==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/ISOMERASE INHIBITOR 08-AUG-11 3TC5 . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA-INTERACT . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.GRAEBER,W.JANCZYK,B.SPERL,N.ELUMALAI,C.KOZANY,F.HAUSCH,T.A . 144 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8219.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 85 59.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 20.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.4 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 . 2 1.4 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 . 6 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 20.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 0 0 0 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 2 0 1 1 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 1 0 1 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 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 7 A L 0 0 93 0, 0.0 3,-0.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0-173.0 11.7 -12.1 4.4 2 8 A P > - 0 0 46 0, 0.0 3,-1.7 0, 0.0 120,-0.0 -0.035 360.0 -50.4 -61.1 168.7 14.6 -10.9 6.7 3 9 A P T 3 S+ 0 0 101 0, 0.0 19,-0.2 0, 0.0 17,-0.0 -0.170 124.3 6.1 -52.0 115.1 18.0 -10.0 5.4 4 10 A G T 3 S+ 0 0 15 1,-0.3 17,-2.1 -3,-0.2 2,-0.3 0.454 90.2 137.3 101.4 7.8 19.5 -12.6 3.0 5 11 A W E < +A 20 0A 40 -3,-1.7 2,-0.3 15,-0.2 -1,-0.3 -0.657 23.5 176.5 -97.1 140.7 16.6 -15.1 2.6 6 12 A E E -A 19 0A 97 13,-2.3 13,-2.4 -2,-0.3 2,-0.4 -0.970 30.7-116.8-135.1 151.3 15.3 -16.8 -0.5 7 13 A K E +A 18 0A 90 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.706 40.7 173.8 -85.1 136.7 12.6 -19.4 -1.2 8 14 A A E -A 17 0A 18 9,-3.0 9,-2.6 -2,-0.4 2,-0.5 -0.876 29.3-119.7-138.6 170.1 13.9 -22.7 -2.6 9 15 A M E -A 16 0A 118 -2,-0.3 7,-0.2 7,-0.2 6,-0.1 -0.964 34.1-110.3-118.7 128.3 12.7 -26.2 -3.5 10 16 A S > - 0 0 15 5,-2.8 4,-1.7 -2,-0.5 6,-0.0 -0.359 19.4-147.4 -58.9 126.9 14.0 -29.3 -1.8 11 17 A R T 4 S+ 0 0 241 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 0.823 96.7 34.7 -66.1 -32.5 16.1 -31.3 -4.3 12 18 A S T 4 S+ 0 0 119 3,-0.1 -1,-0.2 1,-0.0 -2,-0.1 0.911 134.1 20.7 -89.5 -46.4 15.1 -34.6 -2.7 13 19 A S T 4 S- 0 0 66 2,-0.1 -2,-0.2 0, 0.0 3,-0.1 0.651 87.5-131.6-100.5 -20.7 11.5 -34.0 -1.5 14 20 A G < + 0 0 43 -4,-1.7 2,-0.2 1,-0.3 -3,-0.1 0.417 59.4 138.1 81.0 -2.0 10.3 -31.0 -3.6 15 21 A R - 0 0 135 -6,-0.1 -5,-2.8 1,-0.1 -1,-0.3 -0.479 60.7-102.0 -78.3 147.0 8.9 -29.2 -0.5 16 22 A V E +A 9 0A 52 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.412 