==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 28-MAY-13 4KYB . COMPND 2 MOLECULE: DESIGNED PROTEIN OR342; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; . AUTHOR A.KUZIN,S.LEW,S.RAJAGOPALAN,J.SEETHARAMAN,L.MAO,R.XIAO,D.LEE . 318 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15327.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 16.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 3.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 28 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 29.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 1 0 0 0 3 2 0 1 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 0 3 1 2 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 . 0 0 0 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 2 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 2 A A 0 0 5 0, 0.0 139,-0.1 0, 0.0 136,-0.1 0.000 360.0 360.0 360.0 133.2 0.6 8.6 -11.6 2 3 A R - 0 0 190 137,-0.4 139,-1.2 135,-0.1 2,-0.5 -0.292 360.0-147.3 -59.3 143.1 -1.7 8.5 -8.6 3 4 A I E -a 141 0A 39 137,-0.1 2,-0.2 139,-0.0 139,-0.2 -0.934 10.3-162.1-128.6 112.4 -5.4 8.4 -9.5 4 5 A R E -a 142 0A 164 137,-2.1 139,-2.8 -2,-0.5 2,-0.4 -0.600 11.1-155.2 -86.7 148.4 -8.4 9.9 -7.6 5 6 A D E +a 143 0A 11 -2,-0.2 2,-0.3 137,-0.2 139,-0.2 -0.857 23.4 156.9-133.8 102.4 -11.9 8.6 -8.3 6 7 A V E -a 144 0A 30 137,-2.1 139,-2.6 -2,-0.4 2,-0.5 -0.890 40.9-125.7-125.2 151.3 -15.0 10.7 -7.7 7 8 A Q E +a 145 0A 91 -2,-0.3 2,-0.3 137,-0.2 139,-0.2 -0.810 65.1 101.0 -82.8 133.6 -18.6 11.0 -8.9 8 9 A G S S- 0 0 28 137,-2.2 2,-0.4 -2,-0.5 3,-0.0 -0.863 73.4 -73.2-173.7-150.7 -19.1 14.6 -10.1 9 10 A D >> - 0 0 68 -2,-0.3 3,-2.0 1,-0.1 4,-0.8 -0.989 27.8-139.8-135.1 130.9 -19.4 16.6 -13.2 10 11 A I T 34 S+ 0 0 6 -2,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.762 100.3 63.4 -59.6 -25.5 -16.3 17.4 -15.3 11 12 A T T 34 S+ 0 0 4 1,-0.2 -1,-0.3 56,-0.1 58,-0.0 0.444 103.3 49.6 -86.6 3.9 -17.4 21.0 -15.9 12 13 A E T <4 S+ 0 0 120 -3,-2.0 -1,-0.2 55,-0.1 -2,-0.2 0.606 82.7 121.1-106.9 -21.8 -17.2 21.7 -12.2 13 14 A F < - 0 0 31 -4,-0.8 2,-0.6 -3,-0.4 95,-0.1 -0.188 52.3-148.9 -52.6 121.2 -13.7 20.3 -11.7 14 15 A Q + 0 0 142 55,-0.0 2,-0.2 53,-0.0 55,-0.2 -0.825 52.3 79.4 -93.6 118.8 -11.1 22.8 -10.4 15 16 A G S S- 0 0 19 53,-1.2 92,-0.1 -2,-0.6 3,-0.1 -0.872 87.4 -63.5-178.1-149.3 -7.6 22.0 -11.6 16 17 A D S S+ 0 0 35 90,-2.1 55,-1.1 1,-0.3 54,-0.5 0.712 103.2 5.1-103.6 -24.3 -5.1 22.4 -14.5 17 18 A A E -bc 71 107A 0 89,-1.2 91,-3.2 53,-0.2 2,-0.4 -0.957 49.0-152.8-159.3 139.3 -6.7 20.3 -17.3 18 19 A I E -bc 72 108A 1 53,-1.6 55,-2.7 -2,-0.3 