==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-APR-05 1ZG7 . COMPND 2 MOLECULE: PROCARBOXYPEPTIDASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR M.ADLER,J.BRYANT,B.BUCKMAN,I.ISLAM,B.LARSEN,S.FINSTER, . 914 3 9 9 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34645.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 623 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 82 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 57 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 282 30.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.0 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 3 0 1 2 0 6 0 1 2 0 3 0 1 2 0 3 2 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 0 4 5 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 PARALLEL BRIDGES PER LADDER . 2 0 6 0 0 3 0 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 . 0 0 0 0 0 0 3 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 5 A T 0 0 119 0, 0.0 2,-0.2 0, 0.0 8,-0.0 0.000 360.0 360.0 360.0 -9.2 7.9 9.4 61.4 2 6 A G - 0 0 70 1,-0.1 2,-0.2 7,-0.0 11,-0.1 -0.502 360.0-116.0 -68.5 131.5 6.9 10.5 57.9 3 7 A H + 0 0 57 -2,-0.2 2,-0.3 10,-0.1 -1,-0.1 -0.422 36.3 174.4 -71.9 139.2 9.9 10.5 55.5 4 8 A S > - 0 0 42 3,-0.2 3,-0.6 -2,-0.2 5,-0.1 -0.994 30.9-148.2-143.1 143.8 11.2 13.8 53.9 5 9 A Y T 3 S+ 0 0 39 -2,-0.3 72,-0.1 1,-0.2 -1,-0.1 0.635 102.4 52.5 -86.1 -13.1 14.2 14.4 51.7 6 10 A E T 3 S+ 0 0 99 277,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.091 106.7 63.0-107.0 18.5 14.6 17.9 53.1 7 11 A K S < S- 0 0 119 -3,-0.6 2,-0.5 276,-0.1 -3,-0.2 -0.942 89.9-104.7-139.7 154.7 14.6 16.8 56.8 8 12 A Y - 0 0 20 -2,-0.3 2,-0.4 -5,-0.1 -3,-0.1 -0.774 41.7-149.6 -81.1 126.5 16.8 14.6 58.9 9 13 A N - 0 0 9 -2,-0.5 -6,-0.1 60,-0.2 -7,-0.0 -0.843 6.4-127.4-102.7 136.3 15.0 11.3 59.4 10 14 A N > - 0 0 45 -2,-0.4 4,-2.5 1,-0.1 3,-0.3 -0.230 36.6 -97.3 -73.9 168.0 15.2 9.0 62.4 11 15 A W H > S+ 0 0 12 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.892 121.8 56.4 -55.9 -42.3 16.1 5.3 62.0 12 16 A E H > S+ 0 0 126 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.911 112.9 43.6 -54.7 -41.6 12.5 4.0 62.1 13 17 A T H > S+ 0 0 5 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.915 113.0 50.1 -70.2 -46.1 11.7 6.3 59.2 14 18 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.908 112.1 48.8 -61.4 -41.1 14.8 5.5 57.3 15 19 A E H X S+ 0 0 62 -4,-3.0 4,-1.6 2,-0.2 -1,-0.2 0.925 112.5 47.0 -64.0 -45.7 