==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 25-AUG-10 2XP6 . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA-INTERACT . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.POTTER,V.OLDFIELD,C.NUNNS,C.FROMONT,S.RAY,C.J.NORTHFIELD, . 145 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8247.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 85 58.6 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 . 28 19.3 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 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 20.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 1 1 1 1 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 88 0, 0.0 3,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 146.2 -17.0 4.0 35.3 2 8 A P > - 0 0 30 0, 0.0 3,-2.2 0, 0.0 121,-0.0 -0.076 360.0 -52.3 -75.3 171.1 -17.2 7.2 33.2 3 9 A P T 3 S+ 0 0 99 0, 0.0 19,-0.1 0, 0.0 3,-0.1 -0.041 123.8 5.9 -44.7 127.9 -18.2 10.7 34.5 4 10 A G T 3 S+ 0 0 10 1,-0.2 17,-2.6 -3,-0.1 2,-0.3 0.124 97.0 126.2 94.3 -20.8 -21.5 10.7 36.4 5 11 A W E < +A 20 0A 6 -3,-2.2 2,-0.3 15,-0.3 15,-0.3 -0.548 29.5 168.4 -81.9 132.7 -22.1 6.9 36.5 6 12 A E E -A 19 0A 111 13,-3.4 13,-2.6 -2,-0.3 2,-0.3 -0.982 33.6-111.3-140.8 156.4 -22.7 5.0 39.7 7 13 A K E +A 18 0A 118 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.653 37.8 175.2 -84.5 138.3 -23.8 1.5 40.7 8 14 A A E -A 17 0A 28 9,-2.7 9,-2.3 -2,-0.3 2,-0.5 -0.899 29.4-115.4-132.2 167.4 -27.1 1.0 42.4 9 15 A M E -A 16 0A 116 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.912 28.7-124.7-101.7 134.9 -29.4 -1.8 43.6 10 16 A S > - 0 0 19 5,-2.9 4,-1.6 -2,-0.5 6,-0.0 -0.552 13.9-156.9 -74.0 131.9 -32.7 -2.4 42.0 11 17 A R T 4 S+ 0 0 244 -2,-0.3 -1,-0.2 2,-0.2 -2,-0.0 0.807 91.4 43.3 -89.4 -18.4 -35.4 -2.4 44.6 12 18 A S T 4 S+ 0 0 124 3,-0.1 -1,-0.1 1,-0.1 -2,-0.0 0.958 130.6 20.3 -77.4 -46.3 -37.9 -4.4 42.6 13 19 A S T 4 S- 0 0 58 2,-0.2 -2,-0.2 1,-0.0 3,-0.1 0.676 86.6-129.4-105.2 -25.1 -35.5 -7.0 41.3 14 20 A G < + 0 0 47 -4,-1.6 2,-0.2 1,-0.3 -3,-0.1 0.253 66.6 127.6 83.4 -14.5 -32.4 -7.1 43.5 15 21 A R - 0 0 140 -6,-0.1 -5,-2.9 1,-0.1 -1,-0.3 -0.503 64.4-114.0 -74.2 145.3 -30.1 -6.8 40.5 16 22 A V E +A 9 0A 64 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.444 40.5 174.7 -66.3 148.1 -27.4 -4.1 40.3 17 23 A Y E -A 8 0A 66 -9,-2.3 -9,-2.7 -2,-0.1 2,-0.4 -0.865 28.0-110.2-142.6-179.5 -27.9 -1.4 37.6 18 24 A Y E -AB 7 27A 19 9,-3.1 9,-2.2 -2,-0.3 2,-0.3 -0.952 26.5-174.4-121.2 139.9 -26.1 1.8 36.7 19 25 A F E -AB 