==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL TRANSPORT 01-DEC-10 3PSA . COMPND 2 MOLECULE: PROTEIN HI_1472; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR L.TIRADO-LEE,A.LEE,D.C.REES,H.W.PINKETT . 326 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14287.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 227 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 4.0 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 21 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 2 3 1 2 1 3 0 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 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 PARALLEL BRIDGES PER LADDER . 2 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 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 22 A D 0 0 138 0, 0.0 2,-0.4 0, 0.0 15,-0.1 0.000 360.0 360.0 360.0 170.3 -33.4 43.9 4.2 2 23 A R E -A 14 0A 47 12,-3.0 12,-2.6 13,-0.0 2,-0.5 -0.962 360.0-139.4-129.7 148.4 -35.6 42.4 1.5 3 24 A I E +A 13 0A 121 -2,-0.4 2,-0.3 10,-0.2 10,-0.2 -0.945 26.9 174.0-105.0 126.3 -39.1 43.2 0.4 4 25 A I E -A 12 0A 4 8,-2.8 8,-2.6 -2,-0.5 2,-0.5 -0.788 28.1-130.2-116.0 166.5 -41.4 40.2 -0.4 5 26 A T E -A 11 0A 59 -2,-0.3 6,-0.2 6,-0.2 105,-0.0 -0.980 26.2-150.8-114.6 124.5 -45.0 40.0 -1.3 6 27 A D > - 0 0 4 4,-2.8 3,-1.7 -2,-0.5 106,-0.2 -0.193 33.5 -93.2 -85.3-178.8 -47.0 37.4 0.7 7 28 A Q T 3 S+ 0 0 0 104,-2.4 105,-0.1 1,-0.3 -1,-0.1 0.360 126.0 60.0 -81.4 6.1 -50.1 35.5 -0.4 8 29 A L T 3 S- 0 0 43 103,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.179 121.8-110.2-101.0 14.6 -52.4 38.1 1.1 9 30 A D < + 0 0 78 -3,-1.7 2,-0.4 1,-0.3 -2,-0.2 0.637 69.6 151.7 63.4 21.9 -50.6 40.5 -1.5 10 31 A R - 0 0 67 101,-0.1 -4,-2.8 1,-0.0 2,-0.4 -0.647 46.6-132.4 -84.2 133.0 -48.9 42.3 1.5 11 32 A K E -A 5 0A 151 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.725 32.6-174.4 -83.1 129.5 -45.6 43.9 0.9 12 33 A V E -A 4 0A 10 -8,-2.6 -8,-2.8 -2,-0.4 2,-0.6 -0.993 21.1-147.8-138.3 125.5 -43.4 42.9 3.8 13 34 A T E +A 3 0A 76 -2,-0.4 -10,-0.2 -10,-0.2 96,-0.1 -0.850 28.0 171.6 -94.5 125.0 -39.9 43.9 4.7 14 35 A I E -A 2 0A 0 -12,-2.6 -12,-3.0 -2,-0.6 73,-0.1 -0.847 36.2 -86.0-127.2 163.0 -37.8 41.2 6.3 15 36 A P - 0 0 40 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.181 37.1-114.1 -63.3 160.5 -34.1 40.8 7.4 16 37 A D S S+ 0 0 77 1,-0.1 2,-0.4 -15,-0.1 -2,-0.0 0.840 104.7 30.6 -63.8 -36.3 -31.5 39.6 4.9 17 38 A H S S- 0 0 120 69,-0.0 2,-0.5 134,-0.0 -1,-0.1 -0.963 73.5-154.0-127.8 140.6 -31.1 36.4 6.9 18 39 A I + 0 0 1 -2,-0.4 3,-0.0 132,-0.2 23,-0.0 -0.975 31.0 146.7-117.5 127.0 -33.7 34.6 8.9 19 40 A N S S+ 0 