2,-0.5 -0.951 20.3-151.7-106.9 137.9 -9.8 18.4 -18.2 19 20 A V E +bc 73 109A 1 89,-4.2 91,-1.7 -2,-0.4 2,-0.4 -0.935 17.8 179.6-113.5 117.2 -9.4 15.6 -20.7 20 21 A N E -b 74 0A 10 53,-2.1 55,-2.0 -2,-0.5 2,-0.5 -0.935 29.2-119.4-123.5 144.6 -12.3 14.6 -22.9 21 22 A A E +b 75 0A 4 -2,-0.4 2,-0.2 53,-0.2 93,-0.2 -0.667 45.5 153.6 -76.1 119.1 -12.9 12.1 -25.6 22 23 A A E -b 76 0A 11 53,-1.0 55,-2.3 -2,-0.5 56,-1.0 -0.684 43.6 -88.8-125.6-170.0 -13.8 13.7 -29.0 23 24 A N E > -b 78 0A 10 -2,-0.2 3,-0.5 53,-0.2 56,-0.2 -0.338 42.6-100.5 -88.7 178.5 -13.4 12.7 -32.6 24 25 A N T 3 S+ 0 0 0 54,-1.1 30,-2.5 1,-0.2 55,-0.1 0.730 122.2 63.2 -74.0 -17.8 -10.5 13.5 -34.8 25 26 A Y T 3 S- 0 0 27 28,-0.2 -1,-0.2 218,-0.2 27,-0.1 0.788 99.4-138.5 -72.0 -27.6 -12.5 16.4 -36.3 26 27 A L < + 0 0 0 -3,-0.5 2,-0.7 1,-0.2 -2,-0.1 0.760 52.0 144.0 71.7 31.4 -12.6 18.0 -32.8 27 28 A K - 0 0 29 216,-0.1 -1,-0.2 22,-0.0 2,-0.2 -0.881 55.5-119.0-108.9 107.6 -16.2 19.0 -33.3 28 29 A L - 0 0 9 -2,-0.7 -6,-0.1 5,-0.1 216,-0.1 -0.172 35.6-171.0 -57.3 107.8 -18.0 18.8 -29.9 29 30 A G - 0 0 28 -2,-0.2 2,-0.2 1,-0.2 8,-0.1 0.510 32.5 -58.2 -71.6-139.0 -20.8 16.3 -30.0 30 31 A A S > S+ 0 0 92 3,-0.1 3,-0.8 4,-0.1 2,-0.3 -0.476 94.5 33.1-104.5 175.2 -23.5 15.6 -27.5 31 32 A G T 3> S- 0 0 62 1,-0.2 4,-1.7 2,-0.2 5,-0.1 -0.629 127.1 -10.9 81.0-136.5 -23.3 14.5 -23.8 32 33 A V H 3> S+ 0 0 65 -2,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.860 134.8 61.4 -66.9 -35.8 -20.4 15.7 -21.7 33 34 A A H <> S+ 0 0 11 -3,-0.8 4,-1.7 1,-0.2 -1,-0.2 0.888 108.5 43.9 -58.8 -38.4 -18.7 17.0 -24.8 34 35 A G H > S+ 0 0 21 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.851 108.4 57.2 -71.7 -35.9 -21.7 19.2 -25.3 35 36 A A H X S+ 0 0 33 -4,-1.7 4,-1.8 1,-0.2 5,-0.2 0.820 107.8 49.9 -63.9 -29.0 -21.6 20.1 -21.6 36 37 A I H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 5,-0.4 0.917 109.7 48.5 -74.2 -46.6 -18.1 21.3 -22.1 37 38 A L H X S+ 0 0 57 -4,-1.7 4,-1.9 3,-0.2 -2,-0.2 0.910 114.1 48.3 -58.2 -43.4 -18.9 23.5 -25.1 38 39 A R H < S+ 0 0 195 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.953 119.8 32.2 -67.9 -53.5 -21.8 25.0 -23.2 39 40 A K H < S+ 0 0 63 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.749 123.1 48.0 -76.3 -26.5 -20.2 25.9 -19.9 40 41 A G H < S- 0 0 1 -4,-2.2 26,-3.2 -5,-0.2 3,-0.2 0.855 110.1-138.7 -79.0 -36.0 -16.8 26.6 -21.4 41 42 A G >X - 0 0 13 -4,-1.9 4,-0.7 -5,-0.4 3,-0.5 -0.455 30.9 -54.6 104.8-179.1 -18.4 28.7 -24.1 42 43 A P H 3> S+ 0 0 92 0, 0.0 4,-1.8 0, 0.0 3,-0.2 0.744 119.7 76.5 -67.7 -24.2 -18.0 29.3 -27.9 43 44 A S H 3> S+ 0 0 49 -3,-0.2 4,-1.9 