==== 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 08-JUL-04 1TYZ . 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 . 1327 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44979.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 995 75.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 154 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 1.8 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 . 4 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 . 110 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 182 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 433 32.6 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 5 1 4 0 0 8 1 7 4 3 3 1 1 3 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 10 6 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 . 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 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 65 0, 0.0 2,-0.4 0, 0.0 240,-0.2 0.000 360.0 360.0 360.0 165.4 27.2 28.1 178.2 2 2 A N > + 0 0 80 238,-3.4 3,-0.7 1,-0.1 4,-0.2 -0.794 360.0 160.8-136.5 96.2 26.2 31.6 177.0 3 3 A L G > S+ 0 0 1 -2,-0.4 3,-2.0 1,-0.2 -1,-0.1 0.770 73.1 75.9 -78.5 -27.1 24.6 31.9 173.6 4 4 A Q G 3 S+ 0 0 114 1,-0.3 -1,-0.2 -3,-0.1 4,-0.1 0.549 74.3 77.9 -64.0 -6.3 23.3 35.3 174.7 5 5 A R G < S+ 0 0 70 -3,-0.7 -1,-0.3 235,-0.1 -2,-0.1 0.848 89.8 66.2 -70.5 -30.4 26.7 36.8 174.3 6 6 A F S < S- 0 0 45 -3,-2.0 -1,-0.0 -4,-0.2 51,-0.0 -0.774 90.1-120.9 -97.9 132.5 26.0 36.8 170.5 7 7 A P - 0 0 90 0, 0.0 2,-0.4 0, 0.0 54,-0.1 -0.303 20.8-151.1 -65.9 153.3 23.3 39.0 169.0 8 8 A R - 0 0 117 -4,-0.1 49,-0.2 52,-0.1 48,-0.1 -0.993 5.4-144.9-129.6 120.1 20.5 37.4 167.1 9 9 A Y - 0 0 77 47,-3.0 2,-0.6 -2,-0.4 50,-0.1 -0.768 27.3-116.0 -87.5 128.3 18.7 39.3 164.3 10 10 A P + 0 0 77 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.479 58.6 139.9 -67.7 108.1 15.0 38.4 164.1 11 11 A L + 0 0 11 -2,-0.6 34,-0.4 41,-0.1 33,-0.3 0.347 59.4 69.7-124.1 -4.0 14.2 36.7 160.7 12 12 A T S S- 0 0 29 31,-0.1 31,-0.2 -3,-0.1 30,-0.1 -0.728 84.6-119.0-114.8 163.5 11.8 34.2 162.2 13 13 A F S S- 0 0 78 29,-2.6 30,-0.1 1,-0.3 -1,-0.1 0.747 72.1 -90.4 -70.2 -24.8 8.3 34.4 163.7 14 14 A G S S+ 0 0 26 28,-0.4 -1,-0.3 0, 0.0 -3,-0.0 -0.950 83.2 3.7 142.4-161.9 9.6 33.1 167.0 15 15 A P S S- 0 0 95 0, 0.0 154,-0.0 0, 0.0 -2,-0.0 -0.175 76.9-118.2 -52.0 145.5 10.0 29.6 168.6 16 16 A T - 0 0 3 1,-0.1 23,-0.1 153,-0.1 26,-0.1 -0.719 29.5-113.4 -91.7 138.3 9.1 26.8 166.2 17 17 A P - 0 0 46 0, 0.0 21,-2.6 0, 0.0 2,-0.4 -0.302 16.5-140.6 -69.3 147.6 6.1 24.5 167.1 18 18 A I E -A 37 0A 34 