==== Secondary Structure Definition by the program DSSP, CMBI version by M.L. Hekkelman/2010-10-21 ==== DATE=2015-02-06 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 25-NOV-03 1RLJ . COMPND 2 MOLECULE: NRDI PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR R.WU,R.ZHANG,F.COLLART,A.JOACHIMIAK,MIDWEST CENTER FOR . 135 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7192.8 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 16.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.5 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 . 1 0.7 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 . 3 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 41 30.4 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 2 0 0 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -9 A E 0 0 141 0, 0.0 3,-0.2 0, 0.0 117,-0.1 0.000 360.0 360.0 360.0 135.5 45.1 5.1 17.8 2 -8 A N > + 0 0 14 1,-0.2 4,-2.5 116,-0.1 3,-0.3 -0.381 360.0 144.7-115.0 51.0 43.4 3.7 14.7 3 -7 A L H > + 0 0 81 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.832 68.4 59.6 -58.2 -35.6 44.8 6.2 12.3 4 -6 A Y H > S+ 0 0 180 -3,-0.2 4,-1.4 2,-0.2 5,-0.3 0.931 109.4 42.5 -60.9 -45.3 45.0 3.6 9.6 5 -5 A F H > S+ 0 0 30 -3,-0.3 4,-2.9 2,-0.2 3,-0.3 0.943 113.5 53.0 -65.3 -46.9 41.3 3.0 9.8 6 -4 A Q H < S+ 0 0 5 -4,-2.5 26,-0.6 1,-0.2 -2,-0.2 0.915 115.7 38.6 -53.8 -49.5 40.6 6.7 10.0 7 -3 A S H < S+ 0 0 45 -4,-2.7 -1,-0.2 24,-0.2 -2,-0.2 0.661 124.9 36.6 -79.7 -17.7 42.5 7.6 6.9 8 -2 A N H < S+ 0 0 85 -4,-1.4 -2,-0.2 -3,-0.3 -3,-0.2 0.775 92.9 88.6-106.1 -33.2 41.5 4.5 4.8 9 -1 A A S < S- 0 0 23 -4,-2.9 23,-0.3 -5,-0.3 116,-0.0 -0.241 74.5-130.2 -64.7 156.1 37.9 3.8 5.6 10 1 A M + 0 0 139 22,-0.1 -1,-0.1 21,-0.1 -4,-0.1 0.390 58.5 138.6 -89.3 6.2 35.2 5.5 3.6 11 2 A V - 0 0 14 1,-0.1 22,-0.5 36,-0.1 2,-0.4 -0.220 47.6-135.1 -55.3 135.1 33.3 6.7 6.6 12 3 A Q E -ab 33 47A 16 34,-0.9 36,-2.8 20,-0.1 2,-0.5 -0.783 11.7-157.1 -99.4 136.0 32.0 10.2 6.3 13 4 A I E -ab 34 48A 1 20,-3.1 22,-2.2 -2,-0.4 2,-0.4 -0.943 10.7-177.4-111.5 125.0 32.3 12.9 9.0 14 5 A I E -ab 35 49A 0 34,-3.0 36,-1.8 -2,-0.5 2,-0.3 -0.991 12.1-177.4-122.8 130.2 29.9 15.8 8.9 15 6 A F E -ab 36 50A 7 20,-2.1 22,-2.6 -2,-0.4 2,-0.4 -0.859 23.2-148.9-130.2 163.4 30.2 18.5 11.5 16 7 A D + 0 0 6 34,-2.1 2,-0.3 -2,-0.3 6,-0.1 -0.977 25.0 165.7-127.2 139.4 28.6 21.8 12.8 17 8 A S + 0 0 8 -2,-0.4 -2,-0.0 5,-0.1 34,-0.0 -0.986 21.6 176.0-155.5 143.5 30.6 24.5 14.4 18 9 A K S S+ 0 0 167 -2,-0.3 -1,-0.1 