==== 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 26-JAN-06 2FU8 . COMPND 2 MOLECULE: METALLO-BETA-LACTAMASE L1; . SOURCE 2 ORGANISM_SCIENTIFIC: STENOTROPHOMONAS MALTOPHILIA; . AUTHOR L.NAUTON,G.GARAU,R.KAHN,O.DIDEBERG . 532 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22614.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 355 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 13.9 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 . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 33 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 20.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 2 0 0 2 2 0 1 1 0 2 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 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 PARALLEL BRIDGES PER LADDER . 5 1 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 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 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 24 A E 0 0 188 0, 0.0 284,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.7 26.4 5.4 10.7 2 25 A V - 0 0 115 284,-0.0 2,-0.1 282,-0.0 0, 0.0 -0.969 360.0-147.9-120.1 116.6 24.9 7.9 13.1 3 26 A P - 0 0 48 0, 0.0 282,-0.2 0, 0.0 3,-0.1 -0.347 33.6 -85.3 -76.6 166.4 24.4 11.5 12.1 4 27 A L - 0 0 38 280,-2.9 280,-0.1 277,-0.2 321,-0.1 -0.349 59.1 -91.2 -62.2 149.5 24.6 14.5 14.4 5 28 A P - 0 0 98 0, 0.0 -1,-0.1 0, 0.0 319,-0.1 -0.267 41.8-107.1 -65.9 151.9 21.2 15.3 16.1 6 29 A Q - 0 0 66 1,-0.1 272,-0.1 -3,-0.1 275,-0.0 -0.408 45.1 -88.0 -68.0 153.6 18.8 17.6 14.5 7 30 A L - 0 0 48 270,-0.5 2,-0.5 -2,-0.1 269,-0.1 -0.390 43.8-135.5 -57.7 143.2 18.3 21.1 16.1 8 31 A R - 0 0 233 -3,-0.1 267,-0.1 267,-0.1 2,-0.1 -0.937 13.4-133.0-108.8 121.9 15.7 21.0 18.8 9 32 A A - 0 0 29 -2,-0.5 2,-1.2 265,-0.1 267,-0.1 -0.355 26.6-105.7 -67.6 150.1 13.1 23.8 18.9 10 33 A Y - 0 0 46 118,-0.2 264,-0.6 265,-0.1 2,-0.3 -0.702 49.3-175.6 -77.9 97.7 12.3 25.5 22.1 11 34 A T - 0 0 92 -2,-1.2 2,-0.3 262,-0.1 3,-0.0 -0.772 2.4-175.0-101.0 148.4 8.9 23.9 22.8 12 35 A V - 0 0 17 -2,-0.3 5,-0.1 1,-0.1 261,-0.0 -0.844 35.7 -68.5-136.0 167.2 6.7 25.0 25.7 13 36 A D >> - 0 0 110 -2,-0.3 3,-1.6 1,-0.1 4,-0.6 -0.296 46.9-118.5 -55.7 139.5 3.4 24.1 27.5 14 37 A A G >4 S+ 0 0 55 1,-0.3 3,-1.5 2,-0.2 257,-0.2 0.825 111.8 63.6 -48.0 -41.0 0.3 24.9 25.4 15 38 A S G >4 S+ 0 0 33 1,-0.3 21,-1.5 2,-0.2 3,-1.0 0.804 95.0 60.5 -58.7 -31.5 -0.9 27.4 28.1 16 39 A W G <4 S+ 0 0 51 -3,-1.6 39,-0.3 1,-0.2 -1,-0.3 0.747 112.1 39.1 -65.8 -24.3 2.2 29.5 27.4 17 40 A L G << S+ 0 0 0 -3,-1.5 254,-2.9 -4,-0.6 -1,-0.2 0.230 86.8 117.0-108.2 12.8 1.0 29.9 23.8 18 41 A Q < - 