14.1 1.7 57.6 16 20 A A H X S+ 0 0 58 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.874 112.1 53.0 -63.6 -34.5 10.5 2.2 56.5 17 21 A W H X S+ 0 0 12 -4,-2.5 4,-3.3 2,-0.2 5,-0.4 0.937 103.3 54.4 -66.6 -46.7 11.9 4.3 53.6 18 22 A T H X S+ 0 0 0 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.884 112.7 46.1 -55.7 -36.9 14.3 1.6 52.5 19 23 A K H X S+ 0 0 127 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.910 117.0 42.0 -72.4 -42.3 11.3 -0.8 52.3 20 24 A Q H X S+ 0 0 106 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.932 112.5 50.8 -73.3 -48.7 9.0 1.6 50.5 21 25 A V H X S+ 0 0 5 -4,-3.3 4,-1.1 1,-0.2 -1,-0.2 0.911 113.2 48.4 -59.6 -35.9 11.5 3.0 48.0 22 26 A T H < S+ 0 0 25 -4,-1.3 3,-0.4 -5,-0.4 7,-0.2 0.907 111.1 50.8 -70.2 -36.6 12.4 -0.6 47.1 23 27 A S H < S+ 0 0 67 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.884 110.8 49.0 -68.1 -35.4 8.7 -1.4 46.7 24 28 A E H < S+ 0 0 122 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.688 120.1 34.6 -80.2 -14.6 8.2 1.5 44.5 25 29 A N >X + 0 0 26 -4,-1.1 4,-2.6 -3,-0.4 3,-2.0 -0.349 61.4 153.8-137.2 59.5 11.1 0.8 42.2 26 30 A P T 34 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.730 77.6 56.0 -60.1 -23.2 11.6 -3.0 41.8 27 31 A D T 34 S+ 0 0 82 1,-0.1 3,-0.1 -3,-0.1 -5,-0.0 0.561 120.9 27.3 -85.1 -9.5 13.2 -2.6 38.4 28 32 A L T <4 S+ 0 0 6 -3,-2.0 21,-2.7 1,-0.2 2,-0.4 0.537 120.0 45.1-126.8 -20.5 15.9 -0.2 39.8 29 33 A I E < -A 48 0A 5 -4,-2.6 2,-0.4 -7,-0.2 -1,-0.2 -0.986 47.5-179.8-137.1 141.9 16.3 -1.2 43.4 30 34 A S E -A 47 0A 61 17,-1.0 17,-2.9 -2,-0.4 2,-0.4 -0.993 21.2-143.1-134.8 135.6 16.7 -4.3 45.5 31 35 A R E +A 46 0A 65 -2,-0.4 2,-0.3 15,-0.2 15,-0.2 -0.829 24.2 164.1-104.0 148.1 17.1 -4.3 49.3 32 36 A T E -A 45 0A 78 13,-2.1 13,-2.8 -2,-0.4 2,-0.5 -0.933 32.1-126.6-152.1 162.7 19.3 -6.5 51.3 33 37 A A E -A 44 0A 55 -2,-0.3 11,-0.2 11,-0.3 3,-0.1 -0.978 13.9-170.7-116.4 130.9 20.7 -6.7 54.8 34 38 A I E - 0 0 31 9,-2.9 2,-0.3 -2,-0.5 10,-0.1 0.502 64.9 -37.4-100.0 -2.4 24.5 -7.2 55.1 35 39 A G E - 0 0 25 8,-0.4 8,-2.3 140,-0.0 2,-0.3 -0.985 61.6 -91.7 171.5-168.9 24.6 -7.8 58.9 36 40 A T E -A 42 0A 44 -2,-0.3 6,-0.2 6,-0.2 138,-0.1 -0.895 34.2-122.2-133.5 147.6 23.2 -6.8 62.2 37 41 A T > - 0 0 1 4,-2.1 3,-1.6 -2,-0.3 71,-0.1 -0.333 38.1 -92.8 -82.0 178.1 24.5 -4.1 64.6 38 42 A F T 3 S+ 0 0 85 1,-0.3 -1,-0.1 2,-0.1 90,-0.0 0.893 128.9 43.9 -58.7 -39.1 25.5 -4.6 68.2 39 43 A L T 3 S- 0 0 105 88,-0.0 -1,-0.3 2,-0.0 