==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-OCT-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-SEP-13 4MUQ . COMPND 2 MOLECULE: D,D-DIPEPTIDASE/D,D-CARBOXYPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR P.J.STOGIOS,E.EVDOKIMOVA,D.MEZIANE-CHERIF,R.DI LEO,V.YIM,P.C . 251 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12995.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 169 67.3 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 . 47 18.7 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 23 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 52 20.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 1 0 0 1 2 1 0 0 0 0 1 1 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 0 3 2 0 1 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 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 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 0 A G 0 0 107 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-173.3 26.8 -9.7 50.5 2 1 A M - 0 0 140 228,-0.1 229,-2.7 1,-0.0 230,-0.4 -0.442 360.0-151.1 -64.5 125.6 26.7 -13.1 48.8 3 2 A M E -A 230 0A 86 227,-0.2 2,-0.4 -2,-0.2 -1,-0.0 -0.754 8.8-151.8 -94.0 146.3 28.3 -13.1 45.4 4 3 A K E -A 229 0A 66 225,-4.2 225,-3.2 -2,-0.3 2,-0.4 -0.930 9.1-128.2-121.4 150.1 27.1 -15.6 42.8 5 4 A T E -A 228 0A 99 -2,-0.4 2,-0.5 223,-0.2 223,-0.2 -0.796 13.4-160.5-100.2 132.4 28.9 -17.1 39.9 6 5 A I E -A 227 0A 29 221,-4.0 221,-2.7 -2,-0.4 2,-0.6 -0.954 6.8-158.8-110.8 126.1 27.7 -17.0 36.3 7 6 A E E -A 226 0A 116 -2,-0.5 2,-0.4 219,-0.2 219,-0.2 -0.921 12.8-172.1-109.8 118.6 29.2 -19.6 33.9 8 7 A L E -A 225 0A 7 217,-2.8 217,-2.8 -2,-0.6 2,-0.2 -0.902 20.3-132.6-117.8 138.1 28.9 -18.8 30.2 9 8 A E E > -A 224 0A 54 -2,-0.4 3,-1.9 215,-0.2 4,-0.2 -0.536 32.5-113.2 -77.8 152.1 29.7 -20.9 27.1 10 9 A K G > S+ 0 0 77 213,-1.1 3,-2.1 1,-0.3 4,-0.2 0.841 113.5 65.6 -57.0 -34.0 31.7 -19.0 24.5 11 10 A E G > S+ 0 0 122 1,-0.3 3,-1.7 2,-0.2 -1,-0.3 0.706 83.2 76.6 -65.6 -15.7 28.8 -19.1 22.0 12 11 A E G X S+ 0 0 80 -3,-1.9 3,-1.6 1,-0.3 227,-0.4 0.648 74.5 78.3 -70.5 -11.1 26.9 -16.8 24.4 13 12 A I G < S+ 0 0 0 -3,-2.1 228,-2.4 1,-0.3 -1,-0.3 0.682 87.4 61.3 -65.3 -13.1 29.1 -13.9 23.1 14 13 A Y G < S+ 0 0 53 -3,-1.7 15,-0.4 -4,-0.2 2,-0.3 0.264 97.3 70.7-101.1 13.4 26.8 -14.0 20.1 15 14 A C < + 0 0 56 -3,-1.6 224,-2.9 13,-0.1 226,-0.2 -0.938 68.0 58.5-125.0 149.1 23.6 -13.2 22.1 16 15 A G S > S- 0 0 32 -2,-0.3 3,-1.1 222,-0.2 222,-0.2 -0.495 83.4 -67.3 128.0 171.8 22.4 -10.0 23.9 17 16 A N T 3 S+ 0 0 46 1,-0.2 -1,-0.1 220,-0.2 221,-0.1 0.674 120.5 54.1 -67.8 -21.2 21.4 -6.4 23.7 18 17 A L T 3 S+ 0 0 7 221,-0.4 -1,-0.2 -3,-0.2 2,-0.1 0.169 70.2 143.8-107.1 19.6 24.9 -5.2 22.9 19 18 A L < - 0 0 8 -3,-1.1 2,-0.8 1,-0.1 222,-0.2 -0.356 44.5-141.7 -57.7 129.7 25.8 -7.2 19.9 20 19 A L + 0 0 5 220,-2.0 2,-0.5 -2,-0.1 -1,-0.1 -0.853 26.1 179.7 -91.4 109.5 27.9 -5.4 17.4 21 20 A V + 0 0 0 -2,-0.8 2,-0.2 3,-0.0 86,-0.2 -0.960 23.4 118.2-116.1 115.6 26.6 -6.5 14.0 22 21 A N S S- 0 0 11 3,-1.6 3,-0.2 -2,-0.5 139,-0.1 -0.858 79.3 -63.1-157.1-169.0 28.2 -5.0 10.9 23 22 A K S S+ 0 0 148 137,-0.4 138,-0.1 -2,-0.2 83,-0.0 0.874 133.6 43.8 -58.5 -36.3 30.3 -5.9 7.8 24 23 A N S S+ 0 0 113 1,-0.2 -1,-0.2 81,-0.1 -3,-0.0 0.803 118.6 42.2 -75.0 -32.2 33.1 -7.2 10.0 25 24 A Y S S- 0 0 84 -3,-0.2 -3,-1.6 80,-0.1 -1,-0.2 -0.873 76.2-160.3-129.8 98.4 31.0 -9.1 12.6 26 25 A P - 0 0 22 0, 0.0 2,-0.4 0, 0.0 79,-0.2 -0.206 31.2 -96.0 -76.3 163.1 28.1 -11.2 11.3 27 26 A L + 0 0 15 77,-2.9 3,-0.1 1,-0.1 -13,-0.0 -0.648 40.3 178.9 -68.5 130.9 25.1 -12.4 13.2 28 27 A R + 0 0 152 -2,-0.4 2,-0.6 -14,-0.3 -1,-0.1 0.636 65.8 54.8-113.2 -21.9 25.9 -16.0 14.3 29 28 A D + 0 0 64 -15,-0.4 -1,-0.2 1,-0.1 3,-0.1 -0.958 54.4 176.2-113.7 114.3 22.8 -16.9 16.2 30 29 A N + 0 0 125 -2,-0.6 2,-2.8 1,-0.2 -1,-0.1 0.576 51.8 106.7 -86.3 -11.6 19.6 -16.5 14.1 31 30 A N + 0 0 90 2,-0.0 2,-0.2 0, 0.0 -1,-0.2 -0.209 44.6 165.0 -76.5 52.4 17.4 -18.0 16.8 32 31 A V + 0 0 29 -2,-2.8 2,-0.3 77,-0.2 3,-0.2 -0.489 10.6 174.5 -62.7 131.1 15.8 -14.7 17.9 33 32 A K + 0 0 140 -2,-0.2 16,-0.1 1,-0.1 3,-0.1 -0.853 47.7 60.3-133.3 177.4 12.8 -15.3 20.1 34 33 A G + 0 0 29 -2,-0.3 15,-2.4 1,-0.3 2,-0.3 0.741 68.2 161.5 74.9 24.1 10.3 -13.3 22.1 35 34 A L E +B 48 0B 47 13,-0.2 -1,-0.3 -3,-0.2 13,-0.2 -0.612 8.5 168.1 -77.7 134.6 9.3 -11.4 18.9 36 35 A V E -B 47 0B 28 11,-2.8 11,-2.5 -2,-0.3 2,-0.1 -0.956 44.7 -83.5-139.9 158.6 6.0 -9.7 19.1 37 36 A P E -B 46 0B 68 0, 0.0 9,-0.3 0, 0.0 3,-0.1 -0.452 34.7-139.1 -61.5 137.1 4.2 -7.1 17.0 38 37 A A E S+ 0 0 6 7,-2.9 2,-0.3 4,-0.4 8,-0.1 0.834 80.8 3.6 -67.4 -32.6 5.4 -3.6 17.9 39 38 A D E > -B 42 0B 19 3,-0.6 3,-1.8 6,-0.4 6,-0.2 -0.988 65.3-121.9-156.3 142.9 1.9 -2.1 17.7 40 39 A I T 3 S+ 0 0 158 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.1 0.764 115.5 58.3 -50.7 -32.0 -1.7 -3.3 17.2 41 40 A R T 3 S+ 0 0 124 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.649 113.3 37.6 -78.7 -14.7 -1.7 -0.8 14.2 42 41 A F E X +B 39 0B 57 -3,-1.8 3,-1.8 3,-0.1 -3,-0.6 -0.570 66.1 167.2-136.7 70.4 1.2 -2.6 12.6 43 42 A P E 3 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.700 74.5 56.7 -63.0 -20.7 0.8 -6.4 13.2 44 43 A N E 3 S+ 0 0 152 1,-0.1 2,-0.8 -7,-0.1 29,-0.2 0.443 86.5 85.1 -96.1 0.9 3.5 -7.3 10.6 45 44 A I E < - 