0 0 18 -3,-1.0 17,-2.3 252,-0.2 19,-0.2 -0.729 62.6-132.6 -90.7 110.7 -2.8 30.3 24.5 19 42 A P B -A 34 0A 32 0, 0.0 2,-0.3 0, 0.0 15,-0.2 -0.261 26.2-175.9 -60.3 145.0 -4.0 33.7 23.3 20 43 A M - 0 0 27 13,-1.1 3,-0.1 12,-0.2 45,-0.1 -0.974 27.7-107.6-136.5 152.7 -6.2 35.7 25.7 21 44 A A - 0 0 73 -2,-0.3 12,-0.1 1,-0.2 10,-0.1 -0.280 60.1 -68.9 -66.1 162.3 -8.1 39.0 25.4 22 45 A P - 0 0 31 0, 0.0 2,-0.5 0, 0.0 10,-0.2 -0.314 48.2-155.6 -58.9 133.9 -6.7 42.0 27.2 23 46 A L E -C 31 0B 29 8,-2.6 8,-3.0 -3,-0.1 2,-0.3 -0.957 14.7-131.2-114.6 116.7 -7.1 41.7 31.0 24 47 A Q E +C 30 0B 93 -2,-0.5 6,-0.3 6,-0.2 3,-0.1 -0.529 29.4 171.1 -75.4 126.8 -7.2 45.0 32.9 25 48 A I E S- 0 0 5 4,-3.0 2,-0.3 1,-0.4 5,-0.2 0.791 70.4 -16.8 -96.7 -44.5 -4.9 45.3 35.9 26 49 A A E > S-C 29 0B 2 3,-1.9 3,-0.7 146,-0.0 -1,-0.4 -0.877 91.0 -68.2-148.9-175.4 -5.3 49.0 36.7 27 50 A D T 3 S+ 0 0 74 144,-3.0 145,-0.1 -2,-0.3 3,-0.0 0.773 131.8 15.3 -55.1 -34.7 -6.6 52.1 34.9 28 51 A H T 3 S+ 0 0 58 143,-0.2 15,-2.8 14,-0.0 2,-0.4 0.380 112.4 86.9-116.1 1.5 -3.7 52.2 32.3 29 52 A T E < +CD 26 42B 0 -3,-0.7 -4,-3.0 13,-0.2 -3,-1.9 -0.936 48.0 172.3-120.2 122.3 -2.2 48.7 32.6 30 53 A W E -CD 24 41B 32 11,-2.8 11,-3.0 -2,-0.4 2,-0.6 -0.969 32.6-130.6-127.1 143.0 -3.3 45.5 30.8 31 54 A Q E +CD 23 40B 0 -8,-3.0 -8,-2.6 -2,-0.3 9,-0.2 -0.832 34.2 165.1 -84.0 121.9 -2.1 42.0 30.4 32 55 A I + 0 0 0 7,-3.2 33,-0.2 -2,-0.6 -12,-0.2 0.260 43.7 86.3-125.0 13.6 -2.2 41.3 26.7 33 56 A G S S- 0 0 0 6,-0.5 -13,-1.1 1,-0.3 2,-0.2 0.463 86.3 -60.5 -84.2-138.0 -0.1 38.2 26.4 34 57 A T B > -AB 19 37A 0 3,-1.5 3,-0.6 -15,-0.2 -1,-0.3 -0.558 55.8 -89.2-104.4-177.5 -1.1 34.6 26.7 35 67 A E T 3 S+ 0 0 69 -17,-2.3 197,-0.6 -20,-0.3 198,-0.2 0.858 126.1 25.2 -61.6 -32.9 -2.7 32.6 29.6 36 68 A D T 3 S+ 0 0 54 -21,-1.5 2,-0.4 -18,-0.2 -1,-0.2 0.257 113.3 66.5-122.4 15.6 0.7 31.7 31.0 37 69 A L B < S-B 34 0A 0 -3,-0.6 -3,-1.5 -22,-0.2 2,-0.2 -0.984 74.0-132.8-135.3 127.7 3.1 34.4 29.8 38 70 A T + 0 0 0 185,-2.6 2,-0.3 -2,-0.4 16,-0.2 -0.534 28.5 166.2 -77.4 138.6 2.9 38.1 30.8 39 71 A A - 0 0 0 -2,-0.2 -7,-3.2 14,-0.1 2,-0.5 -0.842 22.7-155.4-148.3 107.2 3.1 40.9 28.4 40 72 A L E -DE 31 51B 0 11,-2.5 11,-2.8 -2,-0.3 2,-0.5 -0.778 7.2-162.2 -97.3 127.7 2.0 44.2 29.9 41 73 A L E -DE 30 50B 0 -11,-3.0 -11,-2.8 -2,-0.5 2,-0.5 -0.924 1.8-167.4-103.0 125.9 0.6 47.1 28.0 42 74 A V E -DE 29 49B 0 7,-2.8 7,-2.4 -2,-0.5 2,-0.5 -0.974 11.0-162.2-113.8 116.8 0.6 50.5 29.7 43 75 A Q E + E 0 48B 44 -15,-2.8 5,-0.2 -2,-0.5 33,-0.0 -0.900 15.0 168.2-108.3 126.2 -1.6 52.9 27.7 44 76 A T E > - E 0 47B 21 3,-1.8 3,-1.5 -2,-0.5 103,-0.1 -0.824 