==== 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 HYDROLASE/HYDROLASE INHIBITOR 01-NOV-99 1DAZ . COMPND 2 MOLECULE: HIV-1 PROTEASE (RETROPEPSIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR B.MAHALINGAM,J.M.LOUIS,C.C.REED,J.M.ADOMAT,J.KROUSE,Y.F.WANG . 199 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9619.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 36.7 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 . 6 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 25 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 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 RESIDUES PER ALPHA HELIX . 0 3 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 PARALLEL BRIDGES PER LADDER . 2 1 4 0 0 2 2 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 1 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 1 C P 0 0 89 0, 0.0 198,-2.1 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 164.0 13.6 14.1 29.3 2 2 C Q E -A 198 0A 127 196,-0.2 2,-0.5 197,-0.2 196,-0.2 -0.982 360.0-163.7-119.8 130.3 17.2 14.2 28.0 3 3 C I E -A 197 0A 30 194,-3.1 194,-2.8 -2,-0.4 2,-0.1 -0.968 7.6-150.9-119.2 118.1 17.9 15.0 24.4 4 4 C T - 0 0 63 -2,-0.5 3,-0.3 192,-0.2 192,-0.1 -0.339 15.4-130.3 -78.2 168.8 21.3 14.2 22.9 5 5 C L S S+ 0 0 2 190,-0.5 186,-0.2 1,-0.2 185,-0.1 0.177 74.2 109.4-111.8 20.2 22.7 16.3 20.1 6 6 C W S S+ 0 0 191 185,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.857 95.3 16.3 -59.9 -36.9 23.7 13.7 17.5 7 7 C K S S- 0 0 166 -3,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.824 113.4 -62.2-130.0 168.7 20.9 15.0 15.4 8 8 C R - 0 0 81 -2,-0.3 2,-2.2 1,-0.1 119,-0.1 -0.287 52.1-118.0 -53.8 131.5 18.8 18.1 15.5 9 9 C P + 0 0 2 0, 0.0 15,-2.7 0, 0.0 2,-0.4 -0.481 50.3 169.1 -75.0 76.0 16.8 18.4 18.8 10 10 C L E +D 23 0B 89 -2,-2.2 2,-0.3 13,-0.2 13,-0.2 -0.734 6.9 172.3 -94.2 136.3 13.4 18.3 17.3 11 11 C V E -D 22 0B 17 11,-2.7 11,-3.0 -2,-0.4 2,-0.4 -0.897 36.3-100.2-136.7 163.1 10.2 17.9 19.4 12 12 C T E -D 21 0B 67 -2,-0.3 55,-2.4 9,-0.2 2,-0.3 -0.714 41.1-174.5 -85.7 135.8 6.5 18.1 18.8 13 13 C I E -DE 20 66B 1 7,-3.2 7,-2.3 -2,-0.4 2,-0.4 -0.886 18.0-143.5-127.1 160.0 4.8 21.3 19.8 14 14 C K E +DE 19 65B 91 51,-2.1 51,-2.4 -2,-0.3 2,-0.3 -0.994 29.6 156.9-126.9 123.1 1.1 22.5 19.9 15 15 C I E > -DE 18 64B 2 3,-2.5 3,-2.0 -2,-0.4 49,-0.1 -0.985 66.4 -1.5-147.7 134.1 0.3 26.0 19.0 16 16 C G T 3 S- 0 0 52 47,-0.6 3,-0.1 -2,-0.3 48,-0.1 0.767 129.9 -56.8 58.5 26.2 -2.9 27.6 17.8 17 17 C G T 3 S+ 0 0 74 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.547 116.5 109.2 83.1 8.5 -4.6 24.2 17.8 18 18 C Q E < -D 15 0B 98 -3,-2.0 -3,-2.5 2,-0.0 2,-0.4 -0.927 62.1-135.6-120.9 145.2 -2.0 22.7 15.5 19 