==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BETA-LACTAMASE 03-JUL-00 1E4D . COMPND 2 MOLECULE: BETA-LACTAMASE OXA-10; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR L.MAVEYRAUD,D.GOLEMI,L.P.KOTRA,S.TRANIER,S.VAKULENKO, . 979 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40314.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 690 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 187 19.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 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 . 12 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 . 50 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 135 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 256 26.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.3 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 6 3 5 0 0 0 8 8 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 3 7 4 4 0 0 4 0 4 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 7 0 0 0 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 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 22 A I 0 0 102 0, 0.0 2,-0.3 0, 0.0 30,-0.3 0.000 360.0 360.0 360.0 134.1 30.6 13.2 58.0 2 23 A T E -a 31 0A 91 28,-2.3 30,-1.9 2,-0.0 2,-0.4 -0.765 360.0-118.0-112.7 161.1 30.9 10.3 60.5 3 24 A E E -a 32 0A 98 -2,-0.3 2,-0.5 28,-0.2 30,-0.2 -0.835 19.3-172.3-104.8 136.0 31.0 6.5 60.0 4 25 A N > + 0 0 49 28,-3.3 3,-0.9 -2,-0.4 4,-0.2 -0.862 5.0 178.1-126.5 97.8 28.4 4.2 61.4 5 26 A T G > S+ 0 0 86 -2,-0.5 3,-0.9 1,-0.2 4,-0.2 0.608 73.7 73.5 -81.3 -10.9 29.5 0.6 60.8 6 27 A S G > S+ 0 0 61 1,-0.2 3,-1.7 2,-0.2 -1,-0.2 0.827 86.1 67.0 -68.8 -28.3 26.4 -0.9 62.6 7 28 A W G X S+ 0 0 10 -3,-0.9 3,-1.3 1,-0.3 -1,-0.2 0.698 82.7 76.5 -63.0 -19.4 24.5 0.2 59.5 8 29 A N G X> S+ 0 0 65 -3,-0.9 3,-1.6 1,-0.2 4,-0.7 0.760 77.4 73.9 -59.6 -26.7 26.5 -2.5 57.6 9 30 A K H X> S+ 0 0 156 -3,-1.7 4,-0.6 1,-0.3 3,-0.5 0.801 88.6 59.9 -56.6 -31.1 24.2 -5.1 59.3 10 31 A E H <4 S+ 0 0 66 -3,-1.3 -1,-0.3 -4,-0.2 4,-0.2 0.614 107.2 45.6 -72.7 -14.3 21.5 -4.1 56.9 11 32 A F H <4>S+ 0 0 8 -3,-1.6 5,-2.7 -4,-0.2 -1,-0.2 0.560 96.8 74.5 -98.5 -13.4 23.6 -5.0 53.8 12 33 A S H X<5S+ 0 0 88 -4,-0.7 3,-0.7 -3,-0.5 -2,-0.1 0.836 83.8 59.3 -84.4 -31.8 24.9 -8.4 55.0 13 34 A A T 3<5S+ 0 0 98 -4,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.888 118.7 32.2 -63.1 -38.9 21.9 -10.7 54.6 14 35 A E T 3 5S- 0 0 93 -4,-0.2 -1,-0.3 -3,-0.1 -2,-0.2 0.274 