==== 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 08-FEB-08 2ZHW . COMPND 2 MOLECULE: THROMBIN LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.BRANDT,B.BAUM,A.HEINE,G.KLEBE . 286 4 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12627.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 62.9 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 . 78 27.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 22 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 0 0 1 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 . 5 4 0 4 3 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 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 0 126 0, 0.0 146,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -41.0 13.7 21.0 20.1 2 1AL D > + 0 0 63 144,-0.1 3,-1.2 3,-0.0 145,-0.1 0.108 360.0 136.0-125.8 14.8 10.5 19.5 18.6 3 1 L a T 3 + 0 0 30 1,-0.2 143,-0.2 143,-0.1 144,-0.1 -0.300 65.6 21.1 -58.2 153.0 11.4 15.9 19.3 4 2 L G T 3 S+ 0 0 0 141,-2.6 236,-1.8 1,-0.2 2,-0.6 0.497 90.4 116.7 71.2 3.9 8.8 13.6 20.7 5 3 L L < - 0 0 39 -3,-1.2 -1,-0.2 140,-0.3 234,-0.1 -0.938 59.2-143.4-106.4 110.0 5.9 15.8 19.6 6 4 L R > > - 0 0 0 -2,-0.6 5,-2.3 1,-0.1 3,-2.0 -0.633 5.8-142.9 -86.7 121.7 3.7 13.9 17.1 7 5 L P T 3 5S+ 0 0 11 0, 0.0 -1,-0.1 0, 0.0 134,-0.1 0.742 102.6 42.2 -46.4 -32.9 2.2 15.9 14.2 8 6 L L T 3 5S+ 0 0 32 133,-0.4 31,-0.1 30,-0.4 -2,-0.1 0.483 130.3 20.7 -97.7 -3.3 -1.0 13.8 14.3 9 7 L F T X>>S+ 0 0 11 -3,-2.0 5,-2.4 29,-0.2 3,-1.6 0.481 128.8 23.5-127.2 -87.5 -1.3 13.7 18.1 10 8 L E G >45S+ 0 0 31 1,-0.3 3,-0.9 3,-0.2 5,-0.1 0.879 121.4 55.7 -56.7 -36.7 0.4 16.2 20.4 11 9 L K G 34> - 0 0 3 -2,-0.2 3,-0.6 1,-0.1 4,-0.5 -0.580 34.9-101.8 -85.1 163.3 -4.1 8.2 21.1 17 14AL K T 34 S+ 0 0 182 1,-0.2 -1,-0.1 -2,-0.2 4,-0.0 0.597 114.3 23.7 -64.7 -13.8 -6.4 5.6 22.5 18 14BL T T >> S+ 0 0 51 2,-0.1 3,-1.7 1,-0.0 4,-0.5 0.485 86.2 101.9-132.0 4.9 -4.0 4.2 25.1 19 14CL E H X> S+ 0 0 19 -3,-0.6 4,-1.7 1,-0.3 3,-1.4 0.848 79.3 64.0 -56.7 -28.8 -1.5 6.9 25.9 20 14DL R H 3X S+ 0 0 106 -4,-0.5 4,-2.9 1,-0.3 5,-0.3 0.857 88.6 66.6 -68.4 -21.8 -3.5 7.5 29.1 21 14EL E H <> S+ 0 0 53 -3,-1.7 4,-0.5 1,-0.2 -1,-0.3 0.814 103.8 47.5 -65.0 -20.3 -2.6 4.1 30.4 22 14FL L H XX S+ 0 0 0 -3,-1.4 3,-0.7 -4,-0.5 4,-0.7 0.939 111.1 48.7 -78.8 -52.5 1.0 5.3 30.5 23 14GL L H >< S+ 0 0 70 -4,-1.7 3,-1.8 1,-0.3 -2,-0.2 0.913 109.6 52.6 -49.5 -49.5 0.1 8.5 32.3 24 14HL E H 3< S+ 0 0 140 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.785 103.4 58.0 -65.6 -24.3 -2.0 6.7 34.8 25 14IL S H << S+ 0 0 20 -3,-0.7 2,-1.6 -4,-0.5 -1,-0.3 0.694 86.7 87.4 -77.6 -11.8 0.9 4.4 35.6 26 14JL Y << 0 0 22 -3,-1.8 -1,-0.2 -4,-0.7 -4,-0.0 -0.556 360.0 360.0 -91.6 76.9 3.0 7.4 36.5 27 14KL I 0 0 179 -2,-1.6 -3,-0.1 -3,-0.0 -1,-0.1 -0.175 360.0 360.0 -47.1 360.0 2.2 7.9 40.2 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,-0.5 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 136.9 4.8 -8.0 19.1 30 17 H V B -A 220 0A 11 190,-4.2 190,-1.9 1,-0.2 143,-0.1 -0.880 360.0 -4.5-105.3 130.3 2.8 -10.5 21.1 31 18 H E S S+ 0 0 124 141,-0.6 -1,-0.2 -2,-0.5 187,-0.2 0.810 101.7 125.1 67.0 31.2 -0.7 -9.7 22.4 32 19 H G - 0 0 20 -3,-0.3 2,-0.3 152,-0.1 152,-0.3 -0.344 53.3-115.6-108.3-171.0 -0.6 -6.1 21.2 33 20 H S E -B 183 0B 80 150,-4.0 150,-2.3 -2,-0.1 2,-0.1 -0.834 35.0 -79.2-128.7 168.4 -2.8 -4.1 18.9 34 21 H D E -B 182 0B 103 -2,-0.3 148,-0.2 148,-0.2 147,-0.1 -0.438 52.8-117.3 -61.5 138.9 -2.7 -2.4 15.5 35 22 H A - 0 0 8 146,-2.9 2,-0.2 59,-0.1 -1,-0.1 -0.335 24.1-117.4 -68.3 153.8 -1.0 0.9 15.8 36 23 H E > - 0 0 50 1,-0.1 3,-1.6 -2,-0.1 4,-0.3 -0.612 44.0 -86.4 -81.5 160.3 -2.9 4.1 14.9 37 24 H I T 3 S+ 0 0 88 