0, 0.0 0, 0.0 0.720 91.7 24.8-114.8 -49.9 30.1 28.2 15.3 19 10 A T S S- 0 0 106 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.241 111.7-106.7-102.1 13.7 33.2 29.2 17.1 20 11 A G S > S+ 0 0 16 1,-0.0 4,-2.4 90,-0.0 5,-0.2 0.395 85.7 116.4 84.1 -3.0 35.5 26.6 15.6 21 12 A N H > S+ 0 0 36 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.915 81.9 45.8 -65.2 -44.0 36.1 24.1 18.4 22 13 A V H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.902 112.1 53.5 -64.4 -40.2 34.3 21.2 16.6 23 14 A Q H > S+ 0 0 78 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.933 109.9 46.7 -58.0 -48.8 36.3 22.1 13.5 24 15 A R H < S+ 0 0 119 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.886 111.0 54.2 -61.2 -39.4 39.5 22.0 15.4 25 16 A F H >< S+ 0 0 0 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.945 108.5 45.2 -61.1 -52.4 38.5 18.7 17.0 26 17 A V H >< S+ 0 0 1 -4,-2.6 3,-1.6 1,-0.3 5,-0.3 0.800 104.8 64.4 -64.8 -26.7 37.8 16.9 13.7 27 18 A N T 3< S+ 0 0 104 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.482 91.1 66.2 -74.8 -0.5 41.0 18.2 12.3 28 19 A K T < S+ 0 0 98 -3,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.465 94.5 74.7 -95.0 -4.8 42.8 16.2 15.0 29 20 A T S < S- 0 0 19 -3,-1.6 -26,-0.0 -4,-0.2 89,-0.0 -0.531 81.0-129.2-101.3 171.5 41.6 13.0 13.2 30 21 A G + 0 0 11 -2,-0.2 -3,-0.1 0, 0.0 -1,-0.1 0.263 59.1 135.3-103.0 10.4 42.8 11.4 10.0 31 22 A F - 0 0 8 -5,-0.3 -24,-0.2 1,-0.1 3,-0.1 -0.340 40.7-159.7 -60.5 140.3 39.3 11.0 8.5 32 23 A Q S S+ 0 0 131 -26,-0.6 2,-1.0 -23,-0.3 -1,-0.1 0.726 76.1 63.2 -96.7 -28.0 39.5 12.1 4.8 33 24 A Q E +a 12 0A 58 -22,-0.5 -20,-3.1 2,-0.0 2,-0.5 -0.773 67.0 150.8-101.4 89.7 35.8 12.9 4.1 34 25 A I E +a 13 0A 41 -2,-1.0 2,-0.3 -22,-0.2 -20,-0.2 -0.960 10.6 157.6-125.2 114.9 35.1 15.8 6.4 35 26 A R E -a 14 0A 79 -22,-2.2 -20,-2.1 -2,-0.5 2,-0.2 -0.944 38.5-112.1-134.9 156.7 32.5 18.4 5.5 36 27 A K E > -a 15 0A 51 -2,-0.3 3,-2.2 -22,-0.2 -20,-0.2 -0.552 33.8-111.9 -85.8 151.7 30.4 20.9 7.4 37 28 A V T 3 S+ 0 0 13 -22,-2.6 3,-0.4 1,-0.3 -21,-0.1 0.709 115.5 54.7 -54.7 -21.4 26.6 20.5 7.6 38 29 A D T 3 S+ 0 0 112 -23,-0.3 -1,-0.3 1,-0.2 -22,-0.1 0.424 91.2 71.5 -96.2 0.4 26.2 23.6 5.4 39 30 A E S < S+ 0 0 115 -3,-2.2 2,-0.3 2,-0.0 -1,-0.2 0.070 89.4 59.6-108.4 29.4 28.4 22.6 2.4 40 31 A M - 0 0 23 -3,-0.4 3,-0.1 -5,-0.1 -5,-0.0 -0.992 54.0-157.0-151.6 147.5 26.3 19.9 0.8 41 32 A D S S+ 0 0 132 -2,-0.3 2,-0.3 1,-0.2 -1,-0.0 0.272 82.9 20.9-104.6 7.5 22.9 19.7 -0.8 42 33 A H - 0 0 91 28,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.959 56.5-151.9-170.9 152.4 22.5 15.9 -0.3 43 34 A V + 0 0 11 -2,-0.3 4,-0.1 26,-0.1 30,-0.0 -0.988 21.9 160.1-134.4 121.2 23.8 13.0 1.6 44 35 A D + 0 0 117 -2,-0.4 -1,-0.1 2,-0.1 26,-0.0 0.446 59.9 64.7-120.2 -4.3 23.8 9.5 0.1 45 36 A T S S- 0 0 51 1,-0.1 28,-0.1 -34,-0.0 -1,-0.0 -0.898 92.5 -93.6-121.0 148.8 26.4 7.7 2.2 46 37 A P - 0 0 30 0, 0.0 -34,-0.9 0, 0.0 2,-0.3 -0.195 52.3-176.5 -56.5 151.5 26.3 6.8 5.9 47 38 A F E -bc 12 74A 0 26,-2.2 28,-3.1 -36,-0.1 29,-0.6 -0.964 29.6-124.3-151.3 166.4 27.9 9.4 8.2 48 39 A V E -bc 13 76A 1 -36,-2.8 -34,-3.0 -2,-0.3 2,-0.4 -0.922 27.7-144.9-111.4 135.0 29.0 10.4 11.7 49 40 A L E -bc 14 77A 0 27,-2.2 29,-2.4 -2,-0.4 2,-0.5 -0.863 14.8-175.8-106.5 135.8 27.8 13.7 13.1 50 41 A V E +bc 15 78A 0 -36,-1.8 -34,-2.1 -2,-0.4 29,-0.2 -0.993 21.2 157.2-126.4 120.8 29.9 16.0 15.4 51 42 A T E - c 0 79A 0 27,-2.3 29,-2.8 -2,-0.5 2,-0.2 -0.710 30.8-123.5-132.5-176.7 28.1 19.1 16.6 52 43 A Y - 0 0 45 27,-0.3 2,-0.4 -2,-0.2 29,-0.2 -0.454 27.2-103.6-117.6-168.0 28.2 21.6 19.5 53 44 A T - 0 0 33 27,-0.3 6,-0.2 -2,-0.2 2,-0.2 -0.973 28.6-171.0-127.9 138.2 25.7 22.8 22.2 54 45 A T B >> -E 58 0B 47 4,-2.7 4,-1.5 -2,-0.4 3,-0.7 -0.522 49.6 -19.5-115.1-173.9 23.7 26.0 22.4 55 46 A N G >4 S- 0 0 102 1,-0.2 3,-1.0 2,-0.2 -1,-0.2 0.193 126.1 -2.1 -30.7 129.3 21.5 27.7 25.0 56 47 A F G 34 S- 0 0 148 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.833 130.7 -56.4 54.5 41.6 20.2 25.4 27.8 57 48 A G G <4 S+ 0 0 3 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.766 96.7 155.8 65.3 27.8 21.7 22.2 26.4 58 49 A Q B << -E 54 0B 93 -4,-1.5 -4,-2.7 -3,-1.0 34,-0.3 -0.480 49.4-109.3 -89.1 156.0 20.0 22.6 23.1 59 50 A V - 0 0 10 -6,-0.2 -6,-0.1 -2,-0.2 5,-0.1 -0.666 46.8-102.5 -80.4 130.2 20.9 21.3 19.6 60 51 A P >> - 0 0 2 0, 0.0 4,-2.0 0, 0.0 3,-0.6 -0.217 26.5-122.8 -52.7 144.6 22.1 24.1 17.3 61 52 A A H 3> S+ 0 0 71 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.887 111.5 55.0 -57.6 -42.6 19.4 25.2 14.9 62 53 A S H 3> S+ 0 0 49 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.820 108.6 49.2 -62.2 -30.4 21.6 24.4 11.9 63 54 A T H <> S+ 0 0 0 -3,-0.6 4,-2.7 2,-0.2 -1,-0.2 0.879 109.1 51.7 -76.8 -37.2 22.1 20.9 13.1 64 55 A Q H X S+ 0 0 92 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.922 109.8 49.6 -64.5 -41.8 18.4 20.4 13.6 65 56 A S H < S+ 0 0 56 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.935 112.2 48.8 -59.7 -47.7 