==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COAGULATION FACTOR 19-APR-99 1RFN . COMPND 2 MOLECULE: PROTEIN (COAGULATION FACTOR IX); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.-P.HOPFNER,A.LANG,A.KARCHER,K.SICHLER,E.KOPETZKI, . 292 2 7 6 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14602.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 61.0 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 . 85 29.1 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 . 3 1.0 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 . 1 0.3 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 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 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 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 . 6 2 2 6 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 16 A V > 0 0 2 0, 0.0 3,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 115.5 20.0 22.0 59.3 2 17 A V B 3 +A 179 0A 13 177,-2.8 177,-1.1 1,-0.2 132,-0.1 -0.734 360.0 14.7 -91.8 141.3 21.3 20.6 62.5 3 18 A G T 3 S+ 0 0 41 130,-0.6 -1,-0.2 -2,-0.3 2,-0.1 0.803 100.9 131.1 66.0 31.7 24.4 22.3 64.0 4 19 A G < - 0 0 24 -3,-0.6 2,-0.3 129,-0.1 142,-0.2 -0.213 50.1-118.6-103.3-165.9 24.1 25.3 61.7 5 20 A E E -B 145 0B 116 140,-1.9 140,-1.6 -2,-0.1 2,-0.4 -0.930 32.1 -92.6-135.4 158.3 24.1 29.1 62.0 6 21 A D E -B 144 0B 107 -2,-0.3 138,-0.2 138,-0.2 2,-0.1 -0.552 40.9-133.0 -74.5 126.3 21.7 31.9 61.4 7 22 A A - 0 0 5 136,-2.7 136,-0.1 -2,-0.4 -1,-0.1 -0.460 17.6-119.8 -76.8 150.6 22.1 33.4 57.9 8 23 A K > - 0 0 122 -2,-0.1 3,-1.9 1,-0.1 4,-0.2 -0.678 45.9 -85.6 -87.0 146.2 22.2 37.2 57.5 9 24 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.1 0, 0.0 47,-0.1 -0.248 116.2 15.6 -53.3 135.1 19.5 38.6 55.4 10 25 A G T 3 S+ 0 0 12 45,-0.2 278,-0.4 94,-0.1 277,-0.4 0.598 89.0 119.4 76.6 12.6 20.5 38.5 51.7 11 26 A Q S < S+ 0 0 29 -3,-1.9 3,-0.1 1,-0.3 275,-0.1 0.725 85.9 26.1 -81.2 -23.7 23.3 36.0 52.3 12 27 A F S > S+ 0 0 16 -4,-0.2 3,-1.9 92,-0.1 -1,-0.3 -0.614 71.8 172.6-138.4 72.1 21.8 33.4 50.0 13 28 A P T 3 S+ 0 0 3 0, 0.0 93,-0.6 0, 0.0 41,-0.4 0.718 76.1 60.3 -53.6 -27.1 19.6 35.4 47.5 14 29 A W T 3 S+ 0 0 4 91,-0.2 16,-1.7 93,-0.2 94,-0.2 0.635 81.7 106.9 -79.6 -16.0 19.0 32.2 45.4 15 30 A Q E < +J 29 0C 4 -3,-1.9 39,-0.7 14,-0.2 40,-0.5 -0.376 42.8 171.5 -68.5 136.5 17.3 30.4 48.3 16 31 A V E -JK 28 53C 0 12,-1.4 12,-1.5 37,-0.2 2,-0.4 -0.949 22.1-137.4-139.7 159.2 13.5 29.9 48.3 