==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 25-AUG-10 2XPB . 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) . 8337.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 89 61.0 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 . 30 20.5 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 . 1 0.7 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 . 7 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 20.5 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 . 2 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 91 0, 0.0 31,-0.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 151.9 29.4 -42.7 21.8 2 8 A P > - 0 0 17 0, 0.0 3,-2.1 0, 0.0 31,-0.1 -0.105 360.0 -50.2 -62.4 165.2 32.0 -41.0 19.5 3 9 A P T 3 S+ 0 0 102 0, 0.0 19,-0.1 0, 0.0 3,-0.1 -0.051 125.3 5.8 -45.6 126.0 34.6 -38.4 20.9 4 10 A G T 3 S+ 0 0 13 1,-0.3 17,-2.3 -3,-0.2 2,-0.2 0.227 93.8 130.4 90.6 -10.9 33.0 -35.7 23.1 5 11 A W E < +A 20 0A 20 -3,-2.1 2,-0.3 15,-0.2 -1,-0.3 -0.551 29.2 175.1 -85.8 139.9 29.4 -37.0 23.1 6 12 A E E -A 19 0A 41 13,-2.6 13,-2.5 -2,-0.2 2,-0.3 -0.979 27.2-118.9-142.2 154.1 27.5 -37.3 26.3 7 13 A K E +A 18 0A 117 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.662 37.6 163.8 -92.3 143.9 23.9 -38.3 27.3 8 14 A A E -A 17 0A 30 9,-2.3 9,-2.5 -2,-0.3 2,-0.4 -0.953 34.9-110.8-151.8 171.2 21.6 -36.0 29.1 9 15 A M E -A 16 0A 115 -2,-0.3 7,-0.3 7,-0.3 2,-0.2 -0.918 33.4-119.8-109.0 135.0 18.0 -35.3 30.1 10 16 A S > - 0 0 21 5,-3.2 4,-0.8 -2,-0.4 6,-0.0 -0.474 10.0-142.1 -69.9 140.0 16.0 -32.4 28.6 11 17 A R T 4 S+ 0 0 245 -2,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.935 97.7 35.8 -62.5 -50.0 14.6 -29.7 31.0 12 18 A S T 4 S+ 0 0 124 1,-0.1 -1,-0.1 3,-0.1 -2,-0.0 0.916 130.4 24.0 -74.1 -46.8 11.2 -29.3 29.1 13 19 A S T 4 S- 0 0 66 2,-0.2 -2,-0.1 1,-0.0 -1,-0.1 0.779 85.4-130.6 -95.9 -32.1 10.4 -32.7 27.9 14 20 A G < + 0 0 48 -4,-0.8 2,-0.2 1,-0.4 -3,-0.1 0.353 64.7 138.2 84.6 -3.1 12.2 -35.2 30.2 15 21 A R - 0 0 134 -6,-0.1 -5,-3.2 1,-0.1 -1,-0.4 -0.508 58.6-114.7 -73.2 140.8 13.3 -36.7 27.0 16 22 A V E +A 9 0A 51 -7,-0.3 2,-0.3 -2,-0.2 -7,-0.3 -0.430 40.1 172.6 -64.5 142.9 17.0 -37.9 26.7 17 23 A Y E -A 8 0A 64 -9,-2.5 -9,-2.3 -2,-0.1 2,-0.4 -0.841 27.5-114.5-138.5-172.2 19.2 -36.0 24.2 18 24 A Y E -AB 7 27A 19 9,-2.7 9,-2.7 -2,-0.3 2,-0.3 -0.985 23.9-171.2-133.8 139.4 22.9 -36.0 23.3 19 25 A F E -AB 6 26A 71 -13,-2.5 -13,-2.6 -2,-0.4 2,-0.5 -0.914 14.0-146.5-129.3 145.0 25.4 -33.2 23.7 20 26 A N E > -A 5 0A 0 5,-2.7 4,-2.3 -2,-0.3 5,-0.3 -0.970 3.6-165.1-120.1 120.5 29.0 -32.8 22.5 21 27 A H T 4 S+ 0 0 128 -17,-2.3 -16,-0.1 -2,-0.5 -1,-0.1 0.597 89.2 49.5 -85.3 -8.4 31.2 -30.8 24.8 22 28 A I T 4 S+ 0 0 55 -18,-0.2 -1,-0.2 -19,-0.1 99,-0.2 0.850 126.9 23.5 -88.7 -42.5 34.0 -30.3 22.1 23 29 A T T 4 S- 0 0 1 2,-0.1 109,-2.5 98,-0.1 -2,-0.2 0.552 94.5-130.7-102.0 -12.3 31.6 -29.1 19.4 24 30 A N < + 0 0 55 -4,-2.3 2,-0.2 1,-0.2 -3,-0.1 0.622 56.7 148.6 64.5 16.5 28.7 -27.8 21.5 25 31 A A - 0 0 10 -5,-0.3 -5,-2.7 107,-0.2 2,-0.3 -0.509 25.2-173.1 -74.1 146.6 26.3 -29.8 19.2 26 32 A S E +B 19 0A 50 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.994 9.7 160.9-144.1 142.7 23.2 -31.1 20.7 27 33 A Q E -B 18 0A 66 -9,-2.7 -9,-2.7 -2,-0.3 -2,-0.0 -0.988 43.4-125.8-154.5 151.6 20.5 -33.5 19.2 28 34 A W S S+ 0 0 105 -2,-0.3 2,-0.1 -11,-0.2 -1,-0.1 0.886 89.2 76.2 -61.6 -42.6 17.7 -35.8 20.1 29 35 A E S S- 0 0 146 1,-0.1 -11,-0.1 -11,-0.1 -2,-0.1 -0.430 86.7-108.5 -82.5 149.8 19.1 -38.8 18.2 30 36 A R - 0 0 123 -2,-0.1 2,-0.5 -13,-0.1 3,-0.1 -0.335 19.0-153.5 -66.8 143.9 22.0 -40.9 19.3 31 37 A P + 0 0 2 0, 0.0 -26,-0.0 0, 0.0 -1,-0.0 -0.992 34.6 146.8-109.6 124.6 25.4 -40.8 17.7 32 38 A S 0 0 89 1,-0.8 -27,-0.1 -2,-0.5 -2,-0.0 0.620 360.0 360.0-111.7 -43.9 27.3 -44.1 18.1 33 39 A G 0 0 73 -3,-0.1 -1,-0.8 -32,-0.1 93,-0.1 -0.763 360.0 360.0 -96.5 360.0 29.0 -43.6 14.7 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 0 167 0, 0.0 2,-0.1 0, 0.0 89,-0.1 0.000 360.0 360.0 360.0 125.2 40.6 -39.5 13.3 36 52 A P - 0 0 51 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.453 360.0-126.6 -80.6 156.3 41.6 -38.2 9.7 37 53 A A S S+ 0 0 83 1,-0.1 74,-0.5 -2,-0.1 2,-0.4 0.781 92.6 30.6 -65.0 -29.5 44.7 -36.1 9.0 38 54 A R E -C 110 0B 129 72,-0.2 2,-0.3 70,-0.0 72,-0.2 -0.978 60.9-177.4-138.2 143.0 42.7 -33.5 7.3 39 55 A V E -C 109 0B 3 70,-2.1 70,-2.2 -2,-0.4 2,-0.4 -0.931 16.4-144.0-128.7 162.1 39.2 -32.0 7.4 40 56 A R E +C 108 0B 77 107,-2.6 106,-2.7 -2,-0.3 107,-1.8 -0.999 28.3 167.5-125.0 131.8 37.4 -29.4 5.4 41 57 A C E - D 0 145B 0 66,-1.1 65,-2.3 -2,-0.4 66,-0.4 -0.941 25.6-152.2-133.4 159.1 35.0 -27.0 7.1 42 58 A S E -CD 105 144B 9 102,-2.1 102,-2.6 -2,-0.3 2,-0.3 -0.792 23.8-170.6-113.9 165.5 33.1 -23.9 6.4 43 59 A H E - D 0 143B 8 61,-1.8 2,-0.4 -2,-0.3 100,-0.2 -0.979 24.7-139.8-149.2 169.2 32.1 -21.6 9.2 44 60 A L E - D 0 142B 0 98,-2.0 98,-2.3 -2,-0.3 2,-0.5 -0.999 25.9-161.6-129.9 126.8 30.0 -18.5 10.2 45 61 A L E - D 0 141B 7 -2,-0.4 51,-3.2 96,-0.2 2,-0.6 -0.923 12.0-167.2-115.3 130.2 31.7 -16.2 12.5 46 62 A V E - D 0 140B 2 94,-2.9 94,-2.7 -2,-0.5 2,-0.1 -0.973 