==== 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 IMMUNE SYSTEM 10-OCT-03 1R5I . COMPND 2 MOLECULE: HLA CLASS II HISTOCOMPATIBILITY ANTIGEN, DR . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.ZHAO,Z.LI,S.J.DROZD,Y.GUO,W.MOURAD,H.LI . 1196 8 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57245.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 862 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 283 23.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 105 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 342 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 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 2 2 2 0 6 2 0 0 0 2 0 0 0 0 2 0 2 4 0 0 0 2 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 4 6 8 4 2 10 3 5 0 2 2 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 4 4 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 A I 0 0 200 0, 0.0 2,-0.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -12.7 58.0 -4.3 93.4 2 2 A K - 0 0 128 1,-0.0 2,-0.4 2,-0.0 199,-0.4 -0.604 360.0-152.7 -74.0 107.8 59.0 -1.7 90.8 3 3 A E + 0 0 101 -2,-0.8 197,-0.2 1,-0.1 3,-0.1 -0.700 19.9 174.5 -85.8 129.7 57.1 -2.5 87.6 4 4 A E + 0 0 99 195,-2.3 2,-0.3 -2,-0.4 196,-0.2 0.857 56.9 11.1-102.4 -44.2 58.7 -1.5 84.4 5 5 A H E -A 199 0A 33 194,-1.6 194,-2.8 197,-0.2 2,-0.4 -0.968 49.4-160.8-140.6 157.2 56.7 -2.8 81.4 6 6 A V E -A 198 0A 19 -2,-0.3 21,-2.8 192,-0.2 2,-0.6 -0.981 1.6-169.7-139.7 124.3 53.4 -4.5 80.6 7 7 A I E -AB 197 26A 6 190,-2.2 190,-2.7 -2,-0.4 2,-0.4 -0.968 16.3-168.7-112.6 120.3 52.5 -6.4 77.5 8 8 A I E -AB 196 25A 23 17,-2.5 17,-2.7 -2,-0.6 2,-0.7 -0.935 19.0-157.5-117.4 133.9 48.8 -7.2 77.2 9 9 A Q E -AB 195 24A 0 186,-2.7 186,-2.5 -2,-0.4 2,-0.5 -0.940 27.2-176.1-103.3 114.2 47.0 -9.5 74.8 10 10 A A E +AB 194 23A 7 13,-3.1 13,-2.3 -2,-0.7 2,-0.3 -0.955 11.0 162.7-121.6 131.9 43.5 -8.2 74.7 11 11 A E E +AB 193 22A 3 182,-2.4 182,-2.6 -2,-0.5 2,-0.3 -0.957 5.6 173.9-140.7 157.0 40.5 -9.6 72.9 12 12 A F E -AB 192 21A 8 9,-2.0 9,-2.2 -2,-0.3 2,-0.3 -0.987 16.3-154.5-158.9 161.5 36.8 -9.3 73.0 13 13 A Y E -AB 191 20A 2 178,-2.0 178,-2.1 -2,-0.3 2,-0.4 -0.994 16.2-158.6-142.0 137.6 33.5 -10.3 71.3 14 14 A L E >> -AB 190 19A 0 5,-2.5 4,-2.1 -2,-0.3 5,-1.4 -0.961 