6 26A 68 -13,-2.6 -13,-3.4 -2,-0.4 2,-0.5 -0.936 15.6-146.1-126.1 149.8 -27.4 5.4 37.1 20 26 A N E > -A 5 0A 0 5,-2.5 4,-1.7 -2,-0.3 -15,-0.3 -0.982 2.4-161.8-121.1 120.1 -25.8 8.7 36.0 21 27 A H T 4 S+ 0 0 108 -17,-2.6 -16,-0.1 -2,-0.5 -1,-0.1 0.633 90.1 51.9 -83.4 -6.2 -26.5 11.6 38.3 22 28 A I T 4 S+ 0 0 56 -18,-0.2 -1,-0.2 -19,-0.1 98,-0.2 0.883 125.0 20.9 -91.2 -41.3 -25.6 14.1 35.6 23 29 A T T 4 S- 0 0 1 2,-0.1 108,-2.9 97,-0.1 119,-0.2 0.459 94.9-128.4-107.5 -2.5 -27.8 12.9 32.8 24 30 A N < + 0 0 56 -4,-1.7 2,-0.2 1,-0.2 -3,-0.1 0.643 57.2 150.8 54.4 19.9 -30.4 10.9 35.0 25 31 A A - 0 0 12 -5,-0.2 -5,-2.5 106,-0.2 2,-0.3 -0.486 23.5-174.4 -70.7 150.2 -29.8 7.9 32.6 26 32 A S E +B 19 0A 50 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.985 11.2 154.2-150.5 138.9 -30.3 4.5 34.1 27 33 A Q E -B 18 0A 52 -9,-2.2 -9,-3.1 -2,-0.3 -2,-0.0 -0.973 45.3-125.3-156.0 162.4 -29.7 1.0 32.6 28 34 A W S S+ 0 0 107 -2,-0.3 -1,-0.1 -11,-0.2 2,-0.1 0.856 87.4 85.6 -76.8 -40.8 -28.8 -2.6 33.6 29 35 A E S S- 0 0 129 1,-0.1 -11,-0.2 -11,-0.1 -2,-0.1 -0.336 89.5-108.7 -67.1 140.3 -25.8 -2.8 31.3 30 36 A R - 0 0 148 1,-0.1 2,-0.4 -2,-0.1 -1,-0.1 -0.552 54.2 -83.6 -66.8 130.2 -22.4 -1.6 32.6 31 37 A P 0 0 9 0, 0.0 -1,-0.1 0, 0.0 -26,-0.0 -0.590 360.0 360.0 -67.9 128.5 -21.4 1.7 30.9 32 38 A S 0 0 112 -2,-0.4 -2,-0.1 -31,-0.1 0, 0.0 0.510 360.0 360.0-165.5 360.0 -20.0 2.2 28.3 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 0 164 0, 0.0 89,-0.1 0, 0.0 88,-0.0 0.000 360.0 360.0 360.0 123.4 -14.3 15.3 26.8 35 52 A P - 0 0 49 0, 0.0 3,-0.1 0, 0.0 87,-0.0 -0.210 360.0-133.9 -59.8 155.0 -15.3 16.7 23.3 36 53 A A S S+ 0 0 84 1,-0.2 74,-0.6 73,-0.1 2,-0.3 0.790 90.6 17.0 -80.6 -38.2 -15.1 20.5 22.5 37 54 A R E -C 109 0B 133 72,-0.2 2,-0.3 70,-0.0 -1,-0.2 -0.971 69.4-167.4-129.3 150.1 -18.5 20.6 20.8 38 55 A V E -C 108 0B 2 70,-2.2 70,-2.1 -2,-0.3 2,-0.4 -0.950 14.5-138.8-127.4 158.6 -21.3 18.1 20.9 39 56 A R E +C 107 0B 82 107,-2.5 106,-2.4 -2,-0.3 107,-1.6 -0.979 30.9 168.0-115.1 132.5 -24.5 17.8 18.8 40 57 A C E - D 0 144B 0 66,-1.2 65,-2.5 -2,-0.4 66,-0.3 -0.949 26.0-153.3-138.2 156.2 -27.8 17.0 20.5 41 58 A S E -CD 104 143B 10 102,-2.2 102,-3.0 -2,-0.3 2,-0.3 -0.808 23.1-171.3-112.8 162.0 -31.6 16.8 19.9 42 59 A H E - D 0 142B 8 61,-2.0 2,-0.5 -2,-0.3 100,-0.2 -0.972 23.5-140.3-146.8 169.6 -34.0 17.2 22.7 43 60 A L E - D 0 141B 0 98,-2.0 98,-1.4 -2,-0.3 2,-0.4 -0.985 24.3-158.3-130.8 126.4 -37.7 16.9 23.5 44 61 A L E - D 0 140B 8 -2,-0.5 51,-2.8 96,-0.2 2,-0.6 -0.854 