==== 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 TRANSPORT PROTEIN 29-MAY-09 3HN0 . COMPND 2 MOLECULE: NITRATE TRANSPORT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PARABACTEROIDES DISTASONIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 560 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24519.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 394 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 61 10.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 32 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 174 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.1 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 4 1 0 2 2 4 4 0 1 1 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 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 PARALLEL BRIDGES PER LADDER . 0 2 4 3 3 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 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 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 23 A D 0 0 153 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.2 15.9 41.8 29.1 2 24 A T + 0 0 112 28,-0.0 29,-1.1 29,-0.0 2,-0.3 0.350 360.0 52.1-117.2 0.1 19.1 40.7 27.4 3 25 A V E S-a 31 0A 28 27,-0.2 2,-0.6 23,-0.0 29,-0.2 -0.920 71.5-129.6-133.6 158.6 18.7 36.9 27.6 4 26 A I E -a 32 0A 1 27,-2.6 29,-3.4 -2,-0.3 2,-0.6 -0.965 29.8-145.9-104.9 115.9 16.0 34.3 26.7 5 27 A K E -a 33 0A 90 -2,-0.6 49,-2.1 27,-0.2 48,-2.0 -0.767 16.1-173.6 -93.8 122.1 15.5 32.1 29.7 6 28 A V E -ab 34 54A 1 27,-2.8 29,-2.7 -2,-0.6 2,-0.5 -0.969 6.1-162.5-116.3 118.6 14.7 28.5 29.0 7 29 A S E -ab 35 55A 7 47,-2.8 49,-2.3 -2,-0.5 2,-0.5 -0.880 4.9-168.7-104.6 122.5 13.8 26.2 31.9 8 30 A V E -ab 36 56A 0 27,-2.8 29,-2.4 -2,-0.5 49,-0.1 -0.945 23.8-126.5-112.0 114.9 14.0 22.5 31.2 9 31 A L E -a 37 0A 25 47,-2.5 5,-0.3 -2,-0.5 4,-0.2 -0.455 46.2 -92.7 -55.1 131.4 12.5 20.1 33.8 10 32 A R S S+ 0 0 127 27,-3.1 -1,-0.1 -2,-0.1 3,-0.1 -0.194 89.2 66.8 -47.2 138.1 15.3 17.6 34.8 11 33 A G S > S- 0 0 11 1,-0.1 3,-1.4 -3,-0.1 4,-0.3 -0.916 102.3 -34.4 141.6-167.1 15.1 14.5 32.6 12 34 A P T >> S+ 0 0 28 0, 0.0 3,-1.2 0, 0.0 4,-0.7 0.678 115.2 75.7 -67.3 -18.9 15.6 13.4 29.0 13 35 A S H >> S+ 0 0 10 1,-0.3 4,-0.9 -4,-0.2 3,-0.8 0.822 83.7 69.3 -62.0 -25.0 14.2 16.6 27.4 14 36 A V H X4 S+ 0 0 0 -3,-1.4 3,-0.5 -5,-0.3 4,-0.5 0.841 88.6 65.9 -64.4 -25.9 17.6 18.2 28.3 15 37 A I H X4 S+ 0 0 0 -3,-1.2 3,-1.1 -4,-0.3 4,-0.3 0.912 97.7 51.3 -61.5 -39.0 19.1 16.0 25.7 16 38 A A H << S+ 0 0 0 -3,-0.8 -1,-0.3 -4,-0.7 3,-0.2 0.799 116.1 41.7 -63.0 -31.0 17.2 17.8 23.0 17 39 A F T XX S+ 0 0 0 -4,-0.9 3,-1.8 -3,-0.5 