1,-0.2 -1,-0.1 -2,-0.2 57,-0.1 -0.482 115.0 10.4 -64.2 134.3 -1.7 6.1 12.0 38 25 H G T 3 S+ 0 0 11 -2,-0.2 -30,-0.4 104,-0.1 -1,-0.2 0.434 92.1 125.1 76.1 4.0 1.0 8.6 13.0 39 26 H M S < S+ 0 0 7 -3,-1.6 -2,-0.1 1,-0.3 -33,-0.1 0.755 82.0 21.0 -64.7 -36.2 1.3 6.9 16.4 40 27 H S > + 0 0 10 -4,-0.3 3,-2.1 102,-0.1 -1,-0.3 -0.656 68.2 167.1-135.6 68.2 5.0 6.2 16.3 41 28 H P T 3 S+ 0 0 1 0, 0.0 103,-1.1 0, 0.0 51,-0.2 0.705 78.0 58.5 -62.1 -20.7 6.4 8.6 13.7 42 29 H W T 3 S+ 0 0 2 101,-0.2 18,-1.6 103,-0.1 104,-0.1 0.538 78.1 121.6 -79.9 -11.4 9.9 7.8 14.9 43 30 H Q E < -J 59 0C 2 -3,-2.1 49,-1.0 16,-0.2 2,-0.4 -0.367 45.0-168.3 -61.1 128.8 9.4 4.1 14.1 44 31 H V E -JK 58 91C 0 14,-2.9 14,-0.6 47,-0.2 2,-0.5 -0.957 14.1-143.0-121.7 137.7 12.0 2.9 11.5 45 32 H M E -JK 57 90C 0 45,-2.2 45,-3.0 -2,-0.4 2,-0.6 -0.888 9.8-146.4-100.3 125.6 12.1 -0.4 9.6 46 33 H L E -JK 56 89C 0 10,-2.9 9,-3.4 -2,-0.5 10,-1.2 -0.812 25.6-166.9 -87.3 124.3 15.4 -2.0 8.9 47 34 H F E -JK 54 88C 1 41,-2.4 41,-1.9 -2,-0.6 2,-0.3 -0.965 20.5-135.7-127.3 128.9 15.3 -3.7 5.6 48 35 H R E > -JK 53 87C 92 5,-2.9 5,-1.0 -2,-0.4 39,-0.2 -0.616 13.6-148.9 -74.9 131.1 17.5 -6.2 3.8 49 36 H K T > 5S+ 0 0 45 37,-1.7 3,-0.5 -2,-0.3 -1,-0.1 0.995 79.6 38.9 -65.9 -63.9 18.1 -5.3 0.1 50 36AH S T 3 5S+ 0 0 108 1,-0.5 -1,-0.3 36,-0.3 2,-0.1 -0.947 124.4 27.8-137.0 115.3 18.4 -8.8 -1.3 51 37 H P T 3 5S- 0 0 81 0, 0.0 -1,-0.5 0, 0.0 -3,-0.2 0.370 103.6-136.8 -76.6 128.7 16.6 -10.8 -0.2 52 38 H Q T < 5 + 0 0 51 -3,-0.5 2,-0.3 -2,-0.1 229,-0.2 -0.304 53.0 122.1 -49.9 127.7 14.3 -7.9 0.4 53 39 H E E < -J 48 0C 70 -5,-1.0 -5,-2.9 227,-0.1 2,-0.3 -0.930 67.0 -70.3 176.0 158.6 12.9 -8.6 3.9 54 40 H L E +J 47 0C 34 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.538 38.6 175.8 -71.9 128.3 12.5 -7.1 7.4 55 41 H L E - 0 0 22 -9,-3.4 2,-0.3 1,-0.3 -8,-0.2 0.844 56.5 -49.8 -89.0 -57.4 15.8 -7.0 9.3 56 42 H b E -J 46 0C 2 -10,-1.2 -10,-2.9 169,-0.1 -1,-0.3 -0.974 52.6 -85.6-165.8 176.6 14.7 -5.2 12.5 57 43 H G E +J 45 0C 0 169,-3.7 12,-0.3 -2,-0.3 2,-0.3 -0.351 45.6 161.0 -84.7-178.5 13.0 -2.3 14.2 58 44 H A E -J 44 0C 0 -14,-0.6 -14,-2.9 10,-0.1 2,-0.3 -0.943 25.1-119.9 177.0 177.2 14.7 1.0 14.8 59 45 H S E -JL 43 67C 0 8,-2.4 8,-2.5 -2,-0.3 2,-0.5 -0.957 12.9-122.2-142.2 158.4 13.9 4.6 15.6 60 46 H L E + L 0 66C 0 -18,-1.6 86,-2.9 -2,-0.3 6,-0.2 -0.858 27.7 167.3 -99.7 124.0 14.4 8.1 14.3 61 47 H I S S- 0 0 22 4,-2.4 2,-0.2 -2,-0.5 5,-0.2 0.461 71.0 -14.8-119.7 -3.7 16.2 10.5 16.6 62 48 H S S S- 0 0 37 3,-0.9 -1,-0.1 85,-0.1 84,-0.1 -0.839 94.8 -65.9-171.3-159.5 17.0 13.4 14.2 63 49 H D S S+ 0 0 71 -2,-0.2 74,-2.5 1,-0.2 3,-0.1 0.567 128.3 14.2 -92.8 -4.3 16.9 13.8 10.3 64 50 H R S S+ 0 0 62 72,-0.2 69,-3.1 1,-0.1 2,-0.4 0.315 106.0 91.1-149.6 26.8 19.8 11.5 9.5 65 51 H W E - M 0 132C 17 67,-0.2 -4,-2.4 65,-0.0 -3,-0.9 -0.997 48.0-174.2-123.5 126.9 20.4 9.5 12.7 66 52 H V E -LM 60 131C 0 65,-2.2 65,-2.0 -2,-0.4 2,-0.4 -0.972 12.2-148.6-122.9 127.7 18.6 6.1 13.4 67 53 H L E +LM 59 130C 0 -8,-2.5 -8,-2.4 -2,-0.4 2,-0.3 -0.851 30.6 145.6-104.0 132.3 18.9 4.2 16.7 68 54 H T E - M 0 129C 0 61,-2.1 61,-2.1 -2,-0.4 2,-0.4 -0.873 50.6 -75.4-151.1 178.4 18.8 0.4 16.8 69 55 H A > - 0 0 0 -12,-0.3 3,-1.7 -2,-0.3 4,-0.4 -0.727 34.1-131.0 -85.5 139.0 20.1 -2.6 18.6 70 56 H A G >> S+ 0 0 0 -2,-0.4 4,-2.7 1,-0.3 3,-1.5 0.804 104.8 64.7 -49.9 -37.9 23.7 -3.7 17.8 71 57 H H G 34 S+ 0 0 18 1,-0.3 -1,-0.3 2,-0.2 9,-0.0 0.614 87.7 69.5 -73.0 -11.3 22.6 -7.3 17.3 72 58 H b G <4 S+ 0 0 0 -3,-1.7 -1,-0.3 1,-0.1 -2,-0.2 0.779 116.9 23.2 -69.4 -28.8 20.5 -6.3 14.3 73 59 H L T <4 S+ 0 0 0 -3,-1.5 9,-2.5 -4,-0.4 2,-0.5 0.762 131.2 34.5-106.2 -36.8 23.7 -5.7 12.5 74 60 H L E < +P 