48.3 166.8 -67.3 137.6 9.5 -25.4 -0.2 17 23 A Y E -A 8 0A 66 -9,-2.6 -9,-3.0 -2,-0.1 2,-0.4 -0.897 29.6-116.4-141.3 178.0 12.3 -24.3 2.2 18 24 A Y E -AB 7 27A 27 9,-3.0 9,-2.3 -2,-0.3 2,-0.4 -0.957 21.6-169.4-125.9 138.4 14.2 -21.2 3.0 19 25 A F E -AB 6 26A 52 -13,-2.4 -13,-2.3 -2,-0.4 2,-0.6 -0.977 12.0-150.5-129.6 135.9 17.9 -20.5 2.5 20 26 A N E > -A 5 0A 1 5,-2.7 4,-2.0 -2,-0.4 5,-0.3 -0.937 1.9-163.3-109.5 117.0 20.0 -17.6 3.8 21 27 A H T 4 S+ 0 0 116 -17,-2.1 -16,-0.1 -2,-0.6 -1,-0.1 0.536 88.7 52.2 -80.2 -4.8 23.0 -16.7 1.6 22 28 A I T 4 S+ 0 0 52 -18,-0.3 -1,-0.2 -19,-0.2 97,-0.1 0.823 125.1 22.0 -93.1 -41.3 24.7 -14.7 4.3 23 29 A T T 4 S- 0 0 0 2,-0.1 107,-2.6 -19,-0.1 -2,-0.2 0.569 94.8-130.4 -99.6 -13.8 24.6 -17.2 7.1 24 30 A N < + 0 0 54 -4,-2.0 2,-0.2 1,-0.2 -3,-0.2 0.619 57.1 149.7 61.9 18.7 24.2 -20.4 4.9 25 31 A A - 0 0 8 -5,-0.3 -5,-2.7 105,-0.2 2,-0.3 -0.478 27.6-168.0 -74.6 148.6 21.3 -21.4 7.2 26 32 A S E +B 19 0A 51 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.997 12.1 162.6-140.2 142.5 18.5 -23.4 5.8 27 33 A Q E -B 18 0A 67 -9,-2.3 -9,-3.0 -2,-0.3 -2,-0.0 -0.983 40.8-128.7-155.4 155.9 15.1 -24.2 7.4 28 34 A W S S+ 0 0 128 -2,-0.3 2,-0.1 -11,-0.2 -1,-0.1 0.863 84.9 77.6 -77.4 -39.4 11.6 -25.4 6.5 29 35 A E S S- 0 0 156 1,-0.1 -11,-0.1 -11,-0.1 -2,-0.1 -0.411 91.9-102.1 -76.6 150.6 9.6 -22.6 8.1 30 36 A R 0 0 171 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.558 360.0 360.0 -70.8 121.8 9.2 -19.1 6.6 31 37 A P 0 0 48 0, 0.0 -1,-0.1 0, 0.0 -26,-0.0 -0.352 360.0 360.0 -72.2 360.0 11.5 -16.7 8.4 32 ! 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 33 51 A E 0 0 162 0, 0.0 89,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 134.9 20.2 -5.1 12.7 34 52 A P - 0 0 38 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.387 360.0-137.2 -70.5 146.5 21.5 -5.2 16.3 35 53 A A S S+ 0 0 86 1,-0.2 74,-0.5 73,-0.1 2,-0.3 0.814 89.4 19.2 -69.8 -34.9 24.4 -2.9 17.3 36 54 A R - 0 0 138 72,-0.2 2,-0.3 109,-0.1 72,-0.2 -0.983 67.4-175.1-135.4 146.8 26.2 -5.7 19.2 37 55 A V E -C 107 0B 2 70,-2.2 70,-2.3 -2,-0.3 2,-0.4 -0.962 17.4-141.3-134.2 156.3 25.9 -9.5 19.2 38 56 A R E +C 106 0B 79 -2,-0.3 106,-2.3 68,-0.3 107,-1.6 -0.973 30.1 176.4-113.5 133.5 27.4 -12.3 21.2 39 57 A C E - D 0 143B 0 66,-1.5 65,-2.7 -2,-0.4 66,-0.5 -0.965 23.6-155.5-136.7 154.2 28.4 -15.4 19.4 40 58 A S E -CD 103 142B 9 102,-2.7 102,-2.8 -2,-0.3 2,-0.3 -0.846 20.9-167.1-112.9 159.7 30.1 -18.8 19.8 41 59 A H E - D 0 141B 10 61,-1.9 2,-0.4 -2,-0.3 100,-0.2 -0.981 23.4-148.2-144.5 160.7 31.8 -20.7 