==== 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 HYDROLASE 09-JUL-04 1TZ2 . COMPND 2 MOLECULE: 1-AMINOCYCLOPROPANE-1-CARBOXYLATE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS SP.; . AUTHOR S.KARTHIKEYAN,Q.ZHOU,Z.ZHAO,C.L.KAO,Z.TAO,H.ROBINSON,H.W.LIU . 1330 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43594.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1001 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 153 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 1.7 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 . 3 0.2 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 . 112 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 184 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 432 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 41 3.1 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 1 0 6 2 4 0 1 5 2 7 5 2 4 0 2 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 11 5 4 4 4 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 . 3 0 4 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 4 0 4 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 58 0, 0.0 240,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 175.6 26.1 28.2 178.9 2 2 A N > + 0 0 78 238,-3.0 3,-0.6 1,-0.1 4,-0.1 -0.656 360.0 157.3-151.5 91.1 25.1 31.6 177.6 3 3 A L G > S+ 0 0 1 1,-0.2 3,-2.2 -2,-0.2 -1,-0.1 0.751 71.9 77.0 -79.7 -29.2 23.7 32.0 174.1 4 4 A Q G 3 S+ 0 0 125 1,-0.3 -1,-0.2 -3,-0.1 4,-0.1 0.583 76.0 78.3 -59.9 -11.0 22.0 35.2 175.1 5 5 A R G < S+ 0 0 62 -3,-0.6 -1,-0.3 235,-0.1 -2,-0.2 0.850 86.5 67.7 -67.4 -32.8 25.5 36.8 174.8 6 6 A F S < S- 0 0 50 -3,-2.2 -1,-0.0 -4,-0.1 234,-0.0 -0.764 91.7-118.1 -94.6 127.4 25.0 36.9 171.0 7 7 A P - 0 0 87 0, 0.0 2,-0.5 0, 0.0 54,-0.1 -0.223 22.9-147.8 -61.3 149.6 22.4 39.2 169.5 8 8 A R - 0 0 118 -4,-0.1 49,-0.2 52,-0.1 48,-0.1 -0.983 2.1-149.0-124.3 122.8 19.5 37.6 167.6 9 9 A Y - 0 0 78 47,-2.8 2,-0.3 -2,-0.5 50,-0.1 -0.815 28.6-120.8 -91.9 117.4 17.8 39.3 164.7 10 10 A P + 0 0 75 0, 0.0 43,-0.1 0, 0.0 -1,-0.0 -0.386 54.0 144.5 -61.8 117.1 14.1 38.3 164.5 11 11 A L + 0 0 10 -2,-0.3 34,-0.4 41,-0.1 33,-0.3 0.339 57.8 70.3-128.8 -3.5 13.3 36.6 161.2 12 12 A T S S- 0 0 29 31,-0.1 31,-0.2 32,-0.1 30,-0.1 -0.619 85.1-116.2-113.6 170.6 10.8 34.1 162.6 13 13 A F S S- 0 0 73 29,-2.3 30,-0.1 1,-0.4 29,-0.1 0.778 74.4 -87.9 -77.2 -24.5 7.3 34.3 164.0 14 14 A G S S- 0 0 25 28,-0.4 -1,-0.4 0, 0.0 -3,-0.0 -0.905 83.5 -1.5 143.6-169.3 8.6 33.0 167.4 15 15 A P S S- 0 0 94 0, 0.0 154,-0.0 0, 0.0 -2,-0.0 -0.097 78.3-114.8 -47.2 146.1 9.2 29.6 168.9 16 16 A T - 0 0 2 1,-0.1 23,-0.1 153,-0.1 26,-0.1 -0.719 30.1-114.9 -90.6 135.9 8.2 26.9 166.5 17 17 A P - 0 0 43 0, 0.0 21,-2.5 0, 0.0 2,-0.4 -0.237 17.4-139.8 -68.1 154.0 5.3 24.6 167.6 18 18 A I E -A 37 0A 33 19,-0.2 19,-0.3 20,-0.1 296,-0.0 -0.942 20.8-171.8-113.1 135.6 5.6 20.9 168.3 19 19 A Q E -A 36 0A 55 17,-3.0 17,-2.2 -2,-0.4 2,-0.1 -0.990 22.9-119.4-132.9 137.1 2.8 18.6 167.1 20 20 A P E -A 35 0A 80 0, 0.0 2,-0.6 0, 0.0 15,-0.3 -0.410 10.3-147.2 -72.5 149.5 2.1 15.0 167.8 21 21 A L > + 0 0 2 13,-3.7 4,-2.9 1,-0.2 13,-0.4 -0.605 37.8 156.6-112.3 68.0 2.1 12.6 164.8 22 22 A A H > + 0 0 65 -2,-0.6 4,-2.6 2,-0.2 5,-0.2 0.840 68.4 50.5 -63.8 -37.9 -0.5 10.4 166.3 23 23 A R H > S+ 0 0 95 2,-0.2 4,-3.1 -3,-0.2 5,-0.2 0.975 115.0 42.1 -67.1 -52.9 -1.7 8.9 163.1 24 24 A L H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.933 114.6 53.3 -58.1 -44.6 1.7 8.0 161.9 25 25 A S H <>S+ 0 0 9 -4,-2.9 5,-2.6 2,-0.2 4,-0.3 0.932 112.7 43.1 -55.2 -49.3 2.6 6.8 165.4 26 26 A K H ><5S+ 0 0 167 -4,-2.6 3,-2.9 1,-0.2 -2,-0.2 0.962 109.6 56.3 -62.3 -52.3 -0.4 4.5 165.4 27 27 A H H 3<5S+ 0 0 114 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.838 106.6 52.7 -47.3 -38.1 0.1 3.3 161.9 28 28 A L T 3<5S- 0 0 30 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.512 136.9 -79.4 -79.5 -6.5 3.6 2.2 162.9 29 29 A G T < 5 - 0 0 56 -3,-2.9 -3,-0.2 -4,-0.3 -2,-0.2 0.335 50.4-105.6 127.1 -8.5 2.4 0.2 165.9 30 30 A G S + b 0 315A 9 -21,-2.5 3,-1.6 -2,-0.6 278,-0.1 -0.429 46.9 150.9 -79.2 72.6 7.8 22.7 162.7 39 39 A E G > S+ 0 0 0 -2,-1.8 3,-1.9 276,-0.9 10,-0.4 0.833 73.2 69.6 -65.5 -29.8 10.9 24.7 161.7 40 40 A D G 3 S+ 0 0 20 275,-1.4 -1,-0.3 1,-0.3 3,-0.1 0.526 101.4 45.0 -64.4 -6.2 9.4 24.7 158.2 41 41 A C G < S+ 0 0 25 -3,-1.6 -1,-0.3 274,-0.2 -2,-0.2 0.091 81.2 109.1-125.2 22.3 6.7 27.0 159.4 42 42 A N S < S+ 0 0 3 -3,-1.9 -29,-2.3 5,-0.2 -28,-0.4 0.523 73.7 34.9 -78.8 -6.1 