110.0-123.3 -99.6 8.5 21.7 -10.0 50.9 15 36 A A T < 5 + 0 0 81 -3,-0.7 2,-0.4 1,-0.2 -3,-0.2 0.877 46.9 175.3 54.3 48.5 25.4 -9.5 50.5 16 37 A V < - 0 0 15 -5,-2.7 2,-0.6 -6,-0.0 -1,-0.2 -0.672 27.5-153.4 -90.6 132.2 25.1 -6.0 49.1 17 38 A N + 0 0 111 -2,-0.4 202,-3.1 202,-0.3 2,-0.3 -0.945 52.2 104.8 -98.0 118.0 28.2 -3.9 48.4 18 39 A G E -B 218 0A 6 -2,-0.6 2,-0.3 200,-0.3 200,-0.3 -0.969 56.2-115.0-175.6-179.9 26.9 -0.3 48.6 19 40 A V E -B 217 0A 0 198,-2.7 198,-2.3 -2,-0.3 2,-0.4 -0.996 9.4-159.8-143.0 142.3 26.8 2.9 50.6 20 41 A F E -B 216 0A 0 -2,-0.3 13,-1.1 196,-0.2 2,-0.4 -0.990 7.1-168.9-119.0 132.6 24.1 5.0 52.4 21 42 A V E -BC 215 32A 1 194,-2.6 194,-2.3 -2,-0.4 2,-0.4 -0.988 8.3-179.6-117.6 133.9 24.7 8.7 53.3 22 43 A L E -BC 214 31A 15 9,-2.5 9,-2.0 -2,-0.4 2,-0.5 -0.988 4.9-171.4-140.4 121.2 22.2 10.3 55.6 23 44 A a E -BC 213 30A 0 190,-3.2 190,-2.5 -2,-0.4 2,-0.5 -0.961 12.7-147.4-121.4 129.0 22.3 14.0 56.7 24 45 A K E S-B 212 0A 106 5,-1.8 2,-1.6 -2,-0.5 188,-0.2 -0.838 77.8 -20.8 -95.6 123.8 20.1 15.6 59.4 25 46 A S S S+ 0 0 60 186,-3.2 2,-0.3 -2,-0.5 -1,-0.1 -0.168 131.3 2.7 80.3 -45.8 19.2 19.2 58.9 26 47 A S S > S- 0 0 36 -2,-1.6 3,-1.3 3,-0.2 -2,-0.1 -0.967 80.5 -93.3-160.5 172.7 22.0 20.0 56.5 27 48 A S T 3 S+ 0 0 37 -2,-0.3 3,-0.3 1,-0.3 120,-0.1 0.423 112.7 71.8 -79.7 1.2 25.0 18.5 54.6 28 49 A K T 3 S+ 0 0 190 1,-0.2 2,-0.3 -4,-0.1 -1,-0.3 0.482 94.9 55.3 -89.7 -6.8 27.4 19.5 57.5 29 50 A S S < S+ 0 0 74 -3,-1.3 -5,-1.8 -5,-0.1 2,-0.3 -0.627 79.6 146.4-123.5 74.1 25.9 16.8 59.7 30 51 A a E - C 0 23A 17 -2,-0.3 -28,-2.3 -3,-0.3 2,-0.3 -0.780 25.5-172.4-114.2 153.5 26.2 13.6 57.7 31 52 A A E +aC 2 22A 18 -9,-2.0 -9,-2.5 -2,-0.3 2,-0.3 -0.962 7.3 178.2-137.6 159.6 26.8 9.9 58.6 32 53 A T E -aC 3 21A 0 -30,-1.9 -28,-3.3 -2,-0.3 3,-0.3 -0.986 38.1-126.3-155.6 160.2 27.4 6.8 56.4 33 54 A N S S+ 0 0 4 -13,-1.1 2,-0.2 -2,-0.3 -25,-0.1 0.692 106.1 26.1 -81.7 -20.2 28.2 3.1 56.6 34 55 A D > - 0 0 53 -14,-0.4 4,-2.2 1,-0.1 -1,-0.3 -0.723 59.4-171.3-151.1 96.7 31.3 3.5 54.4 35 56 A L H > S+ 0 0 66 -3,-0.3 4,-0.9 -2,-0.2 -1,-0.1 0.848 90.0 55.2 -58.2 -40.1 33.2 6.7 54.3 36 57 A A H >4 S+ 0 0 57 1,-0.2 3,-0.9 2,-0.2 4,-0.3 0.976 113.6 38.3 -55.4 -57.3 35.4 5.4 51.4 37 58 A R H >4 S+ 0 0 13 1,-0.2 3,-0.9 2,-0.2 105,-0.4 0.748 102.5 74.2 -73.6 -19.6 32.4 4.6 49.1 38 59 A A H 3< S+ 0 0 2 -4,-2.2 105,-2.0 1,-0.3 104,-0.4 0.869 105.0 36.9 -56.5 -39.1 30.5 7.7 50.2 39 60 