1,-0.2 5,-0.2 0.905 90.3 54.1 -55.3 -47.8 -14.3 30.0 -27.4 44 45 A I H <> S+ 0 0 0 -3,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.904 108.8 47.4 -53.8 -46.8 -13.5 26.3 -26.9 45 46 A Q H X S+ 0 0 30 -4,-0.7 4,-1.2 1,-0.2 -1,-0.2 0.834 108.3 56.1 -69.1 -31.2 -15.1 25.3 -30.2 46 47 A E H X S+ 0 0 112 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.891 105.6 50.6 -65.8 -40.3 -13.4 28.2 -32.1 47 48 A E H X S+ 0 0 52 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.872 108.4 53.6 -63.4 -37.8 -9.9 26.9 -31.0 48 49 A C H X S+ 0 0 0 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.766 108.6 49.2 -67.2 -29.4 -10.9 23.4 -32.2 49 50 A D H < S+ 0 0 77 -4,-1.2 -2,-0.2 2,-0.2 -1,-0.2 0.929 109.0 51.1 -74.8 -46.6 -11.8 24.8 -35.6 50 51 A R H < S+ 0 0 177 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.817 111.0 50.6 -57.9 -33.0 -8.5 26.7 -35.9 51 52 A I H < S- 0 0 70 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.916 96.1-167.1 -68.4 -45.7 -6.6 23.5 -35.0 52 53 A G < - 0 0 23 -4,-1.5 -1,-0.1 -27,-0.1 -2,-0.1 -0.170 39.4 -17.5 76.6 179.8 -8.5 21.5 -37.6 53 54 A K - 0 0 85 -4,-0.1 2,-0.2 1,-0.0 -28,-0.2 -0.194 60.2-172.5 -59.6 139.1 -8.6 17.8 -38.0 54 55 A I - 0 0 19 -30,-2.5 2,-0.3 4,-0.1 6,-0.1 -0.687 31.9 -88.8-116.7 179.6 -5.9 15.6 -36.2 55 56 A R > - 0 0 124 -2,-0.2 3,-1.5 1,-0.1 21,-0.2 -0.665 44.1 -97.5 -91.6 146.1 -5.3 11.9 -36.4 56 57 A V T 3 S+ 0 0 41 -2,-0.3 2,-0.2 1,-0.2 21,-0.2 -0.326 115.1 34.7 -52.5 143.1 -7.0 9.2 -34.3 57 58 A G T 3 S+ 0 0 3 19,-2.3 37,-0.3 1,-0.4 -1,-0.2 -0.312 101.9 96.1 96.8 -47.6 -4.6 8.4 -31.5 58 59 A E < - 0 0 98 -3,-1.5 18,-1.4 -2,-0.2 -1,-0.4 -0.099 63.0-143.5 -70.8 170.2 -3.3 12.0 -31.2 59 60 A A E -D 75 0A 11 16,-0.2 2,-0.4 35,-0.2 16,-0.2 -0.982 5.4-151.3-136.7 148.3 -4.6 14.7 -28.8 60 61 A A E -D 74 0A 7 14,-2.3 14,-3.5 -2,-0.3 2,-0.5 -0.952 8.0-141.6-125.0 144.2 -5.1 18.4 -29.2 61 62 A V E +D 73 0A 38 -2,-0.4 2,-0.3 12,-0.2 12,-0.2 -0.900 25.1 164.0-112.5 121.4 -4.9 21.2 -26.6 62 63 A T E -D 72 0A 3 10,-2.2 10,-2.5 -2,-0.5 -18,-0.1 -0.793 40.8 -89.8-120.5 169.1 -7.3 24.2 -26.5 63 64 A G E -D 71 0A 16 -2,-0.3 8,-0.2 8,-0.2 -1,-0.1 -0.194 30.1-125.4 -72.4 173.6 -8.1 26.8 -23.9 64 65 A A > - 0 0 5 6,-1.3 3,-2.2 1,-0.3 5,-0.1 0.438 28.0-163.1-108.5 -3.8 -10.9 26.3 -21.3 65 66 A G T 3 S- 0 0 44 1,-0.3 -1,-0.3 5,-0.2 -24,-0.2 -0.304 74.6 -8.0 56.8-127.9 -13.0 29.4 -21.8 66 67 A N T 3 S+ 0 0 134 -26,-3.2 -1,-0.3 -27,-0.1 -26,-0.2 0.397 107.4 113.7 -83.9 4.8 -15.4 29.9 -18.8 67 68 A L S < S- 0 0 9 -3,-2.2 2,-2.3 -27,-0.2 -3,-0.1 -0.554 81.9-113.2 -74.7 136.7 -14.5 26.5 -17.3 68 69 A P S S+ 0 0 