==== 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 ISOMERASE/RNA 22-MAY-09 3HJW . COMPND 2 MOLECULE: PSEUDOURIDINE SYNTHASE CBF5; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR B.LIANG,J.ZHOU,E.KAHEN,R.M.TERNS,M.P.TERNS,H.LI . 500 3 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23689.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 339 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 101 20.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 35 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 22.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.4 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 1 0 3 0 3 2 0 1 2 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 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 . 1 5 3 2 3 1 0 2 1 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 1 1 0 0 1 0 0 0 1 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 11 A R 0 0 221 0, 0.0 2,-0.5 0, 0.0 149,-0.1 0.000 360.0 360.0 360.0 -24.3 39.3 9.3 -1.7 2 12 A I - 0 0 100 147,-0.2 164,-0.1 164,-0.1 5,-0.0 -0.732 360.0-174.6-100.2 124.9 36.1 11.3 -1.6 3 13 A L > - 0 0 2 -2,-0.5 3,-2.0 97,-0.1 4,-0.2 -0.773 43.0-109.3 -94.3 155.9 33.2 11.2 0.9 4 14 A P G > S+ 0 0 65 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.808 118.2 65.7 -48.5 -34.3 30.0 13.3 0.2 5 15 A A G 3 S+ 0 0 24 1,-0.2 94,-0.0 194,-0.0 -3,-0.0 0.342 87.8 71.5 -73.6 7.2 31.1 15.6 3.0 6 16 A D G < + 0 0 53 -3,-2.0 -1,-0.2 2,-0.1 -4,-0.0 0.515 68.1 131.7 -99.9 -6.9 34.1 16.6 0.9 7 17 A I < - 0 0 100 -3,-1.4 2,-0.2 -4,-0.2 -4,-0.0 -0.067 62.3-112.7 -51.1 141.3 32.1 18.7 -1.7 8 18 A K - 0 0 208 1,-0.0 2,-0.4 2,-0.0 -1,-0.1 -0.561 33.0-156.8 -73.0 138.0 33.4 22.1 -2.6 9 19 A R - 0 0 73 -2,-0.2 2,-0.5 262,-0.0 264,-0.1 -0.970 8.0-148.6-126.5 122.1 31.0 24.9 -1.5 10 20 A E - 0 0 145 -2,-0.4 262,-3.2 262,-0.1 2,-0.5 -0.745 16.9-138.8 -84.6 124.2 30.7 28.4 -2.9 11 21 A V E -A 271 0A 65 -2,-0.5 2,-0.4 260,-0.3 260,-0.3 -0.743 20.0-158.3 -81.3 124.6 29.8 31.1 -0.4 12 22 A L E -A 270 0A 41 258,-4.0 258,-2.2 -2,-0.5 2,-0.5 -0.851 9.6-131.2-109.0 143.2 27.2 33.6 -1.9 13 23 A I E +A 269 0A 80 -2,-0.4 256,-0.2 256,-0.2 3,-0.2 -0.806 29.5 165.2 -97.7 124.1 26.6 37.1 -0.6 14 24 A K S