4,-0.8 0.318 83.2 109.6 -96.5 3.7 18.5 21.1 24.3 18 40 A A H X> S+ 0 0 3 -3,-1.1 4,-2.0 -4,-0.5 3,-1.2 0.846 73.7 55.1 -54.2 -43.4 22.1 19.9 24.9 19 41 A D H 3> S+ 0 0 38 -4,-0.3 4,-2.8 1,-0.3 -1,-0.3 0.721 99.6 62.5 -68.8 -18.0 23.6 21.8 22.2 20 42 A W H <4 S+ 0 0 8 -3,-1.8 14,-0.3 2,-0.2 -1,-0.3 0.729 105.6 46.3 -76.3 -21.7 22.1 25.0 23.6 21 43 A L H << S+ 0 0 33 -3,-1.2 -2,-0.2 -4,-0.8 -1,-0.2 0.885 117.6 43.1 -77.8 -44.0 24.2 24.5 26.8 22 44 A E H < S+ 0 0 80 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.929 137.4 9.9 -63.4 -46.9 27.2 23.7 24.7 23 45 A N S < S- 0 0 84 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 -0.743 82.0-146.0-141.5 77.4 26.7 26.6 22.2 24 46 A P - 0 0 57 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.272 20.0-126.6 -55.6 127.1 24.0 29.0 23.4 25 47 A P - 0 0 26 0, 0.0 7,-2.7 0, 0.0 2,-0.5 -0.314 13.7-138.7 -69.4 154.7 22.0 30.4 20.4 26 48 A I E -C 31 0A 122 5,-0.2 2,-0.5 -23,-0.1 5,-0.2 -0.987 20.9-178.0-117.2 122.9 21.6 34.1 20.0 27 49 A I E > S-C 30 0A 17 3,-2.7 3,-1.5 -2,-0.5 165,-0.0 -0.994 72.6 -14.8-122.1 123.5 18.2 35.4 18.8 28 50 A D T 3 S- 0 0 110 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.876 129.7 -53.2 51.8 43.0 17.6 39.1 18.3 29 51 A N T 3 S+ 0 0 149 1,-0.2 2,-0.5 -3,-0.0 -1,-0.3 0.716 115.8 119.8 64.2 23.6 20.8 39.9 20.2 30 52 A K E < - C 0 27A 42 -3,-1.5 -3,-2.7 -27,-0.0 2,-0.3 -0.987 62.0-132.8-116.5 127.4 19.6 37.8 23.1 31 53 A K E -aC 3 26A 68 -29,-1.1 -27,-2.6 -2,-0.5 2,-0.5 -0.613 20.0-128.0 -75.6 134.4 21.5 34.8 24.4 32 54 A V E -a 4 0A 2 -7,-2.7 2,-0.6 -2,-0.3 -27,-0.2 -0.710 26.5-162.9 -83.3 122.7 19.4 31.7 25.0 33 55 A Q E -a 5 0A 65 -29,-3.4 -27,-2.8 -2,-0.5 2,-0.5 -0.951 2.2-158.3-119.3 107.7 20.1 30.5 28.5 34 56 A V E +a 6 0A 13 -2,-0.6 2,-0.4 -14,-0.3 -27,-0.2 -0.779 12.0 179.3 -90.4 131.7 19.1 27.0 29.4 35 57 A K E -a 7 0A 116 -29,-2.7 -27,-2.8 -2,-0.5 2,-0.4 -0.994 23.6-134.1-129.9 133.8 18.6 26.1 33.1 36 58 A V E -a 8 0A 35 -2,-0.4 2,-0.3 -29,-0.2 -27,-0.2 -0.720 21.9-160.3 -85.1 132.1 17.6 22.7 34.4 37 59 A V E -a 9 0A 18 -29,-2.4 -27,-3.1 -2,-0.4 6,-0.0 -0.880 16.3-135.6-115.9 151.5 14.9 22.8 37.1 38 60 A D S S+ 0 0 104 -2,-0.3 3,-0.1 -29,-0.2 -1,-0.1 0.638 76.7 22.0 -89.6 -14.5 14.2 20.0 39.5 39 61 A S > - 0 0 33 1,-0.1 4,-2.9 18,-0.0 5,-0.2 -0.998 64.7-123.2-148.5 155.2 10.4 19.8 39.5 40 62 A P H > S+ 0 0 40 0, 0.0 4,-3.6 0, 0.0 5,-0.2 0.902 116.7 58.2 -53.3 -42.0 7.3 20.7 37.4 41 63 A D H > S+ 0 0 115 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.916 108.6 42.8 -51.1 -52.5 6.2 22.6 40.4 42 64 A L H > S+ 0 0 90 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.914 