17 32 A V E -JK 27 52C 2 35,-1.7 35,-2.2 -2,-0.3 2,-0.4 -0.919 13.9-136.8-119.9 149.6 11.1 27.9 50.4 18 33 A L E -JK 26 51C 0 8,-3.1 7,-1.2 -2,-0.4 8,-0.9 -0.883 16.1-167.8-109.2 136.9 8.2 25.8 49.2 19 34 A N E + K 0 50C 21 31,-2.6 31,-2.5 -2,-0.4 4,-0.2 -0.976 31.4 112.0-125.1 135.2 4.7 25.8 50.9 20 35 A G S S+ 0 0 31 2,-2.2 29,-0.1 -2,-0.4 3,-0.0 -0.336 85.2 4.2-155.4-117.5 1.9 23.4 50.3 21 36 A K S S+ 0 0 164 1,-0.1 2,-0.3 -2,-0.1 28,-0.0 0.798 143.5 16.5 -53.6 -28.2 0.3 20.8 52.5 22 38 A V S > S- 0 0 87 -4,-0.0 -2,-2.2 0, 0.0 3,-0.8 -0.985 92.9-104.3-145.2 150.2 2.7 22.2 55.0 23 39 A D T 3 S+ 0 0 122 -2,-0.3 -4,-0.2 1,-0.2 -5,-0.0 -0.521 99.5 2.6 -78.9 142.7 4.7 25.4 55.2 24 40 A A T 3 S+ 0 0 14 -2,-0.2 -1,-0.2 -6,-0.2 -5,-0.2 0.838 79.4 147.8 52.4 40.8 8.4 25.3 54.5 25 41 A F < + 0 0 51 -7,-1.2 158,-0.4 -3,-0.8 2,-0.3 0.683 69.4 6.8 -77.6 -18.2 8.2 21.6 53.7 26 42 A a E -J 18 0C 5 -8,-0.9 -8,-3.1 158,-0.1 160,-0.2 -0.974 68.3-132.9-155.6 165.1 11.0 21.9 51.1 27 43 A G E -J 17 0C 1 158,-2.2 12,-0.4 -2,-0.3 2,-0.3 -0.522 20.4-179.1-113.1-177.2 13.5 24.4 49.8 28 44 A G E -J 16 0C 0 -12,-1.5 -12,-1.4 -2,-0.2 2,-0.3 -0.938 19.7-119.0-165.5-177.8 14.6 25.4 46.3 29 45 A S E -JL 15 37C 2 8,-1.8 8,-2.7 -2,-0.3 2,-0.6 -0.996 24.9-116.2-140.3 145.0 17.0 27.6 44.2 30 46 A I E + L 0 36C 0 -16,-1.7 78,-2.5 -2,-0.3 6,-0.2 -0.694 26.8 175.2 -82.9 118.3 16.4 30.4 41.7 31 47 A V E S- 0 0 15 4,-3.1 2,-0.3 -2,-0.6 -1,-0.2 0.824 71.7 -39.6 -85.6 -39.2 17.6 29.5 38.2 32 48 A N E > S- L 0 35C 19 3,-1.4 3,-1.0 74,-0.1 -1,-0.4 -0.942 83.4 -58.1-169.8-179.4 16.2 32.8 36.8 33 49 A E T 3 S+ 0 0 67 -2,-0.3 66,-2.6 1,-0.3 64,-0.1 0.730 134.8 28.0 -44.7 -31.2 13.2 35.1 37.0 34 50 A K T 3 S+ 0 0 40 64,-0.2 61,-2.3 198,-0.2 2,-0.4 0.518 109.9 72.2-113.9 -5.5 10.9 32.3 36.1 35 51 A W E < -LM 32 94C 9 -3,-1.0 -4,-3.1 59,-0.2 -3,-1.4 -0.935 45.9-172.5-127.3 141.7 12.5 29.0 37.2 36 52 A I E -LM 30 93C 0 57,-1.7 57,-1.9 -2,-0.4 2,-0.4 -0.918 13.7-148.2-119.7 143.2 13.2 27.2 40.5 37 53 A V E +LM 29 92C 0 -8,-2.7 -8,-1.8 -2,-0.3 2,-0.3 -0.902 34.6 140.3-109.3 142.1 15.3 24.0 41.0 38 54 A T E - M 0 91C 0 53,-1.9 53,-2.3 -2,-0.4 2,-0.3 -0.868 52.2 -62.7-159.9-170.4 14.4 21.6 43.7 39 55 A A > - 0 0 0 -12,-0.4 3,-0.8 51,-0.3 4,-0.3 -0.644 34.1-135.8 -88.5 146.4 14.1 17.9 44.6 40 56 A A G > S+ 0 0 4 -2,-0.3 3,-1.7 1,-0.2 -1,-0.1 0.879 103.1 60.2 -69.6 -36.8 11.7 15.7 42.7 41 57 A H G 3 S+ 0 0 43 1,-0.3 -1,-0.2 44,-0.2 3,-0.1 0.552 91.5 70.4 -70.0 -4.3 10.3 