19,-0.2 19,-0.2 20,-0.1 296,-0.0 -0.904 21.0-169.1-106.1 134.9 6.4 20.8 167.9 19 19 A Q E -A 36 0A 52 17,-2.8 17,-2.1 -2,-0.4 2,-0.2 -0.969 22.0-121.7-126.9 141.5 3.6 18.6 166.6 20 20 A P E -A 35 0A 85 0, 0.0 2,-0.7 0, 0.0 15,-0.3 -0.589 12.1-149.2 -79.4 142.5 2.9 15.0 167.4 21 21 A L > + 0 0 2 13,-3.2 4,-2.2 -2,-0.2 13,-0.4 -0.638 34.9 159.6-108.3 69.0 2.9 12.7 164.4 22 22 A A H > + 0 0 65 -2,-0.7 4,-2.4 2,-0.2 5,-0.2 0.853 67.0 48.7 -61.5 -41.4 0.2 10.4 165.9 23 23 A R H > S+ 0 0 87 256,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.943 113.4 46.1 -69.0 -45.8 -1.0 8.8 162.7 24 24 A L H > S+ 0 0 0 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.904 113.4 51.7 -62.2 -39.6 2.5 8.0 161.4 25 25 A S H <>S+ 0 0 9 -4,-2.2 5,-2.5 2,-0.2 3,-0.4 0.940 113.1 42.7 -61.7 -49.1 3.4 6.7 164.9 26 26 A K H ><5S+ 0 0 172 -4,-2.4 3,-2.2 1,-0.2 -2,-0.2 0.908 108.9 59.8 -63.8 -42.4 0.4 4.4 165.0 27 27 A H H 3<5S+ 0 0 111 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.819 105.8 50.2 -55.3 -32.1 1.0 3.4 161.4 28 28 A L T 3<5S- 0 0 28 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.307 137.0 -77.6 -91.9 9.8 4.4 2.1 162.5 29 29 A G T < 5 - 0 0 57 -3,-2.2 -3,-0.2 1,-0.1 -2,-0.1 0.260 53.7-104.8 117.2 -14.7 3.2 0.0 165.4 30 30 A G S + b 0 315A 7 -21,-2.6 3,-1.4 -2,-0.6 278,-0.1 -0.447 48.6 150.1 -79.6 72.6 8.7 22.8 162.3 39 39 A E G > S+ 0 0 0 -2,-1.7 3,-1.6 276,-0.9 10,-0.5 0.818 74.0 69.3 -67.5 -27.4 11.8 24.7 161.3 40 40 A D G 3 S+ 0 0 22 275,-1.4 -1,-0.3 1,-0.3 3,-0.2 0.658 101.8 45.1 -63.7 -15.8 10.2 24.5 157.8 41 41 A C G < S+ 0 0 28 -3,-1.4 -1,-0.3 274,-0.2 -2,-0.2 0.057 81.1 107.4-115.4 25.1 7.5 27.0 159.0 42 42 A N S < S+ 0 0 4 -3,-1.6 -29,-2.6 5,-0.2 -28,-0.4 0.565 73.9 36.3 -82.0 -8.7 9.7 29.5 160.9 43 43 A S - 0 0 6 4,-0.4 4,-0.3 -31,-0.2 -31,-0.1 -0.992 53.9-143.4-150.3 152.6 9.7 32.5 158.6 44 44 A G S S+ 0 0 3 -2,-0.3 2,-1.3 -33,-0.3 570,-0.3 0.389 77.8 106.1 -89.3 2.9 7.6 34.6 156.3 45 45 A L S > S- 0 0 12 -34,-0.4 3,-2.2 1,-0.2 568,-0.2 -0.699 112.5 -50.7 -88.9 92.1 10.7 35.1 154.2 46 46 A A T 3 S- 0 0 5 -2,-1.3 -1,-0.2 566,-0.8 -2,-0.1 0.843 109.4 -52.8 42.8 49.9 10.2 32.9 151.2 47 47 A F T 3 S- 0 0 40 -4,-0.3 -4,-0.4 -6,-0.1 -1,-0.3 0.155 79.8-149.4 78.3 -15.4 9.3 29.9 153.3 48 48 A G < + 0 0 2 -3,-2.2 270,-0.4 -6,-0.1 2,-0.2 -0.143 21.4 176.4 56.5-143.4 12.4 30.0 155.5 49 49 A G >> - 0 0 0 -10,-0.5 3,-1.1 1,-0.1 4,-1.0 -0.784 55.0 -41.2 129.5-176.8 13.8 26.7 156.9 50 50 A N H 3> S+ 0 0 8 266,-2.7 4,-1.9 1,-0.3 3,-0.5 0.853 128.8 61.6 -54.4 -38.0 16.9 25.7 159.0 51 51 A K H 3> S+ 0 0 19 265,-0.3 4,-2.5 1,-0.2 -1,-0.3 0.863 100.0 55.1 -59.3 -34.2 19.2 28.1 157.1 52 52 A T H <> S+ 0 0 0 -3,-1.1 4,-0.7 2,-0.2 -1,-0.2 0.843 104.1 53.2 -69.3 -32.7 17.2 31.1 158.2 53 53 A R H >< S+ 0 0 17 -4,-1.0 3,-0.8 -3,-0.5 4,-0.4 0.930 111.0 47.6 -66.2 -42.0 17.6 30.1 161.9 54 54 A K H >X S+ 0 0 1 -4,-1.9 3,-1.7 1,-0.2 4,-0.6 0.927 104.9 61.1 -60.2 -45.3 21.4 30.0 161.3 55 55 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.3 3,-0.3 0.680 85.5 75.6 -58.7 -20.5 21.3 33.4 159.5 56 56 A E H << S+ 0 0 4 -3,-0.8 -47,-3.0 -4,-0.7 -1,-0.3 0.861 99.7 43.4 -64.2 -30.3 20.0 35.1 162.6 57 57 A Y H <4 S+ 0 0 25 -3,-1.7 4,-0.4 -4,-0.4 -1,-0.2 0.653 114.7 48.5 -88.8 -13.5 23.5 34.9 164.1 58 58 A L H >X S+ 0 0 0 -4,-0.6 4,-2.0 -3,-0.3 3,-0.6 0.833 98.1 65.8 -91.1 -37.5 25.4 36.0 161.0 59 59 A I H 3X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.864 93.2 60.0 -55.4 -40.9 23.4 39.0 160.0 60 60 A P H 3> S+ 0 0 27 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.912 109.6 45.0 -56.6 -37.9 24.4 41.1 163.1 61 61 A E H <> S+ 0 0 66 -3,-0.6 4,-2.8 -4,-0.4 6,-0.3 0.923 109.3 54.0 -70.3 -43.4 28.0 40.7 162.0 62 62 A A H <>S+ 0 0 0 -4,-2.0 5,-1.3 1,-0.2 -1,-0.2 0.928 115.2 42.3 -55.5 -42.3 27.3 41.5 158.4 63 63 A L H <5S+ 0 0 79 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.902 109.5 56.3 -70.5 -43.4 25.6 44.7 159.6 64 64 A A H <5S+ 0 0 87 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.961 108.4 52.1 -54.1 -54.4 28.3 45.5 162.2 65 65 A Q T <5S- 0 0 81 -4,-2.8 85,-0.0 1,-0.1 83,-0.0 -0.148 114.6-102.5 -66.8 176.9 30.9 45.4 159.4 66 66 A G T 5 + 0 0 56 83,-0.1 -3,-0.1 2,-0.0 82,-0.1 0.119 63.0 158.8 -98.0 33.5 29.6 47.7 156.7 67 67 A C < + 0 0 11 -5,-1.3 3,-0.1 -6,-0.3 80,-0.0 -0.195 20.6 174.3 -59.3 135.3 28.4 45.0 154.4 68 68 A D + 0 0 65 80,-2.0 26,-2.7 1,-0.2 2,-0.3 0.321 65.4 50.4-119.8 3.2 25.8 45.9 151.8 69 69 A T E -fg 94 149B 6 79,-1.3 81,-2.4 24,-0.3 2,-0.5 -0.996 66.0-145.1-145.6 136.0 25.6 42.6 149.8 70 70 A L E -fg 95 150B 0 24,-2.7 26,-2.0 -2,-0.3 2,-0.5 -0.886 19.8-168.0-102.7 128.2 25.1 39.0 151.0 71 71 A V E +fg 96 151B 0 79,-2.7 81,-3.3 -2,-0.5 2,-0.2 -0.966 17.4 151.1-119.9 127.7 27.1 36.5 148.8 72 72 A S E -fg 97 152B 0 24,-1.9 26,-2.2 -2,-0.5 2,-0.3 -0.814 24.7-142.9-143.1-173.3 26.5 32.8 149.1 73 73 A I E +f 98 0B 18 79,-0.5 82,-0.5 -2,-0.2 2,-0.3 -0.985 25.3 132.5-155.3 156.5 26.6 29.6 147.1 74 74 A G E -f 99 0B 3 24,-1.9 26,-1.8 -2,-0.3 -2,-0.0 -0.972 52.4 -58.7 174.2 177.7 24.9 26.2 146.6 75 75 A G E > -f 100 0B 2 -2,-0.3 3,-1.5 24,-0.2 26,-0.2 -0.069 64.9 -88.4 -68.6 178.6 23.6 23.7 144.1 76 76 A I T 3 S+ 0 0 2 24,-0.7 