S+ 0 0 48 254,-2.4 2,-0.7 -2,-0.5 255,-0.2 0.849 79.4 25.5 -93.5 -59.3 23.1 38.4 0.0 15 25 A D > - 0 0 52 253,-1.8 3,-1.2 1,-0.1 -1,-0.2 -0.848 60.6-178.9-114.4 99.3 23.7 41.5 2.1 16 26 A E T 3 S+ 0 0 131 -2,-0.7 -1,-0.1 1,-0.2 252,-0.1 0.693 81.2 58.9 -64.7 -22.3 27.2 43.0 1.4 17 27 A N T 3 S+ 0 0 124 2,-0.1 -1,-0.2 251,-0.0 2,-0.2 0.554 73.7 119.0 -90.3 -10.1 26.6 45.8 4.0 18 28 A A < - 0 0 31 -3,-1.2 2,-0.3 250,-0.1 250,-0.0 -0.383 40.6-177.2 -62.7 124.9 26.0 43.6 7.0 19 29 A E - 0 0 169 -2,-0.2 231,-0.4 2,-0.0 2,-0.4 -0.872 19.5-128.8-119.8 156.5 28.6 44.2 9.8 20 30 A T - 0 0 46 -2,-0.3 229,-0.0 265,-0.1 264,-0.0 -0.898 16.8-125.5-110.8 138.2 29.0 42.4 13.1 21 31 A N > - 0 0 46 -2,-0.4 3,-2.4 1,-0.1 -2,-0.0 -0.726 12.1-149.9 -80.7 113.3 29.2 44.1 16.5 22 32 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.640 94.5 64.5 -58.9 -18.4 32.4 43.0 18.3 23 33 A D T 3 S+ 0 0 137 3,-0.0 2,-0.4 -3,-0.0 -2,-0.0 0.655 92.6 78.9 -75.7 -18.1 30.7 43.5 21.7 24 34 A W S < S- 0 0 70 -3,-2.4 299,-0.2 299,-0.0 298,-0.1 -0.774 91.3 -11.0-102.3 138.1 28.2 40.8 20.9 25 35 A G S S- 0 0 3 297,-1.9 298,-0.0 -2,-0.4 0, 0.0 0.086 73.3 -91.4 73.7 175.4 28.7 37.0 21.1 26 36 A F - 0 0 69 5,-0.0 -1,-0.1 6,-0.0 5,-0.1 -0.840 31.8-151.1-133.3 92.7 31.8 34.9 21.7 27 37 A P - 0 0 28 0, 0.0 4,-0.5 0, 0.0 3,-0.2 -0.317 39.0 -96.7 -55.9 146.0 33.6 33.8 18.5 28 38 A P S > S+ 0 0 25 0, 0.0 3,-1.8 0, 0.0 2,-1.8 0.824 119.2 46.4 -38.8 -64.4 35.5 30.5 19.0 29 39 A E T 3 S+ 0 0 124 1,-0.3 0, 0.0 206,-0.0 0, 0.0 -0.544 109.6 53.2 -87.6 76.3 39.0 31.8 19.7 30 40 A K T 3 S+ 0 0 93 -2,-1.8 -1,-0.3 -3,-0.2 3,-0.0 0.045 79.1 117.4-177.9 -13.5 37.9 34.5 22.2 31 41 A R S < S- 0 0 1 -3,-1.8 5,-0.1 -4,-0.5 -1,-0.1 -0.566 73.2-115.6 -69.5 123.8 35.9 32.2 24.5 32 42 A P >> - 0 0 62 0, 0.0 4,-2.4 0, 0.0 3,-1.2 -0.339 37.1-103.0 -54.3 148.9 37.3 32.0 28.0 33 43 A I H 3> S+ 0 0 3 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.815 120.1 53.1 -47.8 -43.3 38.6 28.5 28.6 34 44 A E H 3> S+ 0 0 115 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.847 113.0 43.6 -64.0 -35.5 35.6 27.4 30.7 35 45 A M H <> S+ 0 0 37 -3,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.837 109.1 59.3 -76.0 -35.6 33.1 28.6 28.0 36 46 A H