==== 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 2FU6 . 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) . 22303.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 356 66.9 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 . 36 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 107 20.1 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 2 0 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 0 180 0, 0.0 284,-0.0 0, 0.0 280,-0.0 0.000 360.0 360.0 360.0 -18.5 24.5 5.9 10.8 2 25 A V - 0 0 120 1,-0.1 2,-0.0 282,-0.0 0, 0.0 0.443 360.0-179.0-124.4 125.8 24.8 8.0 13.2 3 26 A P - 0 0 42 0, 0.0 282,-0.2 0, 0.0 3,-0.1 -0.300 41.5 -89.4 -77.2 165.5 24.2 11.6 12.2 4 27 A L - 0 0 37 280,-3.0 280,-0.1 277,-0.2 321,-0.1 -0.380 59.2 -91.8 -61.3 153.5 24.5 14.6 14.5 5 28 A P - 0 0 99 0, 0.0 -1,-0.1 0, 0.0 319,-0.1 -0.290 41.6-104.9 -68.0 154.8 21.2 15.3 16.2 6 29 A Q - 0 0 63 1,-0.1 272,-0.1 -3,-0.1 2,-0.1 -0.386 45.6 -89.0 -66.6 155.9 18.7 17.7 14.6 7 30 A L - 0 0 49 270,-0.6 2,-0.5 -2,-0.1 269,-0.1 -0.458 44.1-132.6 -58.6 139.7 18.4 21.2 16.2 8 31 A R - 0 0 214 -2,-0.1 2,-0.2 -3,-0.1 267,-0.1 -0.880 13.2-133.2-102.2 128.1 15.7 21.1 18.9 9 32 A A - 0 0 29 -2,-0.5 2,-1.2 265,-0.1 267,-0.1 -0.530 28.1-105.8 -75.8 144.0 13.1 23.8 18.9 10 33 A Y - 0 0 60 -2,-0.2 264,-0.6 118,-0.2 2,-0.3 -0.606 50.6-173.7 -71.5 99.8 12.4 25.6 22.2 11 34 A T - 0 0 94 -2,-1.2 2,-0.3 262,-0.1 264,-0.0 -0.737 4.1-177.9-105.0 141.6 9.0 23.9 22.8 12 35 A V - 0 0 14 -2,-0.3 5,-0.1 1,-0.0 261,-0.0 -0.914 35.1 -69.8-141.6 165.6 6.7 24.9 25.7 13 36 A D >> - 0 0 109 -2,-0.3 3,-1.4 1,-0.1 4,-0.5 -0.264 45.6-119.1 -58.7 146.5 3.4 24.0 27.4 14 37 A A G >4 S+ 0 0 55 1,-0.3 3,-1.8 2,-0.2 4,-0.4 0.807 111.0 63.0 -58.5 -40.9 0.4 24.9 25.4 15 38 A S G >4 S+ 0 0 33 1,-0.3 21,-1.8 2,-0.2 3,-0.6 0.791 96.3 60.2 -57.5 -29.8 -0.9 27.4 28.1 16 39 A W G <4 S+ 0 0 49 -3,-1.4 -1,-0.3 1,-0.2 39,-0.2 0.776 112.6 39.4 -63.9 -27.0 2.2 29.5 27.5 17 40 A L G << S+ 0 0 0 -3,-1.8 254,-2.9 -4,-0.5 -2,-0.2 0.293 87.7 114.9-107.7 7.8 1.0 29.8 23.9 18 41 A Q < - 0 0 27 -3,-0.6 17,-2.4 -4,-0.4 19,-0.2 -0.667 62.8-131.3 -86.6 112.8 -2.8 30.2 24.5 19 42 A P B -A 34 0A 42 0, 0.0 2,-0.3 0, 0.0 15,-0.2 -0.230 25.5-175.8 -63.9 149.0 -4.0 33.6 23.4 20 43 A M - 0 0 29 13,-1.1 3,-0.1 12,-0.2 45,-0.1 -0.956 27.1-110.0-137.2 156.4 -6.2 35.8 25.7 21 44 A A - 0 0 71 -2,-0.3 12,-0.1 1,-0.2 10,-0.1 -0.340 60.7 -66.5 -75.4 162.6 -8.0 39.1 25.3 22 45 A P - 0 0 32 0, 0.0 2,-0.5 0, 0.0 10,-0.2 -0.298 49.4-158.2 -55.8 