19 C L E +D 14 0B 122 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.801 34.3 162.6 -96.6 136.9 0.8 20.2 16.0 20 20 C K E -D 13 0B 23 -7,-2.3 -7,-3.2 -2,-0.4 2,-0.4 -0.919 39.1-109.0-145.3 167.5 4.2 20.9 14.5 21 21 C E E -D 12 0B 101 -2,-0.3 62,-0.4 -9,-0.2 2,-0.3 -0.886 39.5-176.5-103.0 133.5 7.8 19.9 14.8 22 22 C A E -D 11 0B 0 -11,-3.0 -11,-2.7 -2,-0.4 2,-0.5 -0.964 24.7-122.4-134.1 152.9 10.2 22.5 16.3 23 23 C L E -Df 10 84B 2 60,-3.2 62,-3.0 -2,-0.3 2,-0.8 -0.795 21.1-132.5 -95.8 125.0 13.9 22.8 17.0 24 24 C L E - f 0 85B 1 -15,-2.7 2,-0.6 -2,-0.5 62,-0.1 -0.697 33.0-172.5 -77.8 111.4 15.0 23.4 20.6 25 25 C D > + 0 0 1 60,-2.6 3,-1.5 -2,-0.8 62,-0.3 -0.867 26.4 179.7-118.4 103.3 17.5 26.3 20.1 26 26 C T T 3 S+ 0 0 0 -2,-0.6 -1,-0.1 1,-0.3 98,-0.1 0.645 87.3 61.4 -71.2 -16.7 19.6 27.6 22.9 27 27 C G T 3 S+ 0 0 17 81,-0.1 2,-0.5 96,-0.1 -1,-0.3 0.278 88.8 85.4 -91.6 6.4 21.2 30.0 20.5 28 28 C A < - 0 0 16 -3,-1.5 59,-3.0 57,-0.2 60,-0.1 -0.948 57.5-165.3-111.2 126.3 17.8 31.7 19.8 29 29 C D S S+ 0 0 47 -2,-0.5 59,-1.3 57,-0.2 2,-0.2 0.841 77.8 35.3 -73.8 -32.4 16.7 34.5 22.2 30 30 C D S S- 0 0 73 57,-0.2 2,-0.5 56,-0.1 57,-0.2 -0.618 83.5-108.8-118.3 174.9 13.1 34.2 20.8 31 31 C T - 0 0 0 43,-0.4 45,-2.8 -2,-0.2 2,-0.5 -0.916 30.5-172.0-110.6 124.1 10.7 31.7 19.5 32 32 C V E -gH 76 84B 8 52,-1.8 52,-3.2 -2,-0.5 2,-0.3 -0.967 1.1-169.2-123.8 122.1 9.9 31.7 15.7 33 33 C I E -g 77 0B 0 43,-3.2 45,-2.0 -2,-0.5 47,-0.2 -0.822 31.8 -96.1-112.9 144.9 7.2 29.7 14.1 34 34 C E E -g 78 0B 84 -2,-0.3 -1,-0.1 43,-0.2 49,-0.0 -0.136 65.5 -67.9 -52.9 147.8 6.5 29.0 10.4 35 35 C E S S+ 0 0 101 43,-0.6 2,-0.3 45,-0.2 -1,-0.2 -0.137 71.9 158.4 -42.8 120.3 3.9 31.2 8.8 36 36 C M - 0 0 14 -3,-0.2 2,-2.3 2,-0.1 -3,-0.1 -0.987 51.4-109.9-150.5 145.5 0.5 30.4 10.3 37 37 C S + 0 0 120 -2,-0.3 -2,-0.1 -21,-0.0 40,-0.0 -0.406 47.3 174.6 -77.8 66.1 -2.9 32.2 10.6 38 38 C L - 0 0 15 -2,-2.3 2,-0.1 1,-0.1 -2,-0.1 -0.535 27.1-127.1 -74.0 130.9 -2.7 32.8 14.3 39 39 C P + 0 0 105 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.383 60.4 49.9 -78.0 161.6 -5.6 34.9 15.5 40 40 C G S S- 0 0 60 -2,-0.1 2,-0.2 2,-0.0 -2,-0.0 -0.446 87.9 -35.5 111.1 177.1 -5.1 38.1 17.6 41 41 C R + 0 0 208 -2,-0.1 19,-0.4 19,-0.1 2,-0.3 -0.493 57.4 172.2 -78.4 145.7 -3.2 41.3 17.8 42 42 C W - 0 0 104 -2,-0.2 17,-0.2 17,-0.1 15,-0.0 -0.964 24.7-139.9-150.3 166.8 0.4 41.5 16.6 43 43 C K E -I 58 0B 130 15,-1.5 15,-3.3 -2,-0.3 2,-0.3 -0.985 27.3-116.8-131.9 134.4 3.2 43.9 16.0 44 44 C P E +I 57 0B 97 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.573 44.5 161.1 -76.1 132.0 5.6 43.8 13.0 45 45 C I E -I 56 0B 44 11,-2.6 11,-2.6 -2,-0.3 2,-0.4 -0.892 33.1-124.0-140.3 171.9 9.3 43.3 