==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 30-SEP-02 1MWJ . COMPND 2 MOLECULE: 5'-D(*CP*GP*CP*GP*A*GP*(DU)P*TP*CP*GP*CP*G)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR T.E.BARRETT,O.SCHARER,R.SAVVA,T.BROWN,J.JIRICNY,G.L.VERDINE, . 165 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8473.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 5.5 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 . 11 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.4 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 0 0 1 0 2 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 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 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A M 0 0 111 0, 0.0 2,-0.5 0, 0.0 71,-0.0 0.000 360.0 360.0 360.0 148.0 11.5 28.7 9.9 2 2 A V - 0 0 14 69,-0.1 26,-0.1 24,-0.0 22,-0.1 -0.892 360.0-139.4-123.3 99.2 11.7 32.5 10.4 3 3 A E - 0 0 156 -2,-0.5 2,-0.1 24,-0.3 63,-0.0 -0.130 21.3-111.3 -52.3 149.9 8.5 34.4 9.7 4 4 A D - 0 0 42 61,-0.0 2,-0.6 1,-0.0 63,-0.2 -0.465 13.4-141.7 -83.0 154.1 8.6 37.7 7.9 5 5 A I B +A 66 0A 8 61,-2.9 61,-1.9 -2,-0.1 2,-0.3 -0.873 46.5 142.2-117.4 90.3 7.7 41.0 9.5 6 6 A L + 0 0 28 -2,-0.6 54,-0.1 59,-0.2 59,-0.0 -0.927 15.7 155.7-131.1 158.6 5.8 42.9 6.9 7 7 A A > - 0 0 24 -2,-0.3 3,-0.8 56,-0.0 2,-0.1 -0.949 46.2 -91.7-170.1 157.3 2.9 45.3 6.8 8 8 A P T 3 S+ 0 0 101 0, 0.0 92,-0.1 0, 0.0 91,-0.1 -0.518 104.8 38.9 -78.7 159.3 1.7 48.0 4.5 9 9 A G T 3 S+ 0 0 56 90,-0.8 91,-0.1 91,-0.3 2,-0.1 0.489 77.1 145.6 87.2 0.3 2.8 51.6 5.2 10 10 A L < - 0 0 4 -3,-0.8 92,-1.5 89,-0.3 -1,-0.3 -0.361 43.2-150.7 -69.5 149.8 6.4 50.7 6.2 11 11 A R S S+ 0 0 39 52,-2.7 92,-1.3 1,-0.3 2,-0.4 0.791 80.5 21.4 -91.8 -28.2 9.1 53.2 5.3 12 12 A V E -bc 64 103A 0 51,-1.2 53,-2.2 90,-0.2 2,-0.5 -0.997 57.4-162.2-142.7 141.4 11.8 50.5 5.1 13 13 A V E -bc 65 104A 1 90,-2.1 92,-3.8 -2,-0.4 2,-0.4 -0.990 18.5-150.3-122.0 116.7 12.0 46.7 4.6 14 14 A F E -bc 66 105A 0 51,-3.4 53,-2.0 -2,-0.5 2,-0.4 -0.720 14.4-169.3 -85.6 136.5 15.2 45.1 5.6 15 15 A C E -bc 67 106A 0 90,-2.6 92,-3.4 -2,-0.4 53,-0.3 -0.984 6.6-175.6-136.5 128.5 16.3 42.0 3.7 16 16 A G E -b 68 0A 5 51,-1.8 53,-2.6 -2,-0.4 54,-0.2 -0.566 36.6-106.7-109.9 174.5 19.0 39.5 4.4 17 17 A I S S- 0 0 17 90,-0.4 53,-3.8 1,-0.3 52,-0.5 1.000 81.8 -41.9 -63.4 -73.7 20.3 36.5 2.5 18 18 A N S S- 0 0 26 51,-0.2 -1,-0.3 50,-0.2 53,-0.2 -0.927 71.2 -71.8-151.2 172.1 19.0 33.6 4.7 19 19 A