==== 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 2XPA . 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, . 146 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8276.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 60.3 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 19.2 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 . 9 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 19.9 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 . 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 92 0, 0.0 3,-0.2 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 148.9 29.4 -42.7 22.0 2 8 A P > - 0 0 40 0, 0.0 3,-2.2 0, 0.0 122,-0.0 0.075 360.0 -43.7 -60.7 174.4 32.1 -41.0 19.8 3 9 A P T 3 S+ 0 0 98 0, 0.0 19,-0.1 0, 0.0 0, 0.0 -0.127 126.8 3.9 -49.5 119.5 34.6 -38.3 21.0 4 10 A G T 3 S+ 0 0 13 1,-0.3 17,-2.1 -3,-0.2 2,-0.3 0.282 93.0 134.6 98.8 -3.0 32.9 -35.6 23.2 5 11 A W E < +A 20 0A 23 -3,-2.2 2,-0.3 15,-0.2 -1,-0.3 -0.622 24.0 171.7 -91.0 137.8 29.4 -37.1 23.4 6 12 A E E -A 19 0A 88 13,-2.4 13,-2.6 -2,-0.3 2,-0.3 -0.974 30.6-119.8-136.3 152.9 27.3 -37.4 26.6 7 13 A K E +A 18 0A 104 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.623 37.5 171.9 -87.0 142.7 23.7 -38.4 27.3 8 14 A A E -A 17 0A 21 9,-2.5 9,-2.4 -2,-0.3 2,-0.4 -0.940 32.2-114.2-143.7 166.3 21.6 -35.8 29.1 9 15 A M E -A 16 0A 136 -2,-0.3 7,-0.2 7,-0.2 6,-0.1 -0.917 37.0-112.8-105.7 136.2 17.9 -35.3 30.0 10 16 A S > - 0 0 14 5,-2.8 4,-1.2 -2,-0.4 6,-0.0 -0.408 12.4-139.2 -69.1 139.7 16.0 -32.5 28.4 11 17 A R T 4 S+ 0 0 242 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.809 99.4 28.2 -64.7 -39.4 14.8 -29.5 30.5 12 18 A S T 4 S+ 0 0 124 3,-0.1 -1,-0.2 1,-0.0 -2,-0.0 0.848 131.6 30.5 -87.6 -40.0 11.3 -29.2 28.9 13 19 A S T 4 S- 0 0 72 2,-0.2 -2,-0.1 1,-0.0 3,-0.1 0.781 83.9-133.9 -96.7 -35.2 10.5 -32.7 27.8 14 20 A G < + 0 0 34 -4,-1.2 2,-0.2 1,-0.3 -3,-0.1 0.335 63.3 139.0 77.4 -1.2 12.3 -35.0 30.2 15 21 A R - 0 0 131 -6,-0.1 -5,-2.8 1,-0.1 -1,-0.3 -0.491 60.0-109.6 -74.1 141.5 13.3 -36.8 27.0 16 22 A V E +A 9 0A 67 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.410 45.2 167.6 -62.1 143.3 17.0 -38.1 26.7 17 23 A Y E -A 8 0A 63 -9,-2.4 -9,-2.5 -2,-0.1 2,-0.4 -0.902 31.2-112.9-148.0 179.8 19.2 -36.2 24.2 18 24 A Y E -AB 7 27A 22 9,-2.8 9,-2.0 -2,-0.3 2,-0.4 -0.948 23.1-169.2-126.2 137.4 22.9 -36.1 23.3 19 25 A F E -AB 6 26A 56 -13,-2.6 -13,-2.4 -2,-0.4 2,-0.6 -0.948 12.1-149.4-126.1 137.8 25.3 -33.1 23.9 20 26 A N E > -A 5 0A 0 5,-2.7 4,-1.9 -2,-0.4 5,-0.3 -0.955 3.8-165.7-113.4 117.2 28.8 -32.8 22.5 21 27 A H T 4 S+ 0 0 116 -17,-2.1 -1,-0.1 -2,-0.6 -16,-0.1 0.568 88.0 52.2 -83.6 -4.2 31.0 -30.8 24.8 22 28 A I T 4 S+ 0 0 54 -18,-0.2 -1,-0.2 -19,-0.1 99,-0.1 0.851 125.7 21.5 -91.4 -41.8 