==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-MAY-02 1LW7 . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR NADR; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR S.K.SINGH,O.V.KURNASOV,B.CHEN,H.ROBINSON,N.V.GRISHIN,A.L.OST . 344 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18641.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 243 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 2 0.6 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 . 15 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 35.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.0 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 2 1 0 1 1 2 2 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 3 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 57 A E 0 0 233 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -94.5 95.2 10.0 66.9 2 58 A K - 0 0 122 2,-0.0 27,-0.0 0, 0.0 0, 0.0 0.909 360.0-132.6 90.3 82.4 93.1 12.7 65.2 3 59 A K - 0 0 138 108,-0.0 27,-1.0 109,-0.0 28,-0.7 -0.241 25.1-168.8 -59.7 147.8 89.7 11.5 63.9 4 60 A V E -a 31 0A 11 26,-0.1 108,-2.7 25,-0.1 109,-0.8 -0.952 4.1-171.1-148.7 123.5 88.8 12.6 60.3 5 61 A G E -ab 32 113A 0 26,-1.7 28,-3.5 -2,-0.3 2,-0.2 -0.803 7.1-153.9-119.4 159.5 85.6 12.4 58.3 6 62 A V E -ab 33 114A 0 107,-1.9 109,-1.8 -2,-0.3 2,-0.3 -0.735 3.9-166.1-119.2 168.8 84.2 13.0 54.8 7 63 A I E -a 34 0A 2 26,-1.2 28,-2.9 -2,-0.2 2,-0.4 -0.966 6.3-154.6-155.6 139.5 80.9 13.8 53.2 8 64 A F E +a 35 0A 27 107,-0.5 2,-0.3 -2,-0.3 28,-0.2 -0.907 25.7 141.8-120.8 147.0 79.7 13.7 49.7 9 65 A G E -a 36 0A 16 26,-1.0 28,-3.4 -2,-0.4 -2,-0.0 -0.984 48.8-139.2-168.2 171.2 77.0 15.7 48.0 10 66 A K - 0 0 114 -2,-0.3 -1,-0.1 26,-0.2 4,-0.1 0.635 33.5-160.5-108.6 -31.4 75.8 17.4 44.9 11 67 A F + 0 0 7 1,-0.2 3,-0.3 2,-0.1 54,-0.1 0.950 14.8 179.2 43.4 67.2 74.4 20.3 47.0 12 68 A Y S S- 0 0 4 1,-0.8 -1,-0.2 49,-0.0 139,-0.2 -0.656 84.9 -8.3-130.5 75.0 72.2 21.5 44.2 13 69 A P S S- 0 0 1 0, 0.0 -1,-0.8 0, 0.0 2,-0.5 0.493 91.6-120.6 -97.4-153.8 71.4 23.5 46.1 14 70 A V - 0 0 2 -3,-0.3 2,-0.2 -2,-0.1 151,-0.2 -0.896 31.6-169.3-104.6 125.2 72.4 23.5 49.7 15 71 A H >> - 0 