14.0 45.8 42 58 A a G < S+ 0 0 11 -3,-0.8 2,-0.9 1,-0.2 -1,-0.3 0.682 86.8 73.6 -81.7 -19.1 9.2 17.4 47.1 43 59 A V < + 0 0 27 -3,-1.7 2,-0.5 -4,-0.3 -1,-0.2 -0.772 62.5 178.8-102.4 91.4 6.5 17.4 44.5 44 60 A E > - 0 0 120 -2,-0.9 3,-1.1 1,-0.1 -3,-0.0 -0.797 43.0 -97.2 -90.0 127.4 3.7 15.0 45.4 45 60AA T T 3 S+ 0 0 141 -2,-0.5 2,-0.8 1,-0.2 -1,-0.1 0.005 102.5 21.4 -43.2 145.1 0.9 15.0 42.8 46 61 A G T 3 S+ 0 0 78 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 -0.329 86.4 117.0 93.4 -52.7 -2.1 17.2 43.6 47 62 A V < - 0 0 48 -3,-1.1 2,-0.7 -2,-0.8 -1,-0.2 -0.258 64.7-129.0 -57.9 131.7 -0.6 19.6 46.2 48 63 A K - 0 0 157 -3,-0.1 2,-0.4 21,-0.0 -1,-0.1 -0.743 26.8-146.2 -82.9 115.9 -0.6 23.3 45.1 49 64 A I - 0 0 10 -2,-0.7 21,-1.2 21,-0.1 2,-0.4 -0.705 12.4-164.9 -91.6 136.8 2.9 24.6 45.6 50 65 A T E -KN 19 69C 24 -31,-2.5 -31,-2.6 -2,-0.4 2,-0.5 -0.972 8.1-153.9-119.5 128.7 3.7 28.2 46.6 51 66 A V E -KN 18 68C 1 17,-2.7 17,-1.8 -2,-0.4 2,-0.5 -0.892 6.1-166.6-108.9 128.6 7.2 29.6 46.3 52 67 A V E -KN 17 67C 9 -35,-2.2 -35,-1.7 -2,-0.5 3,-0.3 -0.957 6.3-174.8-116.8 124.2 8.6 32.5 48.4 53 68 A A E +KN 16 66C 0 13,-2.3 13,-1.6 -2,-0.5 -37,-0.2 -0.747 68.2 39.8-108.1 159.2 11.8 34.2 47.3 54 69 A G S S+ 0 0 5 -39,-0.7 2,-0.3 50,-0.5 10,-0.3 0.843 83.9 159.7 70.1 32.4 13.5 36.8 49.4 55 70 A E + 0 0 29 -40,-0.5 -1,-0.2 -3,-0.3 -45,-0.2 -0.693 16.8 144.7 -94.3 142.2 12.8 34.9 52.6 56 71 A H S S+ 0 0 32 -2,-0.3 87,-1.5 1,-0.3 2,-0.8 0.454 72.7 30.1-132.4 -74.4 14.6 35.2 55.9 57 72 A N B -P 142 0D 26 85,-0.2 -1,-0.3 1,-0.1 5,-0.3 -0.874 67.2-157.6 -97.6 112.0 12.3 34.8 59.0 58 73 A I S S+ 0 0 47 83,-3.2 -1,-0.1 -2,-0.8 84,-0.1 0.634 90.9 48.7 -63.9 -13.6 9.5 32.4 57.9 59 74 A E S S+ 0 0 126 82,-0.4 -1,-0.2 -3,-0.0 2,-0.1 0.789 108.4 50.7 -97.7 -36.0 7.3 33.8 60.6 60 75 A E S S- 0 0 116 -3,-0.2 2,-0.7 81,-0.2 -4,-0.2 -0.400 82.0-109.1-100.5 178.1 7.7 37.6 60.1 61 76 A T + 0 0 96 1,-0.1 -3,-0.1 -2,-0.1 -6,-0.0 -0.791 31.2 171.5-112.2 90.6 7.3 40.1 57.2 62 77 A E - 0 0 56 -2,-0.7 -1,-0.1 -5,-0.3 -7,-0.0 0.651 45.1-126.1 -70.1 -16.2 10.7 41.5 56.2 63 78 A H S S+ 0 0 169 1,-0.0 -1,-0.1 -9,-0.0 -2,-0.1 0.607 95.2 90.6 78.3 13.0 9.2 43.2 53.1 64 79 A T + 0 0 32 -10,-0.3 -9,-0.1 40,-0.1 40,-0.1 0.449 61.9 115.3-111.3 -10.2 11.8 41.5 50.9 65 80 A E - 0 0 46 -13,-0.1 2,-0.3 1,-0.0 -11,-0.2 -0.167 43.9-170.0 -62.8 153.5 9.4 38.5 50.3 66 81 A Q E -N 53 0C 29 -13,-1.6 -13,-2.3 2,-0.0 2,-0.3 -0.876 6.9-156.4-148.3 110.1 8.0 37.5 46.9 