0 98 -2,-0.5 -1,-0.1 23,-0.0 132,-0.0 0.433 70.7 50.4-135.1 -11.9 -32.7 32.3 11.9 20 41 A R S S+ 0 0 104 21,-0.1 66,-1.1 22,-0.1 67,-0.6 -0.312 70.7 163.4-130.2 54.5 -35.5 32.7 14.4 21 42 A A E -bc 41 87B 0 19,-2.9 21,-3.3 64,-0.2 22,-1.2 -0.406 26.8-151.4 -74.4 142.6 -38.7 32.1 12.4 22 43 A V E -bc 43 88B 0 65,-2.1 67,-2.5 20,-0.2 2,-0.7 -0.985 11.2-159.3-113.5 123.8 -42.0 31.4 14.2 23 44 A V E +bc 44 89B 0 20,-2.6 22,-1.7 -2,-0.5 67,-0.1 -0.858 16.0 177.2-113.6 103.2 -44.2 29.3 12.0 24 45 A L E + c 0 90B 0 65,-2.7 67,-0.6 -2,-0.7 2,-0.3 -0.146 62.2 69.2 -99.0 40.7 -47.9 29.4 13.0 25 46 A Q > - 0 0 0 65,-0.2 4,-2.1 -2,-0.1 5,-0.1 -0.926 67.8-145.1-156.9 131.4 -49.2 27.1 10.2 26 47 A H H > S+ 0 0 10 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.824 99.0 55.8 -69.3 -32.0 -48.7 23.4 9.7 27 48 A Q H > S+ 0 0 7 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.951 111.0 43.8 -66.4 -45.5 -48.5 23.6 5.9 28 49 A T H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 -2,-0.2 0.905 112.0 56.0 -63.9 -40.2 -45.7 26.1 6.0 29 50 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.942 107.9 46.9 -56.7 -45.3 -44.1 24.0 8.7 30 51 A N H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.886 111.3 50.8 -65.8 -39.5 -44.1 20.9 6.6 31 52 A I H X S+ 0 0 0 -4,-2.0 4,-0.8 2,-0.2 -2,-0.2 0.945 110.0 50.8 -63.4 -43.9 -42.7 22.8 3.5 32 53 A A H ><>S+ 0 0 0 -4,-3.1 5,-2.6 1,-0.2 3,-0.6 0.872 107.2 53.4 -62.8 -37.7 -39.9 24.2 5.8 33 54 A V H ><5S+ 0 0 0 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.919 110.1 48.7 -58.0 -44.1 -39.1 20.6 7.0 34 55 A Q H 3<5S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.609 107.5 53.9 -74.2 -10.0 -38.8 19.7 3.4 35 56 A L T <<5S- 0 0 0 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.332 113.5-118.0 -96.4 3.2 -36.5 22.6 2.6 36 57 A D T < 5S+ 0 0 55 -3,-1.3 3,-0.3 282,-0.3 -3,-0.2 0.865 76.0 131.2 59.5 38.9 -34.2 21.5 5.4 37 58 A A > < + 0 0 0 -5,-2.6 3,-2.3 1,-0.2 -4,-0.2 0.320 23.4 109.0-100.4 6.2 -35.0 24.9 7.2 38 59 A T G > + 0 0 7 -6,-0.3 3,-1.5 1,-0.3 -1,-0.2 0.755 69.4 66.1 -65.7 -20.3 -35.8 23.7 10.7 39 60 A K G 3 S+ 0 0 168 1,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.705 99.5 54.2 -69.0 -15.2 -32.5 25.1 12.2 40 61 A Q G < S+ 0 0 22 -3,-2.3 -19,-2.9 -20,-0.1 2,-0.4 0.229 94.0 89.0-100.6 9.3 -33.9 28.6 11.4 41 62 A I E < +b 21 0B 9 -3,-1.5 -19,-0.2 -21,-0.2 3,-0.1 -0.907 40.3 170.0-112.5 134.9 -37.2 28.0 13.3 42 63 A V E + 0 0 27 -21,-3.3 25,-0.7 -2,-0.4 2,-0.3 0.461 66.6 25.5-120.3 -5.7 -37.7 28.8 17.0 43 64 A G E -bd 22 67B 0 -22,-1.2 -20,-2.6 23,-0.1 -1,-0.3 -0.982 58.6-171.4-154.6 152.9 -41.4 28.4 