==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURE GENOMICS, UNKNOWN FUNCTION 23-NOV-10 2L6O . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN YP_926445.1; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA AMAZONENSIS; . AUTHOR P.SERRANO,M.GERALT,B.MOHANTY,R.HORST,K.WUTHRICH,JOINT CENTER . 114 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7291.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 67 58.8 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 . 17 14.9 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 . 2 1.8 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 . 1 0.9 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 . 8 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 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 . 0 1 2 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 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 1 A M 0 0 239 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 121.6 -18.0 -14.1 7.9 2 2 A G - 0 0 71 0, 0.0 3,-0.0 0, 0.0 0, 0.0 -0.948 360.0-140.2-163.0 148.4 -16.9 -10.5 7.3 3 3 A A S S+ 0 0 118 -2,-0.3 2,-0.3 2,-0.0 0, 0.0 0.143 76.3 24.4-113.0 16.4 -19.0 -7.4 6.6 4 4 A G S S- 0 0 42 2,-0.1 31,-0.0 3,-0.0 0, 0.0 -0.953 80.0-103.9-164.2 172.0 -17.0 -5.5 3.9 5 5 A Q S S+ 0 0 128 -2,-0.3 33,-0.1 -3,-0.0 -2,-0.0 0.148 70.9 142.8 -83.7 15.2 -14.4 -6.1 1.1 6 6 A T - 0 0 55 1,-0.1 -2,-0.1 60,-0.0 25,-0.0 -0.093 56.3-128.2 -66.8 158.6 -11.7 -4.6 3.4 7 7 A P S S- 0 0 7 0, 0.0 60,-0.9 0, 0.0 -1,-0.1 0.976 79.4 -27.1 -74.1 -55.1 -8.1 -5.9 3.5 8 8 A H - 0 0 36 58,-0.1 3,-0.5 3,-0.1 60,-0.1 -0.951 47.3-133.9-156.1 144.6 -7.7 -6.5 7.3 9 9 A P S S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.805 108.0 57.5 -69.6 -29.5 -9.3 -4.7 10.3 10 10 A Q S S+ 0 0 131 2,-0.1 2,-0.4 -3,-0.1 47,-0.1 0.630 79.9 102.9 -82.4 -15.5 -5.9 -4.4 12.0 11 11 A L - 0 0 4 -3,-0.5 2,-0.7 43,-0.1 -3,-0.1 -0.583 66.8-147.9 -63.0 122.5 -4.4 -2.4 9.0 12 12 A I - 0 0 89 -2,-0.4 42,-2.1 2,-0.1 43,-0.3 -0.906 34.3 -93.2-103.1 109.3 -4.4 1.2 10.2 13 13 A W S S+ 0 0 51 -2,-0.7 2,-0.2 40,-0.2 16,-0.1 -0.203 95.9 66.3 -58.8 156.3 -4.9 3.5 7.2 14 14 A P S S- 0 0 10 0, 0.0 40,-0.9 0, 0.0 2,-0.3 0.547 74.1-178.4 -66.9 170.3 -3.5 5.1 5.2 15 15 A A E -AB 28 53A 0 13,-2.1 13,-1.8 38,-0.2 2,-0.4 -0.882 26.0-138.7-136.5 168.7 -2.0 2.1 3.4 16 16 A L E -AB 27 52A 0 36,-2.4 36,-1.0 -2,-0.3 2,-0.3 -0.958 14.6-166.9-136.0 103.6 0.3 1.3 0.4 17 17 A L E -AB 26 51A 0 9,-2.1 9,-2.8 -2,-0.4 