67 82 A K E +N 52 0C 143 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.678 16.4 174.5 -90.5 143.1 5.2 34.9 46.5 68 83 A R E -N 51 0C 34 -17,-1.8 -17,-2.7 -2,-0.3 2,-0.4 -0.986 23.6-131.8-145.5 152.9 4.7 33.0 43.2 69 84 A N E -N 50 0C 69 -2,-0.3 27,-2.4 -19,-0.2 2,-0.5 -0.831 25.1-119.4-107.2 145.3 2.5 30.2 42.0 70 85 A V E +O 95 0C 34 -21,-1.2 25,-0.2 -2,-0.4 -21,-0.1 -0.715 26.4 178.3 -87.3 125.1 3.8 27.2 40.0 71 86 A I E S+ 0 0 92 23,-3.1 2,-0.3 -2,-0.5 24,-0.1 0.301 70.4 20.1-106.8 7.0 2.3 26.8 36.5 72 87 A R E -O 94 0C 121 22,-0.7 22,-2.1 2,-0.0 2,-0.4 -0.881 56.1-157.8-174.1 142.1 4.4 23.8 35.6 73 88 A I E -O 93 0C 67 -2,-0.3 20,-0.2 20,-0.2 18,-0.0 -0.992 8.0-175.6-126.2 128.9 6.4 21.0 37.1 74 89 A I E -O 92 0C 25 18,-2.3 18,-2.1 -2,-0.4 2,-0.2 -0.865 6.8-170.3-126.9 93.5 9.1 19.1 35.1 75 90 A P E -O 91 0C 58 0, 0.0 16,-0.2 0, 0.0 14,-0.1 -0.552 45.3 -85.5 -78.4 152.7 10.6 16.2 37.1 76 91 A H > - 0 0 16 14,-2.0 3,-2.2 12,-0.4 14,-0.1 -0.373 38.9-123.3 -58.6 137.9 13.6 14.7 35.4 77 92 A H T 3 S+ 0 0 133 1,-0.3 -1,-0.2 -3,-0.1 11,-0.0 0.701 110.5 56.2 -57.0 -23.6 12.4 12.1 32.9 78 93 A N T 3 S+ 0 0 88 10,-0.1 2,-0.3 2,-0.0 -1,-0.3 0.550 83.8 108.5 -85.6 -8.4 14.5 9.4 34.6 79 94 A Y < + 0 0 40 -3,-2.2 2,-0.2 9,-0.2 9,-0.1 -0.532 39.0 166.0 -73.1 129.4 12.8 10.1 37.9 80 95 A N B >> -Q 84 0E 82 4,-0.6 4,-2.5 7,-0.5 3,-1.0 -0.694 23.6-167.5-149.7 93.4 10.3 7.3 39.0 81 95AA A T 34 S+ 0 0 61 1,-0.3 4,-0.2 -2,-0.2 -1,-0.1 0.660 88.0 65.6 -53.5 -19.0 9.1 7.2 42.5 82 95BA A T 34 S+ 0 0 88 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.946 113.4 28.2 -70.2 -48.9 7.7 3.7 41.9 83 96 A I T <4 S- 0 0 135 -3,-1.0 2,-0.3 1,-0.3 -2,-0.2 0.948 144.8 -17.7 -75.2 -52.2 11.1 2.2 41.4 84 97 A N B < -Q 80 0E 49 -4,-2.5 -4,-0.6 3,-0.1 -1,-0.3 -0.974 49.7-153.8-156.0 143.0 13.0 4.6 43.6 85 98 A K S S+ 0 0 99 -2,-0.3 -44,-0.2 -4,-0.2 -4,-0.1 0.402 92.6 45.1-103.2 2.8 12.1 8.1 45.0 86 99 A Y S > S+ 0 0 62 -6,-0.1 3,-0.9 -46,-0.1 2,-0.6 0.387 85.4 98.8-122.5 -1.2 15.6 9.5 45.5 87 100 A N T 3 S+ 0 0 22 1,-0.3 -7,-0.5 -7,-0.1 3,-0.1 -0.809 100.7 6.0 -93.5 123.7 17.3 8.6 42.3 88 101 A H T 3 S+ 0 0 28 -2,-0.6 2,-2.2 1,-0.2 -12,-0.4 0.837 85.4 177.7 70.6 37.1 17.3 11.5 39.8 89 102 A D < + 0 0 0 -3,-0.9 2,-0.3 -50,-0.1 -1,-0.2 -0.450 34.3 108.2 -74.1 74.3 15.8 13.6 42.6 90 103 A I + 0 0 0 -2,-2.2 -14,-2.0 -51,-0.3 2,-0.3 -0.981 38.5 173.7-151.6 138.1 15.7 16.9 40.7 91 104 A A E -MO 38 75C 0 -53,-2.3 -53,-1.9 -2,-0.3 2,-0.4 -0.976 