==== 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 25-MAR-03 1OV6 . COMPND 2 MOLECULE: PURINE NUCLEOSIDE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.E.EALICK,E.M.BENNETT,R.ANAND,J.A.SECRIST,P.W.PARKER,A.E.HA . 711 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32945.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 529 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 102 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 6 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 . 57 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 202 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.5 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 3 0 3 0 0 3 3 1 2 3 0 0 0 0 0 0 1 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 3 2 1 0 1 2 0 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 . 8 0 1 5 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 2 1 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 A 0 0 74 0, 0.0 5,-0.2 0, 0.0 7,-0.1 0.000 360.0 360.0 360.0 150.3 110.1 49.2 34.6 2 2 A T - 0 0 19 3,-2.8 3,-0.1 6,-0.0 5,-0.0 -0.827 360.0 -87.1-134.1 172.9 107.3 48.3 32.3 3 3 A P S S+ 0 0 107 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.834 126.9 19.3 -50.8 -36.5 106.8 47.6 28.6 4 4 A H S S+ 0 0 40 1,-0.2 2,-0.5 67,-0.1 41,-0.1 0.491 119.3 62.2-115.9 -5.4 106.1 51.3 27.9 5 5 A I - 0 0 0 -3,-0.1 -3,-2.8 2,-0.1 2,-1.5 -0.949 60.1-161.2-126.3 111.5 107.6 53.1 30.9 6 6 A N + 0 0 97 -2,-0.5 2,-0.3 -5,-0.2 35,-0.1 -0.613 58.2 93.6 -91.4 77.6 111.3 52.8 31.6 7 7 A A - 0 0 3 -2,-1.5 2,-0.3 33,-0.1 -2,-0.1 -0.942 66.0-115.4-155.1 172.0 111.3 53.9 35.2 8 8 A E > - 0 0 106 -2,-0.3 3,-2.6 1,-0.1 4,-0.4 -0.780 45.7 -76.7-116.8 161.1 111.1 52.5 38.7 9 9 A M T 3 S+ 0 0 126 -2,-0.3 71,-0.1 1,-0.3 -1,-0.1 -0.287 121.1 34.4 -52.4 132.8 108.5 52.7 41.5 10 10 A G T 3 S+ 0 0 36 70,-0.3 -1,-0.3 2,-0.3 70,-0.1 -0.004 89.4 97.6 107.2 -28.1 109.0 56.1 43.1 11 11 A D S < S+ 0 0 42 -3,-2.6 2,-0.3 28,-0.1 -2,-0.1 0.864 81.7 51.4 -62.7 -39.2 109.9 57.9 39.9 12 12 A F S S- 0 0 5 -4,-0.4 -2,-0.3 68,-0.1 37,-0.1 -0.710 88.1-120.9 -98.8 154.0 106.3 59.2 39.3 13 13 A A - 0 0 2 2,-0.3 44,-0.1 -2,-0.3 -1,-0.1 -0.332 33.6-101.2 -81.7 172.6 104.3 61.1 41.9 14 14 A D S S+ 0 0 61 68,-0.2 69,-2.6 42,-0.1 70,-2.3 0.572 111.3 57.3 -72.1 -8.5 101.0 59.8 43.1 15 15 A V E -a 84 0A 0 41,-0.2 43,-2.1 68,-0.2 2,-0.4 -0.990 69.8-170.5-126.1 128.7 99.3 62.3 40.8 16 16 A V E -ab 85 58A 0 68,-2.6 70,-2.6 -2,-0.4 2,-0.4 -0.971 13.2-152.9-127.5 127.9 99.9 62.5 37.1 17 17 A L E -ab 86 59A 0 41,-2.9 43,-2.0 -2,-0.4 70,-0.2 -0.788 18.0-165.6 -90.8 134.8 98.9 65.2 34.6 18 18 A M E -a 87 0A 0 68,-3.1 70,-1.8 -2,-0.4 43,-0.2 -0.902 6.6-171.1-130.5 107.3 98.5 63.8 31.1 19 19 A P E -a 88 0A 0 0, 0.0 43,-1.6 0, 0.0 44,-0.4 -0.549 28.4-124.0 -88.7 159.4 98.3 65.9 28.0 20 20 A G S S+ 0 0 14 68,-0.8 43,-1.1 41,-0.2 42,-0.4 0.999 95.7 55.0 -63.1 -72.4 97.4 64.4 24.6 21 21 A D S > S- 0 0 51 1,-0.1 3,-1.7 40,-0.1 4,-0.3 -0.460 80.7-138.7 -66.6 126.9 100.4 65.6 22.5 22 22 A P