==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-DEC-09 2X01 . COMPND 2 MOLECULE: BETA-LACTAMASE OXA-10; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR L.VERCHEVAL,F.KERFF,C.BAUVOIS,E.SAUVAGE,R.GUIET,M.GALLENI,P. . 490 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20329.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 351 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 18.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 6 1.2 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 . 26 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.7 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 1 3 1 0 0 4 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 2 2 2 0 0 2 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 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 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 21 A S 0 0 108 0, 0.0 30,-1.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 147.0 17.5 4.0 81.4 2 22 A I E -a 31 0A 51 28,-0.2 2,-0.4 22,-0.0 30,-0.2 -0.989 360.0-163.9-119.0 129.6 13.9 3.1 81.1 3 23 A T E -a 32 0A 84 28,-2.0 30,-2.1 -2,-0.4 2,-0.3 -0.909 19.7-121.1-117.3 133.8 11.3 5.5 82.7 4 24 A E E -a 33 0A 83 -2,-0.4 2,-0.6 28,-0.2 30,-0.2 -0.583 15.7-157.7 -73.0 136.3 7.6 4.7 83.5 5 25 A N > - 0 0 49 28,-3.6 3,-1.3 -2,-0.3 4,-0.4 -0.969 7.1-161.3-110.6 107.6 5.1 7.0 81.8 6 26 A T G > S+ 0 0 115 -2,-0.6 3,-1.1 1,-0.3 4,-0.3 0.841 80.3 62.5 -65.0 -34.9 2.0 6.6 84.1 7 27 A S G > S+ 0 0 74 1,-0.2 3,-0.8 2,-0.1 4,-0.3 0.615 87.7 73.0 -68.0 -16.0 -0.6 7.9 81.6 8 28 A W G X> S+ 0 0 5 -3,-1.3 3,-1.1 1,-0.2 4,-0.5 0.766 79.8 70.3 -74.3 -27.3 0.0 5.1 79.0 9 29 A N H X> S+ 0 0 58 -3,-1.1 4,-2.5 -4,-0.4 3,-0.8 0.759 80.9 80.9 -59.7 -25.2 -1.7 2.3 81.1 10 30 A K H <> S+ 0 0 127 -3,-0.8 4,-1.9 -4,-0.3 -1,-0.2 0.848 90.8 48.7 -43.4 -48.5 -5.0 4.2 80.3 11 31 A E H <> S+ 0 0 43 -3,-1.1 4,-0.7 -4,-0.3 -1,-0.3 0.755 111.0 50.8 -67.2 -29.3 -5.1 2.5 76.8 12 32 A F H <<>S+ 0 0 7 -3,-0.8 5,-2.7 -4,-0.5 4,-0.4 0.904 110.1 48.0 -77.8 -43.7 -4.4 -1.0 78.4 13 33 A S H ><5S+ 0 0 91 -4,-2.5 3,-1.4 3,-0.2 -2,-0.2 0.926 105.3 60.5 -55.5 -52.2 -7.2 -0.7 81.0 14 34 A A H 3<5S+ 0 0 65 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.751 115.4 31.8 -49.1 -36.8 -9.7 0.5 78.4 15 35 A E T 3<5S- 0 0 74 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.341 109.0-119.5-104.3 4.2 -9.4 -2.7 76.4 16 36 A A T < 5 + 0 0 81 -3,-1.4 2,-0.4 -4,-0.4 -3,-0.2 0.958 62.9 150.8 54.3 57.5 -8.7 -4.9 79.4 17 37 A V < - 0 0 12 -5,-2.7 2,-0.7 -6,-0.1 -1,-0.2 -0.976 44.5-147.3-130.5 120.6 -5.3 -5.9 78.0 18 38 A N + 0 0 120 -2,-0.4 202,-2.7 202,-0.2 2,-0.3 -0.829 52.2 116.3 -81.4 116.7 -2.1 -6.9 79.8 19 39 A G E -B 219 0A 8 -2,-0.7 2,-0.3 