33.7 -30.4 22.1 23 29 A T T 4 S- 0 0 0 2,-0.1 109,-2.5 98,-0.1 -2,-0.2 0.533 95.4-129.8-101.9 -9.1 31.4 -29.0 19.3 24 30 A N < + 0 0 55 -4,-1.9 -3,-0.2 1,-0.2 2,-0.1 0.615 57.5 149.9 60.6 14.1 28.6 -27.8 21.5 25 31 A A - 0 0 8 -5,-0.3 -5,-2.7 107,-0.2 2,-0.3 -0.401 27.6-167.9 -72.2 152.0 26.2 -29.7 19.2 26 32 A S E +B 19 0A 52 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.982 12.4 162.7-141.5 138.1 23.0 -31.1 20.6 27 33 A Q E -B 18 0A 41 -9,-2.0 -9,-2.8 -2,-0.3 -2,-0.0 -0.984 40.1-132.0-146.8 154.3 20.6 -33.6 18.9 28 34 A W S S+ 0 0 106 -2,-0.3 -1,-0.1 -11,-0.2 2,-0.0 0.933 86.3 78.1 -71.8 -44.5 17.7 -36.1 19.9 29 35 A E S S- 0 0 135 1,-0.1 -11,-0.1 -12,-0.1 -2,-0.1 -0.329 91.6-108.4 -68.6 141.3 19.1 -39.1 18.0 30 36 A R - 0 0 131 1,-0.1 2,-0.5 -13,-0.1 -1,-0.1 -0.482 36.2-114.4 -64.6 134.4 22.0 -41.2 19.6 31 37 A P + 0 0 6 0, 0.0 -1,-0.1 0, 0.0 -26,-0.0 -0.651 41.3 172.9 -70.8 122.0 25.2 -40.5 17.6 32 38 A S 0 0 123 -2,-0.5 -2,-0.0 -31,-0.1 0, 0.0 0.916 360.0 360.0 -94.8 -65.0 26.0 -44.0 16.0 33 39 A G 0 0 66 -32,-0.1 93,-0.1 -31,-0.0 0, 0.0 -0.154 360.0 360.0 -79.0 360.0 28.9 -43.1 13.7 34 ! 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 35 51 A E 0 0 159 0, 0.0 89,-0.1 0, 0.0 88,-0.0 0.000 360.0 360.0 360.0 133.1 40.2 -39.6 13.2 36 52 A P - 0 0 52 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.293 360.0-126.2 -73.2 160.4 41.1 -38.3 9.7 37 53 A A S S+ 0 0 81 1,-0.1 74,-0.7 73,-0.1 2,-0.3 0.777 92.8 19.8 -72.6 -30.8 44.3 -36.5 9.0 38 54 A R E -C 110 0B 144 72,-0.2 2,-0.3 85,-0.0 72,-0.2 -0.980 64.0-170.2-139.8 146.0 42.5 -33.5 7.4 39 55 A V E -C 109 0B 2 70,-2.0 70,-2.5 -2,-0.3 2,-0.4 -0.925 17.5-137.0-128.1 160.0 38.9 -32.1 7.4 40 56 A R E +C 108 0B 76 107,-2.6 106,-2.9 -2,-0.3 107,-1.5 -0.990 30.6 174.8-115.2 134.4 37.2 -29.4 5.3 41 57 A C E - D 0 145B 0 66,-1.3 65,-2.7 -2,-0.4 66,-0.4 -0.942 23.2-155.9-134.7 151.6 35.0 -26.9 7.1 42 58 A S E -CD 105 144B 12 102,-2.4 102,-2.8 -2,-0.3 2,-0.3 -0.836 22.5-169.3-111.3 161.9 33.0 -23.8 6.5 43 59 A H E - D 0 143B 8 61,-1.8 2,-0.4 -2,-0.3 100,-0.2 -0.979 24.3-146.4-146.5 164.3 32.1 -21.3 9.2 44 60 A L E - D 0 142B 0 98,-1.9 98,-1.7 -2,-0.3 2,-0.4 -0.993 25.5-160.2-127.0 126.4 30.0 -18.3 10.1 45 61 A L E - D 0 141B 7 -2,-0.4 51,-3.1 96,-0.2 2,-0.5 -0.888 12.2-168.1-115.0 129.8 31.7 -16.0 12.5 46 62 A V E - D 0 140B 2 94,-3.0 94,-2.7 -2,-0.4 2,-0.1 -0.990 17.2-158.7-112.8 114.4 30.0 -13.4 14.6 47 63 A K - 0 0 14 -2,-0.5 2,-0.3 92,-0.2 92,-0.2 -0.489 7.4-166.4 -84.9 166.2 32.5 -11.0 16.2 48 64 A H > - 0 0 8 90,-0.3 3,-2.7 -2,-0.1 17,-0.2 -0.886 42.2 -82.9-142.4 178.6 31.9 -8.9 19.3 49 65 A S T 3 S+ 0 0 62 15,-3.2 16,-0.1 1,-0.3 13,-0.1 0.746 127.9 51.7 -56.9 -25.1 33.6 -5.9 21.2 50 66 A Q T 3 S+ 0 0 137 14,-0.3 -1,-0.3 3,-0.1 89,-0.1 