==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-AUG-02 1H2Z . COMPND 2 MOLECULE: PROLYL ENDOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR D.REA,V.FULOP . 712 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28518.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 476 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 159 22.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 2 0.3 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 . 68 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 0.7 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 1 0 0 0 2 0 2 1 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 2 1 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 2 5 4 3 8 1 1 1 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 . 1 0 6 1 0 0 1 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 1 A M 0 0 165 0, 0.0 666,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-125.3 20.1 53.8 52.7 2 2 A L - 0 0 68 2,-0.1 3,-0.0 1,-0.1 665,-0.0 -0.198 360.0-125.2 -70.9 164.8 22.0 53.9 56.0 3 3 A S S S+ 0 0 90 1,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.609 89.7 28.0 -86.9 -15.8 22.9 57.2 57.6 4 4 A F S S- 0 0 41 49,-0.0 2,-0.4 0, 0.0 -2,-0.1 -0.936 72.9-126.8-141.4 165.2 26.6 56.5 57.8 5 5 A Q - 0 0 158 -2,-0.3 44,-0.0 -3,-0.0 -2,-0.0 -0.932 27.4-117.4-117.4 136.1 29.3 54.4 56.0 6 6 A Y - 0 0 34 -2,-0.4 3,-0.1 1,-0.1 40,-0.1 -0.463 42.2 -97.6 -70.7 144.0 31.6 51.9 57.7 7 7 A P - 0 0 27 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.122 36.1-101.2 -59.9 153.9 35.3 52.8 57.5 8 8 A D - 0 0 156 1,-0.0 2,-0.4 2,-0.0 37,-0.1 -0.640 44.0-175.0 -75.3 129.8 37.7 51.3 55.0 9 9 A V - 0 0 30 -2,-0.4 -3,-0.0 -3,-0.1 -1,-0.0 -0.929 22.1-126.2-135.7 114.1 39.7 48.6 56.7 10 10 A Y - 0 0 163 -2,-0.4 2,-0.6 1,-0.1 -2,-0.0 -0.230 17.1-146.8 -58.9 137.2 42.5 46.7 54.9 11 11 A R - 0 0 50 17,-0.1 2,-1.5 18,-0.0 17,-0.2 -0.933 1.7-151.6-111.0 114.1 42.3 42.9 54.8 12 12 A D > - 0 0 47 15,-2.6 3,-1.5 -2,-0.6 14,-0.2 -0.712 16.4-179.0 -84.4 90.3 45.6 41.1 54.9 13 13 A E T 3 S+ 0 0 111 -2,-1.5 -1,-0.2 1,-0.3 15,-0.0 0.401 74.3 66.5 -71.1 -2.3 44.5 38.0 53.0 14 14 A T T 3 S+ 0 0 113 13,-0.1 2,-1.9 12,-0.1 -1,-0.3 0.537 70.9 104.2 -93.2 -9.7 48.0 36.5 53.3 15 15 A A < + 0 0 22 -3,-1.5 11,-2.6 12,-0.0 2,-0.4 -0.528 46.8 149.0 -76.0 84.4 47.6 36.2 57.1 16 16 A I E -A 25 0A 96 -2,-1.9 2,-0.4 9,-0.2 9,-0.2 -0.980 22.7-174.7-121.1 131.7 47.0 32.4 57.3 17 17 A Q E -A 24 0A 90 7,-2.7 7,-3.4 -2,-0.4 2,-0.6 -0.977 21.0-130.9-127.9 142.1 48.0 30.3 60.2 18 18 A D E -A 23 0A 75 -2,-0.4 2,-0.8 5,-0.2 5,-0.2 -0.818 15.9-169.4 -95.9 