A S T << S+ 0 0 76 -4,-0.9 -1,-0.3 -3,-0.9 2,-0.2 0.435 92.6 115.2 -93.2 -2.6 32.8 9.9 48.1 40 61 A K < - 0 0 106 -3,-0.9 102,-0.5 -4,-0.3 2,-0.4 -0.499 64.6-127.4 -75.9 138.1 33.2 7.3 45.3 41 62 A E E +G 141 0B 95 -2,-0.2 2,-0.3 100,-0.2 100,-0.3 -0.696 32.0 171.3 -98.5 131.9 31.8 8.5 41.9 42 63 A Y E -G 140 0B 40 98,-2.7 98,-2.6 -2,-0.4 156,-0.0 -0.907 43.7 -80.8-131.4 157.6 29.3 6.4 39.9 43 64 A L - 0 0 28 -2,-0.3 96,-0.2 96,-0.2 145,-0.1 -0.397 36.8-145.6 -51.3 132.5 27.0 6.7 36.8 44 65 A P > + 0 0 0 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.697 26.9 178.6 -78.2 -22.5 23.9 8.6 37.9 45 66 A A G > S- 0 0 0 88,-1.6 3,-2.1 1,-0.3 4,-0.2 -0.217 71.2 -6.9 46.9-135.4 21.5 6.7 35.6 46 67 A S G > S+ 0 0 9 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.618 121.0 79.0 -74.0 -4.8 17.9 7.9 36.1 47 68 A T G X S+ 0 0 0 -3,-1.9 3,-1.5 1,-0.3 -1,-0.3 0.787 81.1 72.9 -63.0 -22.1 18.9 10.1 39.1 48 69 A F G <> S+ 0 0 0 -3,-2.1 4,-2.7 1,-0.3 -1,-0.3 0.707 73.8 81.5 -64.0 -16.3 20.1 12.5 36.4 49 70 A X H <> S+ 0 0 0 -3,-1.6 4,-2.7 1,-0.2 -1,-0.3 0.793 83.5 63.4 -59.0 -26.3 16.4 13.2 35.6 50 71 A I H <> S+ 0 0 2 -3,-1.5 4,-2.1 -4,-0.2 -1,-0.2 0.990 111.5 32.2 -61.1 -58.7 16.5 15.7 38.5 51 72 A P H > S+ 0 0 0 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.927 119.0 55.5 -64.0 -42.7 19.1 18.0 36.9 52 73 A N H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.923 107.9 48.9 -56.0 -45.6 17.8 17.2 33.4 53 74 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.934 112.6 47.2 -62.7 -45.5 14.3 18.3 34.4 54 75 A I H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.935 114.5 46.7 -58.9 -48.1 15.5 21.5 36.0 55 76 A I H X S+ 0 0 0 -4,-3.1 4,-2.4 2,-0.2 6,-0.3 0.898 109.3 54.8 -62.9 -40.2 17.7 22.3 33.0 56 77 A G H X>S+ 0 0 0 -4,-2.8 6,-2.5 -5,-0.3 4,-0.7 0.898 113.5 42.2 -58.4 -44.2 14.8 21.5 30.6 57 78 A L H ><5S+ 0 0 11 -4,-2.2 3,-0.6 4,-0.2 -2,-0.2 0.922 113.0 52.5 -68.3 -44.9 12.6 24.0 32.4 58 79 A E H 3<5S+ 0 0 57 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.846 112.6 44.4 -60.0 -38.3 15.4 26.6 32.7 59 80 A T H 3<5S- 0 0 28 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.624 112.0-116.1 -84.5 -17.0 16.1 26.6 29.0 60 81 A G T <<5S+ 0 0 52 -4,-0.7 -3,-0.2 -3,-0.6 -4,-0.1 0.340 84.6 118.6 94.1 -3.0 12.5 26.6 27.9 61 82 A V S S- 0 0 43 102,-0.0 3,-1.4 99,-0.0 -1,-0.2 -0.945 70.8 -65.9-170.5-170.3 6.0 24.6 32.3 65 86 A E T 3 S+ 0 0 25 -2,-0.3 22,-0.4 1,-0.3 