88,-0.0 0.287 124.9 -98.7 -93.3 11.9 22.0 -3.7 69.3 40 44 A G S < S+ 0 0 46 -3,-1.6 2,-0.2 1,-0.3 -2,-0.1 0.616 70.8 144.7 88.5 12.5 20.2 -5.8 66.6 41 45 A N - 0 0 39 1,-0.1 -4,-2.1 2,-0.0 2,-0.6 -0.532 53.3-110.2 -82.7 149.6 19.3 -3.3 64.0 42 46 A N E -A 36 0A 59 -6,-0.2 2,-1.4 -2,-0.2 -6,-0.2 -0.743 17.9-140.2 -86.7 122.7 19.4 -4.5 60.3 43 47 A I E - 0 0 0 -8,-2.3 -9,-2.9 -2,-0.6 -8,-0.4 -0.611 28.7-157.6 -81.5 91.2 22.2 -3.0 58.2 44 48 A Y E -A 33 0A 17 -2,-1.4 2,-0.4 -11,-0.2 62,-0.4 -0.344 12.3-167.1 -72.9 151.3 20.4 -2.4 54.9 45 49 A L E -A 32 0A 2 -13,-2.8 -13,-2.1 59,-0.2 2,-0.5 -0.997 8.0-151.7-139.6 128.2 22.0 -2.1 51.6 46 50 A L E -AB 31 103A 0 57,-2.9 57,-3.0 -2,-0.4 2,-0.8 -0.905 4.2-151.9-104.7 129.6 20.3 -0.9 48.4 47 51 A K E -AB 30 102A 72 -17,-2.9 -17,-1.0 -2,-0.5 2,-0.6 -0.895 18.6-166.8-102.4 102.9 21.4 -2.1 45.1 48 52 A V E +AB 29 101A 0 53,-3.4 53,-3.2 -2,-0.8 2,-0.2 -0.842 39.1 72.2 -98.6 116.2 20.6 0.7 42.6 49 53 A G S S- 0 0 3 -21,-2.7 48,-0.2 -2,-0.6 51,-0.1 -0.853 85.4 -70.7 159.4 163.7 20.7 -0.1 38.9 50 54 A K - 0 0 48 46,-2.6 -22,-0.1 49,-0.3 -23,-0.1 -0.725 62.4-113.1 -77.7 121.5 19.0 -1.9 36.0 51 55 A P + 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -22,-0.0 -0.165 54.8 140.6 -57.2 145.7 19.7 -5.6 36.6 52 56 A G > - 0 0 45 3,-0.0 3,-0.6 -3,-0.0 2,-0.2 -0.967 53.4 -64.2-172.7 169.1 21.9 -7.4 34.2 53 57 A P T 3 S- 0 0 110 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.441 102.7 -20.0 -74.5 134.2 24.7 -10.0 34.0 54 58 A N T 3 S+ 0 0 163 -2,-0.2 0, 0.0 1,-0.1 0, 0.0 0.761 79.6 176.5 42.8 51.5 28.0 -9.3 35.6 55 59 A K < - 0 0 23 -3,-0.6 44,-0.2 1,-0.1 -1,-0.1 -0.489 29.7-118.2 -83.0 148.4 27.8 -5.5 35.9 56 60 A P - 0 0 23 0, 0.0 44,-2.0 0, 0.0 2,-0.3 -0.295 35.3-147.5 -74.4 175.5 30.6 -3.5 37.6 57 61 A A E -cd 100 186A 1 128,-2.8 130,-3.0 42,-0.2 131,-0.8 -0.958 18.8-145.2-146.9 158.7 29.7 -1.5 40.8 58 62 A I E -cd 101 188A 1 42,-2.2 44,-3.0 -2,-0.3 2,-0.5 -0.984 23.2-146.4-120.7 131.7 30.4 1.6 42.8 59 63 A F E +cd 102 189A 0 129,-2.8 131,-3.1 -2,-0.4 2,-0.4 -0.929 20.2 175.0-104.7 127.5 30.1 1.2 46.6 60 64 A M E -cd 103 190A 3 42,-3.2 44,-2.7 -2,-0.5 2,-0.3 -0.987 4.0-176.3-135.1 121.2 28.8 4.2 48.6 61 65 A D E -cd 104 191A 0 129,-2.1 131,-2.7 -2,-0.4 2,-0.3 -0.844 2.6-171.4-114.9 156.0 28.1 4.3 52.3 62 66 A a + 0 0 0 42,-2.5 45,-1.5 -2,-0.3 46,-0.2 -0.839 59.8 42.1-133.8 168.6 26.7 6.9 54.6 63 67 A G + 0 0 0 129,-0.3 45,-2.4 5,-0.3 49,-0.2 0.785 54.1 141.8 64.8 