81 0D 33 -4,-2.7 -1,-0.3 7,-0.2 7,-0.2 -0.963 55.4 136.7-132.3 117.6 26.3 -7.8 14.3 75 60AH Y E > > -P 80 0D 50 5,-3.7 3,-2.4 -2,-0.5 5,-2.0 -0.440 24.0-171.6-160.0 80.9 25.7 -11.2 15.8 76 60BH P G > 5S+ 0 0 43 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 0.800 80.0 66.6 -45.2 -45.2 28.4 -13.7 15.1 77 60CH P G 3 5S+ 0 0 66 0, 0.0 44,-0.0 0, 0.0 -2,-0.0 0.737 113.0 33.4 -53.0 -23.5 26.6 -16.7 16.6 78 60DH W G < 5S- 0 0 192 -3,-2.4 0, 0.0 2,-0.1 0, 0.0 0.281 120.6-107.7-114.9 9.3 24.0 -16.5 13.9 79 60EH D T < 5 + 0 0 151 -3,-2.1 2,-0.6 -4,-0.3 -5,-0.0 0.751 65.4 156.1 65.0 37.4 26.5 -15.3 11.3 80 60FH K E < +P 75 0D 47 -5,-2.0 -5,-3.7 -9,-0.0 -1,-0.2 -0.821 6.2 135.8 -93.4 119.3 25.1 -11.7 11.3 81 60GH N E -P 74 0D 116 -2,-0.6 -7,-0.2 -7,-0.2 2,-0.2 -0.574 28.9-173.6-158.9 93.2 27.5 -9.0 10.2 82 60HH F - 0 0 24 -9,-2.5 2,-0.3 -2,-0.1 30,-0.1 -0.533 12.1-148.3 -86.1 150.2 25.9 -6.4 7.8 83 60IH T > - 0 0 69 -2,-0.2 3,-1.7 1,-0.1 4,-0.2 -0.757 33.7-104.3-105.2 167.6 27.6 -3.6 6.0 84 61 H E G > S+ 0 0 34 1,-0.3 3,-2.5 -2,-0.3 25,-0.4 0.917 118.6 60.1 -50.0 -51.0 25.9 -0.3 5.1 85 62 H N G 3 S+ 0 0 113 1,-0.3 -1,-0.3 23,-0.1 -36,-0.0 0.652 96.0 63.0 -60.8 -12.0 25.6 -1.3 1.5 86 63 H D G < S+ 0 0 60 -3,-1.7 -37,-1.7 -37,-0.1 2,-0.3 0.539 103.7 53.4 -91.0 2.8 23.4 -4.3 2.5 87 64 H L E < -K 48 0C 0 -3,-2.5 22,-0.6 -39,-0.2 2,-0.3 -0.902 48.3-169.3-140.1 162.6 20.6 -2.2 3.9 88 65 H L E -KN 47 108C 0 -41,-1.9 -41,-2.4 -2,-0.3 2,-0.5 -0.956 23.5-132.4-134.0 156.9 18.0 0.6 3.8 89 66 H V E -KN 46 107C 0 18,-2.2 18,-2.4 -2,-0.3 2,-0.7 -0.961 13.8-151.2-111.6 135.6 15.9 2.2 6.5 90 67 H R E -KN 45 106C 1 -45,-3.0 -45,-2.2 -2,-0.5 3,-0.4 -0.912 18.0-169.2-112.4 105.6 12.2 2.6 5.7 91 68 H I E +KN 44 105C 0 14,-2.8 14,-2.7 -2,-0.7 -47,-0.2 -0.750 60.3 24.5-100.7 135.5 10.7 5.6 7.6 92 69 H G S S+ 0 0 7 -49,-1.0 -1,-0.2 -2,-0.3 2,-0.1 0.619 83.3 152.2 91.1 18.7 7.1 6.5 8.0 93 70 H K + 0 0 13 -3,-0.4 -1,-0.2 -50,-0.4 3,-0.1 -0.414 26.6 164.7 -86.0 158.9 5.6 3.0 7.6 94 71 H H + 0 0 38 1,-0.3 87,-3.0 4,-0.2 2,-0.3 0.508 66.4 64.5-127.2 -56.9 2.5 1.5 8.9 95 72 H S B S-Q 180 0E 19 85,-0.3 -1,-0.3 1,-0.1 85,-0.3 -0.552 74.6-140.4 -71.0 135.8 2.0 -1.7 6.8 96 73 H R S S+ 0 0 21 83,-2.4 -1,-0.1 -2,-0.3 84,-0.1 0.975 91.8 18.1 -55.9 -63.2 4.6 -4.3 7.2 97 74 H T S S+ 0 0 25 82,-0.3 185,-0.8 183,-0.1 -1,-0.1 0.735 100.3 92.9 -91.6 -30.2 5.0 -5.5 3.6 98 75 H R S S- 0 0 27 81,-0.3 2,-1.6 183,-0.1 -4,-0.2 -0.382 74.4-123.0 -75.9 142.8 3.5 -2.8 1.3 99 76 H Y - 0 0 30 -2,-0.1 2,-1.8 184,-0.1 -1,-0.1 -0.618 31.0-141.4 -82.8 87.9 5.5 0.0 -0.3 100 77 H E >> - 0 0 34 -2,-1.6 4,-2.6 -5,-0.2 3,-1.9 -0.142 17.7-147.6 -64.1 85.0 3.5 2.9 1.1 101 77AH R T 34 S+ 0 0 190 -2,-1.8 -1,-0.1 1,-0.3 4,-0.1 -0.152 76.3 8.4 -46.2 135.8 3.5 5.3 -1.8 102 78 H N T 34 S+ 0 0 141 2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.250 129.7 59.1 72.4 -11.4 3.5 9.0 -1.0 103 79 H I T <4 S+ 0 0 58 -3,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.828 87.0 62.7-114.9 -55.0 4.0 8.2 2.7 104 80 H E < - 0 0 0 -4,-2.6 2,-0.3 -14,-0.0 -12,-0.2 -0.476 59.0-154.9 -79.7 151.0 7.2 6.2 3.5 105 81 H K E -N 91 0C 68 -14,-2.7 -14,-2.8 -2,-0.1 2,-0.4 -0.939 5.8-156.3-114.2 142.9 10.7 7.4 2.8 106 82 H I E -N 90 0C 9 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.988 14.7-171.6-123.7 117.0 13.6 5.0 2.2 107 83 H S E -N 89 0C 16 -18,-2.4 -18,-2.2 -2,-0.4 2,-0.2 -0.789 16.9-128.6-117.4 163.8 17.2 6.1 3.0 108 84 H M E -N 88 0C 66 -2,-0.3 26,-3.6 -20,-0.2 2,-0.5 -0.680 30.1-107.3-105.8 156.1 20.7 4.7 2.4 109 85 H L E -O 133 0C 5 -22,-0.6 24,-0.2 -25,-0.4 3,-0.1 -0.741 23.2-176.5 -97.1 124.9 23.4 4.4 5.0 110 86 H E E S- 0 0 39 22,-2.7 2,-0.3 -2,-0.5 -1,-0.2 