==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 14-MAY-01 1H4R . COMPND 2 MOLECULE: MERLIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.R.COOPER,B.S.KANG,P.SHEFFIELD,Y.DEVEDJIEV,Z.S.DEREWENDA . 588 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31283.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 416 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 106 18.0 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 . 50 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 169 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.2 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 0 0 0 0 0 4 2 0 0 4 0 0 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 0 10 0 4 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 . 0 0 0 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 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 20 A K 0 0 215 0, 0.0 19,-1.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 174.5 9.7 51.0 64.8 2 21 A T E -A 19 0A 70 17,-0.2 2,-0.4 18,-0.1 17,-0.2 -0.966 360.0-147.8-136.7 165.6 11.5 48.7 62.5 3 22 A F E -A 18 0A 12 15,-1.9 15,-2.8 -2,-0.3 2,-0.3 -0.950 34.8-103.3-128.5 150.3 10.9 45.5 60.5 4 23 A T E -A 17 0A 38 -2,-0.4 69,-1.7 13,-0.2 2,-0.4 -0.554 33.0-165.7 -78.1 132.7 13.6 43.0 59.8 5 24 A V E -Ab 16 73A 0 11,-2.9 11,-2.0 -2,-0.3 2,-0.5 -0.962 9.1-148.2-117.9 136.9 15.1 43.0 56.3 6 25 A R E -Ab 15 74A 85 67,-3.0 69,-2.6 -2,-0.4 2,-0.5 -0.929 11.0-161.8-104.6 126.8 17.2 40.1 55.1 7 26 A I E -Ab 14 75A 0 7,-3.1 7,-2.0 -2,-0.5 2,-0.7 -0.944 0.7-160.6-112.8 122.6 19.9 41.0 52.6 8 27 A V E +Ab 13 76A 20 67,-2.7 69,-2.4 -2,-0.5 5,-0.2 -0.914 14.0 175.6-107.8 111.6 21.4 38.2 50.5 9 28 A T - 0 0 10 3,-2.7 69,-0.1 -2,-0.7 89,-0.0 -0.595 48.1-103.7-100.2 174.6 24.8 39.0 49.0 10 29 A M S S+ 0 0 63 67,-0.3 3,-0.1 -2,-0.2 68,-0.1 0.802 121.8 48.4 -69.5 -24.9 26.8 36.6 47.0 11 30 A D S S- 0 0 80 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.868 125.6 -44.9 -78.1 -47.9 29.1 36.2 50.1 12 31 A A - 0 0 55 -5,-0.0 -3,-2.7 2,-0.0 2,-0.3 -0.959 57.0 -90.4-169.5-176.9 26.5 35.7 52.8 13 32 A E E +A 8 0A 103 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.821 36.5 175.1-114.8 151.1 23.3 36.8 54.3 14 33 A M E -A 7 0A 47 -7,-2.0 -7,-3.1 -2,-0.3 2,-0.4 -0.967 19.1-133.4-148.5 165.5 22.7 39.5 56.9 15 34 A E E -A 6 0A 96 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.937 17.2-176.6-126.8 146.5 19.9 41.2 58.6 16 35 A F E -A 5 0A 27 -11,-2.0 -11,-2.9 -2,-0.4 2,-0.7 -0.936 32.2-115.7-133.0 158.6 19.2 44.8 59.4 17 36 