==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . 217 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11284.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 154 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 5.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 8 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 42.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.4 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 0 1 1 0 1 1 0 0 0 1 0 0 0 0 0 0 1 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 0 PARALLEL BRIDGES PER LADDER . 1 0 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A P 0 0 104 0, 0.0 26,-0.3 0, 0.0 64,-0.2 0.000 360.0 360.0 360.0 166.1 25.7 4.0 90.9 2 3 A M E -a 27 0A 9 24,-2.5 26,-2.9 62,-0.1 2,-0.5 -0.305 360.0-132.1 -65.9 156.8 22.3 3.9 92.6 3 4 A T E -aB 28 63A 44 60,-2.4 60,-2.6 24,-0.2 2,-0.6 -0.972 15.1-167.0-116.8 124.3 21.5 1.2 95.0 4 5 A L E -aB 29 62A 0 24,-2.6 26,-2.2 -2,-0.5 2,-0.5 -0.936 10.8-164.0-106.6 115.1 18.2 -0.8 94.8 5 6 A G E +aB 30 61A 0 56,-2.6 56,-1.9 -2,-0.6 2,-0.3 -0.867 27.8 124.9-102.7 131.0 17.6 -2.8 98.0 6 7 A Y E -a 31 0A 18 24,-2.0 26,-2.3 -2,-0.5 -2,-0.0 -0.967 61.6 -72.9-165.3 165.4 15.0 -5.6 98.0 7 8 A W E -a 32 0A 21 -2,-0.3 2,-2.1 24,-0.2 26,-0.2 -0.271 58.0-100.6 -56.3 156.0 14.4 -9.3 98.7 8 9 A N S S+ 0 0 61 24,-2.2 2,-0.3 23,-0.1 -1,-0.1 -0.365 95.3 88.0 -82.9 59.0 15.9 -11.6 96.1 9 10 A I S S- 0 0 13 -2,-2.1 198,-0.2 1,-0.2 4,-0.2 -0.872 88.2-107.1-143.9 169.2 12.5 -12.1 94.5 10 11 A R S >> S+ 0 0 2 196,-3.0 3,-1.6 -2,-0.3 4,-0.6 0.997 76.9 116.0 -62.5 -72.3 10.4 -10.5 91.8 11 12 A G G >4 S- 0 0 5 196,-2.5 3,-0.9 195,-0.3 197,-0.1 0.040 89.9 -15.9 43.1-137.6 7.8 -9.0 94.2 12 13 A L G 34 S+ 0 0 52 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.409 130.2 65.5 -78.6 -2.8 7.5 -5.2 94.4 13 14 A A G <> S+ 0 0 0 -3,-1.6 4,-3.0 -4,-0.2 5,-0.3 0.514 73.8 89.0 -98.4 -8.0 10.8 -4.5 92.7 14 15 A H H S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.866 114.9 51.6 -64.0 -35.7 8.5 -2.7 87.8 16 17 A I H > S+ 0 0 0 -4,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.935 109.8 47.9 -67.9 -46.9 11.4 -0.7 89.4 17 18 A R H X S+ 0 0 2 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.937 113.2 49.3 -59.0 -46.2 14.1 -2.9 87.9 18 19 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.910 112.2 47.6 -60.6 -41.6 12.4 -2.7 84.5 19 20 A L H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.894 109.7 52.5 -68.1 -39.7 12.1 1.1 84.7 20 21 A L H <>S+ 0 0 0 -4,-2.7 5,-2.7 2,-0.2 -2,-0.2 0.910 112.7 46.0 -58.9 -43.1 15.8 1.4 85.8 21 22 A E H ><5S+ 0 0 35 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.914 110.9 51.7 -66.4 -44.0 16.7 -0.7 82.7 22 23 A Y H 3<5S+ 0 0 60 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.839 