135.1 -6.7 42.1 27.2 23 46 A L E -C 31 0B 30 8,-2.4 8,-3.1 -3,-0.1 2,-0.3 -0.984 17.4-130.3-115.6 119.5 -7.2 41.7 31.1 24 47 A Q E +C 30 0B 99 -2,-0.5 6,-0.3 6,-0.2 3,-0.1 -0.586 29.5 173.2 -80.1 131.3 -7.2 45.0 32.9 25 48 A I E S- 0 0 12 4,-3.2 2,-0.2 1,-0.4 5,-0.2 0.780 70.2 -17.5-100.9 -45.5 -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 -0.874 90.5 -67.5-148.1-173.1 -5.3 49.0 36.7 27 50 A D T 3 S+ 0 0 75 144,-2.8 145,-0.1 1,-0.3 3,-0.0 0.795 133.1 15.2 -54.8 -37.0 -6.6 52.2 34.9 28 51 A H T 3 S+ 0 0 59 143,-0.2 15,-2.4 14,-0.0 2,-0.5 0.358 112.5 87.8-112.6 1.2 -3.7 52.3 32.4 29 52 A T E < +CD 26 42B 0 -3,-0.7 -4,-3.2 13,-0.2 -3,-1.9 -0.936 47.1 171.1-120.0 123.6 -2.3 48.7 32.7 30 53 A W E -CD 24 41B 32 11,-2.7 11,-2.9 -2,-0.5 2,-0.5 -0.973 32.9-130.7-128.3 140.4 -3.4 45.6 30.9 31 54 A Q E +CD 23 40B 0 -8,-3.1 -8,-2.4 -2,-0.3 9,-0.2 -0.815 35.1 163.9 -80.6 124.8 -2.1 42.0 30.5 32 55 A I + 0 0 0 7,-3.1 33,-0.2 -2,-0.5 -12,-0.2 0.260 43.4 83.8-130.3 10.9 -2.1 41.3 26.7 33 56 A G S S- 0 0 0 6,-0.4 -13,-1.1 1,-0.3 2,-0.2 0.434 88.6 -60.2 -91.0-133.6 0.0 38.2 26.3 34 57 A T B > -AB 19 37A 0 3,-1.6 3,-0.9 -15,-0.2 -1,-0.3 -0.680 56.3 -86.4-105.4-168.7 -1.1 34.6 26.6 35 67 A E T 3 S+ 0 0 65 -17,-2.4 197,-0.5 1,-0.3 -19,-0.2 0.842 127.8 24.1 -69.1 -32.7 -2.7 32.5 29.7 36 68 A D T 3 S+ 0 0 52 -21,-1.8 2,-0.4 -18,-0.1 -1,-0.3 0.297 113.8 68.9-117.6 12.7 0.9 31.8 31.0 37 69 A L B < S-B 34 0A 0 -3,-0.9 -3,-1.6 -22,-0.3 2,-0.2 -0.979 72.3-135.1-131.6 128.4 3.1 34.5 29.7 38 70 A T + 0 0 0 185,-2.8 2,-0.3 -2,-0.4 16,-0.3 -0.526 27.3 166.6 -79.4 134.4 2.9 38.1 30.8 39 71 A A - 0 0 0 -2,-0.2 -7,-3.1 14,-0.1 2,-0.5 -0.846 22.4-154.8-143.0 110.0 3.0 41.0 28.4 40 72 A L E -DE 31 51B 0 11,-2.7 11,-2.6 -2,-0.3 2,-0.5 -0.758 6.3-162.4 -97.3 123.3 2.0 44.3 30.0 41 73 A L E -DE 30 50B 0 -11,-2.9 -11,-2.7 -2,-0.5 2,-0.6 -0.907 3.5-168.6 -97.8 126.6 0.5 47.1 28.0 42 74 A V E -DE 29 49B 0 7,-2.9 7,-2.4 -2,-0.5 2,-0.5 -0.983 9.7-161.7-116.8 115.8 0.6 50.5 29.7 43 75 A Q E + E 0 48B 41 -15,-2.4 5,-0.2 -2,-0.6 33,-0.0 -0.913 15.3 168.6-103.9 128.9 -1.5 53.0 27.8 44 76 A T E > - E 0 47B 20 3,-1.8 3,-1.4 -2,-0.5 103,-0.1 -0.801 50.3-103.3-134.1 167.0 -1.1 56.7 28.3 45 77 A P T 3 S+ 0 0 122 0, 0.0 3,-0.1 0, 0.0 102,-0.1 0.644 122.6 46.9 -69.8 -5.5 -2.2 60.0 26.7 46 78 A D T 3 S- 0 0 102 1,-0.5 101,-0.3 101,-0.1 2,-0.1 -0.121 126.4 -62.6-125.3 38.2 1.3 60.2 25.2 47 79 A G E < -E 44 0B 14 -3,-1.4 -3,-1.8 99,-0.1 -1,-0.5 -0.397 57.4 -72.2 110.9 174.7 1.8 56.7 23.8 48 80 A A E -Ef 