A N E -A 4 0A 109 -2,-0.3 2,-0.5 -13,-0.2 -13,-0.2 -0.871 34.6-158.4 -91.4 112.7 16.5 46.7 61.2 18 37 A C E -A 3 0A 0 -15,-2.8 -15,-1.9 -2,-0.7 9,-0.0 -0.854 20.8-116.9 -97.7 126.1 14.8 48.9 58.5 19 38 A E E > -A 2 0A 102 -2,-0.5 3,-2.0 -17,-0.2 -17,-0.2 -0.321 28.6-114.9 -58.4 144.2 12.9 51.9 59.8 20 39 A M T 3 S+ 0 0 74 -19,-1.6 43,-0.4 1,-0.3 -1,-0.1 0.811 113.6 34.3 -55.3 -30.4 9.2 51.6 58.9 21 40 A K T 3 S+ 0 0 148 41,-0.1 -1,-0.3 40,-0.1 -2,-0.1 0.223 84.8 133.4-110.8 14.0 9.4 54.6 56.5 22 41 A W < - 0 0 54 -3,-2.0 40,-2.1 39,-0.1 41,-0.4 -0.329 48.0-135.2 -63.1 148.5 12.9 54.2 55.1 23 42 A K B > -E 61 0B 101 38,-0.3 4,-1.6 39,-0.1 3,-0.4 -0.414 30.6 -94.7 -91.4 171.7 13.2 54.6 51.4 24 43 A G H > S+ 0 0 0 36,-2.0 4,-3.0 33,-0.7 34,-0.3 0.917 123.9 57.5 -48.8 -48.2 15.2 52.4 49.0 25 44 A K H > S+ 0 0 112 33,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.831 104.4 51.3 -55.2 -39.4 18.1 54.9 49.2 26 45 A D H > S+ 0 0 61 -3,-0.4 4,-1.7 32,-0.3 -1,-0.2 0.901 114.7 40.7 -67.6 -44.3 18.4 54.5 53.1 27 46 A L H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.922 115.9 51.2 -72.8 -42.2 18.4 50.8 53.1 28 47 A F H X S+ 0 0 13 -4,-3.0 4,-2.6 -5,-0.2 -2,-0.2 0.919 110.3 49.3 -60.0 -45.4 20.8 50.6 50.1 29 48 A D H X S+ 0 0 51 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.879 109.7 51.3 -63.1 -38.5 23.2 53.1 51.7 30 49 A L H X S+ 0 0 28 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.908 111.0 48.2 -64.2 -43.9 23.2 51.1 54.9 31 50 A V H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.955 112.9 47.5 -61.4 -48.7 24.0 47.9 53.0 32 51 A C H X>S+ 0 0 4 -4,-2.6 5,-2.7 1,-0.2 4,-0.9 0.923 112.5 49.1 -60.6 -44.3 26.8 49.6 51.0 33 52 A R H ><5S+ 0 0 166 -4,-2.6 3,-0.7 1,-0.2 -1,-0.2 0.914 108.8 53.3 -60.7 -43.9 28.4 51.2 54.2 34 53 A T H 3<5S+ 0 0 78 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.870 112.4 44.8 -59.7 -37.9 28.2 47.8 56.0 35 54 A L H 3<5S- 0 0 33 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.595 110.7-122.2 -80.4 -12.6 30.1 46.2 53.1 36 55 A G T <<5 + 0 0 38 -4,-0.9 2,-0.5 -3,-0.7 -3,-0.2 0.805 59.6 155.9 73.3 26.4 32.6 49.1 52.9 37 56 A L < + 0 0 5 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.792 22.8 161.8 -96.4 121.6 31.5 49.5 49.3 38 57 A R + 0 0 180 -2,-0.5 2,-1.8 1,-0.1 3,-0.3 0.584 65.0 79.4-108.0 -18.5 31.9 52.9 47.6 39 58 A E > + 0 0 18 1,-0.2 3,-0.8 -7,-0.1 4,-0.2 -0.415 60.2 147.1 -85.4 62.0 31.6 51.7 43.9 40 59 A T G > + 0 0 43 -2,-1.8 3,-1.6 1,-0.2 -1,-0.2 0.636 40.1 84.0 -77.7 -19.1 27.9 51.6 44.5 41 60 A W G 3 S+ 