111.1 47.9 -62.0 -35.1 14.5 1.3 80.3 23 24 A T T 3<5S- 0 0 16 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.314 111.7-118.8 -88.8 6.6 16.0 4.6 81.5 24 25 A D T < 5 + 0 0 112 -3,-1.5 -3,-0.2 1,-0.2 2,-0.2 0.841 51.5 176.6 58.0 36.0 19.6 3.3 81.1 25 26 A S < - 0 0 19 -5,-2.7 2,-0.7 -6,-0.2 -1,-0.2 -0.469 31.7-129.3 -75.2 141.1 20.1 3.9 84.8 26 27 A S + 0 0 83 -2,-0.2 -24,-2.5 -23,-0.0 2,-0.3 -0.827 49.7 146.0 -89.5 115.3 23.4 2.9 86.5 27 28 A Y E -a 2 0A 9 -2,-0.7 2,-0.3 -26,-0.3 -24,-0.2 -0.982 38.0-152.4-149.1 156.1 22.5 0.9 89.5 28 29 A E E -a 3 0A 119 -26,-2.9 -24,-2.6 -2,-0.3 2,-0.5 -0.942 24.0-129.1-123.9 153.6 23.6 -2.0 91.7 29 30 A E E -a 4 0A 39 -2,-0.3 2,-0.7 -26,-0.2 -24,-0.2 -0.878 4.6-153.8-108.3 131.4 21.2 -4.2 93.7 30 31 A K E -a 5 0A 76 -26,-2.2 -24,-2.0 -2,-0.5 2,-0.5 -0.936 25.7-157.5 -96.4 113.1 21.5 -5.1 97.4 31 32 A K E -a 6 0A 111 -2,-0.7 2,-0.4 -26,-0.2 -24,-0.2 -0.826 7.0-160.8-102.7 124.1 19.8 -8.4 97.6 32 33 A Y E -a 7 0A 0 -26,-2.3 -24,-2.2 -2,-0.5 2,-0.5 -0.833 4.7-153.2-104.0 142.0 18.3 -9.7 100.8 33 34 A T - 0 0 71 -2,-0.4 11,-0.4 -26,-0.2 2,-0.2 -0.963 7.0-143.4-121.4 128.3 17.5 -13.4 101.5 34 35 A M - 0 0 12 -2,-0.5 8,-0.2 1,-0.1 7,-0.1 -0.489 21.5-114.9 -80.3 151.1 14.9 -14.6 103.9 35 36 A G - 0 0 17 6,-2.4 175,-0.1 -2,-0.2 -1,-0.1 -0.248 38.2 -93.0 -75.1 174.0 15.3 -17.8 106.0 36 37 A D >> - 0 0 109 1,-0.2 4,-2.2 4,-0.1 5,-0.5 -0.185 59.7 -27.1 -86.8 175.7 13.1 -20.9 105.6 37 38 A A T 45S+ 0 0 61 1,-0.3 -1,-0.2 2,-0.2 174,-0.0 -0.256 108.2 18.3 -63.5 153.3 9.9 -22.1 107.3 38 39 A P T 45S+ 0 0 115 0, 0.0 -1,-0.3 0, 0.0 -3,-0.0 -0.995 134.3 27.5 -87.4 -9.8 8.4 -21.9 109.8 39 40 A D T 45S- 0 0 119 -3,-0.4 -2,-0.2 2,-0.0 3,-0.2 0.718 78.1-150.9 -89.0 -22.8 10.1 -18.7 111.0 40 41 A Y T <5 - 0 0 57 -4,-2.2 -4,-0.1 1,-0.2 -3,-0.1 0.930 24.7-136.0 48.4 55.5 11.2 -17.1 107.7 41 42 A D < - 0 0 81 -5,-0.5 -6,-2.4 1,-0.2 3,-0.3 -0.155 27.6-176.2 -45.8 115.7 14.2 -15.4 109.3 42 43 A R >> + 0 0 106 -8,-0.2 4,-2.4 -3,-0.2 3,-1.8 0.263 45.0 120.3-100.3 11.0 14.5 -11.8 108.2 43 44 A S H 3> + 0 0 39 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.792 63.2 64.1 -49.1 -40.5 17.7 -11.2 110.0 44 45 A Q H 34 S+ 0 0 79 -11,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.835 117.0 30.1 -56.7 -34.0 19.8 -10.3 106.9 45 46 A W H X> S+ 0 0 9 -3,-1.8 3,-1.9 2,-0.1 4,-1.4 0.892 118.8 52.8 -84.9 -49.6 17.5 -7.2 106.4 46 47 A L H 3< S+ 0 0 87 -4,-2.4 4,-0.4 1,-0.3 -2,-0.2 0.799 100.0 63.6 -63.4 -30.2 16.5 -6.4 110.0 47 48 A N T 3< S+ 0 0 105 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.1 0.638 120.8 21.8 -71.4 -13.1 20.2 -6.4 111.1 48 49 A E T X4 S+ 0 0 54 -3,-1.9 3,-2.0 -5,-0.2 -2,-0.2 0.365 89.9 106.9-130.9 3.4 20.8 -3.3 108.8 49 50 A K T 3< S+ 0 0 53 -4,-1.4 3,-0.4 