13.2-171.2-110.7 133.1 -39.0 19.5 25.9 45 62 A V E - D 0 139B 2 94,-2.7 94,-3.0 -2,-0.4 2,-0.1 -0.984 18.2-159.4-119.9 114.9 -42.1 19.3 28.0 46 63 A K - 0 0 26 -2,-0.6 2,-0.3 92,-0.2 92,-0.2 -0.453 8.1-166.6 -84.3 163.4 -42.9 22.7 29.6 47 64 A H > - 0 0 8 90,-0.3 3,-2.4 -2,-0.1 17,-0.2 -0.891 42.8 -81.6-142.5 177.3 -45.1 23.1 32.7 48 65 A S T 3 S+ 0 0 60 15,-3.5 16,-0.1 1,-0.3 15,-0.1 0.749 127.8 50.8 -55.5 -27.1 -46.9 25.9 34.6 49 66 A Q T 3 S+ 0 0 141 14,-0.2 -1,-0.3 3,-0.1 89,-0.1 0.404 81.0 120.9 -93.8 1.9 -43.6 26.8 36.3 50 67 A S S < S- 0 0 7 -3,-2.4 87,-0.2 1,-0.1 88,-0.1 -0.243 80.2-108.4 -55.0 150.3 -41.4 27.1 33.1 51 68 A R S S+ 0 0 145 85,-2.7 86,-0.1 1,-0.3 -1,-0.1 0.895 116.2 20.2 -52.8 -40.6 -39.7 30.5 32.5 52 69 A R S S- 0 0 141 85,-0.2 2,-2.6 84,-0.2 -1,-0.3 -0.837 74.5-159.6-132.2 106.4 -42.3 30.9 29.7 53 70 A P + 0 0 53 0, 0.0 8,-3.1 0, 0.0 2,-0.3 -0.292 63.2 91.2 -81.4 61.7 -45.3 28.7 30.0 54 71 A S + 0 0 55 -2,-2.6 2,-0.3 6,-0.2 5,-0.2 -0.982 45.7 164.4-149.7 146.4 -46.2 29.0 26.3 55 72 A S - 0 0 20 3,-2.5 3,-0.4 -2,-0.3 41,-0.1 -0.986 53.0 -94.5-156.3 173.2 -45.3 27.1 23.1 56 73 A W S S+ 0 0 115 -2,-0.3 3,-0.1 39,-0.3 39,-0.1 0.806 124.4 50.8 -56.8 -30.3 -46.1 26.4 19.5 57 74 A R S S+ 0 0 89 1,-0.3 2,-0.3 37,-0.1 -1,-0.2 0.830 125.6 12.8 -75.9 -33.6 -48.3 23.4 20.7 58 75 A Q - 0 0 73 -3,-0.4 -3,-2.5 1,-0.1 -1,-0.3 -0.978 58.4-147.2-155.1 124.2 -50.3 25.4 23.3 59 76 A E S S+ 0 0 181 -2,-0.3 2,-0.5 1,-0.3 -1,-0.1 0.903 97.2 30.5 -63.5 -38.4 -50.7 29.2 23.9 60 77 A K S S- 0 0 147 -6,-0.1 2,-0.7 -5,-0.0 -1,-0.3 -0.952 78.7-149.3-128.0 112.1 -51.0 28.7 27.7 61 78 A I + 0 0 3 -8,-3.1 -14,-0.1 -2,-0.5 -11,-0.1 -0.742 25.3 165.6 -85.1 116.7 -49.2 25.8 29.2 62 79 A T + 0 0 90 -2,-0.7 -14,-0.2 -16,-0.1 -1,-0.2 0.631 31.7 113.8-103.5 -22.6 -51.2 24.7 32.3 63 80 A R - 0 0 35 -16,-0.1 -15,-3.5 -17,-0.1 -14,-0.2 -0.150 66.9-115.7 -53.6 145.5 -49.8 21.2 33.2 64 81 A T > - 0 0 58 -17,-0.2 4,-2.7 -16,-0.1 5,-0.2 -0.460 24.9-107.0 -75.2 152.3 -48.0 20.9 36.5 65 82 A K H > S+ 0 0 91 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.838 122.8 49.4 -38.5 -41.8 -44.3 20.1 36.8 66 83 A E H > S+ 0 0 156 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.893 108.0 50.6 -78.5 -36.7 -45.2 16.7 38.1 67 84 A E H > S+ 0 0 106 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.908 110.0 53.8 -60.5 -40.4 -47.7 16.0 35.2 68 85 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.863 105.9 51.3 -58.8 -42.5 -44.8 17.1 32.9 69 86 A L H X S+ 0 0 49 -4,-1.8 