14.0 46 46 C M E -I 55 0B 113 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.982 22.0-174.6-124.6 131.7 12.5 42.2 12.4 47 47 C I E -I 54 0B 20 7,-2.3 7,-2.6 -2,-0.4 2,-0.3 -0.951 8.5-168.8-122.6 148.7 14.7 39.3 13.7 48 48 C G E +I 53 0B 38 -2,-0.4 2,-0.2 5,-0.2 5,-0.2 -0.830 21.1 139.1-135.2 174.7 18.1 38.3 12.4 49 49 C G E > -I 52 0B 22 3,-1.8 3,-1.7 -2,-0.3 100,-0.1 -0.845 67.2 -1.9-176.5-149.2 20.8 35.7 12.5 50 50 C I T 3 S+ 0 0 6 -2,-0.2 101,-2.1 1,-0.2 102,-0.8 -0.389 131.6 18.4 -60.8 133.0 23.2 34.1 10.0 51 51 C G T 3 S- 0 0 33 100,-0.3 2,-0.3 99,-0.1 102,-0.3 0.166 121.6 -80.1 94.0 -22.4 22.4 35.5 6.5 52 52 C G E < -I 49 0B 26 -3,-1.7 -3,-1.8 100,-0.2 2,-0.3 -0.907 64.4 -34.0 131.9-156.0 20.5 38.6 7.7 53 53 C F E -I 48 0B 136 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.733 37.3-163.0-112.3 157.7 17.1 39.6 8.9 54 54 C I E -I 47 0B 25 -7,-2.6 -7,-2.3 -2,-0.3 2,-0.4 -0.970 25.6-114.1-136.3 150.3 13.5 38.6 8.3 55 55 C K E +I 46 0B 159 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.722 41.2 171.3 -85.6 131.1 10.1 40.3 8.9 56 56 C V E -I 45 0B 6 -11,-2.6 -11,-2.6 -2,-0.4 2,-0.5 -0.906 34.0-116.9-136.7 161.9 7.9 38.5 11.5 57 57 C R E -IJ 44 77B 49 20,-2.6 20,-2.1 -2,-0.3 2,-0.6 -0.909 28.0-141.8-102.2 126.6 4.7 39.2 13.4 58 58 C Q E -IJ 43 76B 45 -15,-3.3 -15,-1.5 -2,-0.5 2,-0.4 -0.804 18.5-173.9 -94.5 118.4 5.1 39.4 17.2 59 59 C Y E - J 0 75B 7 16,-2.6 16,-2.5 -2,-0.6 3,-0.4 -0.936 11.1-147.7-111.8 132.2 2.3 37.9 19.2 60 60 C D E S+ 0 0 99 -2,-0.4 14,-0.2 -19,-0.4 -19,-0.1 -0.627 72.4 14.9 -99.0 154.0 2.2 38.2 23.0 61 61 C Q E S+ 0 0 138 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.843 77.2 168.1 56.7 41.3 0.8 35.7 25.5 62 62 C I E - J 0 73B 24 11,-3.1 11,-2.3 -3,-0.4 2,-0.4 -0.735 31.9-132.5 -88.2 129.3 0.6 32.8 23.1 63 63 C I E + J 0 72B 116 -2,-0.4 -47,-0.6 9,-0.2 2,-0.4 -0.671 32.7 172.6 -80.1 135.4 -0.0 29.4 24.7 64 64 C I E -EJ 15 71B 1 7,-2.9 7,-1.4 -2,-0.4 2,-0.5 -0.990 25.3-148.6-148.9 131.2 2.3 26.7 23.4 65 65 C E E -EJ 14 70B 51 -51,-2.4 -51,-2.1 -2,-0.4 2,-0.6 -0.919 15.0-166.0-102.4 124.9 2.9 23.1 24.5 66 66 C I E > S-EJ 13 69B 0 3,-3.6 3,-2.3 -2,-0.5 -53,-0.2 -0.946 71.2 -28.5-116.6 110.9 6.5 21.9 24.0 67 67 C A T 3 S- 0 0 35 -55,-2.4 -1,-0.2 -2,-0.6 -54,-0.1 0.894 129.0 -44.8 50.9 44.3 7.1 18.2 24.3 68 68 C G T 3 S+ 0 0 56 -56,-0.3 2,-0.6 1,-0.2 -1,-0.3 0.345 116.9 118.7 84.7 -7.8 4.1 17.9 26.6 69 69 C H E < - J 0 66B 67 -3,-2.3 -3,-3.6 1,-0.0 -1,-0.2 -0.841 59.0-137.1 -98.6 120.3 5.2 20.9 28.6 70 70 C K E + J 0 65B 150 -2,-0.6 2,-0.3 -5,-0.3 -5,-0.2 -0.453 31.7 160.9 -74.3 145.9 2.8 23.9 28.7 71 71 C A E - J 0 64B 9 -7,-1.4 -7,-2.9 -2,-0.1 2,-0.3 -0.969 23.9-153.4-158.0 162.0 4.1 27.4 28.4 72 72 