==== 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 09-JUL-01 1JJT . COMPND 2 MOLECULE: IMP-1 METALLO BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR P.M.D.FITZGERALD,N.SHARMA . 440 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20713.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 302 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 17.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 21 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 23.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.8 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 1 0 0 2 0 2 2 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 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 PARALLEL BRIDGES PER LADDER . 2 1 4 1 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 3 A S 0 0 180 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.8 46.1 9.5 28.9 2 4 A L - 0 0 68 1,-0.2 19,-0.0 18,-0.1 18,-0.0 -0.646 360.0 -72.8-111.2 165.4 46.4 12.7 30.9 3 5 A P - 0 0 68 0, 0.0 17,-0.3 0, 0.0 -1,-0.2 -0.233 60.7-100.1 -61.8 153.7 43.8 14.7 32.8 4 6 A D - 0 0 119 1,-0.1 2,-0.1 15,-0.1 14,-0.0 -0.317 39.2 -89.9 -72.9 154.5 41.4 16.7 30.6 5 7 A L - 0 0 26 14,-0.1 2,-0.4 -2,-0.1 14,-0.2 -0.402 42.3-147.6 -56.3 131.4 41.5 20.4 29.8 6 8 A K E -A 18 0A 84 12,-2.6 12,-2.6 -2,-0.1 2,-0.4 -0.902 14.2-172.6-111.1 140.1 39.6 22.5 32.3 7 9 A I E +A 17 0A 38 -2,-0.4 2,-0.4 10,-0.2 10,-0.2 -0.951 17.3 165.0-129.1 109.5 37.7 25.8 31.5 8 10 A E E -A 16 0A 92 8,-2.4 8,-2.8 -2,-0.4 2,-0.2 -0.967 38.0-111.4-136.2 147.4 36.3 27.8 34.4 9 11 A K E +A 15 0A 127 -2,-0.4 6,-0.3 6,-0.3 3,-0.1 -0.473 28.9 173.8 -71.6 136.5 35.0 31.3 35.0 10 12 A L E - 0 0 44 4,-3.6 2,-0.3 1,-0.6 5,-0.2 0.712 69.4 -23.7-110.3 -30.6 37.2 33.5 37.1 11 13 A D E > S-A 14 0A 31 3,-1.5 3,-2.2 0, 0.0 -1,-0.6 -0.898 98.2 -47.8-168.7 172.3 35.4 36.8 36.8 12 14 A E T 3 S+ 0 0 131 1,-0.3 3,-0.1 -2,-0.3 137,-0.0 -0.415 129.6 0.4 -61.9 125.6 32.9 38.4 34.3 13 15 A G T 3 S+ 0 0 13 -2,-0.2 24,-3.1 1,-0.1 2,-0.5 0.432 115.1 100.6 75.8 -1.0 34.5 37.9 30.8 14 16 A V E < +AB 11 36A 6 -3,-2.2 -4,-3.6 22,-0.2 -3,-1.5 -0.965 44.5 177.6-127.8 126.3 37.5 36.0 32.2 15 17 A Y E -AB 9 35A 45 20,-2.3 20,-2.5 -2,-0.5 2,-0.5 -0.936 22.1-138.9-121.1 145.2 38.1 32.3 32.2 16 18 A V E -AB 8 34A 11 -8,-2.8 -8,-2.4 -2,-0.3 2,-0.5 -0.896 16.7-159.3 -96.4 128.1 41.1 30.2 33.4 17 19 A H E -AB 7 33A 2 16,-2.9 16,-2.2 -2,-0.5 2,-0.5 -0.938 6.1-164.1-106.2 138.4 42.0 27.3 31.1 18 20 A T E +AB 6 32A 1 -12,-2.6 -12,-2.6 -2,-0.5 2,-0.2 -0.984 10.2 175.6-123.6 121.1 44.1 24.5 32.7 19 21 A S E - B 0 31A 0 12,-1.8 12,-1.9 -2,-0.5 2,-0.4 -0.742 17.4-139.7-117.4 167.6 46.0 21.9 30.6 20 22 A F E + B 0 30A 32 -17,-0.3 2,-0.3 -2,-0.2 -18,-0.1 -0.997 17.5 177.5-138.6 136.4 48.3 19.1 31.8 21 23 A E E - B 0 29A 48 8,-1.7 8,-3.5 -2,-0.4 2,-0.8 -0.983 29.3-132.3-137.7 142.9 51.6 17.6 30.5 22 24 A E E + B 0 28A 114 -2,-0.3 2,-0.4 6,-0.3 6,-0.2 -0.845 43.9 169.5 -89.6 100.0 54.0 15.0 31.7 23 25 A V > - 0 0 61 4,-1.7 3,-1.7 -2,-0.8 4,-0.2 -0.956 40.7 -48.9-129.5 143.0 57.4 16.7 31.4 24 26 A N T 3 S- 0 0 103 -2,-0.4 3,-0.4 1,-0.2 0, 0.0 -0.011 106.5 -30.9 37.9-132.5 60.9 15.9 32.6 25 27 A G T 3 S+ 0 0 66 1,-0.2 -1,-0.2 -3,-0.0 3,-0.1 0.136 121.5 84.1-100.6 11.9 61.4 14.8 36.2 26 28 A W S < S- 0 0 137 -3,-1.7 -1,-0.2 1,-0.4 -2,-0.2 0.246 85.4-141.6-100.2 5.7 58.5 17.0 37.4 27 29 A G - 0 0 31 -3,-0.4 -4,-1.7 -4,-0.2 -1,-0.4 -0.286 63.7 -5.9 64.2-156.3 55.8 14.4 36.7 28 30 A V E S-B 22 0A 70 -6,-0.2 -6,-0.3 -3,-0.1 -8,-0.0 -0.565 73.0-156.2 -76.8 130.9 52.5 15.9 35.4 29 31 A V E -B 21 0A 24 -8,-3.5 -8,-1.7 -2,-0.3 2,-0.2 -0.948 7.4-142.4-112.4 118.3 52.4 19.7 35.4 30 32 A P E -B 20 0A 42 0, 0.0 2,-0.4 0, 0.0 -10,-0.2 -0.628 18.8-164.4 -74.9 144.9 49.3 21.8 35.4 31 33 A K E -B 19 0A 2 -12,-1.9 -12,-1.8 -2,-0.2 2,-0.4 -0.986 1.3-158.6-134.1 120.3 49.5 24.9 33.3 32 34 A H E +B 18 0A 2 162,-2.5 2,-0.3 -2,-0.4 -14,-0.2 -0.789 19.6 156.1-103.3 141.2 47.1 27.9 33.6 33 35 A G E -B 17 0A 0 -16,-2.2 -16,-2.9 -2,-0.4 2,-0.3 -0.860 32.1-111.7-141.9 179.9 46.3 30.5 30.9 34 36 A L E -BC 16 45A 1 11,-2.2 11,-3.1 -2,-0.3 2,-0.4 -0.777 6.8-152.7-117.2 159.9 43.3 32.8 30.3 35 37 A V E -BC 15 44A 1 -20,-2.5 -20,-2.3 -2,-0.3 2,-0.6 -0.976 21.0-161.9-124.9 118.5 40.5 33.4 27.9 36 38 A V E -BC 14 43A 8 7,-2.8 7,-2.9 -2,-0.4 2,-0.3 -0.902 8.9-142.3-108.0 122.3 39.4 37.0 27.8 37 39 A L E - C 0 42A 27 -24,-3.1 2,-0.4 -2,-0.6 5,-0.3 -0.683 14.7-174.2 -81.9 131.3 36.0 37.9 26.4 38 40 A V E > - C 0 41A 7 3,-4.0 3,-2.9 -2,-0.3 2,-0.6 -0.866 61.0 -73.9-127.9 85.5 35.7 41.1 24.3 39 41 A N T 3 