==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEASE 16-AUG-97 1AT3 . COMPND 2 MOLECULE: HERPES SIMPLEX VIRUS TYPE II PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN HERPESVIRUS 2; . AUTHOR S.HOOG,W.W.SMITH,X.QIU,S.S.ABDEL-MEGUID . 434 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18395.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 17.7 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 0.5 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 . 39 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 3 0 1 0 0 2 4 0 1 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 0 3 1 0 4 0 2 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 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 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 17 A R 0 0 133 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -36.3 12.2 41.0 7.6 2 18 A A - 0 0 25 69,-0.1 71,-0.1 1,-0.0 69,-0.1 -0.504 360.0-128.6 -78.1 146.6 15.1 38.4 7.3 3 19 A V - 0 0 22 69,-0.2 2,-0.6 -2,-0.2 69,-0.5 -0.892 25.9-131.1 -94.2 116.0 18.6 39.8 7.5 4 20 A P - 0 0 64 0, 0.0 2,-0.4 0, 0.0 67,-0.2 -0.679 27.4-162.4 -73.0 122.5 20.3 38.3 4.4 5 21 A I E -A 70 0A 4 65,-2.7 65,-3.1 -2,-0.6 2,-0.4 -0.904 7.6-149.3-111.2 135.5 23.5 36.8 5.7 6 22 A Y E -AB 69 137A 25 131,-3.4 131,-2.0 -2,-0.4 2,-0.4 -0.860 9.1-165.6-102.0 136.5 26.5 35.9 3.4 7 23 A V E +AB 68 136A 0 61,-1.8 61,-2.5 -2,-0.4 2,-0.3 -0.932 11.4 175.0-116.8 146.7 28.8 33.0 4.4 8 24 A A E +AB 67 135A 0 127,-1.6 127,-2.4 -2,-0.4 2,-0.3 -0.983 18.2 112.4-151.6 146.4 32.2 32.6 2.6 9 25 A G E -A 66 0A 0 57,-1.3 57,-2.5 -2,-0.3 2,-0.3 -0.909 64.0 -66.0 165.8 173.0 35.0 30.2 3.2 10 26 A F E -A 65 0A 0 121,-0.5 55,-0.2 123,-0.5 96,-0.2 -0.674 24.5-158.5 -87.1 135.4 37.0 27.2 1.8 11 27 A L S S- 0 0 1 53,-3.3 97,-0.4 1,-0.4 2,-0.3 0.703 82.8 -12.7 -79.7 -24.3 35.0 24.0 1.4 12 28 A A - 0 0 0 52,-0.8 2,-0.5 119,-0.1 -1,-0.4 -0.946 63.2-125.9-171.4 152.2 38.5 22.3 1.4 13 29 A L > - 0 0 15 117,-0.3 3,-0.9 -2,-0.3 11,-0.3 -0.950 25.8-135.6-110.1 128.8 42.2 23.1 1.2 14 30 A Y T 3 S+ 0 0 23 48,-3.0 3,-0.2 -2,-0.5 2,-0.2 0.846 93.2 19.1 -53.9 -52.4 44.1 21.2 -1.6 15 31 A D T 3 S+ 0 0 174 47,-0.3 -1,-0.2 1,-0.1 10,-0.1 -0.447 87.8 121.9-122.9 62.7 47.4 20.0 0.0 16 32 A S S < S- 0 0 38 -3,-0.9 -1,-0.1 -2,-0.2 -2,-0.1 0.653 83.8-102.9 -94.6 -23.4 46.3 20.4 3.7 17 33 A G + 0 0 67 -3,-0.2 3,-0.1 -4,-0.2 -2,-0.1 0.652 56.0 169.6 106.4 17.6 46.8 16.9 5.0 18 34 A D - 0 0 17 -5,-0.3 -1,-0.2 1,-0.1 5,-0.1 -0.302 46.3 -91.9 -59.0 145.3 43.1 15.8 5.1 19 35 A P > - 0 0 82 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.025 47.6 -88.1 -52.7 171.5 42.9 12.0 5.7 20 36 A G T 4 S+ 0 0 76 1,-0.2 3,-0.2 2,-0.2 -2,-0.1 0.931 124.3 39.7 -47.4 -59.2 42.8 9.7 2.7 21 37 A E T 4 S+ 0 0 166 1,-0.2 -1,-0.2 3,-0.0 -3,-0.1 0.890 115.4 47.5 -58.9 -52.7 39.0 9.7 2.3 22 38 A L T 4 S+ 0 0 21 106,-0.1 -1,-0.2 2,-0.0 -2,-0.2 0.787 84.0 115.1 -65.0 -31.2 38.2 13.4 2.9 23 39 A A < - 0 0 49 -4,-1.9 2,-0.4 -3,-0.2 -9,-0.1 -0.001 46.6-163.0 -45.6 143.9 41.0 14.9 0.7 24 40 A L - 0 0 14 -11,-0.3 -6,-0.1 -10,-0.2 -1,-0.1 -0.972 3.4-162.2-131.7 145.2 40.0 16.9 -2.4 25 41 A D > - 0 0 73 -2,-0.4 4,-1.9 1,-0.1 3,-0.3 -0.871 31.5-104.2-128.1 163.4 42.1 17.8 -5.4 26 42 A P H > S+ 0 0 65 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.893 115.5 48.5 -51.9 -49.8 42.1 20.3 -8.3 27 43 A D H > S+ 0 0 127 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.889 111.5 49.3 -63.9 -38.2 41.0 17.9 -11.0 28 44 A T H 4 S+ 0 0 40 -3,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.838 114.3 45.9 -69.9 -30.1 38.1 16.4 -9.0 29 45 A V H >X S+ 0 0 0 -4,-1.9 3,-1.6 2,-0.2 4,-0.9 0.933 108.5 56.3 -76.5 -39.4 36.9 19.9 -8.1 30 46 A R H >< S+ 0 0 137 -4,-2.9 3,-0.9 1,-0.3 -2,-0.2 0.922 107.5 49.5 -54.7 -44.3 37.3 21.0 -11.7 31 47 A A T 3< S+ 0 0 38 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.598 107.2 55.1 -73.3 -11.3 35.0 18.2 -12.8 32 48 A A T <4 S+ 0 0 0 -3,-1.6 -1,-0.2 -4,-0.4 86,-0.2 0.540 86.4 129.3 -99.4 -6.8 32.4 19.1 -10.2 33 49 A L << + 0 0 16 -3,-0.9 82,-0.1 -4,-0.9 83,-0.1 -0.839 61.3 27.4-108.7 135.3 32.0 22.7 -11.3 34 50 A P S S- 0 0 91 0, 0.0 24,-0.0 0, 0.0 -1,-0.0 0.601 100.0-119.0 -76.7 156.7 29.5 24.1 -12.0 35 51 A P - 0 0 38 0, 0.0 81,-0.2 0, 0.0 -2,-0.1 -0.347 10.9-133.8 -63.4 140.0 27.3 22.0 -9.7 36 52 A E S S+ 0 0 121 79,-3.3 80,-0.2 -4,-0.2 79,-0.1 0.975 92.8 22.2 -55.5 -52.3 24.6 20.1 -11.6 37 53 A N S S- 0 0 115 78,-0.4 -1,-0.1 81,-0.3 81,-0.0 -0.857 101.1 -87.4-118.7 152.1 22.1 21.2 -9.0 38 54 A P - 0 0 76 0, 0.0 -1,-0.1 0, 0.0 17,-0.1 -0.132 39.2-123.4 -54.3 146.8 22.1 24.1 -6.5 39 55 A L - 0 0 4 15,-0.5 15,-3.5 81,-0.1 81,-0.2 -0.866 24.7-152.4 -99.6 112.0 23.8 23.5 -3.2 40 56 A P E -C 53 0A 28 0, 0.0 81,-1.8 0, 0.0 2,-0.5 -0.448 10.6-131.6 -74.9 160.9 21.4 24.1 -0.4 41 57 A I E +Cd 52 121A 0 11,-2.1 10,-2.9 79,-0.2 11,-1.4 -0.973 31.9 171.6-118.3 124.7 22.8 25.2 3.0 42 58 A N E -Cd 50 122A 4 79,-2.2 81,-2.6 -2,-0.5 2,-0.5 -0.791 35.1-101.2-126.6 171.1 21.6 