0 15 -2,-0.5 4,-2.5 146,-0.2 3,-0.7 -0.715 40.8-106.1-113.8 166.8 69.6 23.3 52.3 16 72 A T H 3> S+ 0 0 38 144,-2.3 4,-2.4 1,-0.3 5,-0.1 0.642 119.9 66.9 -60.2 -12.2 69.5 23.7 56.0 17 73 A G H 3> S+ 0 0 15 143,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.935 105.0 37.1 -72.6 -50.8 69.1 20.0 55.9 18 74 A H H <> S+ 0 0 38 -3,-0.7 4,-2.8 2,-0.2 5,-0.2 0.963 116.9 56.1 -60.9 -55.3 72.6 19.3 54.6 19 75 A I H X S+ 0 0 24 -4,-2.5 4,-1.9 1,-0.2 5,-0.2 0.926 106.4 47.0 -44.0 -62.6 73.9 22.2 56.8 20 76 A N H >X S+ 0 0 59 -4,-2.4 4,-2.3 1,-0.2 3,-0.6 0.935 112.6 51.1 -47.4 -53.6 72.6 20.7 60.0 21 77 A X H 3X S+ 0 0 27 -4,-1.9 4,-2.5 1,-0.3 5,-0.3 0.905 106.3 54.0 -48.4 -53.2 74.0 17.3 59.1 22 78 A I H 3X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.2 -1,-0.3 0.829 108.8 48.2 -54.7 -38.1 77.5 18.7 58.3 23 79 A Y H < S+ 0 0 82 -4,-2.3 3,-1.0 1,-0.2 4,-0.4 0.937 110.8 43.7 -50.3 -57.6 76.6 17.1 63.4 25 81 A A H >< S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.3 -1,-0.2 0.867 109.4 60.5 -57.1 -39.5 79.3 15.1 61.7 26 82 A F H >< S+ 0 0 36 -4,-1.9 3,-1.0 -5,-0.3 -1,-0.3 0.781 97.4 56.7 -62.0 -28.2 81.7 18.0 62.6 27 83 A S T << S+ 0 0 70 -4,-1.4 -1,-0.3 -3,-1.0 -2,-0.2 0.545 104.5 55.3 -81.5 -4.9 81.0 17.6 66.3 28 84 A K T < S+ 0 0 115 -3,-1.5 2,-0.3 -4,-0.4 -1,-0.2 0.332 110.4 47.9-104.9 2.3 82.2 14.0 66.0 29 85 A V < - 0 0 14 -3,-1.0 3,-0.2 -4,-0.1 -25,-0.1 -0.924 64.4-139.2-142.2 165.8 85.5 14.9 64.4 30 86 A D S S+ 0 0 79 -27,-1.0 2,-0.3 1,-0.3 -26,-0.1 0.688 100.4 20.8 -94.8 -21.5 88.6 17.1 64.8 31 87 A E E -a 4 0A 38 -28,-0.7 -26,-1.7 -3,-0.0 2,-0.4 -0.939 69.6-167.9-151.8 121.6 88.7 17.6 61.0 32 88 A L E -ac 5 76A 0 43,-1.2 45,-2.7 -2,-0.3 2,-0.6 -0.939 7.5-155.7-117.8 132.7 85.9 17.2 58.4 33 89 A H E -ac 6 77A 8 -28,-3.5 -26,-1.2 -2,-0.4 2,-0.6 -0.926 9.3-161.1-111.8 115.6 86.3 17.2 54.6 34 90 A V E -ac 7 78A 0 43,-3.3 45,-2.2 -2,-0.6 2,-0.5 -0.855 5.0-156.5-103.6 113.2 83.3 18.1 52.6 35 91 A I E -ac 8 79A 0 -28,-2.9 -26,-1.0 -2,-0.6 2,-0.7 -0.743 6.8-159.0 -95.1 125.1 83.2 17.1 48.9 36 92 A V E -ac 9 80A 0 43,-4.0 45,-2.6 -2,-0.5 2,-0.5 -0.909 19.3-158.9-100.3 115.4 81.0 18.9 46.3 37 93 A C