==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL TRANSPORT 27-MAY-04 1WFZ . COMPND 2 MOLECULE: NITROGEN FIXATION CLUSTER-LIKE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.NAKANISHI,T.TOMIZAWA,S.KOSHIBA,M.INOUE,T.KIGAWA, . 130 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7888.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 92 70.8 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 . 19 14.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 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 . 10 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 33.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 1 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 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 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 115 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-169.5 22.6 8.1 -0.7 2 2 A S + 0 0 138 1,-0.1 2,-1.2 2,-0.1 0, 0.0 0.918 360.0 77.7 -54.0 -47.6 23.6 5.3 -3.1 3 3 A S S S- 0 0 116 1,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.511 80.2-152.3 -69.2 95.9 25.2 3.3 -0.3 4 4 A G - 0 0 64 -2,-1.2 2,-0.2 1,-0.1 -2,-0.1 -0.560 7.4-138.4 -75.2 128.8 22.2 1.9 1.4 5 5 A S - 0 0 127 -2,-0.3 2,-0.7 1,-0.0 -1,-0.1 -0.489 9.2-128.0 -85.2 156.1 22.6 1.1 5.1 6 6 A S + 0 0 123 -2,-0.2 2,-0.3 3,-0.0 3,-0.0 -0.898 67.2 53.7-109.6 108.9 21.4 -2.0 6.8 7 7 A G + 0 0 59 -2,-0.7 -2,-0.0 1,-0.1 0, 0.0 -0.972 47.6 91.5 168.7-154.9 19.3 -1.4 9.9 8 8 A E S S- 0 0 203 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.0 0.812 72.6-148.5 37.6 38.2 16.3 0.5 11.3 9 9 A N - 0 0 136 -3,-0.0 -1,-0.1 1,-0.0 -3,-0.0 0.079 11.0-118.3 -34.4 140.2 14.4 -2.7 10.4 10 10 A P - 0 0 50 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.199 23.3-117.6 -69.7-164.5 10.8 -1.9 9.5 11 11 A R S S+ 0 0 187 1,-0.1 43,-0.2 43,-0.1 3,-0.1 -0.994 80.3 10.7-146.6 136.6 7.6 -3.1 11.2 12 12 A N S S+ 0 0 64 -2,-0.3 42,-1.0 1,-0.2 2,-0.7 0.942 76.5 155.3 64.1 49.3 4.7 -5.3 10.1 13 13 A V + 0 0 35 40,-0.2 2,-0.2 -3,-0.1 -1,-0.2 -0.845 12.0 125.7-112.6 95.9 6.4 -6.4 6.9 14 14 A G - 0 0 23 -2,-0.7 41,-0.1 26,-0.1 26,-0.0 -0.671 51.6-133.9-154.3 94.0 5.0 -9.7 5.6 15 15 A S - 0 0 61 -2,-0.2 2,-0.2 1,-0.1 39,-0.1 0.002 27.2-126.7 -43.4 149.3 3.6 -10.1 2.1 16 16 A L - 0 0 21 37,-0.2 2,-0.6 8,-0.2 -1,-0.1 -0.518 43.0 -63.4 -99.0 169.0 0.3 -12.0 2.0 17 17 A D > - 0 0 96 1,-0.2 3,-1.2 -2,-0.2 6,-0.2 -0.322 47.4-174.5 -54.2 101.2 -0.7 -15.1 -0.0 18 18 A K T 3 S+ 0 0 130 -2,-0.6 -1,-0.2 