119.1 47.8 26.5 60.6 19 19 A Y E > S-A 22 0A 14 3,-3.2 3,-2.4 -2,-0.6 584,-0.0 -0.874 75.4 -45.1-109.2 95.5 46.2 25.2 63.8 20 20 A H T 3 S- 0 0 75 -2,-0.8 -1,-0.1 1,-0.3 3,-0.1 0.812 125.0 -35.5 52.1 38.5 46.9 21.5 63.9 21 21 A G T 3 S+ 0 0 55 1,-0.2 2,-0.7 0, 0.0 -1,-0.3 0.053 117.5 110.6 106.2 -24.1 45.9 21.1 60.2 22 22 A H E < -A 19 0A 86 -3,-2.4 -3,-3.2 2,-0.0 2,-0.4 -0.767 62.6-141.1 -90.9 115.8 43.2 23.7 60.2 23 23 A K E -A 18 0A 129 -2,-0.7 2,-0.5 -5,-0.2 -5,-0.2 -0.611 19.5-168.6 -78.1 125.1 44.1 26.8 58.2 24 24 A V E -A 17 0A 10 -7,-3.4 -7,-2.7 -2,-0.4 2,-0.4 -0.967 9.9-149.3-120.5 125.3 42.8 30.0 59.9 25 25 A C E -A 16 0A 78 -2,-0.5 -9,-0.2 -9,-0.2 -12,-0.1 -0.781 12.3-177.1 -94.0 133.5 42.8 33.4 58.2 26 26 A D > + 0 0 14 -11,-2.6 3,-1.9 -2,-0.4 4,-0.2 -0.618 7.3 171.7-129.6 73.9 43.3 36.5 60.3 27 27 A P T 3 S+ 0 0 13 0, 0.0 -15,-2.6 0, 0.0 3,-0.2 0.630 78.9 47.0 -59.0 -21.1 42.9 39.5 57.9 28 28 A Y T > S+ 0 0 3 -17,-0.2 3,-2.4 1,-0.2 4,-0.2 0.073 70.1 121.7-111.9 28.6 42.9 42.1 60.7 29 29 A A G X + 0 0 18 -3,-1.9 3,-2.2 1,-0.3 4,-0.2 0.826 65.0 71.0 -58.8 -31.2 45.9 40.7 62.5 30 30 A W G > S+ 0 0 63 1,-0.3 3,-1.5 -3,-0.2 -1,-0.3 0.712 80.6 72.8 -60.7 -19.5 47.5 44.1 62.0 31 31 A L G < S+ 0 0 2 -3,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.556 76.8 81.4 -72.0 -7.4 45.1 45.6 64.5 32 32 A E G < S+ 0 0 43 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.658 76.7 78.5 -69.0 -17.7 47.1 43.7 67.2 33 33 A D X - 0 0 81 -3,-1.5 3,-0.9 -4,-0.2 6,-0.3 -0.805 60.8-174.6 -96.2 106.8 49.6 46.6 67.1 34 34 A P T 3 S+ 0 0 44 0, 0.0 -1,-0.2 0, 0.0 167,-0.1 0.703 78.1 58.7 -73.1 -15.7 48.2 49.5 69.1 35 35 A D T 3 S+ 0 0 82 4,-0.1 2,-0.1 5,-0.0 -2,-0.0 0.529 80.5 105.3 -92.1 -8.3 51.0 51.9 68.2 36 36 A S S <> S- 0 0 18 -3,-0.9 4,-2.6 -6,-0.2 5,-0.2 -0.343 74.3-126.6 -77.6 155.4 50.8 51.8 64.4 37 37 A E H > S+ 0 0 130 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.871 112.5 57.0 -63.2 -36.1 49.4 54.6 62.3 38 38 A Q H > S+ 0 0 122 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.919 110.4 41.6 -60.8 -47.4 47.0 52.0 60.7 39 39 A T H > S+ 0 0 4 -6,-0.3 4,-2.6 2,-0.2 5,-0.2 0.944 114.4 50.8 -69.3 -43.4 45.5 51.0 64.0 40 40 A K H X S+ 0 0 95 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.943 111.6 48.8 -58.4 -45.5 45.3 54.6 65.3 41 41 A A H X S+ 0 0 59 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.882 109.4 53.7 -61.0 -39.4 43.5 55.6 62.1 42 42 A F H X S+ 0 0 9 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.962 110.2 45.6 -59.8 -51.3 41.2 52.6 62.5 43 43 A V H X S+ 0 0 23 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.941 