34.6 26.3 7.3 58.4 64 68 A F S S+ 0 0 0 128,-0.6 2,-0.5 1,-0.2 47,-0.1 0.925 75.9 44.9 -64.9 -47.9 29.7 5.8 59.6 65 69 A H S > S- 0 0 4 1,-0.1 3,-1.4 3,-0.1 -1,-0.2 -0.904 83.5-140.8-105.0 122.4 29.7 8.5 62.3 66 70 A A T 3 S+ 0 0 0 57,-1.4 57,-0.2 -2,-0.5 -1,-0.1 0.803 95.9 50.4 -48.1 -44.7 26.4 9.1 64.2 67 71 A R T 3 S+ 0 0 34 55,-1.3 2,-2.0 1,-0.2 -1,-0.2 0.612 83.7 91.9 -75.9 -12.2 26.5 12.9 64.5 68 72 A E X> + 0 0 5 -3,-1.4 3,-1.8 1,-0.2 4,-0.8 -0.357 49.4 164.7 -84.6 61.0 27.1 13.5 60.8 69 73 A W H 3> + 0 0 28 -2,-2.0 4,-2.0 207,-0.4 -1,-0.2 0.760 66.2 63.5 -49.6 -36.1 23.5 13.8 59.9 70 74 A I H 3> S+ 0 0 1 206,-0.3 4,-2.0 1,-0.2 -1,-0.3 0.839 98.0 59.7 -62.7 -28.7 24.0 15.4 56.4 71 75 A S H <> S+ 0 0 1 -3,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.949 105.6 45.2 -61.7 -51.4 25.8 12.2 55.4 72 76 A H H X S+ 0 0 0 -4,-0.8 4,-1.5 1,-0.2 3,-0.2 0.927 111.7 54.7 -60.1 -43.0 22.7 10.0 56.1 73 77 A A H X S+ 0 0 7 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.863 103.4 55.7 -60.8 -39.9 20.6 12.6 54.3 74 78 A F H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.891 101.8 53.7 -63.2 -45.4 22.8 12.4 51.2 75 79 A a H X S+ 0 0 0 -4,-1.6 4,-1.9 30,-0.2 -1,-0.2 0.921 112.1 46.9 -53.9 -42.3 22.4 8.6 50.6 76 80 A Q H X S+ 0 0 4 -4,-1.5 4,-1.9 2,-0.2 5,-0.2 0.944 112.3 49.5 -65.3 -46.3 18.6 9.0 50.7 77 81 A W H X S+ 0 0 14 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.924 108.3 54.7 -57.9 -45.9 18.8 12.0 48.3 78 82 A F H X S+ 0 0 1 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.905 106.3 51.1 -56.6 -47.0 21.0 10.1 45.9 79 83 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 5,-0.3 0.917 111.4 45.2 -62.2 -43.3 18.6 7.2 45.7 80 84 A R H X S+ 0 0 77 -4,-1.9 4,-3.0 1,-0.2 5,-0.3 0.947 112.3 53.4 -64.7 -43.7 15.5 9.3 44.8 81 85 A E H X S+ 0 0 42 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.933 108.3 51.3 -52.7 -49.4 17.6 11.3 42.3 82 86 A A H X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.950 116.1 37.2 -55.5 -55.8 18.6 8.0 40.7 83 87 A V H < S+ 0 0 24 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.839 115.6 54.2 -71.3 -30.1 15.1 6.6 40.2 84 88 A L H < S+ 0 0 115 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.833 116.5 35.4 -74.1 -31.7 13.5 9.9 39.4 85 89 A T H >X S+ 0 0 30 -4,-2.1 4,-2.5 -5,-0.3 3,-2.2 0.559 82.6 117.4-100.4 -9.0 15.9 10.8 36.6 86 90 A Y T 3< S+ 0 0 54 -4,-1.2 4,-0.1 1,-0.3 7,-0.1 -0.418 85.7 19.7 -62.4 125.5 16.5 7.4 35.0 87 91 A G T 34 