12.9-113.4-129.1 137.1 30.2 -8.5 71.4 15 15 A N E 45S+A 189 0A 38 174,-2.5 174,-2.0 -2,-0.4 -2,-0.0 -0.856 84.5 3.3-117.3 154.3 26.5 -9.3 70.8 16 16 A P T 45S+ 0 0 43 0, 0.0 -1,-0.2 0, 0.0 172,-0.1 -0.981 125.4 63.5 -84.1 6.2 24.3 -8.8 69.1 17 17 A D T 45S- 0 0 35 2,-0.1 -2,-0.2 1,-0.1 3,-0.1 0.788 88.4-145.2 -55.5 -32.4 26.7 -6.8 67.0 18 18 A Q T <5 + 0 0 37 -4,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.942 48.6 141.2 63.0 45.9 28.8 -9.9 66.3 19 19 A S E < +B 14 0A 39 -5,-1.4 -5,-2.5 2,-0.0 2,-0.3 -0.974 26.1 179.3-123.4 136.1 32.0 -7.9 66.4 20 20 A G E -B 13 0A 23 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.787 9.4-160.2-126.6 172.2 35.3 -9.1 67.9 21 21 A E E -B 12 0A 12 -9,-2.2 -9,-2.0 -2,-0.3 2,-0.4 -0.987 5.2-170.7-154.5 146.4 38.8 -7.7 68.3 22 22 A F E +B 11 0A 0 12,-0.4 12,-2.0 -2,-0.3 2,-0.3 -0.981 24.5 150.1-141.1 125.7 42.2 -9.2 69.0 23 23 A X E -BC 10 33A 0 -13,-2.3 -13,-3.1 -2,-0.4 2,-0.4 -0.999 37.1-132.1-159.0 157.0 45.2 -7.1 69.8 24 24 A F E -BC 9 32A 0 8,-2.8 7,-2.7 -2,-0.3 8,-1.2 -0.915 23.6-166.4-112.1 140.7 48.6 -6.7 71.5 25 25 A D E -BC 8 30A 7 -17,-2.7 -17,-2.5 -2,-0.4 2,-0.5 -0.962 9.7-160.7-130.4 141.1 49.5 -3.7 73.7 26 26 A F E > S-BC 7 29A 2 3,-3.6 3,-2.9 -2,-0.4 -19,-0.2 -0.976 76.9 -30.2-124.6 118.5 52.8 -2.4 75.1 27 27 A D T 3 S- 0 0 52 -21,-2.8 -20,-0.1 -2,-0.5 -1,-0.1 0.821 128.7 -43.8 45.4 37.5 52.8 0.0 78.0 28 28 A G T 3 S+ 0 0 17 -22,-0.3 2,-0.3 1,-0.3 -1,-0.3 0.202 119.5 103.2 98.1 -18.0 49.5 1.5 76.7 29 29 A D E < S-C 26 0A 1 -3,-2.9 -3,-3.6 305,-0.1 2,-0.4 -0.797 75.4-110.5-103.7 144.9 50.3 1.6 73.0 30 30 A E E -C 25 0A 5 -2,-0.3 -5,-0.3 303,-0.3 3,-0.1 -0.543 25.0-175.6 -74.2 124.3 49.1 -0.8 70.4 31 31 A I E - 0 0 0 -7,-2.7 13,-2.0 -2,-0.4 14,-0.4 0.923 67.4 -44.0 -81.5 -48.5 51.7 -3.1 69.0 32 32 A F E -CD 24 43A 0 -8,-1.2 -8,-2.8 11,-0.2 -1,-0.4 -0.985 48.9-154.2-170.8 166.0 49.3 -4.6 66.5 33 33 A H E -CD 23 42A 37 9,-1.8 9,-2.8 -2,-0.3 2,-0.6 -0.929 24.9-115.2-144.5 166.5 45.8 -6.1 66.0 34 34 A V E - D 0 41A 4 -12,-2.0 2,-0.6 -2,-0.3 -12,-0.4 -0.946 22.3-132.8-112.7 120.2 44.3 -8.5 63.6 35 35 A D E >> - D 0 40A 53 5,-2.3 4,-1.7 -2,-0.6 5,-1.1 -0.592 18.3-155.3 -68.5 113.3 41.6 -7.3 61.2 36 36 A X T 45S+ 0 0 34 -2,-0.6 -1,-0.2 -16,-0.2 441,-0.1 0.928 85.7 50.9 -60.4 -48.5 38.9 -9.9 61.6 37 37 A A T 45S+ 0 0 25 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.886 123.4 29.7 -57.4 -46.0 37.2 -9.5 58.2 38 38 A K T 45S- 0 0 90 2,-0.1 -1,-0.2 452,-0.0 -2,-0.2 0.635 101.6-137.9 -87.5 -16.1 40.4 -9.7 56.1 39 39 A K T <5 + 0 0 17 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.992 56.2 127.6 53.3 69.7 42.0 -12.0 58.8 40 40 A E E < -D 35 0A 92 -5,-1.1 -5,-2.3 16,-0.1 -1,-0.2 -0.974 64.0-108.0-156.7 140.6 45.4 -10.3 58.7 41 41 A T E -D 34 0A 28 13,-0.3 2,-0.4 -2,-0.3 -7,-0.2 -0.460 32.6-169.6 -67.3 132.6 47.9 -8.8 61.1 42 42 A V E -D 33 0A 45 -9,-2.8 -9,-1.8 -2,-0.2 2,-0.2 -0.972 13.7-139.4-130.3 117.0 48.1 -5.0 60.9 43 43 A W E -D 32 0A 48 -2,-0.4 -11,-0.2 -11,-0.2 3,-0.1 -0.521 12.3-134.8 -80.2 141.0 50.9 -3.1 62.7 44 44 A R S S+ 0 0 50 -13,-2.0 2,-0.4 1,-0.2 -12,-0.1 0.799 102.7 22.6 -60.5 -30.4 50.4 0.1 64.6 45 45 A L S >> S- 0 0 30 -14,-0.4 3,-1.5 1,-0.1 4,-0.6 -0.988 82.2-133.0-137.1 126.5 53.6 1.4 62.9 46 46 A E H >> S+ 0 0 169 -2,-0.4 3,-0.8 1,-0.3 4,-0.6 0.780 102.1 66.6 -51.4 -31.8 54.8 -0.2 59.7 47 47 A E H >4 S+ 0 0 79 1,-0.2 3,-1.7 2,-0.2 -1,-0.3 0.885 90.9 64.2 -58.5 -38.7 58.4 -0.5 61.0 48 48 A F H X> S+ 0 0 4 -3,-1.5 3,-1.4 1,-0.3 4,-1.0 0.851 95.9 57.6 -53.5 -37.8 57.2 -3.1 63.5 49 49 A G H << S+ 0 0 31 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.721 97.2 62.8 -66.9 -21.2 56.2 -5.4 60.7 50 50 A R T << S+ 0 0 175 -3,-1.7 -1,-0.3 -4,-0.6 -2,-0.2 0.183 114.0 32.4 -88.6 17.1 59.8 -5.4 59.5 51 51 A F T <4 S+ 0 0 95 -3,-1.4 2,-0.3 1,-0.4 -2,-0.2 0.408 122.5 26.5-146.5 -10.4 61.1 -6.9 62.7 52 52 A A < - 0 0 9 -4,-1.0 -1,-0.4 216,-0.0 2,-0.3 -0.952 57.2-159.1-152.3 168.1 58.3 -9.2 63.9 53 53 A S B -h 375 0B 55 321,-0.9 323,-2.7 -2,-0.3 2,-0.3 -0.925 2.4-161.8-146.9 170.1 55.4 -11.3 62.7 54 54 A F - 0 0 17 -2,-0.3 2,-1.3 321,-0.2 -13,-0.3 -0.929 27.2-121.2-159.8 132.3 52.2 -12.9 63.9 55 55 A E >> - 0 0 98 321,-0.4 3,-3.3 -2,-0.3 4,-0.6 -0.620 19.0-161.1 -78.1 94.4 50.0 -15.7 62.5 56 56 A A H >> S+ 0 0 10 -2,-1.3 4,-1.6 1,-0.3 3,-1.0 0.799 86.9 74.0 -45.0 -33.3 46.6 -13.9 62.1 57 57 A Q H 3> S+ 0 0 12 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.846 88.6 61.4 -50.1 -36.2 45.1 -17.5 62.0 58 58 A G H <> S+ 0 0 12 -3,-3.3 4,-2.2 1,-0.2 -1,-0.3 0.907 99.8 52.2 -58.3 -43.5 45.8 -17.5 65.7 59 59 A A H S+ 0 0 9 -4,-2.7 5,-3.4 -5,-0.3 6,-0.4 0.953 113.4 42.6 -49.8 -49.8 25.2 -14.6 78.6 75 75 A K H ><5S+ 0 0 146 -4,-1.8 3,-1.7 -5,-0.3 -2,-0.2 0.940 114.4 50.2 -61.2 -48.7 23.0 -17.6 79.3 76 76 A R H 3<5S+ 0 0 61 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.842 106.9 53.1 -59.8 -37.2 24.6 -18.4 82.6 77 77 A S T 3<5S- 0 0 12 -4,-3.4 -1,-0.3 -5,-0.2 -2,-0.2 0.414 121.8-111.8 -78.5 3.4 24.3 -14.7 83.8 78 78 A N T < 5 - 0 0 126 -3,-1.7 -3,-0.2 -5,-0.3 -2,-0.2 0.896 69.0 -57.1 65.0 42.3 20.6 -15.2 82.9 79 79 A Y S - 0 0 124 3,-0.4 3,-2.3 -2,-0.3 0, 0.0 -0.991 46.8 -85.8-138.9 137.9 51.3 27.9 63.2 99 99 A L T 3 S- 0 0 108 -2,-0.3 57,-0.2 1,-0.3 55,-0.0 -0.154 108.7 -4.9 -50.7 131.5 49.3 29.1 60.2 100 100 A R T 3 S+ 0 0 187 55,-1.5 -1,-0.3 1,-0.2 56,-0.1 0.499 97.6 128.6 64.8 2.4 49.6 26.8 57.2 101 101 A E < - 0 0 105 -3,-2.3 -3,-0.4 1,-0.1 -1,-0.2 -0.824 69.9-108.1 -93.6 111.8 52.0 24.6 59.0 102 102 A P + 0 0 96 0, 0.0 2,-0.2 0, 0.0 52,-0.2 0.074 53.3 157.6 -35.7 137.5 50.8 21.0 58.8 103 103 A N E - K 0 153D 10 50,-2.4 50,-2.3 -6,-0.1 2,-0.3 -0.817 32.2-120.4-150.3-173.5 49.5 19.6 62.1 104 104 A V E - K 0 152D 30 48,-0.3 -10,-1.7 -2,-0.2 2,-0.4 -0.982 9.4-141.6-146.0 132.2 47.1 16.9 63.4 105 105 A L E -JK 93 151D 0 46,-3.1 46,-2.0 -2,-0.3 2,-0.5 -0.755 17.6-157.3 -91.0 135.2 43.9 17.0 65.4 106 106 A I E -JK 92 150D 0 -14,-3.5 -14,-2.0 -2,-0.4 2,-0.7 -0.958 4.6-162.2-116.3 122.2 43.6 14.2 68.0 107 107 A a E -JK 91 149D 0 42,-2.8 42,-1.8 -2,-0.5 2,-0.6 -0.910 10.0-161.6-104.4 111.7 40.1 13.2 69.3 108 108 A F E -JK 90 148D 22 -18,-3.6 -18,-2.3 -2,-0.7 2,-0.6 -0.856 6.6-172.5 -95.6 121.0 40.5 11.2 72.5 109 109 A I E +JK 89 147D 1 38,-2.5 38,-1.8 -2,-0.6 2,-0.3 -0.969 22.8 173.6-112.6 115.7 37.4 9.1 73.4 110 110 A D E +J 88 0D 35 -22,-2.3 -22,-2.1 -2,-0.6 36,-0.2 -0.789 36.0 19.8-130.4 168.8 37.9 7.6 76.8 111 111 A K E S+ 0 0 72 34,-0.3 2,-0.3 -2,-0.3 -1,-0.2 0.850 84.9 126.1 48.2 53.7 36.4 5.6 79.7 112 112 A F E - K 0 145D 0 33,-1.3 33,-2.6 -3,-0.2 -1,-0.2 -0.847 40.4-130.8-136.6 171.3 33.5 4.0 77.9 113 113 A T B +I 85 0C 0 -28,-1.5 -28,-2.8 -2,-0.3 31,-0.1 -0.869 68.6 42.7-178.8 149.4 31.7 0.7 77.0 114 114 A P S S- 0 0 0 0, 0.0 2,-2.5 0, 0.0 -1,-0.2 0.541 83.5-115.8 -68.1 169.2 30.4 -1.2 75.2 115 115 A P S S+ 0 0 3 0, 0.0 2,-0.4 0, 0.0 22,-0.1 -0.280 81.1 107.6 -73.0 55.3 33.1 -0.9 72.4 116 116 A V + 0 0 37 -2,-2.5 52,-0.4 2,-0.0 2,-0.3 -0.978 37.5 147.9-136.1 122.1 30.8 0.6 69.8 117 117 A V - 0 0 28 -2,-0.4 2,-0.5 50,-0.1 50,-0.2 -0.990 35.8-141.2-152.2 152.4 30.9 4.2 68.9 118 118 A N E -N 166 0E 92 48,-1.8 48,-2.1 -2,-0.3 2,-0.4 -0.974 23.2-170.2-120.4 118.7 30.4 6.5 65.8 119 119 A V E -N 165 0E 25 -2,-0.5 2,-0.4 46,-0.2 46,-0.2 -0.862 5.9-175.0-113.8 145.6 32.8 9.3 65.3 120 120 A T E -N 164 0E 29 44,-1.6 44,-2.7 -2,-0.4 2,-0.3 -0.972 16.0-145.8-142.9 124.0 32.6 12.2 62.8 121 121 A W E -NO 163 128E 8 7,-0.5 7,-2.0 -2,-0.4 2,-0.4 -0.691 21.4-166.5 -85.7 138.8 35.1 15.0 62.0 122 122 A L E -NO 162 127E 12 40,-2.0 40,-1.8 -2,-0.3 2,-0.6 -0.987 16.1-172.1-134.5 128.5 33.5 18.4 61.2 123 123 A R E > S-NO 161 126E 69 3,-2.8 3,-2.1 -2,-0.4 38,-0.2 -0.970 84.0 -25.8-117.4 112.4 35.1 21.5 59.6 124 124 A N T 3 S- 0 0 79 36,-2.5 -1,-0.2 -2,-0.6 37,-0.1 0.898 127.8 -48.1 48.6 48.5 32.7 24.4 59.6 125 125 A G T 3 S+ 0 0 63 35,-0.3 -1,-0.3 1,-0.2 36,-0.1 0.214 117.2 109.9 82.8 -15.7 29.7 22.1 59.7 126 126 A K E < S-O 123 0E 103 -3,-2.1 -3,-2.8 1,-0.0 2,-0.2 -0.793 73.3-118.0 -97.4 131.7 30.9 19.8 56.8 127 127 A P E -O 122 0E 87 0, 0.0 2,-0.4 0, 0.0 -5,-0.3 -0.484 29.5-149.5 -67.4 130.4 32.0 16.3 57.6 128 128 A V E +O 121 0E 14 -7,-2.0 -7,-0.5 -2,-0.2 3,-0.0 -0.835 29.7 155.6-103.3 142.4 35.7 15.8 56.7 129 129 A T > + 0 0 101 -2,-0.4 3,-1.9 -9,-0.1 -1,-0.1 0.651 34.4 103.0-131.9 -40.7 37.1 12.5 55.6 130 130 A T T 3 S+ 0 0 131 1,-0.2 -2,-0.0 21,-0.1 -1,-0.0 -0.263 98.5 5.8 -55.8 127.5 40.2 12.6 53.5 131 131 A G T 3 S+ 0 0 55 1,-0.3 -1,-0.2 20,-0.1 2,-0.1 0.191 92.3 135.0 89.2 -17.8 43.2 11.7 55.6 132 132 A V < + 0 0 47 -3,-1.9 2,-0.3 19,-0.1 -1,-0.3 -0.348 24.9 171.0 -69.8 145.1 41.4 10.7 58.8 133 133 A S E -L 150 0D 62 17,-1.5 17,-3.2 -2,-0.1 2,-0.3 -0.887 10.5-163.9-142.7 171.7 42.4 7.5 60.6 134 134 A E E -L 149 0D 114 -2,-0.3 15,-0.2 15,-0.3 2,-0.2 -0.977 18.6-115.6-156.7 162.7 41.6 5.9 63.9 135 135 A T - 0 0 6 13,-2.5 3,-0.1 -2,-0.3 199,-0.0 -0.497 34.8-106.2 -97.0 170.8 42.8 3.2 66.3 136 136 A V - 0 0 27 -2,-0.2 2,-0.8 1,-0.1 12,-0.3 -0.048 61.7 -63.0 -80.3-169.1 41.0 0.0 67.3 137 137 A F - 0 0 30 10,-0.1 