4,-3.0 -5,-0.2 -1,-0.2 0.918 106.9 54.9 -64.5 -39.4 -42.5 14.5 34.5 70 87 A E H X S+ 0 0 129 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.917 108.6 47.3 -58.4 -43.5 -45.2 11.9 33.9 71 88 A L H X S+ 0 0 63 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.923 112.5 49.6 -59.9 -50.9 -45.3 12.7 30.1 72 89 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.917 109.9 50.6 -52.0 -49.4 -41.4 12.6 29.9 73 90 A N H X S+ 0 0 50 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.932 110.5 50.6 -59.5 -44.9 -41.3 9.2 31.7 74 91 A G H X S+ 0 0 19 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.887 111.0 47.9 -57.0 -45.0 -44.0 7.9 29.2 75 92 A Y H X S+ 0 0 24 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.902 109.9 52.2 -64.4 -39.1 -41.9 9.1 26.2 76 93 A I H X S+ 0 0 22 -4,-2.6 4,-3.3 1,-0.2 5,-0.3 0.944 109.1 51.7 -65.1 -47.8 -38.8 7.6 27.6 77 94 A Q H X S+ 0 0 137 -4,-2.6 4,-2.1 1,-0.2 6,-0.3 0.927 111.1 45.9 -48.6 -48.4 -40.7 4.3 28.0 78 95 A K H X>S+ 0 0 82 -4,-2.1 6,-1.7 2,-0.2 4,-0.9 0.871 114.2 48.4 -71.7 -32.1 -41.8 4.3 24.4 79 96 A I H <5S+ 0 0 33 -4,-2.6 3,-0.4 1,-0.2 -2,-0.2 0.942 113.9 45.9 -69.0 -46.9 -38.4 5.2 23.1 80 97 A K H <5S+ 0 0 130 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.804 113.8 48.6 -66.3 -31.1 -36.7 2.5 25.2 81 98 A S H <5S- 0 0 81 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.641 110.2-121.6 -82.4 -17.3 -39.3 -0.2 24.2 82 99 A G T <5S+ 0 0 62 -4,-0.9 -3,-0.2 -3,-0.4 -4,-0.1 0.452 78.8 124.6 88.8 3.9 -38.9 0.8 20.5 83 100 A E S - 0 0 96 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.662 23.7-115.4 -96.6 159.1 -38.6 6.8 18.1 86 103 A F H > S+ 0 0 8 -2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.923 112.6 52.4 -51.0 -53.3 -37.1 9.8 19.7 87 104 A E H > S+ 0 0 73 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.819 109.4 48.9 -53.9 -44.3 -37.5 12.0 16.4 88 105 A S H > S+ 0 0 35 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.899 112.9 45.8 -64.5 -45.1 -41.1 11.2 16.0 89 106 A L H X S+ 0 0 5 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.867 113.4 50.9 -67.7 -36.7 -42.1 12.0 19.6 90 107 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.912 109.8 49.5 -65.9 -44.4 -40.0 15.2 19.5 91 108 A S H < S+ 0 0 41 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.880 121.5 35.3 -61.5 -42.2 -41.7 16.4 16.3 92 109 A Q H < S+ 0 0 90 -4,-1.9 -2,-0.2 -5,-0.1 -1,-0.2 0.801 132.9 19.4 -81.1 -31.5 -45.1 15.7 17.7 93 110 A F H < S+ 0 0 58 -4,-2.5 2,-0.3 -5,-0.1 -3,-0.2 0.485 