==== 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 BLOOD CLOTTING/HYDROLASE INHIBITOR 11-DEC-98 1VR1 . COMPND 2 MOLECULE: THROMBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.J.DEKKER,A.EICHINGER,A.A.STOOP,W.BODE,H.PANNEKOEK,A.J.G.HO . 284 5 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13260.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 59.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 26.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 19 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 1 2 1 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 . 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 0 PARALLEL BRIDGES PER LADDER . 4 4 0 4 4 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 1 0 1 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 1BL A 0 0 123 0, 0.0 61,-0.0 0, 0.0 146,-0.0 0.000 360.0 360.0 360.0-111.8 14.1 18.6 18.6 2 1AL D > + 0 0 78 3,-0.1 3,-1.2 144,-0.0 145,-0.1 -0.262 360.0 169.6-123.0 29.4 10.3 18.5 18.7 3 1 L a T 3 + 0 0 24 1,-0.2 143,-0.2 143,-0.1 144,-0.1 -0.055 46.9 13.4 -55.7 150.7 10.9 14.9 19.8 4 2 L G T 3 S+ 0 0 0 141,-2.7 237,-1.6 1,-0.2 2,-0.6 0.560 90.2 114.7 66.0 12.4 8.2 12.5 21.1 5 3 L L < - 0 0 33 -3,-1.2 -1,-0.2 140,-0.3 235,-0.1 -0.950 62.2-140.3-111.9 107.4 5.2 14.7 20.1 6 4 L R > > - 0 0 0 -2,-0.6 5,-2.4 1,-0.1 3,-1.4 -0.563 6.0-137.5 -76.1 136.7 3.3 12.8 17.5 7 5 L P T 3 5S+ 0 0 17 0, 0.0 -1,-0.1 0, 0.0 134,-0.1 0.872 104.5 39.8 -55.3 -36.8 1.8 14.8 14.6 8 6 L L T 3 5S+ 0 0 34 133,-0.5 31,-0.1 30,-0.3 -2,-0.1 0.472 129.8 22.0 -97.3 -3.1 -1.5 12.9 14.7 9 7 L F T X>>S+ 0 0 15 -3,-1.4 5,-2.1 29,-0.1 3,-1.8 0.405 126.8 25.7-124.4 -88.4 -1.9 12.7 18.5 10 8 L E G >45S+ 0 0 28 1,-0.3 3,-1.1 3,-0.2 -5,-0.1 0.855 119.7 56.5 -53.2 -40.2 -0.1 15.1 20.9 11 9 L K G 34> S+ 0 0 44 2,-0.1 3,-1.3 1,-0.0 4,-0.6 0.410 85.9 101.7-128.4 5.8 -4.5 2.9 25.3 19 14CL E H >> S+ 0 0 6 -3,-0.5 4,-1.8 1,-0.3 3,-1.0 0.791 76.4 67.0 -61.1 -29.6 -2.2 5.6 26.4 20 14DL R H 3> S+ 0 0 164 -4,-0.4 4,-2.6 1,-0.2 -1,-0.3 0.845 91.2 63.6 -57.3 -33.0 -4.4 6.3 29.5 21 14EL E H <> S+ 0 0 44 -3,-1.3 4,-0.9 1,-0.2 -1,-0.2 0.852 105.0 46.2 -58.0 -32.2 -3.4 2.8 30.8 22 14FL L H XX S+ 0 0 0 -3,-1.0 4,-0.8 -4,-0.6 3,-0.6 0.944 112.0 48.2 -74.2 -53.0 0.2 4.1 31.0 23 14GL L H >< S+ 0 0 48 -4,-1.8 3,-1.1 1,-0.2 -2,-0.2 0.918 108.6 55.5 -57.2 -35.4 -0.6 7.3 32.7 24 14HL E H 3< S+ 0 0 102 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.829 102.6 56.8 -70.6 -26.0 -2.8 5.5 35.2 25 14IL S H << S+ 0 0 21 -4,-0.9 2,-2.5 -3,-0.6 -1,-0.3 0.663 80.5 92.9 -76.7 -15.9 0.2 3.3 36.2 26 14JL Y << 0 0 19 -3,-1.1 -1,-0.2 -4,-0.8 136,-0.1 -0.327 360.0 360.0 -82.7 70.0 2.4 6.3 37.0 27 14KL I 0 0 181 -2,-2.5 134,-0.0 134,-0.0 0, 0.0 -0.426 360.0 360.0 102.4 360.0 1.4 6.2 40.7 28 !* 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 29 16 H I 0 0 0 0, 0.0 2,-0.4 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 126.9 4.2 -9.2 19.6 30 17 H V B +A 221 0A 13 191,-2.5 191,-1.3 1,-0.2 143,-0.1 -0.831 360.0 0.2-101.4 132.5 2.1 -11.7 21.6 31 18 H E S S+ 0 0 133 -2,-0.4 -1,-0.2 141,-0.4 188,-0.2 0.825 100.8 125.7 63.9 37.1 -1.3 -10.7 22.9 32 19 H G - 0 0 27 -3,-0.4 2,-0.3 153,-0.1 153,-0.2 -0.259 51.0-128.7-105.0-163.6 -1.1 -7.2 21.5 33 20 H S E -B 184 0B 62 151,-1.8 151,-2.3 -2,-0.1 2,-0.1 -0.880 36.1 -72.3-147.3 167.1 -3.5 -5.3 19.1 34 21 H D E -B 183 0B 103 -2,-0.3 149,-0.2 149,-0.2 2,-0.1 -0.498 49.9-123.7 -63.6 138.5 -3.2 -3.4 15.9 35 22 H A - 0 0 6 147,-2.9 2,-0.1 -2,-0.1 3,-0.1 -0.472 25.8-113.8 -73.7 154.5 -1.5 -0.0 16.3 36 23 H E > - 0 0 46 1,-0.1 3,-1.7 -2,-0.1 4,-0.3 -0.472 48.1 -80.3 -78.9 157.6 -3.5 3.0 15.1 37 