==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-OCT-11 4A5R . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS LICHENIFORMIS; . AUTHOR P.POWER,E.SAUVAGE,R.HERMAN,F.KERFF,P.CHARLIER . 514 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21763.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 349 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 14.4 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 8 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 31.3 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+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 0 0 0 0 2 4 2 6 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 1 1 3 0 0 2 2 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 . 4 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 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 30 A K > 0 0 169 0, 0.0 4,-1.5 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -8.0 37.1 8.6 35.4 2 31 A D H > + 0 0 103 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.812 360.0 59.3 -74.4 -30.6 40.6 7.1 35.1 3 32 A D H > S+ 0 0 91 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.893 107.8 47.1 -63.3 -38.7 39.4 3.5 34.6 4 33 A F H > S+ 0 0 9 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.891 109.5 53.7 -68.4 -40.9 37.5 4.6 31.5 5 34 A A H X S+ 0 0 25 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.894 107.4 50.8 -57.7 -43.9 40.5 6.5 30.2 6 35 A K H X S+ 0 0 97 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.868 110.0 50.5 -63.9 -36.0 42.7 3.4 30.5 7 36 A L H X S+ 0 0 21 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.873 107.5 53.2 -66.0 -39.5 40.0 1.5 28.6 8 37 A E H <>S+ 0 0 21 -4,-2.3 5,-1.4 1,-0.2 4,-0.3 0.839 114.1 43.3 -62.8 -33.9 40.0 4.2 25.9 9 38 A E H <5S+ 0 0 139 -4,-1.7 -2,-0.2 3,-0.2 -1,-0.2 0.861 113.1 50.6 -78.7 -38.5 43.8 3.8 25.7 10 39 A Q H <5S+ 0 0 145 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.883 123.4 29.6 -67.6 -39.4 43.8 -0.1 25.7 11 40 A F T <5S- 0 0 35 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.351 101.3-129.0-103.7 2.8 41.2 -0.4 23.0 12 41 A D T 5 + 0 0 108 -4,-0.3 222,-0.4 1,-0.2 2,-0.3 0.911 68.2 117.7 45.6 55.6 42.1 2.8 21.1 13 42 A A < - 0 0 13 -5,-1.4 2,-0.5 -6,-0.2 220,-0.2 -0.916 68.4-112.4-141.7 162.2 38.5 4.0 21.1 14 43 A K E -A 232 0A 63 218,-3.4 218,-1.6 -2,-0.3 2,-0.4 -0.910 35.0-150.0-100.3 132.3 36.4 6.8 22.4 15 44 A L E -A 231 0A 0 -2,-0.5 2,-0.4 216,-0.2 216,-0.2 -0.836 14.4-169.6-109.0 139.6 33.8 