==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEASE 25-JUL-97 1NSA . COMPND 2 MOLECULE: PROCARBOXYPEPTIDASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR R.HUBER . 395 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15931.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 273 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 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 . 27 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 1 0 1 1 0 3 0 0 1 1 1 0 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 1 0 3 0 1 1 1 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 1 0 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 7AA F > 0 0 85 0, 0.0 3,-2.1 0, 0.0 76,-0.7 0.000 360.0 360.0 360.0 13.9 70.1 1.9 8.3 2 8AA E T 3 + 0 0 117 1,-0.3 50,-0.2 74,-0.2 3,-0.1 -0.318 360.0 4.7 -57.1 121.2 69.4 0.5 4.9 3 9AA G T 3 S+ 0 0 22 1,-0.3 -1,-0.3 -2,-0.2 2,-0.2 0.418 93.9 134.0 82.7 -1.2 65.6 0.1 4.4 4 10AA E < - 0 0 19 -3,-2.1 72,-2.2 49,-0.0 -1,-0.3 -0.550 37.6-160.3 -78.6 149.1 64.7 1.7 7.8 5 11AA K E -A 50 0A 33 45,-1.0 45,-2.5 70,-0.2 2,-0.5 -0.849 16.0-135.2-125.6 156.3 61.8 4.3 7.7 6 12AA V E -AB 49 73A 0 67,-1.8 67,-1.5 -2,-0.3 66,-1.3 -0.981 26.7-156.3-112.2 128.2 60.6 7.1 9.9 7 13AA F E -AB 48 71A 0 41,-3.0 41,-2.1 -2,-0.5 2,-0.5 -0.896 14.4-154.1-103.0 147.8 56.8 7.2 10.4 8 14AA R E -AB 47 70A 46 62,-3.3 62,-3.0 -2,-0.4 2,-0.4 -0.982 25.1-177.8-110.2 116.5 54.4 10.0 11.3 9 15AA V E -AB 46 69A 0 37,-2.3 37,-1.1 -2,-0.5 2,-0.6 -0.966 18.6-136.1-114.4 137.2 51.3 8.5 13.0 10 16AA N E -AB 45 68A 38 58,-2.5 58,-0.6 -2,-0.4 2,-0.5 -0.799 11.9-160.1 -99.2 140.0 48.3 10.4 14.3 11 17AA V E +A 44 0A 0 33,-2.5 33,-1.6 -2,-0.6 32,-1.5 -0.882 13.7 174.2-114.9 116.9 46.7 9.6 17.5 12 18AA E + 0 0 106 -2,-0.5 2,-0.2 30,-0.2 -1,-0.1 0.849 62.1 4.9 -87.9 -48.0 43.2 10.6 18.2 13 19AA D S > S- 0 0 79 29,-0.2 4,-1.4 28,-0.0 3,-0.4 -0.794 80.8 -87.0-138.9-177.4 42.3 9.2 21.5 14 20AA E H > S+ 0 0 151 -2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.665 119.9 59.2 -70.3 -11.9 43.6 7.3 24.5 15 21AA N H > S+ 0 0 95 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.916 101.7 