T >> S+ 0 0 44 0, 0.0 3,-2.3 0, 0.0 4,-0.7 0.825 96.8 71.8 -53.0 -38.5 103.7 64.5 24.1 23 23 A L H 3> S+ 0 0 137 1,-0.3 4,-1.2 2,-0.2 3,-0.2 0.768 88.6 63.4 -51.5 -29.5 105.3 67.9 23.4 24 24 A R H <> S+ 0 0 100 -3,-1.7 4,-2.4 1,-0.2 -1,-0.3 0.678 88.7 68.3 -73.7 -16.6 103.2 69.5 26.1 25 25 A A H <> S+ 0 0 0 -3,-2.3 4,-2.4 -4,-0.3 -1,-0.2 0.944 101.6 45.1 -66.6 -48.1 104.7 67.4 28.9 26 26 A K H X S+ 0 0 97 -4,-0.7 4,-2.0 -3,-0.2 5,-0.2 0.901 114.1 51.2 -61.3 -42.1 108.1 69.2 28.5 27 27 A Y H X S+ 0 0 61 -4,-1.2 4,-1.6 1,-0.2 5,-0.3 0.903 109.8 48.3 -62.6 -43.7 106.3 72.5 28.4 28 28 A I H X>S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 5,-1.0 0.917 110.9 52.4 -63.5 -43.1 104.2 71.8 31.5 29 29 A A H X5S+ 0 0 4 -4,-2.4 4,-0.6 1,-0.2 7,-0.3 0.885 115.3 38.0 -61.4 -42.9 107.3 70.7 33.4 30 30 A E H <5S+ 0 0 137 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.686 122.4 42.9 -85.6 -16.6 109.4 73.8 32.7 31 31 A T H <5S+ 0 0 71 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.823 132.2 13.0 -96.3 -36.5 106.5 76.3 32.9 32 32 A F H <5S+ 0 0 34 -4,-2.7 2,-0.3 -5,-0.3 -3,-0.2 0.651 110.5 74.2-115.6 -20.0 104.6 75.0 36.0 33 33 A L << - 0 0 14 -5,-1.0 2,-0.3 -4,-0.6 3,-0.3 -0.739 61.4-148.5-101.3 147.4 106.9 72.6 37.8 34 34 A E E S+C 51 0A 123 17,-2.4 17,-1.7 -2,-0.3 -3,-0.0 -0.838 79.2 10.6-109.7 148.7 110.0 73.3 39.9 35 35 A D E S- 0 0 145 -2,-0.3 -1,-0.2 15,-0.2 14,-0.1 0.815 85.7-176.7 56.2 34.0 113.0 71.0 40.2 36 36 A A E - 0 0 46 -3,-0.3 2,-0.3 -7,-0.3 14,-0.2 -0.362 8.1-168.8 -65.7 139.3 111.6 68.9 37.4 37 37 A R E -C 49 0A 115 12,-2.3 12,-2.0 -2,-0.1 2,-0.3 -0.957 25.9-111.0-127.8 147.9 113.6 65.7 36.5 38 38 A E E +C 48 0A 113 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.635 37.1 167.2 -80.5 132.2 113.2 63.4 33.5 39 39 A V E + 0 0 14 8,-2.0 2,-0.3 -2,-0.3 9,-0.2 0.464 59.8 27.1-123.8 -5.8 111.8 60.0 34.3 40 40 A N E +C 47 0A 2 7,-1.0 7,-2.2 -35,-0.1 -1,-0.3 -0.958 37.8 158.7-159.6 141.5 110.8 58.5 31.0 41 41 A N > + 0 0 90 -2,-0.3 3,-2.3 5,-0.2 5,-0.2 0.357 32.1 138.7-139.8 -2.0 111.7 58.7 27.3 42 42 A V G > S- 0 0 38 1,-0.3 3,-2.5 3,-0.2 -38,-0.0 -0.189 84.6 -5.0 -53.2 133.9 110.5 55.4 25.8 43 43 A R G 3 S- 0 0 203 1,-0.3 -1,-0.3 2,-0.0 3,-0.1 0.610 126.6 -69.0 56.3 12.1 108.8 55.8 22.4 44 44 A G G < S+ 0 0 44 -3,-2.3 2,-1.6 1,-0.2 -1,-0.3 0.563 95.5 138.4 86.0 7.4 109.3 59.6 22.8 45 45 A M < - 0 0 18 -3,-2.5 -3,-0.2 -41,-0.1 -1,-0.2 -0.654 44.3-154.1 -87.3 82.7 106.7 59.8 25.6 46 46 A L - 0 0 46 -2,-1.6 15,-0.7 -5,-0.2 2,-0.4 -0.375 10.7-165.8 -62.8 127.4 108.6 62.2 27.8 47 47 A G E -CD 40 60A 0 -7,-2.2 -8,-2.0 13,-0.2 -7,-1.0 -0.893 5.6-174.1-115.5 147.3 107.7 62.0 31.5 48 48 A F E -CD 38 59A 18 11,-2.4 11,-2.5 -2,-0.4 2,-0.4 -0.987 11.0-162.9-141.5 150.3 108.7 64.5 34.2 49 49 A T E +CD 37 58A 1 -12,-2.0 -12,-2.3 -2,-0.3 9,-0.2 -1.000 32.3 121.8-134.4 133.7 108.3 64.7 38.0 50 50 A G E - D 0 57A 6 7,-3.0 7,-2.8 -2,-0.4 2,-0.3 -0.734 51.3 -80.1-160.0-152.0 108.7 67.9 40.0 51 51 A T E -CD 34 56A 34 -17,-1.7 -17,-2.4 5,-0.3 2,-0.5 -0.971 14.3-160.1-137.0 