P - 0 0 12 0, 0.0 55,-2.2 0, 0.0 2,-0.1 -0.452 43.0-128.6 -72.7 144.5 18.6 32.7 8.3 20 20 A G B > -f 74 0B 23 53,-0.2 4,-2.1 -2,-0.1 55,-0.2 -0.334 33.2-101.3 -78.6 174.3 21.6 31.7 10.4 21 21 A L H > S+ 0 0 112 53,-0.5 4,-1.1 2,-0.2 54,-0.1 0.778 123.5 46.3 -70.8 -22.7 21.5 28.4 12.3 22 22 A S H > S+ 0 0 61 2,-0.2 4,-2.1 1,-0.1 5,-0.3 0.945 112.5 48.1 -79.1 -51.9 20.8 30.3 15.6 23 23 A S H >>S+ 0 0 9 1,-0.2 4,-2.4 2,-0.2 5,-1.0 0.883 106.9 59.5 -54.5 -43.4 18.1 32.6 14.1 24 24 A A H <5S+ 0 0 16 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.958 108.8 42.7 -51.4 -55.4 16.5 29.6 12.5 25 25 A G H <5S+ 0 0 71 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.860 116.5 45.2 -61.8 -42.0 15.9 27.9 15.8 26 26 A T H <5S- 0 0 70 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.754 102.1-131.2 -74.6 -26.0 14.7 30.9 17.7 27 27 A G T <5 + 0 0 29 -4,-2.4 -24,-0.3 1,-0.3 -3,-0.2 0.674 68.4 117.8 82.3 18.5 12.4 31.9 14.9 28 28 A F > < - 0 0 66 -5,-1.0 3,-0.7 -6,-0.2 -1,-0.3 -0.916 69.4-110.0-121.7 142.5 13.8 35.5 15.1 29 29 A P T 3 S- 0 0 14 0, 0.0 27,-0.1 0, 0.0 39,-0.0 -0.498 98.1 -2.3 -71.0 138.9 15.7 37.5 12.4 30 30 A F T 3 S+ 0 0 27 -2,-0.2 8,-0.2 1,-0.1 5,-0.0 0.911 82.8 157.6 44.8 59.3 19.3 38.2 13.2 31 31 A A < + 0 0 18 -3,-0.7 -1,-0.1 22,-0.1 23,-0.1 0.734 35.0 99.5 -83.9 -26.7 19.1 36.4 16.6 32 32 A H S > S- 0 0 95 1,-0.2 3,-2.1 2,-0.1 -12,-0.0 -0.499 74.5-134.7 -67.5 127.8 22.7 35.6 17.1 33 33 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.465 100.9 66.4 -60.1 -5.3 24.3 38.2 19.5 34 34 A A T 3 S+ 0 0 57 2,-0.0 2,-0.6 1,-0.0 -2,-0.1 0.675 79.0 94.8 -90.9 -18.0 27.3 38.6 17.2 35 35 A N < - 0 0 30 -3,-2.1 3,-0.5 107,-0.1 4,-0.3 -0.654 65.7-153.1 -80.7 115.8 25.2 40.1 14.4 36 36 A R > + 0 0 48 105,-2.2 4,-3.1 -2,-0.6 3,-0.3 0.508 64.6 107.2 -64.5 -7.0 25.3 43.9 14.6 37 37 A F H > S+ 0 0 0 104,-0.3 4,-2.8 1,-0.2 5,-0.3 0.860 79.7 43.6 -39.6 -64.5 21.9 44.5 12.9 38 38 A W H > S+ 0 0 12 -3,-0.5 4,-1.5 -8,-0.2 13,-0.3 0.888 116.4 46.8 -54.1 -44.4 19.9 45.5 16.0 39 39 A K H > S+ 0 0 79 -3,-0.3 4,-3.0 -4,-0.3 5,-0.3 0.970 113.7 50.8 -64.5 -46.6 22.7 47.8 17.3 40 40 A V H X S+ 0 0 0 -4,-3.1 4,-3.6 1,-0.2 5,-0.3 0.934 109.9 45.2 -55.9 -59.1 23.1 49.3 13.8 41 41 A I H X>S+ 0 0 1 -4,-2.8 5,-2.0 2,-0.2 4,-1.2 0.817 115.3 51.2 -58.2 -28.9 19.4 50.2 13.1 42 42 A Y H ><5S+ 0 0 98 -4,-1.5 3,-0.9 -5,-0.3 5,-0.3 0.995 116.9 37.0 -67.6 -62.4 19.2 51.6 16.6 43 43 A Q H 3<5S+ 0 0 75 