C I E + J 0 63B 73 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.971 39.1 99.8-146.5 126.3 2.9 30.9 27.5 73 73 C G E - J 0 62B 9 -11,-2.3 -11,-3.1 -2,-0.3 2,-0.4 -0.946 66.7 -29.4-173.5-161.4 4.9 33.7 26.0 74 74 C T E - 0 0 45 -2,-0.3 -43,-0.4 -13,-0.2 2,-0.4 -0.612 50.4-173.1 -81.2 129.4 5.9 35.8 23.0 75 75 C V E - J 0 59B 0 -16,-2.5 -16,-2.6 -2,-0.4 2,-0.4 -0.993 11.7-150.5-126.9 131.3 5.8 34.0 19.7 76 76 C L E -gJ 32 58B 2 -45,-2.8 -43,-3.2 -2,-0.4 2,-0.4 -0.831 10.8-160.3-100.6 137.5 7.1 35.4 16.4 77 77 C V E +gJ 33 57B 1 -20,-2.1 -20,-2.6 -2,-0.4 -43,-0.2 -0.981 35.0 99.1-123.3 128.5 5.5 34.2 13.1 78 78 C G E S-g 34 0B 1 -45,-2.0 2,-2.4 -2,-0.4 -43,-0.6 -0.976 78.9 -41.6-178.5-172.0 7.1 34.5 9.7 79 79 C P + 0 0 93 0, 0.0 -45,-0.1 0, 0.0 -23,-0.0 -0.316 68.3 155.9 -73.8 57.5 9.1 32.9 6.9 80 80 C T - 0 0 13 -2,-2.4 -45,-0.2 -47,-0.2 70,-0.1 -0.634 46.5-135.5 -82.6 141.7 11.6 31.0 9.1 81 81 C P S S+ 0 0 60 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.747 89.8 22.2 -69.3 -20.6 13.2 27.9 7.5 82 82 C V S S- 0 0 27 -50,-0.1 2,-0.4 68,-0.0 -60,-0.1 -0.995 87.2-106.9-146.5 145.2 12.6 25.9 10.7 83 83 C N - 0 0 9 -62,-0.4 -60,-3.2 -2,-0.3 2,-0.4 -0.633 45.2-162.5 -72.0 126.0 10.2 26.2 13.7 84 84 C I E -fH 23 32B 6 -52,-3.2 -52,-1.8 -2,-0.4 2,-0.7 -0.955 19.8-157.9-123.2 125.7 12.4 27.4 16.5 85 85 C I E -f 24 0B 0 -62,-3.0 -60,-2.6 -2,-0.4 -57,-0.2 -0.900 27.6-166.7 -98.7 113.6 11.8 27.3 20.3 86 86 C G >> - 0 0 0 -2,-0.7 4,-2.5 -62,-0.1 3,-1.5 -0.299 37.1 -84.0 -93.9-177.3 14.1 29.9 21.8 87 87 C R H 3> S+ 0 0 33 -59,-3.0 4,-2.2 -62,-0.3 5,-0.3 0.772 117.4 70.5 -57.0 -32.1 15.2 30.8 25.4 88 88 C N H 34 S+ 0 0 41 -59,-1.3 -1,-0.3 1,-0.2 4,-0.2 0.830 116.6 24.4 -57.4 -31.2 12.1 32.8 26.2 89 89 C L H <> S+ 0 0 0 -3,-1.5 4,-1.4 2,-0.1 3,-0.3 0.743 114.1 65.0-102.6 -31.7 10.1 29.5 26.2 90 90 C L H <>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 3,-0.2 0.873 101.5 53.4 -59.6 -36.5 13.0 27.1 27.0 91 91 C T T ><5S+ 0 0 17 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.861 104.4 56.2 -65.7 -35.2 13.3 28.8 30.4 92 92 C Q T 345S+ 0 0 86 -5,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.803 107.9 46.1 -67.3 -32.9 9.6 28.2 31.0 93 93 C I T 3<5S- 0 0 12 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.310 117.7-113.6 -92.7 9.9 9.8 24.5 30.5 94 94 C G T < 5 + 0 0 49 -3,-1.1 -3,-0.2 1,-0.2 2,-0.2 0.788 53.9 170.7 65.3 33.5 12.9 24.4 32.7 95 95 C A < + 0 0 3 -5,-2.6 10,-0.6 -6,-0.1 2,-0.3 -0.504 6.4 178.6 -79.3 141.6 15.4 23.4 30.0 96 96 C T E -BC 104 198A 13 102,-2.4 102,-2.3 -2,-0.2 2,-0.4 -0.905 28.9-123.7-137.5 162.0 19.1 23.3 30.7 97 97 C L E -BC 103 197A 0 6,-2.4 6,-3.2 -2,-0.3 2,-0.4 -0.919 33.8-168.6-104.8 135.3 22.3 22.5 28.8 98 98 C N E BC 102 196A 31 98,-2.3 98,-1.9 -2,-0.4 4,-0.2 -0.990 360.0 360.0-137.0 132.2 24.5 19.9 30.6 99 99 C F 0 0 53 2,-1.7 3,-0.2 -2,-0.4 -1,-0.1 0.270 360.0 360.0-158.4 360.0 28.0 18.7 30.1 100 !