18.1-155.9-111.0 116.9 30.0 -13.5 14.6 47 63 A K - 0 0 12 -2,-0.6 2,-0.3 92,-0.2 92,-0.2 -0.437 11.2-170.6 -82.9 167.6 32.6 -11.2 16.1 48 64 A H > - 0 0 8 90,-0.3 3,-2.2 -2,-0.1 17,-0.2 -0.871 42.0 -80.1-145.9-179.0 32.0 -9.1 19.3 49 65 A S T 3 S+ 0 0 61 15,-2.6 16,-0.1 1,-0.3 15,-0.1 0.765 126.7 48.5 -59.1 -29.2 33.7 -6.2 21.3 50 66 A Q T 3 S+ 0 0 146 3,-0.1 -1,-0.3 13,-0.0 89,-0.1 0.354 83.0 123.0 -94.3 9.2 36.2 -8.5 23.0 51 67 A S S < S- 0 0 7 -3,-2.2 87,-0.2 1,-0.1 86,-0.1 -0.364 76.6-115.1 -61.4 150.3 37.3 -10.2 19.7 52 68 A R S S+ 0 0 214 85,-3.0 86,-0.1 1,-0.3 -1,-0.1 0.846 113.5 22.9 -57.5 -32.2 41.0 -10.0 19.0 53 69 A R S S- 0 0 148 84,-0.3 2,-3.1 85,-0.2 -1,-0.3 -0.708 76.5-165.2-134.2 85.9 40.1 -7.9 15.9 54 70 A P + 0 0 51 0, 0.0 8,-2.9 0, 0.0 2,-0.3 -0.233 60.5 79.1 -77.8 64.9 36.6 -6.3 16.4 55 71 A S + 0 0 30 -2,-3.1 2,-0.3 6,-0.2 5,-0.2 -0.984 49.2 168.5-151.7 161.6 36.2 -5.3 12.7 56 72 A S B > -G 59 0C 15 3,-3.0 3,-0.8 -2,-0.3 41,-0.1 -0.986 54.9 -85.4-158.3 171.5 35.1 -6.9 9.5 57 73 A W T 3 S+ 0 0 142 -2,-0.3 3,-0.1 1,-0.2 39,-0.1 0.746 128.0 53.1 -45.2 -28.4 34.1 -6.5 5.9 58 74 A R T 3 S+ 0 0 89 1,-0.3 2,-0.4 37,-0.1 -1,-0.2 0.835 123.4 11.2 -81.6 -33.6 30.6 -6.0 7.4 59 75 A Q B < -G 56 0C 79 -3,-0.8 -3,-3.0 1,-0.1 -1,-0.3 -0.981 56.5-146.2-151.6 131.3 31.4 -3.3 9.9 60 76 A E S S+ 0 0 187 -2,-0.4 2,-0.6 1,-0.3 -1,-0.1 0.939 98.4 27.1 -64.6 -45.1 34.4 -1.1 10.5 61 77 A K S S- 0 0 161 -6,-0.1 2,-0.6 -5,-0.0 -1,-0.3 -0.945 76.2-154.7-124.5 114.3 33.9 -1.2 14.2 62 78 A I + 0 0 4 -8,-2.9 -11,-0.1 -2,-0.6 -14,-0.1 -0.796 23.7 162.8 -92.7 121.4 32.2 -4.1 15.8 63 79 A T + 0 0 87 -2,-0.6 -14,-0.2 -16,-0.1 -1,-0.1 0.458 27.4 121.3-117.9 -13.1 30.5 -3.1 19.1 64 80 A R - 0 0 35 -17,-0.1 -15,-2.6 1,-0.1 2,-0.1 -0.215 65.1-114.3 -53.9 145.3 28.0 -5.9 19.9 65 81 A T > - 0 0 62 -17,-0.2 4,-2.5 -16,-0.1 5,-0.2 -0.406 24.8-106.9 -72.8 162.3 28.6 -7.7 23.2 66 82 A K H > S+ 0 0 88 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.893 123.3 52.3 -53.0 -39.6 29.7 -11.3 23.4 67 83 A E H > S+ 0 0 162 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.877 108.6 51.1 -67.9 -35.9 26.2 -12.2 24.7 68 84 A E H > S+ 0 0 102 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.930 109.5 49.0 -63.8 -48.1 24.7 -10.4 21.7 69 85 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.872 109.5 53.2 -53.4 -42.4 26.9 -12.3 19.3 70 86 A L H X S+ 0 0 52 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.944 107.0 51.6 -66.0 -43.9 25.8 -15.5 21.0 71 87 A E H X S+ 0 0 118 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.881 