0 0 23 -3,-1.8 -7,-2.9 -6,-0.2 -6,-0.4 -0.877 66.2-170.3-102.2 105.5 6.3 -5.3 12.1 46 45 A L E +B 37 0B 57 -2,-0.8 28,-3.3 28,-0.4 2,-0.3 -0.645 12.2 170.0 -98.4 151.6 7.8 -7.5 14.9 47 46 A M E -B 36 0B 1 -11,-2.5 -11,-2.8 -2,-0.2 65,-0.2 -0.957 48.8 -76.5-144.4 162.8 10.4 -6.5 17.5 48 47 A K E > -B 35 0B 62 63,-2.2 4,-2.6 -2,-0.3 3,-0.4 -0.411 52.4-115.7 -58.2 141.1 11.8 -8.2 20.6 49 48 A R H > S+ 0 0 129 -15,-2.4 4,-2.2 1,-0.3 5,-0.1 0.871 112.8 46.3 -51.9 -50.1 9.1 -7.9 23.3 50 49 A D H > S+ 0 0 114 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.867 113.3 51.2 -66.0 -32.2 11.1 -5.7 25.7 51 50 A V H > S+ 0 0 2 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.897 107.5 51.7 -69.5 -42.7 12.1 -3.4 22.8 52 51 A A H X S+ 0 0 3 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.910 109.3 52.3 -58.3 -40.7 8.5 -3.0 21.6 53 52 A N H X S+ 0 0 92 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.917 108.8 48.5 -64.0 -40.8 7.6 -2.0 25.1 54 53 A V H X S+ 0 0 18 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.907 107.8 55.1 -65.4 -40.7 10.3 0.6 25.2 55 54 A L H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.930 107.0 50.8 -58.6 -45.1 9.2 2.0 21.9 56 55 A Q H X S+ 0 0 47 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.897 107.3 54.0 -59.5 -40.9 5.7 2.4 23.3 57 56 A L H X S+ 0 0 82 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.902 110.1 46.6 -59.7 -41.6 7.1 4.3 26.3 58 57 A I H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.934 111.3 50.5 -67.4 -45.0 8.9 6.8 24.0 59 58 A F H X>S+ 0 0 23 -4,-2.5 5,-2.1 1,-0.2 4,-0.5 0.891 113.0 48.2 -58.5 -40.3 5.8 7.3 21.8 60 59 A E H ><5S+ 0 0 126 -4,-2.5 3,-0.9 -5,-0.2 -1,-0.2 0.927 109.8 52.3 -61.8 -46.5 3.8 7.9 25.0 61 60 A K H 3<5S+ 0 0 124 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.867 117.4 35.8 -63.3 -39.1 6.4 10.3 26.3 62 61 A I H 3<5S- 0 0 13 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.368 105.4-123.3 -96.7 3.2 6.5 12.5 23.2 63 62 A S T <<5 + 0 0 101 -3,-0.9 -3,-0.2 -4,-0.5 3,-0.1 0.927 46.6 167.0 53.1 51.8 2.8 12.2 22.4 64 63 A A > < + 0 0 5 -5,-2.1 3,-2.6 1,-0.2 2,-0.3 0.789 8.5 175.7 -67.0 -29.5 3.6 10.9 18.9 65 64 A G T 3 S- 0 0 52 -6,-0.4 -1,-0.2 1,-0.3 3,-0.1 -0.433 71.7 -32.6 58.7-119.6 -0.0 9.7 18.3 66 65 A N T 3 S+ 0 0 97 -2,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.183 115.0 101.1-112.0 13.0 -0.0 8.4 14.8 67 66 A S S < S+ 0 0 41 -3,-2.6 52,-2.7 1,-0.1 2,-0.5 0.741 79.3 52.0 -75.1 -22.4 2.6 10.9 13.5 68 67 A I E S-C 118 0C 9 50,-0.2 50,-0.2 -4,-0.2 -1,-0.1 -0.958 70.6-169.6-115.6 130.5 5.4 8.3 13.6 69 68 A V E -C 117 0C 9 48,-2.8 48,-2.2 -2,-0.5 2,-0.4 -0.928 