==== 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/ISOMERASE INHIBITOR 19-OCT-06 2ITK . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA-INTERACT . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.P.NOEL,Y.ZHANG . 150 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8136.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 58.7 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 19.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.3 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 1.3 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 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 19.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 100 0, 0.0 3,-0.2 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 154.5 51.6 4.1 35.5 2 8 A P > - 0 0 33 0, 0.0 3,-2.2 0, 0.0 121,-0.0 -0.095 360.0 -57.1 -59.1 162.6 51.2 7.1 33.1 3 9 A P T 3 S+ 0 0 102 0, 0.0 19,-0.1 0, 0.0 3,-0.1 -0.154 124.3 8.1 -48.7 122.8 50.3 10.6 34.5 4 10 A G T 3 S+ 0 0 13 1,-0.3 17,-2.4 -3,-0.2 2,-0.2 0.170 94.8 129.7 96.8 -15.9 47.1 10.7 36.5 5 11 A W E < +A 20 0A 21 -3,-2.2 2,-0.3 15,-0.2 -1,-0.3 -0.541 27.9 171.2 -83.9 136.8 46.6 6.9 36.6 6 12 A E E -A 19 0A 91 13,-3.0 13,-2.7 -2,-0.2 2,-0.3 -0.969 33.2-111.5-138.3 154.0 45.9 5.0 39.9 7 13 A K E +A 18 0A 125 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.670 40.9 175.4 -86.5 138.8 44.8 1.4 40.8 8 14 A A E -A 17 0A 21 9,-3.1 9,-2.3 -2,-0.3 2,-0.5 -0.819 27.9-115.4-138.6 177.8 41.3 1.0 42.3 9 15 A M E -A 16 0A 98 -2,-0.3 2,-0.2 7,-0.2 7,-0.2 -0.968 25.9-123.9-125.2 119.7 38.9 -1.7 43.4 10 16 A S > - 0 0 13 5,-2.5 4,-1.7 -2,-0.5 6,-0.0 -0.458 15.1-156.9 -64.3 125.7 35.6 -2.5 41.8 11 17 A R T 4 S+ 0 0 233 -2,-0.2 -1,-0.2 1,-0.2 0, 0.0 0.808 91.5 40.5 -72.3 -30.6 32.8 -2.2 44.4 12 18 A S T 4 S+ 0 0 124 3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.806 132.8 19.2 -88.9 -27.5 30.4 -4.4 42.5 13 19 A S T 4 S- 0 0 63 2,-0.2 -2,-0.2 0, 0.0 3,-0.1 0.627 86.5-130.1-118.4 -20.1 32.9 -7.1 41.3 14 20 A G < + 0 0 44 -4,-1.7 2,-0.2 1,-0.3 -3,-0.1 0.434 61.9 133.5 80.0 -0.9 36.0 -7.0 43.4 15 21 A R - 0 0 136 -6,-0.1 -5,-2.5 1,-0.1 -1,-0.3 -0.587 61.2-108.4 -84.3 146.4 38.3 -6.8 40.3 16 22 A V E +A 9 0A 70 -2,-0.2 2,-0.3 -7,-0.2 -7,-0.2 -0.399 43.6 172.2 -67.5 142.0 41.2 -4.3 40.1 17 23 A Y E -A 8 0A 61 -9,-2.3 -9,-3.1 -2,-0.1 2,-0.4 -0.889 28.3-112.4-141.6-179.6 40.8 -1.4 37.7 18 24 A Y E -AB 7 27A 19 9,-2.9 9,-2.2 -2,-0.3 2,-0.4 -0.953 24.8-174.2-123.2 135.4 42.5 1.8 36.7 19 25 A F E -AB 6 26A 52 -13,-2.7 -13,-3.0 -2,-0.4 2,-0.5 -0.972 14.8-147.8-128.1 141.5 41.3 5.3 37.2 20 26 A N E > -A 5 0A 0 5,-2.6 4,-2.0 -2,-0.4 -15,-0.2 -0.952 1.9-162.5-112.8 118.4 42.8 8.6 36.0 21 27 A H T 4 S+ 0 0 118 -17,-2.4 -16,-0.1 -2,-0.5 -1,-0.1 0.562 89.4 50.1 -81.2 -5.9 42.2 11.5 38.4 22 28 A I T 4 S+ 0 0 53 -18,-0.2 -1,-0.2 -19,-0.1 98,-0.2 0.816 126.0 22.0 -92.1 -41.5 43.1 14.1 35.7 23 29 A T T 4 S- 0 0 1 2,-0.1 108,-2.7 97,-0.1 -2,-0.2 0.574 94.8-130.2-102.0 -11.8 40.9 12.8 32.8 24 30 A N < + 0 0 53 -4,-2.0 -3,-0.1 1,-0.2 2,-0.1 0.627 56.0 151.3 61.9 18.5 38.3 10.9 35.0 25 31 A A - 0 0 10 -5,-0.2 -5,-2.6 106,-0.2 2,-0.3 -0.467 23.5-173.6 -72.6 148.4 38.9 7.9 32.6 26 32 A S E +B 19 0A 49 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.992 11.0 155.5-143.2 147.0 38.4 4.4 34.1 27 33 A Q E -B 18 0A 55 -9,-2.2 -9,-2.9 -2,-0.3 -2,-0.0 -0.984 45.2-126.0-162.8 158.4 39.1 1.0 32.5 28 34 A W S S+ 0 0 102 -2,-0.3 2,-0.1 -11,-0.2 -1,-0.1 0.859 86.6 85.3 -72.9 -37.8 39.9 -2.6 33.4 29 35 A E S S- 0 0 124 1,-0.1 -11,-0.1 -11,-0.1 3,-0.1 -0.409 91.4-105.8 -76.8 137.3 42.9 -2.7 31.3 30 36 A R - 0 0 150 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.470 52.2 -98.4 -61.3 124.5 46.3 -1.6 32.5 31 37 A P 0 0 13 0, 0.0 -1,-0.1 0, 0.0 -26,-0.0 -0.125 360.0 360.0 -57.1 141.9 47.0 1.8 30.8 32 38 A S 0 0 132 -3,-0.1 0, 0.0 -31,-0.1 0, 0.0 0.094 360.0 360.0 -58.7 360.0 49.2 1.7 27.6 33 ! 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 34 51 A E 0 0 151 0, 0.0 89,-0.1 0, 0.0 88,-0.0 0.000 360.0 360.0 360.0 152.9 54.4 15.3 26.9 35 52 A P - 0 0 46 0, 0.0 3,-0.1 0, 0.0 87,-0.0 -0.198 360.0-136.7 -56.4 150.0 53.3 16.6 23.4 36 53 A A S S+ 0 0 87 1,-0.2 74,-0.5 73,-0.1 2,-0.3 0.819 89.7 16.3 -75.8 -37.0 53.7 20.3 22.5 37 54 A R - 0 0 152 72,-0.2 2,-0.3 109,-0.1 72,-0.2 -0.975 66.9-167.3-135.7 149.8 50.2 20.3 20.9 38 55 A V E -C 108 0B 2 70,-2.3 70,-2.6 -2,-0.3 2,-0.5 -0.951 14.3-141.3-129.7 155.9 47.2 18.1 20.9 39 56 A R E +C 107 0B 82 -2,-0.3 106,-2.4 68,-0.3 107,-1.8 -0.984 29.6 174.7-114.8 129.5 44.1 17.9 18.8 40 57 A C E - D 0 144B 0 66,-1.3 65,-2.5 -2,-0.5 66,-0.5 -0.954 24.0-156.1-131.9 151.8 40.8 17.1 20.6 41 58 A S E -CD 104 143B 10 102,-2.8 102,-3.0 -2,-0.3 2,-0.3 -0.833 22.7-169.5-108.4 161.7 37.2 16.8 20.0 42 59 A H E - D 0 142B 0 61,-1.8 2,-0.4 -2,-0.3 100,-0.2 -0.980 24.8-145.4-147.7 162.5 34.6 17.2 22.7 43 60 A L E - D 0 141B 0 98,-2.3 98,-2.2 -2,-0.3 2,-0.5 -0.996 25.9-161.0-124.7 119.9 31.0 16.8 23.6 44 61 A L E - D 0 140B 0 -2,-0.4 51,-3.4 96,-0.2 2,-0.6 -0.883 12.2-169.2-106.8 130.9 29.7 19.5 26.0 45 62 A V E - D 0 139B 2 94,-2.8 94,-2.4 -2,-0.5 2,-0.1 -0.973 17.9-156.8-114.6 114.3 26.6 19.3 28.2 46 63 A K - 0 0 1 -2,-0.6 2,-0.3 92,-0.2 92,-0.2 -0.420 9.5-169.0 -82.5 165.2 25.8 22.6 29.7 47 64 A H > - 0 0 8 90,-0.3 