E - c 0 81A 4 -28,-3.4 2,-0.3 -2,-0.7 45,-0.2 -0.866 9.9-172.4-105.0 128.8 80.6 16.4 43.5 38 94 A S E - c 0 82A 6 43,-2.6 45,-2.6 -2,-0.5 2,-0.3 -0.799 17.9-168.8-118.2 156.3 79.7 17.6 40.0 39 95 A D >> - 0 0 27 -2,-0.3 4,-3.2 43,-0.2 5,-0.6 -0.839 18.9-146.7-145.5 100.9 78.7 16.0 36.8 40 96 A T H >5S+ 0 0 79 -2,-0.3 4,-1.4 1,-0.2 -1,-0.1 0.784 98.8 33.0 -29.2 -55.5 78.6 18.3 33.8 41 97 A V H >5S+ 0 0 77 2,-0.2 4,-1.6 3,-0.1 -1,-0.2 0.855 120.0 49.0 -79.5 -40.4 75.8 16.6 32.1 42 98 A R H >>5S+ 0 0 44 2,-0.2 4,-2.2 1,-0.2 3,-0.9 0.990 114.9 44.5 -62.7 -58.1 73.9 15.4 35.2 43 99 A D H 3X5S+ 0 0 8 -4,-3.2 4,-2.5 1,-0.3 -2,-0.2 0.920 111.6 55.4 -49.8 -49.8 74.0 18.9 36.8 44 100 A L H 3X<>S+ 0 0 20 -4,-2.5 3,-0.8 -5,-0.2 5,-0.6 0.979 115.8 40.0 -61.1 -58.3 69.1 22.8 36.0 48 104 A Y H 3<5S+ 0 0 165 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.824 111.3 59.0 -60.4 -34.0 67.2 22.8 32.7 49 105 A D H 3<5S+ 0 0 133 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.828 105.5 58.8 -66.3 -30.1 64.7 20.4 34.2 50 106 A S T <<5S- 0 0 14 -4,-1.2 102,-0.1 -3,-0.8 101,-0.1 -0.051 92.1-117.4 -83.6-168.4 64.0 22.9 36.9 51 107 A K T 5 + 0 0 179 100,-0.7 2,-0.2 101,-0.1 -3,-0.1 -0.011 60.4 141.6-123.1 26.6 62.7 26.5 36.4 52 108 A X < - 0 0 18 -5,-0.6 117,-0.1 99,-0.1 -2,-0.1 -0.517 47.5-142.5 -70.3 134.2 65.7 28.2 37.9 53 109 A K S S+ 0 0 123 -2,-0.2 2,-0.3 115,-0.2 -1,-0.1 0.991 82.1 22.8 -61.4 -66.9 66.6 31.4 35.9 54 110 A R S S- 0 0 128 114,-0.1 -1,-0.1 -7,-0.0 0, 0.0 -0.720 84.7-120.0-102.3 153.9 70.4 31.2 36.1 55 111 A X - 0 0 62 -2,-0.3 2,-0.4 -3,-0.0 -11,-0.0 -0.810 22.8-121.9 -99.2 132.8 72.4 28.1 36.7 56 112 A P - 0 0 1 0, 0.0 -9,-0.1 0, 0.0 109,-0.0 -0.548 30.4-139.9 -69.8 123.9 74.7 27.7 39.7 57 113 A T > - 0 0 78 -2,-0.4 4,-2.0 1,-0.1 5,-0.1 -0.123 25.8-104.7 -75.1 178.0 78.3 27.0 38.6 58 114 A V H > S+ 0 0 39 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.917 128.5 49.3 -67.3 -41.6 80.7 24.6 40.3 59 115 A Q H > S+ 0 0 113 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.941 106.9 53.3 -61.0 -47.3 82.3 27.8 41.6 60 116 A D H > S+ 0 0 36 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.908 