==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT 03-JUN-09 3HPC . COMPND 2 MOLECULE: SNX5 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR L.M.I.KOHARUDIN,W.FUREY,A.M.GRONENBORN . 155 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10572.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 103 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 11.6 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 . 1 0.6 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 . 9 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 39.4 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+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 0 0 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 X S 0 0 173 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 4.6 1.0 25.7 3.4 2 21 X V + 0 0 131 1,-0.1 2,-0.2 2,-0.0 0, 0.0 -0.325 360.0 176.6 -64.6 136.7 0.4 22.2 4.8 3 22 X S + 0 0 116 2,-0.0 2,-0.4 -2,-0.0 -1,-0.1 -0.707 12.8 165.6-147.4 85.3 -2.7 20.6 3.2 4 23 X V - 0 0 93 -2,-0.2 2,-0.5 2,-0.0 -2,-0.0 -0.877 35.0-138.8-120.4 132.7 -3.2 17.0 4.4 5 24 X D - 0 0 147 -2,-0.4 2,-0.4 2,-0.0 -2,-0.0 -0.860 31.3-150.5 -83.1 123.0 -6.0 14.4 4.2 6 25 X L - 0 0 138 -2,-0.5 2,-0.4 2,-0.0 -2,-0.0 -0.800 15.0-168.1-107.4 141.0 -6.2 12.7 7.6 7 26 X N - 0 0 138 -2,-0.4 2,-0.5 3,-0.0 -2,-0.0 -0.967 6.4-169.5-128.4 125.2 -7.3 9.2 8.3 8 27 X V - 0 0 121 -2,-0.4 -2,-0.0 1,-0.1 0, 0.0 -0.974 64.9 -33.7-126.1 113.8 -7.9 8.1 11.8 9 28 X D S S- 0 0 149 -2,-0.5 -1,-0.1 1,-0.1 26,-0.1 0.833 75.3-155.1 48.1 57.1 -8.5 4.5 12.8 10 29 X P - 0 0 51 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.222 11.0-138.2 -60.7 147.1 -10.3 3.5 9.6 11 30 X S S S+ 0 0 57 1,-0.2 24,-2.0 23,-0.1 25,-0.8 0.724 84.0 26.0 -83.9 -19.7 -12.6 0.5 10.0 12 31 X L E +A 34 0A 18 22,-0.2 2,-0.4 23,-0.1 22,-0.2 -0.963 62.5 172.7-149.2 119.2 -11.8 -1.4 6.8 13 32 X Q E -A 33 0A 84 20,-2.7 20,-2.4 -2,-0.4 2,-0.4 -0.985 6.5-175.7-132.7 123.5 -8.6 -1.2 4.8 14 33 X I E +A 32 0A 5 -2,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.975 10.4 159.9-125.5 135.0 -7.8 -3.4 1.8 15 34 X D E -A 31 0A 50 16,-2.5 16,-2.9 -2,-0.4 3,-0.1 -0.880 40.3-129.6-142.5 166.7 -4.6 -3.6 -0.2 16 35 X I E + 0 0 10 -2,-0.3 14,-0.2 14,-0.2 109,-0.1 -0.907 30.9 171.8-116.0 92.2 -2.7 -5.8 -2.6 17 36 X P E + 0 0 73 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.656 65.0 15.9 -81.8 -14.6 0.8 -5.9 -1.0 18 37 X D E -A 29 0A 91 11,-0.5 11,-2.4 -3,-0.1 2,-0.3 -0.988 60.7-175.5-155.3 149.0 2.2 -8.6 -3.3 19 38 X A E -A 28 0A 32 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.983 12.8-145.5-147.1 155.1 1.4 -10.2 -6.6 20 39 X L E -A 27 0A 80 7,-2.4 7,-2.7 -2,-0.3 2,-0.5 -0.965 4.7-163.5-125.5 129.1 2.9 -13.1 -8.6 21 40 X S E +A 26 0A 30 