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.794 112.3 60.5 -58.4 -34.4 22.2 53.8 16.2 44 44 A A H 3<5S- 0 0 0 -4,-3.6 -1,-0.3 -5,-0.3 -2,-0.2 0.848 121.5-108.8 -62.3 -36.1 21.3 54.5 12.6 45 45 A G T <<5S+ 0 0 40 -4,-1.2 -3,-0.2 -3,-0.9 -2,-0.1 0.368 86.9 114.6 125.2 -3.3 18.1 56.0 13.9 46 46 A F S - 0 0 133 1,-0.1 3,-1.2 -14,-0.0 4,-0.2 -0.707 31.3-107.2 -94.6 154.8 16.3 42.2 21.2 53 53 A P G > S+ 0 0 20 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.794 120.3 65.7 -51.1 -30.7 15.5 39.6 18.4 54 54 A Q G > S+ 0 0 104 1,-0.3 3,-0.6 2,-0.1 -3,-0.0 0.934 98.3 49.7 -57.5 -47.9 12.6 38.6 20.7 55 55 A E G X S+ 0 0 48 -3,-1.2 3,-2.7 1,-0.2 -1,-0.3 0.327 74.6 122.6 -77.6 10.3 10.9 42.0 20.2 56 56 A A G X + 0 0 1 -3,-1.5 3,-2.1 1,-0.3 4,-0.2 0.794 65.5 61.5 -40.9 -46.2 11.3 41.8 16.4 57 57 A Q G X S+ 0 0 121 -3,-0.6 3,-1.4 1,-0.3 4,-0.3 0.782 89.8 71.0 -55.1 -27.9 7.6 42.2 15.7 58 58 A H G <> S+ 0 0 97 -3,-2.7 4,-0.6 1,-0.3 3,-0.5 0.533 73.8 85.3 -72.6 2.0 7.7 45.6 17.4 59 59 A L G X4>S+ 0 0 0 -3,-2.1 5,-1.6 1,-0.2 3,-1.3 0.845 78.4 65.4 -68.4 -33.9 9.6 46.9 14.3 60 60 A L G X45S+ 0 0 45 -3,-1.4 3,-2.2 1,-0.3 -1,-0.2 0.868 92.5 62.7 -54.9 -38.7 6.2 47.5 12.7 61 61 A D G 345S+ 0 0 111 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.2 0.807 107.6 41.7 -56.0 -33.9 5.6 50.1 15.4 62 62 A Y G <<5S- 0 0 51 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.273 123.3-112.1 -95.2 8.3 8.6 52.0 14.0 63 63 A R T < 5S+ 0 0 161 -3,-2.2 -52,-2.7 1,-0.2 -51,-1.2 0.904 74.9 128.3 58.8 51.5 7.3 51.2 10.5 64 64 A C E < - b 0 12A 0 -5,-1.6 2,-0.3 -54,-0.2 -1,-0.2 -0.928 38.5-161.2-131.3 150.5 10.2 48.9 9.6 65 65 A G E - b 0 13A 0 -53,-2.2 -51,-3.4 -2,-0.3 2,-0.3 -0.893 3.2-152.7-133.0 165.7 10.0 45.4 8.2 66 66 A V E +Ab 5 14A 5 -61,-1.9 -61,-2.9 -2,-0.3 2,-0.3 -0.997 24.3 140.5-143.2 141.1 12.2 42.4 7.8 67 67 A T E - b 0 15A 4 -53,-2.0 -51,-1.8 -2,-0.3 2,-0.3 -0.883 31.9-126.6-159.9-177.2 12.5 39.5 5.4 68 68 A K E - b 0 16A 24 -53,-0.3 -51,-0.2 -2,-0.3 -50,-0.2 -0.964 14.6-130.8-143.3 159.0 15.1 37.3 3.6 69 69 A L S S+ 0 0 10 -53,-2.6 2,-0.4 -52,-0.5 -51,-0.2 0.932 96.2 29.2 -74.9 -47.4 16.0 36.2 0.1 70 70 A V - 0 0 11 -53,-3.8 -1,-0.2 -54,-0.2 15,-0.1 -0.930 60.4-159.3-119.8 138.2 16.4 32.5 0.9 71 71 A D + 0 0 93 -2,-0.4 -1,-0.1 -53,-0.2 -69,-0.1 0.837 62.3 104.3 -82.4 -39.0 14.7 30.6 3.7 72 72 A R S S- 0 0 102 -54,-0.1 -2,-0.1 1,-0.1 -48,-0.0 -0.268 74.1-128.4 -47.9 116.3 17.1 27.7 3.9 73 73 A P + 0 0 51 