==== 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 LYASE 12-JUL-08 3DSJ . COMPND 2 MOLECULE: CYTOCHROME P450 74A, CHLOROPLAST; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR D.S.LEE,P.NIOCHE,C.S.RAMAN . 930 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39182.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 671 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 69 7.4 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 41 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 109 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 381 41.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 2.8 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 4 2 0 2 1 1 2 2 6 2 0 2 3 4 1 0 0 0 1 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 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 0 PARALLEL BRIDGES PER LADDER . 0 4 0 2 4 0 0 1 1 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 2 0 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 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 52 A L 0 0 104 0, 0.0 354,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 144.0 -28.3 44.0 36.3 2 53 A P - 0 0 85 0, 0.0 354,-2.7 0, 0.0 2,-0.5 -0.439 360.0-117.5 -68.5 143.5 -30.3 43.5 33.2 3 54 A I B -a 356 0A 104 352,-0.2 2,-0.4 -2,-0.1 354,-0.2 -0.761 37.0-167.4 -79.3 124.2 -30.2 40.1 31.5 4 55 A R - 0 0 91 352,-2.6 354,-0.5 -2,-0.5 2,-0.2 -0.900 25.5-111.4-111.9 145.1 -28.7 40.5 28.0 5 56 A N - 0 0 143 -2,-0.4 352,-0.0 352,-0.1 0, 0.0 -0.529 42.8-107.4 -64.3 139.1 -28.6 38.1 25.1 6 57 A I - 0 0 10 352,-0.2 40,-0.2 -2,-0.2 -1,-0.1 -0.630 42.1-144.3 -72.9 117.6 -25.0 37.0 24.6 7 58 A P + 0 0 21 0, 0.0 40,-2.9 0, 0.0 2,-0.1 -0.199 51.6 63.9 -77.6 174.9 -24.0 38.7 21.3 8 59 A G - 0 0 22 38,-0.2 2,-0.3 32,-0.1 40,-0.2 -0.110 57.6-135.0 101.2 162.2 -21.7 37.4 18.6 9 60 A N - 0 0 102 38,-0.4 40,-0.3 -2,-0.1 37,-0.0 -0.974 16.3-126.3-152.3 171.4 -22.0 34.4 16.2 10 61 A Y - 0 0 33 -2,-0.3 10,-0.1 1,-0.3 6,-0.1 0.375 43.8-141.0-101.9 1.3 -19.9 31.6 14.8 11 62 A G - 0 0 47 5,-0.1 -1,-0.3 4,-0.1 3,-0.1 -0.205 49.9 -25.2 68.7-163.5 -20.4 32.2 11.1 12 63 A L S > S- 0 0 127 1,-0.1 4,-2.1 2,-0.0 0, 0.0 -0.439 82.3 -82.4 -79.2 155.3 -20.9 29.4 8.6 13 64 A P T 4 S- 0 0 103 0, 0.0 2,-2.7 0, 0.0 -1,-0.1 -0.246 108.0 -5.3 -51.5 144.5 -19.6 25.9 9.2 14 65 A I T > S+ 0 0 142 1,-0.2 4,-1.6 -3,-0.1 40,-0.1 -0.334 133.4 55.8 68.5 -62.5 -15.9 25.5 8.3 15 66 A V H > S+ 0 0 86 -2,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.821 99.7 58.0 -76.8 -32.6 -15.4 29.0 6.8 16 67 A G H X S+ 0 0 11 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.976 111.0 41.8 -58.2 -59.9 -16.5 31.0 9.9 17 68 A P H > S+ 0 0 25 0, 0.0 4,-2.1 0, 0.0 -2,-0.2 0.878 113.5 54.3 -57.0 -36.8 -13.9 29.4 12.2 18 69 A I H X S+ 0 0 41 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.945 109.2 46.9 -64.2 -45.8 -11.2 29.7 9.5 19 70 A K H X S+ 0 0 103 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.919 112.5 50.1 -60.3 -43.1 -11.8 33.4 9.0 20 71 A D H X S+ 0 0 22 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.863 109.5 51.7 -64.1 -34.9 -11.8 33.9 12.8 21 72 A R H X S+ 0 0 14 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.891 108.0 51.8 -67.5 -40.3 -8.5 32.0 13.0 22 73 A W H X>S+ 0 0 91 -4,-2.4 4,-2.4 2,-0.2 5,-2.3 0.898 111.1 47.6 -61.3 -41.8 -7.0 34.2 10.3 23 74 A D H <>S+ 0 0 18 -4,-2.2 5,-2.4 3,-0.2 6,-2.1 0.950 112.8 49.6 -61.8 -48.6 -8.0 37.3 12.2 24 75 A Y H <5S+ 0 0 31 -4,-2.4 -2,-0.2 4,-0.2 6,-0.2 0.914 124.9 24.8 -58.8 -47.7 -6.6 35.8 15.4 25 76 A F H <5S+ 0 0 29 -4,-2.6 -1,-0.2 4,-0.2 -2,-0.2 0.847 137.1 7.7 -88.1 -37.1 -3.2 34.8 14.1 26 77 A Y T <5S+ 0 0 52 -4,-2.4 -3,-0.2 -5,-0.3 -4,-0.1 0.838 122.5 39.6-117.5 -51.5 -2.5 37.1 11.1 27 78 A D T - 0 0 26 -6,-2.1 4,-2.6 -7,-0.2 -4,-0.2 -0.006 42.5 -72.7 83.5 157.3 -3.5 39.4 16.4 30 81 A A H > S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.896 127.9 50.2 -56.1 -47.5 -5.1 38.2 19.7 31 82 A E H > S+ 0 0 51 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.942 117.7 37.7 -62.8 -48.3 -5.5 41.5 21.4 32 83 A E H > S+ 0 0 40 -4,-0.5 4,-3.0 2,-0.2 5,-0.3 0.822 109.1 64.3 -74.8 -28.2 -7.2 43.3 18.6 33 84 A F H X S+ 0 0 0 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.957 113.5 34.5 -53.3 -49.7 -9.2 40.2 17.6 34 85 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.912 119.0 49.8 -74.4 -42.0 -10.9 40.5 21.0 35 86 A K H X S+ 0 0 46 -4,-2.8 4,-2.4 -5,-0.2 -2,-0.2 0.899 106.1 54.7 -68.2 -38.3 -11.0 44.3 21.3 36 87 A S H X S+ 0 0 20 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.882 111.7 45.9 -61.9 -36.2 -12.5 44.8 17.8 37 88 A R H X S+ 0 0 22 -4,-1.0 4,-2.8 -5,-0.3 6,-0.3 0.833 106.8 57.1 -78.2 -32.3 -15.4 42.4 18.7 38 89 A I H X>S+ 0 0 35 -4,-2.1 5,-1.4 2,-0.2 4,-1.2 0.949 112.9 43.9 -57.4 -44.9 -15.9 44.1 22.1 39 90 A R H <5S+ 0 0 147 -4,-2.4 3,-0.4 2,-0.2 -2,-0.2 0.958 114.6 47.0 -64.2 -51.3 -16.4 