0.849 78.2 -13.7 -74.6 -37.2 26.5 6.5 5.2 111 87 H K E -O 132 0C 104 21,-1.1 21,-1.7 -27,-0.1 2,-0.4 -0.795 54.0-136.4-176.3 125.5 27.8 4.6 8.1 112 88 H I E -O 131 0C 18 -2,-0.3 2,-0.5 19,-0.2 19,-0.2 -0.705 21.3-166.7 -79.2 125.1 27.0 2.0 10.7 113 89 H Y E -O 130 0C 41 17,-3.4 17,-2.8 -2,-0.4 2,-0.4 -0.969 3.3-171.5-117.6 122.1 28.3 2.7 14.3 114 90 H I E -O 129 0C 51 -2,-0.5 15,-0.2 15,-0.2 13,-0.1 -0.913 38.0 -96.0-110.3 137.7 28.3 -0.1 16.9 115 91 H H > - 0 0 20 13,-1.9 3,-1.8 -2,-0.4 13,-0.1 -0.213 32.1-133.1 -47.6 129.9 29.1 0.4 20.6 116 92 H P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.671 104.7 42.0 -71.0 -16.3 32.8 -0.5 21.0 117 93 H R T 3 S+ 0 0 165 9,-0.1 2,-0.3 2,-0.0 -2,-0.1 -0.070 76.7 147.3-108.4 21.3 32.0 -2.6 24.1 118 94 H Y < - 0 0 18 -3,-1.8 2,-1.2 1,-0.1 8,-0.2 -0.486 43.3-141.2 -61.2 125.0 28.8 -4.3 22.8 119 95 H N B > +R 125 0F 35 6,-3.7 5,-2.6 -2,-0.3 6,-0.7 -0.625 43.1 149.3 -97.5 84.0 28.7 -7.8 24.5 120 96 H W T 5 + 0 0 65 -2,-1.2 -1,-0.2 4,-0.2 6,-0.0 0.762 68.4 64.7 -84.3 -19.9 27.5 -10.3 21.9 121 97 H R T 5S+ 0 0 198 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.846 120.7 7.8 -68.6 -35.6 29.6 -13.1 23.3 122 97AH E T 5S- 0 0 107 3,-0.1 -2,-0.1 -3,-0.1 79,-0.1 0.811 133.1 -13.5-115.4 -68.4 27.8 -13.2 26.7 123 98 H N T 5S- 0 0 6 -4,-0.3 -3,-0.2 77,-0.1 80,-0.1 0.316 81.8-102.7-133.8 15.4 24.7 -11.2 27.5 124 99 H L > < - 0 0 19 -5,-2.6 3,-0.7 1,-0.2 -4,-0.2 0.734 55.0-178.7 67.5 23.5 24.1 -8.5 24.8 125 100 H D B 3 +R 119 0F 8 -6,-0.7 -6,-3.7 1,-0.2 -1,-0.2 -0.346 67.0 12.4 -53.4 132.3 25.4 -6.0 27.2 126 101 H R T 3 S- 0 0 39 -8,-0.2 2,-1.8 1,-0.2 -1,-0.2 0.938 80.9-173.3 63.5 49.3 25.3 -2.5 25.6 127 102 H D < + 0 0 1 -3,-0.7 2,-0.3 78,-0.2 -1,-0.2 -0.543 36.4 118.3 -79.2 87.4 23.1 -3.7 22.7 128 103 H I + 0 0 0 -2,-1.8 -13,-1.9 -59,-0.3 2,-0.3 -0.999 33.4 171.6-158.9 147.4 23.1 -0.5 20.7 129 104 H A E -MO 68 114C 0 -61,-2.1 -61,-2.1 -2,-0.3 2,-0.3 -0.985 19.1-139.2-155.0 151.6 24.1 1.0 17.4 130 105 H L E -MO 67 113C 0 -17,-2.8 -17,-3.4 -2,-0.3 2,-0.4 -0.885 11.0-160.9-114.0 146.7 23.8 4.3 15.4 131 106 H M E -MO 66 112C 0 -65,-2.0 -65,-2.2 -2,-0.3 2,-0.4 -0.996 6.6-151.7-129.1 126.7 23.1 4.7 11.7 132 107 H K E -MO 65 111C 39 -21,-1.7 -22,-2.7 -2,-0.4 -21,-1.1 -0.812 20.2-131.6 -93.5 130.7 23.8 7.8 9.7 133 108 H L E - O 0 109C 0 -69,-3.1 -24,-0.2 -2,-0.4 -70,-0.0 -0.546 12.2-127.2 -84.3 153.5 21.6 8.3 6.7 134 109 H K S S+ 0 0 117 -26,-3.6 -1,-0.1 -2,-0.2 -25,-0.1 0.914 95.2 11.2 -67.3 -38.5 23.2 9.2 3.4 135 110 H K S S- 0 0 152 -27,-0.3 -1,-0.1 -72,-0.1 -27,-0.1 -0.940 97.5 -87.2-132.9 158.8 20.9 12.2 3.0 136 111 H P - 0 0 84 0, 0.0 2,-0.3 0, 0.0 -72,-0.2 -0.312 40.9-125.3 -64.4 148.2 18.5 13.9 5.5 137 112 H V - 0 0 11 -74,-2.5 2,-0.6 -32,-0.0 -30,-0.0 -0.748 22.4-118.8 -92.7 140.9 15.0 12.5 5.7 138 113 H A - 0 0 65 -2,-0.3 -1,-0.0 6,-0.0 -33,-0.0 -0.655 26.3-131.1 -84.7 122.4 12.1 14.9 5.3 139 114 H F + 0 0 87 -2,-0.6 2,-0.2 2,-0.1 5,-0.2 -0.296 39.1 155.2 -66.0 157.7 9.9 15.1 8.3 140 115 H S B > -S 143 0G 46 3,-2.2 3,-0.5 -99,-0.1 -37,-0.0 -0.839 61.4 -70.3-161.9-172.4 6.1 14.8 7.7 141 116 H D T 3 S+ 0 0 77 -2,-0.2 -133,-0.4 1,-0.2 3,-0.1 0.709 135.1 38.8 -66.3 -22.5 3.0 13.8 9.6 142 117 H Y T 3 S+ 0 0 78 1,-0.2 2,-0.4 -39,-0.1 -1,-0.2 0.376 114.4 59.5-108.2 -0.6 4.2 10.1 9.6 143 118 H I B < +S 140 0G 0 -3,-0.5 -3,-2.2 -52,-0.1 -101,-0.2 -0.961 59.2 131.4-139.8 114.8 7.9 10.9 10.2 144 119 H H - 0 0 3 -103,-1.1 -84,-0.2 -2,-0.4 -52,-0.1 -0.963 50.1-105.0-165.5 136.5 9.3 12.7 13.2 145 120 H P - 0 0 9 0, 0.0 -141,-2.6 0, 0.0 -140,-0.3 -0.301 26.1-131.4 -72.4 152.9 12.1 12.0 15.6 146 121 H V - 0 0 1 -86,-2.9 2,-0.2 -143,-0.2 95,-0.2 -0.615 28.3-108.5 -91.4 159.9 