2,-0.2 -0.751 1.4-170.6 -87.4 143.4 -0.6 -1.6 -2.0 18 18 A K - 0 0 43 32,-1.8 7,-0.1 31,-1.3 3,-0.1 -0.671 21.6-141.8-138.1 83.3 2.2 -2.7 -4.4 19 19 A Q - 0 0 14 5,-0.5 3,-0.1 -2,-0.2 30,-0.1 0.136 28.4 -86.1 -59.7 155.3 0.6 -5.1 -6.9 20 20 A Q S S- 0 0 116 1,-0.2 2,-1.4 26,-0.1 -1,-0.1 -0.284 109.9 -0.0 -65.1 139.9 2.4 -8.2 -8.2 21 21 A G S S+ 0 0 57 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 -0.153 115.8 94.8 69.1 -33.6 4.7 -7.5 -11.2 22 22 A C - 0 0 64 -2,-1.4 -1,-0.2 -3,-0.1 63,-0.1 -0.105 58.6-157.7 -76.2 176.3 3.8 -3.8 -11.2 23 23 A N + 0 0 73 61,-0.1 2,-0.5 -3,-0.1 62,-0.3 0.518 55.4 111.0-128.5 -22.5 5.7 -1.0 -9.5 24 24 A E - 0 0 75 60,-0.1 -5,-0.5 61,-0.1 2,-0.2 -0.482 65.5-135.4 -66.4 111.1 3.1 1.8 -9.0 25 25 A L - 0 0 0 -2,-0.5 -7,-0.2 -7,-0.1 -2,-0.1 -0.583 11.1-140.1 -60.1 139.1 2.4 2.1 -5.3 26 26 A L E -A 17 0A 37 -9,-2.8 -9,-2.1 -2,-0.2 2,-0.2 -0.911 16.8-156.2-103.9 87.5 -1.3 2.4 -4.8 27 27 A P E -A 16 0A 28 0, 0.0 2,-0.4 0, 0.0 -11,-0.2 -0.578 8.6-169.4 -62.5 141.0 -1.6 5.1 -2.0 28 28 A L E -A 15 0A 4 -13,-1.8 -13,-2.1 -2,-0.2 78,-0.1 -0.920 10.9-164.7-138.5 100.3 -4.9 4.6 -0.2 29 29 A R S S- 0 0 158 -2,-0.4 2,-0.3 -15,-0.2 -1,-0.1 0.823 70.7 -23.4 -59.1 -35.9 -5.7 7.6 2.2 30 30 A T S >> S- 0 0 55 -17,-0.1 3,-1.2 -16,-0.1 4,-0.9 -0.928 84.0 -69.0-161.7-178.9 -8.4 5.6 4.0 31 31 A N H 3> S+ 0 0 49 -2,-0.3 4,-2.2 1,-0.3 5,-0.1 0.741 123.2 64.4 -57.8 -28.4 -10.9 2.7 3.7 32 32 A D H 3> S+ 0 0 87 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.895 97.7 55.1 -61.5 -41.2 -12.9 4.7 1.1 33 33 A D H <4 S+ 0 0 52 -3,-1.2 4,-0.3 1,-0.2 -1,-0.2 0.797 109.6 47.0 -66.3 -30.8 -10.0 4.5 -1.3 34 34 A W H >X S+ 0 0 17 -4,-0.9 3,-1.2 2,-0.2 4,-1.0 0.881 110.6 50.3 -74.5 -43.1 -9.9 0.7 -1.0 35 35 A Q H 3X S+ 0 0 69 -4,-2.2 4,-1.9 1,-0.3 -2,-0.2 0.876 102.4 63.0 -63.3 -35.4 -13.7 0.5 -1.5 36 36 A R H 3< S+ 0 0 154 -4,-2.5 4,-0.5 2,-0.2 -1,-0.3 0.696 96.8 61.9 -60.8 -19.7 -13.3 2.7 -4.6 37 37 A F H X> S+ 0 0 32 -3,-1.2 4,-2.2 -4,-0.3 3,-2.2 0.995 111.6 31.3 -65.0 -72.5 -11.1 -0.2 -6.0 38 38 A C H 3< S+ 0 0 27 -4,-1.0 4,-0.2 1,-0.3 -2,-0.2 0.707 114.7 63.8 -64.3 -20.7 -13.9 -2.9 -6.1 39 39 A A T 3< S+ 0 0 81 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.757 119.4 22.9 -62.8 -28.2 -16.5 -0.2 -6.8 40 40 A D T <4 S+ 0 0 140 -3,-2.2 -2,-0.2 -4,-0.5 -3,-0.1 0.605 137.9 15.1-129.0 -16.1 -14.8 0.6 -10.1 41 41 A S < - 0 0 72 -4,-2.2 2,-1.9 2,-0.1 -1,-0.2 -0.648 50.2-168.6-165.0 97.2 -12.8 -2.5 -11.1 42 42 A K + 