47.3 20.1 40 91 A K H <5S+ 0 0 168 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.928 123.4 33.6 -58.3 -46.9 -18.6 45.7 17.4 41 92 A Y H <5S- 0 0 40 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.563 98.3-134.0 -86.7 -8.4 -20.9 43.9 20.0 42 93 A N T <5S+ 0 0 130 -4,-1.2 2,-0.3 -3,-0.4 -3,-0.2 0.923 71.9 104.2 51.3 48.3 -20.6 46.6 22.7 43 94 A S < - 0 0 8 -5,-1.4 -2,-0.2 -6,-0.3 -1,-0.2 -0.983 67.4-150.3-157.6 141.8 -20.0 43.8 25.2 44 95 A T S S+ 0 0 37 -2,-0.3 22,-2.8 1,-0.1 2,-0.4 0.285 94.3 61.9 -94.2 6.1 -17.1 42.2 27.1 45 96 A V E S+C 65 0B 1 20,-0.2 2,-0.3 21,-0.1 20,-0.2 -0.987 71.7 134.6-128.7 123.7 -19.0 38.9 27.0 46 97 A Y E -C 64 0B 0 18,-1.4 18,-3.3 -2,-0.4 2,-0.3 -0.992 53.0 -94.7-161.7 164.2 -19.7 37.4 23.5 47 98 A R E +C 63 0B 62 -40,-2.9 -38,-0.4 -2,-0.3 2,-0.3 -0.677 49.1 156.4 -84.9 136.1 -19.7 34.2 21.4 48 99 A V E -C 62 0B 2 14,-1.8 14,-2.2 -2,-0.3 2,-0.4 -0.986 42.4-111.7-155.5 151.5 -16.6 33.6 19.2 49 100 A N E -C 61 0B 3 -2,-0.3 12,-0.2 -40,-0.3 -40,-0.0 -0.732 34.0-158.5 -79.9 135.8 -14.7 30.8 17.5 50 101 A M - 0 0 8 10,-2.4 3,-0.3 -2,-0.4 -29,-0.1 -0.880 25.7 -71.9-112.4 149.6 -11.3 30.0 19.0 51 102 A P S S+ 0 0 5 0, 0.0 38,-0.4 0, 0.0 152,-0.1 -0.371 97.6 37.2 -66.1 158.2 -8.4 28.3 17.4 52 103 A P + 0 0 2 0, 0.0 3,-0.1 0, 0.0 4,-0.1 -0.981 65.5 139.1 -91.0 -17.8 -7.5 25.6 16.4 53 104 A G >> + 0 0 4 -3,-0.3 4,-2.6 1,-0.1 3,-2.0 -0.271 42.7 87.9 48.9-133.8 -10.8 24.2 15.1 54 105 A A T 34 S- 0 0 44 1,-0.3 165,-0.1 2,-0.2 -1,-0.1 -0.160 116.0 -30.9 51.8-133.3 -10.0 22.3 11.8 55 106 A F T 34 S+ 0 0 152 164,-1.8 166,-0.3 -3,-0.1 -1,-0.3 0.232 136.1 64.3 -98.7 12.0 -9.1 18.7 12.5 56 107 A I T <4 S+ 0 0 23 -3,-2.0 2,-0.4 1,-0.3 35,-0.3 0.839 101.8 40.0-100.4 -46.1 -7.5 19.4 15.9 57 108 A A < - 0 0 7 -4,-2.6 -1,-0.3 1,-0.1 33,-0.2 -0.892 65.0-149.6-108.3 136.4 -10.5 20.6 18.0 58 109 A E S S+ 0 0 195 31,-0.6 -1,-0.1 -2,-0.4 32,-0.1 0.890 88.3 18.7 -64.1 -41.9 -13.9 19.1 17.8 59 110 A N - 0 0 79 30,-0.5 -1,-0.2 -6,-0.1 -6,-0.1 -0.938 54.4-175.6-142.9 110.6 -15.7 22.3 18.6 60 111 A P + 0 0 18 0, 0.0 -10,-2.4 0, 0.0 2,-0.5 0.459 50.4 118.2 -83.4 -2.0 -14.3 25.9 18.4 61 112 A Q E +C 49 0B 85 -12,-0.2 303,-0.4 28,-0.1 2,-0.3 -0.544 35.4 157.3 -78.8 121.9 -17.3 27.6 19.9 62 113 A V E -C 48 0B 2 -14,-2.2 -14,-1.8 -2,-0.5 2,-0.5 -0.853 43.6-125.0-130.3 166.1 -16.9 29.5 23.2 63 114 A V E -Cd 47 365B 0 301,-2.3 303,-2.4 -2,-0.3 2,-0.4 -0.987 37.2-143.1-105.4 119.7 -18.4 32.2 