11.7 10.8 19.2 147 122 H a B -c 241 0B 2 93,-1.8 95,-2.3 -2,-0.2 -1,-0.1 -0.528 19.8-133.0 -83.7 157.1 13.5 12.5 22.1 148 123 H L - 0 0 33 93,-0.2 95,-0.1 -2,-0.2 -145,-0.0 -0.927 35.1-106.9-107.7 141.2 16.4 11.0 24.0 149 124 H P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 119,-0.0 -0.252 19.3-138.2 -73.7 157.5 16.0 11.2 27.8 150 125 H D > - 0 0 51 1,-0.0 4,-3.4 118,-0.0 5,-0.3 -0.647 36.5-101.0 -96.6 154.2 17.9 13.5 30.2 151 126 H R H > S+ 0 0 150 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.855 124.3 48.5 -49.0 -37.6 19.2 12.1 33.5 152 127 H E H > S+ 0 0 129 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.899 112.8 44.9 -79.2 -34.2 16.3 13.7 35.3 153 128 H T H > S+ 0 0 13 -3,-0.3 4,-2.6 2,-0.2 5,-0.3 0.974 117.9 46.5 -69.9 -45.4 13.6 12.4 32.9 154 129 H A H X S+ 0 0 5 -4,-3.4 4,-1.8 1,-0.2 -2,-0.2 0.904 113.7 48.6 -55.3 -43.9 15.4 9.0 33.1 155 129AH A H < S+ 0 0 73 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.870 114.8 45.1 -69.4 -31.6 15.5 9.3 36.8 156 129BH S H < S+ 0 0 38 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.847 122.1 31.3 -83.5 -29.7 11.9 10.2 37.1 157 129CH L H < S+ 0 0 2 -4,-2.6 2,-2.2 -5,-0.2 -2,-0.2 0.664 89.2 92.1-107.1 -15.1 10.3 7.8 34.8 158 130 H L < + 0 0 43 -4,-1.8 2,-0.4 -5,-0.3 -1,-0.1 -0.482 63.5 135.1 -80.6 68.6 12.5 4.7 35.0 159 131 H Q > - 0 0 85 -2,-2.2 3,-2.9 -3,-0.1 29,-0.4 -0.976 64.7-103.7-128.8 132.5 10.4 3.1 37.8 160 132 H A T 3 S+ 0 0 53 -2,-0.4 29,-0.2 1,-0.3 3,-0.1 -0.176 113.0 26.7 -43.7 126.2 9.1 -0.3 38.4 161 133 H G T 3 S+ 0 0 38 27,-3.5 -1,-0.3 1,-0.4 2,-0.2 -0.034 91.5 122.0 103.1 -34.9 5.4 -0.2 37.6 162 134 H Y < - 0 0 28 -3,-2.9 26,-2.2 25,-0.1 -1,-0.4 -0.459 58.5-134.9 -66.8 130.8 5.8 2.6 35.2 163 135 H K E +D 187 0B 29 -141,-0.4 2,-0.2 24,-0.2 -138,-0.1 -0.704 23.9 179.7 -95.9 142.2 4.5 1.7 31.7 164 136 H G E -D 186 0B 0 22,-2.5 22,-2.0 -2,-0.4 2,-0.4 -0.548 26.0-115.7-116.8-177.2 6.3 2.3 28.4 165 137 H R E -DE 185 231B 2 66,-2.3 66,-2.4 20,-0.3 2,-0.4 -0.998 19.2-162.3-131.3 135.0 5.2 1.4 25.0 166 138 H V E -DE 184 230B 0 18,-3.0 18,-1.9 -2,-0.4 2,-0.3 -0.935 9.7-176.3-117.7 142.9 6.8 -1.0 22.5 167 139 H T E +D 183 0B 2 62,-0.8 2,-0.3 -2,-0.4 16,-0.2 -0.969 17.2 124.7-134.7 145.5 6.1 -1.1 18.7 168 140 H G E -D 182 0B 0 14,-1.8 14,-1.9 -2,-0.3 57,-0.2 -0.926 56.3-114.1 174.9 170.9 7.3 -3.3 15.9 169 141 H W S S+ 0 0 3 55,-0.4 56,-0.1 -2,-0.3 3,-0.1 0.031 71.8 122.8-104.8 15.5 6.4 -5.6 13.0 170 142 H G S S- 0 0 2 1,-0.2 54,-0.3 52,-0.1 53,-0.1 0.066 70.4 -41.0 -73.8-171.7 7.8 -8.7 14.5 171 143 H N - 0 0 45 52,-2.6 6,-0.2 1,-0.2 -1,-0.2 -0.149 39.5-148.1 -53.3 147.8 6.2 -12.1 15.3 172 144 H L S S+ 0 0 56 4,-2.9 -141,-0.6 1,-0.2 2,-0.3 0.411 82.9 15.7 -91.0 -9.1 2.7 -12.0 16.7 173 145 H K 0 0 52 3,-0.5 -1,-0.2 -143,-0.1 80,-0.1 -0.998 360.0 360.0-161.4 155.8 3.4 -15.2 18.6 174 146 H E 0 0 127 78,-0.4 -2,-0.0 -2,-0.3 48,-0.0 -0.532 360.0 360.0 -76.7 360.0 6.3 -17.3 19.8 175 ! 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 0.0 176 150 H G 0 0 70 0, 0.0 -4,-2.9 0, 0.0 -3,-0.5 0.000 360.0 360.0 360.0 -67.6 2.7 -15.1 12.8 177 151 H Q - 0 0 108 -6,-0.2 2,-0.2 -5,-0.1 -6,-0.1 -0.805 360.0-126.6-102.8 140.8 3.4 -11.8 10.9 178 152 H P - 0 0 3 0, 0.0 -82,-0.2 0, 0.0 3,-0.1 -0.537 2.8-144.0 -88.7 152.5 1.3 -8.6 11.3 179 153 H S S S+ 0 0 89 -2,-0.2 -83,-2.4 1,-0.1 -82,-0.3 0.906 87.5 22.9 -78.8 -36.7 -0.2 -6.7 8.4 180 154 H V B S-Q 95 0E 18 -85,-0.3 -85,-0.3 -84,-0.1 -1,-0.1 -0.840 103.5 -70.9-125.2 163.7 0.4 -3.4 10.2 181 155 H L - 0 0 5 -87,-3.0 -146,-2.9 -2,-0.3 2,-0.3 -0.255 54.8-143.1 -47.5 132.5 2.8 -2.0 12.8 182 156 H Q E -BD 34 168B 10 -14,-1.9 -14,-1.8 -148,-0.2 2,-0.3 -0.718 14.0-162.5-107.1 156.9 1.8 -3.4 16.2 183 157 H V E +BD 33 167B 10 -150,-2.3 -150,-4.0 -2,-0.3 2,-0.3 -0.989 11.8 171.6-144.8 139.8 1.8 -1.8 19.7 184 158 H V E - D 0 166B 13 -18,-1.9 -18,-3.0 -2,-0.3 2,-0.4 -0.977 24.1-138.5-146.2 137.6 1.7 -2.9 23.3 185 159 H N E - D 0 165B 11 -2,-0.3 -20,-0.3 -20,-0.2 -22,-0.1 -0.880 28.5-172.9 -97.6 136.4 2.1 -0.9 26.6 186 160 H L E - D 0 164B 0 -22,-2.0 -22,-2.5 -2,-0.4 2,-0.2 -0.992 22.1-121.0-136.6 140.6 4.2 -2.7 29.2 187 161 H P E - D 0 163B 9 0, 0.0 23,-3.2 0, 0.0 2,-0.4 -0.525 29.4-118.3 -78.6 141.5 5.2 -2.2 32.9 188 162 H I B -F 209 0B 10 -26,-2.2 -27,-3.5 -29,-0.4 2,-0.3 -0.626 36.0-136.3 -74.6 129.0 8.8 -1.8 33.9 189 163 H V - 0 0 10 19,-2.6 19,-0.4 -2,-0.4 -29,-0.1 -0.683 19.8 -94.1-101.5 147.3 9.6 -4.7 36.2 190 164 H E > - 0 0 65 -2,-0.3 4,-2.2 1,-0.1 3,-0.3 -0.245 35.6-120.9 -54.9 138.5 11.6 -4.6 39.5 191 165 H R H > S+ 0 0 79 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.878 109.6 50.0 -54.5 -48.9 15.3 -5.4 39.0 192 166 H P H > S+ 0 0 79 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.890 111.0 51.8 -64.8 -30.7 15.4 -8.5 41.3 193 167 H V H > S+ 0 0 44 -3,-0.3 4,-0.7 2,-0.2 -2,-0.2 0.935 108.5 49.7 -70.1 -38.7 12.4 -9.9 39.5 194 168 H c H >< S+ 0 0 2 -4,-2.2 3,-1.3 1,-0.2 4,-0.3 0.980 115.9 44.2 -55.3 -55.3 14.1 -9.4 36.1 195 169 H K H >< S+ 0 0 96 -4,-2.4 3,-1.2 1,-0.3 -2,-0.2 0.866 112.5 51.1 -52.1 -48.0 17.2 -11.2 37.6 196 170 H D H 3< S+ 0 0 145 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.566 102.0 64.6 -74.7 -4.9 15.2 -13.9 39.2 197 171 H S T << S+ 0 0 12 -3,-1.3 2,-0.3 -4,-0.7 -1,-0.2 0.515 107.5 30.2 -94.3 -8.0 13.4 -14.5 35.9 198 172 H T < - 0 0 18 -3,-1.2 4,-0.1 -4,-0.3 59,-0.0 -0.934 61.0-133.3-146.3 166.5 16.5 -15.7 34.0 199 173 H R S S+ 0 0 247 -2,-0.3 -1,-0.1 2,-0.1 2,-0.1 0.590 79.7 97.7 -92.9 -19.4 19.8 -17.5 34.1 200 174 H I S S- 0 0 69 1,-0.1 2,-0.8 -77,-0.0 -2,-0.2 -0.362 85.6-108.0 -67.2 149.4 21.6 -14.8 32.0 201 175 H R - 0 0 125 -79,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.705 34.7-154.5 -83.0 115.3 23.5 -12.1 33.8 202 176 H I - 0 0 14 -2,-0.8 2,-0.2 -4,-0.1 -7,-0.0 -0.687 10.7-159.1 -89.3 140.2 21.6 -8.8 33.6 203 177 H T > - 0 0 13 -2,-0.3 3,-1.3 -80,-0.1 -1,-0.0 -0.554 35.7 -99.2-111.4 175.3 23.5 -5.5 33.8 204 178 H D T 3 S+ 0 0 92 1,-0.3 62,-0.1 -2,-0.2 -2,-0.0 0.544 119.5 66.3 -67.7 -14.1 22.8 -1.8 34.7 205 179 H N T 3 S+ 0 0 12 61,-0.1 58,-2.9 60,-0.1 2,-0.3 0.275 100.3 63.9 -88.1 9.8 22.7 -1.2 30.9 206 180 H M E < + G 0 262B 2 -3,-1.3 2,-0.3 56,-0.2 56,-0.2 -0.963 56.2 178.2-132.0 150.5 19.6 -3.3 30.7 207 181 H F E - G 0 261B 8 54,-1.8 54,-3.2 -2,-0.3 2,-0.3 -0.877 18.0-138.1-138.4 167.4 16.0 -3.2 32.1 208 182 H c E - G 0 260B 0 -19,-0.4 -19,-2.6 -2,-0.3 2,-0.3 -0.888 14.0-171.4-129.7 153.6 13.0 -5.5 31.7 209 183 H A E +FG 188 259B 0 50,-1.8 50,-2.4 -2,-0.3 -21,-0.3 -0.989 28.5 97.6-146.0 146.3 9.3 -4.9 31.1 210 184 H G - 0 0 5 -23,-3.2 2,-0.1 -2,-0.3 10,-0.1 -0.678 61.6 -82.6 147.2 159.8 6.2 -7.1 31.1 211 184AH Y - 0 0 25 8,-0.3 45,-0.2 -2,-0.2 8,-0.1 -0.334 42.1-116.3 -80.9 165.5 3.3 -8.1 33.3 212 185 H K - 0 0 54 -2,-0.1 4,-0.2 43,-0.1 3,-0.1 -0.578 26.9-109.1 -98.9 165.7 3.4 -10.9 35.8 213 186 H P S > S+ 0 0 72 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.889 122.9 57.0 -59.2 -34.9 1.4 -14.2 35.6 214 186AH D T 3 S+ 0 0 92 1,-0.2 3,-0.0 2,-0.0 -3,-0.0 0.851 92.6 64.3 -52.0 -56.2 -0.4 -12.6 38.6 215 186BH E T 3 S- 0 0 82 1,-0.2 2,-3.6 -3,-0.1 -1,-0.2 0.295 90.5-143.8 -65.0 3.8 -1.4 -9.3 36.8 216 186CH G S < S+ 0 0 58 -3,-0.9 -1,-0.2 -4,-0.2 -5,-0.0 -0.253 71.2 92.1 65.2 -61.6 -3.6 -11.3 34.3 217 186DH K + 0 0 110 -2,-3.6 2,-0.2 1,-0.1 -2,-0.1 -0.260 56.1 177.2 -65.3 152.6 -2.8 -8.9 31.4 218 187 H R + 0 0 88 -187,-0.2 2,-0.2 -8,-0.1 -1,-0.1 -0.715 16.2 143.4-143.8-167.5 0.1 -9.8 29.1 219 188 H G + 0 0 5 -2,-0.2 -8,-0.3 -8,-0.1 2,-0.3 -0.569 15.1 178.5 138.8 150.1 2.1 -8.8 26.0 220 189 H D B -A 30 0A 13 -190,-1.9 -190,-4.2 -2,-0.2 2,-0.1 -0.974 31.4-100.7-169.9 164.4 5.7 -8.8 24.8 221 190 H A - 0 0 8 -2,-0.3 32,-0.3 -192,-0.3 2,-0.3 -0.271 42.5-172.8 -78.7 177.8 8.1 -8.0 22.0 222 191 H d > - 0 0 11 30,-0.1 3,-2.3 -2,-0.1 4,-0.3 -0.916 37.4 -42.7-160.9 178.7 9.3 -10.8 19.9 223 192 H E T 3 S+ 0 0 125 -2,-0.3 -52,-2.6 1,-0.3 -167,-0.1 -0.289 125.5 29.7 -53.4 132.7 11.7 -11.7 17.1 224 193 H G T 3 S+ 0 0 4 -54,-0.3 -55,-0.4 -169,-0.1 -1,-0.3 0.105 101.7 81.8 99.7 -14.1 11.7 -9.0 14.4 225 194 H D X + 0 0 0 -3,-2.3 3,-1.8 -57,-0.2 21,-0.3 0.550 65.0 127.9 -84.5 -17.5 10.8 -6.3 17.0 226 195 H S T 3 + 0 0 21 -4,-0.3 -169,-3.7 1,-0.3 21,-0.2 -0.016 69.2 20.3 -43.3 142.1 14.5 -6.2 17.9 227 196 H G T 3 S+ 0 0 0 19,-2.7 -1,-0.3 1,-0.3 -168,-0.1 0.342 94.8 125.8 75.7 -2.9 16.0 -2.7 17.7 228 197 H G < - 0 0 0 -3,-1.8 18,-3.1 -171,-0.2 2,-0.3 -0.337 63.9 -84.7 -81.8 171.1 12.7 -0.9 18.0 229 198 H P E - H 0 245B 1 0, 0.0 -62,-0.8 0, 0.0 2,-0.7 -0.590 17.4-158.8 -91.1 138.3 11.9 1.7 20.7 230 199 H F E -EH 166 244B 0 14,-3.2 14,-2.2 -2,-0.3 13,-1.7 -0.942 37.1-178.8 -94.9 99.9 10.7 1.4 24.2 231 200 H V E -EH 165 242B 3 -66,-2.4 -66,-2.3 -2,-0.7 2,-0.3 -0.675 18.8-164.3-110.3 160.2 9.2 4.9 24.6 232 201 H M E - H 0 241B 0 9,-2.9 9,-2.8 -2,-0.2 2,-0.7 -0.988 21.5-125.8-136.4 148.0 7.5 6.8 27.4 233 202 H K E - H 0 240B 24 -2,-0.3 7,-0.2 7,-0.2 5,-0.1 -0.849 27.6-131.4 -97.4 118.0 5.4 10.0 27.4 234 203 H S > - 0 0 0 5,-2.8 4,-1.3 -2,-0.7 5,-0.1 -0.458 8.9-157.0 -69.0 130.1 6.8 12.5 29.9 235 204 H P T 4 S+ 0 0 47 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.467 89.9 61.4 -81.8 -0.7 4.0 13.9 32.1 236 204AH F T 4 S+ 0 0 140 3,-0.1 -2,-0.0 1,-0.0 -3,-0.0 0.831 128.8 2.2 -93.6 -40.9 6.2 17.0 32.7 237 204BH N T 4 S- 0 0 67 2,-0.2 -3,-0.1 -3,-0.0 -1,-0.0 0.241 93.2-123.2-129.2 5.7 6.5 18.3 29.2 238 205 H N < + 0 0 90 -4,-1.3 2,-0.3 1,-0.2 -228,-0.1 0.647 65.3 132.1 51.7 26.4 4.3 15.8 27.3 239 206 H R - 0 0 54 -234,-0.1 -5,-2.8 -5,-0.1 2,-0.4 -0.757 59.7-111.5 -98.7 153.4 7.0 14.7 24.8 240 207 H W E - H 0 233B 1 -236,-1.8 -93,-1.8 -2,-0.3 2,-0.4 -0.700 31.0-165.6 -83.9 134.3 7.9 11.0 24.0 241 208 H Y E -cH 147 232B 18 -9,-2.8 -9,-2.9 -2,-0.4 2,-1.0 -0.958 20.7-132.2-118.6 137.0 11.2 9.7 25.2 242 209 H Q E + H 0 231B 0 -95,-2.3 -11,-0.3 -2,-0.4 3,-0.1 -0.784 32.3 167.3 -87.0 100.1 12.9 6.5 24.0 243 210 H M E + 0 0 1 -13,-1.7 21,-1.6 -2,-1.0 22,-0.5 0.724 61.0 21.7 -84.6 -22.0 13.9 4.9 27.3 244 211 H G E -IH 263 230B 0 -14,-2.2 -14,-3.2 19,-0.2 2,-0.4 -0.936 56.2-140.8-146.9 164.2 14.7 1.6 25.7 245 212 H I E -IH 262 229B 0 17,-1.0 17,-2.5 -2,-0.3 2,-0.2 -0.995 40.1-108.3-123.4 128.5 15.6 -0.5 22.7 246 213 H V E +I 261 0B 8 -18,-3.1 -19,-2.7 -2,-0.4 15,-0.2 -0.394 55.3 153.1 -57.8 124.1 14.2 -4.0 22.1 247 214 H S E - 0 0 5 13,-2.0 2,-0.3 1,-0.3 14,-0.2 0.723 45.2 -25.5-124.0 -61.7 17.1 -6.3 22.8 248 215 H W E +I 260 0B 42 12,-1.3 12,-3.5 -25,-0.0 -1,-0.3 -0.992 42.2 165.4-160.6 170.3 16.3 -9.8 24.0 249 216 H G - 0 0 38 -2,-0.3 2,-0.5 10,-0.2 10,-0.1 -0.917 40.5-101.1-168.5 175.7 14.1 -12.4 25.7 250 217 H E S S- 0 0 48 -2,-0.3 4,-0.2 8,-0.3 2,-0.1 -0.931 90.6 -34.5-116.2 95.3 13.4 -16.1 26.3 251 219 H G S S- 0 0 24 -2,-0.5 2,-0.4 2,-0.1 3,-0.1 -0.377 90.9 -75.4 74.0-172.1 10.6 -17.1 24.0 252 220 H d S S- 0 0 18 1,-0.1 -78,-0.4 -3,-0.1 -30,-0.1 -0.995 101.3 -10.4-128.4 127.7 7.8 -14.4 23.4 253 221 H D S S+ 0 0 26 -2,-0.4 2,-0.4 -32,-0.3 -1,-0.1 0.919 83.4 164.9 54.0 53.6 5.2 -13.6 26.0 254 221AH R > - 0 0 117 -4,-0.2 