1,-0.3 5,-0.3 0.821 89.8 38.8 -48.0 -40.6 17.2 -1.8 108.3 50 51 A F T 3 S+ 0 0 156 -4,-0.4 -1,-0.3 1,-0.2 3,-0.2 0.252 104.1 70.8-100.7 14.6 18.0 1.1 110.6 51 52 A K S < S+ 0 0 171 -3,-2.0 -1,-0.2 1,-0.1 -2,-0.1 0.156 80.6 74.3-114.9 15.5 21.6 1.7 109.4 52 53 A L S S- 0 0 45 -3,-0.4 -1,-0.1 -4,-0.1 -2,-0.1 0.406 100.8-111.9-114.6 -1.3 20.9 3.0 105.9 53 54 A G + 0 0 55 1,-0.3 2,-0.3 -3,-0.2 15,-0.1 0.644 61.9 153.9 79.0 15.1 19.6 6.6 106.5 54 55 A L - 0 0 15 -5,-0.3 -1,-0.3 1,-0.1 -2,-0.1 -0.583 42.5-146.3 -79.8 137.5 16.1 5.8 105.4 55 56 A D S S+ 0 0 135 1,-0.3 -1,-0.1 13,-0.3 14,-0.1 0.878 99.5 16.8 -68.9 -38.6 13.3 8.0 106.9 56 57 A F S S- 0 0 158 2,-0.1 -1,-0.3 -3,-0.0 15,-0.1 -0.758 96.1-138.4-133.7 78.3 10.8 5.1 107.0 57 58 A P + 0 0 27 0, 0.0 2,-0.3 0, 0.0 -7,-0.1 -0.121 45.3 130.8 -50.0 132.9 13.0 2.0 106.6 58 59 A N - 0 0 68 -9,-0.1 -2,-0.1 13,-0.0 -4,-0.0 -0.969 51.2 -70.9-168.5 168.0 11.4 -0.5 104.2 59 60 A L S S+ 0 0 13 -2,-0.3 -53,-0.2 1,-0.1 13,-0.1 -0.992 103.7 41.2-120.6 132.7 11.9 -2.7 101.2 60 61 A P S S+ 0 0 2 0, 0.0 11,-0.7 0, 0.0 2,-0.3 0.512 77.6 168.2 -75.9 157.5 12.3 -1.8 98.4 61 62 A Y E -BC 5 70A 4 -56,-1.9 -56,-2.6 9,-0.2 2,-0.4 -0.960 21.2-153.6-130.0 154.4 14.5 1.2 98.9 62 63 A L E -BC 4 69A 1 7,-2.7 7,-2.9 -2,-0.3 2,-0.5 -0.998 2.9-164.8-127.6 126.1 16.5 3.3 96.4 63 64 A I E +BC 3 68A 31 -60,-2.6 -60,-2.4 -2,-0.4 2,-0.3 -0.962 14.5 168.2-107.3 119.9 19.6 5.2 97.3 64 65 A D E > - C 0 67A 37 3,-3.1 3,-2.1 -2,-0.5 2,-0.4 -0.782 65.0 -72.2-133.7 88.7 20.6 7.8 94.6 65 66 A G T 3 S- 0 0 61 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.475 119.0 -6.8 59.9-116.0 23.3 10.0 96.2 66 67 A T T 3 S+ 0 0 126 -2,-0.4 2,-0.6 -3,-0.1 -1,-0.3 0.673 117.8 94.0 -81.9 -20.9 21.6 12.1 98.8 67 68 A H E < -C 64 0A 101 -3,-2.1 -3,-3.1 2,-0.0 2,-0.5 -0.653 51.6-179.9 -77.8 118.3 18.1 10.9 97.8 68 69 A K E -C 63 0A 80 -2,-0.6 2,-0.4 -5,-0.2 -13,-0.3 -0.983 11.3-178.2-123.0 116.9 17.0 8.0 99.9 69 70 A I E +C 62 0A 28 -7,-2.9 -7,-2.7 -2,-0.5 2,-0.3 -0.951 15.0 178.7-128.6 132.5 13.6 6.7 98.9 70 71 A T E +C 61 0A 17 -2,-0.4 -9,-0.2 -9,-0.2 4,-0.1 -0.773 47.8 71.5-119.0 175.1 11.2 4.0 100.2 71 72 A Q S >> S- 0 0 112 -11,-0.7 4,-2.3 -2,-0.3 3,-0.6 0.752 74.1-122.3 79.0 112.1 7.7 3.1 99.0 72 73 A S H 3> S+ 0 0 7 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.848 111.3 50.0 -52.6 -43.5 7.7 1.3 95.6 73 74 A N H 3> S+ 0 0 33 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.867 110.2 51.2 -63.9 -36.6 5.4 3.9 94.0 74 75 A A H <> S+ 0 0 41 -3,-0.6 4,-2.1 2,-0.2 -2,-0.2 0.877 109.9 49.7 -66.4 -38.4 7.5 6.8 95.3 75 76 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.940 111.8 48.4 -64.8 -46.9 10.6 5.1 93.8 76 77 A L H X S+ 0 0 1 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.934 112.9 47.1 -58.4 -47.4 8.9 4.6 90.4 77 78 A R H X S+ 0 0 59 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.864 109.3 55.0 -64.7 -36.2 7.7 8.2 90.4 78 79 A Y H X S+ 0 0 30 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.955 113.4 40.6 -60.3 -50.9 11.2 9.5 91.3 79 80 A I H X S+ 0 0 2 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.916 114.8 53.4 -63.6 -43.0 12.8 7.7 88.4 80 81 A A H ><>S+ 0 0 0 -4,-2.8 5,-2.9 -5,-0.2 3,-0.6 0.906 107.0 49.9 -60.7 -44.5 9.9 8.6 86.0 81 82 A R H ><5S+ 0 0 155 -4,-2.7 3,-1.1 1,-0.2 -1,-0.2 0.892 106.2 57.3 -61.3 -38.5 10.2 12.3 86.8 82 83 A K H 3<5S+ 0 0 108 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.786 116.8 34.7 -60.7 -30.8 13.9 12.2 86.1 83 84 A H T <<5S- 0 0 71 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.111 112.1-109.2-116.8 18.9 13.3 10.8 82.6 84 85 A N T < 5S+ 0 0 109 -3,-1.1 -3,-0.2 -4,-0.2 -4,-0.1 0.886 71.6 140.4 56.5 42.7 10.0 12.6 81.6 85 86 A L < + 0 0 18 -5,-2.9 69,-2.6 -8,-0.1 2,-0.3 -0.222 38.4 99.3-110.4 44.5 8.0 9.4 81.9 86 87 A C S S- 0 0 23 67,-0.2 7,-0.1 -6,-0.2 2,-0.1 -0.825 82.0 -85.6-124.8 161.4 4.9 10.8 83.5 87 88 A G - 0 0 10 -2,-0.3 -1,-0.0 5,-0.2 -2,-0.0 -0.387 36.6-171.0 -61.7 145.3 1.4 11.9 82.4 88 89 A E + 0 0 115 -2,-0.1 -1,-0.1 0, 0.0 2,-0.0 0.818 59.3 59.5-107.9 -53.3 1.4 15.5 81.2 89 90 A S S > S- 0 0 55 1,-0.1 4,-2.5 4,-0.0 5,-0.2 -0.312 89.2-109.4 -77.0 163.4 -2.2 16.6 80.6 90 91 A E H > S+ 0 0 128 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.929 120.6 50.5 -58.1 -46.0 -4.9 16.6 83.4 91 92 A K H > S+ 0 0 166 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.905 111.2 49.3 -61.1 -41.2 -6.7 13.6 81.8 92 93 A E H > S+ 0 0 52 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.896 110.6 49.9 -63.4 -41.2 -3.4 11.7 81.7 93 94 A Q H X S+ 0 0 76 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.883 110.3 50.1 -68.1 -36.4 -2.6 12.5 85.3 94 95 A I H X S+ 0 0 73 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.948 112.7 46.7 -63.5 -47.8 -6.0 11.4 86.5 95 96 A R H X S+ 0 0 42 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.909 111.7 52.7 -58.3 -43.7 -5.6 8.1 84.5 96 97 A E H X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.926 112.5 43.3 -58.1 -48.8 -2.1 7.7 86.0 97 98 A D H X S+ 0 0 67 -4,-2.4 4,-1.8 2,-0.2 5,-0.2 0.901 114.1 49.5 -69.4 -42.1 -3.3 8.2 89.6 98 99 A I H X S+ 0 0 88 -4,-2.7 4,-2.9 -5,-0.2 -2,-0.2 0.963 116.1 43.5 -58.3 -50.4 -6.3 5.9 89.2 99 100 A L H X S+ 0 0 3 -4,-2.8 4,-3.2 -5,-0.2 5,-0.3 0.879 108.0 56.8 -66.8 -39.5 -4.2 3.2 87.6 100 101 A E H X S+ 0 0 16 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.940 117.3 36.3 -55.7 -47.4 -1.3 3.4 90.1 101 102 A N H X S+ 0 0 90 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.886 116.9 51.5 -75.4 -38.2 -3.7 2.8 92.9 102 103 