200,-0.3 200,-0.3 -0.945 51.5-121.3-164.8-177.4 0.7 -5.7 77.7 20 40 A V E -B 218 0A 0 198,-2.5 198,-2.5 -2,-0.3 2,-0.4 -0.986 8.8-160.5-140.7 146.0 3.7 -3.3 77.5 21 41 A F E -B 217 0A 0 -2,-0.3 13,-1.0 196,-0.2 2,-0.5 -1.000 7.2-169.7-123.9 128.9 4.7 -0.5 75.2 22 42 A V E -BC 216 33A 0 194,-2.5 194,-2.6 -2,-0.4 2,-0.4 -0.990 7.2-178.0-119.1 128.6 8.3 0.6 75.0 23 43 A L E -BC 215 32A 13 9,-2.6 9,-3.2 -2,-0.5 2,-0.4 -0.991 4.2-172.3-131.7 125.8 9.1 3.9 73.1 24 44 A a E -BC 214 31A 0 190,-3.1 190,-2.6 -2,-0.4 2,-0.6 -0.978 12.0-150.4-126.0 131.5 12.6 5.4 72.6 25 45 A K E S-B 213 0A 111 5,-1.2 2,-1.8 -2,-0.4 188,-0.2 -0.889 77.7 -21.1-100.7 118.2 13.4 8.8 71.1 26 46 A S S S+ 0 0 53 186,-3.4 2,-0.3 -2,-0.6 187,-0.1 -0.309 132.2 3.1 83.7 -54.9 16.7 9.1 69.2 27 47 A S S > S- 0 0 28 -2,-1.8 3,-1.1 3,-0.3 -2,-0.2 -0.956 76.3-100.8-154.0 172.3 18.3 6.1 70.9 28 48 A S T 3 S+ 0 0 29 -2,-0.3 3,-0.2 1,-0.2 120,-0.1 0.378 104.6 82.4 -81.7 6.0 17.7 3.3 73.4 29 49 A K T 3 S+ 0 0 159 1,-0.3 2,-0.3 -4,-0.1 -1,-0.2 0.572 98.6 40.5 -82.0 -10.6 19.5 5.2 76.2 30 50 A S S < S+ 0 0 59 -3,-1.1 -5,-1.2 -5,-0.1 2,-0.3 -0.806 79.5 152.3-142.1 95.0 16.3 7.1 76.8 31 51 A a E -aC 2 24A 8 -30,-1.8 -28,-2.0 -2,-0.3 2,-0.3 -0.881 26.9-150.6-125.0 151.9 13.1 5.0 76.6 32 52 A A E +aC 3 23A 24 -9,-3.2 -9,-2.6 -2,-0.3 2,-0.3 -0.893 17.0 174.1-122.9 157.3 9.7 5.2 78.2 33 53 A T E -aC 4 22A 0 -30,-2.1 -28,-3.6 -2,-0.3 -11,-0.2 -0.976 40.6-130.2-153.5 158.6 7.2 2.5 79.1 34 54 A N S S+ 0 0 2 -13,-1.0 2,-0.4 -2,-0.3 -25,-0.1 0.781 102.7 27.0 -79.1 -28.0 3.9 1.9 80.9 35 55 A D > - 0 0 59 -14,-0.3 4,-1.7 1,-0.1 -1,-0.3 -0.944 58.3-164.2-144.0 118.9 5.5 -1.0 82.9 36 56 A L H > S+ 0 0 78 -2,-0.4 4,-0.7 2,-0.2 -1,-0.1 0.914 94.6 47.0 -69.2 -47.1 9.1 -1.4 84.0 37 57 A A H >4 S+ 0 0 67 1,-0.2 3,-1.0 2,-0.2 4,-0.4 0.968 114.5 46.2 -56.4 -55.2 8.8 -5.1 84.9 38 58 A R H >4 S+ 0 0 19 1,-0.2 3,-0.8 2,-0.2 105,-0.4 0.796 99.8 70.3 -60.3 -29.4 6.9 -6.1 81.7 39 59 A A H 3< S+ 0 0 0 -4,-1.7 105,-2.2 1,-0.3 104,-0.4 0.813 109.1 33.4 -56.8 -35.3 9.4 -4.1 79.4 40 60 A S T << S+ 0 0 70 -3,-1.0 -1,-0.3 -4,-0.7 2,-0.2 0.342 90.3 117.2-106.4 3.1 12.2 -6.6 80.1 41 61 A K < - 0 0 104 -3,-0.8 102,-0.5 -4,-0.4 2,-0.4 -0.536 65.7-125.2 -68.0 141.3 10.0 -9.7 80.4 42 62 A E + 0 0 90 -2,-0.2 2,-0.3 100,-0.2 100,-0.3 -0.778 33.5 172.4-103.7 128.4 10.9 -12.2 77.6 43 63 A Y B -G 141 0B 35 98,-2.8 98,-2.3 -2,-0.4 0, 0.0 -0.839 44.8 -77.7-127.1 161.2 8.3 -13.6 75.1 44 64 A L - 0 0 29 -2,-0.3 96,-0.2 96,-0.2 145,-0.2 -0.408 38.2-144.1 -51.0 126.2 8.2 -15.8 72.0 45 65 A P > + 0 0 0 0, 0.0 3,-1.9 0, 0.0 -1,-0.2 0.790 29.8 177.8 -65.0 -26.7 9.2 -13.5 69.1 46 66 A A G > S- 0 0 2 88,-1.6 3,-2.4 1,-0.3 4,-0.2 -0.266 70.5 -7.9 46.8-138.3 