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.952 9.6 178.2-111.1 128.0 3.1 -13.4 -12.4 22 41 X E E > S-A 25 0A 105 3,-2.3 3,-2.0 -2,-0.5 -2,-0.0 -0.966 80.1 -18.6-130.5 116.4 3.8 -16.9 -13.8 23 42 X R T 3 S- 0 0 227 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.894 128.7 -56.0 42.0 48.5 3.9 -17.1 -17.6 24 43 X D T 3 S+ 0 0 38 1,-0.2 2,-0.4 55,-0.0 -1,-0.3 0.455 111.3 122.0 71.2 8.2 2.0 -13.8 -17.5 25 44 X K E < -A 22 0A 147 -3,-2.0 -3,-2.3 24,-0.0 2,-0.4 -0.882 54.0-141.5 -99.3 133.1 -0.9 -15.1 -15.3 26 45 X V E -A 21 0A 9 -2,-0.4 2,-0.5 -5,-0.2 24,-0.5 -0.788 19.2-168.1-108.1 133.8 -1.3 -13.2 -12.1 27 46 X K E -A 20 0A 81 -7,-2.7 -7,-2.4 -2,-0.4 2,-0.4 -0.985 18.7-156.4-112.1 117.1 -2.1 -14.2 -8.6 28 47 X F E -AB 19 48A 0 20,-3.4 20,-2.8 -2,-0.5 2,-0.7 -0.849 10.5-139.5 -93.6 133.6 -3.0 -11.2 -6.4 29 48 X T E -AB 18 47A 24 -11,-2.4 2,-0.6 -2,-0.4 -11,-0.5 -0.825 19.5-159.1 -87.6 119.7 -2.6 -11.3 -2.6 30 49 X V E - B 0 46A 0 16,-2.7 16,-2.1 -2,-0.7 2,-0.4 -0.922 9.3-167.8-107.3 117.0 -5.6 -9.5 -1.2 31 50 X H E -AB 15 45A 28 -16,-2.9 -16,-2.5 -2,-0.6 2,-0.4 -0.906 3.5-168.1-115.6 127.8 -5.0 -8.3 2.3 32 51 X T E -AB 14 44A 0 12,-2.9 12,-2.1 -2,-0.4 2,-0.4 -0.959 9.9-175.7-120.9 132.2 -7.7 -6.9 4.7 33 52 X K E +AB 13 43A 90 -20,-2.4 -20,-2.7 -2,-0.4 2,-0.3 -0.996 22.2 165.0-116.8 132.0 -7.4 -5.1 8.1 34 53 X T E -A 12 0A 8 8,-2.6 -22,-0.2 -2,-0.4 -23,-0.1 -0.997 41.8-163.9-148.8 146.3 -10.6 -4.4 9.8 35 54 X T + 0 0 110 -24,-2.0 -23,-0.1 -2,-0.3 -24,-0.1 0.315 62.6 116.1-100.4 2.4 -12.0 -3.3 13.2 36 55 X L > - 0 0 63 -25,-0.8 3,-1.1 1,-0.1 5,-0.1 -0.574 64.0-141.5 -77.0 141.8 -15.5 -4.4 12.1 37 56 X P T 3 S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.512 92.1 77.5 -81.5 -2.9 -17.2 -7.3 14.0 38 57 X T T 3 S+ 0 0 83 3,-0.0 2,-0.2 2,-0.0 -2,-0.0 0.693 81.6 79.7 -78.9 -16.6 -18.8 -8.6 10.8 39 58 X F S < S- 0 0 12 -3,-1.1 105,-0.0 1,-0.1 -5,-0.0 -0.605 84.4-127.2 -91.4 151.3 -15.4 -10.2 9.7 40 59 X Q S S+ 0 0 164 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.0 0.709 91.8 7.4 -73.4 -20.8 -14.2 -13.5 11.2 41 60 X S S S- 0 0 52 -5,-0.1 -1,-0.1 1,-0.0 3,-0.1 -0.972 73.5-115.9-152.9 167.2 -10.9 -12.0 12.2 42 61 X P S S+ 0 0 94 0, 0.0 -8,-2.6 0, 0.0 2,-0.3 0.548 98.5 21.9 -81.7 -13.8 -9.3 -8.5 12.2 43 62 X E E S+B 33 0A 112 -10,-0.2 2,-0.3 -8,-0.0 -10,-0.2 -0.900 72.8 138.9-155.7 134.5 -6.5 -9.2 9.7 44 63 X F E -B 32 0A 32 -12,-2.1 -12,-2.9 -2,-0.3 2,-0.3 -0.968 28.3-142.9-167.8 165.3 -6.3 -11.8 7.0 45 64 X S E -B 31 0A 54 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.985 10.6-176.2-141.2 152.6 -5.2 -12.4 3.4 46 65 X V E -B 30 0A 3 -16,-2.1 -16,-2.7 -2,-0.3 2,-0.5 -0.876 27.2-116.9-138.8 164.0 -6.4 -14.5 0.5 47 66 X T E -B 29 0A 66 -2,-0.3 2,-0.3 -18,-0.2 -18,-0.2 -0.958 35.2-179.7-102.8 136.0 -5.1 -15.2 -3.1 48 67 X R E -B 28 0A 1 -20,-2.8 -20,-3.4 -2,-0.5 2,-0.2 -0.969 17.1-150.2-136.9 147.0 -7.2 -14.1 -6.0 49 68 X Q >> - 0 0 41 -2,-0.3 3,-1.6 -22,-0.2 4,-1.0 -0.659 39.3-100.2-107.2 162.4 -7.0 -14.2 -9.8 50 69 X H H >> S+ 0 0 17 -24,-0.5 4,-1.9 1,-0.3 3,-0.9 0.865 120.5 61.4 -48.7 -45.0 -8.5 -11.7 -12.3 51 70 X E H 3> S+ 0 0 94 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.783 100.2 56.5 -53.0 -31.9 -11.5 -14.1 -13.0 52 71 X D H <> S+ 0 0 5 -3,-1.6 4,-1.9 2,-0.2 -1,-0.3 0.808 105.0 49.6 -71.2 -41.1 -12.5 -13.8 -9.3 53 72 X F H < S+ 0 0 1 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.935 112.7 48.4 -66.0 -45.2 -22.8 -7.0 -7.6 61 80 X T H 3< S+ 0 0 67 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.848 111.0 52.6 -66.6 -26.0 -24.1 -5.6 -10.9 62 81 X E H 3< S+ 0 0 142 -4,-2.2 2,-0.8 -5,-0.2 -1,-0.3 0.510 82.3 104.4 -85.0 -5.2 -26.6 -8.5 -11.1 63 82 X T X< - 0 0 37 -3,-1.4 3,-2.0 -4,-0.5 4,-0.0 -0.689 60.9-157.9 -80.1 109.0 -27.9 -7.8 -7.6 64 83 X T G > S+ 0 0 119 -2,-0.8 3,-1.7 1,-0.3 -1,-0.2 0.812 87.0 64.1 -63.4 -29.2 -31.3 -6.1 -8.3 65 84 X D G 3 S+ 0 0 143 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.561 95.8 62.2 -70.4 -11.0 -31.4 -4.3 -4.9 66 85 X Y G X + 0 0 36 -3,-2.0 3,-2.3 -6,-0.2 -1,-0.3 0.252 67.3 109.3 -94.4 14.3 -28.3 -2.4 -6.0 67 86 X A T < S+ 0 0 93 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.811 78.0 52.0 -60.5 -31.7 -30.0 -0.7 -8.9 68 87 X G T 3 S+ 0 0 80 -3,-0.3 -1,-0.3 -4,-0.2 2,-0.3 0.397 101.9 82.7 -83.9 4.1 -29.9 2.7 -7.1 69 88 X L S < S- 0 0 52 -3,-2.3 2,-0.7 67,-0.0 -3,-0.1 -0.749 78.2-120.7-112.4 156.4 -26.2 2.4 -6.5 70 89 X I - 0 0 145 -2,-0.3 -2,-0.1 0, 0.0 -3,-0.0 -0.843 25.2-157.4 -95.9 113.9 -23.0 3.1 -8.4 71 90 X I - 0 0 33 -2,-0.7 3,-0.1 -5,-0.0 -14,-0.0 -0.793 24.1-117.7 -84.3 134.0 -20.9 -0.1 -8.8 72 91 X P - 0 0 13 0, 0.0 55,-0.0 0, 0.0 -1,-0.0 -0.457 40.6 -92.5 -71.4 150.5 -17.2 0.7 -9.4 73 92 X P - 0 0 84 0, 0.0 3,-0.1 0, 0.0 -16,-0.0 -0.320 42.3-102.8 -65.9 146.0 -15.9 -0.5 -12.7 74 93 X A - 0 0 35 1,-0.1 -20,-0.1 -3,-0.1 2,-0.1 -0.286 39.9-106.1 -58.4 145.3 -14.3 -4.0 -13.0 75 94 X P - 0 0 5 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.419 42.9-105.2 -66.4 152.3 -10.5 -3.9 -13.2 76 95 X T - 0 0 102 1,-0.1 3,-0.1 -3,-0.1 48,-0.1 -0.495 38.2 -91.7 -82.4 157.5 -9.2 -4.8 -16.7 77 96 X K - 0 0 132 -2,-0.1 -1,-0.1 1,-0.1 43,-0.0 -0.404 49.0-102.5 -62.2 131.5 -7.6 -8.1 -17.5 78 97 X P - 0 0 23 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.331 41.9-171.0 -53.2 138.8 -3.8 -8.2 -17.1 79 98 X D + 0 0 100 37,-0.1 3,-0.2 1,-0.1 41,-0.0 -0.902 23.9 161.9-142.1 103.3 -2.2 -7.9 -20.5 80 99 X F > + 0 0 5 -2,-0.4 4,-2.3 -56,-0.2 5,-0.2 0.130 42.3 116.0-101.7 15.5 1.6 -8.4 -20.9 81 100 X D H > S+ 0 0 117 