21.7-133.7-145.8 157.6 12.8 18.9 39.3 92 105 A L E -MO 37 74C 0 -18,-2.1 -18,-2.3 -2,-0.3 2,-0.4 -0.876 13.8-161.4-114.3 145.7 12.0 22.3 37.7 93 106 A L E -MO 36 73C 0 -57,-1.9 -57,-1.7 -2,-0.4 2,-0.5 -0.975 7.4-150.2-129.9 121.1 9.2 24.7 38.6 94 107 A E E -MO 35 72C 28 -22,-2.1 -23,-3.1 -2,-0.4 -22,-0.7 -0.785 18.2-138.9 -92.7 129.5 7.9 27.4 36.3 95 108 A L E - O 0 70C 0 -61,-2.3 -25,-0.2 -2,-0.5 -27,-0.0 -0.552 9.4-131.9 -85.3 148.6 6.5 30.5 38.1 96 109 A D S S+ 0 0 56 -27,-2.4 -1,-0.1 -2,-0.2 -26,-0.1 0.893 94.2 22.9 -64.6 -45.5 3.3 32.3 37.0 97 110 A E S S- 0 0 119 -28,-0.2 -1,-0.1 -64,-0.1 2,-0.1 -0.947 96.2-102.6-124.0 143.0 4.8 35.8 37.1 98 111 A P - 0 0 51 0, 0.0 -64,-0.2 0, 0.0 2,-0.1 -0.372 35.8-116.1 -66.8 144.5 8.6 36.5 36.9 99 112 A L - 0 0 6 -66,-2.6 2,-0.7 -67,-0.1 -66,-0.1 -0.467 23.4-121.4 -77.0 152.0 10.4 37.4 40.0 100 113 A V - 0 0 93 -2,-0.1 2,-0.2 6,-0.0 5,-0.1 -0.877 30.1-133.2 -98.3 114.1 11.9 40.9 40.3 101 114 A L + 0 0 44 -2,-0.7 2,-0.3 3,-0.1 5,-0.2 -0.458 44.7 132.9 -73.1 136.3 15.7 40.5 40.9 102 115 A N B > S-R 105 0F 41 3,-1.3 3,-0.6 -2,-0.2 185,-0.1 -0.846 73.0 -60.6-159.1-169.7 17.3 42.5 43.6 103 116 A S T 3 S+ 0 0 28 -2,-0.3 184,-0.4 1,-0.2 185,-0.2 0.621 135.8 40.7 -63.1 -12.6 19.8 42.0 46.5 104 117 A Y T 3 S+ 0 0 77 1,-0.2 -50,-0.5 183,-0.1 2,-0.5 0.580 114.9 52.0-108.8 -16.5 17.4 39.5 48.1 105 118 A V B < S+R 102 0F 0 -3,-0.6 -3,-1.3 -52,-0.1 -1,-0.2 -0.808 71.6 144.7-126.7 87.4 16.3 37.7 45.0 106 119 A T - 0 0 0 -93,-0.6 -76,-0.3 -2,-0.5 177,-0.1 -0.983 43.6-120.1-128.3 134.2 19.3 36.5 43.0 107 120 A P - 0 0 14 0, 0.0 177,-1.8 0, 0.0 178,-0.3 -0.235 25.6-117.5 -68.8 160.7 19.8 33.4 40.9 108 121 A I - 0 0 2 -78,-2.5 2,-0.4 175,-0.2 90,-0.2 -0.635 31.7-109.4 -92.6 154.7 22.5 30.8 41.5 109 122 A b B -c 198 0B 1 88,-1.3 90,-2.9 -2,-0.2 2,-0.5 -0.723 25.6-160.7 -88.7 135.9 25.1 30.1 38.9 110 123 A I - 0 0 5 -2,-0.4 154,-0.2 88,-0.2 2,-0.1 -0.976 15.8-161.6-115.3 120.5 25.0 26.8 37.0 111 124 A A - 0 0 5 -2,-0.5 152,-0.0 88,-0.4 114,-0.0 -0.424 31.4 -66.7 -99.1 174.0 28.3 25.8 35.4 112 125 A D > - 0 0 77 -2,-0.1 4,-2.6 1,-0.1 -1,-0.2 -0.042 51.2-108.5 -48.7 157.9 29.3 23.4 32.6 113 126 A K H > S+ 0 0 113 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.846 120.8 49.6 -60.0 -33.4 28.9 19.7 33.4 114 127 A E H > S+ 0 0 118 2,-0.2 4,-0.8 1,-0.1 -1,-0.2 0.870 114.0 40.5 -75.3 -42.8 32.7 19.6 33.6 115 128 A Y H >> S+ 0 0 17 2,-0.2 4,-3.0 1,-0.2 3,-0.6 0.887 107.4 62.5 -74.3 -40.1 33.3 