S- 0 0 139 -2,-0.4 -1,-0.1 1,-0.3 -26,-0.0 -0.398 121.1 -7.0 54.5-107.1 32.0 41.5 23.5 40 42 A A T 3 S+ 0 0 66 -2,-0.6 27,-1.0 -3,-0.1 -1,-0.3 0.513 127.3 85.9 -93.3 -0.1 31.6 38.9 20.8 41 43 A E E < -Cd 38 67A 46 -3,-2.9 -3,-4.0 25,-0.2 2,-0.4 -0.694 58.6-157.2-104.8 153.2 35.3 38.2 20.7 42 44 A A E -Cd 37 68A 0 25,-1.5 27,-1.5 -5,-0.3 28,-1.0 -0.997 5.8-163.2-127.8 128.6 37.6 35.9 22.7 43 45 A Y E -Cd 36 70A 23 -7,-2.9 -7,-2.8 -2,-0.4 2,-0.5 -0.945 15.2-134.9-113.3 135.7 41.4 36.3 23.2 44 46 A L E -Cd 35 71A 1 26,-2.7 28,-2.4 -2,-0.4 2,-0.7 -0.770 6.2-157.5 -87.1 128.6 43.7 33.5 24.4 45 47 A I E S-Cd 34 72A 0 -11,-3.1 -11,-2.2 -2,-0.5 28,-0.2 -0.922 76.7 -18.9 -99.3 102.4 46.3 34.4 27.1 46 48 A D S S- 0 0 0 26,-2.8 -1,-0.2 -2,-0.7 35,-0.2 0.417 81.3-109.2 69.1 150.7 48.8 31.6 26.5 47 49 A T - 0 0 0 33,-1.6 35,-0.3 1,-0.2 37,-0.1 -0.752 33.5 -99.6 -97.9 154.1 48.0 28.4 24.6 48 50 A P - 0 0 0 0, 0.0 35,-0.4 0, 0.0 34,-0.2 -0.027 47.2 -93.1 -53.2 173.4 47.6 25.0 26.2 49 51 A F S S+ 0 0 27 33,-0.1 2,-0.3 -18,-0.1 31,-0.1 0.815 100.9 42.6 -61.7 -31.1 50.6 22.6 25.9 50 52 A T S > S- 0 0 40 1,-0.1 4,-2.3 29,-0.1 5,-0.2 -0.809 72.8-123.6-134.2 160.7 49.2 21.0 22.8 51 53 A A H > S+ 0 0 47 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.943 112.4 54.0 -57.9 -47.5 47.5 21.4 19.4 52 54 A K H > S+ 0 0 75 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.844 112.6 40.2 -61.5 -41.7 44.7 19.0 20.5 53 55 A D H > S+ 0 0 25 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.820 112.5 56.9 -76.1 -30.9 43.8 20.9 23.7 54 56 A T H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.899 108.8 47.2 -62.1 -42.9 44.2 24.2 21.9 55 57 A E H X S+ 0 0 21 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.885 111.1 51.5 -66.5 -35.7 41.6 23.0 19.4 56 58 A K H X S+ 0 0 91 -4,-1.4 4,-1.4 -5,-0.2 -2,-0.2 0.930 109.1 50.8 -67.6 -40.4 39.4 21.9 22.2 57 59 A L H X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 5,-0.2 0.898 112.8 44.7 -59.2 -47.7 39.7 25.3 23.9 58 60 A V H >X S+ 0 0 9 -4,-2.2 4,-3.7 1,-0.2 3,-0.6 0.945 109.8 55.2 -66.0 -42.0 38.7 27.1 20.7 59 61 A T H 3X S+ 0 0 65 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.811 104.7 54.9 -61.1 -29.9 35.9 24.8 19.9 60 62 A W H 3< S+ 0 0 80 -4,-1.4 -1,-0.2 2,-0.2 -2,-0.2 0.817 116.6 35.4 -74.7 -33.8 34.3 25.4 23.3 61 63 A F H X<>S+ 0 0 2 -4,-1.2 5,-2.6 -3,-0.6 3,-1.0 0.845 116.8 52.5 -89.3 -40.2 34.2 29.1 22.8 62 64 A V H ><5S+ 0 0 69 -4,-3.7 3,-2.9 1,-0.2 -2,-0.2 0.963 105.5 55.7 -55.2 -50.2 33.4 29.1 19.1 63 65 A E T 3<5S+ 0 0 124 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.604 104.0 55.1 -65.5 -9.7 30.5 26.7 19.6 64 66 A R T < 5S- 0 0 127 -3,-1.0 -1,-0.3 2,-0.2 -2,-0.2 0.220 131.7 -92.7-101.7 11.6 29.0 29.3 22.1 65 67 A G T < 5S+ 0 0 62 -3,-2.9 2,-0.7 1,-0.2 -3,-0.2 0.514 86.1 131.5 95.8 0.7 29.2 32.0 19.4 66 68 A Y < - 0 0 74 -5,-2.6 2,-0.4 -8,-0.1 -1,-0.2 -0.814 43.7-153.8 -96.8 111.4 32.6 33.3 20.4 67 69 A K E -d 41 0A 168 -27,-1.0 -25,-1.5 -2,-0.7 2,-0.9 -0.647 23.9-118.7 -78.6 132.0 35.0 33.8 17.4 68 70 A I E -d 42 0A 15 -2,-0.4 -25,-0.2 1,-0.2 3,-0.1 -0.623 32.0-179.0 -75.7 105.2 38.7 33.6 18.4 69 71 A K E - 0 0 98 -27,-1.5 2,-0.3 -2,-0.9 -1,-0.2 0.744 56.3 -44.3 -75.3 -25.5 40.1 37.0 17.5 70 72 A G E -d 43 0A 0 -28,-1.0 -26,-2.7 22,-0.1 2,-0.3 -0.967 44.2-123.9 171.8 167.8 43.6 36.2 18.6 71 73 A S E -de 44 94A 0 22,-1.3 24,-2.3 -2,-0.3 2,-0.4 -0.976 10.1-160.0-136.9 150.6 46.2 34.8 21.1 72 74 A I E -de 45 95A 0 -28,-2.4 -26,-2.8 -2,-0.3 2,-0.5 -0.998 10.5-149.5-129.6 134.9 49.2 36.2 22.9 73 75 A S - 0 0 1 22,-2.3 24,-0.4 -2,-0.4 8,-0.1 -0.910 5.3-151.0-107.9 132.7 52.0 34.0 24.4 74 76 A S S S- 0 0 2 -2,-0.5 68,-1.7 22,-0.1 2,-0.3 0.605 76.0 -6.3 -79.2 -13.5 53.9 35.2 27.5 75 77 A H S S- 0 0 1 2,-0.2 5,-0.1 66,-0.2 -1,-0.1 -0.972 75.7 -98.2-170.9 172.6 57.2 33.5 26.8 76 78 A F S S+ 0 0 16 -2,-0.3 5,-0.2 4,-0.1 -1,-0.0 0.732 79.6 110.6 -82.3 -17.3 58.7 31.1 24.3 77 79 A H S >> S- 0 0 29 1,-0.1 3,-2.1 3,-0.1 4,-1.3 -0.155 80.4-112.5 -55.8 148.5 58.5 27.8 26.3 78 80 A S H 3> S+ 0 0 54 1,-0.3 4,-1.9 2,-0.2 -1,-0.1 0.650 111.3 71.1 -59.7 -19.4 55.9 25.3 24.9 79 81 A D H 34 S+ 0 0 19 1,-0.2 -1,-0.3 2,-0.2 -60,-0.1 0.636 113.7 30.6 -73.7 -7.6 53.6 25.6 27.9 80 82 A S H <4 S+ 0 0 0 -3,-2.1 -33,-1.6 -34,-0.1 -2,-0.2 0.632 133.7 29.1-115.1 -20.8 52.8 29.1 26.5 81 83 A T H >< S+ 0 0 14 -4,-1.3 3,-1.9 -5,-0.2 4,-0.4 0.337 78.2 110.2-119.7 6.4 53.3 28.5 22.7 82 84 A G T 3< S+ 0 0 26 -4,-1.9 4,-0.3 -35,-0.3 -31,-0.2 0.743 84.4 47.4 -60.4 -17.8 52.5 24.9 22.0 83 85 A G T 3> S+ 0 0 0 -35,-0.4 4,-2.6 1,-0.1 -1,-0.3 0.379 81.1 