17.7 21.5 10.0 66 57 A F H >X S+ 0 0 6 -4,-1.7 4,-2.0 1,-0.2 3,-1.3 0.934 111.4 48.7 -57.4 -50.9 20.4 19.2 8.8 67 58 A L H 3X S+ 0 0 3 -4,-2.7 4,-2.2 1,-0.3 -1,-0.2 0.857 101.3 60.3 -62.6 -39.2 19.1 16.2 10.7 68 59 A E H 3< S+ 0 0 143 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.635 116.0 38.3 -66.7 -7.1 15.4 16.5 9.7 69 60 A K H <4 S+ 0 0 124 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.2 0.733 132.4 18.3-109.4 -33.1 16.7 16.1 6.2 70 61 A Y H >< S+ 0 0 28 -4,-2.0 3,-1.8 1,-0.1 4,-0.3 0.236 79.5 114.4-127.7 15.6 19.5 13.4 6.4 71 62 A A G >< + 0 0 20 -4,-2.2 3,-1.2 1,-0.3 -3,-0.1 0.698 66.1 76.4 -61.9 -17.0 19.0 11.6 9.7 72 63 A H G 3 S+ 0 0 134 1,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 0.783 99.7 42.5 -65.3 -23.9 18.3 8.4 7.8 73 64 A L G < S+ 0 0 22 -3,-1.8 -26,-2.2 -28,-0.1 2,-0.3 0.369 86.0 123.8-101.9 3.5 22.0 8.0 7.1 74 65 A L E < -c 47 0A 3 -3,-1.2 -26,-0.2 -4,-0.3 3,-0.1 -0.508 34.8-178.2 -71.4 124.7 23.2 9.0 10.6 75 66 A L E - 0 0A 6 -28,-3.1 2,-0.3 1,-0.4 -27,-0.2 0.782 62.9 -37.0 -90.9 -34.2 25.4 6.4 12.3 76 67 A G E -c 48 0A 0 -29,-0.6 -27,-2.2 26,-0.2 -1,-0.4 -0.958 57.1-117.2-178.9 169.3 26.0 8.1 15.6 77 68 A V E -cd 49 104A 0 26,-2.4 28,-3.1 -2,-0.3 29,-0.8 -0.962 14.5-173.5-133.0 145.3 26.6 11.5 17.2 78 69 A A E -cd 50 106A 0 -29,-2.4 -27,-2.3 -2,-0.4 2,-0.4 -0.963 15.2-161.0-127.9 145.9 29.4 13.2 19.1 79 70 A A E -cd 51 107A 0 27,-2.0 29,-2.2 -2,-0.3 2,-0.4 -0.992 12.6-143.7-137.8 141.4 29.0 16.7 20.7 80 71 A S E + d 0 108A 4 -29,-2.8 -27,-0.3 -2,-0.4 29,-0.2 -0.786 37.3 142.2 -96.7 140.4 31.3 19.4 22.0 81 72 A G E - d 0 109A 11 27,-2.4 29,-3.0 -2,-0.4 2,-0.3 -0.660 45.5-104.7-149.9-153.1 30.3 21.4 25.1 82 73 A N > - 0 0 41 27,-0.2 3,-2.6 -2,-0.2 8,-0.1 -0.903 14.0-141.4-154.8 119.2 31.7 22.9 28.2 83 74 A K G > S+ 0 0 121 -2,-0.3 3,-2.3 1,-0.3 6,-0.1 0.601 94.0 84.3 -60.5 -10.8 31.3 21.5 31.7 84 75 A V G 3 S+ 0 0 122 1,-0.3 -1,-0.3 4,-0.1 4,-0.0 0.791 85.1 63.0 -59.3 -23.9 30.8 25.0 33.0 85 76 A W G X S- 0 0 143 -3,-2.6 3,-2.2 1,-0.2 -1,-0.3 0.365 89.8-165.1 -84.1 5.1 27.2 24.2 31.9 86 77 A G G X S+ 0 0 43 -3,-2.3 3,-2.4 1,-0.3 -1,-0.2 -0.205 70.9 12.5 52.7-124.4 26.8 21.4 34.4 87 78 A D G 3 S+ 0 0 160 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.628 127.8 59.7 -60.3 -15.8 23.8 19.1 33.6 88 79 A N G X S+ 0 0 45 -3,-2.2 3,-1.8 -6,-0.1 -1,-0.3 0.364 74.4 140.4 -94.0 5.8 23.5 20.8 30.2 89 80 A F T < S- 0 0 25 -3,-2.4 -6,-0.1 1,-0.3 -8,-0.1 -0.294 87.0 -27.1 -54.9 119.3 27.0 19.7 29.3 