0.490 82.5 120.3 -96.5 -0.4 35.9 -8.3 22.9 51 67 A S S < S- 0 0 7 -3,-2.7 87,-0.2 87,-0.1 86,-0.1 -0.254 76.7-112.5 -53.0 152.0 37.1 -10.1 19.7 52 68 A R S S+ 0 0 175 85,-3.3 86,-0.1 1,-0.3 -1,-0.1 0.885 115.2 21.0 -54.6 -44.5 40.9 -10.0 18.8 53 69 A R S S- 0 0 143 84,-0.2 2,-2.5 85,-0.2 -1,-0.3 -0.842 78.8-162.9-126.0 92.7 40.2 -7.8 15.8 54 70 A P + 0 0 52 0, 0.0 8,-3.2 0, 0.0 2,-0.3 -0.294 61.9 83.0 -76.2 61.6 36.7 -6.1 16.4 55 71 A S + 0 0 33 -2,-2.5 2,-0.3 6,-0.2 5,-0.2 -0.986 49.1 167.5-158.0 145.0 36.3 -5.1 12.8 56 72 A S - 0 0 11 3,-2.4 3,-0.4 -2,-0.3 41,-0.1 -0.965 53.8 -88.4-153.8 178.2 35.1 -6.8 9.5 57 73 A W S S+ 0 0 145 -2,-0.3 3,-0.1 1,-0.2 39,-0.1 0.790 126.0 50.7 -58.1 -28.6 34.0 -6.3 6.0 58 74 A R S S+ 0 0 96 1,-0.3 2,-0.3 37,-0.1 -1,-0.2 0.821 123.8 15.6 -78.2 -33.3 30.4 -5.8 7.3 59 75 A Q - 0 0 72 -3,-0.4 -3,-2.4 1,-0.1 -1,-0.3 -0.970 58.0-150.9-149.7 120.2 31.2 -3.2 10.1 60 76 A E S S+ 0 0 178 -2,-0.3 2,-0.6 1,-0.3 -1,-0.1 0.899 96.3 32.1 -60.9 -42.0 34.3 -1.1 10.6 61 77 A K S S- 0 0 154 -6,-0.1 2,-0.6 -5,-0.0 -1,-0.3 -0.946 77.6-154.1-120.0 110.7 33.8 -1.0 14.3 62 78 A I + 0 0 3 -8,-3.2 -11,-0.1 -2,-0.6 -14,-0.1 -0.735 25.5 161.0 -85.2 120.7 32.2 -4.0 15.9 63 79 A T + 0 0 81 -2,-0.6 -1,-0.1 -16,-0.1 -14,-0.1 0.452 28.1 118.1-119.2 -10.4 30.4 -3.0 19.1 64 80 A R - 0 0 37 -17,-0.1 -15,-3.2 1,-0.1 -14,-0.3 -0.285 66.4-114.0 -56.5 150.1 28.0 -5.8 19.9 65 81 A T > - 0 0 63 -17,-0.2 4,-2.7 -16,-0.1 5,-0.2 -0.433 23.2-108.2 -78.6 157.1 28.6 -7.5 23.2 66 82 A K H > S+ 0 0 87 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.890 122.5 53.4 -46.7 -42.6 29.6 -11.1 23.4 67 83 A E H > S+ 0 0 140 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.881 108.7 47.9 -64.6 -35.5 26.1 -11.9 24.8 68 84 A E H > S+ 0 0 94 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.894 110.3 52.9 -74.5 -34.4 24.5 -10.2 21.8 69 85 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.917 108.1 50.4 -63.1 -42.4 26.8 -12.1 19.4 70 86 A L H X S+ 0 0 59 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.913 108.2 53.3 -62.5 -42.3 25.7 -15.4 21.1 71 87 A E H X S+ 0 0 121 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.903 110.5 47.0 -55.5 -48.0 22.1 -14.4 20.6 72 88 A L H X S+ 0 0 67 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.929 112.2 49.2 -56.8 -51.6 22.8 -13.8 16.9 73 89 A I H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.912 110.4 51.4 -53.2 -46.0 24.6 -17.2 16.5 74 90 A N H X S+ 0 0 69 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.899 108.9 50.5 -65.1 -39.0 21.7 -19.0 18.3 75 91 A G H X S+ 0 0 25 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.874 111.3 49.1 -63.6 -39.7 19.1 -17.4 15.9 76 92 A Y H X S+ 0 0 25 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.897 