24 H I T 3 S+ 0 0 92 1,-0.3 -1,-0.1 -2,-0.1 57,-0.1 -0.401 117.3 7.5 -58.0 136.4 -2.2 4.9 12.1 38 25 H G T 3 S+ 0 0 13 2,-0.1 -30,-0.3 104,-0.1 -1,-0.3 0.603 89.4 126.5 68.6 10.4 0.7 7.2 13.2 39 26 H M S < S+ 0 0 8 -3,-1.7 -2,-0.1 1,-0.3 -1,-0.1 0.787 83.5 22.5 -72.5 -24.9 0.7 5.9 16.8 40 27 H S > + 0 0 13 -4,-0.3 3,-1.9 102,-0.1 -1,-0.3 -0.615 69.6 167.0-140.7 69.2 4.5 5.1 16.8 41 28 H P T 3 S+ 0 0 2 0, 0.0 103,-1.6 0, 0.0 51,-0.2 0.545 74.3 62.2 -66.7 -8.5 6.0 7.3 14.1 42 29 H W T 3 S+ 0 0 2 101,-0.2 18,-2.4 103,-0.1 2,-0.2 0.389 76.3 120.8 -91.6 -5.4 9.5 6.6 15.3 43 30 H Q E < -J 59 0C 3 -3,-1.9 49,-0.9 16,-0.2 50,-0.4 -0.440 43.9-168.3 -63.4 131.3 9.2 2.8 14.5 44 31 H V E -JK 58 91C 0 14,-2.3 14,-1.3 -2,-0.2 2,-0.5 -0.907 14.5-147.4-125.8 141.1 11.7 1.5 12.0 45 32 H M E -JK 57 90C 0 45,-2.2 45,-2.7 -2,-0.3 2,-0.5 -0.974 12.5-144.4-104.7 129.5 11.9 -1.7 10.0 46 33 H L E -JK 56 89C 1 10,-2.5 9,-2.1 -2,-0.5 10,-0.9 -0.823 25.9-173.0 -89.7 126.0 15.4 -3.2 9.3 47 34 H F E -JK 54 88C 0 41,-3.3 41,-3.1 -2,-0.5 2,-0.3 -0.993 24.8-125.0-134.2 132.5 15.2 -4.8 5.9 48 35 H A E - K 0 87C 17 5,-2.7 2,-0.8 -2,-0.4 5,-0.3 -0.553 13.8-148.0 -71.3 129.5 17.7 -6.9 4.0 49 36 H K 0 0 49 37,-1.7 -1,-0.1 -2,-0.3 38,-0.1 -0.632 360.0 360.0 -93.3 102.7 18.4 -5.5 0.5 50 37 H H 0 0 150 -2,-0.8 -1,-0.2 238,-0.1 -3,-0.0 0.599 360.0 360.0 -90.4 360.0 19.0 -8.9 -0.8 51 ! 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 52 38 H E 0 0 41 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 139.9 14.2 -9.6 1.4 53 39 H R - 0 0 164 -5,-0.3 -5,-2.7 3,-0.0 2,-1.1 -0.825 360.0-113.9-165.6 140.6 13.6 -10.1 4.9 54 40 H F E +J 47 0C 33 -2,-0.4 -7,-0.2 -7,-0.2 3,-0.1 -0.916 36.1 178.3 -55.9 108.4 12.5 -8.6 7.7 55 41 H L E - 0 0 32 -9,-2.1 2,-0.3 -2,-1.1 170,-0.2 0.843 50.1 -51.3 -85.5 -40.7 15.5 -8.4 9.9 56 42 H b E -J 46 0C 4 -10,-0.9 -10,-2.5 -3,-0.1 -1,-0.3 -0.968 53.5 -86.6-179.1 179.2 14.5 -6.6 13.1 57 43 H G E +J 45 0C 1 170,-3.7 12,-0.4 -2,-0.3 2,-0.3 -0.487 40.4 168.3-100.6 178.2 12.8 -3.4 14.5 58 44 H A E -J 44 0C 0 -14,-1.3 -14,-2.3 -2,-0.2 2,-0.3 -0.911 23.7-118.8-169.2-178.8 14.6 -0.1 15.3 59 45 H S E -JL 43 67C 0 8,-2.0 8,-2.8 -2,-0.3 2,-0.6 -0.996 13.6-123.7-145.7 148.9 13.7 3.5 16.1 60 46 H L E + L 0 66C 0 -18,-2.4 86,-2.2 -2,-0.3 6,-0.2 -0.794 30.4 166.5 -92.5 118.9 14.2 6.9 14.7 61 47 H I - 0 0 21 4,-2.1 2,-0.3 -2,-0.6 5,-0.2 0.485 68.0 -6.6-113.1 -10.9 15.9 9.3 17.1 62 48 H S S S- 0 0 35 3,-1.0 3,-0.4 85,-0.1 -1,-0.3 -0.948 88.1 -78.6-163.0-177.3 16.7 12.2 14.7 63 49 H D S S+ 0 0 77 -2,-0.3 74,-2.2 1,-0.2 72,-0.1 0.686 128.5 22.6 -68.8 -11.9 16.6 13.0 11.0 64 50 H R S S+ 0 0 68 72,-0.2 69,-3.1 1,-0.1 2,-0.4 0.404 108.2 77.4-132.8 1.2 19.8 11.0 10.4 65 51 H W E - M 0 132C 25 -3,-0.4 -4,-2.1 67,-0.2 -3,-1.0 -0.968 47.9-169.7-123.9 131.1 20.2 8.4 13.2 66 52 H V E -LM 60 131C 0 65,-2.4 65,-2.2 -2,-0.4 2,-0.4 -0.938 12.0-149.9-113.8 138.7 18.5 5.1 13.9 67 53 H L E +LM 59 130C 0 -8,-2.8 -8,-2.0 -2,-0.4 2,-0.3 -0.885 28.8 148.5-108.9 139.9 18.8 3.1 17.2 68 54 H T E - M 0 129C 0 61,-2.1 61,-1.8 -2,-0.4 2,-0.4 -0.880 50.4 -76.1-157.7 179.9 18.6 -0.7 17.4 69 55 H A > - 0 0 0 -12,-0.4 3,-1.8 -2,-0.3 4,-0.4 -0.759 34.3-132.0 -90.0 139.3 20.0 -3.7 19.3 70 56 H A G >> S+ 0 0 0 -2,-0.4 4,-2.5 1,-0.3 3,-2.0 0.864 104.9 66.0 -54.8 -35.4 23.6 -4.8 18.4 71 57 H H G 34 S+ 0 0 21 1,-0.3 -1,-0.3 2,-0.2 156,-0.0 0.692 88.3 66.7 -65.5 -19.8 22.4 -8.4 18.1 72 58 H b G <4 S+ 0 0 2 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.695 118.1 23.7 -64.2 -26.7 20.3 -7.4 15.0 73 59 H L T <4 S+ 0 0 1 -3,-2.0 9,-2.9 -4,-0.4 2,-0.4 0.743 128.4 35.5-110.8 -31.7 23.6 -6.7 13.2 74 60 H L E < +P 81 0D 