A Q H X S+ 0 0 84 -4,-2.9 4,-2.4 -5,-0.2 -2,-0.2 0.931 110.6 48.9 -64.8 -46.2 -6.0 0.3 91.1 103 104 A F H X S+ 0 0 0 -4,-3.2 4,-2.8 1,-0.2 -1,-0.2 0.877 108.8 54.1 -62.2 -38.1 -3.0 -1.8 90.0 104 105 A M H X S+ 0 0 35 -4,-1.5 4,-2.6 -5,-0.3 -1,-0.2 0.914 107.7 49.9 -60.0 -42.6 -1.8 -1.8 93.6 105 106 A D H X S+ 0 0 81 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.935 112.6 47.2 -59.7 -45.8 -5.2 -3.1 94.8 106 107 A S H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.918 111.1 51.6 -60.2 -45.0 -5.0 -5.8 92.1 107 108 A R H X S+ 0 0 24 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.931 110.7 48.2 -57.0 -47.1 -1.4 -6.7 93.2 108 109 A M H X S+ 0 0 99 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.838 105.6 58.4 -67.0 -33.0 -2.5 -6.9 96.8 109 110 A Q H X S+ 0 0 104 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.932 110.8 41.9 -62.3 -43.9 -5.4 -9.2 96.0 110 111 A L H X S+ 0 0 3 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.924 115.9 48.8 -70.0 -42.3 -3.1 -11.7 94.4 111 112 A A H X S+ 0 0 22 -4,-2.4 4,-1.9 2,-0.2 5,-0.2 0.916 108.6 53.8 -63.6 -42.0 -0.5 -11.5 97.1 112 113 A K H X S+ 0 0 160 -4,-2.9 4,-0.7 1,-0.2 -1,-0.2 0.930 112.8 44.7 -58.5 -46.0 -3.1 -11.8 99.9 113 114 A L H >< S+ 0 0 12 -4,-1.8 3,-0.9 -5,-0.2 -1,-0.2 0.934 113.4 48.3 -59.2 -50.3 -4.3 -15.1 98.2 114 115 A C H 3< S+ 0 0 0 -4,-2.6 99,-3.2 1,-0.3 100,-1.2 0.703 113.5 46.8 -74.3 -19.7 -0.9 -16.5 97.6 115 116 A Y H 3< S+ 0 0 80 -4,-1.9 -1,-0.3 97,-0.3 -2,-0.2 0.523 89.7 104.3 -93.4 -8.9 0.3 -15.9 101.1 116 117 A D X< - 0 0 52 -3,-0.9 3,-1.8 -4,-0.7 6,-0.1 -0.596 69.1-142.3 -77.9 126.6 -2.8 -17.3 102.7 117 118 A P T 3 S+ 0 0 122 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.807 105.1 59.8 -53.5 -29.5 -2.4 -20.8 104.2 118 119 A D T >> + 0 0 65 1,-0.2 4,-1.8 2,-0.1 3,-0.7 0.067 69.9 132.5 -87.3 24.3 -6.0 -21.4 102.9 119 120 A F H <> + 0 0 7 -3,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.835 65.3 53.1 -41.2 -51.1 -4.7 -20.8 99.3 120 121 A E H 34 S+ 0 0 129 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.890 112.2 42.5 -61.4 -42.2 -6.3 -23.9 97.8 121 122 A K H <4 S+ 0 0 161 -3,-0.7 4,-0.3 1,-0.2 -1,-0.2 0.780 118.8 46.2 -75.2 -25.3 -9.8 -23.2 99.1 122 123 A L H X S+ 0 0 46 -4,-1.8 4,-1.5 -3,-0.2 3,-0.4 0.648 91.0 82.6 -90.9 -19.2 -9.6 -19.4 98.2 123 124 A K H X S+ 0 0 70 -4,-1.8 4,-2.8 -5,-0.2 5,-0.2 0.885 84.2 57.1 -58.3 -47.1 -8.1 -19.8 94.7 124 125 A P H > S+ 0 0 80 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.875 104.9 53.1 -53.7 -38.9 -11.5 -20.4 92.9 125 126 A E H > S+ 0 0 138 -3,-0.4 4,-1.6 -4,-0.3 -2,-0.2 0.935 111.7 44.8 -61.5 -47.2 -12.9 -17.1 94.2 126 127 A Y H X S+ 0 0 22 -4,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.943 114.7 48.6 -61.7 -47.5 -9.9 -15.2 92.9 127 