H < S+ 0 0 1 -4,-2.4 3,-0.4 2,-0.2 -2,-0.2 0.940 107.9 44.6 -56.0 -50.6 35.3 26.9 25.4 37 47 A I H >< S+ 0 0 15 -4,-2.4 3,-2.1 1,-0.2 52,-0.2 0.930 107.2 59.4 -57.9 -49.6 34.8 23.6 27.2 38 48 A Q H 3< S+ 0 0 55 -4,-1.8 50,-0.9 1,-0.3 51,-0.7 0.805 118.0 31.8 -49.3 -34.6 31.1 24.2 27.6 39 49 A F T 3< S+ 0 0 7 -4,-1.6 197,-2.4 -3,-0.4 -1,-0.3 -0.213 104.3 120.8-118.1 39.6 30.8 24.4 23.8 40 50 A G E < -G 235 0B 0 -3,-2.1 46,-3.0 46,-0.3 2,-0.4 -0.625 44.0-160.2-113.0 162.2 33.6 22.0 22.9 41 51 A V E -GH 234 85B 0 193,-2.7 193,-3.2 44,-0.2 2,-0.5 -0.998 14.9-142.4-138.0 134.8 34.3 18.7 21.1 42 52 A I E - H 0 84B 0 42,-3.6 42,-2.5 -2,-0.4 2,-1.4 -0.858 5.9-148.3 -99.1 126.9 37.3 16.4 21.5 43 53 A N E -iH 207 83B 0 -2,-0.5 165,-2.9 163,-0.5 2,-0.3 -0.699 35.6-166.2 -86.5 81.8 38.8 14.7 18.4 44 54 A L E -iH 208 82B 0 38,-1.6 38,-2.7 -2,-1.4 2,-1.0 -0.529 26.8-145.9 -82.7 136.0 39.8 11.6 20.4 45 55 A D E -iH 209 81B 15 163,-3.0 165,-0.5 -2,-0.3 36,-0.2 -0.829 29.2-145.1 -90.7 94.9 42.1 8.9 19.3 46 56 A K E - H 0 80B 0 34,-2.9 34,-1.7 -2,-1.0 6,-0.1 -0.420 9.1-137.7 -63.4 128.8 40.4 5.9 21.0 47 57 A P - 0 0 2 0, 0.0 31,-0.1 0, 0.0 2,-0.1 -0.521 25.7-100.0 -78.7 155.6 42.9 3.3 22.3 48 58 A P S S+ 0 0 3 0, 0.0 29,-0.3 0, 0.0 313,-0.2 -0.477 96.9 50.4 -69.4 149.5 42.2 -0.5 21.8 49 59 A G S S+ 0 0 32 27,-2.9 29,-0.1 1,-0.2 311,-0.0 -0.786 89.1 63.8 128.1 -89.4 40.9 -2.1 25.0 50 60 A P S S- 0 0 18 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.177 83.4-104.1 -68.4 160.9 37.9 -0.3 26.6 51 61 A T > - 0 0 49 1,-0.1 4,-2.0 -3,-0.1 5,-0.1 -0.391 34.1-108.5 -74.0 162.9 34.5 0.2 25.0 52 62 A S H > S+ 0 0 0 22,-0.8 4,-1.6 1,-0.2 5,-0.1 0.870 120.5 54.6 -59.0 -36.0 33.6 3.6 23.6 53 63 A H H > S+ 0 0 118 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.878 106.6 49.8 -69.1 -39.2 31.2 4.2 26.5 54 64 A E H > S+ 0 0 94 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.922 106.2 56.1 -61.0 -48.0 33.8 3.5 29.1 55 65 A V H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.885 110.1 45.0 -54.5 -42.8 36.2 5.9 27.5 56 66 A V H X S+ 0 0 9 -4,-1.6 4,-3.1 2,-0.2 -1,-0.2 0.895 108.3 56.6 -70.1 -39.0 33.7 8.7 27.8 57 67 A A H X S+ 0 0 54 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.887 