113.5 49.9 -58.9 -47.9 40.2 53.7 66.0 44 44 A E H X S+ 0 0 108 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.930 110.8 49.6 -58.0 -43.2 39.7 57.3 65.0 45 45 A A H X S+ 0 0 33 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.879 111.6 47.5 -66.2 -40.2 37.6 56.2 62.0 46 46 A Q H >X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 3,-1.2 0.941 111.8 48.6 -66.9 -47.7 35.3 54.0 64.1 47 47 A N H 3X S+ 0 0 25 -4,-2.6 4,-2.4 1,-0.3 -2,-0.2 0.893 102.1 67.3 -60.7 -31.2 34.7 56.5 66.9 48 48 A K H 3< S+ 0 0 137 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.785 110.8 31.9 -61.1 -31.2 34.0 59.1 64.2 49 49 A I H S+ 0 0 71 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.912 112.2 54.5 -58.1 -36.4 27.3 61.0 66.3 53 53 A F H X S+ 0 0 18 -4,-1.4 4,-0.5 1,-0.2 3,-0.2 0.919 112.4 41.5 -61.4 -46.6 25.1 57.9 66.2 54 54 A L H < S+ 0 0 6 -4,-2.4 -1,-0.2 1,-0.2 6,-0.2 0.837 119.0 45.4 -70.4 -34.1 24.9 57.7 70.0 55 55 A E H < S+ 0 0 111 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.580 90.7 84.6 -89.4 -8.1 24.5 61.5 70.5 56 56 A Q H < S+ 0 0 125 -4,-1.5 -1,-0.1 -3,-0.2 -2,-0.1 0.948 79.3 63.8 -58.2 -59.0 21.9 62.1 67.7 57 57 A C S >< S- 0 0 40 -4,-0.5 3,-1.8 1,-0.1 4,-0.3 -0.579 80.8-136.3 -74.6 128.7 18.7 61.3 69.7 58 58 A P T 3> S+ 0 0 107 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.586 91.7 87.9 -58.2 -10.7 18.1 63.7 72.7 59 59 A I H 3> S+ 0 0 16 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.814 80.5 60.9 -62.0 -27.6 17.2 60.6 74.8 60 60 A R H <> S+ 0 0 19 -3,-1.8 4,-3.1 2,-0.2 -1,-0.2 0.933 104.6 46.9 -64.4 -48.1 20.9 60.3 75.7 61 61 A G H > S+ 0 0 42 -4,-0.3 4,-2.6 -3,-0.3 5,-0.2 0.903 111.7 51.6 -60.1 -38.9 20.9 63.8 77.3 62 62 A L H X S+ 0 0 67 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.938 113.4 44.5 -63.0 -45.1 17.7 62.9 79.1 63 63 A Y H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.918 112.7 51.2 -65.5 -45.2 19.3 59.7 80.4 64 64 A K H X S+ 0 0 71 -4,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.925 111.7 47.4 -59.7 -43.3 22.6 61.4 81.3 65 65 A E H X S+ 0 0 119 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.946 113.2 47.4 -64.0 -46.6 20.8 64.1 83.3 66 66 A R H X S+ 0 0 54 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.873 113.1 49.3 -63.7 -37.4 18.7 61.6 85.2 67 67 A M H X S+ 0 0 3 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.916 109.2 51.9 -68.2 -41.7 21.7 59.5 85.9 68 68 A T H < S+ 0 0 49 -4,-2.6 4,-0.3 -5,-0.2 -2,-0.2 0.859 114.9 44.2 -63.7 -33.3 23.6 62.6 87.2 69 69 A E H >< S+ 0 0 103 -4,-2.0 3,-1.0 -5,-0.2 -2,-0.2 0.982 119.4 37.9 -73.0 -57.8 20.7 63.3 89.5 70 70 A L H 3< S+ 0 0 6 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.757 111.6 56.1 -67.9 -32.1 20.0 59.9 90.8 71 71 A Y T 3< S+ 0 0 52 -4,-2.7 2,-1.9 -5,-0.2 -1,-0.3 0.597 83.8 96.3 -76.1 -11.2 23.6 58.7 91.1 72 72 A D < + 0 0 88 -3,-1.0 -1,-0.2 -4,-0.3 22,-0.1 -0.536 55.9 118.9 -82.6 76.4 24.2 61.7 93.3 73 73 A Y S S- 0 0 27 -2,-1.9 2,-0.1 20,-0.4 354,-0.1 -0.976 74.6 -87.1-137.8 146.9 23.8 60.0 96.7 74 74 A P - 0 0 50 0, 0.0 2,-0.5 0, 0.0 18,-0.2 -0.353 41.6-159.5 -57.5 130.7 26.2 59.6 99.6 75 75 A K E +B 91 0B 40 16,-2.8 16,-2.0 -2,-0.1 2,-0.3 -0.929 14.0 176.3-120.8 110.8 28.4 56.4 99.1 76 76 A Y E -B 90 0B 34 -2,-0.5 2,-0.3 14,-0.2 14,-0.2 -0.765 18.9-150.1-111.9 157.0 30.1 54.9 102.1 77 77 A S - 0 0 11 12,-2.0 330,-0.1 -2,-0.3 3,-0.1 -0.701 46.2 -77.3-111.2 168.5 32.3 51.9 102.8 78 78 A C - 0 0 9 -2,-0.3 11,-0.3 1,-0.1 2,-0.2 -0.320 49.5-112.3 -64.2 147.6 32.4 50.0 106.1 79 79 A H - 0 0 13 9,-0.1 2,-0.3 307,-0.1 9,-0.2 -0.532 37.7-169.8 -73.0 153.7 34.5 51.7 108.8 80 80 A F E -C 87 0B 23 7,-2.2 7,-2.9 -2,-0.2 2,-0.4 -0.989 15.1-131.5-146.7 141.2 37.5 49.7 109.7 81 81 A K E +C 86 0B 74 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.816 20.8 177.8 -97.8 136.1 40.0 50.1 112.5 82 82 A K E > -C 85 0B 43 3,-2.7 3,-1.6 -2,-0.4 2,-0.1 -0.966 66.7 -41.8-134.0 114.6 43.7 50.2 112.1 83 83 A G T 3 S- 0 0 23 -2,-0.4 53,-0.2 51,-0.3 52,-0.0 -0.433 124.3 -20.4 67.3-134.4 45.7 50.8 115.3 84 84 A K T 3 S+ 0 0 164 51,-0.4 2,-0.3 -2,-0.1 -1,-0.2 0.168 125.1 71.3 -92.5 13.7 44.1 53.6 117.3 85 85 A R E < -C 82 0B 21 -3,-1.6 -3,-2.7 20,-0.0 2,-0.4 -0.915 68.1-131.5-133.5 159.8 42.1 55.1 114.5 86 86 A Y E -CD 81 103B 22 17,-3.2 17,-2.2 -2,-0.3 2,-0.3 -0.855 21.9-169.9-107.1 147.1 39.1 54.3 112.2 87 87 A F E +CD 80 102B 0 -7,-2.9 -7,-2.2 -2,-0.4 2,-0.3 -0.864 9.3 166.7-131.0 159.4 39.1 54.7 108.4 88 88 A Y E - D 0 101B 25 13,-1.4 13,-3.3 -2,-0.3 2,-0.4 -0.923 31.6-121.4-168.5 150.8 36.4 54.6 105.8 89 89 A F E + D 0 100B 8 -11,-0.3 -12,-2.0 -2,-0.3 2,-0.3 -0.814 35.3 173.4 -95.5 141.8 35.9 55.4 102.1 90 90 A Y E -BD 76 99B 40 9,-2.6 9,-2.7 -2,-0.4 2,-0.4 -0.989 21.4-165.3-152.7 139.5 33.2 58.0 101.2 91 91 A N E -B 75 0B 8 -16,-2.0 -16,-2.8 -2,-0.3 7,-0.1 -1.000 21.1-142.3-125.4 123.7 32.1 59.8 98.1 92 92 A T - 0 0 70 -2,-0.4 -1,-0.1 -18,-0.2 -16,-0.1 0.723 64.5 -81.1 -59.5 -20.6 29.8 62.7 98.7 93 93 A G S S+ 0 0 0 -18,-0.1 -20,-0.4 -19,-0.1 -1,-0.1 -0.277 116.0 29.8 155.5 -60.9 27.9 61.7 95.5 94 94 A L S S+ 0 0 59 -22,-0.1 593,-0.1 3,-0.0 -22,-0.1 0.208 76.0 131.7-115.3 13.1 29.5 62.8 92.3 95 95 A Q - 0 0 49 1,-0.1 591,-0.3 591,-0.1 