110.6 48.7 -55.9 -38.7 22.2 -14.6 20.5 72 88 A L H X S+ 0 0 63 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.957 110.9 49.4 -64.6 -53.3 22.9 -14.0 16.8 73 89 A I H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.895 110.2 51.8 -48.5 -46.8 24.7 -17.3 16.5 74 90 A N H X S+ 0 0 50 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.892 108.4 51.2 -59.2 -40.5 21.7 -19.0 18.2 75 91 A G H X S+ 0 0 17 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.845 111.2 48.0 -63.8 -36.7 19.2 -17.4 15.8 76 92 A Y H X S+ 0 0 26 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.911 110.2 51.0 -76.4 -42.6 21.3 -18.7 12.8 77 93 A I H X S+ 0 0 20 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.906 108.6 52.5 -57.3 -46.9 21.5 -22.2 14.2 78 94 A Q H X S+ 0 0 133 -4,-2.2 4,-1.9 1,-0.2 6,-0.3 0.894 111.8 46.0 -56.1 -42.3 17.7 -22.2 14.7 79 95 A K H X>S+ 0 0 71 -4,-1.7 6,-1.7 2,-0.2 4,-1.0 0.870 113.0 48.8 -72.0 -36.1 17.2 -21.2 11.0 80 96 A I H <5S+ 0 0 32 -4,-2.3 -2,-0.2 4,-0.2 -1,-0.2 0.912 114.3 45.7 -66.0 -43.3 19.7 -23.7 9.7 81 97 A K H <5S+ 0 0 129 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.843 112.7 49.7 -71.2 -31.3 18.1 -26.5 11.7 82 98 A S H <5S- 0 0 79 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.700 110.1-124.2 -76.6 -18.9 14.6 -25.6 10.8 83 99 A G T <5S+ 0 0 61 -4,-1.0 -3,-0.2 2,-0.3 -4,-0.1 0.475 77.3 124.9 84.4 0.6 15.6 -25.5 7.1 84 100 A E S - 0 0 96 -2,-0.3 4,-1.9 1,-0.1 3,-0.2 -0.671 23.3-114.7 -97.7 162.3 20.8 -22.7 4.7 87 103 A F H > S+ 0 0 8 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.894 112.1 51.9 -49.2 -49.0 24.2 -22.5 6.2 88 104 A E H > S+ 0 0 75 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.847 109.2 49.3 -68.0 -38.3 25.9 -21.1 3.1 89 105 A S H > S+ 0 0 36 -3,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.899 113.0 45.8 -69.1 -39.2 23.5 -18.3 2.6 90 106 A L H X S+ 0 0 3 -4,-1.9 4,-3.0 2,-0.2 5,-0.4 0.874 113.1 51.5 -69.8 -38.0 23.7 -17.2 6.3 91 107 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.964 110.4 47.0 -63.0 -50.3 27.5 -17.4 6.1 92 108 A S H < S+ 0 0 45 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.857 122.3 38.2 -59.1 -39.2 27.7 -15.3 2.9 93 109 A Q H < S+ 0 0 92 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.890 131.7 16.6 -76.3 -44.3 25.4 -12.7 4.4 94 110 A F H < S+ 0 0 58 -4,-3.0 2,-0.2 -5,-0.2 -3,-0.2 0.500 83.6 118.2-120.4 -6.3 26.3 -12.5 8.1 95 111 A S < - 0 0 0 -4,-2.1 -49,-0.2 -5,-0.4 5,-0.2 -0.483 48.9-152.8 -75.7 132.7 29.7 -14.0 8.7 96 112 A D S S+ 0 0 3 -51,-3.2 2,-0.3 -2,-0.2 -39,-0.2 0.312 72.5 