110.3 46.9 -56.7 -38.9 32.8 7.7 31.4 58 68 A W H X S+ 0 0 41 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.918 110.8 51.1 -66.6 -45.0 36.5 8.2 32.1 59 69 A I H X S+ 0 0 2 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.946 109.9 49.7 -57.7 -48.8 36.6 11.5 30.3 60 70 A K H X>S+ 0 0 71 -4,-3.1 5,-2.6 1,-0.2 4,-0.6 0.906 114.8 43.9 -55.8 -45.5 33.6 12.8 32.2 61 71 A K H <5S+ 0 0 117 -4,-1.7 3,-0.3 -5,-0.2 -1,-0.2 0.918 117.0 43.5 -72.2 -42.5 35.1 11.9 35.6 62 72 A I H <5S+ 0 0 13 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.870 120.9 39.8 -70.7 -37.0 38.7 13.1 34.9 63 73 A L H <5S- 0 0 9 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.475 109.2-122.3 -91.7 0.3 37.6 16.4 33.3 64 74 A N T <5 + 0 0 128 -4,-0.6 2,-0.4 -3,-0.3 -3,-0.2 0.979 53.4 160.3 53.9 62.5 34.7 16.9 35.8 65 75 A L < - 0 0 19 -5,-2.6 -1,-0.2 1,-0.1 3,-0.1 -0.906 42.6-151.9-113.4 142.2 31.9 17.1 33.2 66 76 A E S S+ 0 0 177 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.860 83.3 13.9 -74.5 -36.6 28.2 16.6 33.8 67 77 A K + 0 0 106 -7,-0.1 20,-3.3 2,-0.0 2,-0.3 -0.998 56.4 157.4-147.1 145.7 27.7 15.4 30.2 68 78 A A E -J 86 0B 13 -2,-0.3 2,-0.4 18,-0.3 18,-0.2 -0.933 15.7-163.1-159.3 141.7 29.5 14.2 27.1 69 79 A G E -J 85 0B 17 16,-2.4 16,-2.7 -2,-0.3 2,-0.2 -0.984 9.1-143.7-129.7 140.0 28.4 12.1 24.2 70 80 A H E -J 84 0B 30 -2,-0.4 14,-0.2 14,-0.2 3,-0.1 -0.667 14.5-126.3 -98.2 158.3 30.4 10.2 21.5 71 81 A G S S- 0 0 2 12,-2.0 -1,-0.2 -2,-0.2 3,-0.1 0.259 75.9 -5.8 -71.0-153.7 29.6 9.7 17.8 72 82 A G S S- 0 0 16 1,-0.1 -1,-0.2 21,-0.1 2,-0.2 -0.130 86.3-109.6 -45.2 125.8 29.5 6.3 16.2 73 83 A T - 0 0 72 -3,-0.1 2,-0.4 9,-0.1 -1,-0.1 -0.408 27.4-149.8 -63.4 124.2 30.6 3.7 18.7 74 84 A L - 0 0 4 -2,-0.2 -22,-0.8 -3,-0.1 6,-0.1 -0.785 25.2-108.1 -90.4 142.1 34.0 2.0 18.0 75 85 A D > - 0 0 83 -2,-0.4 3,-1.2 -24,-0.1 -26,-0.1 -0.170 32.2-102.9 -61.0 156.7 34.5 -1.6 19.2 76 86 A P T 3 S+ 0 0 56 0, 0.0 -27,-2.9 0, 0.0 -1,-0.1 0.874 122.4 42.2 -48.9 -44.9 36.7 -2.4 22.2 77 87 A K T 3 S+ 0 0 146 -29,-0.3 2,-0.3 2,-0.0 116,-0.3 0.533 97.8 94.3 -82.5 -8.2 39.6 -3.6 19.9 78 88 A V < - 0 0 5 -3,-1.2 2,-0.2 -31,-0.1 116,-0.2 -0.685 56.6-164.2 -92.8 135.4 39.2 -0.8 17.4 79 89 A S E + k 0 194B 0 