* 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 0.0 101 101 D P 0 0 86 0, 0.0 -2,-1.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0-176.0 28.2 22.0 34.4 102 102 D Q E -B 98 0A 129 -4,-0.2 2,-0.5 -3,-0.2 -4,-0.2 -0.910 360.0-163.5-101.9 127.6 24.4 22.7 34.2 103 103 D I E -B 97 0A 32 -6,-3.2 -6,-2.4 -2,-0.5 2,-0.1 -0.957 4.4-153.4-118.0 122.0 23.6 25.9 32.4 104 104 D T E -B 96 0A 73 -2,-0.5 3,-0.3 -8,-0.2 -8,-0.1 -0.434 17.5-128.7 -84.2 168.0 20.1 27.5 32.7 105 105 D L S S+ 0 0 1 -10,-0.6 -14,-0.2 1,-0.2 -15,-0.1 0.112 74.2 107.6-113.1 26.5 18.8 29.7 29.9 106 106 D W S S+ 0 0 184 -15,-0.1 2,-0.3 -16,-0.1 -1,-0.2 0.793 93.1 29.9 -70.2 -27.1 17.7 33.0 31.4 107 107 D K S S- 0 0 124 -3,-0.3 0, 0.0 1,-0.0 0, 0.0 -0.792 112.1 -76.4-122.6 167.1 20.8 34.6 29.8 108 108 D R - 0 0 100 -2,-0.3 2,-2.3 1,-0.1 -81,-0.1 -0.416 48.3-116.7 -63.1 134.7 22.6 33.6 26.6 109 109 D P + 0 0 3 0, 0.0 15,-2.6 0, 0.0 2,-0.4 -0.485 52.9 167.5 -76.8 74.5 24.7 30.5 27.2 110 110 D L E +K 123 0C 55 -2,-2.3 2,-0.3 13,-0.2 13,-0.2 -0.746 7.6 173.0 -91.9 136.2 28.0 32.2 26.5 111 111 D V E -K 122 0C 21 11,-2.8 11,-2.7 -2,-0.4 2,-0.4 -0.869 34.6-102.3-135.9 167.6 31.3 30.5 27.4 112 112 D T E -K 121 0C 82 -2,-0.3 55,-2.6 9,-0.2 56,-0.3 -0.783 38.9-175.9 -93.7 135.9 35.0 31.2 26.9 113 113 D I E -KL 120 166C 0 7,-2.9 7,-2.1 -2,-0.4 2,-0.4 -0.821 19.2-141.3-123.9 165.0 36.7 29.1 24.2 114 114 D K E +KL 119 165C 52 51,-1.8 51,-2.2 -2,-0.3 2,-0.4 -0.996 26.7 166.6-130.2 121.7 40.3 28.9 23.1 115 115 D I E > S-KL 118 164C 0 3,-2.7 3,-2.1 -2,-0.4 49,-0.1 -0.992 71.0 -1.3-140.0 128.1 41.0 28.6 19.4 116 116 D G T 3 S- 0 0 44 47,-0.7 3,-0.1 -2,-0.4 48,-0.1 0.724 130.1 -62.1 65.7 20.0 44.3 29.0 17.7 117 117 D G T 3 S+ 0 0 58 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.343 115.5 116.3 86.6 -5.4 45.7 29.8 21.1 118 118 D Q E < -K 115 0C 102 -3,-2.1 -3,-2.7 1,-0.0 2,-0.3 -0.757 63.5-127.4-101.0 141.7 43.4 32.8 21.4 119 119 D L E +K 114 0C 121 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.677 35.3 163.9 -88.4 138.2 40.5 33.3 23.8 120 120 D K E -K 113 0C 29 -7,-2.1 -7,-2.9 -2,-0.3 2,-0.4 -0.931 36.8-115.3-145.3 164.0 37.0 34.2 22.6 121 121 D E E +K 112 0C 122 -2,-0.3 62,-0.4 -9,-0.2 2,-0.3 -0.885 38.6 178.6-103.4 136.5 33.5 34.2 23.8 122 122 D A E -K 111 0C 1 -11,-2.7 -11,-2.8 -2,-0.4 2,-0.5 -0.977 26.6-121.6-140.9 156.0 31.1 31.9 22.1 123 123 D L E -Km 110 184C 8 60,-2.9 62,-3.0 -2,-0.3 2,-0.8 -0.841 20.9-131.0-100.7 126.7 27.4 30.8 22.3 124 124 D L E - m 0 185C 