25.2 64 115 A A E -Cd 46 366B 0 -18,-3.3 -18,-1.4 -2,-0.5 2,-0.5 -0.725 10.4-158.1 -91.8 136.2 -15.6 34.7 25.9 65 116 A L E +Cd 45 367B 0 301,-2.9 303,-0.9 -2,-0.4 -20,-0.2 -0.957 18.5 169.0-114.8 114.2 -15.2 36.6 29.2 66 117 A L + 0 0 3 -22,-2.8 2,-0.3 -2,-0.5 -21,-0.1 -0.126 48.4 66.5-129.3 34.6 -13.2 39.8 28.6 67 118 A D S > S- 0 0 1 -23,-0.1 4,-2.1 308,-0.1 305,-0.3 -0.965 81.8-112.6-148.7 162.1 -13.6 41.8 31.8 68 119 A G T 4 S+ 0 0 7 303,-0.3 304,-0.1 -2,-0.3 284,-0.0 0.500 111.1 54.8 -79.1 -5.7 -12.4 41.4 35.4 69 120 A K T 4 S+ 0 0 86 2,-0.1 282,-0.2 3,-0.1 -1,-0.2 0.847 117.0 33.3 -87.7 -43.6 -15.9 41.0 36.9 70 121 A S T >4 S+ 0 0 0 1,-0.2 3,-1.9 2,-0.1 4,-0.3 0.872 105.8 72.1 -78.7 -39.3 -17.0 38.1 34.6 71 122 A F G >< S+ 0 0 0 -4,-2.1 3,-2.6 1,-0.3 4,-0.2 0.829 81.9 69.2 -47.6 -47.3 -13.6 36.4 34.3 72 123 A P G >> S+ 0 0 48 0, 0.0 3,-1.9 0, 0.0 4,-0.5 0.627 76.7 81.2 -59.8 -9.4 -13.3 35.0 37.8 73 124 A V G X4 S+ 0 0 15 -3,-1.9 3,-1.3 1,-0.3 6,-0.2 0.847 81.9 69.2 -55.4 -29.2 -16.1 32.5 37.1 74 125 A L G <4 S+ 0 0 1 -3,-2.6 -1,-0.3 1,-0.3 267,-0.1 0.634 96.2 51.5 -66.2 -16.0 -13.3 30.5 35.5 75 126 A F G <4 S+ 0 0 34 -3,-1.9 2,-1.0 -4,-0.2 343,-0.3 0.604 84.3 99.0 -90.8 -18.1 -11.8 29.9 39.0 76 127 A D XX - 0 0 58 -3,-1.3 4,-2.6 -4,-0.5 3,-2.0 -0.634 51.8-170.6 -84.6 101.7 -15.0 28.6 40.5 77 128 A V T 34 S+ 0 0 26 -2,-1.0 -1,-0.2 1,-0.3 5,-0.1 0.586 85.8 60.6 -71.9 -9.4 -14.7 24.8 40.5 78 129 A D T 34 S+ 0 0 114 1,-0.1 -1,-0.3 3,-0.1 3,-0.1 0.609 114.8 35.6 -86.0 -13.7 -18.4 24.5 41.6 79 130 A K T <4 S+ 0 0 68 -3,-2.0 266,-2.9 1,-0.2 267,-0.6 0.748 120.3 41.0-106.5 -37.1 -19.3 26.3 38.4 80 131 A V E < -E 344 0B 0 -4,-2.6 2,-0.4 264,-0.2 264,-0.2 -0.924 68.1-135.3-119.0 144.2 -16.8 25.1 35.8 81 132 A E E -E 343 0B 70 262,-3.2 262,-2.3 -2,-0.4 -3,-0.1 -0.743 12.3-163.8 -86.0 140.8 -15.3 21.7 35.0 82 133 A K + 0 0 16 -2,-0.4 2,-0.5 260,-0.2 3,-0.2 -0.364 38.8 135.4-121.7 49.6 -11.5 21.8 34.5 83 134 A K S S- 0 0 81 1,-0.2 23,-0.2 2,-0.1 22,-0.1 -0.891 77.0 -18.7-109.0 123.2 -11.0 18.5 32.8 84 135 A D S S+ 0 0 53 21,-3.0 -1,-0.2 -2,-0.5 21,-0.1 0.744 106.1 103.8 61.0 30.0 -8.8 18.0 29.7 85 136 A L > + 0 0 5 19,-0.2 3,-1.1 -3,-0.2 256,-0.2 0.198 28.3 117.3-131.2 17.1 -8.9 21.8 28.8 86 137 A L T 3 S+ 0 0 59 1,-0.3 -1,-0.1 -4,-0.1 255,-0.1 0.891 92.7 33.8 -45.9 -46.2 -5.5 23.1 29.8 87 138 A T T 3 S- 0 0 10 3,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.363 119.4-114.5 -97.3 2.2 -4.9 