3,-0.1 -0.396 61.7-127.6 -62.3 145.8 33.2 62.9 93.1 96 96 A N S S+ 0 0 36 1,-0.2 590,-1.4 589,-0.1 2,-0.4 0.892 92.6 22.3 -63.2 -40.2 35.3 61.1 90.5 97 97 A Q S S- 0 0 21 588,-0.2 20,-0.2 589,-0.1 -1,-0.2 -0.971 88.8-110.6-128.4 144.0 37.0 58.9 93.1 98 98 A R - 0 0 126 -2,-0.4 2,-0.3 -7,-0.1 -7,-0.2 -0.393 35.8-129.0 -72.9 148.9 35.9 58.0 96.6 99 99 A V E -D 90 0B 1 -9,-2.7 -9,-2.6 16,-0.1 2,-0.6 -0.798 7.4-129.8-103.2 146.0 38.0 59.6 99.3 100 100 A L E -DE 89 114B 1 14,-2.8 13,-2.7 -2,-0.3 14,-2.2 -0.858 28.7-167.9 -97.1 123.7 39.6 57.8 102.3 101 101 A Y E -DE 88 112B 35 -13,-3.3 -13,-1.4 -2,-0.6 2,-0.3 -0.742 7.5-156.3-109.4 158.3 38.8 59.4 105.7 102 102 A V E +DE 87 111B 1 9,-2.6 9,-2.6 -2,-0.3 2,-0.3 -0.966 10.8 176.3-134.5 145.1 40.3 59.0 109.1 103 103 A Q E -D 86 0B 12 -17,-2.2 -17,-3.2 -2,-0.3 7,-0.1 -0.982 31.2-135.8-145.9 146.3 38.9 59.6 112.6 104 104 A D S S+ 0 0 89 5,-0.4 2,-0.3 -2,-0.3 6,-0.1 0.489 89.4 8.9 -81.6 -4.1 40.4 59.0 116.1 105 105 A S S > S- 0 0 54 -19,-0.1 3,-0.7 4,-0.1 -1,-0.1 -0.958 80.0-103.7-166.5 159.6 37.2 57.5 117.5 106 106 A L T 3 S+ 0 0 54 -2,-0.3 -1,-0.0 1,-0.3 -2,-0.0 0.785 125.0 40.6 -61.8 -28.2 33.7 56.5 116.3 107 107 A E T 3 S+ 0 0 198 2,-0.1 -1,-0.3 -3,-0.0 3,-0.1 0.527 99.3 105.0 -99.1 -3.4 32.2 59.7 117.7 108 108 A G S < S- 0 0 25 -3,-0.7 2,-0.2 1,-0.1 -3,-0.0 -0.233 81.6 -92.6 -78.5 160.4 35.2 61.9 116.5 109 109 A E - 0 0 180 1,-0.1 -5,-0.4 -6,-0.0 2,-0.2 -0.527 42.4-131.6 -73.5 133.1 35.3 64.3 113.7 110 110 A A - 0 0 37 -2,-0.2 2,-0.3 -7,-0.1 -7,-0.2 -0.590 21.5-167.4 -86.7 148.7 36.6 62.8 110.4 111 111 A R E -E 102 0B 101 -9,-2.6 -9,-2.6 -2,-0.2 2,-0.3 -0.929 33.4 -89.8-132.8 156.9 39.3 64.3 108.3 112 112 A V E +E 101 0B 78 -2,-0.3 -11,-0.2 -11,-0.2 3,-0.1 -0.532 41.0 170.9 -69.1 126.9 40.5 63.6 104.8 113 113 A F E S+ 0 0 11 -13,-2.7 2,-0.3 -2,-0.3 -12,-0.2 0.796 71.3 4.9-102.1 -45.9 43.3 61.1 104.8 114 114 A L E -E 100 0B 20 -14,-2.2 -14,-2.8 -12,-0.0 -1,-0.3 -0.895 60.2-174.9-149.0 114.4 43.8 60.4 101.0 115 115 A D > - 0 0 41 -2,-0.3 3,-1.1 -16,-0.2 4,-0.2 -0.871 4.0-174.4-110.6 100.2 41.9 62.2 98.3 116 116 A P G > S+ 0 0 4 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.759 74.1 78.7 -68.2 -17.0 42.6 60.7 94.9 117 117 A N G > S+ 0 0 31 1,-0.3 3,-1.0 -20,-0.2 6,-0.3 0.818 86.3 56.8 -61.4 -31.7 40.6 63.4 93.1 118 118 A I G < S+ 0 0 139 -3,-1.1 -1,-0.3 1,-0.2 3,-0.1 0.521 91.4 75.3 -79.3 0.2 43.4 66.0 93.4 119 119 A L G < S+ 0 0 79 -3,-2.0 2,-0.3 1,-0.2 -1,-0.2 0.535 107.8 13.6 -88.7 -6.3 45.8 63.6 91.6 120 120 A S X - 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0 0 4 -2,-0.6 3,-2.0 -3,-0.3 4,-0.3 -0.234 14.8-122.9 -51.9 132.4 43.7 44.0 75.2 646 646 A P T >> S+ 0 0 24 0, 0.0 4,-2.3 0, 0.0 3,-0.8 0.674 100.5 83.5 -51.4 -23.8 41.5 46.1 72.9 647 647 A L H 3> S+ 0 0 6 1,-0.3 4,-2.9 2,-0.2 5,-0.4 0.847 81.9 65.5 -51.1 -33.2 42.7 44.3 69.8 648 648 A H H <> S+ 0 0 2 -3,-2.0 4,-1.7 1,-0.2 -1,-0.3 0.948 109.9 35.3 -53.5 -50.3 40.0 41.7 70.6 649 649 A S H <> S+ 0 0 1 -3,-0.8 4,-2.6 -4,-0.3 5,-0.2 0.810 114.8 57.2 -72.5 -35.8 37.3 44.2 70.0 650 650 A L H X S+ 0 0 7 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.972 111.3 41.5 -61.3 -50.5 39.1 45.9 67.2 651 651 A K H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.884 114.8 53.1 -65.8 -36.0 39.4 42.7 65.1 652 652 A F H X S+ 0 0 0 -4,-1.7 4,-2.7 -5,-0.4 -1,-0.2 0.933 109.9 45.2 -67.1 -44.9 35.8 41.7 66.0 653 653 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.917 111.5 53.2 -68.4 -38.6 34.1 44.9 64.9 654 654 A A H X S+ 0 0 2 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.913 112.0 46.8 -57.1 -45.3 36.2 44.9 61.7 655 655 A T H X S+ 0 0 17 -4,-2.0 4,-2.6 2,-0.2 5,-0.5 0.908 112.0 49.3 -64.4 -43.3 35.0 41.4 61.0 656 656 A L H X>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 4,-2.0 0.940 111.8 48.9 -62.7 -45.9 31.4 42.2 61.8 657 657 A Q H <5S+ 0 0 9 -4,-2.8 5,-0.4 3,-0.2 -1,-0.2 0.867 117.1 41.0 -65.4 -34.7 31.4 45.2 59.5 658 658 A Y H X5S+ 0 0 72 -4,-2.0 4,-0.5 -5,-0.2 -2,-0.2 0.963 123.9 33.6 -78.5 -51.9 32.9 43.4 56.6 659 659 A I H <5S+ 0 0 51 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.920 139.7 12.8 -70.3 -46.8 31.0 40.1 56.8 660 660 A V T ><5S+ 0 0 0 -4,-2.0 3,-1.7 -5,-0.5 6,-0.3 0.823 119.4 61.8 -99.7 -43.2 27.6 41.3 58.0 661 661 A G T 34 S+ 0 0 33 1,-0.4 3,-1.9 -534,-0.3 2,-0.1 0.056 84.3 121.2 148.8 -34.6 36.9 49.2 84.3 682 682 A A T 3 S+ 0 0 53 1,-0.3 -1,-0.4 -535,-0.2 -3,-0.1 -0.413 87.5 12.0 -61.5 132.0 38.3 49.2 87.9 683 683 A G T 3 S+ 0 0 36 1,-0.3 -1,-0.3 -2,-0.1 -536,-0.1 0.538 84.8 159.6 80.1 4.5 38.9 52.6 89.2 684 684 A K < - 0 0 40 -3,-1.9 -1,-0.3 1,-0.1 -560,-0.1 -0.422 44.0-113.3 -61.4 129.9 37.0 54.3 86.4 685 685 A P > - 0 0 5 0, 0.0 4,-2.2 0, 0.0 3,-0.5 -0.317 19.7-112.3 -66.7 152.7 36.0 57.8 87.5 686 686 A T H > S+ 0 0 12 -590,-1.4 4,-2.4 -591,-0.3 5,-0.2 0.869 115.1 58.5 -48.6 -48.2 32.4 58.7 88.1 687 687 A A H > S+ 0 0 50 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.922 110.2 43.3 -52.3 -45.8 32.3 61.1 85.1 688 688 A K H > S+ 0 0 39 -3,-0.5 4,-2.7 -566,-0.2 -1,-0.2 0.867 109.4 56.6 -68.1 -40.2 33.3 58.3 82.7 689 689 A V H X S+ 0 0 36 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.920 108.4 48.7 -57.1 -43.6 30.9 