22.5 35.9 116 129 A T H 3X S+ 0 0 3 -4,-2.6 4,-1.1 1,-0.3 -1,-0.2 0.880 107.4 46.3 -49.4 -40.2 30.3 21.7 38.1 117 129AA N H 3X S+ 0 0 55 -4,-0.9 4,-1.0 -5,-0.2 -1,-0.3 0.758 111.2 51.2 -75.4 -27.8 32.2 18.5 38.9 118 129BA I H << S+ 0 0 66 -4,-0.8 4,-0.3 -3,-0.6 -2,-0.2 0.881 109.5 49.2 -75.5 -41.6 35.5 20.3 39.5 119 130 A F H >< S+ 0 0 12 -4,-3.0 3,-0.7 1,-0.2 -2,-0.2 0.779 106.6 56.9 -67.4 -28.7 33.9 22.7 41.9 120 131 A L H >< S+ 0 0 12 -4,-1.1 3,-1.3 -5,-0.3 -1,-0.2 0.881 101.4 58.4 -69.1 -36.8 32.3 19.8 43.7 121 132 A K T 3< S+ 0 0 145 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.591 78.0 88.8 -69.1 -12.4 35.8 18.4 44.2 122 133 A F T < S- 0 0 112 -3,-0.7 2,-0.6 -4,-0.3 -1,-0.3 0.624 96.7-130.5 -61.2 -9.7 37.0 21.5 46.0 123 134 A G S < S+ 0 0 26 -3,-1.3 27,-2.4 -4,-0.1 2,-0.4 -0.253 73.5 82.8 92.9 -48.6 35.7 19.7 49.1 124 135 A S E +D 149 0B 38 -2,-0.6 2,-0.3 25,-0.2 68,-0.3 -0.786 47.9 172.1-103.2 138.5 33.5 22.3 50.8 125 136 A G E -D 148 0B 0 23,-1.3 23,-2.7 -2,-0.4 2,-0.5 -0.941 27.0-126.2-136.8 157.7 29.9 23.2 50.1 126 137 A Y E -DE 147 190B 53 64,-3.3 64,-2.4 -2,-0.3 2,-0.4 -0.904 22.7-171.0-108.3 130.7 27.3 25.4 51.7 127 138 A V E +DE 146 189B 2 19,-2.7 19,-2.3 -2,-0.5 2,-0.3 -0.969 9.4 174.2-122.2 135.0 23.9 24.0 52.6 128 139 A S E +D 145 0B 2 60,-1.0 2,-0.3 -2,-0.4 17,-0.2 -0.994 10.9 120.8-145.0 150.6 20.9 26.0 53.7 129 140 A G E -D 144 0B 0 15,-1.8 15,-1.8 -2,-0.3 55,-0.2 -0.968 59.8 -98.9 174.9 173.6 17.2 25.7 54.5 130 141 A W S S+ 0 0 4 53,-0.5 10,-0.5 -2,-0.3 54,-0.1 -0.157 75.7 126.6-103.1 35.4 14.4 26.1 57.1 131 142 A G - 0 0 0 1,-0.2 9,-0.6 8,-0.2 52,-0.2 -0.112 69.6 -43.8 -84.4-174.8 14.3 22.4 58.0 132 143 A R B -S 139 0G 86 50,-2.3 7,-0.3 7,-0.2 -1,-0.2 -0.199 40.0-158.3 -52.3 134.7 14.6 20.7 61.4 133 144 A V S S+ 0 0 16 5,-2.5 -130,-0.6 1,-0.2 2,-0.3 0.433 82.4 29.0 -94.5 -2.2 17.3 22.2 63.7 134 145 A F S > S- 0 0 126 4,-0.4 3,-3.1 -132,-0.1 -1,-0.2 -0.957 104.5 -86.7-154.4 137.8 17.5 18.9 65.7 135 147 A H T 3 S- 0 0 82 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 -0.274 118.8 -1.3 -50.0 113.6 16.8 15.3 64.6 136 148 A K T 3 S+ 0 0 169 1,-0.2 -1,-0.3 -2,-0.1 2,-0.1 0.737 117.3 110.2 73.4 25.3 13.0 15.0 65.2 137 149 A G S < S- 0 0 29 -3,-3.1 -1,-0.2 1,-0.2 2,-0.1 -0.147 71.4 -53.6-110.8-154.1 12.7 18.6 66.5 138 150 A R - 0 0 172 1,-0.1 -5,-2.5 -6,-0.1 -4,-0.4 -0.385 52.4-114.0 -82.8 163.4 11.3 22.0 65.5 139 151 A S B -S 132 0G 66 -7,-0.3 2,-0.4 -6,-0.1 -7,-0.2 -0.295 36.4 -90.7 -88.7 177.6 12.1 23.8 62.3 140 152 A A - 0 0 8 -9,-0.6 -82,-0.2 -10,-0.5 4,-0.1 -0.772 19.5-163.0 -95.9 134.4 13.9 27.1 61.9 141 153 A L S S+ 0 0 92 -2,-0.4 -83,-3.2 1,-0.1 -82,-0.4 0.850 87.3 44.7 -78.1 -35.0 12.1 30.4 62.0 142 154 A V B S-P 57 0D 28 -85,-0.2 -85,-0.2 -84,-0.1 -1,-0.1 -0.884 106.6 -91.6-111.8 140.7 15.2 31.9 60.4 143 155 A L - 0 0 6 -87,-1.5 -136,-2.7 -2,-0.4 2,-0.3 -0.196 42.6-156.9 -52.8 129.5 17.2 30.5 57.6 144 156 A Q E -BD 6 129B 22 -15,-1.8 -15,-1.8 -138,-0.2 2,-0.3 -0.744 9.3-171.5-107.1 155.8 20.0 28.2 58.7 145 157 A Y E -BD 5 128B 44 -140,-1.6 -140,-1.9 -2,-0.3 2,-0.3 -0.971 4.0-175.7-144.7 158.7 23.2 27.3 56.8 146 158 A L E - D 0 127B 14 -19,-2.3 -19,-2.7 -2,-0.3 2,-0.5 -0.977 23.9-127.9-157.5 141.0 26.1 24.9 57.3 147 159 A R E - D 0 126B 126 -2,-0.3 -21,-0.2 -21,-0.2 -23,-0.0 -0.795 28.7-167.8 -94.7 127.7 29.3 24.1 55.5 148 160 A V E - D 0 125B 1 -23,-2.7 -23,-1.3 -2,-0.5 2,-0.2 -0.963 14.4-136.7-124.8 125.7 29.8 20.4 54.7 149 161 A P E - D 0 124B 50 0, 0.0 23,-1.9 0, 0.0 -25,-0.2 -0.479 33.5-104.1 -73.9 144.2 32.9 18.6 53.5 150 162 A L B -F 171 0B 66 -27,-2.4 2,-0.4 21,-0.2 21,-0.3 -0.448 36.1-132.7 -70.5 140.0 32.6 16.0 50.7 151 163 A V - 0 0 11 19,-2.3 19,-0.4 -2,-0.1 -1,-0.1 -0.779 26.1 -93.4-101.4 141.3 32.8 12.4 51.8 152 164 A D > - 0 0 87 -2,-0.4 4,-3.1 1,-0.1 5,-0.2 -0.129 28.2-131.0 -44.7 133.1 34.8 9.6 50.3 153 165 A R H > S+ 0 0 147 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.887 110.4 49.1 -57.3 -40.2 32.9 7.7 47.7 154 166 A A H > S+ 0 0 35 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.914 113.4 45.6 -65.6 -44.4 34.1 4.4 49.4 155 167 A T H >> S+ 0 0 40 2,-0.2 4,-1.0 1,-0.2 3,-0.8 0.930 111.0 53.8 -62.0 -49.4 33.0 5.7 52.8 156 168 A c H >X S+ 0 0 3 -4,-3.1 3,-0.9 1,-0.3 4,-0.6 0.914 109.0 47.5 -51.0 -52.9 29.6 7.0 51.4 157 169 A L H 3< S+ 0 0 77 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.682 112.9 50.1 -65.9 -19.1 28.7 3.6 49.9 158 170 A R H << S+ 0 0 197 -4,-0.8 -1,-0.2 -3,-0.8 -2,-0.2 0.566 95.6 70.8 -97.9 -10.9 29.7 1.8 53.1 159 171 A S H << S+ 0 0 25 -4,-1.0 2,-0.3 -3,-0.9 -2,-0.2 0.725 101.8 38.8 -78.7 -23.7 27.7 4.0 55.5 160 172 A T < - 0 0 16 -4,-0.6 4,-0.1 2,-0.2 54,-0.0 -0.851 62.7-141.9-127.3 163.1 24.2 2.7 54.3 161 173 A K S S+ 0 0 210 -2,-0.3 2,-0.2 2,-0.1 -1,-0.1 0.268 83.0 92.7-101.4 6.6 22.6 -0.5 53.3 162 174 A F S S- 0 0 118 1,-0.0 2,-0.6 -5,-0.0 -2,-0.2 -0.651 91.2 -96.0 -97.2 155.9 20.7 1.4 50.7 163 175 A T - 0 0 91 -2,-0.2 2,-0.8 