54.4 -84.0 -30.5 42.9 3.9 22.9 16 22AA D H > S+ 0 0 21 -3,-0.4 4,-1.1 1,-0.2 -2,-0.2 0.863 107.8 51.5 -57.4 -44.0 45.2 4.8 20.1 17 23AA I H >X S+ 0 0 20 -4,-1.4 4,-1.7 2,-0.2 3,-0.6 0.921 109.4 48.1 -64.4 -40.8 47.9 5.5 22.7 18 24AA S H 3X S+ 0 0 61 -4,-1.8 4,-1.1 1,-0.3 -2,-0.2 0.903 106.3 57.4 -75.0 -23.1 47.4 2.2 24.4 19 25AA E H 3X S+ 0 0 19 -4,-2.8 4,-1.7 1,-0.2 -1,-0.3 0.784 105.4 52.0 -65.1 -31.4 47.6 0.5 21.0 20 26AA L H X S+ 0 0 6 -4,-1.7 4,-3.2 1,-0.2 3,-0.7 0.923 112.5 47.0 -57.4 -50.1 53.3 -1.9 19.4 24 30AA A H 3< S+ 0 0 30 -4,-2.4 -1,-0.2 1,-0.2 5,-0.2 0.692 108.1 54.8 -64.4 -30.3 56.3 -0.7 21.4 25 31AA S H 3< S+ 0 0 92 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.2 0.708 117.0 39.0 -80.9 -15.0 56.2 -3.7 23.7 26 32AA T H << S+ 0 0 83 -4,-1.0 2,-0.4 -3,-0.7 -2,-0.2 0.755 120.6 35.4-104.8 -36.6 56.4 -5.9 20.6 27 33AA R S < S- 0 0 75 -4,-3.2 2,-1.1 -5,-0.2 -1,-0.2 -0.943 82.8-113.2-118.6 153.7 58.8 -4.1 18.3 28 34AA Q + 0 0 126 -2,-0.4 23,-0.5 -3,-0.1 2,-0.4 -0.659 45.7 179.9 -79.4 98.0 61.9 -2.0 19.0 29 35AA I - 0 0 26 -2,-1.1 2,-0.8 -5,-0.2 21,-0.2 -0.841 23.1-144.1 -98.4 131.9 60.6 1.5 17.9 30 36AA D E -C 49 0A 19 19,-2.2 19,-2.6 -2,-0.4 2,-0.5 -0.836 18.3-147.3 -99.1 105.3 62.9 4.5 18.2 31 37AA F E +C 48 0A 21 -2,-0.8 17,-0.3 4,-0.3 6,-0.0 -0.582 22.5 175.4 -78.1 124.8 60.7 7.5 19.1 32 38AA W E + 0 0 9 15,-2.4 16,-0.2 -2,-0.5 -1,-0.2 0.880 67.0 39.0 -92.8 -44.2 61.8 10.7 17.7 33 39AA K E S+C 47 0A 54 14,-1.9 14,-3.1 2,-0.1 -1,-0.3 -0.898 123.6 21.5-162.2 112.1 59.0 13.0 18.9 34 40AA P S S- 0 0 22 0, 0.0 13,-0.1 0, 0.0 3,-0.1 0.618 90.9-130.6 -76.0-175.6 57.8 12.6 21.5 35 41AA D S S+ 0 0 45 -2,-0.2 2,-0.3 1,-0.2 -4,-0.3 0.637 83.5 18.8 -91.8 3.4 60.8 10.8 23.1 36 42AA S S > S- 0 0 22 -6,-0.1 3,-1.3 213,-0.1 -1,-0.2 -0.977 73.2-116.0-159.5 161.5 58.6 8.0 24.5 37 43AA V G > S+ 0 0 15 -2,-0.3 3,-0.9 1,-0.3 -16,-0.1 0.630 114.2 64.4 -62.5 -24.8 55.2 6.3 24.1 38 44AA T G 3 S+ 0 0 69 1,-0.2 -1,-0.3 -17,-0.0 203,-0.1 0.621 96.4 56.8 -81.5 -10.9 54.4 7.5 27.6 39 45AA Q G < S+ 0 0 8 -3,-1.3 2,-0.2 202,-0.1 -1,-0.2 0.195 78.6 113.9-108.2 15.9 54.6 11.1 26.5 40 46AA I < - 0 0 7 -3,-0.9 