151.2 106.7 70.0 42.4 52 52 A Y E > S- D 0 55A 21 3,-2.5 3,-1.9 -2,-0.3 -19,-0.1 -0.968 90.8 -20.6-128.0 108.8 104.0 72.6 42.3 53 53 A K T 3 S- 0 0 135 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.921 129.9 -50.3 55.4 46.4 103.9 74.6 45.5 54 54 A G T 3 S+ 0 0 65 1,-0.2 2,-0.5 -20,-0.0 -1,-0.3 0.287 112.8 125.2 78.6 -12.5 105.8 71.9 47.3 55 55 A R E < - D 0 52A 38 -3,-1.9 -3,-2.5 1,-0.1 -1,-0.2 -0.698 64.8-123.8 -85.0 123.9 103.3 69.3 46.0 56 56 A K E + D 0 51A 75 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.3 -0.469 41.6 168.1 -67.4 130.8 105.0 66.4 44.2 57 57 A I E - D 0 50A 1 -7,-2.8 -7,-3.0 -2,-0.2 2,-0.3 -0.999 21.4-156.5-148.8 144.0 103.5 66.1 40.6 58 58 A S E -bD 16 49A 0 -43,-2.1 -41,-2.9 -2,-0.3 2,-0.3 -0.820 5.3-165.8-117.6 159.1 104.3 64.2 37.4 59 59 A V E +bD 17 48A 0 -11,-2.5 -11,-2.4 -2,-0.3 2,-0.3 -0.990 17.3 151.3-147.4 135.2 103.4 64.9 33.8 60 60 A M E - D 0 47A 0 -43,-2.0 -13,-0.2 -2,-0.3 -15,-0.1 -0.910 42.3-106.9-164.6 134.6 103.6 62.7 30.7 61 61 A G - 0 0 0 -15,-0.7 -41,-0.2 -2,-0.3 -40,-0.1 -0.171 16.7-156.5 -62.1 157.9 101.7 62.4 27.4 62 62 A H - 0 0 0 -43,-1.6 10,-0.2 -42,-0.4 9,-0.2 0.304 34.2-125.7-118.9 8.6 99.2 59.6 26.9 63 63 A G - 0 0 9 -43,-1.1 2,-0.3 -44,-0.4 -1,-0.2 -0.006 43.1 -53.4 70.1 176.4 99.1 59.5 23.1 64 64 A V S S+ 0 0 104 4,-0.1 4,-0.4 5,-0.0 117,-0.1 -0.716 95.0 17.0 -93.7 139.1 95.9 59.7 21.0 65 65 A G S > S- 0 0 9 -2,-0.3 4,-2.0 1,-0.1 3,-0.5 0.190 87.2 -76.9 89.8 154.5 92.9 57.4 21.5 66 66 A I H > S+ 0 0 0 114,-0.2 4,-1.7 1,-0.2 5,-0.2 0.870 123.0 56.4 -55.9 -43.1 91.5 55.0 24.1 67 67 A P H > S+ 0 0 90 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.868 110.9 44.2 -61.0 -35.8 94.0 52.1 23.3 68 68 A S H >> S+ 0 0 31 -3,-0.5 4,-1.5 -4,-0.4 3,-0.9 0.970 115.4 43.2 -73.6 -55.2 97.0 54.3 23.9 69 69 A C H 3X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.3 5,-0.3 0.743 107.6 63.5 -65.1 -20.7 96.0 56.1 27.1 70 70 A S H 3X S+ 0 0 20 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.3 0.837 102.7 49.7 -70.1 -33.5 94.7 52.8 28.5 71 71 A I H S+ 0 0 15 -4,-2.3 4,-2.5 1,-0.2 5,-0.8 0.893 113.1 51.6 -60.8 -40.0 101.0 50.9 34.1 76 76 A L H X5S+ 0 0 0 -4,-2.7 6,-2.5 -5,-0.2 4,-0.9 0.922 115.1 44.2 -62.0 -41.5 101.1 54.1 36.1 77 77 A I H <5S+ 0 0 21 -4,-2.3 4,-0.4 -5,-0.2 -2,-0.2 0.942 125.4 28.1 -68.5 -52.1 98.4 52.7 38.3 78 78 A T H <5S+ 0 0 54 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.700 131.3 32.3 -87.9 -20.2 99.7 49.1 38.9 79 79 A D H <5S+ 0 0 63 -4,-2.5 -3,-0.2 -5,-0.4 -2,-0.1 0.677 127.6 31.2-111.1 -19.4 103.4 49.6 38.5 80 80 A F S < S- 0 0 17 80,-0.3 3,-1.7 81,-0.2 112,-0.1 -0.750 70.6-141.0 -89.3 128.0 76.1 72.5 21.6 96 96 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.791 101.2 54.6 -56.9 -30.9 75.5 76.0 20.2 97 97 A H T 3 S+ 0 0 112 2,-0.1 2,-0.7 -3,-0.0 -2,-0.0 0.607 88.0 87.7 -83.1 -8.7 75.9 77.6 23.6 98 98 A V S < S- 0 0 0 -3,-1.7 2,-0.2 4,-0.0 -5,-0.1 -0.813 70.9-158.7 -91.1 117.2 79.3 76.0 24.3 99 99 A K > - 0 0 90 -2,-0.7 3,-2.2 1,-0.1 103,-0.3 -0.571 26.0 -82.5-100.6 