25.8-119.8-118.5 143.3 5.0 4.9 11.9 70 69 A P E +C 116 0C 8 0, 0.0 46,-0.2 0, 0.0 3,-0.1 -0.672 29.8 178.7 -75.6 131.5 7.2 1.8 12.2 71 70 A V E + 0 0 23 44,-3.1 2,-0.3 -2,-0.4 45,-0.2 0.757 65.5 1.9-103.8 -39.6 8.4 1.0 8.7 72 71 A S E +C 115 0C 5 43,-1.3 43,-2.8 -27,-0.1 -1,-0.3 -0.937 62.1 155.4-155.6 129.0 10.6 -2.1 9.3 73 72 A G + 0 0 2 1,-0.5 -26,-0.2 -2,-0.3 38,-0.2 0.260 63.6 14.4-116.5-117.7 11.4 -4.0 12.4 74 73 A Y - 0 0 59 -28,-3.3 -1,-0.5 37,-0.2 2,-0.4 -0.431 66.6-171.3 -60.6 134.6 12.6 -7.6 12.6 75 74 A R - 0 0 18 33,-1.8 36,-0.1 -2,-0.1 2,-0.1 -0.999 14.3-136.9-128.1 136.4 13.6 -9.0 9.2 76 75 A S > - 0 0 34 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.309 33.3-100.1 -76.3 170.7 14.4 -12.6 8.5 77 76 A L H > S+ 0 0 79 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.910 123.5 51.9 -60.8 -43.5 17.4 -13.7 6.4 78 77 A E H > S+ 0 0 138 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.907 110.2 48.9 -61.5 -39.6 15.2 -14.3 3.3 79 78 A E H > S+ 0 0 61 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.922 111.6 48.1 -66.8 -42.5 13.8 -10.8 3.6 80 79 A Q H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.902 112.1 50.5 -63.9 -38.1 17.2 -9.1 4.0 81 80 A T H X S+ 0 0 47 -4,-2.4 4,-3.0 -5,-0.2 5,-0.3 0.927 110.4 49.1 -63.8 -45.3 18.4 -11.1 1.0 82 81 A A H X S+ 0 0 58 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.897 111.7 49.0 -61.7 -40.4 15.4 -10.0 -1.1 83 82 A I H X S+ 0 0 24 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.948 113.6 46.3 -65.5 -45.7 16.0 -6.3 -0.1 84 83 A Y H X S+ 0 0 34 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.954 116.9 42.5 -61.5 -52.0 19.7 -6.5 -0.9 85 84 A D H X S+ 0 0 89 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.877 113.7 52.5 -65.7 -36.1 19.2 -8.2 -4.3 86 85 A G H X S+ 0 0 28 -4,-2.5 4,-2.7 -5,-0.3 5,-0.2 0.888 109.0 50.3 -65.2 -37.2 16.2 -6.0 -5.1 87 86 A S H X>S+ 0 0 2 -4,-2.3 4,-2.7 2,-0.2 5,-1.3 0.851 103.5 58.9 -71.1 -34.1 18.3 -2.9 -4.4 88 87 A L H X5S+ 0 0 65 -4,-2.0 4,-0.7 3,-0.2 -1,-0.2 0.939 113.7 39.6 -55.2 -45.2 21.1 -4.2 -6.6 89 88 A K H <5S+ 0 0 180 -4,-1.6 -2,-0.2 2,-0.1 -1,-0.2 0.914 126.3 32.6 -71.6 -45.5 18.6 -4.3 -9.5 90 89 A D H <5S+ 0 0 124 -4,-2.7 -3,-0.2 -5,-0.1 -2,-0.2 0.903 135.1 19.1 -79.2 -41.5 16.7 -1.0 -8.7 91 90 A N H <5S- 0 0 60 -4,-2.7 4,-0.4 -5,-0.2 -3,-0.2 0.580 102.2-119.3-113.6 -17.3 19.4 1.2 -7.2 92 91 A G X< - 0 0 27 -5,-1.3 4,-2.1 -4,-0.7 -1,-0.2 -0.049 33.7 -70.7 90.3 166.8 22.7 -0.3 -8.3 93 92 A E H > S+ 0 0 134 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.880 123.8 51.0 -65.6 -44.5 25.7 -1.7 -6.5 94 93 A D H > S+ 0 0 113 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.942 