23,-0.3 0.645 124.7 53.9 -69.4 -18.9 4.8 22.1 34.9 66 87 A H T 3 S+ 0 0 48 20,-0.1 -1,-0.3 21,-0.1 2,-0.2 0.272 73.8 131.4-103.2 12.5 1.8 21.1 32.9 67 88 A Q < - 0 0 53 -3,-1.4 20,-0.6 1,-0.0 2,-0.5 -0.434 48.7-143.2 -63.6 132.6 3.5 20.2 29.6 68 89 A V E -H 86 0C 53 -2,-0.2 2,-1.0 18,-0.2 18,-0.2 -0.862 1.3-147.0 -97.7 131.8 2.4 16.8 28.3 69 90 A F E -H 85 0C 26 16,-3.4 16,-1.9 -2,-0.5 2,-0.2 -0.844 23.6-149.4 -96.9 96.1 4.9 14.6 26.6 70 91 A K - 0 0 167 -2,-1.0 2,-0.4 14,-0.2 14,-0.1 -0.485 11.6-122.3 -72.6 139.0 2.8 12.8 23.9 71 92 A W - 0 0 27 -2,-0.2 13,-0.1 743,-0.2 -1,-0.1 -0.692 10.3-148.2 -78.8 131.8 3.8 9.3 22.9 72 93 A D - 0 0 46 -2,-0.4 -1,-0.1 2,-0.1 743,-0.1 0.549 40.8-112.2 -78.5 -9.0 4.4 9.0 19.2 73 94 A G S S+ 0 0 21 1,-0.3 741,-0.1 741,-0.1 742,-0.1 0.374 75.4 129.6 95.8 0.1 3.2 5.4 19.2 74 95 A K - 0 0 38 1,-0.1 -1,-0.3 740,-0.1 852,-0.1 -0.561 69.0 -79.6 -94.0 150.0 6.6 4.0 18.4 75 96 A P - 0 0 56 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.124 46.5-170.4 -57.3 129.4 8.2 1.1 20.4 76 97 A R - 0 0 45 2,-0.1 6,-0.1 -3,-0.1 5,-0.0 -0.803 33.2-113.9-114.0 165.9 9.8 1.9 23.7 77 98 A A S S+ 0 0 88 -2,-0.3 2,-0.4 1,-0.1 3,-0.1 0.800 100.3 42.1 -73.6 -30.7 11.9 -0.3 25.9 78 99 A M S > S- 0 0 100 1,-0.1 3,-1.1 -3,-0.0 4,-0.4 -0.957 72.3-139.4-116.7 141.3 9.4 -0.4 28.8 79 100 A K G > S+ 0 0 176 -2,-0.4 3,-1.8 1,-0.3 -1,-0.1 0.885 102.8 64.6 -62.4 -34.8 5.6 -0.9 28.5 80 101 A Q G 3 S+ 0 0 113 1,-0.3 -1,-0.3 -3,-0.1 15,-0.1 0.732 99.9 53.7 -60.9 -24.7 5.1 1.7 31.3 81 102 A W G < S+ 0 0 32 -3,-1.1 2,-1.9 1,-0.1 -1,-0.3 0.582 81.4 95.2 -84.0 -11.1 6.7 4.4 29.0 82 103 A E S < S+ 0 0 50 -3,-1.8 2,-0.3 -4,-0.4 -1,-0.1 -0.439 75.8 64.6 -86.2 73.1 4.3 3.7 26.1 83 104 A R S S- 0 0 86 -2,-1.9 2,-0.2 -14,-0.1 -11,-0.1 -0.950 96.2 -75.2-177.3 156.7 1.7 6.4 26.9 84 105 A D - 0 0 61 -2,-0.3 2,-0.3 -13,-0.1 -14,-0.2 -0.508 55.5-165.9 -65.1 140.7 1.4 10.2 27.1 85 106 A L E -H 69 0C 3 -16,-1.9 -16,-3.4 -2,-0.2 2,-0.1 -0.973 18.8-135.7-133.9 143.2 3.2 11.4 30.3 86 107 A T E > -H 68 0C 28 -2,-0.3 4,-2.8 -18,-0.2 5,-0.2 -0.385 43.4 -97.7 -79.5 175.1 3.2 14.6 32.4 87 108 A L H > S+ 0 0 2 -20,-0.6 4,-2.1 -22,-0.4 5,-0.2 0.948 129.5 45.4 -58.1 -49.7 6.6 15.9 33.6 88 109 A R H > S+ 0 0 23 -23,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.923 112.5 52.4 -56.6 -47.7 5.9 14.3 37.0 89 110 A G H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.943 108.7 48.9 -53.2 -50.4 4.8 11.1 