128 A L H < S+ 0 0 34 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.846 109.0 52.6 -64.8 -32.8 -10.0 -17.0 89.6 128 129 A Q H < S+ 0 0 155 -4,-2.4 4,-0.4 -5,-0.2 -1,-0.2 0.860 113.7 44.3 -69.6 -32.8 -13.7 -16.4 89.1 129 130 A A H X S+ 0 0 46 -4,-1.6 4,-1.9 -3,-0.2 3,-0.3 0.658 94.2 83.6 -82.2 -17.9 -13.2 -12.7 89.7 130 131 A L H X S+ 0 0 2 -4,-1.3 4,-2.7 1,-0.2 5,-0.3 0.883 83.8 53.7 -61.4 -48.1 -10.1 -12.4 87.5 131 132 A P H > S+ 0 0 72 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.885 109.6 49.5 -54.9 -41.4 -11.9 -12.0 84.1 132 133 A E H > S+ 0 0 133 -4,-0.4 4,-2.0 -3,-0.3 -2,-0.2 0.915 111.1 50.1 -58.9 -46.9 -13.9 -9.1 85.4 133 134 A M H X S+ 0 0 22 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.946 114.4 43.5 -56.6 -49.2 -10.8 -7.4 86.8 134 135 A L H X S+ 0 0 1 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.875 107.8 59.3 -70.0 -35.5 -9.0 -7.8 83.5 135 136 A K H X S+ 0 0 113 -4,-2.6 4,-3.0 -5,-0.3 5,-0.2 0.911 103.8 52.5 -57.2 -42.3 -12.0 -6.7 81.4 136 137 A L H X S+ 0 0 107 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.925 111.3 45.6 -62.6 -42.4 -11.9 -3.4 83.3 137 138 A Y H X S+ 0 0 7 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.903 113.1 51.0 -64.6 -41.4 -8.2 -2.9 82.4 138 139 A S H X S+ 0 0 18 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.923 110.1 48.7 -61.7 -45.8 -8.8 -3.9 78.8 139 140 A Q H < S+ 0 0 121 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.901 111.8 50.1 -60.1 -41.4 -11.7 -1.4 78.5 140 141 A F H < S+ 0 0 65 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.907 111.0 48.1 -66.8 -39.8 -9.6 1.3 80.0 141 142 A L H >< S+ 0 0 2 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.889 82.4 163.2 -65.5 -42.1 -6.6 0.7 77.6 142 143 A G T 3< - 0 0 32 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.1 -0.284 68.7 -27.4 57.1-135.4 -8.8 0.6 74.5 143 144 A K T 3 S+ 0 0 213 3,-0.0 -1,-0.2 2,-0.0 -2,-0.1 0.374 105.2 116.8 -93.7 1.5 -6.9 0.9 71.2 144 145 A Q < - 0 0 58 -3,-1.6 6,-0.1 1,-0.1 3,-0.0 -0.403 65.9-135.9 -71.7 146.9 -4.0 3.0 72.8 145 146 A P S S+ 0 0 34 0, 0.0 2,-0.3 0, 0.0 5,-0.1 0.830 89.1 25.4 -68.9 -29.8 -0.5 1.5 72.7 146 147 A W B > S-D 149 0B 23 3,-1.7 3,-1.5 -5,-0.1 5,-0.1 -0.863 90.1-103.3-134.4 163.7 0.1 2.6 76.3 147 148 A F T 3 S+ 0 0 0 -2,-0.3 3,-0.1 1,-0.3 5,-0.1 0.781 121.0 40.1 -67.2 -24.8 -2.1 3.2 79.3 148 149 A L T 3 S- 0 0 9 3,-0.4 2,-0.4 1,-0.2 -1,-0.3 0.397 123.0 -98.4-100.0 4.6 -1.8 7.0 79.1 149 150 A G B < S-D 146 0B 10 -3,-1.5 -3,-1.7 1,-0.1 -1,-0.2 -0.977 83.8 -6.2 125.0-126.5 -2.0 7.1 75.3 150 151 A D S S+ 0 0 146 -2,-0.4 2,-0.5 -5,-0.1 -1,-0.1 0.561 116.0 73.3 -87.9 -8.8 0.8 7.4 72.7 151 152 A K S S- 0 0 51 -5,-0.1 -3,-0.4 -3,-0.0 2,-0.2 -0.915 79.6-128.2-110.1 127.8 3.6 7.9 75.2 152 153 A I + 0 0 15 -2,-0.5 2,-0.3 -5,-0.1 -2,-0.1 -0.514 37.4 173.2 -71.6 140.8 5.0 5.2 77.5 153 154 A T >> - 0 0 0 -2,-0.2 3,-1.5 -57,-0.0 4,-0.6 -0.838 47.4 -84.7-142.4 176.8 5.0 6.2 81.2 154 155 A F H >> S+ 0 0 0 -69,-2.6 4,-1.3 1,-0.3 3,-1.3 0.818 118.8 65.6 -63.2 -29.7 5.7 4.7 84.6 155 156 A V H 3> S+ 0 0 0 1,-0.3 4,-2.9 -70,-0.2 -1,-0.3 0.798 92.6 63.2 -65.9 -23.5 2.2 3.3 85.0 156 157 A D H <> S+ 0 0 0 -3,-1.5 4,-2.5 2,-0.2 -1,-0.3 0.803 100.2 53.6 -64.2 -29.2 2.9 1.0 82.0 157 158 A F H < S- 0 0 62 -4,-2.9 3,-2.4 -5,-0.1 -1,-0.3 -0.849 75.3-159.9-136.3 88.9 -3.4 -18.3 85.2 171 172 A P T 3 S+ 0 0 93 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.723 88.0 44.4 -48.2 -31.4 -1.7 -18.8 81.8 172 173 A S T >> S+ 0 0 71 1,-0.2 3,-1.3 2,-0.1 4,-0.5 0.399 80.4 104.1 -93.8 2.6 -4.8 -18.1 79.7 173 174 A C T <4 S+ 0 0 15 -3,-2.4 3,-0.2 1,-0.3 -1,-0.2 0.711 83.4 43.0 -66.9 -23.6 -6.2 -15.1 81.5 174 175 A L T >4 S+ 0 0 0 -3,-0.3 3,-2.0 -4,-0.2 7,-0.5 0.557 89.9 88.9 -92.6 -9.6 -5.1 -12.4 78.9 175 176 A D T <4 S+ 0 0 84 -3,-1.3 -2,-0.2 1,-0.3 -1,-0.1 0.827 83.8 54.5 -60.9 -34.3 -6.2 -14.5 75.9 176 177 A A T 3< S+ 0 0 76 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.550 104.5 61.1 -72.4 -9.5 -9.8 -13.1 75.9 177 178 A F X> - 0 0 27 -3,-2.0 4,-2.2 1,-0.2 3,-0.9 -0.789 63.0-177.1-125.2 82.7 -8.4 -9.5 75.8 178 179 A P H 3> S+ 0 0 85 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.867 82.9 55.7 -53.4 -39.1 -6.3 -9.0 72.7 179 180 A N H 3> S+ 0 0 34 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.868 108.8 47.2 -63.1 -34.0 -5.3 -5.5 73.6 180 181 A L H <> S+ 0 0 0 -3,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.912 112.9 49.2 -70.9 -41.9 -3.8 -6.7 76.9 181 182 A K H X S+ 0 0 80 -4,-2.2 4,-2.0 -7,-0.5 -2,-0.2 0.924 113.5 46.7 -56.5 -47.4 -2.0 -9.5 75.1 182 183 A D H X S+ 0 0 91 -4,-2.9 4,-2.5 -5,-0.2 -1,-0.2 0.836 108.9 55.5 -67.4 -34.5 -0.7 -7.0 72.6 183 184 A F H X S+ 0 0 0 -4,-1.9 4,-2.7 -5,-0.2 -1,-0.2 0.925 106.9 49.7 -62.1 -46.8 0.3 -4.7 75.4 184 185 A I H X S+ 0 0 9 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.925 113.7 45.9 -55.3 -47.3 2.4 -7.4 77.0 185 186 A S H X S+ 0 0 77 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.895 112.3 50.9 -65.4 -40.7 4.1 -8.1 73.7 186 187 A R H X S+ 0 0 86 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.920 112.4 46.1 -65.1 -43.8 4.7 -4.4 73.0 187 188 A F H >< S+ 0 0 0 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.949 114.3 47.1 -62.9 -49.3 6.3 -3.8 76.4 188 189 A E H 3< S+ 0 0 58 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.750 107.9 59.2 -63.6 -26.1 8.5 -6.9 76.1 189 190 A G H 3< S+ 0 0 55 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.554 73.5 115.2 -83.5 -11.6 9.5 -5.9 72.6 190 191 A L S S+ 0 0 181 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.887 