17.5 44 65 A V E -b 23 0B 0 23,-2.2 26,-0.5 -2,-0.3 -20,-0.2 -0.913 42.4 -70.7-137.2 162.7 -44.4 26.6 16.0 45 66 A L > - 0 0 0 -22,-1.7 3,-1.3 -2,-0.3 26,-0.3 -0.280 44.1-126.5 -49.8 138.5 -48.2 26.4 16.2 46 67 A S T 3 S+ 0 0 59 24,-2.6 3,-0.4 1,-0.3 25,-0.1 0.810 106.3 53.2 -64.2 -28.9 -49.3 24.9 19.5 47 68 A N T 3> + 0 0 42 1,-0.2 4,-2.3 23,-0.1 3,-0.3 0.008 69.3 123.2 -97.6 30.4 -51.5 22.3 17.8 48 69 A W H <> S+ 0 0 5 -3,-1.3 4,-2.5 1,-0.2 5,-0.3 0.833 70.5 54.6 -61.6 -33.1 -48.8 20.9 15.5 49 70 A K H > S+ 0 0 108 -3,-0.4 4,-1.1 2,-0.2 -1,-0.2 0.875 112.5 43.8 -70.2 -40.5 -49.1 17.3 16.7 50 71 A K H 4 S+ 0 0 119 -3,-0.3 -2,-0.2 2,-0.2 -1,-0.2 0.907 118.0 44.0 -63.6 -46.9 -52.9 17.3 15.9 51 72 A Q H < S+ 0 0 28 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.795 125.0 32.2 -75.0 -31.1 -52.5 19.1 12.5 52 73 A L H < S- 0 0 13 -4,-2.5 -1,-0.2 -5,-0.2 -3,-0.2 0.543 114.6-113.7-101.1 -13.9 -49.5 17.0 11.3 53 74 A G >< - 0 0 6 -4,-1.1 3,-1.9 -5,-0.3 4,-0.3 0.195 30.6 -77.1 91.5 152.2 -50.4 13.7 13.1 54 75 A K T 3 S+ 0 0 149 189,-0.3 3,-0.3 1,-0.3 -1,-0.1 0.658 126.1 51.4 -55.4 -25.5 -48.7 11.8 15.9 55 76 A N T >> S+ 0 0 50 1,-0.2 3,-2.1 -3,-0.1 4,-0.6 0.466 82.0 92.8 -91.4 -8.0 -45.9 10.2 13.8 56 77 A Y H X> S+ 0 0 4 -3,-1.9 3,-1.6 1,-0.3 4,-1.5 0.875 74.0 67.7 -52.4 -39.8 -44.8 13.6 12.3 57 78 A V H 34 S+ 0 0 35 -4,-0.3 -1,-0.3 -3,-0.3 7,-0.2 0.632 88.8 66.2 -60.7 -11.7 -42.2 14.0 15.1 58 79 A R H <4 S+ 0 0 85 -3,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.885 105.6 41.9 -73.7 -37.5 -40.4 11.1 13.6 59 80 A L H << S+ 0 0 8 -3,-1.6 -2,-0.2 -4,-0.6 -1,-0.2 0.826 132.5 23.5 -74.0 -32.4 -39.6 13.2 10.5 60 81 A A >< + 0 0 0 -4,-1.5 3,-2.7 1,-0.1 4,-0.3 -0.571 65.9 167.9-137.3 66.9 -38.8 16.3 12.5 61 82 A P G > S+ 0 0 77 0, 0.0 3,-1.3 0, 0.0 4,-0.3 0.754 73.2 72.0 -58.2 -25.5 -37.8 15.2 16.0 62 83 A E G > S+ 0 0 77 1,-0.2 3,-0.7 2,-0.2 -5,-0.1 0.677 82.4 71.6 -60.3 -19.4 -36.5 18.8 16.7 63 84 A L G X S+ 0 0 0 -3,-2.7 3,-1.9 1,-0.2 -1,-0.2 0.823 79.6 78.0 -68.2 -27.0 -40.2 19.9 16.8 64 85 A E G < S+ 0 0 90 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.2 0.798 102.7 32.3 -49.0 -40.2 -40.6 18.1 20.2 65 86 A N G < S+ 0 0 159 -3,-0.7 2,-0.4 -4,-0.3 -1,-0.3 -0.084 90.6 128.1-113.8 30.3 -38.8 20.9 22.3 66 87 A M < - 0 0 20 -3,-1.9 -23,-0.1 1,-0.1 -22,-0.1 -0.761 64.0-114.0 -90.5 131.2 -39.9 23.8 20.1 67 88 A A B -d 43 0B 39 -25,-0.7 -23,-2.2 -2,-0.4 -1,-0.1 -0.281 22.6-150.9 -56.1 146.9 -41.6 26.8 21.9 68 89 A M + 0 0 95 -25,-0.2 -23,-0.1 1,-0.1 -22,-0.1 -0.689 25.2 165.1-129.3 81.5 -45.3 27.2 20.9 69 90 A P - 0 0 3 0, 0.0 7,-2.8 0, 0.0 11,-0.3 0.192 