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.860 72.1 52.6 -56.3 -40.9 1.5 -9.0 -24.7 82 101 X G H > S+ 0 0 38 -3,-0.2 4,-1.9 2,-0.2 3,-0.2 0.983 114.6 35.8 -63.7 -62.5 3.5 -5.8 -25.5 83 102 X P H > S+ 0 0 4 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.894 116.2 56.6 -61.8 -34.2 6.6 -6.3 -23.3 84 103 X R H X S+ 0 0 104 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.886 107.1 48.2 -61.8 -43.9 6.5 -10.1 -23.8 85 104 X E H X S+ 0 0 111 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.871 111.1 50.5 -65.9 -39.3 6.7 -9.7 -27.6 86 105 X K H X S+ 0 0 100 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.882 108.4 53.3 -66.8 -38.3 9.6 -7.2 -27.3 87 106 X M H X S+ 0 0 44 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.904 107.3 51.1 -59.8 -40.5 11.4 -9.7 -25.0 88 107 X Q H X S+ 0 0 126 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.910 112.9 45.4 -66.2 -39.3 11.0 -12.4 -27.6 89 108 X K H X S+ 0 0 125 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.929 112.1 52.0 -68.9 -46.7 12.5 -10.2 -30.4 90 109 X L H >< S+ 0 0 16 -4,-2.8 3,-1.2 1,-0.2 4,-0.4 0.940 107.5 51.4 -52.5 -52.0 15.2 -9.0 -28.1 91 110 X G H >< S+ 0 0 43 -4,-2.6 3,-1.0 1,-0.3 4,-0.2 0.860 108.0 53.0 -56.6 -35.3 16.3 -12.6 -27.2 92 111 X E H 3< S+ 0 0 140 -4,-1.4 3,-0.3 1,-0.2 -1,-0.3 0.761 109.2 50.6 -71.2 -22.9 16.4 -13.5 -30.9 93 112 X G T X< S+ 0 0 23 -3,-1.2 3,-2.1 -4,-1.1 4,-0.3 0.370 74.3 108.2-100.1 8.7 18.7 -10.5 -31.5 94 113 X E G X S+ 0 0 93 -3,-1.0 3,-1.3 -4,-0.4 -1,-0.2 0.866 77.4 53.1 -58.2 -44.8 21.3 -11.2 -28.8 95 114 X G G 3 S+ 0 0 84 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.614 105.9 55.8 -61.4 -16.6 24.0 -12.3 -31.3 96 115 X S G < S+ 0 0 112 -3,-2.1 2,-0.3 2,-0.1 -1,-0.2 0.343 103.0 55.0-101.3 -5.5 23.6 -9.0 -33.3 97 116 X M S < S- 0 0 48 -3,-1.3 0, 0.0 -4,-0.3 0, 0.0 -0.897 91.5 -91.0-126.3 162.2 24.2 -6.5 -30.6 98 117 X T > - 0 0 90 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.301 37.2-114.3 -65.7 158.3 27.0 -5.9 -28.1 99 118 X K H > S+ 0 0 169 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.890 119.3 51.6 -59.0 -39.1 26.7 -7.5 -24.6 100 119 X E H > S+ 0 0 165 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.924 110.3 46.6 -63.0 -47.2 26.4 -4.1 -23.1 101 120 X E H > S+ 0 0 70 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.905 113.1 49.4 -65.0 -44.1 23.6 -3.0 -25.5 102 121 X F H X S+ 0 0 27 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.935 110.9 48.9 -59.0 -49.9 21.7 -6.3 -24.9 103 122 X A H X S+ 0 0 52 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.900 111.8 50.4 -63.2 -35.1 22.0 -6.0 -21.1 104 123 X K H X S+ 0 0 111 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.938 112.8 44.6 -66.0 -45.4 20.7 -2.4 -21.3 105 124 X M H X S+ 0 0 64 