40,-0.2 1,-0.3 25,-0.1 0.903 130.1 35.4 -58.3 -42.7 20.9 24.7 141.6 77 77 A Q T 3 S+ 0 0 9 38,-0.1 -1,-0.3 39,-0.1 38,-0.1 0.034 87.2 155.6-100.9 26.2 18.0 23.8 143.9 78 78 A S <> - 0 0 6 -3,-1.5 4,-0.6 1,-0.2 -4,-0.1 -0.260 34.9-160.0 -51.8 133.8 19.9 25.0 147.0 79 79 A N H > S+ 0 0 6 2,-0.2 4,-2.3 3,-0.1 5,-0.2 0.830 89.4 62.3 -82.3 -37.1 17.5 26.1 149.8 80 80 A Q H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.912 101.1 48.3 -52.6 -54.9 20.3 28.1 151.4 81 81 A T H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.843 110.4 53.1 -60.7 -33.1 20.7 30.5 148.5 82 82 A R H X S+ 0 0 1 -4,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.941 111.0 45.0 -68.2 -46.4 17.0 31.1 148.3 83 83 A Q H X S+ 0 0 1 -4,-2.3 4,-3.2 2,-0.2 5,-0.2 0.901 112.3 52.2 -65.5 -37.6 16.8 32.1 152.1 84 84 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.937 109.8 50.3 -61.4 -43.9 19.9 34.2 151.7 85 85 A A H X S+ 0 0 2 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.897 113.6 44.1 -59.2 -41.6 18.1 35.9 148.8 86 86 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.930 113.8 50.0 -71.2 -44.6 15.0 36.5 150.8 87 87 A V H X S+ 0 0 0 -4,-3.2 4,-2.0 2,-0.2 -2,-0.2 0.889 110.5 50.5 -61.1 -40.6 16.9 37.7 153.9 88 88 A A H X>S+ 0 0 0 -4,-2.7 5,-2.7 -5,-0.2 4,-1.2 0.955 110.1 48.7 -63.7 -48.7 18.9 40.1 151.8 89 89 A A H ><5S+ 0 0 7 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.933 111.8 50.3 -56.1 -45.1 15.8 41.7 150.2 90 90 A H H 3<5S+ 0 0 58 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.865 113.0 46.2 -62.0 -36.5 14.3 42.0 153.6 91 91 A L H 3<5S- 0 0 32 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.565 115.1-113.3 -83.4 -9.1 17.4 43.7 155.0 92 92 A G T <<5S+ 0 0 41 -4,-1.2 2,-0.3 -3,-0.8 -3,-0.2 0.772 73.6 134.3 81.6 23.6 17.7 46.1 152.0 93 93 A M < - 0 0 19 -5,-2.7 -1,-0.3 -6,-0.2 -24,-0.3 -0.748 57.2-117.9-105.5 153.7 21.0 44.4 150.9 94 94 A K E -f 69 0B 155 -26,-2.7 -24,-2.7 -2,-0.3 2,-0.4 -0.403 30.1-149.2 -80.7 168.2 22.0 43.2 147.4 95 95 A C E -f 70 0B 10 28,-0.3 30,-2.6 -26,-0.2 2,-0.4 -0.995 16.3-173.0-146.6 134.5 22.6 39.5 146.9 96 96 A V E -fh 71 125B 10 -26,-2.0 -24,-1.9 -2,-0.4 2,-0.4 -0.998 12.8-167.1-126.1 130.2 24.9 37.6 144.6 97 97 A L E -fh 72 126B 0 28,-2.7 30,-3.3 -2,-0.4 2,-0.7 -0.979 14.6-153.0-125.5 134.1 24.6 33.8 144.4 98 98 A V E -fh 73 127B 3 -26,-2.2 -24,-1.9 -2,-0.4 2,-0.5 -0.919 21.3-174.3-102.5 109.6 26.9 31.3 142.8 99 99 A Q E -f 74 0B 0 28,-2.8 30,-0.5 -2,-0.7 2,-0.3 -0.936 3.3-179.5-110.8 131.9 24.9 28.3 141.8 100 100 A E E -f 75 0B 39 -26,-1.8 2,-1.5 -2,-0.5 -24,-0.7 -0.819 40.6-100.7-125.3 