1,-0.0 -2,-0.1 -0.638 30.0-158.8 -81.5 119.3 22.0 1.8 47.1 164 176 A I - 0 0 20 -2,-0.6 2,-0.1 -4,-0.1 -7,-0.0 -0.856 15.8-154.7 -96.1 108.8 23.9 5.1 46.5 165 177 A Y > - 0 0 85 -2,-0.8 3,-2.5 1,-0.1 0, 0.0 -0.445 29.8-108.6 -82.2 160.3 23.8 5.7 42.7 166 178 A N T 3 S+ 0 0 68 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.472 115.6 73.5 -67.4 2.4 26.4 7.7 40.9 167 179 A N T 3 S+ 0 0 18 52,-0.1 53,-3.3 55,-0.0 -1,-0.3 0.561 100.0 48.7 -88.1 -13.2 23.7 10.3 40.5 168 180 A M E < - G 0 219B 11 -3,-2.5 2,-0.3 51,-0.3 51,-0.2 -0.767 66.2-164.8-124.1 167.4 24.1 11.2 44.2 169 181 A F E - G 0 218B 14 49,-2.4 49,-2.6 -2,-0.2 2,-0.3 -0.982 18.9-112.9-150.0 161.6 26.9 11.9 46.7 170 182 A c E + G 0 217B 2 -19,-0.4 -19,-2.3 -2,-0.3 2,-0.3 -0.741 31.7 161.9-101.4 148.6 27.7 12.2 50.4 171 183 A A E +FG 150 216B 0 45,-1.1 45,-1.8 -2,-0.3 2,-0.3 -0.968 32.0 71.6-155.7 151.4 28.6 15.3 52.5 172 184 A G S S- 0 0 3 -23,-1.9 2,-0.3 -2,-0.3 7,-0.1 -0.934 75.9 -49.3 135.7-159.9 28.6 15.9 56.2 173 184AA F - 0 0 31 5,-0.6 40,-0.4 -2,-0.3 41,-0.1 -0.861 20.2-143.2-121.1 153.6 30.7 14.9 59.2 174 185 A H S S+ 0 0 107 -2,-0.3 39,-0.8 1,-0.2 -1,-0.1 0.845 107.4 53.8 -73.8 -35.5 32.0 11.6 60.5 175 186 A E S S- 0 0 106 1,-0.2 37,-0.3 37,-0.2 2,-0.2 0.889 98.8-151.9 -66.0 -43.9 31.4 13.0 64.0 176 187 A G + 0 0 9 2,-0.2 2,-0.3 35,-0.2 35,-0.2 -0.649 60.3 108.7 99.8-160.3 27.8 13.9 63.4 177 188 A G S S+ 0 0 43 33,-3.4 2,-0.5 -2,-0.2 34,-0.1 0.018 78.7 69.2 78.4 -31.1 25.9 16.7 65.1 178 188AA R + 0 0 95 -2,-0.3 -5,-0.6 32,-0.1 2,-0.3 -0.956 64.7 115.7-127.0 114.2 25.9 18.8 62.0 179 189 A D B -A 2 0A 8 -177,-1.1 -177,-2.8 -2,-0.5 2,-0.2 -0.927 61.9 -93.2-160.2 176.0 23.8 17.8 59.0 180 190 A S - 0 0 9 -2,-0.3 30,-0.4 -179,-0.3 2,-0.2 -0.612 46.7-171.5 -93.3 163.4 20.9 18.8 56.8 181 191 A d > - 0 0 9 -2,-0.2 3,-1.7 28,-0.1 4,-0.5 -0.797 33.6 -45.7-145.2-173.7 17.5 17.4 57.9 182 192 A Q T 3 S+ 0 0 87 1,-0.2 -50,-2.3 -2,-0.2 -156,-0.1 -0.354 120.0 37.2 -64.4 137.0 13.8 17.2 56.8 183 193 A G T 3 S+ 0 0 16 -158,-0.4 -53,-0.5 -52,-0.2 -1,-0.2 0.173 104.7 76.5 106.2 -13.1 12.4 20.4 55.4 184 194 A D X + 0 0 0 -3,-1.7 3,-1.8 -55,-0.2 -157,-0.2 0.745 62.8 109.2 -97.6 -31.5 15.7 21.2 53.8 185 195 A S T 3 S+ 0 0 13 -4,-0.5 -158,-2.2 1,-0.3 19,-0.2 -0.132 71.8 42.1 -51.2 141.9 15.6 18.9 50.7 186 196 A G T 3 S+ 0 0 1 17,-2.4 -1,-0.3 1,-0.5 18,-0.1 0.053 96.4 117.6 103.4 -18.8 15.1 20.7 47.4 187 197 A G < - 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