S+ 0 0 49 2,-0.4 -1,-0.3 -2,-0.2 3,-0.1 0.103 126.2 55.9 100.7 -18.5 15.2 7.6 31.5 88 92 A Y T <4 S+ 0 0 203 -3,-2.2 2,-0.6 1,-0.3 -2,-0.2 0.743 96.9 53.8-113.9 -40.0 15.3 11.4 31.3 89 93 A E S X S- 0 0 56 -4,-2.5 4,-2.1 1,-0.1 -2,-0.4 -0.921 75.1-145.6-102.4 123.5 18.8 12.5 32.2 90 94 A S H > S+ 0 0 84 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.884 92.7 49.8 -56.9 -46.8 21.4 10.8 29.9 91 95 A H H > S+ 0 0 97 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.947 114.7 42.5 -60.7 -50.4 24.2 10.4 32.3 92 96 A M H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.845 113.6 54.0 -65.7 -33.1 22.2 8.9 35.1 93 97 A T H X S+ 0 0 28 -4,-2.1 4,-1.7 -8,-0.2 -2,-0.2 0.960 111.3 45.0 -64.0 -49.2 20.4 6.7 32.6 94 98 A E H X S+ 0 0 96 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.882 111.1 53.5 -63.6 -39.7 23.7 5.4 31.3 95 99 A F H X S+ 0 0 3 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.945 111.3 45.0 -59.4 -53.4 25.2 4.9 34.8 96 100 A L H < S+ 0 0 0 -4,-2.2 -46,-2.6 1,-0.2 -1,-0.2 0.770 114.6 49.4 -62.3 -31.6 22.2 2.7 36.0 97 101 A N H < S+ 0 0 53 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.896 120.3 34.6 -72.9 -45.3 22.3 0.7 32.7 98 102 A K H < S+ 0 0 99 -4,-2.5 2,-0.3 -5,-0.2 -2,-0.2 0.773 124.5 15.9 -82.8 -31.8 26.0 0.0 32.9 99 103 A L < - 0 0 2 -4,-3.0 2,-0.4 -5,-0.2 -49,-0.3 -0.903 66.3-118.6-140.4 169.2 26.7 -0.4 36.6 100 104 A D E - c 0 57A 11 -44,-2.0 -42,-2.2 -2,-0.3 2,-0.6 -0.880 18.2-142.5-109.9 143.5 25.1 -0.9 40.0 101 105 A F E -Bc 48 58A 3 -53,-3.2 -53,-3.4 -2,-0.4 2,-0.8 -0.936 8.5-154.9-104.6 116.8 25.3 1.5 42.9 102 106 A Y E -Bc 47 59A 20 -44,-3.0 -42,-3.2 -2,-0.6 2,-0.6 -0.884 18.0-170.6 -92.9 106.5 25.6 -0.2 46.3 103 107 A V E -Bc 46 60A 1 -57,-3.0 -57,-2.9 -2,-0.8 -42,-0.2 -0.913 14.9-168.5-105.6 115.9 24.1 2.4 48.7 104 108 A L E - c 0 61A 0 -44,-2.7 -42,-2.5 -2,-0.6 3,-0.2 -0.887 7.4-167.4-103.6 100.3 24.5 1.7 52.4 105 109 A P S S+ 0 0 1 0, 0.0 2,-0.3 0, 0.0 -30,-0.2 0.865 71.8 5.2 -54.0 -50.6 22.2 4.4 53.9 106 110 A V + 0 0 1 -62,-0.4 3,-0.3 1,-0.1 -43,-0.3 -0.919 56.6 175.3-144.4 117.2 23.3 4.1 57.5 107 111 A L S S+ 0 0 0 -45,-1.5 2,-1.8 -2,-0.3 3,-0.2 0.952 82.6 47.7 -81.9 -58.2 26.2 2.0 58.8 108 112 A N > + 0 0 0 -45,-2.4 4,-1.9 1,-0.2 -1,-0.2 -0.563 67.5 158.9 -86.0 72.7 26.4 3.0 62.4 109 113 A I H > S+ 0 0 0 -2,-1.8 4,-2.5 -3,-0.3 5,-0.2 0.944 70.0 52.8 -62.9 -48.5 22.6 2.6 63.1 110 114 A D H > S+ 0 0 4 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.891 