164.4 26.6 25.2 140.4 101 101 A N + 0 0 44 -2,-0.3 -26,-0.1 -26,-0.2 -2,-0.0 -0.682 50.6 160.3 -84.0 89.3 25.4 21.9 139.1 102 102 A W + 0 0 103 -2,-1.5 2,-0.4 2,-0.0 -1,-0.2 0.452 54.4 68.0 -90.6 1.8 26.1 19.9 142.3 103 103 A V S S- 0 0 12 2,-0.2 2,-2.1 -3,-0.1 160,-0.1 -0.954 78.9-130.2-126.1 142.1 23.7 17.1 141.3 104 104 A N S S+ 0 0 122 158,-0.4 2,-0.3 -2,-0.4 -2,-0.0 -0.604 75.4 111.1 -85.1 77.0 23.9 14.5 138.5 105 105 A Y - 0 0 27 -2,-2.1 -2,-0.2 2,-0.1 159,-0.0 -0.983 46.0-172.5-149.8 143.5 20.4 15.4 137.5 106 106 A S + 0 0 26 -2,-0.3 1222,-0.5 4,-0.0 1223,-0.3 -0.167 15.9 168.6-140.9 50.7 19.2 17.1 134.4 107 107 A D > - 0 0 3 217,-0.2 3,-1.9 1,-0.1 4,-0.3 -0.370 42.9-118.9 -66.5 141.8 15.5 17.9 134.7 108 108 A A T 3 S+ 0 0 2 1,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.760 111.7 28.8 -51.3 -36.5 14.0 20.2 132.0 109 109 A V T >> S+ 0 0 0 1,-0.1 3,-2.4 214,-0.1 4,-0.9 0.199 83.6 120.6-112.3 17.2 12.9 22.9 134.5 110 110 A Y T <4 S+ 0 0 6 -3,-1.9 6,-0.2 1,-0.3 3,-0.2 0.806 80.4 40.5 -50.2 -39.4 15.5 22.3 137.2 111 111 A D T 34 S+ 0 0 4 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.163 117.4 49.2 -99.6 23.3 17.0 25.8 137.0 112 112 A R T <4 S+ 0 0 22 -3,-2.4 2,-0.2 542,-0.0 -2,-0.2 0.442 100.3 53.4-140.5 -0.7 13.6 27.6 136.7 113 113 A V S >X S+ 0 0 0 -4,-0.9 4,-1.2 -3,-0.2 3,-0.7 -0.658 93.8 11.0-124.5-179.5 11.3 26.3 139.3 114 114 A G H 3> S- 0 0 1 1,-0.2 4,-1.8 -2,-0.2 207,-0.2 -0.139 122.1 -1.0 58.4-135.0 11.4 26.0 143.1 115 115 A N H 3> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.898 133.3 48.8 -59.4 -47.5 14.2 27.6 145.0 116 116 A I H <> S+ 0 0 0 -3,-0.7 4,-1.8 -6,-0.2 -1,-0.2 0.884 108.2 55.4 -67.1 -32.5 16.2 29.1 142.2 117 117 A Q H X S+ 0 0 3 -4,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.933 108.7 48.7 -62.4 -44.6 13.0 30.7 140.7 118 118 A M H X S+ 0 0 7 -4,-1.8 4,-2.9 1,-0.2 -1,-0.2 0.902 105.6 57.3 -63.9 -38.2 12.3 32.4 143.9 119 119 A S H <>S+ 0 0 0 -4,-2.0 5,-2.2 1,-0.2 -1,-0.2 0.901 107.6 48.0 -59.7 -41.6 15.9 33.8 144.2 120 120 A R H ><5S+ 0 0 30 -4,-1.8 3,-1.7 1,-0.2 -1,-0.2 0.932 112.3 47.3 -65.7 -45.1 15.5 35.5 140.9 121 121 A I H 3<5S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.894 105.7 61.1 -61.2 -38.3 12.2 37.1 141.8 122 122 A L T 3<5S- 0 0 6 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.463 122.0-110.5 -66.7 -1.9 13.7 38.1 145.1 123 123 A G T < 5 + 0 0 41 -3,-1.7 -28,-0.3 1,-0.2 -3,-0.2 0.534 64.6 151.1 86.6 6.3 16.2 40.2 143.0 124 124 A A < - 0 0 13 -5,-2.2 2,-1.2 -30,-0.1 -1,-0.2 -0.323 54.1-118.4 -69.6 151.4 19.4 38.2 143.6 125 125 A D E -h 96 