17.1 42 60 A L E - D 0 140B 0 98,-2.1 98,-2.0 -2,-0.3 2,-0.5 -0.994 26.0-161.7-123.6 118.1 33.2 -24.1 16.1 43 61 A L E - D 0 139B 6 -2,-0.4 51,-3.4 96,-0.2 2,-0.5 -0.884 12.1-168.8-105.6 131.5 36.1 -23.8 13.7 44 62 A V E - D 0 138B 2 94,-2.8 94,-2.3 -2,-0.5 2,-0.1 -0.979 17.8-157.6-114.3 115.1 37.5 -26.6 11.6 45 63 A K - 0 0 10 -2,-0.5 2,-0.3 92,-0.2 92,-0.2 -0.407 8.1-167.0 -85.1 166.5 40.8 -25.6 10.0 46 64 A H > - 0 0 11 90,-0.3 3,-2.2 -2,-0.1 17,-0.2 -0.880 42.5 -83.1-144.8 176.7 42.3 -27.1 6.9 47 65 A S T 3 S+ 0 0 64 15,-2.9 16,-0.1 1,-0.3 13,-0.1 0.705 126.7 50.3 -60.5 -22.0 45.7 -27.2 5.0 48 66 A Q T 3 S+ 0 0 159 3,-0.1 -1,-0.3 88,-0.0 89,-0.1 0.357 81.0 123.9 -97.9 5.5 44.9 -23.8 3.3 49 67 A S S < S- 0 0 6 -3,-2.2 87,-0.2 1,-0.1 88,-0.1 -0.344 74.8-119.0 -59.4 146.2 43.9 -22.1 6.6 50 68 A R S S+ 0 0 161 85,-2.6 86,-0.1 1,-0.3 -1,-0.1 0.853 113.1 28.2 -59.7 -34.7 46.0 -18.9 7.2 51 69 A R S S- 0 0 154 84,-0.2 2,-2.7 85,-0.2 -1,-0.3 -0.792 78.0-167.4-124.7 86.8 47.3 -20.5 10.4 52 70 A P + 0 0 54 0, 0.0 8,-2.5 0, 0.0 2,-0.3 -0.260 60.0 81.4 -76.7 57.9 47.2 -24.4 9.8 53 71 A S + 0 0 41 -2,-2.7 2,-0.3 6,-0.2 5,-0.2 -0.981 47.8 163.1-156.5 149.0 47.7 -25.2 13.5 54 72 A S B > -G 57 0C 17 3,-2.2 3,-0.6 -2,-0.3 41,-0.1 -0.951 55.6 -86.8-155.7 176.7 45.6 -25.4 16.6 55 73 A W T 3 S+ 0 0 116 -2,-0.3 3,-0.1 1,-0.2 39,-0.1 0.737 125.9 53.8 -59.3 -24.3 45.6 -26.7 20.2 56 74 A R T 3 S+ 0 0 92 1,-0.3 2,-0.3 37,-0.1 -1,-0.2 0.805 123.7 10.2 -78.0 -32.6 44.2 -30.0 18.7 57 75 A Q B < -G 54 0C 72 -3,-0.6 -3,-2.2 1,-0.1 -1,-0.3 -0.949 55.3-149.7-159.3 121.3 46.9 -30.6 16.1 58 76 A E S S+ 0 0 177 -2,-0.3 2,-0.6 1,-0.3 -1,-0.1 0.920 97.9 32.3 -64.1 -44.8 50.3 -28.9 15.5 59 77 A K S S- 0 0 159 -6,-0.1 2,-0.7 -5,-0.0 -1,-0.3 -0.931 77.6-155.6-116.5 107.6 50.1 -29.5 11.7 60 78 A I + 0 0 4 -8,-2.5 -11,-0.1 -2,-0.6 -14,-0.1 -0.737 23.3 164.6 -85.4 117.2 46.6 -29.4 10.3 61 79 A T + 0 0 85 -2,-0.7 -1,-0.2 -16,-0.1 -14,-0.1 0.521 28.8 117.6-112.4 -12.7 46.8 -31.5 7.1 62 80 A R - 0 0 37 -17,-0.1 -15,-2.9 1,-0.1 2,-0.1 -0.213 65.5-113.3 -61.0 150.1 43.1 -32.2 6.3 63 81 A T > - 0 0 52 -17,-0.2 4,-2.5 -16,-0.1 5,-0.2 -0.371 23.5-109.9 -76.5 161.9 41.8 -30.8 3.0 64 82 A K H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.884 122.2 54.0 -54.9 -40.0 39.2 -28.0 2.8 65 83 A E H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.906 108.5 47.9 -64.5 -41.4 36.8 -30.7 1.5 66 84 A E H > S+ 0 0 105 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.888 110.4 52.7 -65.5 -39.6 37.5 -32.9 4.5 67 85 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.914 