111.5 46.0 -54.8 -48.6 23.0 2.2 66.9 111 115 A G H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.893 110.5 54.3 -63.2 -37.0 25.1 5.4 67.2 112 116 A Y H X S+ 0 0 2 -4,-1.9 4,-0.9 2,-0.2 3,-0.3 0.929 107.1 49.7 -64.2 -44.1 22.6 7.3 64.9 113 117 A I H >X S+ 0 0 55 -4,-2.5 4,-1.8 1,-0.2 3,-1.2 0.937 107.7 56.1 -58.8 -43.8 19.7 6.3 67.2 114 118 A Y H 3X>S+ 0 0 26 -4,-2.0 4,-2.7 1,-0.3 5,-2.6 0.820 102.6 53.8 -58.6 -35.2 21.7 7.5 70.2 115 119 A T H 3<5S+ 0 0 7 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.719 111.0 48.6 -71.5 -21.1 22.1 11.0 68.6 116 120 A W H <<5S+ 0 0 97 -3,-1.2 -2,-0.2 -4,-0.9 -1,-0.2 0.799 124.9 26.3 -86.4 -29.2 18.3 11.1 68.2 117 121 A T H <5S- 0 0 93 -4,-1.8 -2,-0.2 -5,-0.1 -3,-0.2 0.817 135.8 -2.3-106.8 -36.7 17.6 10.1 71.8 118 122 A K T <5S+ 0 0 76 -4,-2.7 2,-0.3 -5,-0.2 -3,-0.2 0.737 122.5 25.7-126.7 -41.0 20.4 11.0 74.2 119 123 A N > < - 0 0 31 -5,-2.6 3,-2.1 1,-0.1 -1,-0.1 -0.819 46.4-169.3-141.6 101.4 23.5 12.6 72.7 120 124 A R T 3 S+ 0 0 54 -2,-0.3 -5,-0.1 1,-0.3 -1,-0.1 0.688 92.0 54.4 -56.3 -25.5 23.4 14.6 69.4 121 125 A M T 3 S+ 0 0 79 -53,-0.1 -1,-0.3 -55,-0.0 -54,-0.1 0.241 75.7 131.3 -97.8 13.2 27.2 14.7 69.3 122 126 A W < + 0 0 9 -3,-2.1 -55,-1.3 1,-0.1 -7,-0.1 -0.342 23.8 169.5 -66.4 147.1 27.8 10.9 69.6 123 127 A R + 0 0 29 -57,-0.2 -57,-1.4 2,-0.1 -1,-0.1 0.641 47.9 67.6-124.3 -48.8 30.2 9.6 67.0 124 128 A K S S- 0 0 1 -59,-0.2 -58,-0.3 1,-0.1 14,-0.2 0.166 86.3 -88.5 -72.1-174.2 31.1 6.0 67.8 125 129 A T - 0 0 0 12,-2.1 -1,-0.1 -14,-0.1 -2,-0.1 -0.149 37.0-118.3 -80.7-173.4 29.2 2.8 67.8 126 130 A R + 0 0 40 10,-0.1 2,-0.1 9,-0.1 -1,-0.0 0.105 62.0 132.8-120.8 27.9 27.3 1.7 70.9 127 131 A S - 0 0 6 10,-0.1 9,-3.3 8,-0.1 2,-0.1 -0.390 57.3-112.0 -78.8 154.6 29.0 -1.6 71.9 128 132 A T B -H 135 0B 93 7,-0.2 2,-0.4 -2,-0.1 7,-0.1 -0.451 26.1-143.4 -81.0 156.3 30.2 -2.3 75.4 129 133 A N > - 0 0 20 5,-0.5 3,-1.0 3,-0.5 5,-0.1 -0.991 22.3-107.3-125.2 134.0 33.9 -2.6 76.2 130 134 A A T 3 S+ 0 0 105 -2,-0.4 4,-0.1 1,-0.2 3,-0.1 -0.197 98.3 13.4 -59.6 143.8 35.4 -5.0 78.6 131 135 A G T 3 S+ 0 0 89 1,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.762 117.9 64.6 63.3 29.1 36.7 -3.6 81.9 132 136 A T S < S- 0 0 45 -3,-1.0 -3,-0.5 2,-0.1 -1,-0.1 -0.962 71.7-130.8-171.5 157.9 35.0 -0.2 81.6 133 137 A T S S+ 0 0 53 206,-0.4 2,-0.1 -2,-0.3 207,-0.1 0.550 74.6 114.3 -85.9 -19.2 31.6 1.7 81.5 134 138 A b - 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