0 -15,-2.6 2,-0.6 -2,-0.5 62,-0.1 -0.680 34.4-172.0 -76.2 111.2 26.4 27.2 22.9 125 125 D D > - 0 0 3 60,-2.6 3,-1.9 -2,-0.8 62,-0.3 -0.832 26.6-179.2-118.4 100.6 23.9 26.7 20.1 126 126 D T T 3 S+ 0 0 0 -2,-0.6 -1,-0.1 1,-0.3 -102,-0.1 0.649 87.5 61.6 -68.0 -14.6 21.8 23.6 20.0 127 127 D G T 3 S+ 0 0 2 -119,-0.1 2,-0.5 -104,-0.1 -1,-0.3 0.332 87.9 87.4 -92.4 6.0 20.1 25.0 16.8 128 128 D A < - 0 0 0 -3,-1.9 59,-3.2 57,-0.2 60,-0.2 -0.930 56.8-165.5-109.5 124.3 23.4 25.1 14.9 129 129 D D S S+ 0 0 27 72,-2.4 59,-1.3 -2,-0.5 2,-0.2 0.878 79.1 31.1 -69.1 -38.3 24.6 22.0 13.0 130 130 D D S S- 0 0 49 71,-0.2 2,-0.5 57,-0.2 57,-0.2 -0.611 84.7-106.0-117.5 174.1 28.1 23.5 12.8 131 131 D T - 0 0 0 43,-0.4 45,-3.0 -2,-0.2 2,-0.5 -0.896 33.1-172.2-106.4 123.0 30.5 25.7 14.6 132 132 D V E -nO 176 184C 0 52,-1.6 52,-2.9 -2,-0.5 2,-0.3 -0.981 1.2-172.9-122.9 123.3 30.9 29.2 13.2 133 133 D I E -n 177 0C 0 43,-3.3 45,-2.5 -2,-0.5 3,-0.1 -0.872 31.9-100.6-115.1 145.6 33.6 31.7 14.4 134 134 D E - 0 0 78 -2,-0.3 -1,-0.1 43,-0.2 49,-0.0 -0.148 62.6 -68.1 -57.0 157.8 34.0 35.3 13.4 135 135 D E S S+ 0 0 96 43,-0.3 2,-0.3 42,-0.1 -1,-0.2 -0.195 75.9 141.8 -52.9 135.6 36.8 36.1 10.9 136 136 D M - 0 0 24 -3,-0.1 2,-0.6 2,-0.0 -3,-0.0 -0.956 58.1 -88.2-164.1 170.1 40.2 35.5 12.4 137 137 D S + 0 0 119 -2,-0.3 -2,-0.0 -21,-0.0 0, 0.0 -0.846 49.9 179.7 -91.9 120.7 43.7 34.2 11.5 138 138 D L - 0 0 15 -2,-0.6 2,-0.4 2,-0.1 -2,-0.0 -0.991 30.0-121.3-130.4 126.4 43.6 30.4 12.1 139 139 D P S S+ 0 0 99 0, 0.0 2,-0.2 0, 0.0 -23,-0.1 -0.507 73.1 63.4 -67.0 120.6 46.4 28.0 11.5 140 140 D G S S- 0 0 50 -2,-0.4 2,-0.3 22,-0.1 -2,-0.1 -0.702 84.7 -72.8 145.4 163.9 45.3 25.3 9.1 141 141 D R - 0 0 196 -2,-0.2 19,-0.6 19,-0.2 2,-0.3 -0.632 50.1-172.7 -84.8 144.6 44.2 24.6 5.5 142 142 D W E -P 159 0C 86 -2,-0.3 17,-0.2 17,-0.2 34,-0.0 -0.935 18.0-151.5-138.5 162.9 40.6 25.6 4.6 143 143 D K E -P 158 0C 96 15,-1.7 15,-3.3 -2,-0.3 2,-0.3 -0.991 29.1-110.8-134.9 141.0 38.1 25.4 1.8 144 144 D P E +P 157 0C 102 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.552 46.4 156.0 -76.0 129.4 35.3 27.8 0.8 145 145 D I E -P 156 0C 46 11,-2.6 11,-3.2 -2,-0.3 2,-0.4 -0.891 35.1-120.5-141.3 173.0 31.7 26.8 1.5 146 146 D M E -P 155 0C 116 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.961 23.5-172.7-122.7 137.9 28.3 28.3 2.1 147 147 D I E -P 154 0C 10 7,-2.1 7,-2.4 -2,-0.4 2,-0.3 -0.896 13.0-136.4-126.3 156.7 26.1 27.9 5.1 148 148 D G E +P 153 0C 2 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.821 22.7 165.9-115.9 156.2 22.6 29.0 5.9 149 149 D G - 0 0 7 3,-2.5 3,-0.3 -2,-0.3 -98,-0.1 -0.620 57.2 -60.7-141.1-157.4 20.9 30.5 8.8 150 150 D I S S+ 0 0 18 1,-0.2 -99,-0.1 -2,-0.2 3,-0.1 0.883 