0, 0.0 2,-0.3 0, 0.0 -53,-0.2 -0.289 35.9 169.6 -66.1 160.4 19.1 28.3 7.1 74 74 A T B -f 20 0B 6 -55,-2.2 -53,-0.5 1,-0.1 -50,-0.1 -0.984 44.1-120.5-167.9 160.5 22.9 28.2 7.0 75 75 A V S S+ 0 0 100 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.943 100.3 21.6 -73.8 -51.9 26.1 29.0 8.9 76 76 A Q S > S- 0 0 86 1,-0.1 3,-1.9 -56,-0.1 -1,-0.3 -0.945 75.9-125.4-121.8 143.1 27.5 31.5 6.4 77 77 A A G > S+ 0 0 44 -2,-0.4 3,-1.4 1,-0.3 -1,-0.1 0.772 103.2 72.0 -54.8 -27.1 25.7 33.5 3.7 78 78 A N G 3 S+ 0 0 117 1,-0.2 -1,-0.3 -4,-0.0 -4,-0.0 0.497 79.2 73.3 -71.8 -3.2 28.0 32.1 1.0 79 79 A E G < S+ 0 0 92 -3,-1.9 2,-0.4 2,-0.1 -1,-0.2 0.585 75.8 94.7 -84.6 -9.4 26.5 28.6 1.1 80 80 A V S < S- 0 0 10 -3,-1.4 -6,-0.0 -4,-0.2 -62,-0.0 -0.699 78.1-127.7 -84.7 128.2 23.4 29.8 -0.7 81 81 A S > - 0 0 39 -2,-0.4 4,-2.2 1,-0.1 5,-0.1 -0.267 14.5-120.4 -71.6 162.4 23.6 29.3 -4.5 82 82 A K H > S+ 0 0 131 2,-0.2 4,-4.8 1,-0.2 5,-0.3 0.848 117.4 61.6 -69.1 -31.3 22.9 32.1 -7.0 83 83 A Q H > S+ 0 0 138 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.926 108.5 41.1 -57.5 -45.4 20.1 29.9 -8.2 84 84 A E H > S+ 0 0 57 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.848 117.0 48.9 -71.0 -38.3 18.6 30.2 -4.8 85 85 A L H X S+ 0 0 15 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.928 110.9 49.5 -69.4 -42.0 19.4 33.8 -4.6 86 86 A H H X S+ 0 0 66 -4,-4.8 4,-1.4 1,-0.2 -2,-0.2 0.867 113.6 46.0 -66.1 -33.8 18.0 34.6 -8.0 87 87 A A H X S+ 0 0 43 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.2 0.927 110.1 55.2 -71.0 -44.4 14.7 32.7 -7.2 88 88 A G H X S+ 0 0 5 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.888 104.2 53.9 -54.8 -43.0 14.5 34.5 -3.8 89 89 A G H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.941 103.8 55.6 -58.2 -47.0 14.7 37.9 -5.5 90 90 A R H X S+ 0 0 159 -4,-1.4 4,-0.9 1,-0.2 -1,-0.2 0.886 111.3 43.6 -53.2 -44.2 11.8 37.0 -7.8 91 91 A K H X S+ 0 0 137 -4,-1.7 4,-1.4 2,-0.2 3,-0.3 0.856 109.7 57.0 -71.0 -36.9 9.6 36.2 -4.7 92 92 A L H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 3,-0.4 0.932 99.2 60.8 -59.4 -43.5 10.8 39.3 -2.8 93 93 A I H X S+ 0 0 53 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.871 103.5 50.7 -49.9 -42.3 9.6 41.4 -5.8 94 94 A E H X S+ 0 0 102 -4,-0.9 4,-1.4 -3,-0.3 -1,-0.2 0.860 106.9 51.8 -66.2 -40.5 6.1 40.2 -5.1 95 95 A K H X S+ 0 0 52 -4,-1.4 4,-3.4 -3,-0.4 5,-0.4 0.905 110.8 49.5 -64.2 -40.0 6.1 41.0 -1.4 96 96 A I H X S+ 0 0 