114.4 51.4 -65.2 -42.6 9.3 24.8 40.3 43 65 A A H X S+ 0 0 0 -4,-2.9 4,-1.7 2,-0.2 -2,-0.2 0.919 111.3 48.1 -57.7 -43.9 9.0 25.1 36.5 44 66 A Q H X S+ 0 0 35 -4,-3.6 4,-3.1 2,-0.2 5,-0.2 0.908 108.9 53.4 -62.5 -44.7 5.3 26.2 36.9 45 67 A A H X S+ 0 0 30 -4,-2.5 4,-3.2 -5,-0.2 6,-0.2 0.926 106.9 52.4 -58.3 -43.0 6.3 28.7 39.6 46 68 A L H <>S+ 0 0 38 -4,-2.3 5,-3.1 1,-0.2 6,-0.9 0.888 111.3 46.6 -60.7 -40.9 8.9 30.2 37.2 47 69 A L H ><5S+ 0 0 6 -4,-1.7 3,-1.3 3,-0.2 -2,-0.2 0.954 113.5 47.2 -65.7 -50.7 6.3 30.6 34.5 48 70 A I H 3<5S+ 0 0 93 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.944 114.6 46.8 -56.2 -47.4 3.7 32.1 36.9 49 71 A K T 3<5S- 0 0 125 -4,-3.2 -1,-0.3 -5,-0.2 -2,-0.2 0.532 111.1-123.5 -70.3 -4.3 6.3 34.5 38.3 50 72 A Q T < 5S+ 0 0 166 -3,-1.3 -3,-0.2 -4,-0.3 -4,-0.1 0.869 74.3 129.4 56.7 40.9 7.4 35.4 34.8 51 73 A E < + 0 0 98 -5,-3.1 2,-0.3 -6,-0.2 -4,-0.2 0.322 65.8 45.4-103.0 -0.3 10.9 34.4 35.7 52 74 A T - 0 0 1 -6,-0.9 -46,-0.2 -5,-0.1 3,-0.1 -0.973 61.2-159.6-136.7 155.1 11.3 32.1 32.7 53 75 A D S S+ 0 0 14 -48,-2.0 133,-1.8 1,-0.4 2,-0.3 0.775 82.1 18.9 -99.6 -38.0 10.4 32.8 29.1 54 76 A I E S-bD 6 185A 2 -49,-2.1 -47,-2.8 131,-0.2 -1,-0.4 -0.974 70.3-172.7-134.1 143.0 10.2 29.2 27.7 55 77 A A E -bD 7 184A 0 129,-2.3 129,-2.9 -2,-0.3 2,-0.5 -0.994 16.8-148.4-141.0 152.1 9.7 26.0 29.8 56 78 A V E +bD 8 183A 1 -49,-2.3 -47,-2.5 -2,-0.3 127,-0.2 -0.981 41.0 131.9-124.6 117.2 9.8 22.4 29.0 57 79 A L E - D 0 182A 4 125,-2.1 125,-3.0 -2,-0.5 5,-0.1 -0.919 60.3 -49.6-157.5 172.8 7.5 20.2 31.2 58 80 A P E > - D 0 181A 34 0, 0.0 4,-2.0 0, 0.0 3,-0.4 -0.195 45.8-126.7 -61.3 142.9 4.9 17.5 31.0 59 81 A X H > S+ 0 0 0 121,-2.5 4,-2.8 1,-0.2 5,-0.2 0.854 109.5 59.2 -53.8 -38.6 2.1 18.1 28.5 60 82 A I H > S+ 0 0 9 120,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.926 106.8 47.6 -62.2 -38.2 -0.6 17.5 31.2 61 83 A N H > S+ 0 0 34 -3,-0.4 4,-2.9 2,-0.2 5,-0.2 0.897 109.8 52.8 -65.1 -40.8 0.9 20.4 33.2 62 84 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.961 111.0 46.8 -60.5 -46.8 0.9 22.6 30.2 63 85 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.908 112.8 48.9 -58.9 -47.1 -2.7 21.8 29.6 64 86 A N H X S+ 0 0 33 -4,-2.4 4,-2.0 201,-0.3 6,-0.2 0.956 111.2 48.8 -60.8 -50.8 -3.7 22.5 33.2 65 87 A L H <>S+ 0 0 8 -4,-2.9 5,-2.3 1,-0.2 4,-0.5 0.919 113.3 47.9 -55.8 -45.1 -1.8 25.8 33.4 66 88 A Y H ><5S+ 0 0 38 -4,-2.6 3,-1.3 -5,-0.2 -1,-0.2 0.933 111.7 49.4 -60.1 -47.6 -3.5 26.9 30.1 67 89 A N H 3<5S+ 0 0 11 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.789 107.6 56.1 -62.9 -28.7 -6.9 25.8 31.4 68 90 A K T 3<5S- 0 0 