43 76B 2 27,-2.6 29,-2.3 -5,-0.2 30,-1.2 -0.738 27.1-157.5-112.5 149.1 2.0 53.0 24.9 49 81 A V E -Ef 42 78B 0 -7,-2.4 -7,-2.9 -2,-0.3 2,-0.5 -0.987 6.5-155.5-124.6 138.5 4.7 51.0 26.7 50 82 A L E -Ef 41 79B 0 28,-2.5 30,-2.9 -2,-0.4 2,-0.7 -0.972 0.7-160.8-116.8 125.4 5.1 47.2 26.5 51 83 A L E -Ef 40 80B 0 -11,-2.6 -11,-2.7 -2,-0.5 30,-0.2 -0.938 67.7 -22.5-106.7 110.5 6.8 45.3 29.3 52 84 A D - 0 0 0 28,-2.5 37,-0.2 -2,-0.7 -1,-0.2 0.394 52.0-146.7 66.7 160.6 7.8 41.9 27.8 53 85 A G - 0 0 0 35,-2.9 2,-0.3 1,-0.3 36,-0.2 0.409 28.9-140.3-134.0 -6.4 6.4 40.1 24.8 54 86 A G B +h 89 0C 0 34,-1.7 36,-1.5 -16,-0.3 -1,-0.3 -0.591 60.5 6.4 84.4-136.4 6.7 36.5 25.6 55 87 A M S > S- 0 0 0 -2,-0.3 3,-1.9 -39,-0.2 32,-0.2 -0.389 77.3-105.8 -85.4 161.6 7.7 33.9 23.1 56 89 A P G > S+ 0 0 17 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.840 116.8 55.1 -56.4 -33.2 8.9 34.8 19.4 57 90 A Q G 3 S+ 0 0 41 1,-0.2 4,-0.3 215,-0.1 3,-0.3 0.421 88.5 78.8 -82.8 4.3 5.6 33.7 17.8 58 91 A M G <> + 0 0 0 -3,-1.9 4,-2.4 1,-0.2 5,-0.2 0.482 62.1 99.2 -87.4 -2.9 3.4 36.0 19.9 59 92 A A H <> S+ 0 0 1 -3,-0.9 4,-2.1 1,-0.2 -1,-0.2 0.900 83.5 44.8 -54.4 -51.1 4.1 39.2 17.9 60 93 A S H > S+ 0 0 56 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.914 112.9 52.4 -63.4 -42.7 1.0 39.3 15.8 61 94 A H H > S+ 0 0 23 -4,-0.3 4,-2.7 2,-0.2 5,-0.2 0.920 109.3 48.9 -54.0 -47.7 -1.2 38.4 18.8 62 95 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.904 111.2 50.8 -62.1 -41.9 0.2 41.3 20.9 63 96 A L H X S+ 0 0 22 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.861 109.2 50.3 -64.5 -37.9 -0.4 43.6 18.0 64 97 A D H X S+ 0 0 105 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.902 111.4 48.2 -65.0 -46.3 -4.0 42.5 17.7 65 98 A N H X S+ 0 0 15 -4,-2.7 4,-1.2 2,-0.2 -2,-0.2 0.852 109.2 54.2 -62.3 -35.1 -4.5 43.0 21.4 66 99 A M H ><>S+ 0 0 2 -4,-2.1 5,-2.6 -5,-0.2 3,-0.8 0.966 109.2 47.2 -63.6 -48.6 -2.9 46.5 21.1 67 100 A K H ><5S+ 0 0 165 -4,-2.3 3,-1.5 1,-0.3 -2,-0.2 0.893 106.8 56.9 -59.0 -42.4 -5.4 47.4 18.3 68 101 A A H 3<5S+ 0 0 70 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.808 108.7 48.8 -58.2 -29.6 -8.3 46.1 20.4 69 102 A R T <<5S- 0 0 74 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.472 125.1-102.7 -83.5 -4.7 -7.1 48.6 23.1 70 103 A G T < 5S+ 0 0 55 -3,-1.5 2,-0.7 -4,-0.4 -3,-0.2 0.406 80.1 135.5 91.8 5.1 -6.8 51.5 20.6 71 104 A V < - 0 0 6 -5,-2.6 -1,-0.2 -6,-0.2 -2,-0.2 -0.755 36.0-166.3 -95.2 112.4 -3.0 51.2 20.4 72 105 A T >> - 0 0 59 -2,-0.7 3,-1.2 -3,-0.1 4,-1.0 -0.487 38.9 -97.6 -89.2 162.4 -1.7 51.5 16.8 73 106 A P G >4 S+ 0 0 71 0, 0.0 27,-2.0 0, 0.0 3,-0.8 0.875 126.4 50.4 -47.4 -41.2 1.8 50.5 15.7 74 107 A R G 34 S+ 0 0 206 1,-0.2 25,-0.1 25,-0.2 -3,-0.0 0.764 102.5 62.7 -69.3 -26.4 2.9 54.2 15.8 75 108 A D G <4 S+ 0 0 58 -3,-1.2 -27,-2.6 -28,-0.1 2,-0.8 0.743 80.7 90.6 -69.7 -27.5 1.5 54.5 19.3 76 109 A L E << +f 48 0B 0 -4,-1.0 24,-0.2 -3,-0.8 -27,-0.2 -0.666 47.5 162.2 -76.9 108.0 3.9 51.9 20.8 77 110 A R E + 0 0 114 -29,-2.3 25,-1.7 -2,-0.8 2,-0.4 0.756 52.6 27.9 -94.5 -33.1 6.9 54.0 21.9 78 111 A L E -fg 49 102B 18 -30,-1.2 -28,-2.5 23,-0.2 2,-0.4 -0.995 49.3-160.6-146.2 135.6 8.8 51.8 24.3 79 112 A I E -fg 50 103B 0 23,-2.3 25,-2.2 -2,-0.4 2,-0.3 -0.989 15.5-173.7-116.4 129.9 9.6 48.2 25.1 80 113 A L E -f 51 0B 0 -30,-2.9 -28,-2.5 -2,-0.4 2,-0.4 -0.858 9.4-148.6-117.0 152.6 10.9 47.2 28.5 81 114 A L - 0 0 4 23,-0.4 3,-0.1 -2,-0.3 102,-0.1 -0.978 23.6-158.6-127.1 135.7 12.2 43.8 29.6 82 115 A S S S- 0 0 0 -2,-0.4 82,-2.3 1,-0.3 2,-0.3 0.892 90.3 -24.1 -64.1 -49.4 12.2 41.8 32.8 83 116 A H - 0 0 1 80,-0.2 2,-0.4 2,-0.1 -1,-0.3 -0.963 65.7-109.6-160.6 162.1 15.0 39.7 31.3 84 117 A A + 0 0 0 -2,-0.3 2,-0.2 -3,-0.1 79,-0.0 -0.195 64.3 130.0-104.3 48.6 16.2 38.8 27.8 85 118 A H >> - 0 0 5 -2,-0.4 4,-3.5 1,-0.1 3,-2.0 -0.644 69.9-108.1 -91.0 156.8 15.3 35.1 27.4 86 119 A A H 3> S+ 0 0 1 41,-0.5 4,-0.8 1,-0.3 -1,-0.1 0.776 115.4 57.4 -49.1 -38.5 13.4 33.7 24.4 87 120 A D H 34 S+ 0 0 12 -32,-0.2 -1,-0.3 1,-0.1 -32,-0.2 0.497 122.2 22.8 -81.6 -0.7 10.2 33.1 26.4 88 121 A H H <4 S+ 0 0 3 -3,-2.0 -35,-2.9 -35,-0.1 -34,-1.7 0.593 134.0 32.4-131.0 -27.1 9.9 36.8 27.5 89 122 A A H >< S+h 54 0C 0 -4,-3.5 3,-2.1 -36,-0.2 4,-0.3 0.316 83.8 118.4-108.9 5.3 11.8 38.8 24.9 90 123 A G T 3< S+ 0 0 1 -36,-1.5 3,-0.4 -4,-0.8 4,-0.2 0.788 77.2 35.6 -38.6 -55.7 11.1 36.5 22.0 91 124 A P T 3> S+ 0 0 2 0, 0.0 4,-2.6 0, 0.0 -1,-0.3 0.296 83.9 107.5 -90.2 7.6 9.2 38.8 19.7 92 125 A V H <> S+ 0 0 1 -3,-2.1 4,-2.4 1,-0.2 5,-0.2 0.894 78.4 49.0 -55.6 -47.0 11.1 42.1 20.4 93 126 A A H > S+ 0 0 8 37,-0.4 4,-1.6 -3,-0.4 -1,-0.2 0.935 114.2 46.3 -60.2 -47.3 13.0 42.3 17.1 94 127 A E H > S+ 0 0 40 -4,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.911 111.2 51.8 -60.5 -44.0 9.7 41.7 15.1 95 128 A L H X S+ 0 0 0 -4,-2.6 4,-0.8 1,-0.2 6,-0.4 0.874 107.5 53.1 -59.5 -41.1 7.8 44.2 17.2 96 129 A K H < S+ 0 0 48 -4,-2.4 -1,-0.2 1,-0.2 3,-0.2 0.850 110.7 48.2 -63.2 -33.9 10.6 46.8 16.5 97 130 A R H < S+ 0 0 102 