35.2 90 111 A A H <>S+ 0 0 0 -4,-2.8 5,-2.5 1,-0.2 4,-0.3 0.873 114.6 44.8 -63.7 -38.8 7.9 10.8 33.1 91 112 A I H ><5S+ 0 0 1 -4,-2.1 3,-0.8 -5,-0.2 -1,-0.2 0.956 114.0 49.9 -66.1 -47.8 10.2 11.3 36.1 92 113 A Q H 3<5S+ 0 0 34 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.768 118.6 36.1 -69.0 -31.7 8.2 8.9 38.3 93 114 A V T 3<5S- 0 0 10 -4,-2.5 -1,-0.3 -5,-0.2 3,-0.2 0.367 109.6-125.4 -97.7 1.7 8.2 6.0 35.8 94 115 A S T < 5 - 0 0 20 -3,-0.8 2,-1.7 -4,-0.3 -3,-0.2 0.910 31.0-167.4 60.5 53.0 11.7 7.0 34.7 95 116 A A >>< - 0 0 0 -5,-2.5 4,-1.2 1,-0.2 3,-0.9 -0.470 4.8-171.7 -80.8 88.4 10.8 7.4 31.0 96 117 A V H 3> S+ 0 0 20 -2,-1.7 4,-2.5 1,-0.2 3,-0.2 0.832 77.3 58.0 -48.1 -50.0 14.2 7.5 29.4 97 118 A P H 3> S+ 0 0 31 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.870 102.8 54.8 -58.4 -39.2 13.1 8.4 25.8 98 119 A V H <> S+ 0 0 9 -3,-0.9 4,-1.9 1,-0.2 -2,-0.2 0.946 113.2 41.7 -54.4 -48.8 11.4 11.6 27.1 99 120 A F H X S+ 0 0 0 -4,-1.2 4,-2.7 -3,-0.2 -1,-0.2 0.793 108.1 60.8 -76.7 -25.9 14.6 12.8 28.8 100 121 A Q H X S+ 0 0 33 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.933 108.6 43.4 -60.8 -47.2 16.7 11.8 25.8 101 122 A Q H X S+ 0 0 15 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.870 112.4 53.6 -66.8 -39.0 14.8 14.1 23.6 102 123 A I H X S+ 0 0 5 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.945 108.7 49.5 -55.0 -48.8 14.9 16.8 26.3 103 124 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.872 108.7 52.6 -61.6 -40.2 18.7 16.4 26.5 104 125 A R H < S+ 0 0 31 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.903 110.8 46.9 -60.7 -43.0 19.0 16.7 22.7 105 126 A E H < S+ 0 0 80 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.841 111.5 50.5 -71.4 -32.0 17.0 20.0 22.6 106 127 A V H < S- 0 0 4 -4,-2.2 4,-0.5 -5,-0.2 -2,-0.2 0.945 103.1-157.5 -65.0 -50.9 19.1 21.4 25.5 107 128 A G X - 0 0 21 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.205 27.2 -76.5 89.9 159.4 22.3 20.6 23.7 108 129 A E H > S+ 0 0 115 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.854 124.4 51.9 -60.5 -43.7 25.8 20.0 24.8 109 130 A V H > S+ 0 0 128 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.945 116.1 39.8 -63.1 -46.0 26.8 23.6 25.4 110 131 A R H > S+ 0 0 92 -4,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.911 115.1 52.8 -69.5 -39.8 23.8 24.4 27.6 111 132 A M H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.938 109.6 49.1 -60.0 -48.0 24.1 21.0 29.4 112 133 A Q H X S+ 0 0 69 -4,-2.7 4,-1.7 -5,-0.2 -1,-0.2 0.897 110.2 51.8 -55.1 -45.5 27.8 21.6 30.2 113 134 A K H X S+ 0 0 96 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.913 111.0 45.8 -61.7 -46.7 27.0 25.1 31.5 114 135 A Y H X S+ 0 0 19 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.858 110.0 53.1 -70.1 -34.5 24.3 24.0 33.9 115 136 A L H <>S+ 0 0 0 -4,-2.1 5,-2.4 2,-0.2 4,-0.3 0.814 109.4 49.7 -72.9 -28.8 26.2 21.0 35.3 116 137 A K H ><5S+ 0 0 149 -4,-1.7 3,-1.0 -5,-0.2 -2,-0.2 0.928 112.0 49.1 -65.8 -46.5 29.1 23.4 36.1 117 138 A K H 3<5S+ 0 0 105 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.915 115.3 43.3 -56.9 -42.2 26.7 25.7 37.8 118 139 A F T 3<5S- 0 0 10 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.467 103.6-130.3 -84.3 -3.4 25.2 22.7 39.8 119 140 A S T < 5 - 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0 0 17 -3,-0.9 2,-1.8 -5,-0.2 -3,-0.2 0.910 30.8-166.2 60.8 54.8 -13.3 20.1 -18.7 340 116 B A >>< - 0 0 0 -5,-2.7 4,-1.2 1,-0.2 3,-0.9 -0.466 5.4-172.1 -80.1 87.0 -11.6 19.7 -22.1 341 117 B V H 3> S+ 0 0 20 -2,-1.8 4,-2.3 1,-0.3 3,-0.2 0.825 77.2 57.2 -45.2 -51.8 -14.7 19.6 -24.4 342 118 B P H 3> S+ 0 0 31 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.855 102.9 54.9 -58.9 -39.3 -12.8 18.7 -27.6 343 119 B V H <> S+ 0 0 8 -3,-0.9 4,-2.3 1,-0.2 -2,-0.2 0.948 113.2 41.3 -52.4 -52.2 -11.3 15.6 -26.1 344 120 B F H X S+ 0 0 0 -4,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.762 108.5 61.0 -75.5 -23.6 -14.7 14.2 -25.1 345 121 B Q H X S+ 0 0 41 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.946 108.6 43.5 -61.3 -46.6 -16.2 15.4 -28.4 346 122 B Q H X S+ 0 0 86 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.892 112.2 53.7 -68.3 -39.5 -13.8 13.0 -30.2 347 123 B I H X S+ 0 0 4 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.948 108.5 49.7 -51.8 -54.6 -14.5 10.3 -27.6 348 124 B A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.905 108.7 51.8 -54.0 -47.0 -18.3 10.6 -28.3 349 125 B R H < S+ 0 0 100 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.907 112.0 46.9 -55.9 -43.3 -17.8 10.4 -32.1 350 126 B E H < S+ 0 0 101 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.845 111.4 50.4 -72.3 -34.9 -15.7 7.2 -31.6 351 127 B V H < S- 0 0 5 -4,-2.5 4,-0.5 -5,-0.2 -2,-0.2 0.956 102.7-157.5 -60.2 -52.7 -18.3 5.7 -29.2 352 128 B G X - 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