0.1 0.000 360.0 360.0 360.0 149.4 16.3 42.4 61.5 737 4 D S - 0 0 50 1,-0.1 8,-0.3 7,-0.0 3,-0.0 -0.965 360.0-153.3-157.8 141.0 15.4 39.2 63.4 738 5 D D S S+ 0 0 104 6,-2.6 2,-0.3 -2,-0.3 7,-0.2 0.438 86.4 52.7 -90.7 -2.0 17.3 36.5 65.3 739 6 D V S S- 0 0 14 5,-0.6 4,-0.4 1,-0.1 5,-0.1 -0.903 82.4-121.0-134.7 161.8 14.5 33.9 64.5 740 7 D F S S+ 0 0 128 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.0 0.863 98.6 16.0 -75.4 -37.8 12.8 32.7 61.4 741 8 D H S S+ 0 0 19 68,-0.1 42,-0.2 1,-0.1 -1,-0.1 0.804 114.2 58.2-107.3 -39.5 9.1 33.5 62.0 742 9 D L S S- 0 0 1 67,-0.1 43,-0.1 2,-0.1 -2,-0.1 0.715 85.1-135.0 -75.9 -21.0 8.5 35.9 64.9 743 10 D G + 0 0 18 -4,-0.4 2,-0.3 1,-0.2 -3,-0.1 0.850 59.2 131.0 69.3 36.4 10.6 38.9 63.5 744 11 D L - 0 0 0 -5,-0.1 -6,-2.6 34,-0.1 -5,-0.6 -0.906 45.4-152.1-123.2 149.2 12.2 39.5 66.9 745 12 D T >> - 0 0 26 -2,-0.3 3,-0.7 -8,-0.3 4,-0.6 -0.771 34.1-111.9-109.7 160.7 15.8 40.0 68.1 746 13 D K H >> S+ 0 0 109 -2,-0.3 3,-1.3 1,-0.2 4,-0.6 0.873 118.8 60.8 -56.3 -36.2 17.1 39.2 71.6 747 14 D N H >4 S+ 0 0 123 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.841 93.3 64.3 -64.5 -33.4 17.4 42.9 72.2 748 15 D D H <4 S+ 0 0 49 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.755 95.9 58.8 -55.7 -29.8 13.7 43.4 71.6 749 16 D L H X< S- 0 0 1 -3,-1.3 3,-1.6 -4,-0.6 -1,-0.2 0.698 90.9-148.3 -80.7 -19.1 12.9 41.3 74.7 750 17 D Q T << S- 0 0 117 -3,-1.0 44,-0.4 -4,-0.6 -3,-0.1 0.875 73.6 -45.8 52.9 42.3 14.9 43.5 77.1 751 18 D G T 3 S+ 0 0 64 -5,-0.5 -1,-0.3 1,-0.2 -4,-0.1 0.473 91.6 164.3 84.1 4.5 15.8 40.6 79.3 752 19 D A < + 0 0 3 -3,-1.6 -1,-0.2 1,-0.1 43,-0.2 -0.251 16.5 174.1 -56.8 136.5 12.3 39.1 79.4 753 20 D Q + 0 0 129 41,-0.6 67,-2.6 66,-0.1 68,-1.5 0.364 60.9 62.6-124.2 0.6 12.2 35.5 80.6 754 21 D L E -c 821 0D 3 40,-0.4 42,-2.3 65,-0.2 2,-0.4 -0.990 59.6-169.2-130.8 135.6 8.4 35.0 80.7 755 22 D A E -cd 822 796D 0 66,-2.7 68,-2.5 -2,-0.4 2,-0.5 -0.973 15.8-147.5-123.7 140.8 5.9 35.1 77.9 756 23 D I E -cd 823 797D 0 40,-2.9 42,-2.1 -2,-0.4 68,-0.2 -0.933 22.6-162.4-100.5 128.6 2.1 35.2 78.0 757 24 D V E +c 824 0D 2 66,-2.8 68,-0.7 -2,-0.5 42,-0.2 -0.809 12.0 177.7-126.7 91.2 0.8 33.3 74.9 758 25 D P E -c 825 0D 0 0, 0.0 42,-1.8 0, 0.0 43,-0.4 -0.437 31.6-128.5 -80.7 164.8 -2.8 33.8 73.8 759 26 D G S S+ 0 0 1 66,-0.6 42,-1.3 40,-0.2 67,-0.1 0.882 88.6 67.9 -80.5 -41.0 -4.1 32.1 70.6 760 27 D D >> - 0 0 18 1,-0.2 3,-1.9 40,-0.1 4,-0.5 -0.708 68.2-151.0 -90.9 121.2 -5.6 35.2 68.9 761 28 D P H >> S+ 0 0 15 0, 0.0 3,-1.2 0, 0.0 4,-0.5 0.844 97.5 63.2 -54.8 -32.3 -3.1 37.8 67.7 762 29 D E H 3> S+ 0 0 109 1,-0.2 4,-0.5 2,-0.2 3,-0.1 0.677 96.7 57.1 -68.5 -17.7 -5.9 40.4 68.2 763 30 D R H <> S+ 0 0 52 -3,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.636 86.2 81.5 -87.8 -12.5 -5.9 39.7 71.9 764 31 D V H < S+ 0 0 4 -4,-1.9 3,-1.2 -3,-0.2 -1,-0.2 0.904 111.5 52.7 -71.8 -43.2 -3.4 41.8 77.4 768 35 D A H >< S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.809 99.7 65.4 -61.8 -29.1 -0.2 43.9 77.2 769 36 D A T 3< S+ 0 0 67 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.766 89.4 65.4 -67.0 -24.0 -2.4 47.0 78.0 770 37 D L T < S+ 0 0 88 -3,-1.2 -1,-0.3 -4,-0.5 2,-0.2 0.532 102.9 61.3 -73.4 -5.3 -3.0 45.5 81.5 771 38 D M S < S- 0 0 9 -3,-1.7 2,-0.2 -4,-0.2 19,-0.2 -0.588 94.8 -82.4-118.4 177.4 0.7 46.0 82.2 772 39 D D E S+E 789 0D 94 17,-2.1 17,-2.4 1,-0.2 -1,-0.1 -0.514 98.1 0.7 -83.8 150.0 3.2 48.8 82.3 773 40 D K E S- 0 0 147 15,-0.2 2,-0.2 -2,-0.2 -1,-0.2 0.851 78.2-164.6 47.0 52.4 5.0 50.4 79.3 774 41 D P E + 0 0 54 0, 0.0 2,-0.4 0, 0.0 14,-0.2 -0.509 10.8 178.4 -73.8 133.3 3.3 48.3 76.6 775 42 D V E -E 787 0D 63 12,-2.8 12,-3.0 -2,-0.2 2,-0.2 -0.998 28.2-123.9-138.2 129.7 5.1 48.4 73.2 776 43 D K E +E 786 0D 121 -2,-0.4 10,-0.2 10,-0.2 3,-0.1 -0.545 28.8 175.4 -72.2 136.5 4.3 46.6 70.0 777 44 D L E - 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