32 -4,-2.5 -1,-0.3 7,-0.2 7,-0.2 -0.964 56.9 138.9-139.9 107.2 26.3 -8.7 14.9 75 60AH Y E > > -P 80 0D 47 5,-2.8 3,-2.1 -2,-0.4 5,-1.5 -0.485 23.4-172.1-148.9 89.0 25.8 -12.2 16.3 76 60BH P G > 5S+ 0 0 46 0, 0.0 3,-2.7 0, 0.0 -1,-0.1 0.783 78.0 69.0 -56.3 -36.5 28.6 -14.7 15.7 77 60CH P G 3 5S+ 0 0 73 0, 0.0 44,-0.0 0, 0.0 0, 0.0 0.643 112.0 33.3 -54.3 -26.4 26.9 -17.8 17.1 78 60DH W G < 5S- 0 0 186 -3,-2.1 -3,-0.0 2,-0.1 0, 0.0 -0.041 119.1-109.4-114.3 20.1 24.5 -17.7 14.1 79 60EH D T < 5 + 0 0 163 -3,-2.7 2,-0.6 1,-0.2 -5,-0.0 0.924 64.9 155.4 48.6 55.2 27.1 -16.3 11.7 80 60FH K E < +P 75 0D 42 -5,-1.5 -5,-2.8 2,-0.0 -1,-0.2 -0.946 5.6 144.5-115.3 122.0 25.4 -12.9 11.6 81 60GH N E -P 74 0D 113 -2,-0.6 2,-0.3 -7,-0.2 -7,-0.2 -0.603 22.9-175.7-152.7 85.4 27.6 -10.0 10.7 82 60HH F - 0 0 54 -9,-2.9 2,-0.2 -2,-0.1 -2,-0.0 -0.695 5.3-161.6 -88.5 140.7 25.8 -7.3 8.5 83 60IH T > - 0 0 61 -2,-0.3 3,-1.4 28,-0.0 4,-0.3 -0.559 40.1 -89.4-107.6 179.8 27.5 -4.3 7.1 84 61 H E G > S+ 0 0 44 1,-0.3 3,-1.1 -2,-0.2 25,-0.6 0.819 122.9 56.8 -59.2 -31.5 26.1 -1.0 5.8 85 62 H N G 3 S+ 0 0 114 1,-0.3 -1,-0.3 23,-0.1 -36,-0.1 0.704 99.6 60.1 -83.5 -11.1 25.7 -2.3 2.2 86 63 H D G < S+ 0 0 69 -3,-1.4 -37,-1.7 -38,-0.1 2,-0.3 0.549 99.7 67.2 -90.8 -7.0 23.5 -5.3 3.3 87 64 H L E < -K 48 0C 2 -3,-1.1 22,-0.6 -4,-0.3 2,-0.3 -0.903 49.7-166.5-126.4 156.6 20.7 -3.3 4.8 88 65 H L E -KN 47 108C 0 -41,-3.1 -41,-3.3 -2,-0.3 2,-0.4 -0.952 18.2-142.5-127.3 147.7 17.8 -0.9 4.2 89 66 H V E -KN 46 107C 0 18,-2.3 18,-2.5 -2,-0.3 2,-0.5 -0.926 13.9-159.6-108.1 126.0 15.9 1.1 6.9 90 67 H R E -KN 45 106C 0 -45,-2.7 -45,-2.2 -2,-0.4 2,-0.3 -0.971 13.5-172.1-111.4 117.5 12.1 1.5 6.2 91 68 H I E +KN 44 105C 0 14,-3.3 14,-2.7 -2,-0.5 -47,-0.1 -0.822 57.4 26.1-117.1 140.7 10.4 4.3 8.0 92 69 H G S S+ 0 0 8 -49,-0.9 -1,-0.2 -2,-0.3 2,-0.1 0.657 84.6 149.4 86.4 24.8 6.8 5.4 8.4 93 70 H K + 0 0 14 -50,-0.4 -1,-0.2 -3,-0.3 -55,-0.1 -0.423 26.0 158.9 -88.9 175.8 5.4 1.9 7.9 94 71 H H + 0 0 38 1,-0.5 88,-1.8 -2,-0.1 2,-0.2 0.465 63.2 69.6-152.3 -67.2 2.4 0.1 9.2 95 72 H S B S-Q 181 0E 14 86,-0.2 -1,-0.5 1,-0.1 86,-0.3 -0.515 74.5-142.9 -59.9 135.7 1.6 -2.8 7.0 96 73 H R S S+ 0 0 36 84,-2.3 -1,-0.1 -2,-0.2 85,-0.1 0.931 89.7 19.8 -70.3 -47.2 4.4 -5.4 7.4 97 74 H T S S+ 0 0 20 83,-0.4 184,-2.6 183,-0.1 -1,-0.1 0.722 100.4 89.7-101.0 -27.6 4.7 -6.6 3.8 98 75 H R S S- 0 0 166 182,-0.2 2,-0.6 1,-0.1 -4,-0.1 -0.354 76.2-123.1 -54.1 121.0 3.2 -3.9 1.6 99 76 H Y - 0 0 36 183,-0.2 2,-1.5 -2,-0.1 -2,-0.1 -0.891 30.7-140.6 -60.9 125.5 5.6 -1.1 0.2 100 77 H E > - 0 0 23 -2,-0.6 4,-2.3 -5,-0.1 3,-0.5 -0.579 19.1-161.8-113.3 97.1 3.9 1.8 1.4 101 77AH R T 4 S+ 0 0 179 -2,-1.5 2,-0.3 2,-0.2 3,-0.1 -0.140 73.1 17.6 -87.5 141.2 4.0 4.6 -1.2 102 78 H N T 4 S+ 0 0 157 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 -0.207 132.8 47.8 83.5 22.0 3.3 8.1 -0.5 103 79 H I T 4 S+ 0 0 61 -3,-0.5 -1,-0.2 -2,-0.3 -2,-0.2 0.968 93.6 62.8-146.2 -79.4 4.0 7.2 3.2 104 80 H E < - 0 0 7 -4,-2.3 2,-0.4 -3,-0.1 -12,-0.2 -0.195 60.3-152.9 -65.3 155.6 7.1 5.1 3.9 105 81 H K E -N 91 0C 62 -14,-2.7 -14,-3.3 -4,-0.1 2,-0.5 -0.978 3.5-154.9-128.6 129.9 10.6 6.3 3.3 106 82 H I E -N 90 0C 7 -2,-0.4 2,-0.3 -16,-0.2 -16,-0.2 -0.953 17.6-175.7-108.8 124.4 13.4 3.8 2.5 107 83 H S E -N 89 0C 15 -18,-2.5 -18,-2.3 -2,-0.5 2,-0.2 -0.933 19.3-131.0-124.3 155.4 16.9 5.0 3.3 108 84 H M E -N 88 0C 59 -2,-0.3 26,-2.5 -20,-0.2 2,-0.4 -0.602 29.1-112.0 -97.4 161.4 20.4 3.5 2.9 109 85 H L E -O 133 0C 6 -25,-0.6 24,-0.2 -22,-0.6 3,-0.1 -0.757 22.0-174.1-100.9 140.6 23.0 3.4 5.6 110 86 H E E S- 0 0 81 22,-2.7 2,-0.3 -2,-0.4 23,-0.2 0.838 74.7 -6.3 -91.4 -44.4 26.3 