161.0 81.9 78.4 22.9 100 100 A L T 3 S+ 0 0 13 1,-0.3 103,-0.2 -2,-0.2 -1,-0.1 -0.296 117.2 22.4 -55.4 136.8 85.5 78.1 21.7 101 101 A R T 3 S+ 0 0 96 101,-2.8 -1,-0.3 1,-0.3 102,-0.1 0.381 87.2 140.2 82.1 -2.2 87.8 78.3 24.7 102 102 A D < - 0 0 25 -3,-2.2 100,-2.6 100,-0.1 2,-0.5 -0.402 53.9-122.2 -67.6 152.2 85.2 77.2 27.2 103 103 A V E -gH 148 201A 8 44,-0.6 46,-2.7 98,-0.2 2,-0.4 -0.867 26.7-164.3-100.3 129.3 86.5 74.8 29.9 104 104 A V E -gH 149 200A 0 96,-4.0 96,-2.9 -2,-0.5 2,-0.6 -0.958 8.5-160.8-119.3 129.1 84.8 71.5 30.1 105 105 A I E -gH 150 199A 0 44,-3.1 46,-1.8 -2,-0.4 2,-1.5 -0.933 19.3-137.7-108.2 113.9 85.1 69.0 33.1 106 106 A G E +g 151 0A 0 92,-2.3 92,-0.4 -2,-0.6 23,-0.2 -0.525 31.9 166.6 -76.8 88.5 84.1 65.5 32.2 107 107 A M E S+ 0 0 94 -2,-1.5 22,-2.0 44,-1.3 2,-0.3 0.855 78.1 13.0 -66.5 -32.4 82.0 64.2 35.1 108 108 A G E S-gI 152 128A 7 43,-1.8 45,-1.7 20,-0.2 2,-0.4 -0.920 70.6-147.0-138.7 164.6 81.0 61.4 32.7 109 109 A A E -g 153 0A 9 18,-2.2 18,-0.5 -2,-0.3 45,-0.2 -0.886 4.9-164.3-144.5 113.9 82.1 60.0 29.4 110 110 A C E +g 154 0A 44 43,-3.0 45,-3.2 -2,-0.4 73,-0.4 -0.383 20.4 179.5 -81.4 166.5 80.1 58.4 26.7 111 111 A T E -g 155 0A 40 43,-0.2 45,-0.2 -2,-0.1 69,-0.0 -0.992 42.5-145.0-165.3 160.7 81.8 56.4 24.0 112 112 A D S S+ 0 0 77 43,-1.2 44,-0.1 -2,-0.3 2,-0.1 0.208 73.7 108.5-112.0 9.7 81.4 54.3 20.8 113 113 A S - 0 0 11 42,-0.4 4,-0.2 1,-0.1 3,-0.1 -0.391 65.2-142.7 -81.4 163.2 84.3 52.1 21.9 114 114 A K S > S+ 0 0 81 1,-0.1 4,-2.1 2,-0.1 5,-0.2 0.420 74.1 98.9-108.8 1.5 83.8 48.5 23.1 115 115 A V H > S+ 0 0 38 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.887 85.9 45.7 -58.9 -40.3 86.5 48.4 25.8 116 116 A N H > S+ 0 0 11 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.844 110.9 52.4 -73.5 -30.8 84.0 49.0 28.7 117 117 A R H 4>S+ 0 0 125 2,-0.2 5,-3.3 1,-0.2 6,-0.3 0.844 107.0 54.2 -70.7 -31.9 81.5 46.5 27.3 118 118 A I H <5S+ 0 0 103 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.849 114.5 41.1 -68.2 -32.1 84.3 44.0 27.2 119 119 A R H <5S+ 0 0 85 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.812 117.2 47.8 -82.2 -32.8 85.0 44.7 30.9 120 120 A F T ><5S- 0 0 98 -4,-2.3 3,-1.3 3,-0.2 -1,-0.2 -0.090 116.6 -96.8-105.8 34.5 81.4 44.9 32.0 121 121 A K T 3 5S- 0 0 168 -3,-0.4 -3,-0.2 1,-0.3 -4,-0.1 0.850 79.1 -62.3 57.3 38.3 79.8 41.7 30.5 122 122 A D T 3 - 0 0 36 66,-2.2 4,-1.6 1,-0.1 -1,-0.1 -0.682 39.2-138.9 -77.6 128.7 86.1 60.8 40.7 131 131 A F H > S+ 0 0 128 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.895 99.3 51.6 -56.3 -47.5 83.6 63.2 42.2 132 132 A D H > S+ 0 0 77 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.909 108.6 53.1 -58.5 -40.1 86.0 65.0 44.6 133 133 A M H > S+ 0 0 4 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.867 108.4 50.3 -62.9 -36.2 88.3 65.6 41.7 134 134 A V H X S+ 0 0 6 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.933 113.0 45.0 -67.1 -47.0 85.5 67.2 39.7 135 135 A R H X S+ 0 0 123 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.837 112.0 52.3 -66.6 -33.6 84.5 69.5 42.5 136 136 A N H X S+ 0 0 19 -4,-2.5 4,-2.9 -5,-0.2 5,-0.2 0.942 110.8 48.3 -66.0 -45.7 88.1 70.4 43.2 137 137 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.902 112.4 48.3 -60.1 -44.5 88.5 71.3 39.5 138 138 A V H X S+ 0 0 45 -4,-2.4 4,-2.3 2,-0.2 10,-0.2 0.929 114.2 45.3 -62.8 -46.9 85.3 73.4 39.5 139 139 A D H X S+ 0 0 83 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.909 112.3 50.8 -64.7 -42.7 86.3 75.3 42.7 140 140 A A H X S+ 0 0 2 -4,-2.9 4,-1.2 2,-0.2 -1,-0.2 0.901 110.6 50.3 -61.7 -40.1 89.9 75.9 41.5 141 141 A A H ><>S+ 0 0 0 -4,-2.1 5,-3.6 -5,-0.2 3,-0.5 0.928 109.6 51.4 -62.5 -43.4 88.4 77.2 38.2 142 142 A K H ><5S+ 0 0 154 -4,-2.3 3,-2.3 1,-0.2 -2,-0.2 0.928 105.8 54.5 -59.0 -46.5 86.2 79.4 40.2 143 143 A A H 3<5S+ 0 0 88 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.770 107.8 49.9 -60.4 -27.1 89.1 80.8 42.2 144 144 A L T <<5S- 0 0 61 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.302 124.1-106.6 -93.6 10.1 90.9 81.7 39.0 145 145 A G T < 5S+ 0 0 58 -3,-2.3 2,-0.4 1,-0.2 -3,-0.2 0.734 72.4 147.3 73.7 22.2 87.7 83.5 37.9 146 146 A I < - 0 0 33 -5,-3.6 2,-1.0 -6,-0.2 -1,-0.2 -0.786 47.3-139.8 -99.7 136.7 86.9 80.7 35.4 147 147 A D - 0 0 119 -2,-0.4 -44,-0.6 -3,-0.1 2,-0.3 -0.762 28.3-163.0 -91.4 94.3 83.4 79.7 34.4 148 148 A A E -g 103 0A 31 -2,-1.0 2,-0.4 -10,-0.2 -44,-0.2 -0.640 10.6-145.8 -90.4 138.0 83.6 75.8 34.2 149 149 A R E -g 104 0A 82 -46,-2.7 -44,-3.1 -2,-0.3 2,-0.4 -0.822 15.9-163.1 -99.3 132.2 81.1 73.6 32.4 150 150 A V E +g 105 0A 55 -2,-0.4 2,-0.3 -46,-0.2 -44,-0.2 -0.962 37.5 73.2-123.3 127.2 80.5 70.2 33.9 151 151 A G E S-g 106 0A 11 -46,-1.8 -43,-1.8 -2,-0.4 -44,-1.3 -0.878 73.5 -7.8 176.4-142.8 78.8 67.2 32.3 152 152 A N E -g 108 0A 64 22,-0.4 24,-2.8 -2,-0.3 25,-1.0 -0.630 42.8-168.1 -90.5 142.9 79.2 64.5 29.7 153 153 A L E -gj 109 177A 0 -45,-1.7 -43,-3.0 -2,-0.3 2,-0.4 -0.709 17.4-135.4-113.5 167.3 82.1 64.1 27.2 154 154 A F E -gj 110 178A 8 23,-1.9 25,-2.7 -2,-0.3 2,-0.8 -0.990 9.3-154.7-129.5 121.4 82.0 61.7 24.3 155 155 A S E -gj 111 179A 0 -45,-3.2 -43,-1.2 -2,-0.4 -42,-0.4 -0.852 16.5-161.5 -99.9 107.1 85.1 59.6 23.6 156 156 A A - 0 0 9 23,-2.7 -90,-0.2 -2,-0.8 3,-0.1 -0.632 21.6-157.8 -90.2 143.8 85.2 58.6 19.9 157 157 A D S S+ 0 0 71 -2,-0.3 2,-0.6 1,-0.2 -1,-0.1 0.836 88.1 50.4 -83.0 -34.8 87.3 55.8 18.5 158 158 A L - 0 0 98 1,-0.2 3,-0.5 -93,-0.0 -1,-0.2 -0.903 57.9-171.0-112.2 115.6 87.1 57.4 15.0 159 159 A F S S+ 0 0 146 -2,-0.6 2,-0.8 1,-0.3 -1,-0.2 0.845 95.7 47.3 -65.4 -34.1 88.0 61.1 14.6 160 160 A Y S S- 0 0 199 -3,-0.1 -1,-0.3 2,-0.0 4,-0.1 -0.706 89.1-173.0-109.0 77.4 86.7 60.7 11.0 161 161 A S - 0 0 43 -2,-0.8 3,-0.1 -3,-0.5 -2,-0.0 -0.442 27.4-146.2 -76.3 143.4 83.4 59.0 11.7 162 162 A P S S+ 0 0 85 0, 0.0 2,-1.2 0, 0.0 3,-0.2 0.787 90.8 69.7 -74.8 -30.4 81.2 57.6 8.9 163 163 A D > + 0 0 76 1,-0.2 3,-1.4 2,-0.1 4,-0.3 -0.664 55.1 169.2 -93.9 82.3 78.0 58.4 10.9 164 164 A G T > S+ 0 0 42 -2,-1.2 3,-1.3 1,-0.3 4,-0.3 0.756 71.6 71.7 -63.6 -22.7 77.9 62.2 10.9 165 165 A E T >> S+ 0 0 123 1,-0.3 3,-1.4 2,-0.2 4,-1.4 0.743 78.2 75.4 -65.2 -25.8 74.4 61.9 12.3 166 166 A M H <> S+ 0 0 58 -3,-1.4 4,-2.5 1,-0.3 -1,-0.3 0.789 86.1 63.8 -58.9 -26.6 75.7 60.7 15.7 167 167 A F H <> S+ 0 0 48 -3,-1.3 4,-1.9 -4,-0.3 -1,-0.3 0.814 99.8 52.4 -67.8 -28.5 76.8 64.4 16.4 168 168 A D H <> S+ 0 0 87 -3,-1.4 4,-2.4 -4,-0.3 -1,-0.2 0.906 109.8 48.7 -70.3 -42.3 73.1 65.3 16.3 169 169 A V H X S+ 0 0 48 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.910 109.4 52.4 -62.7 -43.3 72.4 62.6 18.8 170 170 A M H <>S+ 0 0 7 -4,-2.5 5,-2.4 1,-0.2 -1,-0.2 0.911 110.1 48.7 -58.9 -43.7 75.2 63.9 21.0 171 171 A E H ><5S+ 0 0 58 -4,-1.9 3,-1.8 1,-0.2 -2,-0.2 0.928 107.7 54.6 -62.7 -44.5 73.8 67.4 20.9 172 172 A K H 3<5S+ 0 0 153 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.811 110.2 47.0 -60.0 -31.0 70.3 66.1 21.8 173 173 A Y T 3<5S- 0 0 147 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.192 118.3-108.1-100.0 19.0 71.7 64.4 24.9 174 174 A G T < 5 + 0 0 33 -3,-1.8 -22,-0.4 1,-0.2 -3,-0.2 0.668 48.5 175.7 69.1 21.8 73.7 67.4 26.1 175 175 A I < - 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O 0 290C 44 -3,-2.6 -3,-2.7 1,-0.1 2,-0.3 -0.714 68.6-119.1 -89.6 132.2 95.5 13.7 -9.8 294 56 B K E + O 0 289C 80 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.3 -0.511 44.4 171.7 -68.0 123.9 92.8 12.3 -7.5 295 57 B I E - O 0 288C 1 -7,-3.0 -7,-2.9 -2,-0.3 2,-0.3 -0.976 19.5-158.1-137.2 149.1 90.1 14.9 -7.1 296 58 B S E -mO 254 287C 0 -43,-1.6 -41,-2.8 -2,-0.3 2,-0.3 -0.899 3.9-169.4-124.9 155.0 86.6 15.1 -5.6 297 59 B V E +mO 255 286C 1 -11,-2.4 -11,-3.0 -2,-0.3 2,-0.3 -0.991 13.7 161.4-144.5 136.6 83.6 17.4 -6.3 298 60 B M E - O 0 285C 0 -43,-2.3 -13,-0.2 -2,-0.3 -14,-0.1 -0.957 37.1-109.7-159.5 137.5 80.4 17.7 -4.2 299 61 B G - 0 0 0 -15,-1.4 -41,-0.2 -2,-0.3 -40,-0.1 -0.251 17.4-164.4 -64.5 153.2 77.6 20.1 -3.8 300 62 B H - 0 0 0 -43,-1.6 10,-0.2 1,-0.2 -42,-0.2 0.340 34.2-128.1-120.2 4.4 77.3 22.0 -0.5 301 63 B G - 0 0 9 -43,-1.3 2,-0.4 -44,-0.3 -1,-0.2 -0.043 42.5 -49.6 73.4 177.9 73.8 23.3 -0.7 302 64 B V S S+ 0 0 106 4,-0.1 4,-0.3 5,-0.0 117,-0.1 -0.750 97.0 18.8 -93.9 132.0 72.7 26.9 -0.3 303 65 B G S > S- 0 0 7 -2,-0.4 4,-2.3 2,-0.1 3,-0.4 0.147 84.2 -82.5 97.4 150.7 73.8 28.9 2.8 304 66 B I H > S+ 0 0 0 114,-0.4 4,-2.2 1,-0.2 5,-0.2 0.883 123.3 55.6 -54.6 -45.9 76.4 29.0 5.5 305 67 B P H > S+ 0 0 85 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.884 112.1 44.2 -57.3 -39.0 74.5 26.5 7.7 306 68 B S H >> S+ 0 0 29 -3,-0.4 4,-1.5 -4,-0.3 3,-0.9 0.977 116.2 41.8 -71.3 -58.2 74.4 23.9 4.9 307 69 B C H 3X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 5,-0.3 0.788 107.6 64.6 -63.2 -25.5 78.0 24.2 3.6 308 70 B S H 3X S+ 0 0 18 -4,-2.2 4,-1.3 -5,-0.3 -1,-0.2 0.863 102.8 48.6 -64.7 -35.0 79.2 24.3 7.2 309 71 B I H S+ 0 0 16 -4,-2.1 4,-1.7 2,-0.2 5,-0.5 0.881 112.0 53.6 -70.3 -35.7 82.4 16.3 7.9 314 76 B L H X5S+ 0 0 0 -4,-2.4 6,-2.1 3,-0.2 4,-1.2 0.917 114.9 41.2 -63.2 -42.4 84.7 16.2 4.9 315 77 B I H <5S+ 0 0 25 -4,-2.3 4,-0.3 4,-0.2 -2,-0.2 