4 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.928 109.1 50.4 -65.2 -43.5 7.2 44.5 -2.3 97 97 A E H < S+ 0 0 114 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.793 117.0 45.9 -63.1 -25.7 4.4 44.8 -4.8 98 98 A D H < S+ 0 0 101 -4,-1.4 -2,-0.2 -5,-0.2 -3,-0.2 0.973 125.1 24.4 -80.4 -61.8 2.2 43.6 -2.0 99 99 A Y H < S- 0 0 72 -4,-3.4 -90,-0.8 -91,-0.1 -89,-0.3 0.679 88.4-153.0 -80.5 -19.1 3.3 45.7 1.0 100 100 A Q < - 0 0 130 -4,-2.7 -91,-0.3 -5,-0.4 -3,-0.1 0.910 15.2-165.7 45.4 65.5 4.7 48.6 -1.1 101 101 A P - 0 0 2 0, 0.0 -90,-0.2 0, 0.0 3,-0.2 -0.285 31.1-119.3 -73.9 161.8 7.3 50.0 1.3 102 102 A Q S S+ 0 0 92 -92,-1.5 32,-2.5 1,-0.3 2,-0.3 0.925 98.5 12.2 -66.5 -38.5 8.9 53.4 0.7 103 103 A A E -cd 12 134A 0 -92,-1.3 -90,-2.1 30,-0.3 2,-0.5 -0.996 62.0-147.9-146.4 140.9 12.2 51.6 0.5 104 104 A L E -cd 13 135A 0 30,-3.1 32,-2.8 -2,-0.3 2,-0.6 -0.896 19.3-160.2-102.0 123.9 13.6 48.1 0.1 105 105 A A E -cd 14 136A 0 -92,-3.8 -90,-2.6 -2,-0.5 2,-0.6 -0.897 1.9-161.6-115.2 109.3 17.0 47.6 1.8 106 106 A I E -cd 15 137A 0 30,-2.7 32,-2.8 -2,-0.6 2,-1.3 -0.806 9.0-150.6 -89.0 121.9 19.1 44.6 0.7 107 107 A L E S+ d 0 138A 0 -92,-3.4 -90,-0.4 -2,-0.6 2,-0.1 -0.685 72.9 51.1 -93.1 81.6 21.8 43.7 3.2 108 108 A G > - 0 0 9 -2,-1.3 4,-2.7 30,-1.0 5,-0.1 -0.150 64.4-145.7 149.8 112.6 24.4 42.3 1.0 109 109 A K H > S+ 0 0 55 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.948 108.3 43.0 -58.7 -51.0 26.0 43.7 -2.2 110 110 A Q H > S+ 0 0 108 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.930 110.0 58.5 -62.0 -42.3 26.4 40.2 -3.7 111 111 A A H > S+ 0 0 3 1,-0.2 4,-3.7 2,-0.2 5,-0.3 0.945 108.0 46.4 -50.7 -54.9 22.8 39.4 -2.5 112 112 A Y H X S+ 0 0 2 -4,-2.7 4,-3.7 1,-0.2 5,-0.3 0.945 112.7 47.5 -51.0 -62.4 21.4 42.3 -4.5 113 113 A E H X>S+ 0 0 28 -4,-2.1 5,-1.9 2,-0.2 4,-0.6 0.850 119.5 40.1 -48.9 -45.4 23.3 41.6 -7.7 114 114 A Q H ><5S+ 0 0 38 -4,-2.8 3,-0.6 3,-0.2 -2,-0.2 0.957 118.0 46.2 -70.0 -54.7 22.4 37.9 -7.6 115 115 A G H 3<5S+ 0 0 4 -4,-3.7 -2,-0.2 -5,-0.3 -3,-0.2 0.846 127.8 28.1 -58.3 -38.6 18.8 38.4 -6.4 116 116 A F H 3<5S- 0 0 22 -4,-3.7 -1,-0.2 -5,-0.3 -2,-0.2 0.294 104.7-118.7-108.9 10.1 18.2 41.2 -9.0 117 117 A S T <<5 + 0 0 76 -3,-0.6 2,-0.4 -4,-0.6 -3,-0.2 0.967 62.1 146.7 50.1 63.6 20.6 40.2 -11.8 118 118 A Q < - 0 0 75 -5,-1.9 3,-0.3 -6,-0.1 2,-0.3 -0.988 35.4-146.8-131.4 137.9 22.6 43.4 -11.5 119 119 A R S S+ 0 0 97 -2,-0.4 -5,-0.0 1,-0.2 0, 0.0 -0.711 71.6 