24.0 26.2 88 139 A G S < S+ 0 0 2 -3,-1.1 -1,-0.2 1,-0.1 253,-0.1 -0.892 77.5 1.9 113.5-132.6 -8.5 24.8 25.3 89 140 A T S S+ 0 0 20 -2,-0.5 -31,-0.6 -38,-0.4 -30,-0.5 0.314 127.2 45.1 -85.7 4.6 -10.9 23.1 22.9 90 141 A Y S S- 0 0 16 -33,-0.2 -3,-0.3 -32,-0.1 -33,-0.1 -0.928 71.7-145.7-132.6 163.8 -8.3 20.4 22.0 91 142 A M - 0 0 47 -2,-0.3 3,-0.1 -35,-0.3 -6,-0.1 -0.999 25.9-113.5-128.2 133.0 -6.0 18.3 24.2 92 143 A P - 0 0 11 0, 0.0 107,-0.1 0, 0.0 5,-0.1 -0.299 50.0 -86.3 -58.1 145.4 -2.6 17.1 23.1 93 144 A S > - 0 0 48 1,-0.2 3,-2.1 2,-0.1 4,-0.2 -0.201 26.0-130.4 -50.5 138.5 -2.3 13.4 22.7 94 145 A T G > >S+ 0 0 50 1,-0.3 5,-2.9 2,-0.2 3,-1.6 0.660 104.3 80.3 -66.2 -11.0 -1.5 11.5 25.9 95 146 A E G > 5S+ 0 0 134 1,-0.3 3,-0.6 3,-0.2 -1,-0.3 0.722 86.7 58.4 -61.6 -21.4 1.2 9.8 23.7 96 147 A L G < 5S+ 0 0 6 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.541 109.1 43.8 -81.9 -9.3 3.1 13.0 24.4 97 148 A T G X 5S- 0 0 4 -3,-1.6 3,-1.9 -4,-0.2 -1,-0.2 -0.255 125.0 -86.7-135.0 43.3 3.0 12.4 28.1 98 149 A G T < 5S- 0 0 34 -3,-0.6 -3,-0.2 1,-0.3 3,-0.1 0.600 83.3 -62.4 65.7 15.6 3.8 8.7 28.6 99 150 A G T 3 - 0 0 2 -2,-0.8 3,-2.4 1,-0.1 4,-0.4 -0.278 19.4 -97.7 -72.4 157.3 -1.1 14.7 33.5 103 154 A L G > S+ 0 0 12 1,-0.3 3,-2.3 2,-0.2 14,-0.1 0.816 118.7 61.1 -41.6 -49.5 -2.1 16.7 36.6 104 155 A S G 3 S+ 0 0 24 1,-0.3 -1,-0.3 -21,-0.0 -19,-0.2 0.702 105.2 49.9 -60.2 -18.6 -2.8 20.0 34.8 105 156 A Y G < S+ 0 0 4 -3,-2.4 -21,-3.0 -21,-0.1 2,-0.3 0.460 91.5 102.0 -94.5 -3.0 -5.5 18.2 32.8 106 157 A L < - 0 0 5 -3,-2.3 -23,-0.1 -4,-0.4 -4,-0.0 -0.638 68.8-131.8 -91.2 136.9 -7.2 16.7 35.8 107 158 A D > - 0 0 4 -2,-0.3 3,-2.3 1,-0.1 6,-0.3 -0.536 27.7-115.7 -76.3 146.7 -10.4 18.1 37.4 108 159 A P T 3 S+ 0 0 25 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 0.744 114.1 70.3 -57.3 -20.2 -10.2 18.5 41.2 109 160 A S T 3 S+ 0 0 92 4,-0.1 307,-0.0 3,-0.0 3,-0.0 0.627 81.1 89.9 -66.5 -15.0 -13.0 15.8 41.4 110 161 A E S X> S- 0 0 34 -3,-2.3 3,-2.0 1,-0.1 4,-0.7 -0.759 79.1-139.0 -87.8 122.7 -10.4 13.2 40.2 111 162 A P H 3> S+ 0 0 106 0, 0.0 4,-1.4 0, 0.0 3,-0.5 0.804 100.0 59.9 -53.7 -34.8 -8.6 11.7 43.2 112 163 A K H 3> S+ 0 0 105 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.722 92.1 69.7 -68.5 -20.2 -5.1 11.8 41.5 113 164 A H H <> S+ 0 0 3 -3,-2.0 4,-2.1 -6,-0.3 5,-0.2 0.941 102.2 44.0 -58.6 -47.0 -5.4 15.6 41.3 114 165 A E H X S+ 0 0 106 -4,-0.7 4,-2.3 -3,-0.5 -2,-0.2 0.938 115.8 47.4 -62.8 -47.3 -5.1 15.8 45.0 115 166 A K H X S+ 0 0 81 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.933 115.5 43.4 -60.8 -47.8 -2.2 13.3 45.1 116 167 A L H X S+ 0 0 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15.5 59.9 -21.0 724 309 B E H > S+ 0 0 14 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.926 115.7 51.1 -64.5 -43.5 18.9 60.9 -19.5 725 310 B A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.920 109.5 51.1 -55.6 -45.9 17.2 63.5 -17.4 726 311 B T H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.917 107.9 50.1 -64.1 -44.9 14.7 60.9 -16.1 727 312 B H H X S+ 0 0 14 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.890 113.9 48.0 -58.1 -36.9 17.4 58.4 -15.1 728 313 B N H X S+ 0 0 3 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.863 111.5 47.8 -72.9 -37.2 19.1 61.2 -13.2 729 314 B L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.3 0.906 112.6 50.4 -67.6 -42.7 16.0 62.5 -11.5 730 315 B L H X>S+ 0 0 0 -4,-2.9 4,-3.0 -5,-0.2 5,-0.5 0.958 114.0 44.6 -56.9 -51.3 15.2 58.9 -10.5 731 316 B F H X>S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.2 5,-1.9 0.936 115.0 46.4 -62.0 -47.8 18.7 58.4 -9.1 732 317 B A H <>S+ 0 0 8 -4,-2.6 5,-2.5 3,-0.2 -1,-0.2 0.861 119.8 40.9 -64.4 -34.7 18.9 61.7 -7.3 733 318 B T H <>S+ 0 0 1 -4,-2.3 5,-2.4 3,-0.2 -2,-0.2 0.893 128.4 27.3 -79.2 -41.8 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71.9 22.4 765 350 B E H X S+ 0 0 130 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.938 114.0 45.9 -63.5 -47.2 9.9 75.2 24.3 766 351 B E H X S+ 0 0 40 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.949 116.0 44.7 -57.7 -53.8 12.2 76.8 21.8 767 352 B I H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.934 116.9 42.7 -61.7 -50.2 10.3 75.7 18.7 768 353 B R H X S+ 0 0 83 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 0.894 115.2 50.2 -66.9 -40.2 6.8 76.5 19.9 769 354 B S H X S+ 0 0 52 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.904 110.7 48.6 -64.0 -45.7 7.9 79.9 21.4 770 355 B V H X S+ 0 0 24 -4,-2.5 4,-1.2 -5,-0.2 -2,-0.2 0.918 112.9 47.8 -61.8 -43.7 9.6 81.0 18.2 771 356 B I H <>S+ 0 0 7 -4,-2.2 5,-2.3 -5,-0.2 6,-0.4 0.917 112.3 49.8 -63.5 -42.5 6.6 80.0 16.1 772 357 B K H ><5S+ 0 0 172 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.938 111.1 48.0 -60.1 -48.1 4.3 81.8 18.4 773 358 B S H 3<5S+ 0 0 104 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.696 104.6 63.2 -65.7 -21.1 6.4 