==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 07-APR-03 1OYS . COMPND 2 MOLECULE: RIBONUCLEASE PH; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR L.S.HARLOW,A.KADZIOLA,K.F.JENSEN,S.LARSEN . 213 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10718.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 153 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 23.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 13 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 30.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 1 0 0 2 1 0 1 0 2 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 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 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 1 A M 0 0 157 0, 0.0 2,-0.2 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0 -41.9 10.7 17.2 41.9 2 2 A R > - 0 0 8 4,-1.1 3,-1.8 1,-0.1 6,-0.0 -0.576 360.0-122.4 -80.9 145.1 9.6 20.9 41.5 3 3 A H T 3 S+ 0 0 146 1,-0.3 -1,-0.1 -2,-0.2 0, 0.0 0.723 113.8 66.7 -58.1 -19.3 5.9 21.4 40.6 4 4 A D T 3 S- 0 0 67 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.759 111.2-121.0 -68.6 -36.0 7.4 23.2 37.6 5 5 A G S < S+ 0 0 64 -3,-1.8 -2,-0.1 1,-0.4 -1,-0.1 0.209 73.3 126.2 104.4 -10.3 8.8 20.0 36.2 6 6 A R - 0 0 10 1,-0.1 -4,-1.1 4,-0.1 -1,-0.4 -0.263 64.7-111.9 -78.2 163.1 12.3 21.6 36.4 7 7 A Q > - 0 0 119 -6,-0.1 3,-1.5 4,-0.1 145,-0.2 -0.493 38.8-103.6 -84.1 164.4 15.4 20.2 38.0 8 8 A H T 3 S+ 0 0 80 1,-0.3 144,-1.7 -2,-0.2 -1,-0.1 0.807 122.3 39.4 -61.8 -29.5 16.7 22.0 41.1 9 9 A D T 3 S+ 0 0 48 142,-0.2 2,-0.5 2,-0.1 -1,-0.3 0.023 93.4 111.4-110.2 27.7 19.5 23.7 39.1 10 10 A E < - 0 0 83 -3,-1.5 142,-0.1 142,-0.2 2,-0.1 -0.879 59.2-136.8-107.8 128.4 17.5 24.4 35.9 11 11 A L - 0 0 20 -2,-0.5 3,-0.1 1,-0.1 -4,-0.1 -0.453 25.9-109.9 -78.0 152.6 16.5 27.9 34.7 12 12 A R - 0 0 8 1,-0.2 -1,-0.1 -2,-0.1 2,-0.0 -0.330 60.1 -67.7 -71.5 163.5 13.1 28.6 33.3 13 13 A P - 0 0 100 0, 0.0 16,-2.1 0, 0.0 2,-0.4 -0.358 58.0-149.7 -57.0 129.5 13.0 29.2 29.5 14 14 A I E -A 28 0A 20 14,-0.2 2,-0.4 -3,-0.1 14,-0.2 -0.890 16.9-179.3-108.3 134.0 14.8 32.5 28.8 15 15 A T E -A 27 0A 69 12,-2.4 12,-2.4 -2,-0.4 2,-0.7 -0.993 16.0-168.3-135.2 129.6 13.9 34.8 26.0 16 16 A F E -A 26 0A 20 -2,-0.4 2,-0.6 10,-0.2 10,-0.2 -0.864 18.1-171.6-115.8 93.3 15.4 38.1 24.9 17 17 A D E -A 25 0A 64 8,-3.0 8,-2.6 -2,-0.7 -2,-0.0 -0.777 18.0-178.9 -92.0 116.9 13.1 39.6 22.4 18 18 A L 0 0 70 -2,-0.6 -1,-0.1 1,-0.2 5,-0.1 0.038 360.0 360.0 -99.4 25.3 14.3 42.7 20.5 19 19 A D 0 0 185 6,-0.1 -1,-0.2 3,-0.1 5,-0.1 -0.170 360.0 360.0-143.5 360.0 11.0 42.9 18.5 20 ! 