3,-2.1 -2,-0.1 17,-0.2 -0.873 42.7 -83.1-144.1 178.8 23.7 23.2 32.9 48 65 A S T 3 S+ 0 0 63 15,-2.9 16,-0.1 1,-0.3 13,-0.0 0.700 126.8 49.9 -61.3 -22.5 22.0 26.0 34.8 49 66 A Q T 3 S+ 0 0 141 3,-0.1 -1,-0.3 4,-0.0 89,-0.1 0.376 82.3 120.8 -96.4 1.8 25.3 26.9 36.6 50 67 A S S < S- 0 0 6 -3,-2.1 87,-0.2 1,-0.1 88,-0.1 -0.349 78.7-115.1 -60.6 149.1 27.3 27.0 33.3 51 68 A R S S+ 0 0 148 85,-2.6 86,-0.1 1,-0.3 -1,-0.1 0.801 112.7 25.0 -59.7 -28.4 28.9 30.4 32.7 52 69 A R S S- 0 0 103 85,-0.2 2,-2.7 84,-0.2 -1,-0.3 -0.781 75.9-163.5-136.4 87.4 26.6 30.8 29.7 53 70 A P + 0 0 48 0, 0.0 8,-2.7 0, 0.0 2,-0.3 -0.301 63.3 82.9 -72.5 60.8 23.5 28.7 30.1 54 71 A S + 0 0 27 -2,-2.7 2,-0.3 6,-0.2 5,-0.2 -0.973 47.7 161.8-158.0 148.3 22.6 28.9 26.4 55 72 A S - 0 0 13 3,-1.9 3,-0.4 -2,-0.3 41,-0.1 -0.943 56.8 -84.9-156.2 178.9 23.7 27.0 23.2 56 73 A W S S+ 0 0 116 -2,-0.3 3,-0.1 1,-0.2 39,-0.1 0.721 125.2 57.1 -59.9 -23.1 22.6 26.3 19.6 57 74 A R S S+ 0 0 93 1,-0.3 2,-0.3 37,-0.1 -1,-0.2 0.829 123.2 3.4 -79.5 -36.8 20.5 23.5 21.0 58 75 A Q - 0 0 65 -3,-0.4 -3,-1.9 1,-0.1 -1,-0.3 -0.947 56.8-142.4-158.8 133.7 18.4 25.5 23.4 59 76 A E S S+ 0 0 175 -2,-0.3 2,-0.5 1,-0.2 -1,-0.1 0.869 97.5 32.9 -67.5 -39.2 18.2 29.2 24.2 60 77 A K S S- 0 0 152 -6,-0.1 2,-0.7 0, 0.0 -1,-0.2 -0.949 75.7-157.2-122.1 106.9 17.7 28.8 27.9 61 78 A I + 0 0 2 -8,-2.7 -11,-0.1 -2,-0.5 -14,-0.1 -0.777 21.9 164.8 -87.9 118.8 19.4 25.8 29.4 62 79 A T + 0 0 91 -2,-0.7 -1,-0.1 -16,-0.1 -14,-0.1 0.462 29.3 119.3-114.2 -9.3 17.7 24.9 32.7 63 80 A R - 0 0 39 -17,-0.1 -15,-2.9 1,-0.1 2,-0.1 -0.295 64.1-116.2 -63.4 146.3 19.0 21.4 33.4 64 81 A T > - 0 0 51 -17,-0.2 4,-2.5 -16,-0.1 5,-0.2 -0.357 22.8-109.0 -75.6 162.6 20.8 21.0 36.7 65 82 A K H > S+ 0 0 71 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.901 122.2 54.2 -54.9 -43.8 24.5 20.0 37.0 66 83 A E H > S+ 0 0 119 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.912 109.1 47.1 -57.6 -44.0 23.3 16.6 38.3 67 84 A E H > S+ 0 0 98 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.886 110.6 52.7 -66.2 -39.7 21.1 16.1 35.2 68 85 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.895 107.9 51.4 -60.2 -41.5 23.9 17.1 32.9 69 86 A L H X S+ 0 0 52 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.901 107.3 52.6 -67.7 -37.8 26.2 14.6 34.6 70 87 A E H X S+ 0 0 132 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.914 110.0 48.6 -61.7 -41.8 23.6 11.8 34.0 71 88 A L H X S+ 0 0 63 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.940 111.9 49.0 -62.9 -47.8 23.4 12.7 30.3 72 89 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.920 110.4 50.9 -55.4 -47.5 27.2 12.7 30.1 73 