3,-2.4 -3,-0.1 -1,-0.2 -0.855 43.8-105.0-100.3 135.2 6.0 -16.5 28.4 255 222 H D T 3 S+ 0 0 83 -2,-0.4 3,-0.1 1,-0.3 -43,-0.1 -0.271 106.4 15.1 -57.9 142.4 4.7 -16.4 31.9 256 223 H G T 3 S+ 0 0 29 1,-0.2 2,-0.3 -45,-0.2 -1,-0.3 0.325 108.6 103.1 69.4 -3.7 7.3 -15.5 34.5 257 224 H K < - 0 0 74 -3,-2.4 2,-0.3 -46,-0.1 -1,-0.2 -0.825 54.7-162.0-103.8 152.5 9.6 -14.3 31.6 258 225 H Y - 0 0 12 -2,-0.3 -8,-0.3 -64,-0.2 2,-0.2 -0.914 21.6-109.3-130.8 153.2 10.1 -10.6 30.8 259 226 H G E -G 209 0B 3 -50,-2.4 -50,-1.8 -2,-0.3 2,-0.4 -0.608 30.8-137.7 -85.3 148.1 11.4 -8.7 27.8 260 227 H F E -GI 208 248B 2 -12,-3.5 -13,-2.0 -2,-0.2 -12,-1.3 -0.835 18.3-169.5-110.2 143.5 14.8 -7.0 28.1 261 228 H Y E -GI 207 246B 2 -54,-3.2 -54,-1.8 -2,-0.4 2,-0.3 -0.977 29.1-109.5-129.2 140.8 15.7 -3.6 26.7 262 229 H T E -GI 206 245B 2 -17,-2.5 2,-1.1 -2,-0.4 -17,-1.0 -0.580 36.4-122.3 -65.3 131.5 18.8 -1.6 26.2 263 230 H H E >> - I 0 244B 22 -58,-2.9 4,-0.9 -2,-0.3 3,-0.5 -0.619 27.9-168.6 -78.8 95.2 19.0 1.2 28.8 264 231 H V G >4 S+ 0 0 0 -21,-1.6 3,-0.9 -2,-1.1 4,-0.4 0.868 80.8 53.8 -62.5 -42.3 19.3 4.2 26.5 265 232 H F G >4 S+ 0 0 22 -22,-0.5 3,-1.5 1,-0.2 4,-0.4 0.902 101.5 62.3 -58.3 -37.2 20.2 6.8 29.1 266 233 H R G <4 S+ 0 0 118 -3,-0.5 -1,-0.2 1,-0.3 3,-0.2 0.785 112.9 34.4 -58.6 -31.1 23.0 4.6 30.3 267 234 H L G XX S+ 0 0 9 -3,-0.9 4,-2.1 -4,-0.9 3,-1.0 0.269 83.4 109.9-110.7 14.6 24.8 4.8 26.9 268 235 H K H <> S+ 0 0 45 -3,-1.5 4,-3.4 -4,-0.4 5,-0.2 0.844 73.1 59.9 -63.0 -30.5 23.8 8.3 26.0 269 236 H K H 3> S+ 0 0 106 -4,-0.4 4,-1.9 1,-0.2 -1,-0.3 0.860 107.7 48.1 -65.6 -27.8 27.3 9.6 26.4 270 237 H W H <> S+ 0 0 34 -3,-1.0 4,-2.0 2,-0.2 -2,-0.2 0.901 110.9 50.5 -72.1 -37.7 28.2 7.1 23.7 271 238 H I H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.967 112.7 46.1 -63.9 -45.7 25.3 8.3 21.6 272 239 H Q H X S+ 0 0 68 -4,-3.4 4,-3.2 2,-0.2 5,-0.2 0.895 109.2 55.1 -60.6 -43.4 26.4 11.9 22.0 273 240 H K H X S+ 0 0 163 -4,-1.9 4,-2.9 -5,-0.2 5,-0.3 0.965 109.4 45.8 -54.8 -57.4 30.1 11.2 21.2 274 241 H V H X S+ 0 0 8 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.822 115.4 48.2 -53.6 -37.6 29.3 9.5 17.9 275 242 H I H < S+ 0 0 39 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.910 113.7 45.1 -73.9 -44.9 27.0 12.3 17.0 276 243 H D H < S+ 0 0 119 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.954 115.9 46.7 -59.3 -55.9 29.4 15.1 17.9 277 244 H Q H < 0 0 68 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.797 360.0 360.0 -58.4 -37.5 32.3 13.4 16.2 278 245 H F < 0 0 121 -4,-1.6 -3,-0.1 -5,-0.3 -4,-0.1 0.022 360.0 360.0-145.5 360.0 30.4 12.6 13.0 279 !* 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 0.0 280 55 I D 0 0 141 0, 0.0 2,-0.6 0, 0.0 -183,-0.1 0.000 360.0 360.0 360.0 -22.2 5.5 -11.4 0.6 281 56 I F - 0 0 47 -229,-0.2 3,-0.2 -183,-0.0 -183,-0.1 -0.795 360.0-120.5 -98.3 117.3 7.1 -8.0 0.4 282 57 I E - 0 0 110 -185,-0.8 2,-0.1 -2,-0.6 -1,-0.0 -0.256 44.8 -92.2 -53.2 131.8 5.8 -5.5 -2.2 283 58 I E - 0 0 85 -184,-0.0 -1,-0.2 1,-0.0 -184,-0.1 -0.208 38.6-142.8 -44.5 107.4 8.6 -4.5 -4.6 284 59 I I - 0 0 14 -3,-0.2 5,-0.1 1,-0.1 -232,-0.0 -0.494 45.8 -75.0 -65.2 158.6 10.2 -1.4 -3.2 285 60 I P - 0 0 30 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 -0.102 36.7-123.9 -48.1 155.0 11.1 0.8 -6.1 286 61 I E S > S+ 0 0 86 1,-0.2 3,-2.0 2,-0.2 -2,-0.1 0.887 104.8 67.5 -67.1 -46.9 14.2 -0.1 -8.2 287 62 I E T 3 S+ 0 0 120 1,-0.3 -1,-0.2 0, 0.0 -3,-0.0 0.879 94.1 55.5 -39.5 -54.6 15.8 3.2 -7.6 288 63 I X T 3 0 0 67 -180,-0.0 -1,-0.3 -200,-0.0 -2,-0.2 0.691 360.0 360.0 -64.7 -12.3 16.3 2.7 -3.8 289 64 I L < 0 0 117 -3,-2.0 -3,-0.1 -4,-0.3 -239,-0.0 -0.083 360.0 360.0-102.9 360.0 18.2 -0.5 -4.6