108.2 50.5 -60.9 -43.9 37.0 -29.9 6.8 68 86 A L H X S+ 0 0 52 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.899 108.2 52.4 -63.5 -41.4 33.6 -29.2 5.2 69 87 A E H X S+ 0 0 87 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.905 110.4 48.5 -58.9 -41.4 32.5 -32.8 5.6 70 88 A L H X S+ 0 0 65 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.941 112.5 48.3 -64.0 -46.3 33.4 -32.6 9.3 71 89 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.919 110.2 51.5 -58.0 -47.5 31.5 -29.3 9.7 72 90 A N H X S+ 0 0 71 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.886 109.9 50.2 -60.9 -39.2 28.4 -30.8 7.9 73 91 A G H X S+ 0 0 25 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.888 109.7 49.6 -64.8 -41.5 28.5 -33.7 10.3 74 92 A Y H X S+ 0 0 27 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.916 109.5 52.0 -64.8 -42.3 28.6 -31.5 13.3 75 93 A I H X S+ 0 0 21 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.911 108.9 51.5 -58.8 -43.4 25.7 -29.5 12.0 76 94 A Q H X S+ 0 0 142 -4,-2.1 4,-2.0 1,-0.2 6,-0.2 0.935 111.8 45.7 -58.0 -48.2 23.7 -32.7 11.6 77 95 A K H X>S+ 0 0 62 -4,-2.2 6,-1.8 2,-0.2 5,-0.8 0.861 114.0 48.4 -66.4 -36.4 24.4 -33.8 15.2 78 96 A I H ><5S+ 0 0 29 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.933 113.2 47.2 -69.6 -44.5 23.6 -30.4 16.6 79 97 A K H 3<5S+ 0 0 128 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.814 111.4 51.4 -66.5 -31.5 20.3 -30.1 14.6 80 98 A S H 3<5S- 0 0 81 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.646 108.6-123.9 -78.1 -17.0 19.3 -33.6 15.6 81 99 A G T <<5S+ 0 0 54 -4,-0.7 -3,-0.2 -3,-0.7 -4,-0.1 0.412 80.7 118.8 84.3 -0.8 19.9 -32.9 19.3 82 100 A E S - 0 0 108 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.704 23.5-124.1 -87.2 147.9 25.0 -29.9 21.9 85 103 A F H > S+ 0 0 8 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.906 113.3 53.9 -51.7 -45.6 26.9 -27.1 20.1 86 104 A E H > S+ 0 0 71 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.870 106.5 50.9 -61.1 -41.1 28.9 -26.5 23.2 87 105 A S H > S+ 0 0 41 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.916 113.3 44.0 -63.8 -46.7 30.0 -30.1 23.6 88 106 A L H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 5,-0.4 0.871 112.9 51.9 -69.7 -37.3 31.2 -30.3 20.0 89 107 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 -5,-0.2 6,-0.2 0.946 109.9 49.5 -62.4 -46.5 33.0 -26.9 20.1 90 108 A S H < S+ 0 0 41 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.855 121.1 35.2 -60.4 -37.2 34.8 -27.9 23.3 91 109 A Q H < S+ 0 0 90 