6,-0.1 -6,-0.1 294,-0.0 -0.632 45.1-169.3 -83.6 141.9 51.9 10.9 23.8 41 47AA K - 0 0 68 -2,-0.2 3,-0.3 4,-0.2 -30,-0.2 -0.872 35.0 -86.3-127.3 151.4 48.6 12.9 24.3 42 48AA P S S+ 0 0 44 0, 0.0 -30,-0.2 0, 0.0 -29,-0.2 -0.320 107.0 31.5 -57.6 155.1 45.4 12.6 22.2 43 49AA H S S+ 0 0 140 -32,-1.5 2,-0.3 1,-0.3 -31,-0.2 0.904 99.6 102.1 58.7 55.4 45.1 14.7 19.1 44 50AA S E -A 11 0A 37 -33,-1.6 -33,-2.5 -3,-0.3 2,-0.3 -0.804 66.9-106.4-153.5-176.5 48.7 14.8 18.2 45 51AA T E -A 10 0A 50 -2,-0.3 2,-0.4 -35,-0.2 -35,-0.2 -0.742 20.0-156.4-117.5 146.7 51.3 13.3 16.0 46 52AA V E -A 9 0A 0 -37,-1.1 -37,-2.3 -2,-0.3 2,-0.4 -0.967 2.0-160.8-131.5 123.9 54.1 10.8 16.8 47 53AA D E +AC 8 33A 0 -14,-3.1 -15,-2.4 -2,-0.4 -14,-1.9 -0.903 25.4 153.1-105.2 132.9 57.4 10.4 14.8 48 54AA F E -AC 7 31A 0 -41,-2.1 -41,-3.0 -2,-0.4 2,-0.3 -0.986 35.0-122.5-156.2 153.7 59.4 7.2 15.2 49 55AA R E -AC 6 30A 28 -19,-2.6 -19,-2.2 -2,-0.3 2,-0.4 -0.814 19.1-156.2-111.7 144.3 61.8 5.0 13.3 50 56AA V E -A 5 0A 0 -45,-2.5 -45,-1.0 -2,-0.3 -21,-0.1 -0.928 20.5-114.2-123.3 136.7 61.5 1.4 12.5 51 57AA K > - 0 0 59 -23,-0.5 3,-2.0 -2,-0.4 4,-0.4 -0.383 32.0-114.1 -69.6 146.7 64.1 -1.3 11.7 52 58AA A G > S+ 0 0 46 1,-0.3 3,-0.9 -50,-0.2 4,-0.3 0.782 116.5 53.9 -47.4 -41.4 64.1 -2.8 8.2 53 59AA E G 3 S+ 0 0 136 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.547 110.3 47.3 -71.6 -20.2 63.0 -6.2 9.4 54 60AA D G <> S+ 0 0 12 -3,-2.0 4,-2.1 1,-0.1 -1,-0.2 0.351 80.3 100.5 -99.7 -8.3 60.0 -4.7 11.2 55 61AA I H <> S+ 0 0 18 -3,-0.9 4,-1.8 -4,-0.4 -2,-0.1 0.863 86.9 40.8 -52.4 -48.2 58.7 -2.4 8.4 56 62AA L H > S+ 0 0 127 -4,-0.3 4,-2.7 2,-0.2 5,-0.2 0.870 112.4 54.6 -72.2 -38.7 55.8 -4.8 7.2 57 63AA A H > S+ 0 0 29 -4,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.906 112.5 44.2 -62.9 -38.1 54.8 -5.8 10.7 58 64AA V H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.877 110.5 52.0 -75.9 -35.4 54.3 -2.2 11.6 59 65AA E H X S+ 0 0 40 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.907 112.7 47.9 -72.2 -30.8 52.5 -1.1 8.5 60 66AA D H X S+ 0 0 78 -4,-2.7 4,-3.5 1,-0.2 -1,-0.2 0.902 111.0 50.2 -65.1 -49.5 50.1 -4.0 9.0 61 67AA