8.9 29.4 161.3 43 43 A S - 0 0 4 4,-0.3 4,-0.3 -31,-0.2 -31,-0.1 -0.995 52.9-141.5-157.9 156.3 8.7 32.4 159.0 44 44 A G S S+ 0 0 3 -2,-0.3 2,-1.2 -33,-0.3 569,-0.3 0.453 78.9 103.2 -87.4 -3.3 6.8 34.7 156.6 45 45 A L S > S- 0 0 11 -34,-0.4 3,-2.8 1,-0.2 567,-0.2 -0.681 114.3 -52.5 -86.4 91.5 10.0 35.0 154.5 46 46 A A T 3 S- 0 0 5 -2,-1.2 -1,-0.2 565,-0.8 -2,-0.1 0.857 108.8 -52.1 41.2 52.5 9.4 32.8 151.5 47 47 A F T 3 S- 0 0 38 -4,-0.3 -4,-0.3 -3,-0.1 -1,-0.3 0.272 80.6-153.3 74.5 -10.6 8.5 29.8 153.7 48 48 A G < + 0 0 1 -3,-2.8 270,-0.4 -6,-0.1 2,-0.3 -0.009 19.7 175.5 44.7-138.7 11.7 30.1 155.8 49 49 A G >> - 0 0 0 -10,-0.4 3,-1.4 1,-0.1 4,-1.0 -0.809 53.5 -34.1 129.7-174.1 12.9 26.8 157.4 50 50 A N H >> S+ 0 0 8 266,-3.9 4,-1.7 1,-0.3 3,-0.7 0.845 129.3 57.9 -50.5 -40.3 15.9 25.7 159.4 51 51 A K H 3> S+ 0 0 8 265,-0.3 4,-2.7 1,-0.3 -1,-0.3 0.797 100.3 58.4 -63.8 -26.7 18.4 28.1 157.7 52 52 A T H <> S+ 0 0 0 -3,-1.4 4,-1.0 2,-0.2 -1,-0.3 0.838 102.1 53.1 -73.0 -30.8 16.3 31.1 158.6 53 53 A R H XX S+ 0 0 14 -4,-1.0 3,-0.7 -3,-0.7 4,-0.5 0.946 111.4 47.9 -66.9 -42.2 16.7 30.2 162.3 54 54 A K H >X S+ 0 0 0 -4,-1.7 3,-1.7 1,-0.2 4,-0.5 0.937 104.2 60.4 -61.8 -45.4 20.5 30.1 161.7 55 55 A L H >X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.3 3,-1.1 0.770 86.9 75.4 -56.0 -27.0 20.4 33.4 159.9 56 56 A E H << S+ 0 0 4 -4,-1.0 -47,-2.8 -3,-0.7 -1,-0.3 0.863 100.5 42.1 -55.0 -35.0 19.0 35.2 163.0 57 57 A Y H << S+ 0 0 22 -3,-1.7 4,-0.3 -4,-0.5 -1,-0.3 0.565 114.9 49.7 -90.2 -7.6 22.5 35.0 164.6 58 58 A L H XX S+ 0 0 0 -3,-1.1 4,-1.8 -4,-0.5 3,-0.7 0.835 97.7 66.2 -93.7 -39.7 24.5 36.0 161.5 59 59 A I H 3X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.802 92.7 59.7 -52.9 -40.6 22.5 39.1 160.4 60 60 A P H 3> S+ 0 0 25 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.912 109.5 45.3 -57.4 -40.7 23.5 41.2 163.5 61 61 A E H <> S+ 0 0 64 -3,-0.7 4,-3.1 -4,-0.3 -2,-0.2 0.901 109.9 53.1 -68.4 -42.6 27.1 40.8 162.5 62 62 A A H <>S+ 0 0 0 -4,-1.8 5,-2.6 1,-0.2 -1,-0.2 0.886 115.0 42.5 -60.5 -38.1 26.4 41.6 158.8 63 63 A L H ><5S+ 0 0 74 -4,-2.3 3,-1.2 3,-0.2 -1,-0.2 0.878 112.1 53.1 -75.6 -39.6 24.7 44.7 159.9 64 64 A A H 3<5S+ 0 0 83 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.961 108.2 