23.4 6.0 43 59 A V E > S- d 0 123A 0 6,-1.0 3,-1.6 3,-0.5 6,-0.2 -0.846 92.8 -21.8 -97.4 126.2 22.5 23.2 9.8 44 60 A D T 3 S- 0 0 38 79,-3.2 2,-0.3 -2,-0.5 -1,-0.2 0.896 112.1 -70.2 41.2 57.5 24.5 20.3 11.0 45 61 A H T 3 S+ 0 0 76 -3,-0.3 2,-1.5 1,-0.2 -1,-0.3 0.407 92.6 139.6 46.4 -0.4 23.6 18.0 8.0 46 62 A R X - 0 0 84 -3,-1.6 3,-2.4 -2,-0.3 -3,-0.5 -0.587 44.9-156.5 -69.2 93.4 20.0 17.7 9.3 47 63 A A T 3 S+ 0 0 74 -2,-1.5 3,-0.3 1,-0.3 -1,-0.2 0.585 86.9 68.3 -54.6 -12.1 18.6 17.9 5.7 48 64 A R T 3 S+ 0 0 203 1,-0.2 2,-1.3 -5,-0.1 -1,-0.3 0.788 87.8 75.0 -75.0 -26.9 15.2 19.2 7.2 49 65 A C < + 0 0 0 -3,-2.4 -6,-1.0 -6,-0.2 2,-0.4 -0.348 58.8 160.2 -87.2 57.0 17.2 22.4 8.2 50 66 A E E +C 42 0A 55 -2,-1.3 -8,-0.3 -3,-0.3 125,-0.2 -0.641 1.6 158.8 -80.1 129.7 17.6 24.2 5.0 51 67 A V E - 0 0 0 -10,-2.9 20,-1.5 -2,-0.4 123,-0.3 0.353 59.3 -10.2-129.1 -4.5 18.3 27.9 5.8 52 68 A G E -CE 41 70A 0 -11,-1.4 -11,-2.1 18,-0.2 2,-0.3 -0.921 61.8-101.6-170.0-165.3 20.0 29.1 2.6 53 69 A R E -CE 40 69A 47 16,-2.1 16,-2.1 -13,-0.3 2,-0.5 -0.994 28.6-117.6-148.6 131.3 21.6 28.4 -0.8 54 70 A V E - E 0 68A 14 -15,-3.5 -15,-0.5 -2,-0.3 14,-0.3 -0.569 27.5-171.1 -66.8 115.7 25.3 28.3 -2.0 55 71 A L E + 0 0 14 12,-2.1 2,-0.3 -2,-0.5 13,-0.2 0.900 63.3 3.5 -77.0 -45.0 25.5 31.2 -4.6 56 72 A A E - E 0 67A 3 11,-1.8 11,-2.3 109,-0.0 2,-0.4 -0.997 47.9-167.9-149.2 142.5 29.1 30.4 -6.1 57 73 A V E - E 0 66A 10 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.996 19.2-175.3-127.7 116.3 31.8 27.8 -5.8 58 74 A V E - E 0 65A 21 7,-3.0 7,-2.7 -2,-0.4 2,-1.0 -0.971 28.4-124.7-119.9 133.5 35.1 28.8 -7.4 59 75 A N E - E 0 64A 24 -2,-0.4 -2,-0.0 5,-0.2 7,-0.0 -0.606 34.7-170.2 -76.7 102.3 38.2 26.6 -7.7 60 76 A D E > - E 0 63A 1 3,-1.7 3,-1.1 -2,-1.0 90,-0.0 -0.702 38.7-107.8 -91.9 152.0 40.9 28.8 -6.1 61 77 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.1 0, 0.0 89,-0.1 0.741 123.4 46.3 -50.8 -20.8 44.5 27.7 -6.4 62 78 A R T 3 S- 0 0 65 1,-0.4 -48,-3.0 87,-0.1 -47,-0.3 0.724 128.5 -58.8 -95.2 -23.6 44.2 26.8 -2.7 63 79 A G E < S- E 0 60A 0 -3,-1.1 -3,-1.7 -50,-0.3 2,-0.5 -0.903 73.4 -46.4 159.0 170.5 40.9 24.9 -2.7 64 80 A P E - E 0 59A 0 0, 0.0 -53,-3.3 0, 0.0 -52,-0.8 -0.531 56.7-166.3 -70.0 117.4 37.2 25.2 -3.6 65 81 A F E -AE 10 58A 0 -7,-2.7 -7,-3.0 -2,-0.5 2,-0.3 -0.804 6.2-169.0-103.8 144.5 36.0 28.5 -2.2 66 82 A F E -AE 9 57A 0 -57,-2.5 -57,-1.3 -2,-0.3 2,-0.4 -0.917 18.5-153.9-136.1 162.3 32.2 29.2 -1.9 67 83 A V E -AE 8 56A 0 -11,-2.3 -12,-2.1 -2,-0.3 -11,-1.8 -0.991 22.6-179.4-135.8 124.9 29.8 32.0 -1.1 68 84 A G E -AE 7 54A 0 -61,-2.5 -61,-1.8 -2,-0.4 2,-0.4 -0.783 20.8-136.7-123.1 167.7 26.4 31.4 0.3 69 85 A L E -AE 6 53A 13 -16,-2.1 -16,-2.1 -2,-0.3 2,-0.6 -0.987 9.8-166.7-127.6 130.6 23.2 33.2 1.3 70 86 A I E +AE 5 52A 1 -65,-3.1 -65,-2.7 -2,-0.4 2,-0.5 -0.951 11.0 172.1-118.6 114.7 21.2 32.5 4.5 71 87 A A + 0 0 6 -20,-1.5 103,-3.3 -2,-0.6 2,-0.3 -0.818 28.8 131.5-126.2 89.4 17.8 34.2 4.5 72 88 A C > - 0 0 2 -69,-0.5 4,-0.8 -2,-0.5 -69,-0.2 -0.896 33.2-176.5-149.3 114.3 16.1 32.7 7.6 73 89 A V H > S+ 0 0 41 101,-0.5 4,-2.5 -2,-0.3 5,-0.2 0.775 86.8 58.5 -80.4 -30.7 14.3 34.7 10.3 74 90 A Q H > S+ 0 0 47 100,-0.3 4,-3.0 2,-0.2 5,-0.2 0.904 103.7 52.2 -66.0 -42.8 13.6 31.7 12.6 75 91 A L H > S+ 0 0 4 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.880 110.2 51.7 -58.4 -40.1 17.3 30.9 12.8 76 92 A E H X S+ 0 0 7 -4,-0.8 4,-3.0 2,-0.2 -2,-0.2 0.969 114.3 40.6 -58.7 -60.1 17.7 34.6 13.9 77 93 A R H X S+ 0 0 129 -4,-2.5 4,-2.6 2,-0.2 5,-0.4 0.931 111.6 53.8 -56.7 -55.7 15.0 34.4 16.6 78 94 A V H X S+ 0 0 6 -4,-3.0 4,-1.1 1,-0.2 -1,-0.2 0.881 117.9 39.1 -47.5 -43.7 16.0 30.9 18.0 79 95 A L H X S+ 0 0 2 -4,-1.5 4,-2.4 -5,-0.2 -2,-0.2 0.922 114.8 52.3 -72.1 -52.6 19.7 32.3 18.4 80 96 A E H < S+ 0 0 77 -4,-3.0 5,-0.3 1,-0.2 -2,-0.2 0.820 115.1 41.8 -53.5 -39.6 18.7 35.8 19.6 81 97 A T H < S+ 0 0 95 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.809 110.9 54.6 -83.2 -31.1 16.4 34.4 22.3 82 98 A A H < S+ 0 0 6 -4,-1.1 2,-1.1 -5,-0.4 -2,-0.2 0.920 90.6 84.1 -67.2 -41.0 18.8 31.6 23.4 83 99 A A < - 0 0 14 -4,-2.4 2,-1.5 1,-0.2 -1,-0.1 -0.456 57.2-176.4 -66.2 97.7 21.5 34.2 24.0 84 100 A S - 0 0 86 -2,-1.1 -1,-0.2 323,-0.2 -3,-0.1 -0.412 38.5-163.3 -90.4 55.4 20.6 35.4 27.5 85 101 A A + 0 0 47 -2,-1.5 326,-0.0 -5,-0.3 -2,-0.0 -0.082 45.4 172.0 -55.5 134.7 23.5 37.6 26.5 86 102 A A 0 0 104 1,-0.3 -1,-0.2 325,-0.1 325,-0.0 0.741 360.0 360.0 -97.3 -64.5 25.6 39.6 28.8 87 103 A I 0 0 93 2,-0.0 -1,-0.3 0, 0.0 0, 0.0 -0.980 360.0 360.0-152.9 360.0 27.9 40.5 26.0 88 ! 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 89 111 A L 0 0 141 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-102.5 26.5 45.9 20.9 90 112 A S - 0 0 77 1,-0.1 2,-0.0 0, 0.0 0, 0.0 0.390 360.0 -84.6-141.9 -75.5 24.3 46.9 18.0 91 113 A R S >> S+ 0 0 142 0, 0.0 4,-1.2 0, 0.0 3,-0.6 -0.164 105.2 19.0-168.0-101.6 21.8 44.8 16.1 92 114 A E H 3> S+ 0 0 61 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.709 