0.913 121.8 36.6 -72.7 -46.8 87.6 17.6 7.0 316 78 B T H <5S+ 0 0 55 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.615 131.9 24.0 -86.5 -12.3 87.1 15.7 10.3 317 79 B D H <5S+ 0 0 73 -4,-1.7 -3,-0.2 -5,-0.2 -2,-0.2 0.569 124.7 40.1-128.8 -12.5 86.0 12.4 8.9 318 80 B F S < S- 0 0 13 80,-0.3 3,-1.5 81,-0.2 112,-0.1 -0.717 74.3-136.9 -88.8 131.8 80.8 47.5 -8.0 334 96 B P T 3 S+ 0 0 48 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.808 103.0 55.1 -55.3 -34.8 80.3 49.1 -11.4 335 97 B H T 3 S+ 0 0 98 2,-0.1 2,-0.9 1,-0.0 -2,-0.0 0.655 85.8 91.7 -76.4 -14.4 83.8 48.0 -12.7 336 98 B V < - 0 0 0 -3,-1.5 2,-0.1 4,-0.0 -5,-0.1 -0.732 67.8-167.6 -82.9 110.1 83.1 44.4 -11.9 337 99 B K > - 0 0 120 -2,-0.9 3,-1.3 1,-0.1 103,-0.3 -0.368 27.8 -77.9 -95.8 174.8 81.7 43.0 -15.1 338 100 B L T 3 S+ 0 0 36 1,-0.2 103,-0.2 -2,-0.1 -1,-0.1 -0.430 115.5 23.3 -70.6 145.2 79.9 39.8 -16.1 339 101 B R T 3 S+ 0 0 103 101,-1.8 -1,-0.2 1,-0.3 2,-0.2 0.537 86.6 142.2 75.4 7.4 82.1 36.8 -16.5 340 102 B D < - 0 0 34 -3,-1.3 100,-1.5 100,-0.2 2,-0.6 -0.592 51.5-128.4 -77.5 143.0 84.8 38.3 -14.3 341 103 B V E -rS 386 439C 3 44,-0.6 46,-2.7 -2,-0.2 2,-0.4 -0.850 25.0-164.1 -96.9 120.8 86.5 35.7 -12.1 342 104 B V E -rS 387 438C 0 96,-3.9 96,-3.2 -2,-0.6 2,-0.5 -0.874 8.1-164.2-108.6 137.0 86.5 36.7 -8.4 343 105 B I E -rS 388 437C 0 44,-2.9 46,-1.9 -2,-0.4 2,-1.2 -0.971 15.1-143.2-120.7 114.8 88.7 35.0 -5.8 344 106 B G E +rS 389 436C 0 92,-2.3 92,-0.5 -2,-0.5 46,-0.2 -0.627 28.3 167.4 -82.8 93.4 87.7 35.7 -2.2 345 107 B M E S+ 0 0 92 -2,-1.2 22,-2.1 44,-1.1 2,-0.3 0.728 81.1 22.0 -72.8 -17.8 90.8 36.1 -0.1 346 108 B G E -rT 390 366C 5 43,-1.5 45,-1.7 20,-0.3 2,-0.4 -0.967 70.0-153.8-143.7 158.5 88.4 37.4 2.5 347 109 B A E -r 391 0C 9 18,-2.0 18,-0.5 -2,-0.3 45,-0.2 -0.899 3.2-159.4-143.7 113.8 84.6 37.1 3.2 348 110 B C E -r 392 0C 42 43,-2.9 45,-3.1 -2,-0.4 73,-0.3 -0.389 24.9-159.5 -78.2 163.0 82.4 39.6 5.1 349 111 B T E -r 393 0C 45 43,-0.2 45,-0.2 1,-0.1 69,-0.0 -0.995 42.0-156.1-155.0 162.1 79.2 38.3 6.5 350 112 B D S S+ 0 0 85 43,-1.7 44,-0.1 -2,-0.3 -1,-0.1 0.555 74.8 100.5 -98.2 -25.7 75.7 38.8 7.8 351 113 B S - 0 0 12 42,-0.5 4,-0.1 1,-0.1 -2,-0.1 -0.140 66.4-145.4 -65.5 161.6 75.8 35.6 9.8 352 114 B K S > S+ 0 0 85 1,-0.1 4,-2.0 2,-0.1 5,-0.2 0.309 74.3 101.0-107.4 3.6 76.4 35.3 13.5 353 115 B V H > S+ 0 0 39 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.896 82.0 44.6 -60.3 -43.9 78.3 32.0 13.2 354 116 B N H > S+ 0 0 8 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.838 111.3 54.8 -72.0 -27.3 81.9 33.4 13.4 355 117 B R H 4>S+ 0 0 125 2,-0.2 5,-3.4 1,-0.2 6,-0.3 0.878 104.8 53.4 -69.3 -37.7 80.8 35.6 16.4 356 118 B I H ><5S+ 0 0 99 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.888 116.5 40.8 -60.9 -39.0 79.6 32.5 18.2 357 119 B R H 3<5S+ 0 0 84 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.859 116.1 47.8 -75.9 -39.4 83.0 31.0 17.5 358 120 B F T ><5S- 0 0 98 -4,-3.0 3,-1.6 3,-0.2 -1,-0.2 -0.078 116.6 -99.6-100.7 34.3 85.1 34.1 18.2 359 121 B K T < 5S- 0 0 