3.5-107.2 156.0 26.4 43.8 -12.1 120 120 A G S S+ 0 0 58 -2,-0.3 -1,-0.2 1,-0.1 2,-0.0 0.761 80.3 179.5 43.7 37.0 28.9 46.2 -10.6 121 121 A A - 0 0 9 -3,-0.3 2,-0.3 -12,-0.1 -1,-0.1 -0.341 16.6-140.2 -66.9 142.9 26.3 47.6 -8.2 122 122 A Q - 0 0 132 3,-0.1 15,-0.1 1,-0.1 -1,-0.1 -0.721 25.2 -91.2-106.2 157.4 27.6 50.2 -5.8 123 123 A W S S+ 0 0 127 -2,-0.3 2,-0.3 13,-0.1 15,-0.2 -0.247 90.4 24.6 -59.2 155.6 26.7 50.7 -2.1 124 124 A G E S+E 137 0A 11 13,-2.9 13,-2.6 2,-0.0 2,-0.2 -0.670 106.1 10.0 96.6-150.1 23.8 53.0 -1.4 125 125 A K E -E 136 0A 129 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.512 62.2-150.3 -75.7 142.2 20.8 54.0 -3.5 126 126 A Q E -E 135 0A 23 9,-2.5 9,-0.5 2,-0.3 -2,-0.0 -0.846 19.6-135.5-112.4 147.0 20.1 52.2 -6.7 127 127 A T E S+ 0 0 149 -2,-0.3 -1,-0.1 7,-0.1 9,-0.0 0.775 83.5 98.9 -68.8 -27.7 18.4 53.6 -9.8 128 128 A L E + 0 0 56 7,-0.1 7,-1.0 6,-0.1 2,-0.3 -0.363 56.2 178.1 -60.7 139.9 16.4 50.4 -9.9 129 129 A T E -E 134 0A 77 5,-0.2 2,-0.3 -26,-0.0 5,-0.2 -0.838 34.5-139.4-136.3 174.8 12.9 50.6 -8.3 130 130 A I E > S-E 133 0A 24 3,-2.6 3,-2.1 1,-0.3 2,-0.2 -0.809 72.2 -67.3-140.5 83.6 9.9 48.5 -7.7 131 131 A G T 3 S- 0 0 70 -2,-0.3 -1,-0.3 1,-0.3 -34,-0.0 -0.422 117.7 -12.7 67.0-128.0 7.0 50.9 -8.4 132 132 A S T 3 S+ 0 0 114 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.613 118.5 99.3 -78.3 -13.0 7.0 53.6 -5.8 133 133 A T E < - E 0 130A 3 -3,-2.1 -3,-2.6 -30,-0.1 2,-0.3 -0.601 64.2-150.8 -78.5 126.7 9.5 51.6 -3.7 134 134 A Q E -dE 103 129A 50 -32,-2.5 -30,-3.1 -2,-0.4 2,-0.4 -0.711 12.6-131.2 -96.2 155.3 13.1 52.7 -4.0 135 135 A I E -dE 104 126A 0 -7,-1.0 -9,-2.5 -9,-0.5 2,-0.3 -0.878 20.9-174.9-113.0 139.6 15.9 50.1 -3.6 136 136 A W E -dE 105 125A 8 -32,-2.8 -30,-2.7 -2,-0.4 2,-0.5 -0.915 18.3-145.0-131.9 152.2 19.1 50.3 -1.5 137 137 A V E +dE 106 124A 1 -13,-2.6 -13,-2.9 -2,-0.3 -30,-0.2 -0.983 25.7 178.8-118.3 116.7 22.2 48.2 -1.0 138 138 A L E -d 107 0A 3 -32,-2.8 -30,-1.0 -2,-0.5 14,-0.1 -0.915 35.0 -97.0-119.4 145.6 23.5 48.2 2.6 139 139 A P - 0 0 11 0, 0.0 17,-0.1 0, 0.0 -32,-0.0 -0.309 47.8-100.2 -63.4 140.2 26.5 46.3 4.1 140 140 A N - 0 0 36 1,-0.1 7,-0.2 -33,-0.1 5,-0.2 -0.457 22.7-141.0 -67.1 126.0 25.7 43.1 5.9 141 141 A P + 0 0 0 0, 0.0 -105,-2.2 0, 0.0 -104,-0.3 0.251 57.8 129.3 -69.2 5.3 25.6 43.4 9.7 142 142 A S > - 0 0 34 -107,-0.2 3,-1.4 1,-0.2 -107,-0.1 -0.380 67.9-129.4 -64.8 146.1 27.2 40.1 10.3 143 143 A G T 3 S+ 0 0 48 1,-0.3 -1,-0.2 