114,-1.3 116,-2.5 -2,-0.3 2,-0.2 -0.607 35.7 54.3-104.7 171.9 41.3 2.4 17.7 80 90 A G E S+Hk 46 195B 0 -34,-1.7 -34,-2.9 114,-0.2 116,-0.2 -0.643 76.3 24.5 115.5-160.7 41.0 5.9 16.1 81 91 A V E +H 45 0B 0 114,-2.2 -36,-0.2 -2,-0.2 116,-0.1 -0.202 52.0 162.6 -57.2 113.0 38.7 8.9 15.5 82 92 A L E -H 44 0B 0 -38,-2.7 -38,-1.6 -2,-0.1 2,-0.2 -0.885 27.5-147.4-131.1 98.7 36.1 9.1 18.2 83 93 A P E -H 43 0B 0 0, 0.0 -12,-2.0 0, 0.0 2,-0.5 -0.524 12.6-166.9 -67.2 132.1 34.4 12.5 18.4 84 94 A V E -HJ 42 70B 0 -42,-2.5 -42,-3.6 -2,-0.2 2,-0.4 -0.964 3.9-158.6-122.1 110.2 33.4 13.4 21.9 85 95 A A E -HJ 41 69B 0 -16,-2.7 -16,-2.4 -2,-0.5 2,-0.4 -0.736 16.4-140.9 -91.5 136.4 31.0 16.4 22.3 86 96 A L E > - J 0 68B 0 -46,-3.0 3,-2.9 -2,-0.4 -46,-0.3 -0.812 38.6 -52.5-110.1 138.3 31.0 18.0 25.7 87 97 A E G > S+ 0 0 24 -20,-3.3 3,-1.9 -2,-0.4 4,-0.2 -0.099 128.1 12.6 52.7-118.9 28.3 19.5 27.9 88 98 A K G 3 S+ 0 0 110 -50,-0.9 -1,-0.3 1,-0.3 3,-0.2 0.593 129.7 56.7 -70.4 -10.5 26.2 22.1 26.0 89 99 A A G X S+ 0 0 0 -3,-2.9 3,-1.9 -51,-0.7 4,-0.3 0.449 75.6 104.2 -92.5 -0.3 27.7 20.9 22.7 90 100 A T G X S+ 0 0 15 -3,-1.9 3,-1.5 1,-0.3 -5,-0.2 0.833 71.6 59.3 -55.4 -36.7 26.6 17.3 23.2 91 101 A R G > S+ 0 0 103 1,-0.3 3,-1.6 -3,-0.2 -1,-0.3 0.640 83.6 79.6 -73.2 -14.1 23.7 17.5 20.8 92 102 A V G X> + 0 0 0 -3,-1.9 3,-2.8 1,-0.3 4,-0.5 0.670 69.2 85.9 -62.1 -18.0 25.9 18.4 17.8 93 103 A V H X> S+ 0 0 20 -3,-1.5 4,-3.1 -4,-0.3 3,-1.6 0.789 73.9 74.3 -52.3 -26.1 26.8 14.7 17.5 94 104 A Q H <4 S+ 0 0 69 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.643 91.6 52.8 -63.4 -17.3 23.6 14.5 15.4 95 105 A A H <4 S+ 0 0 3 -3,-2.8 -1,-0.3 2,-0.1 -2,-0.2 0.645 117.9 39.2 -84.7 -18.6 25.5 16.2 12.6 96 106 A L H X< S+ 0 0 0 -3,-1.6 3,-2.8 -4,-0.5 -2,-0.2 0.890 98.6 67.8 -97.2 -55.7 28.2 13.5 12.9 97 107 A L T 3< S+ 0 0 81 -4,-3.1 -3,-0.1 1,-0.3 73,-0.1 0.816 108.7 41.2 -40.1 -46.8 26.5 10.2 13.6 98 108 A P T 3 S+ 0 0 85 0, 0.0 71,-0.6 0, 0.0 -1,-0.3 0.545 95.9 101.3 -81.5 -7.3 25.0 10.2 10.1 99 109 A A S < S- 0 0 12 -3,-2.8 -3,-0.1 1,-0.1 -4,-0.0 -0.314 81.6 -87.4 -75.7 162.4 28.1 11.5 8.2 100 110 A G - 0 0 11 68,-0.1 99,-2.5 98,-0.1 2,-0.3 -0.249 41.0-153.2 -67.9 154.2 30.5 9.2 6.3 101 111 A K E -LM 167 