5.8 25.1 16 45 A G E +A 230 0A 0 214,-2.8 214,-3.1 -2,-0.4 2,-0.4 -0.992 17.3 176.4-127.5 121.7 30.4 7.3 26.0 17 46 A I E +AB 229 30A 0 13,-3.3 13,-1.8 -2,-0.4 2,-0.3 -0.987 16.0 166.0-133.5 127.8 28.8 6.1 29.2 18 47 A F E +AB 228 29A 0 210,-2.0 210,-2.3 -2,-0.4 2,-0.4 -0.914 11.1 168.8-137.9 126.3 25.6 6.9 31.0 19 48 A A E -AB 227 28A 0 9,-1.9 9,-1.7 -2,-0.3 2,-0.4 -0.980 8.4-173.6-132.3 140.1 24.3 4.7 33.8 20 49 A L E -AB 226 27A 3 206,-2.1 206,-2.5 -2,-0.4 2,-0.8 -0.992 21.2-145.3-137.2 125.8 21.6 5.4 36.3 21 50 A D E >> -A 225 0A 31 5,-2.6 4,-2.7 -2,-0.4 3,-0.8 -0.842 15.6-156.4 -81.6 109.0 20.4 3.4 39.3 22 51 A T T 34 S+ 0 0 34 202,-2.1 -1,-0.1 -2,-0.8 203,-0.1 0.700 88.9 54.7 -62.9 -17.8 16.7 4.1 39.2 23 52 A G T 34 S+ 0 0 6 201,-0.3 -1,-0.2 200,-0.2 395,-0.1 0.753 124.4 17.2 -86.3 -27.0 16.5 3.3 42.9 24 53 A T T <4 S- 0 0 49 -3,-0.8 -2,-0.2 2,-0.2 390,-0.2 0.535 91.2-125.0-121.6 -15.4 19.1 5.7 44.2 25 54 A N < + 0 0 4 -4,-2.7 2,-0.4 1,-0.3 -3,-0.1 0.732 58.7 149.0 63.0 24.3 19.7 8.3 41.4 26 55 A R - 0 0 99 -5,-0.4 -5,-2.6 230,-0.0 -1,-0.3 -0.741 27.5-166.5 -80.6 136.6 23.4 7.4 41.5 27 56 A T E -B 20 0A 41 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -0.840 20.9-153.6-121.6 161.3 24.9 7.8 38.1 28 57 A V E -B 19 0A 16 -9,-1.7 -9,-1.9 -2,-0.3 2,-0.4 -0.990 26.8-180.0-130.0 123.7 28.2 6.9 36.3 29 59 A T E +B 18 0A 30 -2,-0.4 2,-0.3 -11,-0.2 -11,-0.2 -0.944 21.2 166.3-130.0 147.7 29.1 9.1 33.5 30 60 A Y E S-B 17 0A 24 -13,-1.8 -13,-3.3 -2,-0.4 121,-0.1 -0.814 86.3 -20.6-158.3 121.9 31.9 9.4 30.9 31 61 A R S > S+ 0 0 88 -2,-0.3 3,-1.3 -15,-0.2 120,-0.4 0.894 83.1 167.3 38.2 51.4 31.6 11.6 27.9 32 62 A P T 3 + 0 0 20 0, 0.0 120,-2.1 0, 0.0 121,-0.3 0.707 69.3 42.2 -63.7 -23.6 27.9 11.3 28.5 33 63 A D T 3 S+ 0 0 60 118,-0.1 2,-0.3 117,-0.1 -2,-0.1 0.255 85.2 114.2-112.5 9.5 27.0 14.1 26.2 34 64 A E < - 0 0 69 -3,-1.3 117,-0.6 -19,-0.1 2,-0.2 -0.647 68.3-116.7 -80.6 140.2 29.3 13.3 23.3 35 65 A R E +E 150 0B 92 -2,-0.3 2,-0.3 115,-0.1 115,-0.2 -0.547 36.0 172.1 -79.1 136.0 27.6 12.3 20.0 36 66 A F E -E 149 0B 5 113,-2.4 113,-1.8 -2,-0.2 2,-0.2 -0.962 45.6 -93.7-130.6 153.9 28.0 8.8 18.5 37 67 A A E -E 148 0B 6 -2,-0.3 111,-0.3 111,-0.2 194,-0.2 -0.528 34.7-149.6 -58.1 130.5 26.2 7.2 15.5 38 68 A F > + 0 0 0 109,-2.0 3,-1.4 -2,-0.2 -1,-0.2 0.830 27.7 174.9 -77.2 -28.5 23.4 5.3 17.3 39 69 A A G > - 0 0 0 108,-0.6 3,-1.9 98,-0.3 -1,-0.2 -0.301 65.3 -9.0 55.3-140.1 23.3 2.5 14.6 40 70 A S G > S+ 0 0 9 1,-0.3 3,-2.1 165,-0.2 4,-0.4 