90 A N H X S+ 0 0 71 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.899 109.9 50.7 -61.7 -37.8 27.4 9.3 31.8 74 91 A G H X S+ 0 0 15 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.893 109.6 49.3 -64.5 -42.7 24.8 7.9 29.4 75 92 A Y H X S+ 0 0 15 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.920 109.8 51.8 -66.0 -41.9 26.7 9.1 26.4 76 93 A I H X S+ 0 0 20 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.922 109.0 51.5 -56.8 -43.5 29.9 7.6 27.7 77 94 A Q H X S+ 0 0 139 -4,-2.2 4,-2.1 1,-0.2 6,-0.3 0.931 111.4 45.7 -60.5 -47.5 28.0 4.3 28.1 78 95 A K H X>S+ 0 0 76 -4,-2.3 6,-1.9 1,-0.2 5,-1.0 0.869 114.4 49.1 -66.4 -35.2 26.7 4.3 24.6 79 96 A I H ><5S+ 0 0 30 -4,-2.5 3,-0.7 -5,-0.2 -2,-0.2 0.936 112.6 46.9 -66.7 -46.1 30.2 5.2 23.2 80 97 A K H 3<5S+ 0 0 125 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.821 112.6 49.5 -68.9 -32.1 31.9 2.5 25.2 81 98 A S H 3<5S- 0 0 68 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.604 110.0-121.4 -78.6 -13.1 29.4 -0.1 24.2 82 99 A G T <<5S+ 0 0 54 -4,-0.7 -3,-0.2 -3,-0.7 -4,-0.1 0.479 80.9 120.8 82.6 2.7 29.7 0.8 20.5 83 100 A E S - 0 0 99 -2,-0.3 4,-2.4 1,-0.1 3,-0.2 -0.727 21.4-126.6 -87.7 144.8 29.9 6.9 17.9 86 103 A F H > S+ 0 0 9 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.903 110.6 52.6 -50.3 -48.9 31.4 9.8 19.8 87 104 A E H > S+ 0 0 59 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.863 108.9 48.6 -60.6 -39.8 31.3 11.9 16.6 88 105 A S H > S+ 0 0 41 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.905 112.9 46.9 -69.0 -43.5 27.6 11.3 16.1 89 106 A L H X S+ 0 0 2 -4,-2.4 4,-2.7 2,-0.2 5,-0.4 0.883 111.6 51.8 -65.4 -39.0 26.7 12.1 19.7 90 107 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 -5,-0.2 6,-0.2 0.945 109.7 49.7 -62.8 -44.5 28.8 15.3 19.6 91 108 A S H < S+ 0 0 43 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.868 120.9 34.9 -62.5 -35.5 27.0 16.4 16.4 92 109 A Q H < S+ 0 0 86 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.832 132.7 19.5 -86.0 -35.9 23.6 15.8 17.8 93 110 A F H < S+ 0 0 54 -4,-2.7 2,-0.3 -5,-0.2 -3,-0.2 0.472 81.0 117.3-127.0 -5.8 24.0 16.7 21.5 94 111 A S < - 0 0 0 -4,-2.0 2,-0.2 -5,-0.4 -49,-0.2 -0.550 53.2-146.0 -74.3 131.2 27.0 18.9 22.2 95 112 A D S S+ 0 0 0 -51,-3.4 2,-0.3 -2,-0.3 -41,-0.1 -0.104 75.4 89.2 -83.3 33.2 26.1 22.3 23.6 96 113 A C S > S- 0 0 5 -2,-0.2 3,-2.1 -6,-0.2 4,-0.2 -0.958 84.5-125.4-128.2 144.8 29.1 23.8 21.7 97 114 A S G > S+ 0 0 85 -2,-0.3 3,-1.7 1,-0.3 4,-0.2 0.721 106.1 78.8 -62.6 -19.6 29.1 25.2 18.2 98 115 A S G > >S+ 0 0 13 1,-0.3 5,-2.2 2,-0.2 3,-2.0 0.645 70.1 86.8 -60.8 -14.1 32.0 22.7 17.6 99 116 A A G X 5S+ 0 