0 0 116 1,-0.3 -1,-0.2 -3,-0.3 -2,-0.1 0.648 87.4 57.0 -64.9 -17.3 26.6 52.6 41.0 42 61 A F G < S+ 0 0 0 -3,-0.8 38,-3.0 38,-0.1 39,-2.2 0.672 101.4 74.9 -81.5 -17.0 26.9 49.0 39.7 43 62 A F E < +C 79 0A 14 -3,-1.6 2,-0.3 36,-0.3 36,-0.2 -0.518 46.9 163.3-109.5 161.4 24.6 47.6 42.4 44 63 A G E -C 78 0A 7 34,-2.2 34,-1.8 -2,-0.2 2,-0.6 -0.922 40.3-101.8-154.8 178.6 21.0 47.4 43.5 45 64 A L E -C 77 0A 0 11,-0.3 11,-3.0 -2,-0.3 2,-0.3 -0.964 42.8-156.3-115.5 115.9 18.6 45.5 45.8 46 65 A Q E +CD 76 55A 35 30,-2.9 30,-2.6 -2,-0.6 2,-0.2 -0.657 20.2 164.9-101.4 145.6 16.6 42.9 43.9 47 66 A Y E - D 0 54A 12 7,-2.9 7,-2.3 -2,-0.3 2,-0.4 -0.812 32.2-110.6-138.7-179.1 13.3 41.2 44.5 48 67 A T E - D 0 53A 86 -2,-0.2 2,-0.6 5,-0.2 5,-0.2 -0.975 13.7-164.4-127.1 129.5 10.8 39.2 42.4 49 68 A I E > S- D 0 52A 38 3,-3.0 3,-2.5 -2,-0.4 2,-0.2 -0.957 74.2 -50.2-108.9 110.7 7.3 40.1 41.1 50 69 A K T 3 S- 0 0 163 -2,-0.6 0, 0.0 1,-0.3 0, 0.0 -0.450 124.6 -22.0 59.5-127.4 5.7 36.9 40.0 51 70 A D T 3 S+ 0 0 102 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.180 122.6 91.4 -91.7 14.5 8.3 35.4 37.7 52 71 A T E < S-D 49 0A 14 -3,-2.5 -3,-3.0 1,-0.0 2,-0.1 -0.894 73.5-115.7-122.1 147.3 10.2 38.7 36.9 53 72 A V E -D 48 0A 46 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.404 32.0-178.2 -74.2 145.5 13.1 40.6 38.5 54 73 A A E -D 47 0A 9 -7,-2.3 -7,-2.9 -2,-0.1 2,-0.4 -0.993 15.6-141.2-144.6 148.6 12.6 44.0 40.0 55 74 A W E -D 46 0A 13 -2,-0.3 -9,-0.2 -9,-0.2 2,-0.1 -0.875 27.7-106.1-113.9 141.2 14.9 46.5 41.7 56 75 A L - 0 0 11 -11,-3.0 2,-0.4 -2,-0.4 -11,-0.3 -0.428 35.1-129.7 -59.8 134.1 14.3 48.6 44.7 57 76 A K > - 0 0 64 -2,-0.1 3,-1.1 1,-0.1 -33,-0.7 -0.730 7.8-138.7 -91.0 136.6 13.7 52.2 43.7 58 77 A M T 3 S+ 0 0 59 -2,-0.4 -33,-2.6 -34,-0.3 -32,-0.3 0.858 97.9 45.2 -65.9 -37.2 15.8 54.7 45.7 59 78 A D T 3 S+ 0 0 137 -35,-0.2 2,-0.4 -36,-0.2 -1,-0.2 0.254 99.0 84.2 -93.6 11.2 13.1 57.4 46.2 60 79 A K S < S- 0 0 87 -3,-1.1 -36,-2.0 2,-0.0 -35,-0.1 -0.913 86.6-102.2-118.2 142.7 10.3 55.1 47.2 61 80 A K B > -E 23 0B 68 -2,-0.4 3,-1.3 -38,-0.3 4,-0.5 -0.340 30.4-126.6 -58.8 133.7 9.5 53.6 50.7 62 81 A V G > S+ 0 0 1 -40,-2.1 3,-1.2 1,-0.3 5,-0.2 0.889 109.7 49.1 -46.2 -47.2 10.7 50.0 51.0 63 82 A L G 3 S+ 0 0 42 -41,-0.4 -1,-0.3 -43,-0.4 4,-0.1 0.611 99.1 65.9 -75.9 -12.1 7.2 48.9 52.1 64 83 A D G < S+ 0 0 102 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.2 0.535 85.3 97.6 -82.8 -8.6 5.4 50.7 49.3 65 84 A H S < S- 0 0 3 -3,-1.2 2,-2.6 -4,-0.5 -9,-0.1 -0.510 94.6-107.6 -76.5 153.4 7.2 