0.577 115.8 84.7 -68.4 -11.4 20.9 -0.4 15.5 41 71 A T G X> S+ 0 0 0 -3,-1.4 3,-1.2 1,-0.3 4,-0.9 0.814 78.4 71.0 -58.0 -23.5 20.2 0.8 19.0 42 72 A I H <> S+ 0 0 2 -3,-1.9 4,-2.2 1,-0.3 -1,-0.3 0.791 82.1 73.2 -63.0 -23.9 17.6 3.0 17.2 43 73 A K H <> S+ 0 0 0 -3,-2.1 4,-2.1 1,-0.2 -1,-0.3 0.856 93.3 52.3 -56.9 -38.9 15.7 -0.3 16.6 44 74 A A H <> S+ 0 0 1 -3,-1.2 4,-2.3 -4,-0.4 -1,-0.2 0.932 111.4 44.0 -64.0 -49.5 14.7 -0.3 20.3 45 75 A L H X S+ 0 0 0 -4,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.805 110.2 58.2 -66.3 -29.8 13.3 3.2 20.3 46 76 A T H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.923 109.3 42.4 -67.9 -44.9 11.6 2.5 17.0 47 77 A V H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.875 109.6 60.9 -63.9 -37.6 9.6 -0.4 18.5 48 78 A G H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.965 109.6 41.2 -50.9 -52.6 9.1 1.9 21.6 49 79 A V H X S+ 0 0 0 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.894 111.3 55.1 -65.5 -41.5 7.3 4.3 19.3 50 80 A L H >X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 3,-0.8 0.919 105.1 54.1 -56.4 -43.6 5.4 1.6 17.4 51 81 A L H 3< S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.860 104.2 56.1 -60.9 -35.4 4.1 0.3 20.7 52 82 A Q H 3< S+ 0 0 64 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.821 117.7 33.6 -58.2 -35.7 2.8 3.8 21.5 53 83 A Q H << S+ 0 0 86 -4,-1.2 2,-0.4 -3,-0.8 -2,-0.2 0.701 110.2 66.2 -98.8 -27.0 0.8 3.8 18.2 54 86 A K < - 0 0 35 -4,-2.7 2,-0.1 -5,-0.2 -1,-0.0 -0.828 68.0-137.6-108.6 139.1 -0.3 0.2 17.8 55 87 A S > - 0 0 51 -2,-0.4 4,-1.1 1,-0.1 -2,-0.1 -0.370 37.0-102.7 -76.1 166.2 -2.7 -2.0 19.8 56 88 A I T >4 S+ 0 0 64 1,-0.2 3,-0.9 2,-0.2 4,-0.3 0.935 125.7 47.3 -58.2 -45.5 -1.7 -5.6 20.6 57 89 A E G >4 S+ 0 0 159 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.805 101.3 64.2 -68.4 -29.2 -4.1 -6.8 17.9 58 90 A D G >4 S+ 0 0 68 1,-0.2 3,-1.7 2,-0.2 29,-0.3 0.826 94.1 64.9 -53.3 -32.0 -2.8 -4.2 15.4 59 91 A L G << S+ 0 0 1 -4,-1.1 29,-2.7 -3,-0.9 28,-0.5 0.688 89.0 65.4 -72.5 -15.6 0.5 -6.2 15.8 60 92 A N G < S+ 0 0 94 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.525 75.6 120.0 -78.1 -5.6 -1.2 -9.2 14.2 61 93 A Q < - 0 0 94 -3,-1.7 26,-1.3 -4,-0.2 2,-0.4 -0.414 66.3-125.8 -64.4 129.4 -1.5 -7.3 10.9 62 94 A R E -F 86 0C 120 24,-0.2 2,-0.6 -2,-0.2 24,-0.3 -0.640 19.3-157.3 -78.9 128.2 0.3 -9.0 8.0 63 95 A I E -F 85 0C 15 22,-2.7 22,-2.0 -2,-0.4 2,-0.3 -0.936 5.9-158.4-107.2 117.0 2.9 -6.8 6.1 64 96 A T + 0 0 116 -2,-0.6 