3,-0.1 -108,-0.1 0.456 107.2 72.2 -73.8 1.1 30.2 40.1 12.6 144 144 A L T 3 S+ 0 0 89 2,-0.0 -1,-0.3 -4,-0.0 2,-0.3 0.732 77.1 89.7 -85.2 -26.0 31.9 38.2 9.8 145 145 A S S < S- 0 0 38 -3,-1.4 0, 0.0 -5,-0.2 0, 0.0 -0.550 75.1-143.6 -72.0 132.9 32.0 41.3 7.7 146 146 A R + 0 0 227 -2,-0.3 2,-0.4 2,-0.1 -1,-0.1 0.344 66.2 120.4 -77.2 5.6 35.3 43.2 8.4 147 147 A V - 0 0 47 -7,-0.2 -2,-0.1 1,-0.1 2,-0.0 -0.603 68.1-119.0 -75.4 129.4 33.2 46.4 8.0 148 148 A S > - 0 0 63 -2,-0.4 4,-3.0 1,-0.1 3,-0.3 -0.298 12.1-120.4 -68.9 153.1 33.3 48.5 11.2 149 149 A L H > S+ 0 0 55 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.933 115.7 56.7 -55.6 -47.3 30.3 49.3 13.2 150 150 A E H > S+ 0 0 62 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.873 112.2 42.3 -53.5 -38.3 31.0 53.0 12.7 151 151 A K H > S+ 0 0 37 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.960 113.3 50.9 -73.3 -52.4 30.9 52.4 8.9 152 152 A L H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 5,-0.2 0.932 110.3 51.4 -49.0 -52.4 27.8 50.1 9.1 153 153 A V H X S+ 0 0 6 -4,-3.4 4,-3.3 1,-0.2 -1,-0.2 0.940 108.2 49.9 -53.4 -54.2 26.0 52.7 11.1 154 154 A E H X S+ 0 0 126 -4,-1.8 4,-2.7 -5,-0.2 -1,-0.2 0.932 107.6 55.5 -51.8 -49.2 26.7 55.6 8.7 155 155 A A H X S+ 0 0 25 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.908 114.2 38.2 -49.5 -52.2 25.5 53.5 5.8 156 156 A Y H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.889 112.4 59.0 -69.8 -37.1 22.1 52.8 7.4 157 157 A R H X S+ 0 0 93 -4,-3.3 4,-2.7 -5,-0.2 5,-0.3 0.873 99.9 56.9 -58.3 -40.0 22.0 56.4 8.8 158 158 A E H X S+ 0 0 109 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.922 109.3 46.4 -58.1 -44.4 22.2 57.8 5.2 159 159 A L H X S+ 0 0 0 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.945 110.3 51.7 -64.0 -53.2 19.1 55.8 4.3 160 160 A D H >< S+ 0 0 34 -4,-2.5 3,-0.8 1,-0.3 -2,-0.2 0.946 115.6 41.4 -48.1 -57.5 17.1 56.8 7.4 161 161 A Q H 3< S+ 0 0 124 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.844 109.1 61.9 -59.9 -33.8 17.8 60.5 6.7 162 162 A A H 3< S+ 0 0 45 -4,-2.0 2,-1.3 -5,-0.3 -1,-0.2 0.804 91.7 70.5 -64.0 -30.2 17.2 59.8 3.0 163 163 A L S << S- 0 0 7 -4,-1.8 -1,-0.2 -3,-0.8 -60,-0.0 -0.677 76.1-175.4 -91.8 84.1 13.6 58.8 3.8 164 164 A V 0 0 115 -2,-1.3 -2,-0.1 1,-0.0 -3,-0.0 -0.002 360.0 360.0 -67.9 179.8 12.1 62.1 4.8 165 165 A V 0 0 177 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 -0.969 360.0 360.0-138.4 360.0 8.5 62.6 6.0