6.8 -15.2 66.6 47 67 A A G > S+ 0 0 7 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.606 122.3 78.9 -67.5 -10.5 7.0 -13.4 63.3 48 68 A T G X S+ 0 0 0 -3,-1.9 3,-1.2 1,-0.3 -1,-0.3 0.750 82.4 69.5 -61.8 -20.3 9.2 -10.6 64.6 49 69 A F G <> S+ 0 0 0 -3,-2.4 4,-2.5 1,-0.2 -1,-0.3 0.647 74.7 82.1 -70.6 -18.2 12.0 -13.2 64.3 50 70 A X H <> S+ 0 0 3 -3,-1.6 4,-2.7 3,-0.2 -1,-0.2 0.815 85.8 64.1 -51.8 -28.7 11.6 -12.8 60.4 51 71 A I H <> S+ 0 0 1 -3,-1.2 4,-2.1 -4,-0.3 -2,-0.2 0.993 109.9 29.9 -60.6 -66.4 13.9 -9.8 61.0 52 72 A P H > S+ 0 0 0 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.888 120.3 57.6 -61.0 -35.5 17.1 -11.5 62.3 53 73 A N H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.922 106.2 48.2 -61.0 -46.3 16.2 -14.6 60.1 54 74 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.933 113.5 47.4 -57.0 -46.0 16.2 -12.4 57.0 55 75 A I H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.944 113.5 47.5 -64.9 -44.8 19.5 -10.9 57.9 56 76 A I H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 6,-0.3 0.882 108.7 54.5 -61.7 -37.8 21.1 -14.3 58.7 57 77 A G H <>S+ 0 0 0 -4,-2.5 6,-2.5 -5,-0.2 5,-0.8 0.905 112.4 44.1 -65.9 -39.9 19.7 -15.7 55.4 58 78 A L H ><5S+ 0 0 11 -4,-2.0 3,-1.2 4,-0.2 -2,-0.2 0.916 112.1 51.5 -67.8 -45.3 21.4 -12.9 53.5 59 79 A E H 3<5S+ 0 0 55 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.850 112.3 46.5 -62.4 -35.5 24.7 -13.1 55.5 60 80 A T T 3<5S- 0 0 27 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.425 112.1-114.9 -90.5 -3.9 25.0 -16.9 54.9 61 81 A G T < 5S+ 0 0 53 -3,-1.2 -3,-0.2 2,-0.3 -4,-0.1 0.394 86.0 120.3 81.0 -3.2 24.2 -16.8 51.2 62 82 A V S S- 0 0 37 -3,-0.1 3,-1.9 -4,-0.0 -1,-0.2 -0.933 72.1 -59.4-170.5-172.4 20.3 -11.0 47.4 66 86 A E T 3 S+ 0 0 27 1,-0.3 22,-0.4 -2,-0.3 23,-0.3 0.646 127.0 53.0 -59.0 -24.3 17.5 -8.5 47.5 67 87 A H T 3 S+ 0 0 49 20,-0.1 -1,-0.3 21,-0.1 -3,-0.0 0.261 75.3 135.1 -99.6 11.9 15.9 -9.9 44.3 68 88 A Q < - 0 0 55 -3,-1.9 20,-0.6 1,-0.0 2,-0.5 -0.355 46.0-148.0 -53.8 132.5 15.8 -13.5 45.4 69 89 A V E -H 87 0C 47 18,-0.2 2,-0.9 19,-0.1 18,-0.2 -0.954 3.4-145.1-105.5 129.2 12.4 -15.0 44.6 70 90 A F E -H 86 0C 27 16,-3.4 16,-1.9 -2,-0.5 2,-0.3 -0.826 23.8-143.3 -92.7 105.0 11.1 -17.7 47.0 71 91 A K - 0 0 163 -2,-0.9 2,-0.4 14,-0.2 14,-0.1 -0.529 5.2-128.6 -78.0 132.8 9.3 -20.1 44.8 72 92 A W - 0 0 81 -2,-0.3 13,-0.2 1,-0.1 -1,-0.1 -0.692 9.3-149.7 -76.6 126.3 6.1 -21.8 45.9 73 93 A D - 0 0 101 -2,-0.4 -1,-0.1 11,-0.1 10,-0.0 0.444 41.9-109.1 -72.4 -4.9 6.3 -25.6 45.4 74 94 A G S S+ 0 0 48 1,-0.3 3,-0.1 0, 0.0 -1,-0.1 0.379 77.8 130.2 89.0 -5.5 2.6 -25.9 44.9 75 95 A K - 0 0 135 1,-0.1 -1,-0.3 0, 0.0 -2,-0.1 -0.509 70.0 -80.0 -86.0 151.8 2.1 -27.7 48.3 76 96 A P - 0 0 