114.8 43.6 -54.4 -42.7 79.0 29.2 42.8 61 117 A R H >X S+ 0 0 6 -4,-2.0 4,-1.7 2,-0.2 3,-0.5 0.946 111.5 49.1 -70.3 -53.0 78.4 26.0 44.7 62 118 A L H 3X S+ 0 0 41 -4,-3.5 4,-3.6 1,-0.2 5,-0.2 0.946 110.8 54.6 -53.2 -44.0 81.9 25.5 46.2 63 119 A R H 3X S+ 0 0 100 -4,-3.1 4,-2.6 -5,-0.3 -1,-0.2 0.828 101.0 58.2 -58.1 -35.4 81.6 29.2 47.3 64 120 A W H < S+ 0 0 67 -4,-2.6 3,-2.2 -5,-0.2 4,-0.3 0.936 110.1 56.6 -77.7 -53.4 81.1 30.6 52.9 68 124 A I H 3< S+ 0 0 25 -4,-3.0 3,-0.2 1,-0.3 -2,-0.2 0.858 118.1 37.0 -50.4 -37.5 78.6 28.7 55.1 69 125 A F T 3< S+ 0 0 2 -4,-2.6 -1,-0.3 -5,-0.2 7,-0.2 -0.135 82.0 118.6-110.2 38.5 81.5 27.1 56.9 70 126 A K S X S+ 0 0 142 -3,-2.2 3,-3.0 1,-0.2 4,-0.2 0.974 71.5 54.1 -66.3 -57.7 83.9 30.1 56.9 71 127 A Y T 3 S+ 0 0 199 -4,-0.3 3,-0.3 1,-0.3 -1,-0.2 0.803 117.8 39.8 -49.8 -26.7 84.2 30.5 60.6 72 128 A Q T >> S+ 0 0 35 1,-0.2 3,-2.6 2,-0.1 4,-2.4 0.300 76.3 120.7-106.6 12.1 85.2 26.8 60.7 73 129 A K T <4 + 0 0 148 -3,-3.0 -1,-0.2 1,-0.3 -2,-0.1 0.600 65.9 68.9 -51.1 -12.8 87.4 26.9 57.6 74 130 A N T 34 S+ 0 0 107 -3,-0.3 -1,-0.3 -4,-0.2 3,-0.1 0.398 118.8 14.9 -88.6 1.2 90.3 25.8 59.7 75 131 A Q T <4 S+ 0 0 74 -3,-2.6 -43,-1.2 1,-0.4 2,-0.6 0.485 117.3 66.7-140.3 -36.6 88.9 22.3 60.3 76 132 A I E < -c 32 0A 2 -4,-2.4 -1,-0.4 -7,-0.2 2,-0.3 -0.851 68.6-170.6 -95.6 123.1 86.1 21.9 57.8 77 133 A F E -c 33 0A 65 -45,-2.7 -43,-3.3 -2,-0.6 2,-0.4 -0.765 11.6-145.8-114.2 162.9 87.4 21.7 54.3 78 134 A I E +c 34 0A 38 -2,-0.3 2,-0.3 -45,-0.2 -43,-0.2 -0.990 18.6 174.9-135.1 126.8 85.7 21.8 50.9 79 135 A H E -c 35 0A 27 -45,-2.2 -43,-4.0 -2,-0.4 2,-0.5 -0.908 26.1-125.9-131.5 159.1 86.7 20.0 47.7 80 136 A H E -c 36 0A 70 -2,-0.3 2,-0.5 -45,-0.2 -43,-0.2 -0.900 18.7-165.6-107.2 126.3 85.4 19.4 44.3 81 137 A L E -c 37 0A 6 -45,-2.6 -43,-2.6 -2,-0.5 2,-0.7 -0.964 9.6-149.8-114.5 124.7 85.0 15.9 42.9 82 138 A V E +c 38 0A 87 -2,-0.5 2,-0.5 -45,-0.2 -43,-0.2 -0.820 15.6 178.8 -95.8 108.2 84.4 15.5 39.1 83 139 A E + 0 0 40 -45,-2.6 2,-0.5 -2,-0.7 -1,-0.1 -0.407 25.7 141.8-109.1 59.6 82.3 12.4 38.2 84 140 A D S S+ 0 0 73 -2,-0.5 -2,-0.1 1,-0.2 -45,-0.1 -0.856 73.1 14.8-100.3 125.7 82.1 12.7 