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.836 132.6 18.2 -85.0 -37.4 35.9 -31.2 21.8 92 110 A F H < S+ 0 0 53 -4,-2.8 2,-0.3 -5,-0.1 -3,-0.2 0.476 81.2 117.0-126.4 -5.6 36.6 -30.4 18.2 93 111 A S < - 0 0 0 -4,-1.9 2,-0.2 -5,-0.4 -49,-0.2 -0.568 53.5-145.9 -73.4 131.0 37.0 -26.7 17.5 94 112 A D S S+ 0 0 2 -51,-3.4 2,-0.4 -2,-0.3 -41,-0.1 -0.098 73.7 93.3 -82.5 33.3 40.4 -25.7 16.1 95 113 A C S > S- 0 0 27 -2,-0.2 3,-2.2 -6,-0.2 4,-0.2 -0.964 84.3-124.2-126.9 145.3 40.2 -22.4 18.0 96 114 A S G > S+ 0 0 100 -2,-0.4 3,-1.4 1,-0.3 4,-0.2 0.719 107.0 75.8 -58.3 -22.5 41.4 -21.5 21.5 97 115 A S G > > + 0 0 13 1,-0.3 5,-2.4 2,-0.2 3,-1.8 0.605 69.2 88.5 -65.5 -11.0 37.8 -20.5 22.2 98 116 A A G X 5S+ 0 0 1 -3,-2.2 3,-1.7 1,-0.3 -1,-0.3 0.856 79.1 62.5 -52.6 -35.6 37.1 -24.3 22.4 99 117 A K G < 5S+ 0 0 142 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.695 103.5 48.3 -66.2 -20.1 38.0 -24.0 26.1 100 118 A A G X 5S- 0 0 52 -3,-1.8 3,-1.9 -4,-0.2 -1,-0.3 -0.107 128.4 -96.4-107.1 31.8 35.1 -21.6 26.6 101 119 A R T < 5S- 0 0 165 -3,-1.7 -3,-0.2 1,-0.3 -12,-0.2 0.767 80.8 -59.1 58.8 27.5 32.6 -23.8 24.8 102 120 A G T 3 - 0 0 41 -2,-0.3 3,-0.7 -72,-0.2 -72,-0.2 -0.583 49.3 -74.0-102.7 177.0 30.1 -4.7 17.2 109 127 A R T 3 S+ 0 0 85 -74,-0.5 -1,-0.1 -2,-0.2 5,-0.0 -0.362 107.8 50.3 -68.0 152.9 30.9 -4.6 13.5 110 128 A G T 3 S+ 0 0 66 2,-0.2 -1,-0.2 -3,-0.1 4,-0.1 0.232 84.6 91.2 109.1 -7.7 34.4 -3.6 12.4 111 129 A Q S < S+ 0 0 107 -3,-0.7 2,-0.2 2,-0.1 -2,-0.1 0.560 84.2 18.6 -97.3 -12.3 36.4 -6.0 14.5 112 130 A M S S- 0 0 54 1,-0.1 -2,-0.2 2,-0.0 2,-0.0 -0.809 93.5 -41.9-152.9-180.0 36.8 -9.1 12.4 113 131 A Q > - 0 0 44 -2,-0.2 4,-2.3 1,-0.1 3,-0.5 -0.321 55.6-127.3 -60.4 134.0 36.8 -11.1 9.1 114 132 A K H > S+ 0 0 111 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.830 101.7 53.0 -64.1 -42.2 33.9 -10.0 7.0 115 133 A P H > S+ 0 0 62 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.888 114.3 45.7 -60.8 -35.8 32.1 -13.3 6.2 116 134 A F H > S+ 0 0 15 -3,-0.5 4,-2.5 2,-0.2 -2,-0.2 0.921 114.7 47.3 -68.6 -46.7 32.1 -14.1 9.9 117 135 A E H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.937 111.8 49.6 -58.5 -49.9 30.9 -10.7 10.9 118 136 A D H X S+ 0 0 57 -4,-3.3 4,-1.1 1,-0.2 -1,-0.2 0.908 113.5 46.3 -59.8 -43.2 28.1 -10.7 8.2 119 137 A A H >X S+ 0 0 0 -4,-1.8 4,-1.3 -5,-0.3 3,-0.6 0.943 111.4 52.2 -63.2 -47.3 26.9 -14.1 9.3 120 138 A S H 3< S+ 0 0 0 -4,-2.5 3,-0.3 1,-0.2 -2,-0.2 0.898 112.7 44.0 -56.9 -44.5 26.9 -13.1 13.0 121 139 A F H 3< S+ 0 0 7 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.647 111.5 53.9 -80.6 -13.4 24.9 -10.0 12.5 122 140 A A H << S+ 0 0 23 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.623 90.6 95.0 -90.9 -17.6 22.4 -11.7 10.2 123 141 A L S < S- 0 0 2 -4,-1.3 2,-0.2 -3,-0.3 3,-0.1 -0.462 73.1-128.5 -72.4 147.4 21.6 -14.4 12.7 124 142 A R > - 0 0 86 -2,-0.1 3,-2.4 1,-0.1 19,-0.3 -0.508 47.1 -74.6 -82.0 161.2 18.6 -14.2 15.0 125 143 A T T 3 S+ 0 0 92 1,-0.3 19,-0.2 -2,-0.2 -1,-0.1 -0.396 124.0 12.3 -59.6 126.8 19.1 -14.8 18.8 126 144 A G T 3 S+ 0 0 55 17,-2.5 -1,-0.3 1,-0.3 2,-0.2 0.317 100.1 129.8 87.1 -7.2 19.6 -18.5 19.3 127 145 A E < - 0 0 29 -3,-2.4 16,-2.4 16,-0.1 2,-0.4 -0.514 46.6-145.2 -85.1 149.4 20.1 -19.2 15.6 128 146 A M B -E 142 0B 31 14,-0.2 14,-0.2 -2,-0.2 -4,-0.1 -0.899 11.3-131.4-114.8 142.2 22.9 -21.2 14.1 129 147 A S - 0 0 3 12,-3.0 -105,-0.2 -2,-0.4 3,-0.1 -0.265 15.4-121.7 -77.8 169.1 24.7 -20.6 10.8 130 148 A G - 0 0 6 -107,-2.6 11,-0.4 1,-0.2 2,-0.2 -0.165 69.8 -40.9 -83.4-164.9 25.5 -23.1 8.1 131 149 A P - 0 0 21 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 -0.478 63.7-163.4 -62.7 126.8 29.2 -23.5 7.1 132 150 A V E -F 139 0B 6 7,-2.4 7,-2.9 -2,-0.2 2,-0.4 -0.979 7.4-145.9-117.6 124.4 30.8 -20.1 7.0 133 151 A F E +F 138 0B 90 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.742 27.8 154.3 -96.9 130.6 34.1 -19.8 5.1 134 152 A T E > -F 137 0B 20 3,-2.7 3,-0.7 -2,-0.4 -2,-0.0 -0.835 60.4 -91.5-134.9 179.5 36.9 -17.5 6.1 135 153 A D T 3 S+ 0 0 114 -2,-0.3 -85,-2.6 1,-0.2 -84,-0.2 0.701 124.8 58.9 -64.2 -19.2 40.7 -17.3 5.8 136 154 A S T 3 S- 0 0 15 1,-0.2 2,-0.3 -87,-0.2 -90,-0.3 0.774 120.1 -94.2 -78.9 -28.2 40.9 -19.1 9.1 137 155 A G E < - F 0 134B 0 -3,-0.7 -3,-2.7 -92,-0.2 2,-0.4 -0.987 63.5 -31.3 148.1-145.5 38.9 -22.2 8.0 138 156 A I E -DF 44 133B 0 -94,-2.3 -94,-2.8 -2,-0.3 2,-0.3 -0.967 58.5-162.5-119.8 132.3 35.2 -23.2 8.1 139 157 A H E -DF 43 132B 7 -7,-2.9 -7,-2.4 -2,-0.4 2,-0.5 -0.851 22.5-155.8-116.9 145.9 33.0 -22.0 11.0 140 158 A I E -D 42 0B 0 -98,-2.0 -98,-2.1 -2,-0.3 2,-0.4 -0.995 29.1-159.6-108.1 126.6 29.6 -22.9 12.5 141 159 A I E -D 41 0B 0 -2,-0.5 -12,-3.0 -11,-0.4 2,-0.5 -0.919 12.0-167.9-114.1 133.0 28.4 -19.8 14.3 142 160 A L E -DE 40 128B 24 -102,-2.8 -102,-2.7 -2,-0.4 2,-0.6 -0.981 14.6-145.4-119.1 119.6 25.8 -19.6 17.1 143 161 A R E +D 39 0B 25 -16,-2.4 -17,-2.5 -2,-0.5 -104,-0.3 -0.769 23.2 171.9 -85.0 119.2 24.4 -16.3 18.1 144 162 A T 0 0 49 -106,-2.3 -105,-0.2 -2,-0.6 -1,-0.2 0.719 360.0 360.0-101.6 -27.7 23.7 -16.3 21.8 145 163 A E 0 0 112 -107,-1.6 -20,-0.1 -20,-0.0 -106,-0.1 0.412 360.0 360.0-141.6 360.0 22.8 -12.7 22.5