125 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.212 47.0-166.4 -49.7 129.1 -0.6 -26.6 50.9 77 97 A R - 0 0 40 -3,-0.1 6,-0.1 2,-0.0 5,-0.1 -0.936 32.3-112.4-120.8 152.1 0.4 -23.6 53.1 78 98 A A S S+ 0 0 94 -2,-0.3 2,-0.4 4,-0.1 3,-0.1 0.659 103.3 38.0 -65.1 -17.0 -1.3 -22.5 56.3 79 99 A M S > S- 0 0 88 1,-0.1 3,-2.3 0, 0.0 4,-0.4 -0.999 75.1-136.5-131.5 133.5 -2.6 -19.3 54.7 80 100 A K G > S+ 0 0 154 -2,-0.4 3,-1.9 1,-0.3 -1,-0.1 0.880 105.4 63.8 -51.5 -41.9 -3.9 -18.9 51.1 81 101 A Q G 3 S+ 0 0 79 1,-0.3 -1,-0.3 -3,-0.1 15,-0.1 0.630 98.3 55.4 -60.1 -15.0 -2.0 -15.6 50.8 82 102 A W G < S+ 0 0 25 -3,-2.3 2,-2.0 1,-0.1 -1,-0.3 0.519 80.9 97.5 -91.3 -7.0 1.3 -17.6 51.2 83 103 A E S < S+ 0 0 39 -3,-1.9 2,-0.3 -4,-0.4 -1,-0.1 -0.491 74.3 61.2 -84.8 73.8 0.5 -19.8 48.3 84 104 A R S S- 0 0 72 -2,-2.0 -11,-0.1 -14,-0.1 2,-0.1 -0.932 96.1 -71.5-179.7 159.0 2.5 -18.1 45.7 85 105 A D - 0 0 55 -2,-0.3 2,-0.4 -13,-0.2 -14,-0.2 -0.390 56.2-167.1 -60.6 145.0 6.1 -17.0 44.7 86 106 A L E -H 70 0C 7 -16,-1.9 -16,-3.4 371,-0.1 2,-0.2 -0.976 18.8-138.7-139.1 146.7 7.2 -14.2 47.0 87 107 A T E > -H 69 0C 35 -2,-0.4 4,-3.1 -18,-0.2 5,-0.2 -0.453 43.7 -95.0 -91.5 176.7 10.0 -11.8 47.1 88 108 A L H > S+ 0 0 3 -20,-0.6 4,-2.6 -22,-0.4 5,-0.2 0.954 128.7 42.7 -57.4 -52.4 11.8 -11.0 50.4 89 109 A R H > S+ 0 0 27 -23,-0.3 4,-3.5 1,-0.2 5,-0.2 0.945 114.3 53.5 -58.2 -48.7 9.5 -7.9 51.1 90 110 A G H > S+ 0 0 17 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.910 110.2 45.4 -50.0 -49.2 6.5 -9.9 50.0 91 111 A A H X>S+ 0 0 0 -4,-3.1 5,-2.4 2,-0.2 4,-0.7 0.915 116.0 46.8 -66.2 -43.4 7.3 -12.8 52.4 92 112 A I H <5S+ 0 0 3 -4,-2.6 3,-0.5 -5,-0.2 -2,-0.2 0.950 112.5 50.8 -58.5 -46.9 8.0 -10.3 55.3 93 113 A Q H <5S+ 0 0 34 -4,-3.5 -2,-0.2 1,-0.3 -1,-0.2 0.822 119.3 33.3 -70.6 -34.6 4.7 -8.3 54.5 94 114 A V H <5S- 0 0 8 -4,-2.2 -1,-0.3 -5,-0.2 3,-0.2 0.461 108.7-125.3 -94.7 0.6 2.4 -11.3 54.4 95 115 A S T <5 - 0 0 23 -4,-0.7 2,-1.5 -3,-0.5 -3,-0.2 0.935 29.7-161.6 57.9 52.2 4.5 -12.9 57.2 96 116 A A >>< - 0 0 0 -5,-2.4 4,-1.4 1,-0.2 3,-1.2 -0.473 7.6-170.2 -73.2 87.7 5.0 -16.2 55.1 97 117 A V H 3> S+ 0 0 26 -2,-1.5 4,-2.5 1,-0.2 3,-0.3 0.865 79.1 54.8 -44.5 -51.1 6.1 -18.6 57.8 98 118 A P H 3> S+ 0 0 23 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.756 102.8 56.5 -62.9 -25.9 7.1 -21.5 55.4 99 119 A V H <> S+ 0 0 5 -3,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.919 113.0 42.1 -64.1 -46.0 9.5 -19.2 53.5 100 120 A F H X S+ 0 0 0 -4,-1.4 4,-2.7 -3,-0.3 -1,-0.2 0.798 108.7 58.0 -74.8 -32.1 11.3 -18.4 56.8 101 121 A Q H X S+ 0 0 40 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.928 109.9 44.9 -60.8 -42.5 11.1 -22.0 58.0 102 122 A Q H X S+ 0 0 85 