50.3 -60.2 -49.9 27.3 45.6 162.4 65 65 A Q T 3<5S- 0 0 90 -4,-3.1 -1,-0.3 -5,-0.1 -2,-0.2 0.454 116.1-118.3 -68.5 0.6 30.1 45.3 159.8 66 66 A G T < 5 + 0 0 49 -3,-1.2 -3,-0.2 1,-0.2 -2,-0.1 0.775 52.7 166.9 69.1 26.8 28.0 47.6 157.6 67 67 A C < - 0 0 11 -5,-2.6 -1,-0.2 -6,-0.2 3,-0.1 -0.350 23.2-171.0 -71.9 157.2 27.6 45.0 154.8 68 68 A D + 0 0 55 80,-2.5 26,-2.6 1,-0.2 2,-0.3 0.323 65.9 51.7-129.2 3.5 25.0 45.8 152.1 69 69 A T E -fg 94 149B 4 79,-1.4 81,-2.8 24,-0.2 2,-0.5 -0.984 64.7-146.4-147.0 131.7 24.9 42.5 150.2 70 70 A L E -fg 95 150B 0 24,-2.6 26,-2.4 -2,-0.3 2,-0.4 -0.855 18.9-169.4 -99.3 129.6 24.4 38.9 151.3 71 71 A V E +fg 96 151B 0 79,-2.2 81,-3.0 -2,-0.5 2,-0.3 -0.964 18.3 146.5-118.8 134.0 26.3 36.4 149.2 72 72 A S E -f 97 0B 0 24,-2.0 26,-2.2 -2,-0.4 2,-0.3 -0.848 24.1-145.2-151.5-169.6 25.8 32.6 149.6 73 73 A I E +f 98 0B 12 79,-0.4 82,-0.5 -2,-0.3 2,-0.3 -0.998 24.9 126.3-164.3 158.9 25.8 29.4 147.7 74 74 A G E -f 99 0B 0 24,-1.8 26,-1.8 -2,-0.3 -2,-0.0 -0.955 54.6 -45.9 168.5-178.7 24.3 26.0 147.1 75 75 A G E > -f 100 0B 2 1259,-0.3 3,-1.3 -2,-0.3 26,-0.2 0.061 64.2 -89.8 -63.8 178.6 22.8 23.6 144.6 76 76 A I T 3 S+ 0 0 3 24,-0.7 40,-0.2 1,-0.3 25,-0.1 0.929 130.1 35.0 -57.8 -47.1 20.1 24.5 142.0 77 77 A Q T 3 S+ 0 0 9 38,-0.1 -1,-0.3 39,-0.1 38,-0.2 0.199 87.4 151.7 -95.3 19.8 17.3 23.6 144.4 78 78 A S <> - 0 0 1 -3,-1.3 4,-0.7 1256,-0.2 -4,-0.1 -0.167 36.9-159.1 -50.9 137.1 19.1 24.8 147.5 79 79 A N H > S+ 0 0 4 2,-0.2 4,-2.3 1,-0.1 5,-0.2 0.842 89.2 64.0 -83.1 -38.2 16.8 26.0 150.4 80 80 A Q H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.910 100.9 47.8 -50.4 -53.1 19.6 28.0 151.9 81 81 A T H > S+ 0 0 1 1253,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.904 109.9 52.6 -62.7 -38.3 20.0 30.4 148.9 82 82 A R H X S+ 0 0 1 -4,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.931 111.2 46.6 -62.7 -43.6 16.2 31.0 148.7 83 83 A Q H X S+ 0 0 1 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.877 110.6 53.0 -67.2 -35.0 16.1 32.0 152.5 84 84 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.912 109.8 49.3 -64.1 -42.1 19.2 34.2 152.0 85 85 A A H X S+ 0 0 1 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.883 113.3 45.3 -63.0 -40.8 17.4 35.9 149.2 86 