90 81 A A T >> S+ 0 0 0 1,-0.2 3,-1.7 -2,-0.1 4,-0.6 0.757 86.0 158.3 43.4 34.8 27.0 18.6 25.6 91 82 A K H <> + 0 0 74 -3,-1.8 4,-2.4 1,-0.3 5,-0.2 0.652 55.0 80.0 -62.3 -15.8 23.3 17.7 26.0 92 83 A S H 3> S+ 0 0 0 -34,-0.3 4,-2.5 -4,-0.2 -1,-0.3 0.848 89.1 55.5 -61.0 -31.5 22.8 18.0 22.2 93 84 A A H <> S+ 0 0 0 -3,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.907 108.4 46.9 -66.6 -42.4 24.4 14.5 21.8 94 85 A D H X S+ 0 0 56 -4,-0.6 4,-2.3 2,-0.2 5,-0.3 0.913 113.5 48.7 -64.5 -43.9 21.8 13.0 24.3 95 86 A T H X S+ 0 0 42 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.929 114.3 44.4 -62.9 -47.8 18.9 14.8 22.5 96 87 A I H X S+ 0 0 3 -4,-2.5 4,-3.1 -5,-0.2 5,-0.2 0.931 111.9 54.3 -63.2 -45.2 20.0 13.6 19.0 97 88 A S H X>S+ 0 0 29 -4,-2.6 5,-1.2 -5,-0.2 4,-1.1 0.937 115.2 37.5 -53.5 -54.9 20.7 10.1 20.3 98 89 A R H <5S+ 0 0 159 -4,-2.3 3,-0.3 2,-0.2 -1,-0.2 0.929 117.9 51.9 -64.4 -47.1 17.2 9.6 21.8 99 90 A Q H <5S+ 0 0 127 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.925 124.6 23.9 -55.9 -52.0 15.5 11.6 18.9 100 91 A Y H <5S- 0 0 70 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.335 102.5-120.1-102.3 7.3 17.0 9.6 16.1 101 92 A Q T <5 + 0 0 160 -4,-1.1 -3,-0.2 -3,-0.3 -4,-0.1 0.932 66.6 131.7 55.3 51.9 17.8 6.3 17.8 102 93 A V < - 0 0 17 -5,-1.2 -1,-0.2 -6,-0.2 -26,-0.2 -0.927 59.3 -98.3-129.1 155.3 21.6 6.4 17.2 103 94 A P - 0 0 59 0, 0.0 -26,-2.4 0, 0.0 2,-0.7 -0.351 29.6-117.6 -74.3 154.2 24.5 5.9 19.6 104 95 A I E -d 77 0A 57 -28,-0.2 -26,-0.2 1,-0.2 3,-0.1 -0.830 25.3-169.1 -88.7 118.5 26.4 8.7 21.3 105 96 A L E - 0 0A 7 -28,-3.1 2,-0.3 -2,-0.7 -27,-0.2 0.880 61.7 -33.1 -77.5 -38.4 30.0 8.3 20.1 106 97 A H E -d 78 0A 30 -29,-0.8 -27,-2.0 17,-0.1 2,-0.4 -0.943 43.1-145.3-177.0 154.5 31.5 10.8 22.6 107 98 A K E +d 79 0A 63 -2,-0.3 2,-0.3 -29,-0.2 -27,-0.2 -1.000 33.5 165.4-129.8 127.0 30.9 14.0 24.5 108 99 A F E -d 80 0A 2 -29,-2.2 -27,-2.4 -2,-0.4 2,-0.4 -0.928 36.0 -99.3-142.0 167.4 33.8 16.3 25.0 109 100 A E E > S-d 81 0A 76 -2,-0.3 3,-2.6 -29,-0.2 -27,-0.2 -0.746 71.3 -51.6 -93.7 132.6 34.8 19.8 26.1 110 101 A L T 3 S- 0 0 79 -29,-3.0 -85,-0.1 -2,-0.4 -2,-0.1 -0.147 124.6 -7.9 47.3-124.8 35.7 22.5 23.6 111 102 A S T 3 S- 0 0 21 1,-0.1 -1,-0.3 -87,-0.1 -2,-0.0 0.494 105.3-126.4 -80.5 -3.9 38.3 21.4 21.0 112 103 A G < - 0 0 14 -3,-2.6 2,-0.2 4,-0.1 -1,-0.1 0.190 14.3 -95.8 78.9 160.3 38.9 18.2 23.0 113 104 A T > - 0 0 78 -3,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.513 40.4 -98.5-102.9 176.7 