5.4 5.7 111 87 H K E -O 132 0C 89 21,-1.4 21,-3.2 -27,-0.1 2,-0.4 -0.987 53.3-146.8-159.8 145.0 27.7 3.7 8.8 112 88 H I E -O 131 0C 17 -2,-0.3 2,-0.4 19,-0.2 19,-0.2 -0.880 13.6-165.7-108.2 137.7 26.9 1.3 11.6 113 89 H Y E -O 130 0C 71 17,-3.2 17,-2.6 -2,-0.4 2,-0.4 -0.980 2.4-166.4-128.9 120.0 28.3 1.7 15.1 114 90 H I E -O 129 0C 51 -2,-0.4 15,-0.2 15,-0.2 13,-0.1 -0.850 37.5 -97.0-100.3 142.5 28.1 -1.2 17.6 115 91 H H > - 0 0 21 13,-2.0 3,-2.0 -2,-0.4 13,-0.1 -0.339 32.3-130.5 -55.3 132.9 28.8 -0.6 21.3 116 92 H P T 3 S+ 0 0 95 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.733 104.8 43.3 -58.5 -26.1 32.5 -1.5 21.9 117 93 H R T 3 S+ 0 0 163 9,-0.1 2,-0.3 2,-0.1 -2,-0.1 0.096 73.7 145.1-111.1 27.3 31.6 -3.7 25.0 118 94 H Y < - 0 0 17 -3,-2.0 2,-1.0 1,-0.1 8,-0.2 -0.506 42.3-147.5 -59.8 123.6 28.6 -5.4 23.5 119 95 H N B > +R 125 0F 40 6,-2.6 5,-3.5 -2,-0.3 6,-0.7 -0.678 35.8 156.9-102.6 83.2 28.9 -8.9 25.1 120 96 H W T 5 + 0 0 71 -2,-1.0 -1,-0.2 3,-0.2 -2,-0.0 0.751 65.1 71.0 -75.1 -20.4 27.5 -11.3 22.6 121 97 H R T 5S- 0 0 198 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.840 122.2 -6.8 -72.0 -29.5 29.5 -14.2 24.0 122 97AH E T 5S+ 0 0 113 -3,-0.3 -2,-0.1 3,-0.1 -1,-0.1 0.699 133.9 10.8-120.4 -62.0 27.5 -14.6 27.3 123 98 H N T 5S- 0 0 7 -4,-0.3 -3,-0.2 78,-0.1 3,-0.1 0.522 72.4-120.3 -97.2 -35.5 24.9 -12.0 28.0 124 99 H L > < + 0 0 22 -5,-3.5 3,-0.7 1,-0.2 -4,-0.2 0.709 53.5 172.3 76.7 20.6 23.9 -9.6 25.3 125 100 H D B 3 +R 119 0F 6 -6,-0.7 -6,-2.6 1,-0.2 -1,-0.2 -0.376 65.2 16.0 -60.8 137.3 25.1 -7.0 27.8 126 101 H R T 3 S- 0 0 41 -8,-0.2 2,-1.8 1,-0.2 -1,-0.2 0.931 80.8-177.9 60.0 50.2 25.1 -3.5 26.2 127 102 H D < + 0 0 0 -3,-0.7 2,-0.3 79,-0.2 -1,-0.2 -0.563 34.9 116.7 -79.8 76.8 22.9 -4.7 23.3 128 103 H I + 0 0 0 -2,-1.8 -13,-2.0 -59,-0.3 2,-0.3 -0.998 33.5 172.5-149.0 149.3 22.9 -1.4 21.4 129 104 H A E -MO 68 114C 0 -61,-1.8 -61,-2.1 -2,-0.3 2,-0.3 -0.968 19.6-140.8-155.6 145.8 24.0 0.0 18.1 130 105 H L E -MO 67 113C 0 -17,-2.6 -17,-3.2 -2,-0.3 2,-0.4 -0.779 10.3-159.9-109.8 147.0 23.6 3.3 16.1 131 106 H M E -MO 66 112C 0 -65,-2.2 -65,-2.4 -2,-0.3 2,-0.5 -0.982 8.2-149.9-126.0 120.1 23.0 3.5 12.3 132 107 H K E -MO 65 111C 47 -21,-3.2 -22,-2.7 -2,-0.4 -21,-1.4 -0.814 18.5-133.0 -92.0 129.2 23.8 6.7 10.5 133 108 H L E - O 0 109C 0 -69,-3.1 -24,-0.2 -2,-0.5 4,-0.0 -0.526 10.7-128.1 -80.9 152.0 21.6 7.3 7.4 134 109 H K S S+ 0 0 91 -26,-2.5 -25,-0.1 -2,-0.2 -1,-0.1 0.908 94.2 12.7 -64.2 -40.1 23.1 8.4 4.1 135 110 H K S S- 0 0 169 -27,-0.4 -1,-0.2 -72,-0.1 -25,-0.0 -0.974 93.4 -93.5-137.2 147.7 20.7 11.4 3.8 136 111 H P - 0 0 71 0, 0.0 2,-0.3 0, 0.0 -72,-0.2 -0.220 38.6-129.4 -58.2 144.2 18.3 13.0 6.3 137 112 H V - 0 0 7 -74,-2.2 2,-0.5 -75,-0.1 -30,-0.0 -0.756 21.5-118.7 -92.9 148.9 14.7 11.6 6.2 138 113 H A - 0 0 58 -2,-0.3 2,-0.0 6,-0.0 5,-0.0 -0.778 27.0-126.7 -91.6 133.0 11.9 14.2 5.9 139 114 H F + 0 0 85 -2,-0.5 2,-0.3 2,-0.1 5,-0.2 -0.339 39.4 158.6 -71.5 157.4 9.5 14.1 8.9 140 115 H S - 0 0 49 3,-2.3 3,-0.4 -99,-0.1 -37,-0.0 -0.840 60.4 -68.5-157.7-167.8 5.8 13.8 8.1 141 116 H D S S+ 0 0 80 -2,-0.3 -133,-0.5 1,-0.2 3,-0.1 0.716 135.9 36.4 -66.2 -27.0 2.6 12.7 9.9 142 117 H Y S S+ 0 0 76 1,-0.2 2,-0.4 -39,-0.1 -1,-0.2 0.450 113.9 59.0-103.9 -7.2 3.9 9.1 9.9 143 118 H I + 0 0 3 -3,-0.4 -3,-2.3 -52,-0.1 -101,-0.2 -0.962 61.1 131.2-128.5 116.8 7.6 9.8 10.5 144 119 H H - 0 0 13 -103,-1.6 -84,-0.2 -2,-0.4 2,-0.1 -0.963 49.4-105.6-167.6 138.7 8.8 11.6 13.6 145 120 H P - 0 0 2 0, 0.0 -141,-2.7 0, 0.0 -140,-0.3 -0.373 20.9-129.4 -83.0 155.4 11.5 10.9 16.2 146 121 H V - 0 0 2 -86,-2.2 2,-0.2 -143,-0.2 96,-0.2 -0.598 29.2-113.6 -89.7 151.6 11.3 