53 0, 0.0 -53,-1.2 0, 0.0 2,-0.2 0.055 93.2 75.9 -56.3 31.5 -12.6 26.6 -14.0 69 70 A V S S- 0 0 25 -2,-2.3 -53,-0.1 -55,-0.2 -5,-0.1 -0.455 78.0-128.2-121.3-161.3 -9.5 25.1 -15.7 70 71 A R S S+ 0 0 121 -54,-0.5 -6,-1.3 1,-0.4 2,-0.3 0.643 84.3 15.1-110.7 -47.4 -6.7 26.3 -18.0 71 72 A Y E -bD 17 63A 69 -55,-1.1 -53,-1.6 -8,-0.2 2,-0.4 -0.865 55.1-145.4-129.2 153.4 -6.9 23.8 -20.8 72 73 A V E -bD 18 62A 0 -10,-2.5 -10,-2.2 -2,-0.3 2,-0.6 -0.996 19.7-149.2-114.9 131.3 -9.1 21.1 -22.3 73 74 A I E -bD 19 61A 0 -55,-2.7 -53,-2.1 -2,-0.4 2,-0.9 -0.897 6.5-151.8-101.4 115.2 -7.2 18.2 -23.8 74 75 A H E -bD 20 60A 1 -14,-3.5 -14,-2.3 -2,-0.6 2,-1.0 -0.776 6.5-162.2 -92.2 104.1 -9.1 16.6 -26.7 75 76 A A E -bD 21 59A 0 -55,-2.0 -53,-1.0 -2,-0.9 2,-0.6 -0.773 15.2-140.8 -91.0 100.4 -8.1 12.9 -26.9 76 77 A A E +b 22 0A 0 -18,-1.4 -19,-2.3 -2,-1.0 -53,-0.2 -0.465 40.6 151.5 -67.0 106.0 -9.1 11.8 -30.4 77 78 A V E + 0 0 2 -55,-2.3 7,-0.4 -2,-0.6 2,-0.3 0.706 55.5 39.9-115.1 -29.5 -10.6 8.3 -29.9 78 79 A L E +b 23 0A 23 -56,-1.0 -54,-1.1 5,-0.1 -1,-0.2 -0.959 57.6 118.8-128.7 148.6 -13.1 7.8 -32.7 79 80 A G S S- 0 0 1 -2,-0.3 164,-0.3 -56,-0.2 -1,-0.1 0.165 85.7 -13.7-165.0 -73.1 -13.1 8.7 -36.4 80 81 A D S S+ 0 0 47 2,-0.1 167,-0.2 162,-0.1 3,-0.1 0.717 138.8 19.8-113.2 -47.0 -13.2 6.1 -39.1 81 82 A E S S- 0 0 131 1,-0.3 2,-0.1 165,-0.1 166,-0.1 0.868 103.0-173.3 -66.4 -49.6 -12.5 2.7 -37.5 82 83 A P + 0 0 24 0, 0.0 2,-1.1 0, 0.0 -1,-0.3 -0.829 30.6 26.2-124.0 -40.8 -13.3 4.0 -34.8 83 84 A A + 0 0 21 -2,-0.1 2,-0.2 -3,-0.1 -5,-0.1 -0.735 63.4 157.7-101.3 89.1 -13.3 2.9 -31.1 84 85 A S > - 0 0 41 -2,-1.1 4,-1.8 -7,-0.4 5,-0.1 -0.654 51.3-120.0-100.5 160.2 -10.6 0.3 -30.6 85 86 A L H > S+ 0 0 66 -2,-0.2 4,-2.2 2,-0.2 5,-0.1 0.952 119.0 47.8 -63.6 -46.1 -8.8 -0.6 -27.3 86 87 A E H > S+ 0 0 127 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.883 108.2 56.8 -60.1 -39.2 -5.4 0.3 -28.9 87 88 A T H > S+ 0 0 20 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.920 107.6 46.5 -55.7 -44.2 -7.1 3.5 -30.1 88 89 A V H X S+ 0 0 1 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.879 110.2 54.0 -70.0 -35.5 -8.0 4.4 -26.5 89 90 A R H X S+ 0 0 57 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.916 109.2 47.8 -62.4 -46.2 -4.5 3.5 -25.3 90 91 A K H X S+ 0 0 78 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.810 112.3 50.5 -59.4 -34.3 -2.9 5.9 -27.8 91 92 A A H X S+ 0 0 0 -4,-1.3 4,-1.3 2,-0.2 -2,-0.2 0.827 111.7 44.7 -83.5 -35.4 -5.3 8.7 -26.9 92 93 A T H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.894 115.3 49.4 -69.3 -44.8 -4.8 8.5 -23.1 93 94 A K H