131.5 35.4 -66.3 -38.0 17.6 32.3 9.8 151 151 D G S S- 0 0 24 -101,-2.1 2,-0.3 -99,-0.3 -100,-0.3 0.494 122.8 -81.1 -97.4 -2.6 18.1 35.2 7.3 152 152 D G - 0 0 24 -102,-0.8 -3,-2.5 -3,-0.3 2,-0.3 -0.973 63.2 -32.7 143.0-155.4 19.8 33.5 4.4 153 153 D F E -P 148 0C 129 -2,-0.3 2,-0.3 -102,-0.3 -5,-0.2 -0.802 41.1-176.3-112.3 148.2 23.2 32.2 3.3 154 154 D I E -P 147 0C 27 -7,-2.4 -7,-2.1 -2,-0.3 2,-0.4 -0.917 29.4-109.5-136.1 159.5 26.8 33.4 3.8 155 155 D K E +P 146 0C 169 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.758 41.7 174.1 -90.1 133.0 30.3 32.4 2.6 156 156 D V E -P 145 0C 6 -11,-3.2 -11,-2.6 -2,-0.4 2,-0.5 -0.915 33.4-116.2-137.0 163.4 32.6 30.8 5.1 157 157 D R E -PQ 144 177C 89 20,-2.5 20,-2.5 -2,-0.3 2,-0.6 -0.900 28.5-144.8-100.2 124.4 36.0 29.1 5.3 158 158 D Q E -PQ 143 176C 35 -15,-3.3 -15,-1.7 -2,-0.5 2,-0.5 -0.829 17.5-176.4 -96.0 118.6 35.8 25.5 6.4 159 159 D Y E -PQ 142 175C 6 16,-2.4 16,-2.8 -2,-0.6 3,-0.4 -0.964 11.4-153.2-112.6 126.3 38.7 24.3 8.6 160 160 D D E + 0 0 84 -19,-0.6 14,-0.2 -2,-0.5 -19,-0.2 -0.621 67.7 14.7 -99.7 156.5 38.8 20.6 9.5 161 161 D Q E S+ 0 0 167 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.837 78.7 167.5 51.7 44.5 40.4 18.9 12.6 162 162 D I E - Q 0 173C 15 11,-3.0 11,-2.1 -3,-0.4 2,-0.5 -0.745 34.5-129.4 -91.0 130.9 40.8 22.2 14.5 163 163 D I E + Q 0 172C 88 -2,-0.4 -47,-0.7 9,-0.2 2,-0.4 -0.675 37.2 167.9 -80.9 124.3 41.7 21.9 18.2 164 164 D I E -LQ 115 171C 0 7,-2.8 7,-2.0 -2,-0.5 2,-0.5 -1.000 27.7-146.1-142.6 137.1 39.3 24.1 20.3 165 165 D E E -LQ 114 170C 75 -51,-2.2 -51,-1.8 -2,-0.4 2,-0.6 -0.915 13.9-166.6-104.9 126.0 38.7 24.3 24.1 166 166 D I E > S-LQ 113 169C 0 3,-3.4 3,-2.2 -2,-0.5 -53,-0.2 -0.931 72.7 -29.1-117.8 109.1 35.1 25.0 25.1 167 167 D A T 3 S- 0 0 39 -55,-2.6 -1,-0.2 -2,-0.6 -54,-0.1 0.873 127.9 -46.6 53.6 39.4 34.6 26.0 28.7 168 168 D G T 3 S+ 0 0 54 -56,-0.3 2,-0.4 1,-0.3 -1,-0.3 0.324 117.2 116.5 87.5 -8.4 37.6 23.9 29.7 169 169 D H E < - Q 0 166C 66 -3,-2.2 -3,-3.4 1,-0.0 2,-0.3 -0.784 62.3-125.6 -98.5 137.7 36.5 20.9 27.6 170 170 D K E + Q 0 165C 114 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.589 32.3 165.1 -87.4 137.4 38.5 19.6 24.6 171 171 D A E - Q 0 164C 1 -7,-2.0 -7,-2.8 -2,-0.3 2,-0.3 -0.963 15.3-167.8-143.1 150.7 37.1 19.2 21.1 172 172 D I E + Q 0 163C 83 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.909 43.5 87.2-144.0 111.7 38.8 18.7 17.8 173 173 D G E S- Q 0 162C 12 -11,-2.1 -11,-3.0 -2,-0.3 2,-0.3 -0.907 72.2 -16.5-172.6-156.1 36.8 19.0 14.6 174 174 D T E - 0 0 40 -2,-0.3 2,-0.4 -13,-0.2 -43,-0.4 -0.521 47.2-176.6 -77.8 129.5 35.4 21.3 11.9 175 175 D V E - Q 0 159C 0 -16,-2.8 -16,-2.4 -2,-0.3 2,-0.4 -0.996 12.7-152.1-126.9 124.9 