9.7 19.8 147 122 H a B -c 242 0B 4 94,-2.0 96,-2.8 -2,-0.2 -85,-0.1 -0.636 19.9-129.8 -81.9 160.9 13.1 11.5 22.6 148 123 H L - 0 0 36 -2,-0.2 96,-0.1 94,-0.2 -145,-0.0 -0.779 35.1-105.3-102.8 142.2 16.0 10.0 24.6 149 124 H P - 0 0 0 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.268 23.3-146.7 -71.4 153.2 15.6 10.2 28.4 150 125 H D > - 0 0 63 1,-0.0 4,-2.2 119,-0.0 5,-0.2 -0.631 40.3 -92.8-102.0 173.9 17.6 12.5 30.6 151 126 H R H > S+ 0 0 182 -2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.851 125.2 50.3 -59.8 -37.8 18.5 11.4 34.1 152 127 H E H > S+ 0 0 104 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.903 109.5 50.3 -69.2 -37.8 15.5 12.9 35.8 153 128 H T H > S+ 0 0 14 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.951 112.4 47.3 -67.5 -44.9 13.1 11.3 33.3 154 129 H A H X S+ 0 0 10 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.906 111.0 52.9 -59.0 -45.1 14.7 7.9 33.9 155 129AH A H < S+ 0 0 71 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.944 114.9 39.4 -60.6 -46.3 14.6 8.4 37.7 156 129BH S H < S+ 0 0 40 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.785 124.2 35.1 -75.4 -27.9 10.8 9.2 37.7 157 129CH L H < S+ 0 0 2 -4,-2.0 2,-2.2 -5,-0.2 -3,-0.2 0.735 92.8 81.9 -99.7 -28.3 9.6 6.7 35.2 158 130 H L < + 0 0 40 -4,-2.2 2,-0.4 -5,-0.3 -1,-0.2 -0.456 66.4 131.3 -81.6 74.9 11.8 3.6 35.6 159 131 H Q > - 0 0 86 -2,-2.2 3,-2.2 -3,-0.1 30,-0.4 -0.967 66.9 -98.8-130.4 138.3 9.9 2.1 38.5 160 132 H A T 3 S+ 0 0 46 -2,-0.4 30,-0.2 1,-0.3 3,-0.1 -0.365 112.3 25.5 -49.9 132.5 8.5 -1.3 39.2 161 133 H G T 3 S+ 0 0 41 28,-2.7 -1,-0.3 1,-0.3 2,-0.2 -0.130 90.9 116.6 97.6 -33.2 4.8 -1.3 38.3 162 134 H Y < - 0 0 33 -3,-2.2 27,-2.4 26,-0.1 -1,-0.3 -0.501 61.5-130.9 -71.8 143.4 4.9 1.6 35.8 163 135 H K E -D 188 0B 36 -141,-0.4 2,-0.2 25,-0.2 -138,-0.1 -0.690 24.4-178.6-100.3 147.6 3.9 0.5 32.3 164 136 H G E -D 187 0B 0 23,-2.9 23,-2.8 -2,-0.3 2,-0.4 -0.666 25.6-114.7-127.6-179.6 5.8 1.2 29.0 165 137 H R E -DE 186 232B 5 67,-2.5 67,-2.9 21,-0.3 2,-0.4 -0.971 17.5-161.5-127.2 138.8 4.8 0.2 25.5 166 138 H V E -DE 185 231B 0 19,-2.9 19,-2.0 -2,-0.4 2,-0.3 -0.951 10.7-175.8-118.9 139.6 6.4 -2.1 22.9 167 139 H T E +D 184 0B 2 63,-0.9 2,-0.3 -2,-0.4 17,-0.2 -0.950 18.9 122.0-130.2 151.5 5.6 -2.1 19.2 168 140 H G E -D 183 0B 0 15,-1.6 15,-2.1 -2,-0.3 58,-0.1 -0.939 59.6-112.6 172.2 172.7 6.8 -4.3 16.3 169 141 H W + 0 0 2 56,-0.4 57,-0.1 -2,-0.3 3,-0.1 0.085 69.2 134.7-107.7 14.0 5.8 -6.7 13.4 170 142 H G - 0 0 0 1,-0.2 55,-0.3 8,-0.1 54,-0.1 0.073 66.3 -61.3 -57.9 176.1 7.4 -9.7 15.2 171 143 H N - 0 0 28 53,-2.7 7,-0.2 7,-0.1 -1,-0.2 -0.174 36.8-138.8 -63.7 153.9 5.7 -13.0 15.4 172 144 H L S S+ 0 0 56 5,-3.6 -141,-0.4 1,-0.2 2,-0.3 0.646 84.8 20.9 -86.9 -20.4 2.3 -13.3 17.2 173 145 H K S S- 0 0 149 4,-0.5 -1,-0.2 -143,-0.1 51,-0.1 -0.977 77.0-119.4-143.2 165.4 3.1 -16.6 19.0 174 146 H E 0 0 60 79,-0.4 -1,-0.1 -2,-0.3 50,-0.1 0.892 360.0 360.0 -75.5 -42.6 6.3 -18.4 20.0 175 147 H T 0 0 167 78,-0.1 -2,-0.1 -3,-0.1 -1,-0.1 0.751 360.0 360.0-116.9 360.0 5.7 -21.6 18.0 176 ! 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 0.0 177 150 H G 0 0 79 0, 0.0 -5,-3.6 0, 0.0 -4,-0.5 0.000 360.0 360.0 360.0 1.2 1.9 -16.3 12.9 178 151 H Q - 0 0 109 -7,-0.2 2,-0.2 -6,-0.1 -7,-0.1 -0.859 360.0-118.6-113.7 139.9 3.0 -12.9 11.5 179 152 H P - 0 0 5 0, 0.0 -83,-0.1 0, 0.0 3,-0.1 -0.497 3.9-138.4 -79.5 164.0 0.8 -9.9 11.8 180 153 H S S S+ 0 0 92 -2,-0.2 -84,-2.3 -84,-0.1 -83,-0.4 0.837 87.5 21.9 -85.0 -32.1 -0.6 -7.9 8.8 181 154 H V B S-Q 95 0E 19 -86,-0.3 -86,-0.2 -85,-0.1 -1,-0.1 -0.845 102.7 -66.7-131.6 167.6 0.0 -4.6 10.6 182 155 H L - 0 0 6 -88,-1.8 -147,-2.9 -2,-0.3 2,-0.3 -0.196 53.1-148.1 -51.8 131.9 2.2 -3.1 13.3 183 156 H Q E -BD 34 168B 14 -15,-2.1 -15,-1.6 -149,-0.2 2,-0.3 -0.736 10.4-161.0-105.8 159.4 1.2 -4.5 16.8 184 157 H V E +BD 33 167B 6 -151,-2.3 -151,-1.8 -2,-0.3 2,-0.3 -0.995 10.5 174.9-140.5 145.5 1.3 -2.8 20.2 185 158 H V E - D 0 166B 12 -19,-2.0 -19,-2.9 -2,-0.3 2,-0.4 -0.985 21.0-141.1-148.8 142.3 1.3 -4.0 23.8 186 159 H N E + D 0 165B 10 -2,-0.3 -21,-0.3 -21,-0.2 -23,-0.0 -0.875 27.3 179.4-105.6 133.6 1.6 -2.1 27.2 187 160 H L E - D 0 164B 0 -23,-2.8 -23,-2.9 -2,-0.4 2,-0.2 -0.994 25.3-119.7-141.1 145.4 3.7 -3.8 29.9 188 161 H P E - D 0 163B 7 0, 0.0 23,-3.0 0, 0.0 2,-0.3 -0.555 29.0-116.6 -87.2 141.5 4.7 -3.1 33.4 189 162 H I B -F 210 0B 11 -27,-2.4 -28,-2.7 -30,-0.4 2,-0.3 -0.589 34.7-136.7 -72.8 138.0 8.4 -2.9 34.5 190 163 H V - 0 0 7 19,-2.1 19,-0.5 -2,-0.3 -30,-0.1 -0.669 21.6 -96.0-103.8 148.2 9.2 -5.7 37.0 191 164 H E > - 0 0 71 -2,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.328 35.8-118.5 -61.3 142.8 11.3 -5.4 40.2 192 165 H R H > S+ 0 0 84 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.891 111.3 54.7 -54.9 -41.7 14.9 -6.4 39.7 193 166 H P H > S+ 0 0 85 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.891 108.9 49.1 -59.7 -41.1 14.9 -9.3 42.1 194 167 H V H > S+ 0 0 48 -3,-0.4 4,-0.6 2,-0.2 -2,-0.2 0.918 111.1 50.0 -64.9 -40.6 11.9 -10.9 40.3 195 168 H c H >< S+ 0 0 3 -4,-2.0 3,-1.3 1,-0.2 4,-0.4 0.960 111.2 48.9 -60.0 -51.1 13.8 -10.4 36.9 196 169 H K H >< S+ 0 0 94 -4,-2.6 3,-0.8 1,-0.2 -2,-0.2 0.876 110.1 50.8 -58.5 -38.9 16.9 -12.1 38.3 197 170 H D H 3< S+ 0 0 148 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.483 99.1 65.4 -81.1 -1.0 15.0 -15.1 39.7 198 171 H S T << S+ 0 0 22 -3,-1.3 2,-0.3 -4,-0.6 -1,-0.2 0.517 104.7 40.3 -97.5 -8.8 13.2 -15.9 36.5 199 172 H T < - 0 0 17 -3,-0.8 4,-0.1 -4,-0.4 -1,-0.1 -0.977 62.6-137.9-140.2 162.9 16.2 -16.8 34.5 200 173 H R S S+ 0 0 249 -2,-0.3 2,-0.1 2,-0.1 -1,-0.1 0.651 78.5 100.7 -91.4 -13.1 19.6 -18.6 34.6 201 174 H I S S- 0 0 58 1,-0.1 2,-0.6 -78,-0.0 -2,-0.2 -0.384 84.2-110.2 -73.4 142.0 21.3 -15.8 32.6 202 175 H R - 0 0 122 -2,-0.1 2,-0.2 -80,-0.0 -1,-0.1 -0.577 33.9-149.5 -74.2 119.9 23.3 -13.3 34.5 203 176 H I - 0 0 10 -2,-0.6 2,-0.3 -4,-0.1 -78,-0.0 -0.564 12.6-159.6 -85.6 146.6 21.4 -9.9 34.5 204 177 H T > - 0 0 18 -2,-0.2 3,-1.3 -81,-0.1 -1,-0.0 -0.819 35.5-101.9-120.4 178.3 23.4 -6.6 34.5 205 178 H D T 3 S+ 0 0 95 -2,-0.3 62,-0.1 1,-0.3 -2,-0.0 0.615 115.5 70.5 -71.7 -13.3 22.7 -3.0 35.4 206 179 H N T 3 S+ 0 0 12 57,-0.1 58,-2.5 61,-0.1 2,-0.3 0.221 97.5 58.1 -88.1 12.8 22.4 -2.3 31.6 207 180 H M E < - G 0 263B 4 -3,-1.3 2,-0.3 56,-0.3 56,-0.2 -0.964 56.6-173.4-134.2 159.0 19.1 -4.2 31.4 208 181 H F E - G 0 262B 9 54,-1.7 54,-2.7 -2,-0.3 2,-0.3 -0.910 18.6-136.2-143.0 163.7 15.6 -4.2 32.9 209 182 H c E - G 0 261B 0 -19,-0.5 -19,-2.1 -2,-0.3 2,-0.3 -0.862 17.6-174.2-126.5 159.2 12.8 -6.6 32.5 210 183 H A E +FG 189 260B 0 50,-2.0 50,-2.1 -2,-0.3 -21,-0.2 -0.990 26.5 94.1-147.4 154.9 9.1 -6.1 31.9 211 184 H Y - 0 0 5 -23,-3.0 2,-0.2 -2,-0.3 10,-0.1 -0.782 65.8 -69.8 142.2 165.5 5.9 -8.2 31.7 212 184AH Y - 0 0 30 8,-0.4 45,-0.2 -2,-0.2 46,-0.1 -0.621 45.6-117.7 -84.8 152.3 3.0 -9.4 33.7 213 185 H K > - 0 0 52 -2,-0.2 3,-2.3 1,-0.1 4,-0.2 -0.510 33.0-102.9 -81.3 158.4 3.4 -12.0 36.5 214 186 H P G > S+ 0 0 77 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.829 122.7 46.4 -52.4 -37.1 1.6 -15.4 36.2 215 186AH D G 3 S+ 0 0 143 1,-0.2 -3,-0.0 2,-0.0 3,-0.0 0.357 89.3 89.7 -88.6 5.9 -1.1 -14.3 38.7 216 186BH E G < S- 0 0 78 -3,-2.3 2,-1.6 2,-0.2 -1,-0.2 0.455 83.7-136.3 -83.8 -3.4 -1.6 -10.9 