51.2-103.6-130.3 165.5 -1.2 56.7 28.2 45 77 A P T 3 S+ 0 0 126 0, 0.0 3,-0.1 0, 0.0 102,-0.1 0.659 123.0 48.7 -62.6 -13.4 -2.4 59.9 26.5 46 78 A D T 3 S- 0 0 100 1,-0.4 101,-0.3 101,-0.1 2,-0.1 -0.088 126.0 -68.0-119.5 34.7 1.2 60.2 25.2 47 79 A G E < -E 44 0B 15 -3,-1.5 -3,-1.8 99,-0.1 -1,-0.4 -0.456 56.3 -73.8 110.8 178.5 1.7 56.7 23.8 48 80 A A E -Ef 43 76B 2 27,-2.6 29,-2.4 -5,-0.2 30,-1.3 -0.811 24.1-154.9-122.0 153.8 2.1 53.1 24.9 49 81 A V E -Ef 42 78B 0 -7,-2.4 -7,-2.8 -2,-0.3 2,-0.5 -0.973 6.3-155.5-125.9 139.7 4.7 51.0 26.6 50 82 A L E -Ef 41 79B 0 28,-2.6 30,-2.7 -2,-0.4 2,-0.7 -0.979 1.2-161.0-116.1 125.4 5.1 47.2 26.4 51 83 A L E -Ef 40 80B 0 -11,-2.8 -11,-2.5 -2,-0.5 30,-0.2 -0.932 68.0 -20.0-106.8 110.5 6.8 45.3 29.2 52 84 A D - 0 0 0 28,-2.6 -1,-0.2 -2,-0.7 37,-0.2 0.383 53.4-145.0 67.4 154.5 7.8 41.9 27.7 53 85 A G - 0 0 0 35,-3.0 2,-0.3 1,-0.3 36,-0.2 0.484 28.6-140.1-124.6 -8.2 6.5 40.2 24.7 54 86 A G B +h 89 0C 0 34,-1.4 36,-1.6 -16,-0.2 -1,-0.3 -0.632 59.9 4.3 87.3-140.9 6.5 36.5 25.5 55 87 A M S > S- 0 0 0 -2,-0.3 3,-2.0 -39,-0.3 32,-0.2 -0.340 76.3-106.6 -81.0 157.8 7.5 33.9 23.0 56 89 A P G > S+ 0 0 17 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.885 117.6 55.9 -52.4 -36.8 8.8 34.7 19.4 57 90 A Q G 3 S+ 0 0 41 1,-0.2 4,-0.3 215,-0.1 3,-0.2 0.424 88.8 78.5 -83.0 5.7 5.5 33.6 17.8 58 91 A M G <> + 0 0 0 -3,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.463 61.7 101.0 -89.8 -0.5 3.4 36.0 19.9 59 92 A A H <> S+ 0 0 0 -3,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.914 84.2 41.8 -53.3 -51.4 4.2 39.1 17.8 60 93 A S H > S+ 0 0 55 -3,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.897 112.8 54.3 -68.4 -37.6 0.9 39.2 15.8 61 94 A H H > S+ 0 0 21 -4,-0.3 4,-2.6 1,-0.2 5,-0.2 0.935 108.5 49.8 -59.9 -47.1 -1.3 38.4 18.9 62 95 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.927 110.7 49.5 -58.0 -44.3 0.3 41.3 20.8 63 96 A L H X S+ 0 0 20 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.884 110.0 51.1 -65.7 -36.1 -0.4 43.6 17.9 64 97 A D H X S+ 0 0 99 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.902 111.6 47.1 -66.3 -42.0 -4.0 42.4 17.7 65 98 A N H X S+ 0 0 14 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.873 110.9 52.2 -66.2 -38.8 -4.5 43.0 21.4 66 99 A M H X>S+ 0 0 2 -4,-2.5 5,-2.8 -5,-0.2 4,-0.6 0.949 110.3 48.1 -57.9 -48.7 -2.9 46.5 21.1 67 100 A K H ><5S+ 0 0 143 -4,-2.3 3,-1.3 1,-0.3 -2,-0.2 0.890 107.4 55.6 -61.4 -39.9 -5.3 47.3 18.2 68 101 A A H 3<5S+ 0 0 70 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.835 109.2 48.7 -61.4 -32.4 -8.3 46.0 20.3 69 102 A R H 3<5S- 0 0 73 