113.8 44.2 -63.6 -47.7 27.2 1.5 -5.0 95 94 A F H > S+ 0 0 48 -4,-0.4 4,-1.9 1,-0.2 3,-0.3 0.929 113.9 51.1 -59.7 -47.5 23.9 2.6 -3.4 96 95 A T H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.916 107.1 52.2 -60.6 -44.0 23.1 -0.9 -2.1 97 96 A R H < S+ 0 0 131 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.831 115.9 42.7 -60.7 -31.2 26.5 -1.3 -0.5 98 97 A K H < S+ 0 0 98 -4,-1.4 65,-2.6 -3,-0.3 -1,-0.2 0.726 126.2 28.0 -86.6 -25.8 26.0 2.0 1.3 99 98 A Y H < S+ 0 0 67 -4,-1.9 2,-0.4 -3,-0.2 -2,-0.2 0.364 112.1 58.0-122.6 -0.4 22.3 1.7 2.3 100 99 A V S < S- 0 0 6 -4,-2.0 -1,-0.2 -5,-0.2 2,-0.0 -0.963 74.0-132.3-135.2 122.6 21.6 -2.1 2.7 101 100 A A - 0 0 18 -2,-0.4 5,-0.2 1,-0.1 -17,-0.1 -0.370 34.3-100.6 -65.7 146.5 23.5 -4.4 5.1 102 101 A L > - 0 0 66 3,-0.2 3,-2.5 1,-0.1 4,-0.2 -0.354 52.7 -85.0 -56.4 145.8 24.7 -7.7 3.7 103 102 A P T 3 S+ 0 0 35 0, 0.0 -1,-0.1 0, 0.0 -26,-0.1 -0.353 121.8 21.2 -53.4 137.2 22.5 -10.6 4.7 104 103 A N T 3 S+ 0 0 60 2,-0.1 -77,-2.9 -3,-0.1 -82,-0.1 0.488 114.5 75.3 71.8 9.3 23.5 -11.9 8.1 105 104 A H S < S+ 0 0 36 -3,-2.5 2,-0.5 -79,-0.2 -3,-0.2 0.141 70.6 106.8-127.3 14.8 25.1 -8.5 8.8 106 105 A S > - 0 0 4 -5,-0.2 3,-1.5 -4,-0.2 -84,-0.1 -0.836 62.4-146.8 -99.7 131.2 21.9 -6.5 9.4 107 106 A E G > >S+ 0 0 1 -2,-0.5 3,-1.8 1,-0.3 5,-0.8 0.714 97.2 73.8 -59.4 -22.7 20.7 -5.4 12.9 108 107 A H G > 5S+ 0 0 3 1,-0.3 -33,-1.8 2,-0.2 3,-0.9 0.803 85.3 64.1 -64.8 -24.2 17.2 -5.9 11.6 109 108 A Q G < 5S+ 0 0 5 -3,-1.5 -1,-0.3 1,-0.2 -77,-0.2 0.491 97.2 58.7 -75.9 -0.8 17.8 -9.7 11.9 110 109 A T G < 5S- 0 0 7 -3,-1.8 -1,-0.2 -4,-0.1 -2,-0.2 0.590 103.4-123.2 -99.8 -15.5 18.2 -9.3 15.7 111 110 A G T < 5S+ 0 0 0 -3,-0.9 -63,-2.2 -4,-0.4 -37,-0.2 0.537 91.6 97.5 79.8 5.3 14.8 -7.8 16.6 112 111 A L < + 0 0 4 -5,-0.8 59,-2.9 -65,-0.2 2,-0.4 0.442 67.3 75.1-102.6 -5.2 16.7 -4.8 18.1 113 112 A A E - D 0 170C 0 -6,-0.5 2,-0.4 57,-0.2 57,-0.2 -0.882 52.8-178.0-118.1 144.6 16.4 -2.4 15.2 114 113 A I E - D 0 169C 0 55,-2.5 55,-3.0 -2,-0.4 2,-0.5 -1.000 18.9-146.2-139.6 138.9 13.6 -0.3 13.8 115 114 A D E -CD 72 168C 7 -43,-2.8 -44,-3.1 -2,-0.4 -43,-1.3 -0.916 25.4-166.2 -98.7 129.0 13.2 2.0 10.9 116 115 A L E -C 70 0C 0 51,-2.4 2,-0.3 -2,-0.5 -48,-0.0 -0.839 7.1-177.5-116.3 152.1 10.8 4.9 11.6 117 116 A G E -C 69 0C 0 -48,-2.2 -48,-2.8 -2,-0.3 13,-0.2 -0.979 35.2 -91.5-145.6 158.5 9.1 7.4 9.3 118 117 A L E -C 68 0C 47 11,-3.1 2,-1.2 -2,-0.3 -50,-0.2 -0.448 53.4-105.7 -59.4 136.7 6.8 10.3 9.2 119 118 A N + 0 0 85 -52,-2.7 2,-0.3 -2,-0.1 -1,-0.1 -0.594 66.3 138.4 -74.0 99.3 3.2 9.2 8.8 120 119 A K - 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