1,-0.3 7,-0.1 0.521 78.5 69.9 -77.4 -4.8 -0.4 -13.7 -3.6 19 19 A T T 3 S+ 0 0 110 2,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.381 89.5 80.8 -92.0 2.8 -1.8 -17.0 -4.8 20 20 A S < - 0 0 31 -3,-1.2 -4,-0.0 3,-0.2 0, 0.0 -0.438 67.4-146.3-101.5 177.5 -5.2 -16.1 -3.4 21 21 A K S S+ 0 0 100 -2,-0.1 99,-0.2 22,-0.1 100,-0.1 0.711 92.0 66.2-112.3 -38.3 -8.1 -13.9 -4.7 22 22 A N S S+ 0 0 59 1,-0.1 21,-3.1 20,-0.1 2,-0.5 0.700 102.8 59.4 -59.0 -18.1 -9.5 -12.4 -1.5 23 23 A V E S-A 42 0A 2 19,-0.3 19,-0.2 -6,-0.2 -3,-0.2 -0.949 79.9-151.5-119.1 115.5 -6.2 -10.6 -1.2 24 24 A G E -A 41 0A 0 17,-1.2 17,-0.6 -2,-0.5 2,-0.4 -0.223 7.2-137.2 -77.3 170.8 -5.0 -8.3 -3.9 25 25 A T E +A 40 0A 29 87,-0.4 2,-0.5 88,-0.4 15,-0.2 -0.984 18.4 179.3-136.1 124.6 -1.4 -7.5 -4.9 26 26 A G E +A 39 0A 1 13,-2.9 13,-3.3 -2,-0.4 2,-0.6 -0.920 2.2 176.2-130.0 108.9 0.1 -4.1 -5.7 27 27 A L E +A 38 0A 95 -2,-0.5 2,-0.4 11,-0.2 11,-0.2 -0.938 7.3 164.2-115.3 115.3 3.7 -3.7 -6.6 28 28 A V E +A 37 0A 15 9,-2.3 9,-0.7 -2,-0.6 2,-0.2 -0.945 7.8 172.0-134.2 113.2 5.0 -0.3 -7.6 29 29 A G E -A 36 0A 38 -2,-0.4 7,-0.2 7,-0.2 4,-0.0 -0.569 33.3-102.1-112.3 177.4 8.7 0.6 -7.6 30 30 A A E >> -A 35 0A 11 5,-0.7 5,-0.8 -2,-0.2 4,-0.6 -0.872 14.2-157.5-106.0 131.3 10.8 3.5 -8.8 31 31 A P T 45S+ 0 0 133 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.901 94.7 32.9 -69.7 -43.0 12.8 3.4 -12.1 32 32 A A T 45S+ 0 0 99 1,-0.1 -2,-0.1 2,-0.0 0, 0.0 0.982 127.5 35.3 -77.3 -68.4 15.2 6.1 -11.1 33 33 A C T 45S- 0 0 58 1,-0.1 -1,-0.1 -4,-0.0 26,-0.1 0.778 104.6-134.5 -57.6 -26.6 15.6 5.6 -7.4 34 34 A G T <5 + 0 0 48 -4,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.995 44.3 157.7 68.5 65.3 15.3 1.9 -8.0 35 35 A D E < -A 30 0A 6 -5,-0.8 -5,-0.7 23,-0.1 2,-0.4 -0.788 34.9-147.3-119.0 162.8 12.8 0.9 -5.3 36 36 A V E -A 29 0A 66 21,-1.2 2,-0.9 -2,-0.3 -7,-0.2 -0.848 12.1-175.5-135.0 98.5 10.4 -2.0 -4.8 37 37 A M E -A 28 0A 1 -9,-0.7 -9,-2.3 -2,-0.4 2,-0.8 -0.816 5.3-173.6 -97.7 103.4 7.1 -1.3 -3.0 38 38 A K E -AB 27 55A 59 17,-3.1 17,-1.1 -2,-0.9 2,-0.3 -0.847 7.1-178.5-101.1 106.2 5.2 -4.6 -2.6 39 39 A L E +AB 26 54A 0 -13,-3.3 -13,-2.9 -2,-0.8 2,-0.3 -0.807 5.9 175.8-105.7 145.6 1.8 -4.0 -1.0 40 40 A Q E -AB 25 53A 1 13,-2.1 13,-2.3 -2,-0.3 2,-0.4 -0.921 3.8-177.3-152.5 121.9 -0.8 -6.7 -0.2 41 41 A I E -AB 24 52A 1 -17,-0.6 -17,-1.2 -2,-0.3 2,-0.6 -0.956 20.3-137.2-123.3 140.1 -4.2 -6.4 1.5 42 42 A Q E -AB 23 51A 65 9,-2.6 8,-2.2 -2,-0.4 9,-1.1 -0.848 18.3-155.9 -99.0 