37.1 217 186CH G S < S+ 0 0 76 -3,-0.6 2,-0.1 -4,-0.2 -1,-0.1 -0.238 76.8 79.8 85.3 -54.3 -4.4 -11.9 34.6 218 186DH K - 0 0 117 -2,-1.6 2,-0.2 -5,-0.1 -2,-0.2 -0.416 58.1-177.2 -81.7 163.7 -3.0 -10.0 31.6 219 187 H R + 0 0 92 -188,-0.2 2,-0.1 -2,-0.1 -6,-0.1 -0.794 15.0 135.1-146.8-170.3 -0.1 -11.2 29.4 220 188 H G + 0 0 5 -2,-0.2 -8,-0.4 -8,-0.1 2,-0.3 -0.349 14.9 171.3 134.8 151.4 1.9 -10.0 26.4 221 189 H D B -A 30 0A 9 -191,-1.3 -191,-2.5 -2,-0.1 2,-0.1 -0.987 38.5 -87.3-174.7 168.4 5.5 -9.9 25.2 222 190 H A - 0 0 11 -2,-0.3 32,-0.3 -193,-0.2 2,-0.2 -0.435 47.7-174.3 -79.1 163.9 7.9 -9.1 22.4 223 191 H d > - 0 0 10 -2,-0.1 3,-2.4 30,-0.1 4,-0.5 -0.844 41.3 -39.3-148.1-175.3 8.7 -12.2 20.1 224 192 H E T 3 S+ 0 0 126 1,-0.3 -53,-2.7 -2,-0.2 -51,-0.1 -0.291 129.1 26.0 -51.8 130.3 11.0 -13.1 17.1 225 193 H G T 3 S+ 0 0 21 -55,-0.3 -56,-0.4 -170,-0.2 -1,-0.3 0.030 101.1 85.9 99.4 -22.1 11.2 -10.1 14.8 226 194 H D X + 0 0 1 -3,-2.4 3,-2.1 -170,-0.1 21,-0.3 0.651 61.2 121.0 -83.0 -19.7 10.5 -7.5 17.5 227 195 H S T 3 S+ 0 0 24 -4,-0.5 -170,-3.7 1,-0.3 21,-0.2 -0.211 70.9 24.8 -46.0 140.4 14.1 -7.3 18.5 228 196 H G T 3 S+ 0 0 0 19,-2.4 -1,-0.3 1,-0.3 20,-0.1 0.217 95.9 123.3 88.8 -15.9 15.8 -3.9 18.2 229 197 H G < - 0 0 0 -3,-2.1 18,-2.5 1,-0.1 -1,-0.3 -0.129 64.2 -88.2 -77.9 176.4 12.4 -2.1 18.6 230 198 H P E - H 0 246B 0 0, 0.0 -63,-0.9 0, 0.0 2,-0.6 -0.627 16.8-157.8 -94.0 143.8 11.6 0.5 21.2 231 199 H F E -EH 166 245B 0 14,-2.0 14,-2.0 -2,-0.3 13,-1.9 -0.988 35.6-174.7-107.4 108.5 10.1 0.2 24.7 232 200 H V E -EH 165 243B 4 -67,-2.9 -67,-2.5 -2,-0.6 2,-0.3 -0.855 19.7-164.4-119.2 158.7 8.7 3.7 25.2 233 201 H M E - H 0 242B 0 9,-2.5 9,-3.1 -2,-0.3 2,-0.6 -0.952 19.8-129.3-134.9 148.8 7.0 5.6 28.0 234 202 H K E - H 0 241B 7 -2,-0.3 7,-0.2 7,-0.2 5,-0.1 -0.904 24.5-130.4-101.8 118.0 5.0 8.8 28.0 235 203 H S > - 0 0 1 5,-2.8 4,-1.4 -2,-0.6 5,-0.1 -0.525 7.3-156.6 -66.0 126.5 6.1 11.5 30.5 236 204 H P T 4 S+ 0 0 59 0, 0.0 -1,-0.2 0, 0.0 -213,-0.0 0.564 91.1 62.1 -74.6 -7.4 3.2 12.8 32.6 237 204AH F T 4 S+ 0 0 147 3,-0.1 -2,-0.0 1,-0.1 -3,-0.0 0.918 126.3 2.6 -83.6 -47.1 5.3 16.0 33.1 238 204BH N T 4 S- 0 0 66 2,-0.2 3,-0.1 -3,-0.0 -1,-0.1 0.204 92.5-119.6-127.5 8.2 5.7 17.3 29.6 239 205 H N < + 0 0 84 -4,-1.4 2,-0.3 1,-0.2 -229,-0.1 0.607 66.1 134.1 63.0 22.7 3.6 14.8 27.6 240 206 H R - 0 0 64 -5,-0.1 -5,-2.8 -235,-0.1 2,-0.4 -0.693 56.0-119.0-104.1 149.1 6.5 13.6 25.4 241 207 H W E - H 0 234B 1 -237,-1.6 -94,-2.0 -2,-0.3 2,-0.4 -0.746 29.6-164.7 -85.1 136.1 7.3 10.0 24.5 242 208 H Y E -cH 147 233B 17 -9,-3.1 -9,-2.5 -2,-0.4 2,-1.0 -0.949 21.1-129.9-125.9 135.8 10.7 8.7 25.6 243 209 H Q E + H 0 232B 0 -96,-2.8 -11,-0.2 -2,-0.4 3,-0.1 -0.740 35.3 163.1 -86.6 106.7 12.5 5.6 24.5 244 210 H M E + 0 0 1 -13,-1.9 21,-1.7 -2,-1.0 22,-0.5 0.689 59.4 23.2 -90.9 -32.6 13.6 3.9 27.8 245 211 H G E -IH 264 231B 0 -14,-2.0 -14,-2.0 19,-0.2 2,-0.4 -0.914 56.8-141.1-136.1 165.4 14.4 0.4 26.4 246 212 H I E -IH 263 230B 0 17,-0.6 17,-2.3 -2,-0.3 2,-0.3 -0.997 39.8-109.5-121.8 128.8 15.4 -1.6 23.4 247 213 H V E +I 262 0B 8 -18,-2.5 -19,-2.4 -2,-0.4 15,-0.2 -0.468 53.6 159.7 -58.9 119.2 13.8 -5.1 22.9 248 214 H S E - 0 0 2 13,-2.2 2,-0.3 1,-0.3 14,-0.2 0.842 45.1 -28.3-114.0 -63.0 16.8 -7.3 23.6 249 215 H W E +I 261 0B 34 12,-1.7 12,-2.6 -22,-0.0 -1,-0.3 -0.984 43.2 177.9-157.0 164.4 16.0 -10.9 24.5 250 216 H G - 0 0 37 -2,-0.3 2,-0.7 10,-0.2 10,-0.1 -0.898 35.5-114.1-154.5 173.2 13.6 -13.3 26.1 251 217 H E S S- 0 0 47 8,-0.3 4,-0.3 -2,-0.3 2,-0.1 -0.919 89.2 -33.4-120.3 95.7 13.3 -17.1 26.7 252 219 H G S S- 0 0 24 -2,-0.7 2,-0.4 2,-0.1 0, 0.0 -0.397 91.3 -80.4 81.6-168.5 10.4 -18.1 