48.3 46.9 66 85 A D S S+ 0 0 120 -2,-0.2 2,-0.4 -19,-0.0 -1,-0.1 -0.302 74.8 134.6 -77.2 56.8 5.3 45.2 45.7 67 86 A V - 0 0 16 -2,-2.6 -18,-0.1 -5,-0.2 6,-0.0 -0.847 66.8 -96.1-110.2 146.2 7.4 43.0 47.9 68 87 A S - 0 0 86 -2,-0.4 6,-0.2 1,-0.1 -3,-0.0 -0.346 28.3-152.7 -57.4 136.1 6.2 40.2 50.2 69 88 A K + 0 0 109 4,-0.1 2,-0.6 2,-0.1 4,-0.2 0.390 54.8 123.3 -95.4 0.8 5.8 41.5 53.7 70 89 A E S S- 0 0 157 2,-0.1 4,-0.1 1,-0.1 -2,-0.1 -0.539 77.1 -86.5 -63.1 110.3 6.3 38.2 55.5 71 90 A E S S+ 0 0 110 -2,-0.6 -66,-0.1 1,-0.2 -2,-0.1 -0.421 117.1 52.3 -63.4 137.0 9.3 39.0 57.8 72 91 A P S S- 0 0 48 0, 0.0 2,-0.4 0, 0.0 -67,-0.2 0.399 81.8-153.0 -82.0 136.5 12.0 38.9 57.0 73 92 A V E -b 5 0A 3 -69,-1.7 -67,-3.0 -4,-0.2 2,-0.4 -0.594 25.9-147.9 -66.4 126.0 11.4 41.1 53.9 74 93 A T E +b 6 0A 54 -2,-0.4 2,-0.3 -6,-0.2 -67,-0.2 -0.863 25.7 174.2-116.2 135.8 14.2 39.8 51.7 75 94 A F E -b 7 0A 0 -69,-2.6 -67,-2.7 -2,-0.4 2,-0.6 -0.970 25.4-134.1-130.5 148.8 16.3 41.5 49.0 76 95 A H E -bC 8 46A 82 -30,-2.6 -30,-2.9 -2,-0.3 2,-0.6 -0.920 16.1-141.9-103.2 122.7 19.3 40.2 47.0 77 96 A F E + C 0 45A 4 -69,-2.4 -67,-0.3 -2,-0.6 2,-0.3 -0.754 43.2 149.7 -84.7 118.7 22.2 42.6 46.8 78 97 A L E - C 0 44A 26 -34,-1.8 -34,-2.2 -2,-0.6 2,-0.4 -0.956 54.3 -92.6-148.6 156.6 23.5 42.2 43.3 79 98 A A E - C 0 43A 3 -2,-0.3 -36,-0.3 -36,-0.2 3,-0.1 -0.666 32.6-179.8 -73.1 129.1 25.2 44.0 40.5 80 99 A K S S+ 0 0 34 -38,-3.0 2,-0.3 -2,-0.4 -37,-0.2 0.610 72.0 37.8 -97.9 -25.2 22.6 45.4 38.1 81 100 A F S S- 0 0 18 -39,-2.2 -1,-0.2 202,-0.0 118,-0.0 -0.937 74.0-145.3-129.5 149.4 25.1 47.0 35.8 82 101 A Y - 0 0 20 -2,-0.3 4,-0.0 117,-0.2 116,-0.0 -0.900 22.0-112.8-116.5 145.4 28.5 45.6 34.6 83 102 A P - 0 0 4 0, 0.0 3,-0.3 0, 0.0 136,-0.1 -0.280 14.7-132.2 -70.3 159.6 31.7 47.6 33.8 84 103 A E S S+ 0 0 56 1,-0.3 2,-0.4 135,-0.1 136,-0.0 0.806 103.5 23.1 -77.3 -29.0 33.0 47.8 30.3 85 104 A N S > S- 0 0 60 1,-0.1 4,-2.6 2,-0.0 -1,-0.3 -0.897 70.3-168.1-142.1 99.2 36.5 46.9 31.6 86 105 A A H > S+ 0 0 0 -2,-0.4 4,-2.5 -3,-0.3 -1,-0.1 0.909 85.9 53.1 -61.1 -44.7 36.5 45.1 34.9 87 106 A E H 4 S+ 0 0 109 1,-0.2 -1,-0.2 2,-0.2 9,-0.0 0.888 117.5 39.2 -62.3 -35.1 40.3 45.4 35.6 88 107 A E H 4 S+ 0 0 151 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.876 123.6 36.4 -78.9 -40.2 40.1 49.2 35.1 89 108 A E H < S+ 0 0 40 -4,-2.6 2,-1.2 1,-0.2 -3,-0.2 0.735 99.2 72.0 -91.8 -24.9 36.7 49.9 36.8 90 109 A L < + 0 0 1 -4,-2.5 -1,-0.2 -5,-0.3 6,-0.1 -0.720 55.4 155.8 -97.4 88.9 36.5 47.5 39.8 91 110 A V + 0 0 105 -2,-1.2 -1,-0.2 -3,-0.1 2,-0.2 0.863 45.8 73.6 -86.2 -39.8 39.0 49.1 42.1 92 111 A Q S > S- 0 0 26 1,-0.1 4,-2.1 4,-0.0 5,-0.2 -0.521 77.4-131.1 -78.3 145.7 38.0 48.0 45.5 93 112 A E H > S+ 0 0 124 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.913 108.0 54.3 -58.9 -44.2 38.6 44.4 46.6 94 113 A I H > S+ 0 0 36 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.919 108.9 47.9 -57.8 -42.8 35.0 44.1 47.9 95 114 A T H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.930 113.1 47.3 -65.0 -44.7 33.6 45.1 44.5 96 115 A Q H X S+ 0 0 29 -4,-2.1 4,-2.9 1,-0.2 -1,-0.2 0.904 112.6 51.0 -60.8 -44.4 35.8 42.7 42.6 97 116 A H H X S+ 0 0 40 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.900 109.7 47.4 -62.5 -45.2 34.9 40.0 44.9 98 117 A L H X S+ 0 0 3 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.885 113.6 48.6 -67.2 -38.2 31.1 40.4 44.6 99 118 A F H X S+ 0 0 0 -4,-2.2 4,-2.8 -5,-0.2 5,-0.3 0.943 110.4 52.6 -62.4 -48.4 31.4 40.6 40.8 100 119 A F H X S+ 0 0 6 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.918 111.8 44.5 -53.4 -48.0 33.5 37.5 40.8 101 120 A L H X S+ 0 0 30 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.887 115.1 47.6 -68.0 -38.4 31.0 35.5 42.9 102 121 A Q H X S+ 0 0 15 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.902 115.1 43.8 -70.8 -42.0 28.0 36.7 40.9 103 122 A V H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.910 111.4 55.0 -70.4 -40.6 29.5 36.0 37.5 104 123 A K H X S+ 0 0 49 -4,-2.3 4,-2.9 -5,-0.3 5,-0.2 0.914 108.0 49.2 -56.8 -45.2 30.9 32.6 38.6 105 124 A K H X S+ 0 0 85 -4,-1.8 4,-2.8 1,-0.2 6,-0.3 0.901 108.1 54.1 -64.3 -38.4 27.4 31.6 39.7 106 125 A Q H <>S+ 0 0 37 -4,-1.7 5,-2.1 2,-0.2 6,-1.5 0.871 111.9 45.6 -59.1 -37.6 26.1 32.7 36.3 107 126 A I H ><5S+ 0 0 3 -4,-2.2 3,-1.4 4,-0.2 -2,-0.2 0.943 114.4 46.2 -70.4 -47.2 28.6 30.5 34.6 108 127 A L H 3<5S+ 0 0 13 -4,-2.9 44,-0.6 1,-0.3 -2,-0.2 0.850 113.1 50.2 -67.0 -35.4 28.0 27.5 36.9 109 128 A D T 3<5S- 0 0 70 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.377 113.8-118.8 -82.4 3.1 24.2 28.0 36.4 110 129 A E T < 5S+ 0 0 89 -3,-1.4 -3,-0.2 2,-0.2 -2,-0.1 0.651 78.7 125.9 68.5 19.8 24.6 28.1 32.6 111 130 A K S - 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N 0 339D 26 -34,-1.9 -34,-2.0 -2,-0.6 2,-0.4 -0.960 55.5 -89.0-146.0 158.7 63.6 41.2 13.9 374 98 B A E + N 0 338D 2 -2,-0.3 -36,-0.3 -36,-0.2 3,-0.1 -0.624 33.5 179.9 -70.9 127.8 61.9 42.9 16.8 375 99 B K S S+ 0 0 37 -38,-3.4 2,-0.3 -2,-0.4 -37,-0.2 0.669 72.5 35.3 -98.4 -28.7 64.6 44.4 19.1 376 100 B F S S- 