81.1 114.7-127.9 -14.5 -44.7 16.7 21.4 94 111 A S < - 0 0 0 -4,-1.9 -49,-0.2 -5,-0.3 5,-0.1 -0.550 50.6-151.4 -65.6 130.5 -41.7 18.9 22.1 95 112 A D S S+ 0 0 5 -51,-2.8 2,-0.3 -2,-0.3 -39,-0.3 0.205 73.6 96.8 -81.7 3.2 -42.7 22.4 23.4 96 113 A C S > S- 0 0 26 -52,-0.2 3,-2.5 -6,-0.2 4,-0.2 -0.812 82.8-130.1 -89.6 142.7 -39.4 23.6 21.8 97 114 A S G > S+ 0 0 96 -2,-0.3 3,-2.0 1,-0.3 4,-0.2 0.792 105.6 79.2 -61.5 -22.6 -39.5 25.2 18.2 98 115 A S G > > + 0 0 15 1,-0.3 5,-2.1 2,-0.2 3,-2.0 0.652 69.1 86.8 -53.4 -15.5 -36.6 22.7 17.5 99 116 A A G X 5S+ 0 0 1 -3,-2.5 3,-1.7 1,-0.3 -1,-0.3 0.855 77.6 64.8 -51.8 -35.3 -39.6 20.1 17.3 100 117 A K G < 5S+ 0 0 137 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.681 103.4 44.9 -65.7 -17.7 -39.8 21.2 13.6 101 118 A A G X 5S- 0 0 54 -3,-2.0 3,-2.0 -4,-0.2 -1,-0.3 -0.267 131.1 -92.5-113.3 34.4 -36.3 19.7 13.0 102 119 A R T < 5S- 0 0 168 -3,-1.7 -3,-0.2 1,-0.3 -11,-0.2 0.796 81.6 -59.0 58.9 32.7 -37.1 16.5 14.9 103 120 A G T 3 -C 37 0B 36 -2,-0.3 3,-0.9 -72,-0.2 4,-0.4 -0.688 43.7 -72.9-115.5 174.6 -19.9 24.1 23.1 110 127 A R T 3 S+ 0 0 87 -74,-0.6 -1,-0.1 -2,-0.2 5,-0.0 -0.410 115.1 46.7 -62.4 149.2 -19.8 24.7 26.8 111 128 A G T 3 S+ 0 0 67 2,-0.2 -1,-0.2 -3,-0.1 4,-0.1 0.450 97.7 76.4 96.6 5.0 -20.9 28.1 27.8 112 129 A Q S < S+ 0 0 106 -3,-0.9 2,-0.2 2,-0.1 -2,-0.1 0.750 82.2 52.6-114.0 -40.8 -24.0 28.2 25.5 113 130 A M S S- 0 0 55 -4,-0.4 -2,-0.2 1,-0.1 2,-0.0 -0.555 98.3 -77.4 -96.9 161.4 -26.9 26.2 27.1 114 131 A A > - 0 0 52 -2,-0.2 4,-3.1 1,-0.1 5,-0.2 -0.356 53.5-114.3 -48.9 134.1 -28.5 26.2 30.5 115 132 A K H > S+ 0 0 122 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.883 112.2 52.5 -53.3 -47.8 -26.1 24.4 32.8 116 133 A P H > S+ 0 0 64 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.961 116.7 42.9 -55.6 -43.4 -28.1 21.3 33.7 117 134 A F H > S+ 0 0 7 -3,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.904 114.8 49.5 -59.0 -51.4 -28.7 20.7 29.9 118 135 A E H X S+ 0 0 2 -4,-3.1 4,-2.8 2,-0.2 5,-0.2 0.935 112.0 46.8 -58.5 -47.2 -25.1 21.5 29.0 119 136 A D H X S+ 0 0 60 -4,-3.2 4,-1.4 -5,-0.2 -2,-0.2 0.930 113.9 48.6 -64.7 -41.3 -23.7 19.1 31.7 120 137 A A H X S+ 0 0 0 -4,-2.5 4,-1.2 -5,-0.3 3,-0.5 0.947 112.0 49.8 -58.7 -46.8 -26.1 16.4 30.6 121 138 A S H >< S+ 0 0 0 -4,-2.8 3,-0.6 1,-0.2 -2,-0.2 0.918 112.2 46.4 -63.6 -46.4 -25.2 16.8 26.9 122 139 A F H 3< S+ 0 0 11 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.697 109.7 53.5 -69.9 -20.8 -21.4 16.7 27.6 123 140 A A H 3< S+ 0 0 14 