86 A A H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.929 114.0 48.4 -70.7 -44.8 14.2 36.5 151.2 87 87 A V H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.930 112.1 50.0 -60.4 -44.8 16.1 37.6 154.3 88 88 A A H X>S+ 0 0 0 -4,-2.6 5,-3.0 2,-0.2 4,-1.6 0.949 111.4 47.0 -59.2 -52.0 18.2 40.1 152.2 89 89 A A H ><5S+ 0 0 7 -4,-2.2 3,-0.9 1,-0.2 -1,-0.2 0.951 112.8 50.9 -53.8 -50.0 15.1 41.5 150.5 90 90 A H H 3<5S+ 0 0 56 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.863 113.4 45.3 -56.6 -39.3 13.5 41.9 153.9 91 91 A L H 3<5S- 0 0 30 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.640 115.7-111.6 -82.4 -13.3 16.5 43.6 155.2 92 92 A G T <<5S+ 0 0 42 -4,-1.6 2,-0.3 -3,-0.9 -3,-0.2 0.730 74.4 132.8 89.0 21.6 17.0 46.0 152.3 93 93 A M < - 0 0 19 -5,-3.0 -1,-0.3 -6,-0.2 -24,-0.2 -0.729 57.3-119.6-107.1 156.3 20.2 44.2 151.2 94 94 A K E -f 69 0B 141 -26,-2.6 -24,-2.6 -2,-0.3 2,-0.3 -0.363 30.4-150.6 -82.4 172.9 21.3 43.1 147.8 95 95 A C E -f 70 0B 10 28,-0.3 30,-2.7 -26,-0.3 2,-0.4 -0.975 15.2-168.6-152.5 133.5 22.0 39.4 147.3 96 96 A V E -fh 71 125B 11 -26,-2.4 -24,-2.0 -2,-0.3 2,-0.4 -0.990 11.9-167.5-123.5 131.6 24.2 37.3 145.1 97 97 A L E -fh 72 126B 0 28,-3.0 30,-3.1 -2,-0.4 2,-0.6 -0.973 13.1-155.4-124.1 130.7 23.8 33.6 144.9 98 98 A V E -fh 73 127B 1 -26,-2.2 -24,-1.8 -2,-0.4 2,-0.6 -0.916 17.3-167.6-100.3 117.3 26.2 31.1 143.3 99 99 A Q E -fh 74 128B 0 28,-3.3 30,-1.8 -2,-0.6 -24,-0.2 -0.939 5.7-171.2-111.3 120.9 24.1 28.0 142.3 100 100 A E E -f 75 0B 54 -26,-1.8 2,-1.7 -2,-0.6 -24,-0.7 -0.653 36.3-105.0-106.9 163.3 26.1 25.0 141.4 101 101 A N + 0 0 62 -2,-0.2 -26,-0.1 -26,-0.2 -2,-0.0 -0.634 51.8 160.0 -84.8 81.2 25.1 21.7 139.9 102 102 A W + 0 0 77 -2,-1.7 2,-0.4 2,-0.0 -1,-0.2 0.441 53.2 61.7 -82.8 -0.2 25.3 19.7 143.1 103 103 A V S S- 0 0 17 2,-0.2 2,-2.2 -3,-0.1 160,-0.1 -0.984 75.6-130.3-137.1 142.2 23.1 16.9 141.9 104 104 A N S S+ 0 0 126 158,-0.4 2,-0.3 -2,-0.4 -2,-0.0 -0.502 73.2 113.9 -83.6 68.8 23.1 14.3 139.2 105 105 A Y - 0 0 30 -2,-2.2 -2,-0.2 2,-0.1 1002,-0.0 -0.993 44.0-172.5-140.0 140.7 19.5 15.2 138.2 106 106 A S + 0 0 28 -2,-0.3 1221,-0.5 4,-0.0 1222,-0.3 -0.261 17.6 165.5-134.7 52.3 18.4 16.8 134.9 107 107 A D > - 0 0 0 217,-0.2 3,-1.9 1,-0.1 4,-0.3 -0.444 45.1-118.5 -70.6 139.9 14.7 17.7 135.1 108 108 A A T 3 S+ 0 0 1 1,-0.3 3,-0.1 -2,-0.2 -1,-0.1 0.727 112.1 26.5 -50.0 -32.0 13.3 20.0 132.5 109 109 A V T >> S+ 0 0 0 215,-0.1 3,-2.5 214,-0.1 4,-1.1 0.180 81.5 122.0-120.9 20.8 12.4 22.7 134.9 110 110 A Y T <4 S+ 0 0 7 -3,-1.9 3,-0.3 1,-0.3 6,-0.3 0.850 84.5 39.1 -50.2 -40.4 14.9 22.0 137.7 111 111 A D T 34 S+ 0 0 6 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.221 116.4 50.6 -98.1 17.2 16.3 25.5 137.4 112 112 A R T <4 S+ 0 0 20 -3,-2.5 2,-0.2 549,-0.0 -2,-0.2 0.405 103.0 50.7-133.0 -2.0 12.9 27.3 136.9 113 113 A V S >X S+ 0 0 0 -4,-1.1 4,-1.0 -3,-0.3 3,-0.7 -0.679 93.4 12.6-125.7-177.8 10.6 26.2 139.7 114 114 A G H 3> S- 0 0 0 1,-0.2 4,-1.7 -2,-0.2 207,-0.2 -0.173 120.9 -0.4 58.6-135.4 10.7 25.8 143.4 115 115 A N H 3> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.900 133.2 48.5 -58.1 -48.0 13.5 27.5 145.4 116 116 A I H <> S+ 0 0 1 -3,-0.7 4,-2.0 -6,-0.3 -1,-0.2 0.854 106.8 57.3 -68.6 -30.1 15.4 29.1 142.6 117 117 A Q H X S+ 0 0 3 -4,-1.0 4,-2.3 1,-0.2 -1,-0.2 0.957 109.0 46.7 -63.4 -46.1 12.3 30.5 141.1 118 118 A M H X S+ 0 0 7 -4,-1.7 4,-3.5 1,-0.2 -2,-0.2 0.906 106.8 57.5 -62.6 -41.6 11.6 32.3 144.3 119 119 A S H <>S+ 0 0 0 -4,-2.2 5,-2.2 1,-0.2 -1,-0.2 0.921 109.9 44.9 -55.0 -45.2 15.2 33.6 144.6 120 120 A R H ><5S+ 0 0 26 -4,-2.0 3,-1.6 1,-0.2 -1,-0.2 0.899 113.3 49.5 -66.5 -41.5 14.9 35.3 141.3 121 121 A I H 3<5S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.921 105.1 59.1 -63.2 -39.5 11.5 36.7 142.2 122 122 A L T 3<5S- 0 0 6 -4,-3.5 -1,-0.3 -5,-0.2 -2,-0.2 0.396 122.6-109.8 -69.0 4.3 13.0 37.9 145.4 123 123 A G T < 5 + 0 0 39 -3,-1.6 -28,-0.3 1,-0.2 -3,-0.2 0.570 64.7 151.7 80.3 9.7 15.4 39.9 143.3 124 124 A A < - 0 0 13 -5,-2.2 2,-1.1 -30,-0.1 -1,-0.2 -0.381 54.5-116.2 -72.5 151.3 18.6 38.0 144.0 125 125 A D E -h 96 0B 75 -30,-2.7 -28,-3.0 -2,-0.1 2,-0.8 -0.812 38.1-159.6 -88.9 100.9 21.4 37.9 141.3 126 126 A V E -h 97 0B 22 -2,-1.1 2,-0.6 -30,-0.2 -28,-0.2 -0.798 6.3-165.3 -92.1 109.2 21.2 34.2 140.7 127 127 A R E -h 98 0B 80 -30,-3.1 -28,-3.3 -2,-0.8 2,-0.8 -0.842 7.9-156.0-103.6 117.0 24.4 32.9 139.1 128 128 A L E -h 99 0B 70 -2,-0.6 -28,-0.2 -30,-0.2 -30,-0.1 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