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.806 117.3 40.1 -70.6 -34.1 10.2 46.1 12.8 98 131 A R H < S+ 0 0 110 -4,-1.8 2,-0.3 -5,-0.1 -2,-0.2 0.361 120.3 34.2-100.9 1.6 6.4 46.4 12.8 99 132 A T S < S- 0 0 19 -4,-0.8 -25,-0.2 -3,-0.2 -22,-0.1 -0.884 84.0-103.5-144.0 174.9 6.0 49.4 15.2 100 133 A G S S+ 0 0 47 -27,-2.0 -4,-0.1 -2,-0.3 -26,-0.1 0.334 72.0 138.9 -83.1 11.6 7.6 52.6 16.3 101 134 A A - 0 0 5 -6,-0.4 2,-0.3 -28,-0.2 -23,-0.2 -0.280 35.2-165.7 -69.1 137.6 8.9 50.9 19.4 102 135 A K E -g 78 0B 130 -25,-1.7 -23,-2.3 -2,-0.1 2,-0.4 -0.909 18.5-127.5-117.7 144.8 12.3 51.5 20.9 103 136 A V E -g 79 0B 1 -2,-0.3 32,-2.6 30,-0.3 33,-1.3 -0.807 17.1-168.0 -95.8 131.2 13.9 49.2 23.5 104 137 A A E +i 136 0D 0 -25,-2.2 -23,-0.4 -2,-0.4 2,-0.3 -0.990 26.3 145.7-114.1 131.6 15.4 50.5 26.8 105 138 A A E -i 137 0D 5 31,-2.5 33,-1.7 -2,-0.5 2,-0.1 -0.973 48.2 -94.4-156.6 162.4 17.4 48.0 28.8 106 139 A N > - 0 0 4 -2,-0.3 4,-2.7 56,-0.3 5,-0.2 -0.329 48.8 -99.5 -77.4 165.8 20.4 47.7 31.0 107 140 A A H > S+ 0 0 59 31,-0.4 4,-2.2 1,-0.2 5,-0.2 0.864 122.2 51.2 -56.3 -40.5 23.8 46.7 29.6 108 141 A E H > S+ 0 0 107 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.934 113.4 42.5 -64.9 -50.2 23.4 43.1 30.5 109 142 A S H > S+ 0 0 4 1,-0.2 4,-2.7 53,-0.2 5,-0.2 0.880 113.4 54.4 -64.5 -37.5 20.0 42.7 29.0 110 143 A A H X S+ 0 0 10 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.903 109.0 46.5 -61.9 -45.5 21.1 44.6 25.9 111 144 A V H X S+ 0 0 72 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.916 114.6 46.9 -67.2 -36.9 24.1 42.4 25.2 112 145 A L H <>S+ 0 0 13 -4,-2.0 5,-2.8 1,-0.2 3,-0.3 0.914 114.8 46.9 -69.1 -43.5 22.0 39.2 25.7 113 146 A L H ><5S+ 0 0 0 -4,-2.7 3,-1.7 1,-0.2 19,-1.5 0.861 106.0 58.7 -61.0 -42.0 19.3 40.5 23.5 114 147 A A H 3<5S+ 0 0 39 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.758 109.8 45.2 -63.1 -27.1 21.8 41.6 20.8 115 148 A R T ><5S- 0 0 69 -4,-1.0 3,-2.1 -3,-0.3 -1,-0.3 0.231 114.1-117.2 -99.0 18.3 22.9 38.0 20.7 116 149 A G T < 5 - 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0 0 33 -3,-1.2 -13,-0.2 1,-0.1 -21,-0.1 -0.231 49.0-122.6 -61.4 138.9 32.6 17.4 -10.5 510 294 B L - 0 0 49 -15,-2.3 -23,-0.5 1,-0.1 2,-0.2 -0.296 19.6-113.5 -70.2 156.1 31.3 20.0 -12.9 511 295 B T > - 0 0 79 -25,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.471 32.5-109.7 -72.6 161.7 33.2 22.9 -14.3 512 296 B b H > S+ 0 0 3 -28,-0.4 4,-2.9 1,-0.2 5,-0.2 0.909 121.9 55.1 -62.1 -37.7 32.2 26.4 -13.2 513 297 B K H > S+ 0 0 119 -33,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.895 109.9 43.0 -56.2 -45.1 30.8 26.8 -16.7 514 298 B A H > S+ 0 0 39 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.888 113.9 51.9 -73.7 -38.8 28.6 23.7 -16.6 515 299 B Y H X S+ 0 0 12 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.962 113.2 44.3 -58.5 -52.7 27.5 24.6 -13.1 516 300 B A H X S+ 0 0 3 -4,-2.9 4,-3.1 2,-0.2 -2,-0.2 0.936 113.5 50.3 -57.5 -50.6 26.5 28.2 -14.1 517 301 B D H X S+ 0 0 90 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.939 112.1 46.7 -55.2 -50.5 24.8 27.0 -17.3 518 302 B A H X S+ 0 0 54 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.914 112.9 50.4 -57.1 -44.4 22.8 24.4 -15.4 519 303 B A H X S+ 0 0 15 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.930 111.2 49.9 -61.9 -40.4 21.9 27.0 -12.8 520 304 B E H X S+ 0 0 58 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.890 110.1 47.5 -67.2 -40.5 20.8 29.4 -15.5 521 305 B Q H X S+ 0 0 118 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.891 112.8 49.7 -65.8 -42.4 18.5 26.9 -17.4 522 306 B K H X S+ 0 0 146 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.884 111.5 49.7 -61.3 -40.3 16.9 25.9 -14.2 523 307 B F H X S+ 0 0 3 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.938 108.5 50.9 -67.9 -48.4 16.3 29.6 -13.3 524 308 B D H X S+ 0 0 57 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.877 112.3 48.7 -54.4 -41.3 14.8 30.4 -16.7 525 309 B G H X S+ 0 0 30 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.887 109.7 50.8 -66.0 -39.1 12.4 27.5 -16.2 526 310 B Q H X S+ 0 0 43 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.880 109.0 52.2 -65.3 -39.2 11.5 28.6 -12.7 527 311 B L H X S+ 0 0 25 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.946 109.9 48.4 -58.8 -51.8 10.8 32.1 -14.1 528 312 B A H X S+ 0 0 63 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.908 113.1 48.2 -51.7 -48.5 8.4 30.5 -16.7 529 313 B K H < S+ 0 0 160 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.835 110.8 50.5 -64.8 -38.9 6.7 28.4 -14.0 530 314 B E H >< S+ 0 0 52 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.931 110.5 48.8 -63.7 -50.6 6.3 31.5 -11.8 531 315 B T H 3< S+ 0 0 97 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.917 98.3 68.6 -50.8 -44.5 4.8 33.5 -14.6 532 316 B A T 3< 0 0 84 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.326 360.0 360.0 -65.3 15.9 2.5 30.5 -15.2 533 317 B G < 0 0 97 -3,-1.5 -1,-0.1 -5,-0.1 -2,-0.1 0.214 360.0 360.0 72.6 360.0 1.1 31.6 -11.9