134 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.507 124.4-100.9 -84.5 -5.6 -6.3 27.7 34.6 69 91 A G T < 5 + 0 0 53 -3,-1.3 -3,-0.2 -4,-0.5 2,-0.2 0.456 68.1 150.4 103.2 4.6 -5.6 31.0 32.8 70 92 A I < - 0 0 46 -5,-2.3 2,-1.8 -6,-0.2 -1,-0.3 -0.521 55.1-115.9 -67.6 134.8 -1.8 31.1 32.9 71 93 A K S S+ 0 0 161 -2,-0.2 2,-0.3 -24,-0.1 -1,-0.1 -0.555 71.3 115.7 -82.4 81.3 -0.6 33.1 29.8 72 94 A I - 0 0 4 -2,-1.8 2,-0.3 114,-0.2 114,-0.2 -0.950 43.3-159.3-134.4 159.9 1.3 30.3 27.9 73 95 A K E -E 185 0A 71 112,-1.8 112,-2.0 -2,-0.3 2,-0.6 -0.951 27.9-105.8-132.4 160.9 0.9 28.6 24.6 74 96 A L E -E 184 0A 0 201,-3.5 110,-0.2 -2,-0.3 170,-0.2 -0.741 27.5-179.8 -87.6 120.9 2.2 25.3 23.4 75 97 A A E - 0 0 0 108,-2.9 169,-3.1 -2,-0.6 170,-0.4 0.930 54.7 -84.2 -77.3 -51.5 5.1 25.5 20.8 76 98 A G E -EF 183 243A 1 107,-1.1 107,-2.6 167,-0.3 -1,-0.3 -0.974 41.3 -73.3 169.7-165.0 5.5 21.8 20.3 77 99 A C E - F 0 242A 1 165,-2.5 165,-2.1 -2,-0.3 105,-0.1 -0.995 24.5-175.8-132.9 129.4 7.1 18.6 21.6 78 100 A P E + 0 0 0 0, 0.0 162,-1.6 0, 0.0 2,-0.4 0.413 68.2 48.8-104.9 -3.1 10.8 17.6 21.3 79 101 A I E + F 0 239A 2 160,-0.2 102,-0.4 102,-0.2 101,-0.3 -0.999 45.0 174.0-145.8 139.9 10.9 14.1 22.7 80 102 A W + 0 0 11 157,-1.5 2,-0.6 158,-1.2 158,-0.2 0.410 64.0 72.9-128.8 -4.7 8.8 11.1 21.9 81 103 A G + 0 0 2 156,-2.3 67,-0.3 1,-0.1 -1,-0.1 -0.853 49.5 129.8-120.7 91.5 10.4 8.1 23.8 82 104 A T + 0 0 25 -2,-0.6 2,-0.4 1,-0.2 -1,-0.1 0.659 56.6 50.6-117.5 -19.6 9.7 8.4 27.5 83 105 A L + 0 0 2 64,-0.1 84,-2.3 62,-0.0 2,-0.3 -0.973 51.3 167.3-136.7 124.6 8.3 5.2 28.9 84 106 A Y E -GH 146 166B 9 62,-2.1 62,-2.2 -2,-0.4 2,-0.5 -0.963 29.4-128.6-130.2 146.7 9.5 1.6 28.6 85 107 A L E -GH 145 165B 3 80,-2.7 79,-2.9 -2,-0.3 80,-1.3 -0.854 26.2-170.8 -93.6 132.1 8.6 -1.6 30.4 86 108 A V E -GH 144 163B 0 58,-3.0 58,-2.1 -2,-0.5 2,-0.3 -0.917 3.9-177.2-121.4 146.2 11.5 -3.7 31.8 87 109 A E E -GH 143 162B 30 75,-2.4 75,-2.1 -2,-0.4 2,-0.3 -0.994 19.6-131.3-141.9 145.7 11.4 -7.2 33.2 88 110 A K - 0 0 43 54,-2.3 73,-0.1 -2,-0.3 54,-0.1 -0.711 30.3-110.6 -91.5 147.5 13.8 -9.5 34.8 89 111 A T S S+ 0 0 108 71,-0.4 2,-0.1 -2,-0.3 -2,-0.0 -0.998 105.2 38.2-118.4 122.7 14.2 -13.2 33.8 90 112 A P S S- 0 0 84 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 0.550 91.7-141.5 -74.7 158.5 13.3 -15.1 35.8 91 113 A L + 0 0 67 -2,-0.1 -2,-0.1 1,-0.1 52,-0.0 -0.794 27.6 171.6 -89.4 104.9 10.3 -13.3 37.0 92 114 A K + 0 0 150 -2,-0.9 -1,-0.1 1,-0.3 50,-0.0 0.562 67.7 9.2 -78.1-124.1 10.0 -13.8 40.8 93 115 A E S S- 0 0 94 1,-0.1 49,-0.4 47,-0.0 -1,-0.3 -0.379 77.9-149.3 -62.5 130.5 7.3 -11.6 42.4 94 116 