117.8 -6.7 -9.1 2.5 43 43 A V E - B 0 49A 4 -21,-3.1 6,-0.2 -2,-0.6 -22,-0.1 -0.765 7.9-145.6 -95.2 135.5 -10.3 -8.3 1.7 44 44 A D - 0 0 60 4,-1.8 3,-0.4 -2,-0.4 -1,-0.1 -0.148 36.5 -88.5 -86.1-175.0 -13.1 -10.0 3.6 45 45 A E S S+ 0 0 176 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.861 129.6 52.7 -63.8 -36.4 -16.5 -11.1 2.5 46 46 A K S S- 0 0 182 2,-0.1 -1,-0.2 1,-0.0 -3,-0.0 0.729 120.3-111.4 -71.7 -21.9 -17.9 -7.6 3.4 47 47 A G S S+ 0 0 11 -3,-0.4 31,-1.5 1,-0.3 2,-0.4 0.677 72.1 135.1 97.8 21.7 -15.2 -6.0 1.3 48 48 A K B -C 77 0B 70 29,-0.2 -4,-1.8 30,-0.1 2,-0.7 -0.844 61.7-111.4-106.7 141.0 -13.2 -4.5 4.2 49 49 A I E +B 43 0A 0 27,-2.3 26,-1.7 -2,-0.4 -6,-0.2 -0.573 42.1 163.5 -72.4 112.2 -9.4 -4.6 4.6 50 50 A V E + 0 0 66 -8,-2.2 2,-0.4 -2,-0.7 -1,-0.2 0.764 66.0 34.4 -97.8 -33.7 -8.7 -6.9 7.6 51 51 A D E +B 42 0A 46 -9,-1.1 -9,-2.6 23,-0.1 2,-0.4 -0.972 63.3 179.4-127.2 140.2 -5.0 -7.5 6.9 52 52 A A E +B 41 0A 3 -2,-0.4 2,-0.4 -11,-0.2 -11,-0.2 -0.991 1.0 177.5-143.0 131.8 -2.4 -5.2 5.4 53 53 A R E -B 40 0A 80 -13,-2.3 -13,-2.1 -2,-0.4 2,-0.4 -0.999 5.5-169.1-137.2 136.5 1.3 -5.8 4.7 54 54 A F E -B 39 0A 2 -42,-1.0 2,-0.3 -2,-0.4 -15,-0.2 -0.946 4.8-173.3-126.3 146.5 3.9 -3.5 3.0 55 55 A K E -B 38 0A 62 -17,-1.1 -17,-3.1 -2,-0.4 2,-0.3 -0.863 7.3-177.0-143.1 105.0 7.4 -4.2 1.8 56 56 A T - 0 0 12 -2,-0.3 2,-0.4 -19,-0.2 -19,-0.2 -0.782 5.6-168.5-103.8 146.5 9.7 -1.5 0.6 57 57 A F + 0 0 109 -2,-0.3 -21,-1.2 -21,-0.2 2,-0.4 -0.904 56.5 17.8-138.3 107.7 13.2 -1.9 -0.8 58 58 A G S S+ 0 0 53 -2,-0.4 -23,-0.1 -23,-0.2 2,-0.1 -0.970 101.5 27.7 144.4-126.5 15.5 1.1 -1.4 59 59 A C >> - 0 0 24 -2,-0.4 4,-1.2 1,-0.1 3,-0.9 -0.379 69.3-123.4 -72.9 151.5 15.4 4.6 -0.0 60 60 A G H >> S+ 0 0 46 1,-0.2 4,-2.5 2,-0.2 3,-0.5 0.952 105.8 70.1 -59.2 -53.0 13.8 5.3 3.4 61 61 A S H 3> S+ 0 0 29 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.777 104.3 47.3 -34.9 -33.8 11.3 7.8 2.1 62 62 A A H <> S+ 0 0 1 -3,-0.9 4,-2.0 2,-0.2 -1,-0.3 0.928 108.9 50.4 -76.8 -48.5 9.8 4.8 0.4 63 63 A I H S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-0.5 0.996 107.2 53.7 -66.4 -65.8 4.4 2.8 2.8 67 67 A S H X5S+ 0 0 47 -4,-2.4 4,-0.5 1,-0.3 -2,-0.2 0.822 116.9 42.7 -37.7 -40.2 4.5 1.8 6.5 68 68 A L H X5S+ 0 0 26 -4,-2.6 4,-0.6 2,-0.2 -1,-0.3 0.892 116.0 47.3 -76.2 -41.9 2.2 4.8 7.0 69 69 A A H >X5S+ 0 0 0 -4,-2.2 3,-2.2 -5,-0.4 4,-1.5 0.968 109.5 51.0 -63.6 -55.5 0.0 4.1 4.0 70 70 A T H 3X5S+ 0 0 2 -4,-2.9 4,-0.7 1,-0.3 -1,-0.2 0.745 108.2 56.6 -54.8 -23.1 -0.4 0.4 4.7 71 71 A E H 3<< S+ 0 0 1 -4,-1.5 3,-1.0 2,-0.1 -24,-0.3 0.771 85.6 101.2 -73.8 -26.6 -5.8 0.9 4.7 74 74 A K T 3< S+ 0 0 58 -4,-0.7 -24,-0.1 1,-0.3 3,-0.1 -0.368 94.6 7.6 -62.1 132.9 -6.2 -1.2 7.8 75 75 A G T 3 S+ 0 0 57 -26,-1.7 -1,-0.3 1,-0.3 -2,-0.1 0.076 113.3 100.7 83.6 -26.6 -9.7 -1.1 9.1 76 76 A K S < S- 0 0 82 -3,-1.0 -27,-2.3 -4,-0.2 -1,-0.3 -0.371 73.7-112.0 -87.0 168.9 -10.8 0.8 6.0 77 77 A T B >> -C 48 0B 40 -29,-0.3 4,-2.2 -3,-0.1 3,-0.6 -0.620 28.2-105.7-100.4 161.0 -12.6 -0.7 3.0 78 78 A V H 3> S+ 0 0 7 -31,-1.5 4,-1.5 1,-0.3 -30,-0.1 0.813 123.1 55.2 -52.0 -31.9 -11.3 -1.1 -0.6 79 79 A E H 3> S+ 0 0 130 -32,-0.3 4,-0.7 2,-0.2 -1,-0.3 0.893 105.9 49.9 -69.6 -41.0 -13.5 1.9 -1.5 80 80 A E H X> S+ 0 0 101 -3,-0.6 3,-1.5 1,-0.2 4,-1.2 0.936 106.8 54.4 -63.3 -48.2 -12.0 4.1 1.2 81 81 A A H >< S+ 0 0 0 -4,-2.2 3,-0.7 1,-0.3 -1,-0.2 0.900 98.5 63.2 -52.5 -45.0 -8.4 3.4 0.1 82 82 A L H 3< S+ 0 0 72 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.808 103.0 51.2 -50.9 -31.1 -9.3 4.4 -3.5 83 83 A T H << S+ 0 0 88 -3,-1.5 -1,-0.3 -4,-0.7 -2,-0.2 0.845 84.4 107.0 -76.1 -35.3 -9.9 7.9 -2.0 84 84 A I << - 0 0 15 -4,-1.2 2,-0.2 -3,-0.7 27,-0.1 -0.182 58.0-159.2 -47.8 127.1 -6.6 8.0 -0.2 85 85 A K > - 0 0 108 1,-0.1 4,-0.8 21,-0.0 -1,-0.1 -0.657 24.5-130.0-109.3 166.7 -4.3 10.4 -2.1 86 86 A N H > S+ 0 0 46 -2,-0.2 4,-2.5 2,-0.2 5,-0.3 0.846 99.3 71.1 -82.6 -37.3 -0.5 10.8 -2.2 87 87 A T H > S+ 0 0 87 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.908 100.2 47.1 -43.7 -54.1 -0.5 14.5 -1.5 88 88 A D H > S+ 0 0 60 2,-0.2 4,-2.7 1,-0.2 3,-0.3 0.939 110.9 52.2 -55.3 -51.4 -1.6 13.9 2.1 89 89 A I H X S+ 0 0 0 -4,-0.8 4,-2.6 1,-0.2 5,-0.5 0.957 105.4 52.9 -49.7 -61.8 1.0 11.2 2.6 90 90 A A H X>S+ 0 0 16 -4,-2.5 5,-1.6 1,-0.3 4,-1.1 0.851 113.0 46.9 -43.1 -41.5 3.9 13.4 1.4 91 91 A K H <5S+ 0 0 161 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.909 108.9 53.7 -69.5 -43.5 2.7 16.0 4.0 92 92 A E H <5S+ 0 0 113 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.933 117.8 35.6 -56.7 -49.4 2.4 13.4 6.8 93 93 A L H <5S- 0 0 55 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.668 102.1-139.6 -78.6 -17.3 6.0 12.2 6.3 94 94 A C T <5 + 0 0 105 -4,-1.1 -3,-0.2 -5,-0.5 -4,-0.1 0.930 36.0 176.5 57.4 48.4 7.1 15.7 5.5 95 95 A L < - 0 0 28 -5,-1.6 -1,-0.2 -6,-0.1 -2,-0.0 -0.520 29.0-105.7 -85.2 152.5 9.4 14.5 2.7 96 96 A P > - 0 0 59 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 -0.118 31.6-103.1 -69.7 170.0 11.3 16.9 0.4 97 97 A P G > S+ 0 0 113 0, 0.0 3,-0.5 0, 0.0 4,-0.2 0.630 120.8 59.3 -69.7 -13.4 10.5 17.6 -3.2 98 98 A V G 3 S+ 0 0 100 1,-0.2 3,-0.4 2,-0.1 -3,-0.0 0.782 103.5 48.8 -85.1 -30.4 13.4 15.3 -4.2 99 99 A K G <> S+ 0 0 76 -3,-0.5 4,-0.8 1,-0.2 3,-0.5 -0.092 76.9 112.6-100.1 33.6 11.9 12.3 -2.5 100 100 A L H <> + 0 0 76 -3,-0.5 4,-1.3 1,-0.2 5,-0.4 0.895 58.2 75.3 -71.3 -41.4 8.4 12.8 -4.1 101 101 A H H > S+ 0 0 45 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.813 95.8 54.0 -38.9 -37.2 8.6 9.7 -6.2 102 102 A C H > S+ 0 0 1 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.977 100.4 56.7 -64.4 -57.8 8.0 7.8 -2.9 103 103 A S H >X S+ 0 0 3 -4,-0.8 4,-1.3 1,-0.3 3,-0.7 0.903 113.2 40.2 -38.2 -63.4 4.8 9.7 -2.0 104 104 A M H 3X S+ 0 0 96 -4,-1.3 4,-2.8 1,-0.2 5,-0.3 0.887 106.8 66.1 -56.2 -41.3 3.1 8.8 -5.2 105 105 A L H 3X S+ 0 0 11 -4,-1.8 4,-1.9 -5,-0.4 -1,-0.2 0.885 99.5 52.5 -47.9 -44.5 4.6 5.3 -5.0 106 106 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 3,-0.6 0.955 113.0 43.3 -48.7 -62.1 -2.8 1.0 -2.6 111 111 A K H 3X S+ 0 0 35 -4,-2.1 4,-2.9 1,-0.3 5,-0.3 0.957 108.6 56.9 -49.2 -62.3 -4.9 1.2 -5.7 112 112 A A H 3X S+ 0 0 32 -4,-2.0 4,-2.4 -5,-0.2 -87,-0.4 0.831 107.9 52.7 -38.5 -41.5 -3.1 -1.6 -7.5 113 113 A A H X S+ 0 0 39 -4,-2.9 4,-2.7 1,-0.2 3,-0.7 0.965 109.7 47.3 -49.5 -66.2 -8.0 -3.0 -8.1 116 116 A D H 3X S+ 0 0 56 -4,-2.4 4,-1.3 -5,-0.3 -1,-0.2 0.876 113.0 51.2 -43.7 -46.0 -6.1 -6.3 -8.7 117 117 A Y H 3X S+ 0 0 25 -4,-2.5 4,-0.9 -5,-0.3 -1,-0.3 0.892 110.2 48.9 -61.1 -40.9 -8.3 -7.9 -6.1 118 118 A K H XX S+ 0 0 69 -4,-2.5 4,-2.1 -3,-0.7 3,-0.9 0.912 100.5 64.2 -65.7 -43.8 -11.5 -6.6 -7.8 119 119 A L H 3X S+ 0 0 85 -4,-2.7 4,-2.5 1,-0.3 -1,-0.2 0.872 103.5 48.7 -47.1 -42.5 -10.3 -7.8 -11.2 120 120 A K H 3< S+ 0 0 80 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.816 108.4 54.2 -68.9 -30.8 -10.6 -11.4 -9.8 121 121 A Q H << S+ 0 0 98 -4,-0.9 -2,-0.2 -3,-0.9 3,-0.2 0.819 116.4 37.2 -72.4 -31.6 -14.0 -10.6 -8.4 122 122 A E H < S+ 0 0 154 -4,-2.1 2,-0.4 1,-0.3 -2,-0.2 0.766 129.8 31.5 -89.4 -30.0 -15.2 -9.5 -11.9 123 123 A S < + 0 0 59 -4,-2.5 -1,-0.3 -5,-0.3 3,-0.1 -0.851 58.7 178.8-134.5 98.4 -13.3 -12.1 -13.8 124 124 A K S S+ 0 0 196 -2,-0.4 2,-0.3 -3,-0.2 -1,-0.1 0.921 78.8 19.7 -62.3 -45.5 -12.7 -15.5 -12.1 125 125 A S S S+ 0 0 101 2,-0.0 -1,-0.2 0, 0.0 4,-0.1 -0.956 72.8 160.9-129.3 147.2 -10.8 -16.9 -15.1 126 126 A G - 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