34.4 85 141 A G S S+ 0 0 78 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 -0.075 96.1 121.2 101.9 -32.2 82.3 9.4 32.6 86 142 A I S S- 0 0 46 1,-0.1 -1,-0.3 9,-0.1 3,-0.1 -0.542 74.3-105.1 -68.5 117.1 81.7 7.6 35.8 87 143 A P - 0 0 67 0, 0.0 -1,-0.1 0, 0.0 9,-0.1 0.012 51.6 -69.0 -45.2 144.6 78.4 5.5 35.4 88 144 A S > - 0 0 98 2,-0.1 3,-1.9 -3,-0.1 0, 0.0 0.021 59.0 -92.5 -43.4 133.2 75.2 6.6 37.0 89 145 A Y T 3 S+ 0 0 121 1,-0.3 4,-0.3 -3,-0.1 3,-0.1 0.542 114.3 63.7 -10.1 -76.2 74.8 6.5 40.8 90 146 A P T 3 S+ 0 0 100 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.812 120.7 15.2 -29.5 -51.3 73.3 3.1 41.6 91 147 A N S < S+ 0 0 112 -3,-1.9 0, 0.0 1,-0.1 0, 0.0 -0.980 92.4 80.5-137.5 127.2 76.4 1.4 40.2 92 148 A G >> + 0 0 3 -2,-0.4 4,-2.8 -3,-0.1 3,-1.1 0.167 46.2 128.0 165.6 -8.6 79.8 2.9 39.4 93 149 A W H 3> S+ 0 0 22 -4,-0.3 4,-3.2 1,-0.3 5,-0.2 0.728 74.4 55.9 -37.8 -36.3 81.4 2.9 42.9 94 150 A Q H 3> S+ 0 0 107 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.971 116.3 36.7 -63.6 -49.3 84.4 1.1 41.6 95 151 A S H <> S+ 0 0 41 -3,-1.1 4,-0.9 2,-0.2 -2,-0.3 0.802 122.3 46.7 -70.5 -32.5 84.9 3.8 39.0 96 152 A W H >X S+ 0 0 31 -4,-2.8 4,-2.1 2,-0.2 3,-0.7 0.979 106.5 53.4 -75.3 -59.8 83.8 6.5 41.5 97 153 A S H 3X S+ 0 0 1 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.689 100.5 68.9 -50.5 -17.2 85.8 5.4 44.5 98 154 A E H 3X S+ 0 0 98 -4,-0.6 4,-2.6 -5,-0.2 -1,-0.2 0.995 104.6 37.0 -63.5 -61.9 88.8 5.6 42.1 99 155 A A H X S+ 0 0 67 -4,-2.6 4,-2.4 1,-0.2 3,-1.2 0.929 108.9 49.2 -54.5 -48.0 92.7 10.1 43.7 103 159 A L H 3X S+ 0 0 18 -4,-3.4 4,-1.8 1,-0.3 5,-0.2 0.959 104.6 58.9 -54.9 -55.2 91.4 13.3 45.5 104 160 A F H 3<>S+ 0 0 9 -4,-2.6 5,-1.8 -5,-0.2 -1,-0.3 0.672 113.4 40.2 -49.0 -21.2 92.5 11.9 48.9 105 161 A H H X<5S+ 0 0 123 -3,-1.2 3,-2.6 -4,-0.9 -2,-0.2 0.895 115.9 43.1 -94.0 -61.3 96.0 11.8 47.6 106 162 A E H 3<5S+ 0 0 138 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.568 122.4 45.0 -63.4 -4.6 96.4 15.0 45.5 107 163 A K T 3<5S- 0 0 122 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.209 107.7-131.9-119.4 7.6 94.6 16.7 48.4 108 164 A H T < 5 + 0 0 169 -3,-2.6 