42.0 16.5 24.4 114 105 A S H > S+ 0 0 98 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.836 127.3 57.0 -65.5 -29.4 44.0 13.8 22.8 115 106 A K H > S+ 0 0 125 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.881 104.6 50.4 -67.1 -39.5 42.1 11.3 25.0 116 107 A D H > S+ 0 0 24 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.894 109.3 51.4 -65.3 -39.5 38.8 12.6 23.5 117 108 A V H X S+ 0 0 13 -4,-1.9 4,-2.7 2,-0.2 5,-0.3 0.927 110.6 49.3 -62.7 -45.0 40.2 12.1 20.0 118 109 A E H X S+ 0 0 65 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.938 113.5 44.4 -59.6 -50.8 41.2 8.5 20.9 119 110 A L H X S+ 0 0 70 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.921 115.0 49.1 -61.9 -45.1 37.8 7.6 22.4 120 111 A F H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.957 112.8 45.1 -60.0 -53.8 35.9 9.3 19.5 121 112 A T H X S+ 0 0 0 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.849 112.3 52.0 -62.0 -34.7 37.8 7.6 16.7 122 113 A Q H X S+ 0 0 55 -4,-2.1 4,-1.7 -5,-0.3 -1,-0.2 0.892 110.2 49.2 -68.5 -38.4 37.7 4.2 18.4 123 114 A E H X S+ 0 0 62 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.816 106.1 56.3 -69.7 -31.5 33.9 4.5 18.7 124 115 A V H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 5,-0.2 0.917 108.0 48.4 -66.0 -41.4 33.5 5.5 15.1 125 116 A E H X S+ 0 0 62 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.892 111.8 50.1 -65.0 -38.8 35.3 2.3 14.1 126 117 A R H X S+ 0 0 142 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.938 113.7 43.6 -64.8 -48.5 33.1 0.2 16.4 127 118 A V H X S+ 0 0 11 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.858 113.8 50.5 -67.0 -36.6 29.8 1.7 15.1 128 119 A V H X S+ 0 0 21 -4,-2.3 4,-2.2 -5,-0.2 5,-0.4 0.923 111.5 48.9 -67.0 -42.6 30.9 1.4 11.5 129 120 A T H < S+ 0 0 108 -4,-2.2 4,-0.3 -5,-0.2 -2,-0.2 0.924 120.4 37.3 -60.9 -43.5 31.9 -2.2 12.0 130 121 A K H < S+ 0 0 154 -4,-2.3 4,-0.2 -5,-0.2 -2,-0.2 0.846 131.9 23.1 -78.3 -37.1 28.5 -2.9 13.6 131 122 A S H X S+ 0 0 10 -4,-3.2 4,-3.4 -5,-0.2 -3,-0.2 0.449 97.0 87.8-114.0 -1.4 26.1 -0.7 11.6 132 123 A S T < S+ 0 0 61 -4,-2.2 -3,-0.1 -5,-0.3 -2,-0.1 0.995 94.1 41.4 -60.8 -66.0 27.9 -0.2 8.2 133 124 A A T 4 S+ 0 0 107 -5,-0.4 -1,-0.2 -4,-0.3 -2,-0.1 0.885 122.4 44.0 -47.4 -46.0 26.6 -3.3 6.4 134 125 A K T 4 0 0 143 -4,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.964 360.0 360.0 -64.0 -57.0 23.1 -2.7 8.0 135 126 A M < 0 0 72 -4,-3.4 -1,-0.2 -7,-0.1 -4,-0.1 -0.136 360.0 360.0 -45.1 360.0 22.9 1.1 7.4