0 0 13 -39,-2.1 -1,-0.2 202,-0.1 118,-0.0 -0.910 74.4-144.4-127.6 154.3 62.0 45.8 21.5 377 101 B Y - 0 0 21 -2,-0.3 -39,-0.0 117,-0.2 3,-0.0 -0.924 18.8-117.2-121.5 145.4 58.6 44.4 22.6 378 102 B P - 0 0 3 0, 0.0 3,-0.3 0, 0.0 136,-0.1 -0.304 15.5-132.4 -73.0 161.2 55.4 46.2 23.5 379 103 B E S S+ 0 0 57 1,-0.3 2,-0.4 135,-0.1 136,-0.0 0.857 101.7 20.4 -80.0 -39.4 53.9 46.1 27.0 380 104 B N > - 0 0 33 1,-0.1 4,-2.7 2,-0.0 3,-0.4 -0.888 67.7-168.4-133.2 105.1 50.5 45.3 25.6 381 105 B A H > S+ 0 0 0 -2,-0.4 4,-2.1 -3,-0.3 -1,-0.1 0.814 87.6 56.7 -57.9 -37.1 50.5 43.9 22.1 382 106 B E H 4 S+ 0 0 107 1,-0.2 -1,-0.2 2,-0.2 100,-0.0 0.880 115.8 37.4 -67.6 -35.6 46.7 44.2 21.7 383 107 B E H 4 S+ 0 0 156 -3,-0.4 -2,-0.2 1,-0.1 -1,-0.2 0.904 125.4 35.1 -78.5 -43.8 46.9 48.0 22.5 384 108 B E H < S+ 0 0 37 -4,-2.7 2,-1.2 1,-0.2 -3,-0.2 0.772 97.2 74.8 -90.9 -31.3 50.2 48.8 20.7 385 109 B L < + 0 0 2 -4,-2.1 -1,-0.2 -5,-0.2 6,-0.1 -0.708 49.4 163.0 -90.4 94.2 50.5 46.7 17.6 386 110 B V + 0 0 117 -2,-1.2 2,-0.3 4,-0.0 -1,-0.2 0.820 50.2 73.4 -82.5 -32.9 48.0 48.3 15.1 387 111 B Q S > S- 0 0 28 1,-0.1 4,-2.4 4,-0.0 5,-0.2 -0.614 72.3-136.6 -88.8 147.2 49.2 46.7 11.8 388 112 B E H > S+ 0 0 94 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.888 106.1 53.4 -63.0 -43.2 48.7 43.1 10.6 389 113 B I H > S+ 0 0 35 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.930 110.6 47.5 -59.9 -42.0 52.2 42.8 9.3 390 114 B T H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.940 113.0 47.5 -64.5 -47.6 53.6 44.0 12.7 391 115 B Q H X S+ 0 0 28 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.913 112.6 51.2 -57.2 -44.3 51.4 41.6 14.6 392 116 B H H X S+ 0 0 36 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.894 109.0 47.8 -63.4 -46.6 52.3 38.7 12.3 393 117 B L H X S+ 0 0 5 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.871 112.8 49.1 -68.6 -36.4 56.1 39.2 12.6 394 118 B F H X S+ 0 0 0 -4,-2.0 4,-3.0 -5,-0.2 5,-0.3 0.932 109.6 54.0 -61.8 -46.1 55.9 39.4 16.4 395 119 B F H X S+ 0 0 6 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.931 111.3 43.2 -55.4 -49.8 53.8 36.3 16.4 396 120 B L H X S+ 0 0 32 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.902 116.0 47.6 -66.1 -41.0 56.3 34.2 14.4 397 121 B Q H X S+ 0 0 17 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.930 115.8 43.3 -65.5 -45.0 59.3 35.5 16.3 398 122 B V H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.890 111.3 55.0 -70.0 -39.2 57.7 34.9 19.8 399 123 B K H X S+ 0 0 54 -4,-2.5 4,-3.0 -5,-0.3 5,-0.2 0.915 