66.3 -14.0 -85.7 16.3 -46.2 31.0 21.2 70 91 A G B -F 75 0C 9 -26,-0.5 -24,-2.6 5,-0.3 5,-0.3 -0.977 60.5-132.4 172.3-177.1 -49.5 30.8 19.2 71 92 A D - 0 0 35 3,-2.5 3,-0.2 -26,-0.3 -47,-0.1 -0.642 52.6 -57.3-143.7-152.8 -51.6 28.7 16.9 72 93 A L S S+ 0 0 14 1,-0.2 19,-0.4 -2,-0.2 -48,-0.1 0.899 130.0 14.5 -64.3 -39.5 -53.6 29.0 13.6 73 94 A N S S+ 0 0 93 21,-0.1 2,-0.3 17,-0.1 -1,-0.2 0.179 123.3 45.9-127.5 12.0 -55.9 31.8 14.8 74 95 A S - 0 0 55 -3,-0.2 -3,-2.5 24,-0.1 2,-0.3 -0.955 56.8-161.4-149.8 165.6 -54.5 33.3 17.9 75 96 A V B -F 70 0C 18 -2,-0.3 2,-0.6 -5,-0.3 -5,-0.3 -0.977 17.6-140.1-148.8 148.6 -51.1 34.4 19.2 76 97 A N > - 0 0 80 -7,-2.8 4,-2.6 -2,-0.3 3,-0.1 -0.891 17.9-169.2-112.8 98.3 -49.6 35.1 22.6 77 98 A I H > S+ 0 0 25 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.818 83.2 52.3 -61.0 -42.5 -47.4 38.2 22.2 78 99 A E H > S+ 0 0 161 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.923 115.1 43.8 -59.7 -44.6 -45.6 38.1 25.5 79 100 A S H 4 S+ 0 0 57 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.922 114.0 52.2 -62.6 -40.6 -44.6 34.5 24.8 80 101 A L H >< S+ 0 0 0 -4,-2.6 3,-2.1 -11,-0.3 4,-0.3 0.952 105.8 51.0 -63.3 -54.6 -43.7 35.4 21.2 81 102 A L H >< S+ 0 0 69 -4,-2.8 3,-2.1 1,-0.3 -1,-0.2 0.835 98.4 67.2 -56.9 -32.9 -41.4 38.3 21.9 82 103 A A T 3< S+ 0 0 79 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.746 96.5 57.1 -56.5 -28.0 -39.4 36.1 24.4 83 104 A L T < S- 0 0 30 -3,-2.1 -1,-0.3 -4,-0.5 -2,-0.2 0.481 102.7-135.7 -83.1 -5.4 -38.2 34.1 21.4 84 105 A K < - 0 0 169 -3,-2.1 -3,-0.1 -4,-0.3 -2,-0.1 0.921 32.7-163.1 52.4 50.3 -36.8 37.2 19.7 85 106 A P - 0 0 17 0, 0.0 -64,-0.2 0, 0.0 -1,-0.1 -0.289 25.4-160.6 -71.6 148.3 -38.4 36.2 16.4 86 107 A D S S+ 0 0 33 -66,-1.1 2,-0.3 1,-0.3 -65,-0.2 0.590 77.4 3.8 -96.9 -17.1 -37.2 37.7 13.1 87 108 A V E -c 21 0B 0 -67,-0.6 -65,-2.1 20,-0.1 2,-0.4 -0.969 60.3-146.6-157.5 154.7 -40.4 36.7 11.1 88 109 A V E -ce 22 109B 0 20,-2.3 22,-2.6 -2,-0.3 2,-0.5 -0.967 9.3-153.8-126.8 122.7 -43.8 35.1 11.7 89 110 A F E +ce 23 110B 0 -67,-2.5 -65,-2.7 -2,-0.4 2,-0.3 -0.765 21.9 179.7 -86.9 132.1 -45.5 32.9 9.1 90 111 A V E -ce 24 111B 0 20,-2.1 22,-2.3 -2,-0.5 -65,-0.2 -0.894 31.8 -99.2-128.0 161.1 -49.3 32.8 9.5 91 112 A T E > - e 0 112B 0 -67,-0.6 3,-2.2 -19,-0.4 22,-0.2 -0.447 37.7-111.5 -76.2 154.4 -52.1 31.1 7.7 92 113 A N T 3 S+ 0 0 2 20,-1.6 21,-0.1 1,-0.3 -1,-0.1 0.801 115.9 49.6 -59.9 -30.4 -54.0 33.2 5.1 93 114 A Y T 3 S+ 0 0 58 19,-0.2 -1,-0.3 31,-0.1 32,-0.2 0.314 76.0 138.6 -92.5 8.7 -57.3 33.3 7.1 94 115 A A < - 0 0 7 -3,-2.2 -21,-0.1 1,-0.1 5,-0.1 -0.296 68.1 -96.6 -51.2 