2,-0.3 -5,-0.2 -3,-0.2 0.803 61.1 116.9 45.0 47.8 96.6 14.9 51.1 109 165 A F < - 0 0 10 -5,-1.8 -2,-0.1 -6,-0.2 -1,-0.1 -0.998 43.8-161.2-141.5 143.0 93.9 13.7 53.5 110 166 A E - 0 0 123 -2,-0.3 2,-0.1 -5,-0.0 -106,-0.1 -0.867 13.9-161.3-124.5 98.5 92.9 10.2 54.6 111 167 A P - 0 0 7 0, 0.0 -106,-0.2 0, 0.0 3,-0.1 -0.425 9.3-167.4 -74.4 154.2 89.4 10.1 56.1 112 168 A S S S+ 0 0 74 -108,-2.7 20,-1.3 1,-0.2 2,-0.3 0.239 70.0 37.7-125.4 9.0 88.5 7.1 58.3 113 169 A I E -bd 5 132A 29 -109,-0.8 -107,-1.9 18,-0.2 2,-0.4 -0.976 63.8-152.9-158.8 146.1 84.8 7.6 58.6 114 170 A V E -bd 6 133A 0 18,-2.8 20,-1.2 -2,-0.3 2,-0.3 -0.956 7.5-152.0-127.0 143.4 82.0 8.9 56.3 115 171 A F E + d 0 134A 6 -109,-1.8 -107,-0.5 -2,-0.4 2,-0.3 -0.845 35.3 109.4-113.4 152.7 78.7 10.5 57.2 116 172 A S - 0 0 17 18,-1.4 20,-0.5 -2,-0.3 2,-0.2 -0.974 52.0-116.3 174.7-168.7 75.5 10.5 55.3 117 173 A S S S+ 0 0 15 -2,-0.3 4,-0.1 18,-0.2 20,-0.1 -0.553 76.2 89.3-136.3-162.6 71.9 9.3 55.1 118 174 A E > - 0 0 70 -2,-0.2 3,-1.4 2,-0.1 4,-0.2 0.969 63.0-156.3 62.1 77.1 70.9 7.0 52.3 119 175 A P G > S+ 0 0 87 0, 0.0 3,-3.4 0, 0.0 4,-0.3 0.895 82.6 83.3 -53.7 -43.2 71.8 3.8 54.2 120 176 A Q G 3 S+ 0 0 115 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 0.450 86.6 58.3 -40.4 -3.9 72.1 2.0 50.9 121 177 A D G <> S+ 0 0 10 -3,-1.4 4,-3.3 -4,-0.1 5,-0.3 0.657 81.0 83.2-105.4 -20.0 75.6 3.5 50.9 122 178 A K H <> S+ 0 0 117 -3,-3.4 4,-3.6 -4,-0.2 5,-0.3 0.947 96.1 39.8 -45.9 -70.0 77.1 2.1 54.1 123 179 A A H > S+ 0 0 59 -4,-0.3 4,-4.6 1,-0.2 7,-0.2 0.929 117.6 49.4 -48.3 -55.8 78.1 -1.3 52.7 124 180 A P H >>S+ 0 0 25 0, 0.0 4,-2.1 0, 0.0 5,-0.8 0.872 113.8 45.9 -53.3 -42.6 79.4 0.2 49.4 125 181 A Y H X>S+ 0 0 13 -4,-3.3 5,-1.6 1,-0.2 4,-1.2 0.924 117.4 44.9 -64.5 -44.6 81.4 2.9 51.3 126 182 A E H <5S+ 0 0 84 -4,-3.6 -1,-0.2 -5,-0.3 -3,-0.2 0.888 120.0 44.3 -63.5 -40.6 82.5 -0.0 53.5 127 183 A K H <5S+ 0 0 154 -4,-4.6 -2,-0.2 -5,-0.3 -1,-0.1 0.994 127.3 18.4 -67.6 -79.6 83.2 -2.0 50.4 128 184 A Y H <5S+ 0 0 76 -4,-2.1 -3,-0.2 1,-0.2 -2,-0.1 0.687 141.8 25.7 -70.8 -25.6 84.9 0.2 47.8 129 185 A L T < - 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