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.897 110.9 55.7 -68.5 -36.3 17.7 -3.3 -23.5 106 125 X K H X S+ 0 0 99 -4,-3.0 4,-2.1 -5,-0.2 -1,-0.2 0.922 109.1 45.2 -59.2 -49.3 16.9 -6.3 -21.3 107 126 X Q H X S+ 0 0 140 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.903 111.8 53.8 -65.9 -34.0 16.8 -4.2 -18.1 108 127 X E H X S+ 0 0 105 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.914 109.4 46.6 -64.4 -46.3 14.7 -1.6 -20.0 109 128 X L H X S+ 0 0 15 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.853 109.3 55.0 -65.4 -34.9 12.1 -4.3 -21.1 110 129 X E H X S+ 0 0 91 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.927 107.6 50.1 -66.3 -36.7 12.0 -5.7 -17.6 111 130 X A H X S+ 0 0 58 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.885 109.5 51.0 -64.0 -43.2 11.1 -2.2 -16.4 112 131 X E H X S+ 0 0 61 -4,-2.0 4,-2.2 2,-0.2 3,-0.4 0.967 110.7 49.1 -53.0 -53.3 8.3 -1.9 -19.0 113 132 X Y H X S+ 0 0 21 -4,-2.8 4,-2.3 1,-0.3 -2,-0.2 0.888 110.3 50.5 -57.4 -48.9 7.0 -5.3 -17.8 114 133 X L H X S+ 0 0 107 -4,-2.4 4,-2.9 1,-0.2 -1,-0.3 0.828 107.7 53.7 -59.2 -36.5 7.1 -4.2 -14.2 115 134 X A H X S+ 0 0 59 -4,-2.0 4,-2.1 -3,-0.4 -2,-0.2 0.892 109.3 47.6 -66.0 -42.0 5.2 -1.0 -15.1 116 135 X V H X S+ 0 0 41 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.917 113.2 50.5 -58.9 -42.5 2.4 -3.0 -16.8 117 136 X F H X S+ 0 0 28 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.962 110.7 47.1 -65.6 -47.9 2.4 -5.2 -13.6 118 137 X K H X S+ 0 0 160 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.893 110.2 53.8 -59.0 -40.9 2.1 -2.3 -11.2 119 138 X K H X S+ 0 0 166 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.921 110.1 46.2 -64.8 -44.7 -0.7 -0.7 -13.3 120 139 X T H X S+ 0 0 11 -4,-2.3 4,-2.0 2,-0.2 5,-0.2 0.909 109.0 54.2 -67.0 -34.3 -2.8 -3.8 -13.2 121 140 X V H X S+ 0 0 26 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.920 110.5 49.9 -62.9 -36.7 -2.2 -4.3 -9.5 122 141 X S H X S+ 0 0 59 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.897 106.8 52.5 -64.9 -46.1 -3.5 -0.7 -9.3 123 142 X S H X S+ 0 0 39 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.878 115.9 41.5 -57.5 -36.1 -6.6 -1.4 -11.4 124 143 X H H X S+ 0 0 0 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.856 115.3 47.7 -82.8 -40.5 -7.4 -4.3 -9.1 125 144 X E H X S+ 0 0 48 -4,-2.7 4,-2.3 -5,-0.2 5,-0.2 0.923 108.9 52.9 -68.5 -47.9 -6.6 -2.7 -5.7 126 145 X V H X S+ 0 0 42 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.883 105.7 56.5 -55.6 -42.4 -8.6 0.6 -6.4 127 146 X F H X S+ 0 0 2 -4,-1.0 4,-2.0 -5,-0.3 -1,-0.2 0.937 110.1 43.4 -53.8 -47.8 -11.7 -1.5 -7.3 128 147 X L H X S+ 0 0 1 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.860 113.4 51.4 -68.9 -39.7 -11.6 -3.2 -3.9 129 148 X