24.5 253 220 H d S S- 0 0 17 -3,-0.1 -79,-0.4 -2,-0.1 -30,-0.1 -0.994 98.5 -8.3-137.1 127.3 7.6 -15.5 24.1 254 221 H D S S+ 0 0 22 -2,-0.4 2,-0.3 -32,-0.3 -2,-0.1 0.762 84.6 163.0 56.7 36.2 4.8 -14.8 26.6 255 221AH R > - 0 0 120 -4,-0.3 3,-2.0 1,-0.1 -1,-0.2 -0.620 46.7-102.3 -84.0 141.2 5.7 -17.8 28.8 256 222 H D T 3 S+ 0 0 106 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 -0.281 107.9 15.2 -61.0 138.7 4.4 -17.9 32.3 257 223 H G T 3 S+ 0 0 30 1,-0.2 2,-0.3 -45,-0.2 -1,-0.3 0.502 107.8 105.0 73.1 4.5 7.0 -16.9 34.8 258 224 H K < - 0 0 58 -3,-2.0 2,-0.3 -46,-0.1 -1,-0.2 -0.839 51.9-159.0-118.1 150.3 9.3 -15.4 32.1 259 225 H Y - 0 0 12 -2,-0.3 -8,-0.3 -64,-0.1 2,-0.3 -0.926 22.3-111.0-126.4 157.4 9.9 -11.7 31.2 260 226 H G E -G 210 0B 3 -50,-2.1 -50,-2.0 -2,-0.3 2,-0.4 -0.631 33.0-141.8 -85.2 143.0 11.1 -9.8 28.3 261 227 H F E -GI 209 249B 1 -12,-2.6 -13,-2.2 -2,-0.3 -12,-1.7 -0.908 17.5-167.6-114.6 134.8 14.6 -8.2 28.8 262 228 H Y E -GI 208 247B 1 -54,-2.7 -54,-1.7 -2,-0.4 2,-0.3 -0.967 27.0-109.7-122.9 148.0 15.4 -4.7 27.4 263 229 H T E -GI 207 246B 2 -17,-2.3 2,-1.2 -2,-0.4 -17,-0.6 -0.499 36.2-123.4 -73.2 132.6 18.6 -2.6 27.0 264 230 H H E > - I 0 245B 24 -58,-2.5 4,-1.0 -2,-0.3 3,-0.4 -0.582 26.7-169.7 -82.9 97.2 18.6 0.3 29.5 265 231 H V T >4 S+ 0 0 0 -21,-1.7 3,-1.0 -2,-1.2 4,-0.3 0.884 80.4 54.3 -59.3 -44.1 18.9 3.3 27.1 266 232 H F G >4 S+ 0 0 49 -22,-0.5 3,-1.4 1,-0.3 4,-0.3 0.896 103.4 55.8 -61.5 -36.9 19.6 5.8 29.8 267 233 H R G 34 S+ 0 0 134 -3,-0.4 -1,-0.3 1,-0.3 3,-0.2 0.773 114.0 41.4 -65.0 -25.4 22.5 3.8 31.2 268 234 H L G S+ 0 0 36 -3,-1.4 4,-2.6 -4,-0.3 5,-0.2 0.855 71.3 57.7 -59.7 -38.7 23.3 7.5 26.9 270 236 H K H > S+ 0 0 180 -4,-0.3 4,-2.2 -3,-0.2 -1,-0.2 0.929 107.3 49.6 -60.5 -41.8 26.9 8.9 27.2 271 237 H W H > S+ 0 0 19 -3,-0.3 4,-2.3 1,-0.2 5,-0.2 0.951 111.1 50.2 -60.2 -46.2 28.0 6.4 24.6 272 238 H I H X S+ 0 0 1 -4,-1.9 4,-2.5 1,-0.2 5,-0.3 0.947 111.5 46.4 -55.5 -51.4 25.2 7.4 22.3 273 239 H Q H X S+ 0 0 111 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.832 110.8 54.9 -61.6 -36.1 25.9 11.2 22.6 274 240 H K H < S+ 0 0 130 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.909 110.1 43.1 -63.3 -50.1 29.6 10.5 22.0 275 241 H V H < S+ 0 0 24 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.926 120.5 42.0 -67.5 -43.3 29.2 8.7 18.7 276 242 H I H < 0 0 54 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.963 360.0 360.0 -62.3 -52.8 26.6 11.2 17.5 277 243 H D < 0 0 160 -4,-2.8 -3,-0.1 -5,-0.3 -4,-0.1 0.967 360.0 360.0 53.9 360.0 28.5 14.2 18.8 278 !* 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 0.0 279 55 I D 0 0 154 0, 0.0 -181,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0-135.1 5.2 -12.1 1.1 280 56 I F - 0 0 26 2,-0.1 -182,-0.2 -183,-0.0 2,-0.1 0.578 360.0-129.4 99.7 102.8 7.1 -8.9 0.9 281 57 I E - 0 0 89 -184,-2.6 2,-0.1 1,-0.1 0, 0.0 -0.507 38.1 -99.2 -64.8 142.3 5.9 -6.8 -2.0 282 58 I E - 0 0 117 -2,-0.1 -183,-0.2 -183,-0.1 -1,-0.1 -0.373 34.2-137.3 -64.8 149.8 8.9 -5.7 -4.0 283 59 I I - 0 0 11 5,-0.2 5,-0.1 1,-0.1 -1,-0.0 -0.782 38.3 -76.8-104.7 151.9 10.3 -2.2 -3.4 284 60 I P > - 0 0 45 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.064 39.8-119.3 -48.3 146.8 11.4 0.1 -6.2 285 61 I E G > S+ 0 0 140 1,-0.2 3,-0.6 2,-0.2 -2,-0.0 0.705 104.4 75.7 -68.3 -30.0 14.8 -0.7 -7.8 286 62 I E G 3 S+ 0 0 134 1,-0.2 -1,-0.2 2,-0.1 0, 0.0 0.759 94.3 51.7 -41.0 -30.7 16.3 2.7 -6.9 287 63 I X G < 0 0 69 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.698 360.0 360.0 -88.3 -19.8 16.6 1.4 -3.3 288 64 I L < 0 0 91 -3,-0.6 -1,-0.3 -4,-0.5 -5,-0.2 -0.447 360.0 360.0 110.5 360.0 18.3 -1.4 -4.9