X S+ 0 0 103 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.871 113.0 46.5 -62.6 -39.7 -1.0 8.3 -23.7 94 95 A S H X S+ 0 0 12 -4,-1.8 4,-2.0 -37,-0.3 -1,-0.2 0.845 111.0 52.7 -73.0 -32.3 -1.1 11.2 -26.0 95 96 A A H X S+ 0 0 0 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.919 111.5 45.5 -68.8 -42.8 -3.3 13.2 -23.6 96 97 A L H X S+ 0 0 8 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.904 108.8 56.0 -67.5 -44.1 -0.9 12.6 -20.7 97 98 A E H X S+ 0 0 88 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.942 108.1 49.9 -42.3 -56.1 2.1 13.5 -22.9 98 99 A K H X S+ 0 0 62 -4,-2.0 4,-1.3 1,-0.2 -1,-0.2 0.793 108.7 51.4 -63.2 -32.6 0.5 16.8 -23.6 99 100 A A H <>S+ 0 0 1 -4,-1.5 5,-2.1 2,-0.2 4,-0.4 0.902 110.9 47.9 -68.0 -43.3 -0.1 17.4 -19.9 100 101 A V H ><5S+ 0 0 64 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.886 109.4 54.5 -65.6 -38.6 3.5 16.7 -19.1 101 102 A E H 3<5S+ 0 0 126 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.863 108.5 48.6 -55.2 -39.5 4.5 19.1 -22.0 102 103 A L T 3<5S- 0 0 56 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.401 114.1-114.4 -92.8 2.5 2.5 21.9 -20.5 103 104 A G T < 5 + 0 0 47 -3,-0.9 -3,-0.2 -4,-0.4 2,-0.1 0.869 55.4 170.2 71.0 40.2 3.8 21.5 -17.0 104 105 A L < - 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0 0 82 0, 0.0 4,-1.0 0, 0.0 3,-0.5 -0.600 31.2-141.9 -73.6 149.9 -15.1 -3.9 -45.1 285 122 B A H 3> S+ 0 0 48 1,-0.2 4,-2.9 -2,-0.2 5,-0.2 0.797 94.5 57.2 -93.1 -29.9 -15.5 -2.8 -48.7 286 123 B E H 34 S+ 0 0 159 1,-0.2 -1,-0.2 2,-0.2 0, 0.0 0.053 111.6 48.9 -85.2 24.8 -17.3 -5.8 -50.3 287 124 B A H <> S+ 0 0 12 -3,-0.5 4,-1.6 3,-0.1 -2,-0.2 0.479 112.2 44.5-129.6 -36.7 -19.9 -5.1 -47.7 288 125 B V H X S+ 0 0 1 -4,-1.0 4,-2.2 2,-0.2 5,-0.3 0.932 113.9 50.1 -71.0 -52.5 -20.2 -1.4 -48.3 289 126 B C H X S+ 0 0 31 -4,-2.9 4,-1.7 1,-0.2 -3,-0.2 0.920 110.7 53.6 -50.1 -40.4 -20.2 -2.0 -52.0 290 127 B R H > S+ 0 0 135 -5,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.922 110.6 43.3 -62.4 -44.2 -22.9 -4.6 -51.4 291 128 B V H X S+ 0 0 6 -4,-1.6 4,-1.1 2,-0.2 -1,-0.2 0.752 111.0 53.1 -77.2 -24.9 -25.2 -2.2 -49.4 292 129 B M H X S+ 0 0 14 -4,-2.2 4,-2.4 2,-0.2 3,-0.4 0.925 107.3 52.2 -71.3 -44.7 -24.9 0.9 -51.7 293 130 B R H X S+ 0 0 80 -4,-1.7 4,-1.1 -5,-0.3 -1,-0.2 0.720 106.4 57.0 -60.4 -22.7 -25.9 -1.2 -54.7 294 131 B E H X S+ 0 0 77 -4,-0.6 4,-0.5 2,-0.2 -1,-0.2 0.859 109.0 43.0 -78.5 -38.1 -29.0 -2.4 -52.8 295 132 B E H >X S+ 0 0 9 -4,-1.1 4,-1.0 -3,-0.4 3,-0.7 0.861 111.6 53.2 -76.0 -36.9 -30.2 1.1 -52.2 296 133 B I H 3< S+ 0 0 10 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.861 