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.641 93.3 88.3 -88.6 -15.9 -21.7 13.6 29.9 124 141 A L S << S- 0 0 3 -4,-1.2 2,-0.2 -3,-0.6 3,-0.1 -0.530 74.1-135.7 -74.6 147.9 -23.6 11.6 27.2 125 142 A R > - 0 0 65 -2,-0.2 3,-2.6 1,-0.1 19,-0.3 -0.651 45.8 -70.4 -94.2 161.1 -21.6 9.6 24.7 126 143 A T T 3 S+ 0 0 84 1,-0.3 19,-0.2 -2,-0.2 -1,-0.1 -0.262 125.7 18.5 -50.1 129.4 -22.6 9.7 21.0 127 144 A G T 3 S+ 0 0 55 17,-3.0 -1,-0.3 1,-0.3 18,-0.1 0.160 98.5 126.0 93.7 -17.0 -25.8 7.8 20.5 128 145 A E < - 0 0 41 -3,-2.6 16,-2.9 15,-0.1 2,-0.4 -0.390 47.7-147.2 -84.4 148.4 -26.8 8.0 24.3 129 146 A M B -E 143 0B 36 14,-0.2 14,-0.2 -2,-0.1 2,-0.1 -0.918 10.0-136.5-115.4 140.2 -30.0 9.3 25.6 130 147 A S - 0 0 2 12,-2.8 -106,-0.2 -2,-0.4 3,-0.1 -0.328 14.9-124.1 -79.0 166.1 -30.5 11.2 28.9 131 148 A G - 0 0 5 -108,-2.9 11,-0.4 1,-0.2 -106,-0.2 -0.167 67.6 -37.8 -81.5-163.2 -33.2 10.7 31.5 132 149 A P - 0 0 19 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.436 63.2-167.4 -58.5 127.9 -35.4 13.7 32.6 133 150 A V E -F 140 0B 5 7,-2.2 7,-3.0 -2,-0.1 2,-0.4 -0.998 9.3-145.4-126.9 122.3 -33.2 16.7 32.8 134 151 A F E +F 139 0B 85 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.747 29.0 154.3 -96.8 129.0 -34.8 19.8 34.6 135 152 A T E > -F 138 0B 16 3,-2.8 3,-0.6 -2,-0.4 -2,-0.0 -0.899 60.9 -93.5-132.9 177.0 -34.0 23.4 33.5 136 153 A D T 3 S+ 0 0 117 -2,-0.3 -85,-2.7 1,-0.2 -84,-0.2 0.729 123.5 62.8 -60.5 -20.4 -36.0 26.6 33.9 137 154 A S T 3 S- 0 0 33 1,-0.2 -90,-0.3 -87,-0.2 2,-0.3 0.891 119.9 -95.1 -68.0 -40.5 -37.4 25.9 30.4 138 155 A G E < - F 0 135B 0 -3,-0.6 -3,-2.8 -92,-0.2 2,-0.5 -0.954 62.3 -32.7 157.6-143.0 -39.1 22.7 31.5 139 156 A I E -DF 45 134B 0 -94,-3.0 -94,-2.7 -2,-0.3 2,-0.3 -0.957 58.8-163.7-119.8 127.7 -38.1 19.0 31.5 140 157 A H E -DF 44 133B 8 -7,-3.0 -7,-2.2 -2,-0.5 2,-0.4 -0.781 22.7-157.5-110.3 151.1 -35.9 17.6 28.7 141 158 A I E -D 43 0B 0 -98,-1.4 -98,-2.0 -2,-0.3 2,-0.4 -0.992 28.8-158.8-115.2 127.0 -34.9 14.3 27.2 142 159 A I E -D 42 0B 0 -11,-0.4 -12,-2.8 -2,-0.4 2,-0.5 -0.893 12.8-164.2-117.0 136.1 -31.7 14.8 25.4 143 160 A L E -DE 41 129B 29 -102,-3.0 -102,-2.2 -2,-0.4 2,-0.7 -0.977 14.0-145.3-121.5 121.3 -30.2 12.6 22.6 144 161 A R E +D 40 0B 16 -16,-2.9 -17,-3.0 -2,-0.5 -104,-0.3 -0.812 24.3 170.0 -86.9 117.7 -26.5 13.0 21.8 145 162 A T 0 0 48 -106,-2.4 -105,-0.2 -2,-0.7 -1,-0.1 0.627 360.0 360.0-103.3 -16.3 -26.1 12.5 18.1 146 163 A E 0 0 119 -107,-1.6 -107,-2.5 -21,-0.0 -1,-0.3 -0.974 360.0 360.0-158.2 360.0 -22.4 13.6 17.6