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.518 124.9-104.7 -79.7 -11.5 -7.1 48.5 23.0 70 103 A G T <<5S+ 0 0 53 -3,-1.3 2,-0.7 -4,-0.6 -3,-0.2 0.502 78.4 134.7 96.1 7.9 -6.9 51.4 20.5 71 104 A V < - 0 0 7 -5,-2.8 -1,-0.3 -6,-0.2 -2,-0.2 -0.824 38.3-160.8 -96.4 115.1 -3.1 51.3 20.3 72 105 A T >> - 0 0 62 -2,-0.7 4,-0.9 -3,-0.1 3,-0.9 -0.460 36.1-100.3 -86.9 164.1 -1.7 51.4 16.8 73 106 A P G >4 S+ 0 0 57 0, 0.0 27,-2.3 0, 0.0 3,-0.6 0.863 125.6 52.6 -50.8 -36.2 1.8 50.4 15.8 74 107 A R G 34 S+ 0 0 213 1,-0.2 25,-0.1 25,-0.2 -3,-0.0 0.831 101.4 60.5 -70.6 -31.8 2.8 54.1 15.8 75 108 A D G <4 S+ 0 0 61 -3,-0.9 -27,-2.6 -28,-0.1 2,-0.8 0.703 80.8 93.7 -70.2 -23.7 1.5 54.6 19.3 76 109 A L E << +f 48 0B 0 -4,-0.9 -27,-0.2 -3,-0.6 24,-0.2 -0.636 46.9 164.3 -75.9 108.6 3.9 51.9 20.8 77 110 A R E + 0 0 115 -29,-2.4 25,-1.8 -2,-0.8 2,-0.3 0.748 53.3 25.3 -96.0 -30.4 6.9 54.0 21.9 78 111 A L E -fg 49 102B 17 -30,-1.3 -28,-2.6 23,-0.3 2,-0.4 -0.996 48.8-160.8-148.8 139.9 8.8 51.8 24.2 79 112 A I E -fg 50 103B 0 23,-2.3 25,-2.0 -2,-0.3 2,-0.3 -0.997 16.4-174.2-120.0 127.4 9.5 48.1 25.1 80 113 A L E -f 51 0B 0 -30,-2.7 -28,-2.6 -2,-0.4 2,-0.4 -0.862 10.8-146.8-114.8 154.6 11.0 47.2 28.5 81 114 A L - 0 0 5 23,-0.5 3,-0.1 -2,-0.3 83,-0.1 -0.959 23.1-157.5-126.9 145.3 12.1 43.8 29.5 82 115 A S S S- 0 0 0 1,-0.4 82,-1.9 -2,-0.4 2,-0.3 0.961 88.6 -24.9 -73.7 -61.3 12.2 41.7 32.7 83 116 A H - 0 0 0 80,-0.2 2,-1.0 2,-0.1 -1,-0.4 -0.984 64.5-110.5-149.6 161.0 15.0 39.5 31.3 84 117 A A + 0 0 0 -2,-0.3 2,-0.2 -3,-0.1 79,-0.0 -0.249 64.4 131.1 -94.7 51.6 16.2 38.6 27.8 85 118 A H S >> S- 0 0 8 -2,-1.0 4,-2.9 1,-0.1 3,-2.2 -0.657 70.8-106.7 -91.3 159.1 15.2 34.9 27.5 86 119 A A H 3> S+ 0 0 0 41,-0.4 4,-0.5 1,-0.3 -1,-0.1 0.713 117.1 57.1 -56.9 -31.0 13.3 33.6 24.5 87 120 A D H 34 S+ 0 0 10 -32,-0.2 -1,-0.3 2,-0.1 -32,-0.2 0.398 121.2 26.2 -86.5 3.6 10.0 33.2 26.4 88 121 A H H <4 S+ 0 0 0 -3,-2.2 -35,-3.0 -35,-0.1 -34,-1.4 0.600 132.9 30.8-128.1 -36.2 10.0 36.9 27.4 89 122 A A H >< S+h 54 0C 0 -4,-2.9 3,-1.9 -36,-0.2 4,-0.4 0.273 86.2 117.3-104.0 5.5 12.0 38.8 24.8 90 123 A G T 3< S+ 0 0 2 -36,-1.6 3,-0.3 -4,-0.5 4,-0.2 0.796 79.0 32.9 -46.6 -49.8 11.1 36.5 21.9 91 124 A P T 3> S+ 0 0 2 0, 0.0 4,-2.7 0, 0.0 -1,-0.3 0.314 86.3 107.2 -93.5 10.0 9.1 38.7 19.6 92 125 A V H <> S+ 0 0 1 -3,-1.9 4,-2.5 1,-0.2 5,-0.2 0.912 78.1 50.1 -58.4 -47.6 11.1 42.0 20.3 93 126 A A H > S+ 0 0 9 37,-0.4 4,-1.8 -4,-0.4 -1,-0.2 0.946 114.1 45.3 -55.4 -48.0 13.0 42.1 17.0 94 127 A E H > S+ 0 0 41 -4,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.907 110.8 53.3 -62.7 -42.1 9.7 41.6 15.1 95 128 A L H X