102.9 60.3 -67.3 -32.7 -29.5 2.3 -55.7 297 134 B K H 3< S+ 0 0 142 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.752 105.0 48.0 -63.9 -26.1 -31.6 -0.7 -57.0 298 135 B K H << S+ 0 0 151 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.699 91.5 102.7 -88.5 -22.7 -34.6 0.6 -55.2 299 136 B A S < S- 0 0 12 -4,-1.0 4,-0.1 -3,-0.4 -38,-0.1 -0.118 89.4 -78.6 -56.9 157.0 -34.2 4.1 -56.5 300 137 B P > - 0 0 53 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.272 30.1-128.8 -61.9 144.9 -36.5 5.2 -59.4 301 138 B D T 3 S+ 0 0 114 1,-0.3 -135,-0.1 -136,-0.1 -2,-0.1 0.464 103.4 79.0 -74.5 0.7 -35.6 4.1 -62.9 302 139 B T T 3 S+ 0 0 121 2,-0.0 2,-0.4 -137,-0.0 -1,-0.3 0.365 84.9 84.3 -82.1 3.9 -35.9 7.7 -64.1 303 140 B L < - 0 0 3 -3,-1.5 -137,-0.6 -4,-0.1 2,-0.5 -0.897 65.7-163.0-102.4 134.4 -32.4 7.7 -62.5 304 141 B E E -fj 166 270B 69 -35,-1.8 -33,-1.5 -2,-0.4 2,-0.6 -0.949 14.8-162.4-115.7 110.8 -29.4 6.6 -64.5 305 142 B V E -fj 167 271B 0 -139,-1.5 -137,-2.0 -2,-0.5 2,-0.5 -0.820 10.4-168.4-103.9 115.5 -26.5 5.9 -62.1 306 143 B T E -fj 168 272B 13 -35,-2.3 -33,-2.0 -2,-0.6 2,-0.5 -0.848 11.5-152.3 -92.1 129.7 -22.9 5.7 -63.2 307 144 B G E -fj 169 273B 4 -139,-4.4 -137,-1.8 -2,-0.5 2,-0.6 -0.929 12.2-148.3-102.5 123.9 -20.5 4.3 -60.6 308 145 B V E -fj 170 274B 12 -35,-2.6 -33,-1.1 -2,-0.5 2,-0.4 -0.815 11.0-163.3-105.3 122.1 -17.0 5.6 -61.0 309 146 B H E -f 171 0B 4 -139,-1.8 -137,-2.4 -2,-0.6 6,-0.1 -0.809 20.5-145.8-109.3 139.1 -14.0 3.5 -60.1 310 147 B G S S+ 0 0 56 -2,-0.4 2,-0.3 -139,-0.2 -1,-0.1 0.912 84.3 50.6 -64.3 -44.2 -10.4 4.6 -59.5 311 148 B T S > S- 0 0 81 1,-0.1 4,-1.9 -140,-0.1 5,-0.1 -0.674 73.1-134.6-103.2 150.6 -9.0 1.4 -60.9 312 149 B E H > S+ 0 0 111 -2,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.877 110.6 52.3 -57.0 -42.9 -9.5 -0.6 -64.2 313 150 B K H >> S+ 0 0 176 1,-0.2 3,-1.9 2,-0.2 4,-0.8 0.991 108.7 47.2 -61.1 -63.2 -9.6 -3.7 -62.0 314 151 B S H >4 S+ 0 0 38 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.842 106.5 58.0 -46.2 -44.8 -12.3 -2.5 -59.6 315 152 B A H 3< S+ 0 0 13 -4,-1.9 4,-0.4 1,-0.3 -1,-0.3 0.705 110.1 44.5 -64.4 -20.6 -14.6 -1.2 -62.4 316 153 B E H << S+ 0 0 118 -3,-1.9 -1,-0.3 -4,-0.7 -2,-0.2 0.520 88.9 89.0 -98.0 -10.3 -14.7 -4.7 -64.0 317 154 B A S << S+ 0 0 54 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.1 0.889 87.8 49.5 -60.3 -46.4 -15.3 -6.5 -60.7 318 155 B P 0 0 45 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.986 360.0 360.0 -43.1 -80.4 -19.1 -6.1 -60.9 319 156 B R 0 0 251 -4,-0.4 -3,-0.1 0, 0.0 -2,-0.1 0.301 360.0 360.0 177.6 360.0 -18.7 -7.5 -64.5