198B 7 66,-3.2 66,-3.1 97,-0.2 2,-0.4 -0.885 6.0-148.7-126.6 157.9 33.4 7.4 7.8 102 112 A E E -LM 166 197B 19 95,-2.2 94,-2.2 -2,-0.3 95,-1.6 -0.985 14.9-174.6-126.2 143.1 36.8 6.0 6.8 103 113 A Y E -LM 165 195B 23 62,-2.5 62,-2.7 -2,-0.4 2,-0.5 -0.956 22.3-144.3-127.6 147.8 38.7 3.0 8.1 104 114 A V E -LM 164 194B 0 90,-2.6 90,-2.0 -2,-0.3 2,-0.3 -0.978 34.4-175.0-100.4 126.3 42.0 1.4 7.6 105 115 A A E -LM 163 193B 0 58,-3.3 58,-2.6 -2,-0.5 2,-0.6 -0.918 26.5-148.2-124.4 147.5 41.6 -2.4 7.9 106 116 A L E -LM 162 192B 2 86,-2.7 85,-2.7 -2,-0.3 86,-1.1 -0.969 20.9-166.4-111.2 113.8 43.8 -5.4 7.9 107 117 A M E -LM 161 190B 0 54,-3.1 54,-2.9 -2,-0.6 2,-0.6 -0.842 8.2-151.0 -98.3 132.2 42.0 -8.4 6.3 108 118 A H E -LM 160 189B 58 81,-3.3 81,-2.1 -2,-0.4 2,-0.2 -0.927 11.7-147.2-104.1 116.1 43.5 -11.9 6.8 109 119 A L E - M 0 188B 1 50,-3.4 79,-0.3 -2,-0.6 78,-0.1 -0.582 7.8-143.7 -78.8 142.8 42.7 -14.3 3.9 110 120 A H S S+ 0 0 96 77,-2.5 2,-0.3 -2,-0.2 78,-0.1 0.228 82.5 22.8 -90.7 13.6 42.2 -18.0 4.7 111 121 A G S S- 0 0 10 76,-0.3 2,-0.2 48,-0.1 75,-0.1 -0.965 94.9 -79.4-170.3 161.9 43.9 -19.2 1.5 112 122 A D + 0 0 119 -2,-0.3 47,-0.1 74,-0.0 74,-0.1 -0.481 44.9 170.5 -80.1 137.4 46.2 -17.9 -1.2 113 123 A V - 0 0 19 45,-0.2 -4,-0.1 -2,-0.2 45,-0.0 -0.990 38.0-104.4-142.7 134.1 45.0 -15.6 -3.9 114 124 A P > - 0 0 75 0, 0.0 4,-1.8 0, 0.0 3,-0.4 -0.344 29.5-121.6 -57.0 144.0 47.0 -13.7 -6.5 115 125 A E H > S+ 0 0 113 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.837 110.8 58.4 -57.6 -37.4 47.4 -10.0 -5.8 116 126 A D H > S+ 0 0 117 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.910 106.5 48.2 -59.5 -43.6 45.7 -9.0 -9.1 117 127 A K H > S+ 0 0 77 -3,-0.4 4,-3.0 2,-0.2 5,-0.3 0.902 107.0 55.5 -62.8 -49.2 42.5 -10.9 -8.1 118 128 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 5,-0.2 0.937 111.5 43.7 -50.6 -53.0 42.3 -9.4 -4.7 119 129 A I H X S+ 0 0 72 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.933 113.7 52.3 -60.6 -48.7 42.3 -5.8 -6.1 120 130 A Q H X S+ 0 0 115 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.932 114.1 41.1 -45.3 -59.3 39.8 -6.8 -8.9 121 131 A V H >< S+ 0 0 11 -4,-3.0 3,-0.5 1,-0.2 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