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.914 111.0 53.8 -69.8 -39.6 13.1 -23.1 54.8 103 123 A I H X S+ 0 0 5 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.965 110.9 46.7 -50.7 -52.5 15.4 -20.2 55.3 104 124 A A H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.900 108.9 53.5 -62.4 -43.1 16.1 -21.4 58.9 105 125 A R H < S+ 0 0 102 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.911 111.6 45.9 -58.9 -42.9 16.6 -25.1 57.8 106 126 A E H < S+ 0 0 103 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.848 109.7 54.2 -70.3 -32.2 19.3 -24.0 55.2 107 127 A V H < S- 0 0 3 -4,-2.0 4,-0.5 -5,-0.2 -2,-0.2 0.965 103.7-155.0 -67.3 -45.1 21.0 -21.8 57.7 108 128 A G X - 0 0 15 -4,-3.0 4,-2.3 -5,-0.2 5,-0.2 -0.016 26.5 -78.5 87.2 154.3 21.2 -24.7 60.1 109 129 A E H > S+ 0 0 112 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.878 123.8 52.6 -57.7 -45.4 21.4 -24.9 63.9 110 130 A V H > S+ 0 0 129 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.952 116.0 38.7 -63.9 -50.9 25.2 -24.1 64.2 111 131 A R H > S+ 0 0 88 -4,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.883 114.6 54.3 -68.1 -38.9 25.0 -20.9 62.1 112 132 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.956 110.0 47.2 -60.1 -51.4 21.6 -19.8 63.6 113 133 A Q H X S+ 0 0 65 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.902 110.5 52.7 -52.8 -49.5 23.0 -20.1 67.1 114 134 A K H X S+ 0 0 98 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.924 110.9 46.3 -53.8 -52.1 26.2 -18.1 66.2 115 135 A Y H X S+ 0 0 21 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.860 109.9 52.3 -62.3 -38.5 24.2 -15.2 64.7 116 136 A L H X>S+ 0 0 0 -4,-2.2 5,-1.9 2,-0.2 4,-0.8 0.934 111.2 47.8 -66.5 -45.0 21.8 -15.0 67.6 117 137 A K H ><5S+ 0 0 112 -4,-2.4 3,-1.2 -5,-0.2 -2,-0.2 0.967 113.8 49.1 -47.6 -57.3 24.8 -14.8 70.0 118 138 A K H 3<5S+ 0 0 100 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.852 115.5 42.5 -49.5 -42.9 26.3 -12.1 67.6 119 139 A F H 3<5S- 0 0 11 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.473 103.1-127.9 -87.3 -6.6 23.1 -10.1 67.6 120 140 A S T <<5 - 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0 0 55 -14,-0.3 4,-2.3 1,-0.1 -1,-0.3 -0.861 57.3-166.9-154.8 102.3 3.4 7.5 21.7 283 56 B L H > S+ 0 0 74 -2,-0.3 4,-1.1 -3,-0.2 -1,-0.1 0.866 92.3 55.1 -56.3 -39.8 6.7 6.1 20.5 284 57 B A H >> S+ 0 0 62 1,-0.2 3,-0.8 2,-0.2 4,-0.6 0.952 111.5 40.0 -64.9 -51.8 7.8 9.4 19.2 285 58 B R H >4 S+ 0 0 22 1,-0.2 3,-1.0 2,-0.2 105,-0.4 0.862 106.3 66.3 -68.4 -34.3 7.3 11.4 22.4 286 59 B A H 3< S+ 0 0 0 -4,-2.3 105,-2.0 1,-0.3 104,-0.5 0.832 108.4 39.9 -53.4 -32.7 8.8 8.5 24.4 287 60 B S H << S+ 0 0 76 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.508 92.2 106.9 -95.0 -7.5 12.1 9.2 22.7 288 61 B K << - 0 0 118 -3,-1.0 102,-0.6 -4,-0.6 2,-0.4 -0.506 68.1-131.4 -70.1 142.3 11.9 13.0 22.8 289 62 B E E +P 389 0F 101 100,-0.2 2,-0.3 -2,-0.2 100,-0.3 -0.830 27.9 175.6-107.3 136.2 14.2 14.5 25.4 290 63 B Y E -P 388 0F 38 98,-2.3 98,-2.4 -2,-0.4 156,-0.0 -0.918 42.9 -81.0-133.4 152.4 13.3 17.1 28.1 291 64 B L - 0 0 25 -2,-0.3 96,-0.2 96,-0.2 145,-0.2 -0.295 39.2-142.5 -43.8 127.5 14.9 19.0 31.1 292 65 B P > - 0 0 0 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.720 27.8-179.3 -71.7 -22.7 14.7 16.5 34.0 293 66 B A G > S- 0 0 0 88,-1.7 3,-2.1 1,-0.3 4,-0.1 -0.252 71.2 -7.3 51.7-139.8 13.9 19.1 36.7 294 67 B A G > S+ 0 0 9 1,-0.3 3,-2.2 2,-0.2 4,-0.3 0.668 121.9 79.3 -63.2 -14.2 13.6 17.4 40.1 295 68 B T G X S+ 0 0 0 -3,-1.8 3,-1.8 1,-0.3 -1,-0.3 0.867 82.2 69.9 -59.9 -25.5 13.9 14.0 38.6 296 69 B F G <> S+ 0 0 0 -3,-2.1 4,-2.1 1,-0.3 -1,-0.3 0.624 74.6 81.4 -68.3 -14.9 17.6 14.8 38.5 297 70 B X H <> S+ 0 0 3 -3,-2.2 4,-2.7 2,-0.2 -1,-0.3 0.796 84.5 65.0 -58.0 -29.7 17.7 14.5 42.4 298 71 B I H <> S+ 0 0 2 -3,-1.8 4,-2.0 -4,-0.3 3,-0.2 0.993 108.8 32.4 -55.5 -70.8 18.0 10.8 41.8 299 72 B P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -2,-0.2 0.856 120.1 55.6 -53.9 -35.8 21.4 10.8 40.0 300 73 B N H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.854 106.1 49.0 -70.2 -39.7 22.5 13.8 42.2 301 74 B A H X S+ 0 0 0 -4,-2.7 4,-1.9 -5,-0.2 -1,-0.2 0.924 113.0 50.5 -57.5 -43.3 21.7 11.9 45.4 302 75 B I H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.914 112.5 43.1 -65.3 -45.8 23.7 9.0 44.0 303 76 B I H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 6,-0.3 0.904 111.7 54.5 -69.1 -39.0 26.8 11.1 43.0 304 77 B G H <>S+ 0 0 0 -4,-2.2 6,-3.5 1,-0.2 5,-1.2 0.869 111.9 45.8 -61.9 -36.9 26.7 13.0 46.4 305 78 B L H ><5S+ 0 0 8 -4,-1.9 3,-0.9 4,-0.2 -2,-0.2 0.955 114.4 46.8 -65.1 -53.0 26.8 9.7 48.2 306 79 B E H 3<5S+ 0 0 63 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.908 113.7 47.2 -57.8 -48.5 29.5 8.3 46.0 307 80 B T T 3<5S- 0 0 21 -4,-3.1 -1,-0.3 -5,-0.1 -2,-0.2 0.568 112.3-118.2 -73.6 -8.8 31.8 11.4 46.3 308 81 B G T < 5S+ 0 0 49 -3,-0.9 -3,-0.2 -4,-0.4 -4,-0.1 0.633 84.0 121.6 75.8 11.0 31.2 11.5 50.1 309 82 B V S S- 0 0 50 102,-0.0 3,-1.6 99,-0.0 -1,-0.3 -0.921 70.2 -70.2-174.6-177.9 25.6 8.3 54.6 313 86 B E T 3 S+ 0 0 25 -2,-0.3 22,-0.4 1,-0.3 23,-0.3 0.600 123.7 62.6 -69.6 -13.7 21.8 8.0 54.7 314 87 B H T 3 S+ 0 0 52 20,-0.1 -1,-0.3 21,-0.1 -159,-0.0 0.357 74.5 136.2 -95.0 3.4 21.6 9.4 58.3 315 88 B Q < - 0 0 28 -3,-1.6 20,-0.5 1,-0.1 2,-0.5 -0.250 45.1-148.8 -47.2 124.7 23.0 12.8 57.1 316 89 B V - 0 0 60 18,-0.1 2,-0.9 19,-0.1 18,-0.2 -0.878 2.7-149.1 -98.9 130.2 21.1 15.8 58.4 317 90 B F B -Q 333 