120.3 67.8 -66.3 -14.9 22.2 42.3 13.3 93 115 A E H 3> S+ 0 0 66 2,-0.3 4,-3.5 1,-0.2 5,-0.3 0.884 93.9 54.5 -70.1 -34.8 25.8 42.5 14.5 94 116 A R H <> S+ 0 0 50 -3,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.911 110.1 47.6 -62.7 -38.2 24.6 40.7 17.6 95 117 A L H X S+ 0 0 2 -4,-1.2 4,-2.9 2,-0.2 5,-0.3 0.932 111.5 48.8 -68.4 -43.9 23.3 38.2 15.1 96 118 A L H X S+ 0 0 2 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.940 112.9 48.3 -60.8 -44.0 26.6 38.1 13.2 97 119 A Y H X S+ 0 0 26 -4,-3.5 4,-1.5 1,-0.2 -1,-0.2 0.906 113.6 48.0 -62.6 -43.8 28.4 37.6 16.5 98 120 A L H X S+ 0 0 7 -4,-2.3 4,-1.3 -5,-0.3 5,-0.3 0.947 115.4 41.3 -66.2 -48.6 26.0 34.8 17.6 99 121 A I H X S+ 0 0 1 -4,-2.9 4,-3.2 1,-0.2 -2,-0.2 0.942 112.7 54.7 -69.8 -40.4 26.0 32.8 14.3 100 122 A T H < S+ 0 0 5 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.897 114.0 37.9 -56.2 -52.0 29.8 33.1 13.7 101 123 A N H < S+ 0 0 0 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.739 121.9 44.0 -76.5 -23.9 31.0 31.7 17.1 102 124 A Y H < S+ 0 0 16 -4,-1.3 -2,-0.2 -5,-0.2 -3,-0.2 0.874 128.8 26.0 -84.8 -44.8 28.2 29.1 17.3 103 125 A L S < S+ 0 0 1 -4,-3.2 -1,-0.2 -5,-0.3 22,-0.2 -0.530 72.1 150.7-119.2 69.2 28.6 27.9 13.8 104 126 A P + 0 0 0 0, 0.0 30,-2.8 0, 0.0 2,-0.2 0.645 54.5 62.6 -75.9 -12.1 32.2 28.7 12.7 105 127 A S E -FG 124 133A 0 19,-2.3 19,-1.9 28,-0.3 2,-0.3 -0.680 59.9-146.6-117.1 163.9 32.7 25.8 10.1 106 128 A V E -F 123 0A 1 26,-1.5 2,-0.4 -2,-0.2 23,-0.3 -0.868 9.0-162.4-118.2 162.1 31.4 24.4 6.8 107 129 A S E -F 122 0A 22 15,-1.3 15,-2.4 -2,-0.3 2,-0.4 -0.925 8.6-150.0-150.1 113.4 31.2 20.8 5.8 108 130 A L E -F 121 0A 4 -97,-0.4 2,-0.5 -2,-0.4 13,-0.2 -0.723 8.3-154.0 -86.7 131.5 30.8 19.8 2.2 109 131 A S E -F 120 0A 28 11,-3.1 10,-3.0 -2,-0.4 11,-1.1 -0.902 8.4-164.2-106.8 133.9 29.0 16.6 1.5 110 132 A T E F 118 0A 60 -2,-0.5 8,-0.2 8,-0.2 7,-0.1 -0.903 360.0 360.0-115.3 142.6 29.8 14.7 -1.7 111 133 A K 0 0 115 6,-2.1 -1,-0.2 5,-0.4 6,-0.1 0.949 360.0 360.0 -77.0 360.0 27.6 11.9 -3.3 112 ! 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 0.0 113 141 A P 0 0 102 0, 0.0 2,-0.3 0, 0.0 -84,-0.0 0.000 360.0 360.0 360.0 155.0 33.8 12.2 -11.0 114 142 A D > - 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F 0 105A 8 -19,-1.9 -19,-2.3 -2,-0.3 3,-0.2 -0.947 55.2-102.0-159.9 179.1 28.5 23.2 12.0 125 153 A A S S+ 0 0 6 1,-0.3 2,-0.4 -2,-0.3 -1,-0.1 0.912 105.2 7.1 -78.0 -47.1 30.8 23.8 15.0 126 154 A I S S- 0 0 31 -21,-0.1 -1,-0.3 -22,-0.1 2,-0.1 -0.968 74.2-152.4-143.5 119.9 33.8 21.9 13.8 127 155 A G - 0 0 7 -2,-0.4 -20,-0.1 -3,-0.2 4,-0.1 -0.329 20.1-123.5 -84.0 174.5 34.1 20.3 10.3 128 156 A R S S+ 0 0 163 -22,-0.1 2,-0.2 -2,-0.1 -106,-0.1 0.664 88.4 67.5 -95.1 -20.4 36.2 17.3 9.4 129 157 A R S > S- 0 0 23 -23,-0.3 3,-0.7 -118,-0.1 -2,-0.2 -0.657 90.3 -99.8 -97.4 157.8 38.4 18.8 6.7 130 158 A L T 3 S+ 0 0 36 -2,-0.2 -117,-0.3 1,-0.2 -1,-0.1 -0.258 95.8 18.3 -73.9 165.0 41.1 21.4 7.4 131 159 A G T 3 S+ 0 0 0 1,-0.2 2,-1.4 -119,-0.1 -121,-0.5 0.557 78.5 139.0 51.2 15.7 40.9 25.2 7.0 132 160 A T < + 0 0 1 -3,-0.7 -26,-1.5 -121,-0.1 2,-0.5 -0.233 19.8 133.0 -86.6 51.6 37.1 25.0 6.9 133 161 A I B -G 105 0A 0 -2,-1.4 -123,-0.5 72,-0.5 -28,-0.3 -0.878 41.2-153.6-102.7 129.5 36.4 28.1 9.0 134 162 A V - 0 0 3 -30,-2.8 2,-0.3 -2,-0.5 -125,-0.2 -0.470 8.0-137.8-100.7 171.5 33.8 30.4 7.4 135 163 A T E -B 8 0A 13 -127,-2.4 -127,-1.6 -2,-0.2 2,-0.4 -0.962 13.1-159.2-126.8 142.7 32.9 34.2 7.6 136 164 A Y E +B 7 0A 3 -2,-0.3 2,-0.3 -129,-0.2 -129,-0.2 -0.979 23.5 145.5-125.8 135.7 29.4 35.7 7.9 137 165 A D E -B 6 0A 35 -131,-2.0 -131,-3.4 -2,-0.4 6,-0.1 -0.979 54.9-111.0-161.1 168.4 28.4 39.2 7.0 138 166 A T S S+ 0 0 61 -2,-0.3 2,-0.3 -133,-0.2 3,-0.1 0.247 102.6 49.4 -90.0 12.0 25.6 41.3 5.6 139 167 A S S > S- 0 0 45 1,-0.1 4,-1.4 -133,-0.1 5,-0.1 -0.990 77.1-134.8-147.0 140.9 27.5 42.1 2.4 140 168 A L H >> S+ 0 0 19 -2,-0.3 4,-2.1 1,-0.2 3,-0.7 0.971 108.7 52.3 -61.1 -47.5 29.3 39.6 0.1 141 169 A D H 3> S+ 0 0 82 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.855 110.3 48.7 -55.2 -38.6 32.3 41.9 -0.2 142 170 A A H 34 S+ 0 0 33 1,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.760 109.3 52.9 -75.3 -27.0 32.5 42.1 3.6 143 171 A A H << S+ 0 0 1 -4,-1.4 -2,-0.2 -3,-0.7 -1,-0.2 0.824 115.1 39.7 -77.8 -34.0 32.2 38.3 4.0 144 172 A I H >< S+ 0 0 3 -4,-2.1 3,-2.3 1,-0.2 -2,-0.2 0.784 95.3 82.4 -87.8 -22.8 35.1 37.7 1.5 145 173 A A T 3< S+ 0 0 55 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.762 81.4 62.0 -52.5 -35.7 37.5 40.5 2.7 146 174 A P T 3 S+ 0 0 17 0, 0.0 66,-1.9 0, 0.0 2,-1.1 0.555 84.0 92.3 -71.3 -4.4 38.9 38.6 5.7 147 175 A F B < +H 211 0B 1 -3,-2.3 3,-0.3 64,-0.2 64,-0.2 -0.797 47.1 165.1 -93.0 98.7 40.3 36.1 3.2 148 176 A R + 0 0 142 62,-2.0 2,-0.9 -2,-1.1 -1,-0.2 0.682 65.7 63.4 -85.6 -24.8 43.8 37.4 2.4 149 177 A H S S+ 0 0 112 61,-0.5 2,-0.4 60,-0.4 -1,-0.2 -0.437 78.5 124.2-100.1 62.1 45.2 34.3 0.7 150 178 A L - 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