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 21 25 A E 0 0 204 0, 0.0 15,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.2 13.5 51.8 19.9 22 26 A G + 0 0 15 15,-0.3 95,-0.2 92,-0.1 96,-0.1 -0.066 360.0 159.0-100.1 32.2 16.2 49.5 21.3 23 27 A S - 0 0 30 13,-0.1 2,-0.4 -5,-0.1 13,-0.2 -0.192 27.1-152.9 -57.6 141.7 13.5 48.1 23.6 24 28 A V E - B 0 35A 0 11,-2.9 11,-3.6 -5,-0.1 2,-0.7 -0.975 9.4-164.5-126.1 127.3 14.0 44.6 25.2 25 29 A L E -AB 17 34A 43 -8,-2.6 -8,-3.0 -2,-0.4 2,-0.4 -0.926 14.0-168.2-111.7 111.5 11.4 42.1 26.3 26 30 A I E -AB 16 33A 4 7,-2.3 7,-2.1 -2,-0.7 2,-0.4 -0.827 1.7-165.6-102.5 137.7 12.8 39.5 28.5 27 31 A T E +AB 15 32A 11 -12,-2.4 -12,-2.4 -2,-0.4 2,-0.4 -0.987 13.2 176.5-126.2 130.6 10.9 36.4 29.4 28 32 A A E > S-AB 14 31A 6 3,-2.8 3,-2.7 -2,-0.4 2,-0.4 -0.908 71.7 -58.0-131.1 98.6 11.7 33.9 32.2 29 33 A G T 3 S- 0 0 24 -16,-2.1 72,-0.1 -2,-0.4 126,-0.0 -0.505 122.5 -19.1 63.9-118.1 9.0 31.3 32.4 30 34 A N T 3 S+ 0 0 90 -2,-0.4 2,-0.4 70,-0.3 -1,-0.3 0.460 116.2 102.7 -99.5 -2.8 5.9 33.3 33.0 31 35 A T E < +B 28 0A 1 -3,-2.7 -3,-2.8 69,-0.3 2,-0.4 -0.668 49.3 178.2 -81.9 133.4 7.7 36.4 34.2 32 36 A K E +BC 27 98A 64 66,-2.5 66,-1.8 -2,-0.4 65,-1.6 -0.996 7.5 177.0-139.9 131.9 7.9 39.1 31.5 33 37 A V E -BC 26 96A 0 -7,-2.1 -7,-2.3 -2,-0.4 2,-0.5 -0.999 20.6-144.1-137.2 136.2 9.5 42.6 31.7 34 38 A I E -BC 25 95A 54 61,-2.5 61,-2.0 -2,-0.4 2,-0.4 -0.877 22.6-167.9-100.3 125.3 9.8 45.3 29.1 35 39 A C E -BC 24 94A 0 -11,-3.6 -11,-2.9 -2,-0.5 2,-0.4 -0.950 7.1-177.1-120.4 133.1 13.1 47.2 29.4 36 40 A N E - C 0 93A 43 57,-2.7 57,-3.0 -2,-0.4 2,-0.4 -0.968 10.5-158.4-129.8 141.9 14.0 50.5 27.7 37 41 A A E - C 0 92A 15 -2,-0.4 2,-0.4 55,-0.2 -15,-0.3 -0.958 12.3-177.9-118.4 136.5 17.2 52.5 27.7 38 42 A S E - C 0 91A 60 53,-2.4 53,-3.7 -2,-0.4 2,-0.4 -0.997 14.9-143.6-135.3 137.7 17.2 56.2 26.8 39 43 A V E - C 0 90A 47 -2,-0.4 2,-0.4 51,-0.2 51,-0.2 -0.880 16.6-179.9-108.9 134.1 20.2 58.6 26.6 40 44 A E E - C 0 89A 57 49,-2.3 49,-2.2 -2,-0.4 2,-1.3 -0.992 30.8-132.2-131.5 134.4 20.1 62.3 27.5 41 45 A D S S+ 0 0 109 -2,-0.4 2,-0.2 47,-0.2 47,-0.1 -0.157 80.5 82.5 -82.2 45.8 22.9 64.8 27.4 42 46 A R - 0 0 140 -2,-1.3 47,-0.7 47,-0.2 -2,-0.2 -0.779 58.6-158.3-133.4 175.8 22.3 66.1 30.9 43 47 A V - 0 0 4 -2,-0.2 5,-0.2 45,-0.2 4,-0.1 -0.987 37.1 -76.6-157.0 152.0 23.4 64.9 34.3 44 48 A P >> - 0 0 34 0, 0.0 3,-2.7 0, 0.0 4,-0.9 -0.201 51.2-108.4 -52.4 145.4 22.2 65.5 37.9 45 49 A P G >4 S+ 0 0 92 0, 0.0 3,-0.8 0, 0.0 0, 0.0 0.833 116.7 64.4 -43.4 -43.9 23.2 68.9 39.3 46 50 A F G 34 S+ 0 0 148 1,-0.2 0, 0.0 3,-0.1 0, 0.0 0.498 112.1 38.6 -65.1 4.2 25.8 67.4 41.7 47 51 A L G X4 S+ 0 0 33 -3,-2.7 3,-2.9 -4,-0.1 4,-0.4 