0G 30 16,-3.0 16,-1.9 -2,-0.5 2,-0.2 -0.880 23.3-143.0-100.5 99.9 21.0 18.9 56.1 318 91 B K - 0 0 162 -2,-0.9 2,-0.5 14,-0.2 14,-0.1 -0.435 7.1-129.2 -70.3 127.1 20.9 21.7 58.7 319 92 B W - 0 0 83 -2,-0.2 13,-0.1 1,-0.1 -1,-0.1 -0.691 12.2-156.5 -75.0 121.2 18.7 24.7 57.7 320 93 B D - 0 0 111 -2,-0.5 -1,-0.1 11,-0.1 10,-0.0 0.794 42.0-108.5 -72.2 -28.8 20.9 27.8 58.2 321 94 B G S S+ 0 0 42 1,-0.4 3,-0.1 10,-0.1 -2,-0.1 0.415 71.8 133.1 117.6 1.5 17.8 30.0 58.6 322 95 B K - 0 0 138 1,-0.1 -1,-0.4 0, 0.0 -2,-0.1 -0.588 68.2 -90.8 -79.1 142.8 17.6 32.1 55.4 323 96 B P - 0 0 118 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.268 46.0-158.8 -51.8 134.4 14.2 32.3 53.5 324 97 B R - 0 0 42 -3,-0.1 6,-0.1 2,-0.1 5,-0.1 -0.811 31.3-102.3-116.6 160.3 13.7 29.5 51.0 325 98 B A S S+ 0 0 78 -2,-0.3 2,-0.4 1,-0.1 3,-0.0 0.747 106.5 33.7 -56.7 -29.0 11.4 29.4 47.9 326 99 B M S > S- 0 0 111 1,-0.1 3,-3.0 0, 0.0 4,-0.4 -0.996 72.5-134.5-132.9 135.4 8.8 27.2 49.8 327 100 B K G > S+ 0 0 151 -2,-0.4 3,-1.3 1,-0.3 -1,-0.1 0.800 106.2 69.9 -48.7 -34.8 7.8 27.0 53.4 328 101 B Q G 3 S+ 0 0 87 1,-0.2 -1,-0.3 13,-0.1 15,-0.1 0.716 99.2 48.3 -52.3 -27.9 8.1 23.2 53.1 329 102 B W G < S+ 0 0 33 -3,-3.0 2,-2.1 1,-0.1 -1,-0.2 0.529 80.5 98.0 -96.0 -9.6 11.9 23.7 52.8 330 103 B E S < S+ 0 0 73 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.1 -0.430 76.2 67.1 -84.2 65.6 12.5 26.0 55.8 331 104 B R S S- 0 0 68 -2,-2.1 2,-0.1 -14,-0.1 -11,-0.1 -0.957 94.3 -76.2-168.8 162.0 13.6 23.2 58.1 332 105 B D - 0 0 53 -2,-0.3 2,-0.3 -13,-0.1 -14,-0.2 -0.470 54.3-161.7 -67.5 145.1 16.4 20.6 58.7 333 106 B L B -Q 317 0G 8 -16,-1.9 -16,-3.0 -2,-0.1 2,-0.1 -0.994 21.1-146.9-139.8 139.1 16.2 17.7 56.3 334 107 B T > - 0 0 37 -125,-0.4 4,-3.8 -2,-0.3 5,-0.2 -0.409 46.9 -96.4 -81.3 173.3 17.4 14.0 55.8 335 108 B L H > S+ 0 0 3 -20,-0.5 4,-2.4 -22,-0.4 5,-0.2 0.959 128.4 43.2 -57.8 -51.3 18.1 12.8 52.3 336 109 B R H > S+ 0 0 23 -23,-0.3 4,-3.6 2,-0.2 5,-0.3 0.966 116.2 50.2 -58.0 -49.9 14.6 11.1 51.9 337 110 B G H > S+ 0 0 12 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.930 111.7 46.8 -48.8 -54.5 13.2 14.3 53.5 338 111 B A H <>S+ 0 0 0 -4,-3.8 5,-2.5 1,-0.2 -1,-0.2 0.799 116.6 45.4 -57.6 -34.0 15.1 16.5 51.1 339 112 B I H ><5S+ 0 0 2 -4,-2.4 3,-0.7 -3,-0.2 -2,-0.2 0.912 113.0 48.8 -76.6 -46.2 14.0 14.3 48.2 340 113 B Q H 3<5S+ 0 0 38 -4,-3.6 -2,-0.2 1,-0.3 -3,-0.2 0.790 118.2 38.2 -68.0 -36.7 10.3 14.0 49.2 341 114 B V T 3<5S- 0 0 12 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.336 108.0-132.1 -93.9 7.7 9.8 17.8 49.8 342 115 B S T < 5 - 0 0 25 -3,-0.7 2,-1.1 1,-0.2 -3,-0.2 0.886 27.7-165.9 43.3 57.4 12.0 18.2 46.7 343 116 B A >< - 0 0 0 -5,-2.5 4,-1.3 1,-0.2 3,-0.5 -0.624 8.6-168.6 -76.9 98.8 14.2 20.9 48.4 344 117 B V H > S+ 0 0 28 -2,-1.1 4,-2.4 1,-0.2 3,-0.2 0.896 79.7 58.1 -52.6 -51.1 16.2 22.5 45.5 345 118 B P H > S+ 0 0 36 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.824 103.6 54.2 -55.9 -35.5 18.7 24.5 47.7 346 119 B V H > S+ 0 0 8 -3,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.946 113.9 40.1 -60.6 -49.7 20.0 21.3 49.3 347 120 B F H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.739 110.8 57.9 -76.9 -23.6 20.7 19.6 46.0 348 121 B Q H X S+ 0 0 39 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.942 109.6 45.8 -64.0 -46.9 22.1 22.8 44.5 349 122 B Q H X S+ 0 0 76 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.868 112.3 50.2 -63.8 -41.2 24.6 22.7 47.4 350 123 B I H X S+ 0 0 5 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.914 110.4 50.8 -58.3 -46.7 25.3 19.0 46.8 351 124 B A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.886 109.7 50.9 -57.1 -40.6 25.9 19.8 43.1 352 125 B R H < S+ 0 0 109 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.852 112.9 43.7 -70.8 -35.6 28.3 22.6 44.2 353 126 B E H < S+ 0 0 101 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.852 112.6 54.0 -73.8 -36.7 30.3 20.3 46.5 354 127 B V H < S- 0 0 5 -4,-2.7 4,-0.4 -5,-0.2 -2,-0.2 0.995 103.5-153.2 -56.7 -58.6 30.2 17.5 43.8 355 128 B G X - 0 0 22 -4,-2.6 4,-3.0 -5,-0.2 5,-0.3 0.249 26.6 -79.6 91.7 141.6 31.7 19.9 41.2 356 129 B E H > S+ 0 0 95 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.733 126.1 50.1 -33.3 -44.2 31.5 20.2 37.4 357 130 B V H > S+ 0 0 124 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.961 115.3 38.9 -72.1 -54.3 34.2 17.6 36.9 358 131 B R H > S+ 0 0 110 -4,-0.4 4,-1.9 -3,-0.2 -2,-0.2 0.910 116.8 51.5 -63.8 -43.2 32.7 14.8 39.1 359 132 B M H X S+ 0 0 0 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.938 109.9 50.2 -55.8 -49.2 29.1 15.6 38.1 360 133 B Q H X S+ 0 0 85 -4,-1.8 4,-0.9 -5,-0.3 -1,-0.2 0.811 109.1 51.4 -59.8 -39.9 30.0 15.4 34.4 361 134 B K H >X S+ 0 0 100 -4,-1.7 4,-1.9 2,-0.2 3,-0.7 0.938 106.7 50.6 -68.8 -47.7 31.8 12.0 34.8 362 135 B Y H 3X S+ 0 0 30 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.894 104.7 58.4 -62.6 -37.4 29.1 10.2 36.6 363 136 B L H 3<>S+ 0 0 0 -4,-1.8 5,-2.6 1,-0.2 4,-0.4 0.832 106.5 49.3 -60.4 -31.0 26.5 11.2 34.0 364 137 B K H <<5S+ 0 0 141 -4,-0.9 3,-0.5 -3,-0.7 -1,-0.2 0.893 112.9 46.1 -72.8 -42.1 28.6 9.5 31.2 365 138 B K H <5S+ 0 0 107 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.844 117.1 44.9 -64.0 -37.2 28.9 6.3 33.3 366 139 B F T <5S- 0 0 9 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.498 103.9-131.8 -82.9 -6.2 25.1 6.5 34.0 367 140 B S T 5 - 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