110.0 41.7 -46.2 -54.7 14.7 -2.7 72.8 192 193 A K H > S+ 0 0 84 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.824 117.3 47.5 -69.5 -33.0 15.9 -2.0 76.4 193 194 A I H > S+ 0 0 0 -3,-0.3 4,-3.0 -6,-0.2 5,-0.2 0.938 112.9 48.7 -70.6 -47.8 13.3 -4.3 77.9 194 195 A S H X S+ 0 0 34 -4,-3.3 4,-2.2 2,-0.2 -2,-0.2 0.920 110.9 50.0 -57.1 -48.3 14.0 -7.1 75.5 195 196 A A H X S+ 0 0 65 -4,-2.6 4,-0.5 -5,-0.3 -1,-0.2 0.895 114.3 45.9 -58.7 -42.0 17.8 -6.8 76.1 196 197 A Y H >< S+ 0 0 4 -4,-1.6 3,-1.1 -5,-0.2 6,-0.6 0.944 112.2 49.2 -66.3 -47.8 17.3 -7.0 79.8 197 198 A M H 3< S+ 0 0 44 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.827 110.5 50.6 -65.0 -32.9 14.8 -9.8 79.7 198 199 A K H 3< S+ 0 0 172 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.583 100.8 85.4 -79.9 -10.9 17.1 -11.9 77.5 199 200 A S S X< S- 0 0 48 -3,-1.1 3,-1.1 -4,-0.5 -3,-0.0 -0.444 90.7-113.5 -88.1 165.2 20.1 -11.2 79.9 200 201 A S T 3 S+ 0 0 131 1,-0.2 -1,-0.1 -2,-0.1 -4,-0.1 0.641 109.4 71.6 -69.9 -15.3 21.0 -13.2 83.1 201 202 A R T 3 S+ 0 0 102 -5,-0.2 -1,-0.2 2,-0.1 2,-0.2 0.651 71.8 104.0 -77.4 -18.8 20.1 -10.1 85.2 202 203 A F < - 0 0 34 -3,-1.1 3,-0.1 -6,-0.6 -5,-0.0 -0.474 54.9-164.6 -67.5 132.4 16.4 -10.5 84.6 203 204 A L + 0 0 38 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.716 27.6 152.4-124.8 80.0 14.6 -12.0 87.7 204 205 A P + 0 0 26 0, 0.0 -1,-0.1 0, 0.0 -194,-0.1 0.688 52.4 93.1 -80.2 -17.8 11.2 -13.3 86.8 205 206 A R + 0 0 160 -3,-0.1 2,-0.1 1,-0.1 11,-0.1 -0.963 63.0 35.0-140.5 150.3 11.2 -15.9 89.6 206 207 A P - 0 0 32 0, 0.0 -196,-3.0 0, 0.0 -195,-0.3 0.585 67.0-163.4 -68.5 149.9 10.5 -16.5 92.5 207 208 A V S S+ 0 0 4 8,-0.3 -196,-2.5 -198,-0.2 2,-0.2 0.937 71.1 15.6 -67.8 -46.1 7.3 -14.3 92.2 208 209 A F S S- 0 0 8 7,-2.8 -198,-0.2 1,-0.2 7,-0.0 -0.583 93.3 -82.1-120.7 179.1 6.8 -14.1 95.9 209 210 A S > - 0 0 10 -2,-0.2 3,-1.7 -200,-0.1 -1,-0.2 -0.134 51.5 -89.1 -78.8 179.8 8.8 -14.7 99.1 210 211 A K T 3 S+ 0 0 73 1,-0.3 -173,-0.1 -175,-0.1 6,-0.1 0.725 121.3 66.9 -63.8 -21.9 9.4 -18.0 100.9 211 212 A M T 3 S+ 0 0 74 -171,-0.1 -1,-0.3 -175,-0.1 5,-0.1 0.668 80.0 103.9 -72.0 -20.1 6.3 -17.5 103.0 212 213 A A < - 0 0 4 -3,-1.7 -97,-0.3 1,-0.1 4,-0.2 -0.329 62.6-150.8 -70.3 145.2 4.0 -17.8 99.9 213 214 A V S S+ 0 0 69 -99,-3.2 2,-0.4 1,-0.2 -98,-0.2 0.819 92.2 34.5 -78.4 -35.2 2.0 -21.0 99.2 214 215 A W S S+ 0 0 65 -100,-1.2 -1,-0.2 1,-0.1 -45,-0.0 -0.973 123.4 17.7-119.6 137.8 2.2 -20.2 95.5 215 216 A G S S+ 0 0 11 -2,-0.4 -7,-2.8 -3,-0.1 -8,-0.3 0.657 74.8 128.1 84.5 18.7 5.2 -18.6 93.8 216 217 A N 0 0 45 -4,-0.2 -2,-0.1 -9,-0.2 -3,-0.0 0.587 360.0 360.0 -82.1 -11.0 7.7 -19.2 96.5 217 218 A K 0 0 193 -8,-0.0 -1,-0.1 -208,-0.0 -7,-0.1 0.449 360.0 360.0-133.4 360.0 10.1 -20.7 93.9