0B 73 -30,-2.6 -28,-2.7 2,-0.0 2,-0.8 -0.828 36.7-158.0 -90.1 101.6 22.0 38.1 140.9 126 126 A V E -h 97 0B 23 -2,-1.2 2,-0.7 -30,-0.2 -28,-0.2 -0.763 5.4-161.8 -89.6 111.2 21.9 34.4 140.2 127 127 A R E +h 98 0B 81 -30,-3.3 -28,-2.8 -2,-0.8 2,-0.3 -0.821 11.5 177.7-102.5 115.3 25.1 33.2 138.6 128 128 A L - 0 0 60 -2,-0.7 -28,-0.1 -30,-0.2 -30,-0.0 -0.718 19.1-139.9-109.5 160.6 25.1 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R H << S+ 0 0 17 -4,-0.8 4,-0.4 -3,-0.6 3,-0.4 0.867 111.1 50.4 -69.9 -34.8 -8.7 29.4 157.9 387 54 B K H >X S+ 0 0 1 -4,-1.6 3,-1.7 1,-0.2 4,-0.7 0.949 103.5 57.6 -66.1 -49.2 -12.0 28.7 156.2 388 55 B L H 3X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.3 3,-0.3 0.698 88.3 75.5 -57.8 -20.7 -11.8 24.9 156.6 389 56 B E H 3< S+ 0 0 6 -4,-0.8 -47,-3.2 -3,-0.4 -1,-0.3 0.857 100.1 43.5 -62.3 -32.3 -11.6 25.2 160.3 390 57 B Y H <4 S+ 0 0 25 -3,-1.7 4,-0.4 -4,-0.4 -1,-0.2 0.691 115.8 48.0 -85.7 -17.8 -15.3 26.0 160.5 391 58 B L H >X S+ 0 0 0 -4,-0.7 4,-1.8 -3,-0.3 3,-0.7 0.856 96.5 67.6 -87.3 -41.1 -16.3 23.3 157.9 392 59 B I H 3X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.859 92.7 60.2 -49.5 -44.7 -14.4 20.3 159.3 393 60 B P H 3> S+ 0 0 24 0, 0.0 4,-4.2 0, 0.0 -1,-0.2 0.912 107.5 46.5 -51.1 -45.2 -16.5 20.0 162.5 394 61 B E H <> S+ 0 0 65 -3,-0.7 4,-3.0 -4,-0.4 6,-0.3 0.909 110.0 51.5 -63.9 -45.2 -19.6 19.5 160.3 395 62 B A H <>S+ 0 0 0 -4,-1.8 5,-1.6 1,-0.2 -1,-0.2 0.905 117.9 41.2 -58.8 -37.9 -17.9 16.9 158.1 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3<5S- 0 0 5 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.422 122.4-107.5 -68.1 -0.6 -0.6 14.1 149.8 456 123 B G T < 5 + 0 0 39 -3,-1.7 -28,-0.3 1,-0.2 -3,-0.2 0.549 66.4 148.2 87.8 9.2 -2.6 11.1 148.5 457 124 B A < - 0 0 13 -5,-2.2 2,-1.1 -30,-0.1 -1,-0.2 -0.423 54.5-117.1 -77.2 154.2 -5.7 12.8 147.0 458 125 B D E -q 429 0E 71 -30,-2.7 -28,-3.0 -2,-0.1 2,-0.8 -0.798 34.0-160.0 -90.0 100.7 -7.5 11.3 143.9 459 126 B V E -q 430 0E 23 -2,-1.1 2,-0.6 -30,-0.2 -28,-0.2 -0.777 6.4-168.0 -91.7 107.9 -6.9 14.1 141.4 460 127 B R E -q 431 0E 88 -30,-3.0 -28,-3.0 -2,-0.8 2,-0.5 -0.861 3.1-161.1-101.3 114.9 -9.4 13.8 138.6 461 128 B L E q 432 0E 77 -2,-0.6 -28,-0.2 -30,-0.2 -30,-0.1 -0.842 360.0 360.0 -98.3 125.7 -8.6 16.0 135.5 462 129 B V 0 0 97 -30,-1.5 -29,-0.1 -2,-0.5 -1,-0.1 0.330 360.0 360.0 -47.3 360.0 -11.6 16.7 133.2 463 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 464 139 B R > 0 0 200 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 101.0 -21.3 17.9 135.7 465 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