35.3 25.1 12.5 176 176 D L E -nQ 132 158C 2 -45,-3.0 -43,-3.3 -2,-0.4 2,-0.5 -0.841 10.5-158.6 -97.5 136.1 33.8 27.4 10.0 177 177 D V E +nQ 133 157C 0 -20,-2.5 -20,-2.5 -2,-0.4 -43,-0.2 -0.975 36.5 98.1-120.7 122.9 35.2 31.0 9.9 178 178 D G S S- 0 0 0 -45,-2.5 2,-2.3 -2,-0.5 -43,-0.3 -0.970 78.2 -40.5-175.5-171.7 33.2 33.9 8.5 179 179 D P + 0 0 92 0, 0.0 -45,-0.1 0, 0.0 -2,-0.0 -0.351 68.4 157.0 -72.7 62.0 31.0 37.0 9.0 180 180 D T - 0 0 15 -2,-2.3 -45,-0.1 -47,-0.1 3,-0.1 -0.652 51.5-124.5 -89.1 144.7 28.7 35.5 11.7 181 181 D P S S- 0 0 86 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.846 92.9 -3.5 -54.1 -38.6 26.8 37.8 14.1 182 182 D V S S- 0 0 54 -50,-0.1 2,-0.3 -59,-0.0 -50,-0.1 -0.973 87.7 -87.4-150.9 159.8 28.4 36.0 17.0 183 183 D N - 0 0 10 -62,-0.4 -60,-2.9 -2,-0.3 2,-0.4 -0.562 49.4-168.8 -70.8 127.7 30.7 33.0 17.6 184 184 D I E -mO 123 132C 7 -52,-2.9 -52,-1.6 -2,-0.3 2,-0.7 -0.979 21.0-149.4-128.0 134.9 28.6 29.9 17.9 185 185 D I E -m 124 0C 0 -62,-3.0 -60,-2.6 -2,-0.4 -57,-0.2 -0.923 29.6-162.4 -98.9 115.8 29.5 26.4 19.0 186 186 D G >> - 0 0 0 -2,-0.7 4,-2.2 -62,-0.1 3,-1.4 -0.270 34.9 -84.2 -92.5-177.1 27.3 23.9 17.1 187 187 D R H 3> S+ 0 0 28 -59,-3.2 4,-2.1 -62,-0.3 5,-0.3 0.764 117.1 70.4 -60.2 -29.5 26.3 20.3 17.5 188 188 D N H 34 S+ 0 0 40 -59,-1.3 4,-0.3 1,-0.2 -1,-0.3 0.846 116.5 24.7 -58.7 -31.9 29.4 18.9 15.8 189 189 D L H <> S+ 0 0 0 -3,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.703 113.3 65.6-103.7 -26.5 31.4 20.1 18.9 190 190 D L H <>S+ 0 0 0 -4,-2.2 5,-2.7 1,-0.2 4,-0.2 0.886 102.9 51.6 -62.1 -37.4 28.7 20.1 21.5 191 191 D T T ><5S+ 0 0 32 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.869 104.7 57.1 -66.2 -36.1 28.5 16.3 21.1 192 192 D Q T 345S+ 0 0 92 -4,-0.3 -1,-0.2 -5,-0.3 -2,-0.2 0.850 108.4 45.0 -63.8 -35.9 32.2 16.0 21.6 193 193 D I T 3<5S- 0 0 14 -4,-1.5 -1,-0.3 -3,-0.1 -2,-0.2 0.400 119.3-112.9 -88.7 4.5 32.0 17.7 25.0 194 194 D G T < 5 + 0 0 46 -3,-1.0 -3,-0.2 -4,-0.2 2,-0.2 0.743 54.6 168.6 73.4 28.2 29.1 15.5 25.9 195 195 D A < + 0 0 3 -5,-2.7 -190,-0.5 -6,-0.1 2,-0.3 -0.499 5.9 174.2 -78.1 137.8 26.4 18.3 26.0 196 196 D T E - C 0 98A 20 -98,-1.9 -98,-2.3 -2,-0.2 2,-0.4 -0.951 31.0-118.7-137.1 156.3 22.7 17.3 26.2 197 197 D L E -AC 3 97A 1 -194,-2.8 -194,-3.1 -2,-0.3 2,-0.4 -0.802 35.0-173.5 -94.4 140.3 19.5 19.3 26.6 198 198 D N E AC 2 96A 33 -102,-2.3 -102,-2.4 -2,-0.4 -196,-0.2 -0.993 360.0 360.0-139.5 142.5 17.5 18.4 29.7 199 199 D F 0 0 53 -198,-2.1 -197,-0.2 -2,-0.4 -1,-0.1 0.247 360.0 360.0-163.6 360.0 14.0 19.3 31.1 200 ! 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 0.0 201 601 D X 0 0 133 0, 0.0 -72,-2.4 0, 0.0 -71,-0.2 0.000 360.0 360.0 360.0 360.0 22.2 25.2 8.9