2,-0.3 20,-0.2 17,-0.1 -0.669 20.1 161.6 -89.5 155.1 3.7 -7.9 2.5 65 97 A Y - 0 0 13 16,-0.5 2,-0.2 -2,-0.3 19,-0.1 -0.954 24.9-121.5-164.1 166.5 7.0 -6.8 0.9 66 98 A T >> - 0 0 78 -2,-0.3 3,-0.8 1,-0.1 4,-0.6 -0.617 31.6 -99.3-118.5 175.5 9.2 -7.8 -2.0 67 99 A R G >4 S+ 0 0 170 1,-0.2 3,-0.5 2,-0.2 -1,-0.1 0.801 124.2 55.0 -58.5 -32.6 12.8 -8.9 -2.9 68 100 A D G 34 S+ 0 0 156 1,-0.2 -1,-0.2 0, 0.0 0, 0.0 0.692 99.0 61.2 -76.0 -21.6 13.5 -5.3 -3.9 69 101 A D G <4 S+ 0 0 68 -3,-0.8 -1,-0.2 2,-0.0 -2,-0.2 0.668 87.6 97.2 -74.3 -19.9 12.3 -4.1 -0.4 70 102 A L << - 0 0 28 -4,-0.6 2,-0.1 -3,-0.5 4,-0.0 -0.481 57.1-167.2 -73.6 140.6 15.2 -6.2 1.1 71 103 A V - 0 0 45 -2,-0.2 3,-0.3 2,-0.0 30,-0.1 -0.194 43.3 -61.8-109.3-155.4 18.4 -4.5 2.0 72 104 A N S S+ 0 0 106 1,-0.2 2,-0.5 -2,-0.1 -2,-0.1 0.837 118.2 30.1 -64.8 -43.1 21.9 -5.9 3.0 73 105 A Y + 0 0 126 25,-0.1 27,-2.0 1,-0.0 28,-0.3 -0.829 61.9 148.1-131.2 93.1 21.3 -7.9 6.1 74 106 A N > + 0 0 6 -2,-0.5 4,-1.8 -3,-0.3 5,-0.3 -0.580 8.0 167.7-128.6 67.8 17.9 -9.5 6.5 75 107 A P T 4 S+ 0 0 26 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.851 84.7 19.1 -55.3 -41.8 18.4 -12.8 8.5 76 108 A I T >4 S+ 0 0 44 2,-0.1 3,-1.3 14,-0.1 -2,-0.1 0.898 122.5 54.3 -91.5 -49.2 14.6 -13.3 9.1 77 109 A T G >4 S+ 0 0 0 1,-0.3 3,-1.9 2,-0.2 7,-0.1 0.801 99.5 59.8 -64.0 -35.9 12.8 -11.1 6.5 78 110 A E G >< S+ 0 0 78 -4,-1.8 3,-0.5 1,-0.3 -1,-0.3 0.757 101.2 58.6 -63.8 -20.6 14.6 -12.6 3.4 79 111 A K G < S+ 0 0 131 -3,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.360 108.1 45.6 -87.7 4.5 13.1 -15.9 4.4 80 112 A H G <> + 0 0 71 -3,-1.9 4,-2.2 2,-0.1 3,-0.3 0.149 65.8 117.0-138.9 22.1 9.5 -14.6 4.3 81 113 A V T <4 S+ 0 0 25 -3,-0.5 -16,-0.5 1,-0.2 -2,-0.1 0.851 81.6 51.1 -58.3 -38.3 9.1 -12.5 1.0 82 114 A D T 4 S+ 0 0 168 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.818 122.7 26.6 -69.2 -35.0 6.5 -15.0 -0.3 83 115 A T T 4 S- 0 0 78 -3,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.556 96.5-136.5-112.1 -12.1 4.3 -15.0 2.8 84 116 A G < - 0 0 1 -4,-2.2 2,-0.3 -19,-0.1 -20,-0.2 -0.105 17.8-106.2 74.5 178.7 4.8 -11.6 4.5 85 117 A M E -F 63 0C 4 -22,-2.0 -22,-2.7 -4,-0.1 -1,-0.0 -0.995 19.9-115.0-144.3 142.4 5.2 -11.1 8.3 86 118 A T E > -F 62 0C 17 -2,-0.3 4,-2.1 -24,-0.3 -24,-0.2 -0.318 33.1-113.5 -67.0 158.5 3.0 -9.7 11.1 87 119 A L H > S+ 0 0 0 -26,-1.3 4,-2.5 -28,-0.5 5,-0.2 0.896 119.7 58.3 -61.2 -38.7 4.2 -6.5 12.8 88 120 A K H > S+ 0 0 94 -29,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.896 