0 0 183 -4,-0.2 2,-0.2 -2,-0.1 -4,-0.1 -0.496 68.3 93.8 -75.7 62.5 -13.4 -5.9 -9.4 43 43 A H + 0 0 150 -2,-1.9 -2,-0.1 -6,-0.1 -3,-0.1 -0.753 58.8 34.8-141.2-171.8 -10.2 -7.0 -11.2 44 44 A L + 0 0 102 -2,-0.2 -3,-0.0 1,-0.1 0, 0.0 -0.175 54.5 125.5 59.7-157.4 -6.4 -7.3 -10.5 45 45 A L - 0 0 47 1,-0.1 2,-0.2 -25,-0.1 -1,-0.1 1.000 41.5-157.2 75.2 84.1 -5.2 -8.2 -7.0 46 46 A Q > - 0 0 63 1,-0.1 3,-2.3 -26,-0.0 2,-1.3 -0.544 32.4-101.3 -88.6 152.0 -2.9 -11.2 -7.0 47 47 A Y T 3 S+ 0 0 159 1,-0.3 15,-0.2 -2,-0.2 16,-0.1 -0.603 123.8 41.5 -71.5 93.3 -2.2 -13.6 -4.1 48 48 A G T 3 S+ 0 0 28 -2,-1.3 -1,-0.3 14,-0.1 14,-0.1 0.311 73.1 128.2 141.9 -5.3 1.1 -11.8 -3.5 49 49 A D < - 0 0 0 -3,-2.3 -31,-1.3 -29,-0.1 -2,-0.1 0.444 57.8-141.8 -70.5 -7.5 -0.0 -8.1 -4.0 50 50 A K - 0 0 83 -33,-0.2 -32,-1.8 1,-0.1 2,-0.3 0.908 15.3-156.3 44.6 130.9 1.5 -6.8 -0.6 51 51 A L E -BC 17 59A 0 8,-1.8 8,-2.2 -34,-0.2 2,-0.3 -0.917 5.9-170.0-117.5 152.5 -0.1 -4.2 1.7 52 52 A V E -BC 16 58A 0 -36,-1.0 -36,-2.4 -2,-0.3 2,-0.2 -0.975 8.4-158.5-133.8 141.5 1.7 -2.0 4.2 53 53 A D E > -B 15 0A 0 4,-1.0 3,-2.1 -2,-0.3 -38,-0.2 -0.609 40.4 -90.1-109.5 174.8 -0.1 0.1 6.8 54 54 A S T 3 S+ 0 0 35 -42,-2.1 48,-0.3 -40,-0.9 49,-0.2 0.660 125.6 58.4 -60.9 -17.1 1.0 3.2 8.8 55 55 A N T 3 S- 0 0 95 -43,-0.3 -1,-0.3 2,-0.1 18,-0.2 0.243 117.5-110.9 -98.0 11.1 2.3 0.9 11.6 56 56 A F < + 0 0 33 -3,-2.1 17,-1.7 1,-0.3 2,-0.7 0.709 64.3 152.8 64.5 24.7 4.7 -1.0 9.2 57 57 A H E - D 0 72A 75 15,-0.2 -4,-1.0 -45,-0.1 -1,-0.3 -0.777 33.6-150.4 -75.6 115.0 2.7 -4.2 9.2 58 58 A C E -C 52 0A 5 13,-2.5 12,-1.7 -2,-0.7 2,-0.3 -0.623 17.2-176.1 -73.1 153.9 3.3 -6.0 5.9 59 59 A F E -CD 51 69A 4 -8,-2.2 -8,-1.8 10,-0.3 2,-0.3 -0.955 14.0-153.1-140.3 157.5 0.5 -8.2 4.6 60 60 A V E - D 0 68A 44 8,-1.6 8,-2.5 -2,-0.3 2,-0.3 -0.924 23.7-118.0-129.0 148.8 0.2 -10.5 1.6 61 61 A L E - D 0 67A 15 -15,-0.3 2,-0.2 -2,-0.3 6,-0.2 -0.712 29.0-153.6 -86.9 144.1 -3.1 -11.4 -0.1 62 62 A E > - 0 0 76 4,-2.5 3,-1.2 -2,-0.3 4,-0.2 -0.703 31.4-110.5-116.0 165.2 -4.3 -15.1 -0.2 63 63 A E T 3 S+ 0 0 152 1,-0.3 -1,-0.0 -2,-0.2 -2,-0.0 0.668 115.6 72.4 -68.2 -14.5 -6.5 -17.2 -2.5 64 64 A D T 3 S- 0 0 111 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.158 116.2-116.2 -81.0 16.1 -9.0 -17.1 0.5 65 65 A A S < S+ 0 0 89 -3,-1.2 2,-0.3 1,-0.2 -2,-0.1 0.811 82.0 108.6 45.8 37.4 -9.5 -13.4 -0.5 66 66 A H S S- 0 0 63 -4,-0.2 -4,-2.5 -58,-0.0 2,-0.5 -0.852 70.9-117.3-125.6 170.3 -8.1 -12.3 2.9 67 67 A W E -D 