S+ 0 0 0 -4,-2.7 4,-1.0 1,-0.2 6,-0.4 0.873 106.9 52.4 -61.9 -38.8 7.9 44.2 17.2 96 129 A K H < S+ 0 0 51 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.909 111.0 47.8 -63.8 -38.6 10.6 46.7 16.5 97 130 A R H < S+ 0 0 106 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.831 118.0 40.4 -67.9 -34.0 10.2 46.1 12.7 98 131 A R H < S+ 0 0 108 -4,-1.8 2,-0.3 -5,-0.1 -1,-0.2 0.411 119.9 33.0-101.5 -1.1 6.4 46.3 12.8 99 132 A T S < S- 0 0 18 -4,-1.0 -25,-0.2 -3,-0.4 -22,-0.1 -0.863 82.9-104.1-140.6 177.4 6.0 49.3 15.2 100 133 A G S S+ 0 0 45 -27,-2.3 -26,-0.1 -2,-0.3 -4,-0.1 0.365 72.2 136.8 -83.0 7.9 7.6 52.6 16.3 101 134 A A - 0 0 5 -6,-0.4 2,-0.3 -28,-0.2 -23,-0.3 -0.242 37.2-163.0 -68.3 136.7 8.8 50.9 19.5 102 135 A K E -g 78 0B 131 -25,-1.8 -23,-2.3 33,-0.0 2,-0.5 -0.870 18.7-124.6-109.9 151.6 12.3 51.5 20.8 103 136 A V E -g 79 0B 1 -2,-0.3 32,-2.8 30,-0.3 33,-1.5 -0.844 19.1-170.2-101.4 129.4 13.9 49.2 23.4 104 137 A A E +i 136 0D 0 -25,-2.0 -23,-0.5 -2,-0.5 2,-0.3 -0.985 25.7 144.6-113.8 125.3 15.3 50.4 26.8 105 138 A A E -i 137 0D 5 31,-2.2 33,-1.6 -2,-0.5 -23,-0.0 -0.974 48.9 -94.9-153.0 160.2 17.3 47.9 28.7 106 139 A N > - 0 0 5 -2,-0.3 4,-2.6 56,-0.3 5,-0.2 -0.302 48.3 -98.8 -73.9 168.7 20.3 47.6 31.0 107 140 A A H > S+ 0 0 58 31,-0.5 4,-2.3 1,-0.2 5,-0.2 0.893 121.9 50.5 -58.3 -42.6 23.7 46.7 29.5 108 141 A E H > S+ 0 0 109 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.935 114.1 44.0 -60.5 -48.6 23.5 43.0 30.5 109 142 A S H > S+ 0 0 3 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.883 112.2 54.1 -64.4 -38.9 20.0 42.6 29.0 110 143 A A H X S+ 0 0 13 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.903 109.4 46.8 -61.8 -44.7 21.1 44.6 25.9 111 144 A V H X S+ 0 0 77 -4,-2.3 4,-0.9 -5,-0.2 -1,-0.2 0.891 115.0 45.9 -68.9 -36.3 24.1 42.3 25.2 112 145 A L H ><>S+ 0 0 14 -4,-1.9 5,-2.4 -5,-0.2 3,-0.6 0.921 113.8 49.1 -71.4 -41.9 22.0 39.1 25.7 113 146 A L H ><5S+ 0 0 0 -4,-2.9 3,-1.6 1,-0.2 19,-1.5 0.889 106.9 55.7 -60.7 -41.6 19.2 40.5 23.5 114 147 A A H 3<5S+ 0 0 38 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.749 108.2 49.6 -65.3 -23.1 21.8 41.4 20.8 115 148 A R T X<5S- 0 0 73 -4,-0.9 3,-1.7 -3,-0.6 -1,-0.3 0.283 113.1-119.4 -92.0 0.7 23.0 37.8 20.8 116 149 A G T < 5 - 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0 0 32 -3,-1.4 -13,-0.2 1,-0.1 2,-0.1 -0.187 49.3-122.8 -59.0 138.9 32.6 17.4 -10.6 510 294 B L - 0 0 45 -15,-2.3 -23,-0.5 1,-0.1 2,-0.1 -0.357 20.2-114.0 -69.7 155.6 31.3 20.0 -13.0 511 295 B T > - 0 0 81 1,-0.1 4,-2.3 -25,-0.1 5,-0.2 -0.471 32.4-109.0 -75.4 162.5 33.3 22.9 -14.4 512 296 B b H > S+ 0 0 3 -28,-0.4 4,-2.8 1,-0.2 5,-0.2 0.918 121.9 55.1 -59.2 -40.6 32.3 26.4 -13.3 513 297 B K H > S+ 0 0 117 -33,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.917 110.1 44.3 -57.0 -44.8 30.9 26.9 -16.8 514 298 B A H > S+ 0 0 39 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.873 112.6 51.9 -70.5 -39.4 28.7 23.8 -16.6 515 299 B Y H X S+ 0 0 13 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.948 112.0 46.4 -61.4 -47.6 27.5 24.7 -13.1 516 300 B A H X S+ 0 0 4 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.897 113.0 49.7 -60.4 -43.1 26.6 28.2 -14.2 517 301 B D H X S+ 0 0 85 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.914 112.3 46.3 -66.8 -44.0 24.8 26.9 -17.3 518 302 B A H X S+ 0 0 32 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.905 112.9 51.0 -63.0 -42.5 22.8 24.3 -15.3 519 303 B A H X S+ 0 0 12 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.903 111.2 48.0 -62.5 -42.6 21.9 27.0 -12.7 520 304 B E H X S+ 0 0 60 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.922 111.1 50.1 -64.4 -45.4 20.7 29.4 -15.4 521 305 B Q H X S+ 0 0 116 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.930 113.3 45.9 -58.5 -48.1 18.6 26.7 -17.1 522 306 B K H X S+ 0 0 155 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.896 113.1 50.8 -59.6 -41.7 17.0 25.8 -13.8 523 307 B F H X S+ 0 0 4 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.928 109.5 49.6 -65.5 -47.0 16.4 29.5 -13.0 524 308 B D H X S+ 0 0 58 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.889 111.1 50.0 -57.3 -42.4 14.8 30.1 -16.4 525 309 B G H X S+ 0 0 34 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.907 110.6 49.6 -63.4 -40.9 12.5 27.2 -15.9 526 310 B Q H X S+ 0 0 58 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.884 109.3 52.5 -64.3 -39.1 11.6 28.4 -12.4 527 311 B L H X S+ 0 0 26 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.902 109.9 47.6 -63.4 -43.4 10.8 31.9 -13.8 528 312 B A H X S+ 0 0 62 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.893 112.6 49.8 -64.6 -39.3 8.5 30.4 -16.5 529 313 B K H < S+ 0 0 147 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.871 109.1 51.8 -68.8 -35.1 6.8 28.3 -13.9 530 314 B E H >< S+ 0 0 52 -4,-2.2 3,-1.9 1,-0.2 -2,-0.2 0.951 109.1 50.1 -66.9 -45.6 6.3 31.4 -11.7 531 315 B T H 3< S+ 0 0 100 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.896 105.1 58.2 -55.4 -42.1 4.8 33.3 -14.6 532 316 B A T 3< 0 0 89 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.288 360.0 360.0 -76.1 13.8 2.5 30.3 -15.1 533 317 B G < 0 0 95 -3,-1.9 -1,-0.2 -5,-0.1 -2,-0.0 -0.063 360.0 360.0 83.9 360.0 1.2 30.8 -11.5