0.528 78.6 129.6-126.1 -16.6 27.6 66.2 38.5 48 52 A R T << S+ 0 0 137 -4,-0.9 -6,-0.0 -3,-0.8 39,-0.0 -0.141 84.9 12.4 -44.4 129.9 27.2 69.2 36.1 49 53 A G T 3 S+ 0 0 65 1,-0.1 -1,-0.3 38,-0.1 38,-0.1 0.075 97.7 108.1 87.7 -26.4 30.6 70.1 34.7 50 54 A G S < S- 0 0 51 -3,-2.9 -2,-0.2 2,-0.1 3,-0.1 0.758 77.1-136.5 -56.7 -28.9 32.2 66.9 36.1 51 55 A G + 0 0 34 -4,-0.4 2,-0.4 1,-0.3 35,-0.3 0.516 68.5 112.4 82.6 3.4 32.6 65.3 32.7 52 56 A K - 0 0 95 -5,-0.4 -1,-0.3 33,-0.1 31,-0.2 -0.903 59.3-133.1-113.4 140.3 31.3 62.0 34.1 53 57 A G - 0 0 2 29,-3.2 2,-0.3 -2,-0.4 36,-0.2 0.059 11.9-145.8 -80.6-169.9 28.0 60.3 33.3 54 58 A W E -d 89 0A 53 34,-1.7 36,-2.7 32,-0.1 2,-0.4 -0.991 3.9-150.0-156.4 153.8 25.2 58.7 35.3 55 59 A I E +d 90 0A 0 -2,-0.3 2,-0.3 34,-0.2 36,-0.2 -0.998 22.6 166.0-130.4 133.7 22.7 55.8 35.0 56 60 A T E -d 91 0A 38 34,-2.3 36,-2.7 -2,-0.4 2,-0.4 -0.981 17.3-144.7-144.7 155.3 19.3 55.9 36.6 57 61 A A E -d 92 0A 2 -2,-0.3 2,-0.4 12,-0.3 36,-0.2 -0.949 11.9-154.4-134.3 148.8 16.1 53.8 36.3 58 62 A E E -d 93 0A 89 34,-3.6 36,-2.4 -2,-0.4 2,-0.4 -0.908 25.0-175.4-109.3 138.4 12.4 54.0 36.4 59 63 A Y E +d 94 0A 6 -2,-0.4 2,-0.3 34,-0.2 36,-0.2 -0.985 6.3 171.0-143.2 129.4 10.6 50.8 37.3 60 64 A S E d 95 0A 49 34,-2.4 36,-2.9 -2,-0.4 -2,-0.0 -0.974 360.0 360.0-140.3 153.3 6.9 49.9 37.5 61 65 A M 0 0 133 -2,-0.3 36,-0.1 34,-0.2 34,-0.1 -0.749 360.0 360.0-135.8 360.0 4.7 46.8 37.9 62 ! 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 63 85 A G > 0 0 89 0, 0.0 4,-0.9 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -84.3 7.7 52.3 48.2 64 86 A R H > + 0 0 174 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.659 360.0 72.7 -75.9 -13.9 9.6 49.0 47.6 65 87 A T H > S+ 0 0 61 1,-0.2 4,-2.3 2,-0.2 3,-0.3 0.953 91.5 53.3 -63.3 -47.7 9.5 50.2 44.0 66 88 A M H > S+ 0 0 118 1,-0.2 4,-2.6 -3,-0.2 -1,-0.2 0.892 104.6 57.7 -51.9 -43.1 12.1 52.9 44.9 67 89 A E H X S+ 0 0 77 -4,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.917 108.9 43.4 -53.8 -49.9 14.3 50.1 46.3 68 90 A I H X S+ 0 0 11 -4,-1.7 4,-2.4 -3,-0.3 -1,-0.2 0.852 111.4 53.8 -67.8 -36.9 14.3 48.2 43.0 69 91 A Q H X S+ 0 0 45 -4,-2.3 4,-2.2 1,-0.2 -12,-0.3 0.915 110.8 47.5 -62.5 -42.2 14.8 51.4 40.9 70 92 A R H X S+ 0 0 138 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.880 110.4 51.7 -66.9 -38.3 17.9 52.1 43.1 71 93 A L H X S+ 0 0 14 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.911 109.4 50.0 -64.6 -43.8 19.2 48.5 42.8 72 94 A I H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 5,-0.2 0.938 112.0 47.2 -61.4 -47.1 18.9 48.7 39.0 73 95 A G H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.901 114.7 