F H < S+ 0 0 31 -4,-1.8 4,-0.5 -5,-0.2 -2,-0.2 0.917 112.6 45.9 -57.8 -42.5 49.5 -3.2 12.7 62 68AA L H ><>S+ 0 0 0 -4,-2.3 5,-3.5 2,-0.2 3,-0.9 0.959 117.7 44.5 -67.5 -44.7 48.8 0.5 11.9 63 69AA E H ><5S+ 0 0 109 -4,-1.9 3,-1.4 1,-0.3 -2,-0.2 0.921 113.3 48.6 -63.9 -46.5 46.5 -0.5 9.1 64 70AA Q T 3<5S+ 0 0 151 -4,-3.5 -1,-0.3 1,-0.3 -2,-0.2 0.434 117.4 43.1 -70.4 -11.2 44.7 -3.3 11.0 65 71AA N T < 5S- 0 0 51 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.246 113.5-113.0-118.8 9.9 44.2 -1.0 13.9 66 72AA E T < 5 + 0 0 178 -3,-1.4 2,-0.7 1,-0.2 -3,-0.2 0.819 58.4 155.5 61.5 38.5 43.1 2.1 12.0 67 73AA L < - 0 0 5 -5,-3.5 2,-0.3 -6,-0.2 -1,-0.2 -0.837 40.1-136.0 -96.5 123.1 46.1 4.3 12.9 68 74AA Q E +B 10 0A 140 -2,-0.7 -58,-2.5 -58,-0.6 2,-0.3 -0.624 35.8 174.2 -80.4 127.0 46.5 6.9 10.2 69 75AA Y E -B 9 0A 56 -2,-0.3 2,-0.4 -60,-0.2 -60,-0.2 -0.982 27.0-160.8-133.7 163.2 50.1 7.2 9.2 70 76AA E E -B 8 0A 108 -62,-3.0 -62,-3.3 -2,-0.3 2,-0.9 -0.979 27.8-122.0-144.7 142.4 52.5 8.8 6.8 71 77AA V E -B 7 0A 45 -2,-0.4 -64,-0.2 -64,-0.2 3,-0.2 -0.852 25.3-176.8 -84.5 102.7 56.1 7.8 5.9 72 78AA L E S+ 0 0 31 -66,-1.3 2,-0.4 -2,-0.9 -65,-0.2 0.836 75.9 20.4 -63.7 -46.9 58.3 10.8 6.7 73 79AA I E -B 6 0A 7 -67,-1.5 -67,-1.8 1,-0.1 -1,-0.3 -0.973 61.9-166.8-136.4 112.7 61.6 9.2 5.5 74 80AA N S S+ 0 0 105 -2,-0.4 2,-0.4 1,-0.3 3,-0.1 0.768 83.0 17.2 -72.9 -34.3 61.5 6.3 3.1 75 81AA N > - 0 0 38 1,-0.1 4,-1.1 -73,-0.1 -1,-0.3 -0.895 57.8-167.9-142.3 109.9 65.2 5.3 3.4 76 82AA L H > S+ 0 0 0 -72,-2.2 4,-3.1 -75,-0.5 5,-0.2 0.785 85.8 68.9 -61.2 -33.8 67.1 6.5 6.3 77 83AA R H > S+ 0 0 109 -76,-0.7 4,-2.8 -73,-0.3 -1,-0.2 0.944 100.3 47.3 -52.5 -50.4 70.3 5.3 4.6 78 84AA S H > S+ 0 0 62 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.816 110.5 50.9 -53.2 -50.3 70.0 7.9 2.0 79 85AA V H >< S+ 0 0 21 -4,-1.1 3,-0.6 2,-0.2 -2,-0.2 0.929 109.3 52.7 -60.3 -39.5 69.3 10.6 4.5 80 86AA L H >< S+ 0 0 27 -4,-3.1 3,-1.0 1,-0.3 4,-0.4 0.928 111.4 46.5 -63.2 -36.1 72.3 9.5 6.4 81 87AA E H 3< S+ 0 0 112 -4,-2.8 3,-0.4 1,-0.3 -1,-0.3 0.741 107.6 55.1 -78.3 -19.5 74.4 9.8 3.3 82 88AA A T << S+ 0 0 53 -4,-1.3 3,-0.3 -3,-0.6 -1,-0.3 0.160 89.6 86.5 -83.2 -1.1 73.1 13.2 2.3 83 89AA Q S < S+ 0 0 7 -3,-1.0 287,-2.9 1,-0.2 2,-1.7 0.866 76.8 55.1 -69.3 -50.6 74.0 14.5 5.6 84 90AA F + 0 0 98 -4,-0.4 -1,-0.2 -3,-0.4 13,-0.0 -0.672 67.0 136.0 -86.2 66.7 77.6 15.5 5.1 85 91AA D + 0 0 60 -2,-1.7 -1,-0.2 -3,-0.3 -2,-0.0 0.132 19.2 145.2-109.4 25.1 76.9 17.8 2.2 86 92AA S - 0 0 24 1,-0.1 2,-0.2 -3,-0.1 11,-0.1 -0.300 48.3-142.4 -59.5 134.4 79.1 20.8 3.2 87 93AA V + 0 0 154 9,-0.2 2,-0.4 283,-0.1 -1,-0.1 -0.259 68.1 117.9 -92.1 34.4 80.6 22.5 0.1 88 94AA S - 0 0 41 -2,-0.2 -2,-0.1 2,-0.1 6,-0.0 -0.979 56.7-156.6-106.7 131.2 83.7 23.0 2.3 89 95AA R + 0 0 249 -2,-0.4 2,-0.5 2,-0.0 -2,-0.0 0.018 54.3 121.2 -83.7 3.2 87.0 21.3 1.3 90 4 A T - 0 0 54 1,-0.1 -2,-0.1 2,-0.1 4,-0.1 -0.797 48.6-165.9 -93.6 135.4 88.4 21.4 4.8 91 5 A T S S+ 0 0 147 -2,-0.5 -1,-0.1 2,-0.1 3,-0.1 0.644 79.5 53.0 -79.2 -24.2 89.5 18.4 6.8 92 6 A G S S- 0 0 28 1,-0.2 2,-0.2 7,-0.0 -2,-0.1 -0.030 107.7 -29.7 -94.6-151.6 89.6 20.4 10.0 93 7 A H + 0 0 43 10,-0.2 2,-0.3 6,-0.1 -1,-0.2 -0.360 55.6 170.3 -64.8 130.9 87.0 22.6 11.8 94 8 A S > - 0 0 16 -2,-0.2 3,-0.6 3,-0.1 5,-0.1 -0.977 34.2-143.7-132.8 151.1 84.5 24.4 9.8 95 9 A Y T 3 S+ 0 0 43 -2,-0.3 72,-0.2 1,-0.2 4,-0.1 0.663 103.7 55.0 -82.1 -13.1 81.5 26.3 11.2 96 10 A E T 3 S+ 0 0 68 2,-0.1 2,-0.3 277,-0.1 277,-0.2 0.154 106.2 56.1-109.1 15.0 79.5 25.1 8.1 97 11 A K S < S- 0 0 27 -3,-0.6 2,-0.5 -11,-0.1 -3,-0.1 -0.819 93.9 -97.5-137.7 165.3 80.2 21.5 8.6 98 12 A Y - 0 0 6 -2,-0.3 2,-0.4 -5,-0.0 -2,-0.1 -0.855 41.4-152.3 -87.0 125.4 79.5 19.0 11.6 99 13 A N - 0 0 3 -2,-0.5 5,-0.1 -4,-0.1 -6,-0.1 -0.850 8.0-129.5 -99.7 138.2 82.8 18.6 13.6 100 14 A N > - 0 0 54 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.185 36.8 -98.5 -73.4 175.1 83.7 15.5 15.6 101 15 A W H > S+ 0 0 16 2,-0.3 4,-3.5 1,-0.2 5,-0.3 0.916 122.1 56.9 -64.7 -41.7 84.7 16.0 19.2 102 16 A E H > S+ 0 0 151 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.977 113.3 44.8 -51.9 -38.7 88.5 15.8 18.6 103 17 A T H > S+ 0 0 23 1,-0.2 4,-2.3 2,-0.2 -2,-0.3 0.916 114.0 47.1 -76.0 -36.3 87.8 18.6 16.2 104 18 A I H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.875 