94.3 -84.4 7.1 32.4 -11.6 10.1 97 113 A C S > S- 0 0 26 -52,-0.3 3,-1.9 -6,-0.1 4,-0.1 -0.744 84.4-126.9 -92.1 148.3 35.1 -13.7 8.4 98 114 A S G > S+ 0 0 98 -2,-0.3 3,-2.0 1,-0.3 4,-0.1 0.761 106.4 77.3 -63.6 -19.7 36.4 -12.8 4.9 99 115 A S G > > + 0 0 15 1,-0.3 5,-2.7 2,-0.2 3,-1.5 0.532 66.6 90.5 -68.2 -4.5 35.5 -16.4 4.1 100 116 A A G X 5S+ 0 0 1 -3,-1.9 3,-1.7 1,-0.2 -1,-0.3 0.860 77.7 63.5 -49.5 -38.7 32.0 -15.2 3.9 101 117 A K G < 5S+ 0 0 194 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.653 103.1 46.7 -68.2 -16.6 32.8 -14.5 0.2 102 118 A A G X 5S- 0 0 37 -3,-1.5 3,-2.0 -4,-0.1 -1,-0.3 -0.125 128.8 -96.2-111.0 31.0 33.3 -18.3 -0.3 103 119 A R T < 5S- 0 0 136 -3,-1.7 -3,-0.2 1,-0.3 -2,-0.2 0.828 81.4 -57.3 56.6 33.9 30.0 -19.2 1.6 104 120 A G T 3 -C 38 0B 32 -2,-0.3 3,-0.9 -72,-0.2 4,-0.4 -0.607 45.2 -67.9-116.5 178.1 45.2 -30.4 9.4 111 127 A R T 3 S+ 0 0 83 -74,-0.5 -1,-0.1 1,-0.2 5,-0.0 -0.415 114.6 46.7 -64.5 150.2 45.9 -30.1 13.2 112 128 A G T 3 S+ 0 0 72 2,-0.2 -1,-0.2 -2,-0.1 4,-0.1 0.315 96.8 77.6 98.2 -2.4 48.4 -27.4 14.1 113 129 A Q S < S+ 0 0 110 -3,-0.9 2,-0.2 2,-0.1 -2,-0.1 0.853 80.8 53.1-109.3 -39.4 46.8 -24.7 12.0 114 130 A M S S- 0 0 61 -4,-0.4 -2,-0.2 1,-0.1 6,-0.1 -0.549 97.7 -79.2 -97.0 160.9 43.6 -23.2 13.6 115 131 A Q >> - 0 0 76 -2,-0.2 4,-2.4 1,-0.1 3,-1.0 -0.358 56.6-112.2 -52.9 137.5 43.0 -21.7 17.0 116 132 A K H 3> S+ 0 0 114 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.793 111.4 52.2 -57.0 -43.2 42.6 -24.8 19.2 117 133 A P H 3> S+ 0 0 58 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.860 115.3 45.9 -61.3 -32.5 38.9 -24.7 20.2 118 134 A F H <> S+ 0 0 7 -3,-1.0 4,-2.5 2,-0.2 -2,-0.2 0.917 114.0 48.3 -73.1 -43.7 38.1 -24.3 16.4 119 135 A E H X S+ 0 0 10 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.960 112.8 47.2 -62.0 -47.6 40.5 -27.1 15.5 120 136 A D H X S+ 0 0 46 -4,-3.3 4,-1.3 1,-0.2 -1,-0.2 0.904 113.4 47.9 -61.8 -42.7 39.1 -29.5 18.2 121 137 A A H >X S+ 0 0 0 -4,-1.6 4,-1.4 -5,-0.3 3,-0.5 0.952 111.0 52.1 -64.8 -41.1 35.6 -28.8 17.2 122 138 A S H 3< S+ 0 0 0 -4,-2.5 3,-0.3 1,-0.2 -2,-0.2 0.894 112.0 44.7 -61.9 -46.0 36.4 -29.3 13.5 123 139 A F H 3< S+ 0 0 12 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.628 109.7 56.0 -73.9 -16.6 38.1 -32.7 14.1 124 140 A A H << S+ 0 0 14 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.682 91.9 87.2 -88.7 -20.4 35.3 -33.9 16.4 125 141 A L S < S- 0 0 2 -4,-1.4 2,-0.2 -3,-0.3 3,-0.1 -0.464 74.7-135.2 -69.3 145.0 32.6 -33.3 13.8 126 142 A R > - 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