Q H X S+ 0 0 75 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.889 107.6 52.6 -67.9 -37.6 -10.9 0.0 -2.1 130 149 X R H X S+ 0 0 129 -4,-2.8 4,-0.6 1,-0.2 3,-0.3 0.917 111.1 47.5 -60.2 -41.8 -13.8 1.7 -3.8 131 150 X L H >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.914 108.3 56.0 -62.8 -42.7 -16.1 -1.2 -2.7 132 151 X S H 3< S+ 0 0 20 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.775 106.5 49.4 -63.6 -28.5 -14.7 -0.9 0.9 133 152 X S H 3< S+ 0 0 96 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.570 87.0 99.3 -90.6 -5.1 -15.7 2.8 1.2 134 153 X H S 4 S+ 0 0 61 2,-0.1 3,-1.8 3,-0.1 4,-0.2 0.831 121.0 48.1-102.8 -52.6 -23.8 -0.5 1.3 137 156 X L G >4 S+ 0 0 0 1,-0.3 3,-1.6 2,-0.2 6,-0.2 0.817 102.9 63.8 -64.5 -30.9 -21.5 -2.4 -1.0 138 157 X S G 3< S+ 0 0 20 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.1 0.717 102.7 51.2 -62.2 -17.8 -18.9 -2.8 1.7 139 158 X K G < S+ 0 0 160 -3,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.398 81.0 127.8 -95.4 -3.1 -21.4 -4.9 3.7 140 159 X D <> - 0 0 11 -3,-1.6 4,-2.4 -4,-0.2 5,-0.1 -0.330 59.0-139.3 -69.0 132.3 -22.2 -7.2 0.8 141 160 X R H > S+ 0 0 190 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.856 103.5 52.0 -59.8 -36.8 -21.9 -10.9 1.6 142 161 X N H > S+ 0 0 43 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.896 108.5 51.2 -68.1 -37.1 -20.2 -11.8 -1.7 143 162 X F H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.935 110.2 50.7 -61.5 -44.5 -17.7 -9.0 -1.1 144 163 X H H X S+ 0 0 21 -4,-2.4 4,-2.0 1,-0.2 5,-0.2 0.917 109.8 48.0 -58.4 -47.0 -17.0 -10.5 2.3 145 164 X V H X S+ 0 0 49 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.915 109.4 55.2 -60.0 -44.8 -16.5 -14.1 0.8 146 165 X F H < S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.912 115.3 38.4 -54.8 -40.6 -14.2 -12.5 -1.8 147 166 X L H < S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.806 128.3 28.3 -77.2 -32.1 -12.0 -11.0 1.0 148 167 X E H < S+ 0 0 50 -4,-2.0 2,-0.9 -5,-0.2 -3,-0.2 0.715 86.9 95.4-110.3 -29.7 -12.1 -13.8 3.6 149 168 X Y < - 0 0 122 -4,-2.5 2,-1.9 -5,-0.2 4,-0.2 -0.609 58.0-155.6 -81.3 109.1 -12.6 -17.2 2.0 150 169 X D + 0 0 100 -2,-0.9 2,-0.3 -104,-0.1 -1,-0.1 -0.252 58.8 89.0 -87.6 59.4 -9.1 -18.7 1.6 151 170 X Q S S- 0 0 118 -2,-1.9 2,-0.9 -104,-0.1 -104,-0.1 -0.914 90.7 -84.4-139.0 166.7 -9.7 -21.2 -1.3 152 171 X D - 0 0 65 -2,-0.3 -104,-0.1 1,-0.2 -2,-0.1 -0.610 35.4-163.1 -78.2 102.2 -9.6 -20.9 -5.0 153 172 X L S S+ 0 0 46 -2,-0.9 -1,-0.2 1,-0.2 -105,-0.1 0.752 80.9 60.0 -54.2 -30.1 -13.0 -19.5 -6.0 154 173 X S 0 0 68 -3,-0.0 -1,-0.2 0, 0.0 -2,-0.0 0.994 360.0 360.0 -71.0 -48.2 -12.6 -20.5 -9.7 155 174 X V 0 0 146 -3,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.104 360.0 360.0 -81.9 360.0 -12.2 -24.3 -9.5