0 0 -3,-2.1 3,-1.6 1,-0.3 -1,-0.3 0.844 78.4 63.3 -49.1 -37.4 29.1 20.2 17.3 100 117 A K G < 5S+ 0 0 144 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.643 103.1 47.7 -66.6 -17.5 28.9 21.2 13.6 101 118 A A G X 5S- 0 0 51 -3,-2.0 3,-2.2 -4,-0.2 -1,-0.3 -0.213 129.0 -95.5-111.1 34.0 32.4 19.8 13.1 102 119 A R T < 5S- 0 0 143 -3,-1.6 -3,-0.2 1,-0.3 -12,-0.2 0.774 81.6 -58.1 57.8 28.1 31.6 16.5 15.0 103 120 A G T 3 - 0 0 41 -2,-0.3 3,-0.5 -72,-0.2 4,-0.3 -0.597 45.5 -72.4-107.6 174.6 48.9 24.0 23.1 110 127 A R T 3 S+ 0 0 88 -74,-0.5 -1,-0.1 1,-0.2 5,-0.0 -0.390 114.6 45.5 -63.6 148.6 49.0 24.5 26.9 111 128 A G T 3 S+ 0 0 44 2,-0.2 -1,-0.2 -3,-0.1 3,-0.1 0.696 97.3 77.5 88.1 22.7 47.9 28.0 28.0 112 129 A Q S < S+ 0 0 65 -3,-0.5 40,-3.4 1,-0.1 2,-0.2 0.640 80.3 57.9-125.3 -37.4 44.9 28.3 25.7 113 130 A M B S-G 151 0C 0 -4,-0.3 38,-0.3 38,-0.3 -2,-0.2 -0.576 96.2 -80.2-100.0 158.9 42.0 26.2 27.2 114 131 A Q >> - 0 0 17 36,-3.9 4,-2.4 -2,-0.2 3,-0.7 -0.352 57.1-110.9 -50.4 138.5 40.1 26.3 30.5 115 132 A K H 3> S+ 0 0 113 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.801 111.9 48.6 -58.0 -45.7 42.4 24.5 32.9 116 133 A P H 3> S+ 0 0 58 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.890 114.9 49.6 -61.5 -34.7 40.5 21.3 33.7 117 134 A F H <> S+ 0 0 0 -3,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.930 111.8 47.1 -67.9 -47.2 40.0 20.9 29.9 118 135 A E H X S+ 0 0 10 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.939 112.3 49.1 -54.4 -50.9 43.7 21.4 29.1 119 136 A D H X S+ 0 0 49 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.909 113.0 46.7 -62.0 -43.8 44.9 19.1 31.8 120 137 A A H >X S+ 0 0 0 -4,-2.0 4,-1.3 -5,-0.2 3,-0.6 0.946 111.9 51.7 -60.5 -46.5 42.6 16.3 30.7 121 138 A S H 3< S+ 0 0 0 -4,-2.5 3,-0.3 1,-0.3 -2,-0.2 0.881 112.1 44.8 -60.8 -42.1 43.5 16.8 27.0 122 139 A F H 3< S+ 0 0 10 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.662 110.4 54.8 -78.1 -16.4 47.2 16.6 27.6 123 140 A A H << S+ 0 0 18 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.637 92.3 88.3 -90.6 -16.6 46.9 13.5 29.9 124 141 A L S < S- 0 0 3 -4,-1.3 2,-0.2 -3,-0.3 3,-0.1 -0.539 75.8-133.5 -72.3 144.7 45.0 11.6 27.3 125 142 A R > - 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0 0 54 1,-0.2 -53,-0.0 3,-0.1 -97,-0.0 -0.400 360.0 -9.9 47.0-115.1 33.3 27.9 24.6 150 503 B X T 3 S+ 0 0 2 -2,-0.1 -36,-3.9 -36,-0.0 -1,-0.2 0.164 102.0 120.1 -94.7 19.0 36.3 26.2 26.5 151 504 B X B < G 113 0C 97 -3,-1.3 -38,-0.3 -38,-0.3 -39,-0.1 -0.680 360.0 360.0 -73.8 131.5 39.0 28.7 25.4 152 505 B Q 0 0 177 -40,-3.4 -39,-0.1 -2,-0.2 -1,-0.1 0.814 360.0 360.0 -53.5 360.0 40.8 30.6 28.5