61 0A 13 -60,-0.9 -6,-0.2 -2,-0.3 -20,-0.0 -0.946 25.1-154.0-111.7 127.6 -4.9 -10.6 3.9 68 68 A H E -D 60 0A 89 -8,-2.5 -8,-1.6 -2,-0.5 2,-0.6 -0.776 29.5-101.9 -97.8 145.8 -2.5 -12.6 6.2 69 69 A P E -D 59 0A 86 0, 0.0 2,-0.3 0, 0.0 -10,-0.3 -0.602 36.5-173.8 -71.3 116.0 -0.0 -10.8 8.5 70 70 A A E - 0 0 41 -12,-1.7 -11,-0.1 -2,-0.6 -12,-0.1 -0.521 49.6 -77.1-117.9 57.4 3.3 -11.1 6.7 71 71 A A E - 0 0 66 -2,-0.3 -13,-2.5 -14,-0.1 -1,-0.4 0.482 52.8 -79.4 68.1 156.2 5.7 -9.6 9.4 72 72 A P E -D 57 0A 101 0, 0.0 -15,-0.2 0, 0.0 -16,-0.1 -0.404 51.2-124.2 -72.1 169.9 6.4 -6.1 10.6 73 73 A L - 0 0 42 -17,-1.7 5,-0.1 -18,-0.2 -2,-0.0 -0.877 11.1-114.4-126.2 144.7 8.7 -4.0 8.4 74 74 A P >> - 0 0 63 0, 0.0 3,-1.4 0, 0.0 4,-0.8 -0.289 37.9-103.6 -69.9 165.3 12.0 -2.1 9.0 75 75 A P H 3> S+ 0 0 100 0, 0.0 4,-0.6 0, 0.0 3,-0.3 0.805 126.6 48.1 -56.5 -31.1 12.2 1.7 8.6 76 76 A E H 3> S+ 0 0 144 1,-0.2 4,-1.6 2,-0.2 -3,-0.0 0.610 94.4 75.9 -81.7 -16.0 14.0 1.1 5.2 77 77 A G H <> S+ 0 0 7 -3,-1.4 4,-0.9 2,-0.2 -1,-0.2 0.775 90.8 54.6 -76.8 -22.2 11.3 -1.4 4.2 78 78 A L H >X S+ 0 0 1 -4,-0.8 4,-2.1 -3,-0.3 3,-0.9 0.936 106.3 52.8 -63.5 -48.5 8.9 1.4 3.4 79 79 A N H 3X S+ 0 0 27 -4,-0.6 4,-2.7 1,-0.2 -2,-0.2 0.866 101.0 61.6 -53.9 -37.8 11.6 2.8 1.2 80 80 A D H 3< S+ 0 0 117 -4,-1.6 4,-0.5 2,-0.2 -1,-0.2 0.822 107.9 43.9 -60.4 -34.4 11.8 -0.7 -0.6 81 81 A L H XX S+ 0 0 10 -3,-0.9 3,-2.2 -4,-0.9 4,-0.7 0.980 114.8 45.6 -67.8 -64.1 8.1 -0.2 -1.6 82 82 A I H 3X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.3 5,-0.3 0.794 97.1 75.0 -60.6 -27.0 8.5 3.5 -2.8 83 83 A R H 3X S+ 0 0 177 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.3 0.852 98.6 48.9 -45.0 -41.6 11.7 2.5 -4.6 84 84 A A H <> S+ 0 0 17 -3,-2.2 4,-2.9 -4,-0.5 5,-0.3 0.988 112.3 43.0 -64.6 -63.6 9.3 0.9 -7.2 85 85 A H H X S+ 0 0 0 -4,-0.7 4,-1.1 -62,-0.3 6,-0.2 0.864 119.7 45.3 -55.8 -40.1 6.8 3.9 -7.7 86 86 A C H X>S+ 0 0 2 -4,-3.0 4,-3.1 2,-0.2 5,-2.1 0.965 116.0 44.0 -68.5 -51.8 9.7 6.4 -7.8 87 87 A A H <5S+ 0 0 81 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.831 110.2 55.1 -65.7 -33.2 12.0 4.3 -10.2 88 88 A T H <5S+ 0 0 73 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.821 120.5 32.2 -71.1 -28.4 9.1 3.4 -12.5 89 89 A L H <5S- 0 0 88 -4,-1.1 -2,-0.2 -3,-0.5 -3,-0.1 0.912 117.9 -98.8 -88.4 -56.7 8.3 7.2 -12.9 90 90 A G T <5S+ 0 0 67 -4,-3.1 2,-0.2 -5,-0.2 -3,-0.2 0.415 71.9 134.3 143.0 9.4 11.6 8.9 -12.6 91 91 A H < + 0 0 82 -5,-2.1 -1,-0.2 -6,-0.2 2,-0.1 -0.610 25.2 174.3 -95.3 152.5 11.9 10.2 -9.0 92 92 A C - 0 0 98 1,-0.4 6,-0.0 -2,-0.2 -9,-0.0 -0.585 54.2 -71.1-155.5 89.6 14.7 10.0 -6.5 93 93 A C - 0 0 63 1,-0.1 -1,-0.4 -2,-0.1 3,-0.1 0.488 25.9-140.3 46.6 174.5 14.0 12.0 -3.2 94 94 A T S S- 0 0 111 1,-0.6 -1,-0.1 2,-0.2 3,-0.1 -0.473 74.8 -29.9-167.5 76.8 13.7 15.7 -2.2 95 95 A S S S+ 0 0 113 1,-0.1 -1,-0.6 4,-0.0 3,-0.1 0.488 111.3 33.3 72.0 145.6 15.3 16.2 1.3 96 96 A K S S- 0 0 135 1,-0.1 2,-2.5 -3,-0.1 -2,-0.2 0.036 115.6 -42.9 62.9 177.6 15.5 13.6 4.1 97 97 A M S S- 0 0 104 1,-0.1 2,-2.2 -4,-0.1 -1,-0.1 -0.334 93.7 -83.3 -76.0 62.1 15.8 9.8 3.6 98 98 A H S S+ 0 0 31 -2,-2.5 2,-0.3 -3,-0.1 -4,-0.2 -0.520 109.5 1.4 65.4 -72.5 13.3 9.7 0.8 99 99 A L - 0 0 12 -2,-2.2 -20,-0.1 1,-0.1 3,-0.1 -0.996 56.9-145.8-147.4 134.7 10.3 9.5 3.2 100 100 A H S S- 0 0 114 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.893 77.8 -34.6 -61.9 -48.1 10.0 9.6 7.0 101 101 A S S > S- 0 0 35 -23,-0.1 4,-1.7 1,-0.0 -1,-0.2 -0.904 75.4 -70.4-164.8-178.2 7.0 7.3 7.1 102 102 A V H > S+ 0 0 0 -48,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.872 124.8 58.5 -64.5 -38.2 3.7 6.2 5.3 103 103 A M H > S+ 0 0 116 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.949 108.7 45.8 -52.0 -50.4 2.0 9.6 6.2 104 104 A D H > S+ 0 0 58 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.830 109.6 55.3 -65.5 -36.3 4.7 11.4 4.4 105 105 A A H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.931 106.4 49.4 -61.3 -48.5 4.5 9.0 1.4 106 106 A I H X S+ 0 0 13 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.795 112.7 49.2 -65.2 -28.4 0.7 9.7 1.0 107 107 A D H X S+ 0 0 125 -4,-1.4 4,-1.0 -5,-0.2 -2,-0.2 0.942 114.9 45.0 -69.8 -48.4 1.6 13.4 1.1 108 108 A F H >X S+ 0 0 33 -4,-2.6 3,-1.2 1,-0.2 4,-0.8 0.968 108.5 53.0 -57.8 -65.1 4.4 13.0 -1.5 109 109 A L H 3X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.3 3,-0.5 0.748 104.3 58.1 -49.2 -34.0 2.6 10.7 -4.1 110 110 A N H 3< S+ 0 0 80 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 0.909 109.5 42.4 -62.2 -45.0 -0.3 13.2 -4.3 111 111 A A H << S+ 0 0 92 -3,-1.2 -1,-0.2 -4,-1.0 -2,-0.2 0.498 115.6 51.5 -82.5 -8.7 1.9 16.0 -5.5 112 112 A L H < S+ 0 0 33 -4,-0.8 -2,-0.2 -3,-0.5 -1,-0.2 0.849 87.3 93.3 -88.4 -50.5 3.9 13.8 -7.8 113 113 A E < 0 0 95 -4,-2.0 0, 0.0 -5,-0.1 0, 0.0 -0.060 360.0 360.0 -67.1 154.4 1.2 12.2 -9.8 114 114 A G 0 0 122 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.807 360.0 360.0-111.1 360.0 -0.1 13.6 -13.2