85.0 18.4 774 359 B N T 3<5S- 0 0 54 -4,-1.2 3,-0.5 -3,-0.3 -1,-0.3 0.160 129.9 -91.5 -88.6 14.0 6.5 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788 373 B L H > S+ 0 0 9 -3,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.892 114.1 53.0 -67.5 -37.8 19.1 74.5 19.9 789 374 B T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.934 110.8 45.9 -61.0 -47.1 17.1 73.0 17.0 790 375 B K H X S+ 0 0 21 -4,-2.7 4,-2.2 -7,-0.2 -1,-0.2 0.924 114.6 49.4 -62.2 -41.5 19.8 74.0 14.4 791 376 B S H X S+ 0 0 2 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.914 107.8 51.4 -65.4 -46.1 22.5 72.7 16.7 792 377 B V H X S+ 0 0 1 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.920 109.9 50.9 -59.7 -42.3 20.9 69.3 17.4 793 378 B V H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.938 111.7 46.6 -60.8 -47.3 20.5 68.7 13.6 794 379 B Y H X S+ 0 0 36 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.894 111.0 54.0 -60.6 -38.1 24.1 69.6 13.0 795 380 B E H X S+ 0 0 0 -4,-2.7 4,-2.8 58,-0.2 5,-0.3 0.865 105.4 52.0 -67.9 -33.5 25.1 67.3 15.9 796 381 B C H X S+ 0 0 7 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.932 112.3 47.0 -63.9 -44.2 23.2 64.4 14.4 797 382 B L H < S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.816 116.8 42.9 -68.6 -34.1 25.1 64.9 11.2 798 383 B R H < S+ 0 0 0 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.916 115.7 47.5 -73.4 -47.0 28.5 65.2 12.9 799 384 B F H < S+ 0 0 22 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.893 131.7 13.7 -66.8 -40.6 27.9 62.3 15.3 800 385 B E S < S- 0 0 29 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.1 -0.674 75.2-155.6-139.7 79.2 26.7 59.8 12.7 801 386 B P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 -4,-0.1 -0.345 16.7-139.0 -52.4 127.8 27.3 61.0 9.1 802 387 B P S S+ 0 0 17 0, 0.0 2,-0.6 0, 0.0 -5,-0.0 0.879 93.9 42.5 -63.1 -35.0 24.6 59.1 7.1 803 388 B V S S+ 0 0 78 67,-0.2 32,-0.1 1,-0.1 -63,-0.0 -0.953 72.5 178.8-116.3 111.8 27.0 58.3 4.3 804 389 B T + 0 0 47 -2,-0.6 31,-3.0 1,-0.1 2,-0.6 0.625 50.7 72.9 -97.0 -16.6 30.2 57.2 5.7 805 390 B A E + Q 0 834E 32 29,-0.2 2,-0.4 30,-0.1 29,-0.2 -0.905 48.7 172.0-114.0 116.9 32.5 56.3 2.9 806 391 B Q E - Q 0 833E 15 27,-2.2 27,-3.0 -2,-0.6 2,-0.3 -0.972 9.0-172.0-121.2 136.8 34.1 58.9 0.6 807 392 B Y E + Q 0 832E 6 -2,-0.4 2,-0.3 -256,-0.3 25,-0.2 -0.875 9.3 174.1-124.7 156.5 36.8 58.1 -2.0 808 393 B 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