108.2 44.6 -54.7 -44.9 4.7 -8.6 16.0 89 121 A E H > S+ 0 0 86 -30,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.811 111.4 53.2 -72.2 -34.3 7.2 -10.9 14.0 90 122 A L H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.878 109.0 49.2 -65.1 -39.6 8.9 -7.9 12.5 91 123 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.934 111.3 50.3 -65.8 -43.6 9.4 -6.3 15.9 92 124 A D H X S+ 0 0 36 -4,-2.0 4,-2.4 -5,-0.2 5,-0.4 0.923 114.0 43.7 -57.1 -49.6 10.8 -9.6 17.2 93 125 A A H X>S+ 0 0 1 -4,-2.2 4,-1.7 2,-0.2 6,-1.5 0.913 114.3 50.7 -64.4 -45.0 13.2 -9.9 14.2 94 126 A S H X5S+ 0 0 0 -4,-2.9 4,-0.9 4,-0.2 -2,-0.2 0.964 118.2 36.7 -58.7 -52.3 14.3 -6.3 14.5 95 127 A L H <5S+ 0 0 1 -4,-2.9 108,-0.2 -5,-0.2 -2,-0.2 0.894 125.7 33.5 -69.3 -41.9 15.0 -6.4 18.2 96 128 A R H <5S+ 0 0 34 -4,-2.4 87,-2.0 -5,-0.3 88,-0.3 0.735 134.8 22.1 -97.1 -23.7 16.6 -9.9 18.6 97 129 A Y H <5S- 0 0 81 -4,-1.7 -3,-0.2 -5,-0.4 -2,-0.2 0.416 96.1-125.4-115.2 -7.2 18.4 -10.4 15.4 98 130 A S << - 0 0 13 -4,-0.9 2,-0.4 -5,-0.6 -4,-0.2 0.885 37.1-171.9 63.4 37.7 18.8 -6.7 14.3 99 131 A D > - 0 0 0 -6,-1.5 4,-2.0 1,-0.1 -1,-0.2 -0.536 13.7-154.1 -65.6 119.3 17.1 -7.5 11.0 100 132 A N H > S+ 0 0 7 -27,-2.0 4,-2.4 -2,-0.4 34,-0.4 0.848 91.2 48.3 -72.3 -39.4 17.4 -4.3 8.8 101 133 A T H > S+ 0 0 1 -28,-0.3 4,-2.7 2,-0.2 5,-0.2 0.885 109.5 54.7 -65.3 -40.5 14.4 -4.8 6.6 102 134 A A H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.947 110.0 46.9 -54.7 -51.8 12.3 -5.5 9.7 103 135 A Q H X S+ 0 0 1 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.937 112.2 50.1 -54.1 -50.3 13.4 -2.2 11.1 104 136 A N H X S+ 0 0 12 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.868 110.5 49.0 -62.0 -39.1 12.7 -0.4 7.8 105 137 A L H X S+ 0 0 12 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.855 112.8 48.0 -65.7 -39.8 9.2 -1.8 7.5 106 138 A I H X S+ 0 0 0 -4,-2.2 4,-1.3 -5,-0.2 -2,-0.2 0.904 109.7 52.5 -65.3 -43.1 8.5 -0.8 11.1 107 139 A L H <>S+ 0 0 1 -4,-2.8 5,-2.8 1,-0.2 4,-0.5 0.893 107.5 51.7 -63.4 -40.2 9.8 2.7 10.5 108 140 A K H ><5S+ 0 0 110 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.899 105.1 57.3 -58.2 -43.8 7.5 3.1 7.5 109 141 A Q H 3<5S+ 0 0 56 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.791 107.9 46.8 -58.8 -32.6 4.6 2.1 9.7 110 142 A I T 3<5S- 0 0 6 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.488 129.8 -92.6 -91.8 0.9 5.3 4.9 12.1 111 143 A G T < 5 - 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