111.1 52.5 -68.5 -39.4 85.6 20.5 18.6 105 19 A E H X S+ 0 0 60 -4,-3.5 4,-0.9 2,-0.2 3,-0.2 0.948 111.1 45.4 -67.2 -42.7 88.0 20.1 21.5 106 20 A A H >X S+ 0 0 49 -4,-2.5 4,-2.8 -5,-0.3 3,-0.7 0.886 109.6 57.3 -66.1 -40.5 90.9 21.5 19.5 107 21 A W H 3X S+ 0 0 7 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.881 100.7 56.5 -52.9 -46.4 88.6 24.4 18.2 108 22 A T H 3X S+ 0 0 0 -4,-2.1 4,-0.8 -3,-0.2 -1,-0.2 0.839 111.9 44.4 -61.0 -27.9 87.9 25.6 21.8 109 23 A E H XX S+ 0 0 112 -4,-0.9 4,-2.4 -3,-0.7 3,-0.5 0.963 114.3 46.7 -81.1 -52.1 91.6 25.9 22.3 110 24 A Q H 3X S+ 0 0 105 -4,-2.8 4,-1.8 1,-0.3 -2,-0.2 0.873 110.9 50.6 -57.9 -40.7 92.3 27.6 19.0 111 25 A V H 3X S+ 0 0 4 -4,-3.1 4,-1.1 2,-0.2 -1,-0.3 0.822 110.2 52.0 -71.4 -26.8 89.6 30.1 19.3 112 26 A T H << S+ 0 0 27 -4,-0.8 3,-0.4 -3,-0.5 7,-0.3 0.952 111.2 46.8 -75.0 -39.2 90.7 30.9 22.8 113 27 A S H < S+ 0 0 79 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.723 113.6 48.7 -61.1 -41.1 94.3 31.5 21.6 114 28 A K H < S+ 0 0 134 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.682 124.7 26.8 -79.3 -21.4 93.2 33.6 18.7 115 29 A N >X + 0 0 33 -4,-1.1 4,-2.5 -3,-0.4 3,-1.6 -0.374 67.6 154.0-137.8 62.7 90.9 35.9 20.7 116 30 A P T 34 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.629 71.5 60.4 -61.6 -28.9 92.3 35.8 24.2 117 31 A D T 34 S+ 0 0 82 1,-0.1 3,-0.1 -3,-0.1 -5,-0.1 0.583 119.2 25.0 -70.5 -22.8 90.8 39.3 24.9 118 32 A L T <4 S+ 0 0 9 -3,-1.6 21,-2.8 1,-0.2 2,-0.4 0.617 118.2 57.6-116.4 -27.6 87.2 38.1 24.4 119 33 A I E < +D 138 0B 5 -4,-2.5 2,-0.3 -7,-0.3 19,-0.2 -0.906 49.6 176.6-122.8 137.8 87.4 34.3 25.1 120 34 A S E -D 137 0B 60 17,-2.0 17,-2.3 -2,-0.4 2,-0.4 -0.895 16.1-149.1-132.7 148.8 88.4 32.3 28.1 121 35 A R E +D 136 0B 71 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.997 16.6 170.5-131.1 130.5 88.2 28.5 28.5 122 36 A S E -D 135 0B 64 13,-3.1 13,-3.2 -2,-0.4 2,-0.5 -0.938 32.1-130.4-125.1 171.8 87.7 26.1 31.4 123 37 A A E -D 134 0B 49 -2,-0.3 11,-0.2 11,-0.3 3,-0.1 -0.952 18.1-169.0-120.8 110.9 87.0 22.4 32.1 124 38 A I E - 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