179 -3,-0.5 -3,-0.2 1,-0.3 -4,-0.1 0.819 78.7 -58.9 53.9 37.4 83.6 35.3 21.5 360 122 B D T 3 - 0 0 33 66,-2.1 4,-1.6 1,-0.1 3,-0.2 -0.614 38.9-135.5 -73.1 130.9 94.4 30.0 2.8 369 131 B F H > S+ 0 0 138 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.889 99.7 50.5 -55.6 -46.7 97.1 32.3 1.2 370 132 B D H > S+ 0 0 68 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.868 109.2 51.9 -63.0 -37.0 98.8 29.6 -0.9 371 133 B M H > S+ 0 0 3 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.852 109.0 51.0 -67.8 -34.1 95.5 28.5 -2.4 372 134 B V H X S+ 0 0 15 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.952 113.3 44.5 -66.8 -47.6 94.8 32.1 -3.3 373 135 B R H X S+ 0 0 118 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.884 109.9 54.8 -64.1 -39.8 98.1 32.5 -5.0 374 136 B N H X S+ 0 0 20 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.906 110.5 47.9 -59.6 -40.3 97.9 29.1 -6.8 375 137 B A H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.879 109.2 51.5 -68.0 -41.5 94.5 30.3 -8.2 376 138 B V H X S+ 0 0 45 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.935 113.8 45.2 -61.4 -45.8 95.9 33.6 -9.4 377 139 B D H X S+ 0 0 61 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.875 111.8 50.4 -66.6 -39.6 98.7 31.9 -11.2 378 140 B A H X S+ 0 0 3 -4,-2.2 4,-1.2 -5,-0.2 -1,-0.2 0.913 112.0 48.9 -65.8 -39.8 96.6 29.2 -12.8 379 141 B A H <>S+ 0 0 1 -4,-2.4 5,-2.9 2,-0.2 3,-0.3 0.925 110.7 50.8 -63.7 -44.2 94.2 32.0 -14.0 380 142 B K H ><5S+ 0 0 138 -4,-2.3 3,-2.3 1,-0.2 -2,-0.2 0.934 106.8 53.4 -57.7 -48.8 97.2 33.9 -15.4 381 143 B A H 3<5S+ 0 0 91 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.801 109.4 50.8 -57.9 -28.6 98.5 30.8 -17.2 382 144 B L T 3<5S- 0 0 62 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.386 120.2-110.1 -90.2 2.5 95.0 30.6 -18.8 383 145 B G T < 5S+ 0 0 63 -3,-2.3 2,-0.5 1,-0.2 -3,-0.2 0.802 74.5 135.2 74.0 28.7 95.0 34.2 -19.9 384 146 B I < - 0 0 31 -5,-2.9 2,-0.9 -8,-0.1 -1,-0.2 -0.945 51.3-141.9-116.2 129.0 92.4 35.2 -17.3 385 147 B D - 0 0 152 -2,-0.5 -44,-0.6 -3,-0.1 2,-0.3 -0.766 25.2-165.3 -87.6 106.8 92.6 38.3 -15.2 386 148 B A E -r 341 0C 29 -2,-0.9 2,-0.5 -10,-0.2 -44,-0.2 -0.678 12.2-137.0 -94.4 148.9 91.2 37.3 -11.8 387 149 B R E -r 342 0C 82 -46,-2.7 -44,-2.9 -2,-0.3 2,-0.5 -0.895 15.9-158.4-105.4 133.1 90.2 39.9 -9.2 388 150 B V E +r 343 0C 54 -2,-0.5 2,-0.3 -46,-0.2 -44,-0.2 -0.943 41.9 79.7-114.5 129.3 91.2 39.2 -5.6 389 151 B G E S-r 344 0C 11 -46,-1.9 -43,-1.5 -2,-0.5 -44,-1.1 -0.919 72.4 -13.5 176.2-149.5 89.4 40.8 -2.6 390 152 B N E -r 346 0C 59 22,-0.4 24,-3.2 -2,-0.3 25,-0.8 -0.613 41.7-169.0 -88.3 139.5 86.3 40.6 -0.4 391 153 B L E -ru 347 415C 0 -45,-1.7 -43,-2.9 -2,-0.3 2,-0.5 -0.745 19.9-131.7-112.8 164.1 83.2 38.6 -1.0 392 154 B F E -ru 348 416C 9 23,-2.4 25,-2.9 -2,-0.3 2,-0.7 -0.983 11.8-154.9-123.0 121.1 80.0 39.1 1.1 393 155 B S E -ru 349 417C 0 -45,-3.1 -43,-1.7 -2,-0.5 -42,-0.5 -0.849 17.5-165.1 -96.9 113.0 78.3 36.0 2.5 394 156 B A - 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