107.5 50.4 -59.7 -43.3 56.3 31.5 18.7 400 124 B K H X S+ 0 0 96 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.891 108.1 52.7 -61.8 -41.3 59.8 30.4 17.7 401 125 B Q H <>S+ 0 0 35 -4,-1.6 5,-3.1 2,-0.2 6,-1.1 0.886 112.6 45.9 -58.8 -40.8 61.2 31.6 21.1 402 126 B I H ><5S+ 0 0 3 -4,-2.2 3,-1.2 3,-0.2 -2,-0.2 0.936 113.8 46.3 -67.6 -48.1 58.5 29.5 22.8 403 127 B L H 3<5S+ 0 0 12 -4,-3.0 44,-0.5 1,-0.3 -2,-0.2 0.831 114.6 48.0 -67.9 -31.3 59.1 26.4 20.7 404 128 B D T 3<5S- 0 0 65 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.396 114.5-116.8 -88.9 3.9 62.9 26.7 21.1 405 129 B E T < 5S+ 0 0 86 -3,-1.2 -3,-0.2 -4,-0.2 3,-0.1 0.796 76.2 129.5 65.6 33.0 62.5 27.2 25.0 406 130 B K S - 0 0 16 0, 0.0 4,-2.1 0, 0.0 5,-0.2 -0.245 31.0-102.8 -72.2 164.7 54.4 25.8 31.3 411 135 B P H > S+ 0 0 12 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.870 115.1 46.9 -60.9 -45.6 52.4 22.9 29.7 412 136 B E H > S+ 0 0 0 -241,-0.2 4,-2.1 1,-0.2 3,-0.2 0.939 115.0 48.2 -67.3 -43.0 48.8 24.1 29.9 413 137 B A H > S+ 0 0 10 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.897 108.8 55.5 -56.9 -39.6 49.8 27.5 28.6 414 138 B S H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.842 107.5 48.2 -64.8 -33.9 51.8 25.7 25.8 415 139 B V H X S+ 0 0 0 -4,-1.7 4,-2.0 -3,-0.2 -1,-0.2 0.906 111.0 49.8 -74.0 -41.0 48.7 23.8 24.7 416 140 B L H X S+ 0 0 15 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.933 112.8 48.5 -60.9 -45.8 46.5 26.9 24.7 417 141 B L H >X S+ 0 0 2 -4,-2.8 4,-2.3 1,-0.2 3,-0.8 0.938 108.4 53.2 -58.9 -47.0 49.2 28.7 22.6 418 142 B A H 3X S+ 0 0 3 -4,-2.3 4,-2.6 1,-0.3 -1,-0.2 0.893 102.9 58.9 -58.2 -37.8 49.4 25.7 20.2 419 143 B S H 3X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -1,-0.3 0.847 107.7 45.4 -62.3 -33.5 45.7 25.9 19.7 420 144 B Y H S+ 0 0 1 -4,-2.6 4,-3.2 2,-0.2 5,-0.5 0.929 110.8 49.8 -66.1 -44.8 46.7 25.9 14.7 423 147 B Q H X5S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.928 110.9 50.7 -57.3 -43.6 43.8 28.4 14.2 424 148 B A H <5S+ 0 0 10 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.847 120.1 34.4 -63.8 -36.0 46.2 30.8 12.5 425 149 B K H <5S+ 0 0 133 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.899 130.7 26.1 -88.2 -44.7 47.5 28.2 10.1 426 150 B Y H <5S- 0 0 69 -4,-3.2 -3,-0.2 1,-0.3 -2,-0.2 0.582 91.4-141.4 -97.9 -15.0 44.5 26.0 9.4 427 151 B G << + 0 0 30 -4,-1.9 -1,-0.3 -5,-0.5 -2,-0.1 -0.426 63.0 7.3 75.8-159.7 41.5 28.2 10.0 428 152 B D S S- 0 0 79 1,-0.1 2,-0.1 -2,-0.1 41,-0.1 -0.194 81.3-108.4 -59.8 139.1 38.4 26.8 11.6 