108.6 52.0 -69.0 -39.8 21.2 -18.5 12.9 77 93 A I H X S+ 0 0 21 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.941 109.9 51.3 -60.1 -43.1 21.5 -22.1 14.2 78 94 A Q H X S+ 0 0 143 -4,-2.1 4,-2.0 1,-0.2 6,-0.3 0.907 111.2 45.6 -60.8 -46.3 17.7 -22.2 14.6 79 95 A K H X>S+ 0 0 77 -4,-2.0 6,-2.0 2,-0.2 5,-1.2 0.859 114.2 48.7 -65.0 -35.3 17.0 -21.0 11.1 80 96 A I H <5S+ 0 0 28 -4,-2.2 3,-0.5 4,-0.2 -2,-0.2 0.923 113.5 46.5 -71.7 -42.2 19.5 -23.4 9.7 81 97 A K H <5S+ 0 0 131 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.849 113.0 48.3 -67.5 -31.1 18.1 -26.4 11.7 82 98 A S H <5S- 0 0 83 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.614 111.9-123.4 -78.9 -19.3 14.5 -25.6 10.8 83 99 A G T <5S+ 0 0 60 -4,-0.6 -3,-0.2 -3,-0.5 -4,-0.1 0.582 78.1 124.8 83.5 11.9 15.6 -25.3 7.1 84 100 A E S - 0 0 94 -2,-0.3 4,-1.9 1,-0.1 3,-0.3 -0.764 23.7-117.2 -99.8 156.2 20.7 -22.6 4.7 87 103 A F H > S+ 0 0 7 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.880 112.1 53.1 -47.4 -49.3 24.2 -22.3 6.3 88 104 A E H > S+ 0 0 79 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.859 108.1 50.5 -62.2 -37.2 25.8 -20.9 3.0 89 105 A S H > S+ 0 0 37 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.925 113.5 43.0 -70.1 -44.3 23.3 -18.2 2.6 90 106 A L H X S+ 0 0 3 -4,-1.9 4,-2.6 2,-0.2 5,-0.4 0.844 113.6 52.4 -69.5 -35.4 23.7 -17.0 6.2 91 107 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.960 109.3 50.1 -67.2 -44.8 27.5 -17.2 6.1 92 108 A S H < S+ 0 0 46 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.883 121.6 33.8 -57.2 -41.9 27.6 -15.2 2.9 93 109 A Q H < S+ 0 0 93 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.838 133.3 19.4 -79.0 -40.9 25.4 -12.4 4.4 94 110 A F H < S+ 0 0 57 -4,-2.6 -3,-0.2 -5,-0.2 2,-0.2 0.541 81.5 115.8-121.7 -9.2 26.3 -12.3 8.0 95 111 A S < - 0 0 0 -4,-2.3 -49,-0.2 -5,-0.4 5,-0.1 -0.490 51.9-149.6 -70.8 134.2 29.7 -13.9 8.7 96 112 A D S S+ 0 0 1 -51,-3.1 2,-0.3 -2,-0.2 -39,-0.2 0.161 71.6 96.2 -85.1 13.4 32.3 -11.3 10.0 97 113 A C S > S- 0 0 27 -52,-0.2 3,-2.1 -6,-0.2 4,-0.2 -0.787 84.8-124.9-102.0 152.5 35.0 -13.3 8.3 98 114 A S G > S+ 0 0 80 -2,-0.3 3,-1.5 1,-0.3 4,-0.2 0.781 107.6 74.7 -67.4 -21.4 36.5 -12.6 4.9 99 115 A S G > > + 0 0 14 1,-0.3 5,-2.5 2,-0.2 3,-1.7 0.563 69.9 90.4 -64.3 -10.0 35.5 -16.3 4.0 100 116 A A G X 5S+ 0 0 1 -3,-2.1 3,-1.9 1,-0.3 -1,-0.3 0.859 78.2 61.2 -47.8 -39.5 31.9 -15.0 3.8 101 117 A K G < 5S+ 0 0 177 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.686 104.0 49.4 -72.1 -11.7 32.5 -14.4 0.1 102 118 A A G X 5S- 0 0 33 -3,-1.7 3,-1.9 -4,-0.2 -1,-0.3 -0.043 127.7 -97.9-107.8 29.0 33.2 -18.1 -0.3 103 119 A R T < 5S- 0 0 131 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.2 0.752 79.4 -63.2 60.7 24.8 30.0 -19.2 