55.8 84.3 690 690 A I H X S+ 0 0 11 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.907 110.8 49.3 -63.8 -43.9 28.0 58.2 83.6 691 691 A E H X S+ 0 0 66 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.923 111.4 51.4 -62.0 -43.0 29.1 58.8 80.0 692 692 A E H X S+ 0 0 45 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.951 111.0 43.8 -60.2 -53.8 29.3 55.0 79.5 693 693 A V H X S+ 0 0 14 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.873 112.6 55.0 -63.4 -31.5 25.9 54.1 80.8 694 694 A S H X S+ 0 0 0 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.910 109.4 47.0 -67.2 -38.9 24.5 57.0 78.9 695 695 A D H X S+ 0 0 15 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.933 112.2 51.6 -65.9 -45.3 26.0 55.6 75.7 696 696 A M H X S+ 0 0 9 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.966 115.2 37.4 -57.5 -58.4 24.7 52.2 76.5 697 697 A F H X S+ 0 0 3 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.796 113.6 57.2 -70.3 -22.7 21.1 53.0 77.1 698 698 A A H X S+ 0 0 3 -4,-1.7 4,-2.7 -5,-0.3 -1,-0.2 0.908 107.4 49.9 -70.9 -40.0 21.1 55.7 74.3 699 699 A F H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.948 111.0 47.7 -61.3 -51.4 22.1 52.9 71.9 700 700 A I H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.945 112.1 51.9 -54.6 -47.2 19.3 50.6 73.1 701 701 A A H X>S+ 0 0 3 -4,-2.6 5,-1.9 1,-0.2 4,-0.8 0.910 113.2 42.1 -57.6 -48.3 16.9 53.5 72.8 702 702 A R H <5S+ 0 0 58 -4,-2.7 -1,-0.2 3,-0.2 -2,-0.2 0.906 116.0 47.9 -68.8 -41.9 17.8 54.3 69.2 703 703 A C H <5S+ 0 0 28 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.889 124.2 30.4 -67.3 -39.1 18.1 50.8 68.0 704 704 A L H <5S- 0 0 34 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.379 105.9-125.1-100.3 2.5 14.7 49.6 69.5 705 705 A N T <5 + 0 0 142 -4,-0.8 2,-0.5 -5,-0.2 -3,-0.2 0.973 43.0 177.0 50.0 64.0 13.1 53.1 69.2 706 706 A I < - 0 0 28 -5,-1.9 2,-0.2 -6,-0.1 -1,-0.2 -0.886 23.7-133.2-102.1 128.6 12.1 53.3 72.8 707 707 A D - 0 0 131 -2,-0.5 2,-0.1 -212,-0.1 -6,-0.0 -0.551 23.2-112.6 -79.7 142.0 10.5 56.5 74.0 708 708 A W - 0 0 44 -2,-0.2 -213,-0.2 1,-0.0 -1,-0.1 -0.471 23.6-148.7 -72.3 142.3 11.7 58.2 77.2 709 709 A I 0 0 76 -215,-2.6 -213,-0.1 -2,-0.1 -1,-0.0 -0.964 360.0 360.0-116.3 107.8 9.1 58.1 80.1 710 710 A P 0 0 124 0, 0.0 -648,-0.0 0, 0.0 -215,-0.0 -0.276 360.0 360.0 -57.8 360.0 9.5 61.2 82.3 711 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 712 725 A G 0 0 48 0, 0.0 -120,-0.0 0, 0.0 -121,-0.0 0.000 360.0 360.0 360.0 160.6 40.4 37.2 85.4 713 726 A P 0 0 15 0, 0.0 -158,-2.0 0, 0.0 -157,-0.2 -0.699 360.0 360.0 -77.6 360.0 38.8 38.8 82.4