429 153 B Y - 0 0 57 39,-0.4 -1,-0.1 36,-0.1 3,-0.0 -0.439 38.0-179.6 -60.9 137.1 38.4 23.3 13.1 430 154 B D >> - 0 0 67 -2,-0.1 4,-3.5 1,-0.1 3,-1.8 -0.869 20.8-157.3-145.0 102.0 36.3 21.0 10.9 431 155 B P T 34 S+ 0 0 78 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.645 93.5 62.0 -57.9 -15.5 36.1 17.4 12.1 432 156 B S T 34 S+ 0 0 99 1,-0.1 3,-0.2 3,-0.1 -3,-0.0 0.735 120.6 22.3 -80.7 -25.8 35.2 16.3 8.6 433 157 B V T <4 S+ 0 0 103 -3,-1.8 2,-1.3 1,-0.2 -1,-0.1 0.764 120.5 58.8-105.2 -42.6 38.6 17.5 7.2 434 158 B H S < S+ 0 0 24 -4,-3.5 -1,-0.2 3,-0.0 3,-0.1 -0.626 75.6 170.8 -92.1 78.0 40.7 17.5 10.4 435 159 B K > - 0 0 151 -2,-1.3 3,-2.1 1,-0.2 -3,-0.1 -0.388 49.4 -58.5 -85.4 164.4 40.4 13.9 11.4 436 160 B R T 3 S+ 0 0 186 1,-0.3 -1,-0.2 -5,-0.1 22,-0.1 -0.141 128.6 26.8 -41.4 124.6 42.5 12.1 14.2 437 161 B G T > S+ 0 0 37 -3,-0.1 3,-1.9 21,-0.1 -1,-0.3 0.352 77.1 127.4 100.4 -0.9 46.1 12.5 13.3 438 162 B F T < S+ 0 0 39 -3,-2.1 3,-0.2 1,-0.3 -2,-0.1 0.684 77.3 46.8 -63.6 -18.0 45.8 15.8 11.3 439 163 B L T > S+ 0 0 11 1,-0.1 3,-1.9 2,-0.1 -1,-0.3 0.335 76.0 113.7-104.1 8.0 48.5 17.4 13.4 440 164 B A T < S+ 0 0 85 -3,-1.9 -1,-0.1 1,-0.3 -2,-0.1 0.667 82.9 39.0 -54.6 -23.1 51.1 14.5 13.4 441 165 B Q T 3 S+ 0 0 196 -3,-0.2 2,-0.4 -4,-0.2 -1,-0.3 0.305 93.4 102.5-113.3 14.3 53.7 16.5 11.3 442 166 B E < - 0 0 53 -3,-1.9 2,-1.0 1,-0.0 -3,-0.0 -0.747 66.8-136.0 -98.3 137.6 53.3 19.9 13.0 443 167 B E + 0 0 96 -2,-0.4 -40,-0.1 1,-0.2 -3,-0.1 -0.829 48.3 144.0 -90.4 104.6 55.8 21.3 15.5 444 168 B L + 0 0 25 -2,-1.0 -1,-0.2 1,-0.1 -23,-0.1 0.613 48.5 49.5-117.1 -17.4 53.4 22.8 18.1 445 169 B L S S- 0 0 24 -42,-0.1 2,-0.2 -28,-0.1 -1,-0.1 -0.921 80.3-103.9-131.5 151.0 54.9 22.3 21.5 446 170 B P >> - 0 0 4 0, 0.0 3,-1.3 0, 0.0 4,-1.0 -0.512 31.9-126.6 -65.3 141.3 58.2 22.8 23.4 447 171 B K H >> S+ 0 0 144 -44,-0.5 4,-1.5 1,-0.3 3,-0.6 0.855 108.7 63.1 -57.7 -37.4 60.1 19.5 23.9 448 172 B R H 3> S+ 0 0 58 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.816 97.7 56.8 -57.7 -32.1 60.4 20.3 27.6 449 173 B V H <> S+ 0 0 0 -3,-1.3 4,-1.4 1,-0.2 -1,-0.2 0.870 102.8 52.7 -70.6 -36.1 56.6 20.1 27.8 450 174 B I H << S+ 0 0 69 -4,-1.0 5,-0.2 -3,-0.6 -1,-0.2 0.836 105.9 56.0 -63.8 -35.0 56.5 16.5 26.4 451 175 B N H < S+ 0 0 112 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.825 106.7 50.1 -67.8 -29.8 59.0 15.6 29.0 452 176 B L H < S+ 0 0 86 -4,-1.1 2,-0.4 -3,-0.2 -1,-0.2 0.770 108.9 52.7 -81.6 -29.3 56.6 16.8 31.7 453 177 B Y < - 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