1.6 104 120 A G T 3 -C 38 0B 41 -2,-0.3 3,-0.8 -72,-0.2 4,-0.4 -0.596 44.0 -81.5 -94.1 167.4 45.3 -30.5 9.3 111 127 A R T 3 S+ 0 0 92 -74,-0.7 -1,-0.1 -2,-0.2 5,-0.0 -0.428 114.6 46.3 -61.8 145.9 45.6 -30.4 13.1 112 128 A G T 3 S+ 0 0 70 2,-0.2 -1,-0.2 -3,-0.1 4,-0.1 0.473 95.2 79.0 97.1 6.5 48.1 -27.7 14.1 113 129 A Q S < S+ 0 0 115 -3,-0.8 2,-0.2 2,-0.1 -2,-0.1 0.766 80.6 53.1-115.1 -37.6 46.7 -24.8 11.9 114 130 A M S S- 0 0 59 -4,-0.4 -2,-0.2 1,-0.2 5,-0.0 -0.588 98.6 -75.6-100.2 165.8 43.6 -23.3 13.4 115 131 A Q > - 0 0 73 -2,-0.2 4,-2.8 1,-0.1 3,-0.4 -0.275 55.3-112.6 -50.8 138.4 42.9 -21.9 16.9 116 132 A K H > S+ 0 0 117 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.799 112.2 48.4 -51.7 -47.7 42.5 -24.8 19.2 117 133 A P H > S+ 0 0 61 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.900 114.6 48.9 -66.3 -33.0 38.8 -24.6 20.1 118 134 A F H > S+ 0 0 8 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.928 114.5 44.8 -64.5 -47.8 38.0 -24.3 16.4 119 135 A E H X S+ 0 0 1 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.923 111.8 51.8 -61.3 -47.7 40.3 -27.3 15.4 120 136 A D H X S+ 0 0 60 -4,-2.9 4,-1.1 -5,-0.3 -1,-0.2 0.933 112.1 45.8 -60.0 -44.6 39.0 -29.4 18.2 121 137 A A H >X S+ 0 0 0 -4,-2.0 4,-1.3 -5,-0.2 3,-0.7 0.953 111.4 53.1 -62.0 -44.2 35.4 -28.8 17.2 122 138 A S H 3< S+ 0 0 0 -4,-2.6 3,-0.3 1,-0.3 -2,-0.2 0.878 111.0 45.2 -57.9 -42.2 36.2 -29.4 13.5 123 139 A F H 3< S+ 0 0 11 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.638 110.5 54.3 -81.2 -15.0 37.8 -32.8 14.1 124 140 A A H << S+ 0 0 18 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.629 91.9 92.7 -90.2 -16.4 35.0 -34.0 16.4 125 141 A L S < S- 0 0 2 -4,-1.3 2,-0.2 -3,-0.3 3,-0.1 -0.463 75.3-128.9 -74.0 144.4 32.3 -33.2 13.8 126 142 A R > - 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F 0 136B 0 -3,-0.7 -3,-2.8 -92,-0.2 2,-0.4 -0.992 63.0 -26.2 150.4-138.3 34.6 -14.3 18.2 140 156 A I E -DF 46 135B 0 -94,-2.7 -94,-3.0 -2,-0.3 2,-0.3 -0.954 59.8-163.5-118.5 134.8 31.8 -17.0 18.1 141 157 A H E -DF 45 134B 7 -7,-3.0 -7,-2.1 -2,-0.4 2,-0.5 -0.788 22.4-157.0-119.3 146.8 31.6 -19.6 15.2 142 158 A I E -D 44 0B 0 -98,-1.7 -98,-1.9 -2,-0.3 2,-0.5 -0.996 28.7-159.4-109.4 128.6 29.1 -22.0 13.7 143 159 A I E -D 43 0B 0 -2,-0.5 -12,-3.2 -11,-0.4 2,-0.5 -0.936 14.0-167.1-116.4 135.5 31.1 -24.7 12.0 144 160 A L E -DE 42 130B 25 -102,-2.8 -102,-2.4 -2,-0.5 2,-0.6 -0.964 14.4-147.4-117.1 117.8 30.0 -27.0 9.2 145 161 A R E +D 41 0B 28 -16,-2.6 -17,-2.8 -2,-0.5 -104,-0.3 -0.779 21.7 173.1 -83.8 122.9 32.2 -29.9 8.4 146 162 A T 0 0 49 -106,-2.9 -105,-0.2 -2,-0.6 -1,-0.1 0.606 360.0 360.0-108.7 -13.7 31.9 -30.7 4.8 147 163 A E 0 0 124 -107,-1.5 -107,-2.6 -21,-0.0 -1,-0.3 -0.972 360.0 360.0-154.1 360.0 34.6 -33.4 4.1