47.9 -60.8 -41.3 20.8 52.0 38.9 74 96 A R H X S+ 0 0 106 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.937 110.0 49.5 -62.3 -55.4 23.5 50.6 41.2 75 97 A A H X S+ 0 0 0 -4,-2.8 4,-0.7 1,-0.2 3,-0.3 0.909 113.4 46.3 -54.5 -47.0 24.1 47.4 39.4 76 98 A L H >< S+ 0 0 0 -4,-2.0 3,-1.6 -5,-0.2 -1,-0.2 0.938 108.5 54.8 -63.7 -46.4 24.5 49.0 36.0 77 99 A R H >< S+ 0 0 66 -4,-2.0 3,-1.0 1,-0.3 5,-0.2 0.771 98.5 66.2 -58.0 -26.6 26.8 51.7 37.3 78 100 A A H 3< S+ 0 0 60 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.784 107.6 37.8 -66.8 -29.2 29.0 49.0 38.7 79 101 A V T << S+ 0 0 1 -3,-1.6 55,-1.9 -4,-0.7 56,-0.8 0.039 103.7 80.2-113.0 27.2 29.9 47.7 35.2 80 102 A V B < S-E 133 0B 8 -3,-1.0 2,-1.3 53,-0.2 53,-0.2 -0.975 72.6-134.8-137.3 123.0 30.1 51.1 33.3 81 103 A D >> - 0 0 61 51,-2.9 4,-0.9 -2,-0.4 3,-0.7 -0.623 21.7-163.9 -73.3 96.2 33.1 53.5 33.3 82 104 A L H 3> S+ 0 0 35 -2,-1.3 -29,-3.2 1,-0.2 4,-0.6 0.717 83.7 59.2 -58.4 -22.5 31.0 56.6 33.8 83 105 A E H >4 S+ 0 0 116 -31,-0.2 3,-0.7 1,-0.2 -1,-0.2 0.891 103.8 49.6 -73.4 -39.9 33.9 58.8 32.7 84 106 A K H <4 S+ 0 0 103 -3,-0.7 46,-0.3 1,-0.2 -1,-0.2 0.647 103.5 62.8 -71.2 -16.5 34.1 57.1 29.3 85 107 A L H 3< S- 0 0 0 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.739 102.8-139.5 -79.6 -24.9 30.4 57.7 28.9 86 108 A G << - 0 0 16 -3,-0.7 2,-1.8 -4,-0.6 -1,-0.2 -0.170 43.8 -40.8 86.9 172.7 30.8 61.4 29.1 87 109 A E S S+ 0 0 68 -34,-0.1 2,-0.3 -36,-0.1 -34,-0.2 -0.537 104.4 94.9 -78.5 84.2 28.6 63.9 30.9 88 110 A R - 0 0 28 -2,-1.8 -34,-1.7 -47,-0.1 2,-0.4 -0.961 65.1-122.5-163.2 155.5 25.2 62.4 30.1 89 111 A T E -Cd 40 54A 7 -49,-2.2 -49,-2.3 -47,-0.7 2,-0.6 -0.886 9.1-139.8-116.1 144.4 22.8 60.1 31.8 90 112 A I E -Cd 39 55A 0 -36,-2.7 -34,-2.3 -2,-0.4 2,-0.6 -0.878 17.6-153.6 -98.7 117.2 21.3 56.8 30.7 91 113 A W E -Cd 38 56A 85 -53,-3.7 -53,-2.4 -2,-0.6 2,-0.4 -0.808 8.8-165.8 -94.1 121.3 17.6 56.4 31.6 92 114 A I E -Cd 37 57A 1 -36,-2.7 -34,-3.6 -2,-0.6 2,-0.4 -0.871 2.5-169.1-106.5 137.1 16.4 52.8 32.1 93 115 A D E -Cd 36 58A 58 -57,-3.0 -57,-2.7 -2,-0.4 2,-0.4 -0.979 2.8-174.2-131.3 122.7 12.7 52.0 32.2 94 116 A C E -Cd 35 59A 0 -36,-2.4 -34,-2.4 -2,-0.4 2,-0.4 -0.932 5.2-174.3-116.8 138.6 11.3 48.7 33.2 95 117 A D E -Cd 34 60A 61 -61,-2.0 -61,-2.5 -2,-0.4 2,-0.8 -0.966 19.0-143.6-133.2 113.7 7.6 47.6 33.1 96 118 A V E +C 33 0A 15 -36,-2.9 -63,-0.2 -2,-0.4 3,-0.1 -0.679 23.5 173.1 -77.9 112.7 6.7 44.3 34.6 97 119 A I E S+ 0 0 88 -65,-1.6 2,-0.3 -2,-0.8 -64,-0.2 0.670 70.8 20.7 -95.2 -17.3 3.9 43.0 32.3 98 120 A Q E -C 32 0A 89 -66,-1.8 -66,-2.5 5,-0.0 2,-0.6 -0.936 69.5-157.8-153.1 125.2 3.7 39.6 33.9 99 121 A A + 0 0 55 -2,-0.3 -68,-0.1 -68,-0.2 3,-0.1 -0.898 32.9 139.7-114.3 118.1 4.8 38.4 37.3 100 122 A D S S- 0 0 34 -2,-0.6 56,-0.8 1,-0.4 -70,-0.3 -0.204 76.7 -56.4-144.0 46.9 5.6 34.9 38.3 101 123 A G S S+ 0 0 10 54,-0.4 -1,-0.4 55,-0.1 55,-0.2 0.342 114.4 47.9 89.4 139.9 8.7 35.1 40.5 102 124 A G > + 0 0 15 53,-0.2 4,-2.2 -3,-0.1 5,-0.2 0.703 59.5 140.6 72.7 21.3 12.1 36.7 39.8 103 125 A T H > + 0 0 22 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.929 69.0 52.9 -60.9 -45.8 10.9 40.0 38.4 104 126 A R H > S+ 0 0 33 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.903 114.3 39.7 -59.0 -45.6 13.5 42.1 40.1 105 127 A T H > S+ 0 0 5 1,-0.2 4,-2.0 2,-0.2 34,-0.4 0.861 113.9 55.2 -74.2 -33.1 16.5 40.1 38.8 106 128 A A H X S+ 0 0 8 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.840 104.9 54.7 -65.8 -33.0 14.8 39.7 35.4 107 129 A S H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 -1,-0.2 0.883 106.6 51.2 -66.7 -38.3 14.6 43.5 35.2 108 130 A I H X S+ 0 0 0 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.943 111.2 46.0 -63.9 -49.2 18.3 43.8 35.8 109 131 A T H X S+ 0 0 1 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.933 118.3 43.0 -59.9 -48.6 19.2 41.4 33.1 110 132 A G H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.901 111.3 55.1 -64.8 -41.1 16.8 43.0 30.7 111 133 A A H X S+ 0 0 0 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.836 105.7 54.2 -60.3 -34.7 17.9 46.5 31.8 112 134 A F H X S+ 0 0 3 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.947 108.3 46.6 -66.2 -50.8 21.5 45.6 31.0 113 135 A L H X S+ 0 0 1 -4,-1.7 4,-3.0 2,-0.2 -2,-0.2 0.939 111.3 52.0 -55.6 -50.6 20.8 44.5 27.4 114 136 A A H X S+ 0 0 1 -4,-2.3 4,-2.2 1,-0.2 -77,-0.2 0.898 112.1 46.9 -53.9 -42.8 18.7 47.7 26.8 115 137 A M H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.930 110.2 52.7 -65.1 -44.9 21.6 49.7 28.1 116 138 A A H X S+ 0 0 13 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.911 109.2 50.6 -56.6 -43.7 24.1 47.8 26.0 117 139 A I H X S+ 0 0 30 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.919 111.6 46.1 -62.9 -44.3 21.9 48.5 22.9 118 140 A A H X S+ 0 0 12 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.886 112.7 50.2 -66.8 -37.1 21.8 52.3 23.6 119 141 A I H X S+ 0 0 2 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.831 104.8 58.7 -70.5 -30.9 25.5 52.4 24.2 120 142 A G H X S+ 0 0 27 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.910 107.3 46.2 -63.5 -41.3 26.2 50.6 21.0 121 143 A K H X S+ 0 0 112 -4,-1.5 4,-1.6 2,-0.2 6,-0.3 0.817 108.9 56.0 -69.8 -31.1 24.4 53.3 19.1 122 144 A L H <>S+ 0 0 18 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