A P + 0 0 59 0, 0.0 -1,-0.1 0, 0.0 47,-0.0 0.227 43.4 134.7 -99.4 14.8 5.4 -10.1 39.5 95 117 A A - 0 0 18 25,-0.1 2,-0.7 1,-0.1 48,-0.5 -0.374 52.5-131.4 -61.8 140.4 4.1 -6.6 40.7 96 118 A L E -i 122 0B 0 25,-3.2 27,-2.7 46,-0.1 2,-0.5 -0.866 19.9-143.9 -94.5 116.0 4.7 -3.9 38.1 97 119 A Y E -ij 123 144B 19 46,-2.5 48,-1.6 -2,-0.7 2,-0.4 -0.728 19.1-173.3 -88.8 130.6 6.3 -0.9 39.8 98 120 A V - 0 0 1 25,-2.0 3,-0.3 -2,-0.5 28,-0.2 -0.968 10.6-152.2-128.1 129.1 5.2 2.4 38.6 99 121 A F S S+ 0 0 37 -2,-0.4 29,-0.2 46,-0.3 28,-0.2 -0.465 73.5 39.1 -90.4 168.2 6.5 5.9 39.5 100 122 A G S > S- 0 0 10 27,-2.5 3,-2.5 -2,-0.2 6,-0.6 0.868 78.2-150.5 59.5 43.6 4.5 9.1 39.4 101 123 A N T 3 S+ 0 0 85 -3,-0.3 -1,-0.1 1,-0.3 3,-0.1 -0.147 79.5 15.6 -41.4 131.0 1.2 7.8 40.7 102 124 A G T 3 S+ 0 0 26 1,-0.3 -1,-0.3 2,-0.1 2,-0.2 0.389 113.4 89.1 80.4 0.3 -1.6 9.8 39.2 103 125 A T S X> S- 0 0 59 -3,-2.5 4,-2.2 -4,-0.2 3,-0.5 -0.506 96.9 -66.2-120.8-174.9 0.5 11.4 36.4 104 126 A T H 3> S+ 0 0 9 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.858 125.5 49.2 -44.3 -58.3 1.5 10.6 32.8 105 127 A P H 3> S+ 0 0 20 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.901 114.4 46.6 -56.2 -38.9 3.7 7.5 33.4 106 128 A D H <> S+ 0 0 0 -6,-0.6 4,-2.7 -3,-0.5 5,-0.2 0.968 113.9 46.3 -63.6 -52.8 1.0 5.8 35.6 107 129 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.922 113.3 49.2 -58.3 -45.2 -1.9 6.6 33.2 108 130 A L H X S+ 0 0 1 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.818 109.6 51.8 -66.2 -33.0 0.0 5.4 30.2 109 131 A T H X S+ 0 0 0 -4,-1.5 4,-2.6 -5,-0.3 5,-0.2 0.943 110.6 48.3 -68.3 -44.9 1.0 2.2 31.9 110 132 A R H X S+ 0 0 63 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.920 112.0 50.4 -61.2 -38.8 -2.6 1.5 32.8 111 133 A Y H X S+ 0 0 44 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.920 110.7 48.3 -62.7 -47.0 -3.6 2.3 29.2 112 134 A Y H X S+ 0 0 27 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.927 110.8 50.1 -59.9 -45.6 -1.0 -0.1 27.8 113 135 A L H X>S+ 0 0 9 -4,-2.6 5,-2.5 1,-0.2 4,-0.7 0.928 113.5 46.3 -63.9 -43.1 -2.0 -2.9 30.2 114 136 A G H ><5S+ 0 0 45 -4,-2.3 3,-0.8 -5,-0.2 -1,-0.2 0.935 113.1 48.6 -60.8 -48.6 -5.7 -2.5 29.2 115 137 A R H 3<5S+ 0 0 70 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.874 117.2 41.6 -59.0 -40.7 -4.9 -2.3 25.5 116 138 A Q H 3<5S- 0 0 46 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.476 109.8-121.4 -88.9 -3.6 -2.7 -5.5 25.6 117 139 A R T <<5 + 0 0 219 -3,-0.8 2,-0.3 -4,-0.7 -3,-0.2 0.910 67.5 133.9 61.1 46.0 -5.0 -7.4 28.0 118 140 A L < - 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