131.1 -55.5 34.4 10.4 95 116 A P >> - 0 0 53 0, 0.0 4,-1.9 0, 0.0 3,-1.0 -0.236 22.9-123.1 -57.4 146.6 -57.8 37.0 11.9 96 117 A S H 3> S+ 0 0 106 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.870 114.1 59.7 -50.1 -43.7 -56.9 40.6 11.2 97 118 A E H 3> S+ 0 0 150 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.844 105.7 48.2 -52.1 -40.2 -56.8 41.1 14.9 98 119 A M H <> S+ 0 0 4 -3,-1.0 4,-1.5 2,-0.2 -1,-0.2 0.886 111.2 47.3 -73.8 -45.2 -54.0 38.5 15.2 99 120 A I H X S+ 0 0 20 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.939 111.7 53.5 -63.0 -42.2 -51.9 39.9 12.3 100 121 A K H X S+ 0 0 124 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.883 104.4 54.5 -58.0 -41.6 -52.3 43.4 13.9 101 122 A Q H X S+ 0 0 78 -4,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.894 112.5 43.6 -61.5 -37.6 -51.0 42.2 17.3 102 123 A I H ><>S+ 0 0 0 -4,-1.5 5,-1.7 -3,-0.2 3,-1.0 0.931 115.3 46.7 -76.8 -41.0 -47.9 40.9 15.7 103 124 A S H ><5S+ 0 0 47 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.812 102.9 65.0 -69.6 -30.1 -47.3 44.0 13.5 104 125 A D H 3<5S+ 0 0 95 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.726 104.1 45.9 -67.2 -21.2 -47.9 46.3 16.4 105 126 A V T <<5S- 0 0 49 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.112 121.1-111.4-107.4 17.9 -44.7 44.9 18.1 106 127 A N T < 5 + 0 0 143 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.720 68.0 141.4 69.0 27.5 -42.8 45.2 14.8 107 128 A I < - 0 0 10 -5,-1.7 -1,-0.2 -20,-0.0 -2,-0.1 -0.901 56.2-114.2 -97.9 127.9 -42.3 41.6 13.9 108 129 A P - 0 0 33 0, 0.0 -20,-2.3 0, 0.0 2,-0.4 -0.335 29.1-151.6 -54.4 138.3 -42.7 41.0 10.1 109 130 A V E -e 88 0B 1 -22,-0.2 2,-0.5 -96,-0.1 -20,-0.2 -0.971 9.9-168.0-119.7 129.1 -45.6 38.7 9.2 110 131 A V E -e 89 0B 0 -22,-2.6 -20,-2.1 -2,-0.4 2,-0.4 -0.960 12.0-152.6-118.4 115.1 -45.7 36.5 6.1 111 132 A A E -e 90 0B 0 -2,-0.5 -104,-2.4 -22,-0.2 2,-0.5 -0.712 8.5-162.5 -92.4 135.6 -49.2 35.0 5.2 112 133 A I E +e 91 0B 0 -22,-2.3 -20,-1.6 -2,-0.4 -19,-0.2 -0.976 26.2 156.2-123.1 125.9 -49.3 31.8 3.3 113 134 A S - 0 0 0 -2,-0.5 -1,-0.1 -22,-0.2 27,-0.1 0.569 40.4-140.5-112.7 -23.5 -52.3 30.4 1.4 114 135 A L S S+ 0 0 0 25,-0.3 26,-0.5 1,-0.2 2,-0.3 0.777 75.4 91.2 54.5 29.7 -50.7 28.1 -1.1 115 136 A R - 0 0 1 24,-0.5 21,-0.2 23,-0.1 -1,-0.2 -0.993 51.5-173.3-149.0 141.0 -53.3 29.4 -3.6 116 137 A T + 0 0 27 19,-2.0 19,-0.1 -2,-0.3 -1,-0.1 0.498 43.6 112.0 -91.1-110.0 -53.6 32.2 -6.1 117 138 A G S S+ 0 0 30 14,-0.1 2,-0.2 17,-0.0 12,-0.1 -0.271 75.5 3.6 72.8-158.4 -57.1 32.6 -7.5 118 139 A E > - 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