94.3-104.3 8.2 49.3 25.8 20.2 84 86 A I H <> S+ 0 0 2 -3,-1.9 4,-3.2 2,-0.2 5,-0.3 0.941 83.8 53.9 -65.6 -45.6 50.6 28.6 17.9 85 87 A E H > S+ 0 0 131 -4,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.932 112.2 44.1 -51.8 -52.6 51.2 26.2 14.9 86 88 A W H > S+ 0 0 28 -4,-0.3 4,-0.5 1,-0.2 3,-0.3 0.957 113.0 51.6 -59.6 -52.7 47.6 24.9 15.1 87 89 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.0 1,-0.2 3,-1.6 0.900 108.6 50.8 -50.0 -45.5 46.2 28.4 15.5 88 90 A N H ><5S+ 0 0 40 -4,-3.2 3,-1.4 1,-0.3 -1,-0.2 0.878 104.7 57.9 -65.2 -32.2 48.1 29.7 12.5 89 91 A S H 3<5S+ 0 0 69 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.604 107.7 47.3 -74.5 -7.5 46.8 26.8 10.4 90 92 A R T <<5S- 0 0 119 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.189 117.9-111.7-110.9 10.6 43.2 28.0 11.2 91 93 A S T < 5 + 0 0 113 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.800 66.8 145.8 60.2 41.8 44.0 31.6 10.4 92 94 A I < - 0 0 21 -5,-2.0 -1,-0.2 -6,-0.1 21,-0.2 -0.937 55.2-113.8-101.9 117.7 43.6 32.9 13.9 93 95 A P - 0 0 49 0, 0.0 -22,-1.3 0, 0.0 2,-0.3 -0.233 32.9-159.9 -50.9 135.3 46.1 35.8 14.5 94 96 A T E -e 71 0A 0 -24,-0.2 20,-2.3 17,-0.1 2,-0.3 -0.943 3.8-158.9-120.8 146.2 48.9 34.9 17.1 95 97 A Y E +ef 72 114A 48 -24,-2.3 -22,-2.3 -2,-0.3 2,-0.3 -0.948 21.9 144.4-128.7 143.8 51.0 37.4 19.0 96 98 A A E - f 0 115A 0 18,-1.6 20,-1.0 -2,-0.3 2,-0.1 -0.953 50.0 -84.7-160.3 167.6 54.4 37.4 20.8 97 99 A S E > - f 0 116A 16 -24,-0.4 4,-3.0 -2,-0.3 5,-0.3 -0.495 39.5-111.0 -80.4 160.7 57.2 39.9 21.4 98 100 A E H > S+ 0 0 97 18,-2.0 4,-2.2 1,-0.2 5,-0.2 0.917 122.5 49.8 -53.0 -44.1 60.0 40.2 18.8 99 101 A L H > S+ 0 0 78 17,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.939 109.3 50.5 -61.7 -46.0 62.4 38.6 21.3 100 102 A T H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.894 111.1 49.3 -58.7 -42.0 60.0 35.7 22.0 101 103 A N H X S+ 0 0 10 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.872 109.3 53.1 -63.5 -34.5 59.7 35.2 18.2 102 104 A E H X S+ 0 0 99 -4,-2.2 4,-2.8 -5,-0.3 -2,-0.2 0.929 109.5 47.7 -67.1 -41.9 63.5 35.2 18.0 103 105 A L H X S+ 0 0 34 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.924 111.6 50.2 -66.8 -39.8 63.8 32.6 20.7 104 106 A L H <>S+ 0 0 3 -4,-2.4 5,-2.9 -5,-0.2 -2,-0.2 0.955 112.8 46.8 -59.0 -48.0 61.2 30.4 19.0 105 107 A K H ><5S+ 0 0 110 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.939 109.4 52.6 -60.4 -48.0 62.9 30.7 15.6 106 108 A K H 3<5S+ 0 0 181 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.845 109.1 53.2 -53.2 -35.2 66.3 29.9 17.2 107 109 A D T 3<5S- 0 0 87 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.292 118.9-108.9 -85.6 5.8 64.7 26.8 18.7 108 110 A G T < 5S+ 0 0 72 -3,-2.0 -3,-0.2 1,-0.2 2,-0.2 0.699 75.8 134.2 72.7 19.9 63.3 25.5 15.4 109 111 A K < - 0 0 105 -5,-2.9 -1,-0.2 -6,-0.2 2,-0.2 -0.628 64.2 -91.1-106.3 160.6 59.7 26.3 16.4 110 112 A V - 0 0 62 -2,-0.2 2,-0.1 -3,-0.1 -25,-0.1 -0.437 45.5-132.3 -67.1 133.0 56.8 28.0 14.6 111 113 A Q - 0 0 70 -2,-0.2 2,-0.1 1,-0.1 -10,-0.1 -0.469 21.9 -97.5 -85.7 157.4 56.7 31.8 15.2 112 114 A A - 0 0 6 -15,-0.1 -17,-0.1 -2,-0.1 -1,-0.1 -0.458 29.5-129.3 -66.3 144.6 53.7 34.0 16.1 113 115 A T S S+ 0 0 89 -21,-0.2 2,-0.4 1,-0.1 -18,-0.2 0.732 92.1 47.0 -68.9 -23.4 52.2 35.6 13.1 114 116 A N E -f 95 0A 53 -20,-2.3 -18,-1.6 -17,-0.0 2,-0.3 -0.986 68.4-167.6-129.6 133.7 52.3 39.0 14.8 115 117 A S E -f 96 0A 60 -2,-0.4 2,-0.3 -20,-0.2 -18,-0.2 -0.797 1.8-168.6-115.8 153.5 55.1 40.7 16.7 116 118 A F E -f 97 0A 14 -20,-1.0 -18,-2.0 -2,-0.3 -17,-0.3 -0.958 6.5-153.9-140.6 160.9 55.4 43.7 19.0 117 119 A S + 0 0 84 -2,-0.3 3,-0.2 -20,-0.2 2,-0.0 -0.700 47.8 62.9-119.9 167.6 58.0 46.0 20.7 118 120 A G S S- 0 0 57 -2,-0.2 3,-0.5 1,-0.1 -2,-0.1 0.003 80.9 -93.6 96.4 157.2 58.0 48.1 23.8 119 121 A V S S+ 0 0 67 1,-0.2 13,-1.8 12,-0.1 -1,-0.1 0.588 118.3 38.8 -77.4 -10.4 57.7 47.4 27.5 120 122 A N + 0 0 70 11,-0.2 -1,-0.2 -3,-0.2 11,-0.2 -0.179 69.1 173.6-137.4 46.8 53.9 48.1 27.3 121 123 A Y - 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M 0 253C 0 12,-2.2 12,-3.2 -2,-0.4 2,-0.4 -0.809 15.6-144.0-123.8 164.2 12.7 -5.6 17.1 242 22 B F E + M 0 252C 28 -17,-0.4 2,-0.3 -2,-0.3 -18,-0.1 -0.982 20.9 161.4-133.4 136.6 14.8 -6.2 20.2 243 23 B E E - M 0 251C 61 8,-1.7 8,-2.5 -2,-0.4 2,-0.4 -0.994 40.9-107.6-153.6 146.6 17.8 -8.3 21.1 244 24 B E E - M 0 250C 85 -2,-0.3 2,-0.5 6,-0.2 6,-0.2 -0.605 39.4-168.1 -77.8 130.9 20.5 -8.4 23.8 245 25 B V > - 0 0 44 4,-2.3 3,-3.1 -2,-0.4 4,-0.4 -0.956 37.5 -77.6-131.4 115.5 23.8 -7.3 22.3 246 26 B N T 3 S- 0 0 121 -2,-0.5 3,-0.3 1,-0.3 -1,-0.1 0.002 108.9 -17.2 40.5-118.1 27.3 -7.6 23.9 247 27 B G T 3 S+ 0 0 60 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.254 121.6 80.5 -92.6 1.0 27.6 -4.8 26.4 248 28 B W S < S- 0 0 127 -3,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.330 84.2-142.4 -96.3 12.3 24.8 -2.5 25.3 249 29 B G + 0 0 38 -4,-0.4 -4,-2.3 -3,-0.3 2,-0.5 -0.336 68.1 2.8 62.0-147.4 22.0 -4.5 27.0 250 30 B V E S-M 244 0C 68 -6,-0.2 -6,-0.2 -3,-0.1 -8,-0.0 -0.645 74.9-158.3 -73.7 120.0 18.7 -4.7 25.0 251 31 B V E -M 243 0C 21 -8,-2.5 -8,-1.7 -2,-0.5 2,-0.4 -0.900 5.9-144.7-100.8 122.6 19.2 -2.9 21.7 252 32 B P E -M 242 0C 46 0, 0.0 2,-0.4 0, 0.0 -10,-0.2 -0.767 16.5-162.9 -87.2 133.5 16.1 -1.6 19.9 253 33 B K E -M 241 0C 2 -12,-3.2 -12,-2.2 -2,-0.4 2,-0.3 -0.980 3.5-160.2-123.7 121.2 16.3 -1.9 16.0 254 34 B H E +M 240 0C 9 162,-2.4 2,-0.2 -2,-0.4 -14,-0.2 -0.760 18.9 157.5 -95.6 141.3 14.0 -0.0 13.5 255 35 B G E -M 239 0C 0 -16,-2.5 -16,-2.0 -2,-0.3 2,-0.3 -0.745 30.1-117.9-138.0-171.8 13.5 -1.0 9.9 256 36 B L E -MN 238 267C 0 11,-1.9 11,-3.1 -18,-0.3 2,-0.4 -0.887 5.6-150.0-127.2 162.0 10.7 -0.2 7.4 257 37 B V E -MN 237 266C 0 -20,-2.3 -20,-2.5 -2,-0.3 2,-0.4 -0.985 21.7-161.9-124.9 121.5 8.0 -2.0 5.3 258 38 B V E -MN 236 265C 10 7,-2.6 7,-2.5 -2,-0.4 2,-0.5 -0.891 3.9-150.5-108.8 132.9 7.2 -0.1 2.1 259 39 B L E + N 0 264C 29 -24,-2.6 2,-0.4 -2,-0.4 5,-0.2 -0.876 16.8 175.9-108.0 130.0 4.0 -0.8 0.2 260 40 B V E > S- N 0 263C 12 3,-2.2 3,-2.4 -2,-0.5 2,-0.2 -0.967 70.7 -49.1-130.8 113.0 3.6 -0.3 -3.6 261 41 B N T 3 S- 0 0 149 -2,-0.4 -26,-0.0 1,-0.3 27,-0.0 -0.393 121.7 -26.9 53.3-120.9 0.2 -1.5 -4.8 262 42 B A T 3 S+ 0 0 58 -2,-0.2 27,-2.5 -3,-0.1 2,-0.3 0.144 120.6 96.1-111.4 23.8 -0.3 -4.9 -3.2 263 43 B E E < -No 260 289C 61 -3,-2.4 -3,-2.2 25,-0.2 2,-0.4 -0.803 58.0-153.7-105.9 150.8 3.4 -5.7 -3.0 264 44 B A E -No 259 290C 0 25,-2.8 27,-2.1 -2,-0.3 28,-0.9 -0.987 4.6-162.0-130.7 141.2 5.6 -5.1 0.1 265 45 B Y E -No 258 292C 19 -7,-2.5 -7,-2.6 -2,-0.4 2,-0.5 -0.986 14.2-139.7-121.9 128.3 9.3 -4.5 0.5 266 46 B L E -No 257 293C 0 26,-2.3 28,-2.3 -2,-0.4 2,-0.8 -0.725 4.3-155.3 -86.8 126.0 11.3 -4.9 3.8 267 47 B I E S-No 256 294C 0 -11,-3.1 -11,-1.9 -2,-0.5 28,-0.2 -0.912 76.9 -17.9 -99.9 104.2 13.9 -2.3 4.6 268 48 B D S S- 0 0 0 26,-2.9 -1,-0.2 -2,-0.8 35,-0.2 0.455 81.8-108.2 69.5 146.4 16.3 -4.3 6.8 269 49 B T - 0 0 0 33,-1.6 35,-0.3 1,-0.1 37,-0.1 -0.726 35.2 -99.4 -91.1 156.6 15.2 -7.6 8.5 270 50 B P - 0 0 0 0, 0.0 35,-0.4 0, 0.0 -1,-0.1 -0.027 46.5 -94.8 -56.8 172.5 14.5 -8.0 12.3 271 51 B F S S+ 0 0 12 33,-0.1 2,-0.2 -18,-0.1 31,-0.1 0.814 101.5 41.5 -65.0 -35.6 17.3 -9.5 14.4 272 52 B T S > S- 0 0 44 1,-0.1 4,-1.9 29,-0.1 5,-0.1 -0.727 76.7-120.8-120.6 162.7 15.9 -13.0 14.2 273 53 B A H > S+ 0 0 42 -2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.853 113.8 56.5 -61.2 -42.1 14.3 -15.6 11.9 274 54 B K H > S+ 0 0 152 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.913 109.1 42.2 -59.1 -50.3 11.3 -15.7 14.2 275 55 B D H > S+ 0 0 28 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.861 111.6 56.4 -73.9 -31.4 10.6 -12.0 14.1 276 56 B T H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.880 108.4 47.4 -63.1 -41.9 11.2 -11.8 10.4 277 57 B E H X S+ 0 0 56 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.931 110.6 52.0 -67.3 -39.6 8.5 -14.5 9.9 278 58 B K H X S+ 0 0 101 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.892 110.8 48.8 -61.2 -36.7 6.1 -12.7 12.2 279 59 B L H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.971 113.3 45.0 -68.4 -52.9 6.6 -9.5 10.1 280 60 B V H X S+ 0 0 10 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.907 112.0 53.0 -52.6 -47.5 6.0 -11.2 6.8 281 61 B T H X S+ 0 0 52 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.910 103.1 57.1 -63.8 -39.2 3.0 -13.0 8.0 282 62 B W H < S+ 0 0 80 -4,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.899 113.9 39.1 -59.3 -41.1 1.3 -9.8 9.3 283 63 B F H ><>S+ 0 0 2 -4,-1.5 5,-2.2 2,-0.2 3,-0.7 0.886 115.1 51.7 -77.1 -35.7 1.5 -8.3 5.8 284 64 B V H ><5S+ 0 0 72 -4,-2.5 3,-2.3 1,-0.3 -2,-0.2 0.921 104.5 56.1 -66.9 -41.3 0.6 -11.4 3.9 285 65 B E T 3<5S+ 0 0 148 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.722 106.0 54.0 -62.9 -18.7 -2.4 -12.1 6.0 286 66 B R T < 5S- 0 0 131 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.2 0.225 129.9 -94.4-100.3 11.6 -3.6 -8.6 5.0 287 67 B G T < 5S+ 0 0 58 -3,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.485 80.0 130.8 97.2 3.8 -3.2 -9.4 1.3 288 68 B Y < - 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