10,-0.2 -22,-0.1 -1,-0.1 -0.719 57.9-153.5 -84.9 112.9 39.4 -0.2 70.7 138 138 A L E -M 146 0D 1 8,-2.9 8,-2.6 -2,-0.8 -109,-0.0 -0.618 14.4-115.8 -87.7 145.2 42.2 -0.0 73.4 139 139 A P E -M 145 0D 16 0, 0.0 2,-0.3 0, 0.0 6,-0.2 -0.220 20.0-157.5 -76.2 163.0 41.8 -1.6 76.8 140 140 A R > - 0 0 43 4,-0.6 3,-2.8 1,-0.1 6,-0.0 -0.983 30.0-118.6-138.7 146.7 41.7 0.0 80.3 141 141 A E T 3 S+ 0 0 161 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 0.806 118.9 54.8 -57.7 -27.1 42.5 -1.5 83.7 142 142 A D T 3 S- 0 0 64 75,-0.0 -1,-0.3 -3,-0.0 3,-0.1 0.373 120.0-114.1 -87.4 7.6 38.9 -0.8 84.7 143 143 A H S < S+ 0 0 18 -3,-2.8 2,-0.1 1,-0.2 -2,-0.1 0.645 81.0 114.6 70.6 20.1 37.8 -2.7 81.6 144 144 A L - 0 0 9 -31,-0.1 -4,-0.6 -30,-0.0 2,-0.3 -0.325 64.1-104.5 -99.5-170.6 36.3 0.2 79.8 145 145 A F E -KM 112 139D 3 -33,-2.6 -33,-1.3 -6,-0.2 2,-0.3 -0.827 18.6-154.8-127.4 165.3 37.8 1.4 76.5 146 146 A R E + M 0 138D 43 -8,-2.6 -8,-2.9 -2,-0.3 2,-0.3 -0.929 16.8 177.6-126.3 151.9 40.0 4.1 74.9 147 147 A K E -K 109 0D 7 -38,-1.8 -38,-2.5 -2,-0.3 2,-0.4 -0.986 12.6-154.3-156.0 146.1 40.0 5.1 71.2 148 148 A F E -K 108 0D 5 -12,-0.3 -13,-2.5 -2,-0.3 2,-0.4 -0.986 4.5-169.5-128.3 139.4 41.8 7.7 69.1 149 149 A H E -KL 107 134D 9 -42,-1.8 -42,-2.8 -2,-0.4 2,-0.4 -0.968 12.6-156.3-123.9 139.6 40.8 9.4 65.9 150 150 A Y E -KL 106 133D 12 -17,-3.2 -17,-1.5 -2,-0.4 -44,-0.2 -0.925 13.7-175.8-122.9 144.1 43.2 11.6 63.9 151 151 A L E -K 105 0D 1 -46,-2.0 -46,-3.1 -2,-0.4 2,-0.2 -0.889 16.3-150.1-139.4 104.8 42.7 14.4 61.4 152 152 A P E +K 104 0D 61 0, 0.0 2,-0.3 0, 0.0 -48,-0.3 -0.557 33.4 168.3 -71.2 137.2 45.7 15.8 59.6 153 153 A F E -K 103 0D 8 -50,-2.3 -50,-2.4 -2,-0.2 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E > + 0 0 112 -5,-0.2 4,-1.4 2,-0.1 -1,-0.1 0.700 65.0 63.3-104.1 -24.1 11.7 -64.0 32.9 1148 158 H V H > S+ 0 0 41 -6,-0.3 4,-2.7 1,-0.2 5,-0.2 0.863 94.9 61.3 -70.1 -37.1 9.9 -61.2 34.8 1149 159 H A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.943 107.3 42.5 -55.6 -52.7 12.5 -58.5 34.2 1150 160 H I H > S+ 0 0 40 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.894 113.7 53.5 -62.9 -40.2 12.2 -58.6 30.4 1151 161 H N H X S+ 0 0 79 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.907 107.5 49.7 -62.8 -41.2 8.4 -58.8 30.6 1152 162 H K H X S+ 0 0 20 -4,-2.7 4,-2.5 1,-0.2 5,-0.4 0.929 111.1 50.5 -62.3 -42.6 8.3 -55.7 32.9 1153 163 H V H X>S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 5,-1.0 0.873 110.7 49.0 -62.0 -38.2 10.5 -53.9 30.4 1154 164 H R H <5S+ 0 0 112 -4,-2.2 -1,-0.2 3,-0.2 -2,-0.2 0.853 113.3 47.8 -69.9 -35.7 8.2 -54.9 27.5 1155 165 H E H <5S+ 0 0 120 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.988 121.0 32.0 -67.3 -62.9 5.1 -53.7 29.4 1156 166 H L H <5S+ 0 0 47 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.2 0.910 144.7 4.1 -64.6 -47.1 6.3 -50.3 30.6 1157 167 H F T ><5S+ 0 0 23 -4,-1.9 3,-3.3 -5,-0.4 2,-1.9 0.480 85.1 122.9-121.7 -5.3 8.6 -49.4 27.7 1158 168 H G T 3 S- 0 0 41 -3,-3.3 4,-2.0 1,-0.1 3,-0.7 -0.559 70.7-127.8 -71.4 126.8 10.0 -47.3 22.6 1161 171 H K H 3> S+ 0 0 131 -2,-0.3 4,-2.5 1,-0.3 3,-0.3 0.878 109.2 46.5 -38.9 -53.4 11.9 -47.2 19.4 1162 172 H N H 3> S+ 0 0 25 1,-0.2 4,-2.5 2,-0.2 8,-0.4 0.846 108.1 53.9 -63.7 -37.6 15.2 -47.7 21.3 1163 173 H V H <4 S+ 0 0 0 -3,-0.7 -1,-0.2 -6,-0.2 -2,-0.2 0.826 116.0 40.8 -67.2 -29.9 13.9 -50.6 23.5 1164 174 H K H < S+ 0 0 143 -4,-2.0 -2,-0.2 -3,-0.3 -1,-0.2 0.850 124.9 34.4 -85.1 -36.6 12.8 -52.5 20.4 1165 175 H E H < S+ 0 0 111 -4,-2.5 2,-0.7 -5,-0.3 -3,-0.2 0.809 108.3 59.9 -90.2 -34.5 15.9 -51.7 18.2 1166 176 H L X - 0 0 45 -4,-2.5 4,-2.4 -5,-0.2 5,-0.2 -0.855 54.9-167.9-107.0 108.0 18.9 -51.5 20.5 1167 177 H W H > S+ 0 0 167 -2,-0.7 4,-2.9 1,-0.2 5,-0.2 0.890 91.2 52.8 -55.7 -43.6 19.8 -54.6 22.5 1168 178 H W H > S+ 0 0 39 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.924 110.1 48.2 -60.6 -43.2 22.2 -52.8 24.7 1169 179 H F H > S+ 0 0 0 2,-0.2 4,-1.7 -7,-0.2 3,-0.4 0.974 113.4 45.4 -59.8 -58.1 19.6 -50.2 25.6 1170 180 H R H X S+ 0 0 46 -4,-2.4 4,-2.4 -8,-0.4 3,-0.3 0.924 112.4 53.4 -50.6 -48.9 16.9 -52.7 26.4 1171 181 H S H X S+ 0 0 24 -4,-2.9 4,-3.3 -5,-0.2 5,-0.3 0.864 102.2 58.3 -56.4 -38.8 19.5 -54.7 28.4 1172 182 H L H X S+ 0 0 2 -4,-2.0 4,-2.1 -3,-0.4 -1,-0.2 0.933 109.9 43.7 -57.4 -45.3 20.3 -51.6 30.4 1173 183 H L H X S+ 0 0 0 -4,-1.7 4,-1.7 -3,-0.3 -2,-0.2 0.867 113.6 50.2 -67.4 -39.4 16.7 -51.3 31.5 1174 184 H V H X S+ 0 0 26 -4,-2.4 4,-1.3 2,-0.2 3,-0.3 0.938 110.2 49.6 -64.4 -45.1 16.5 -55.1 32.2 1175 185 H K H X S+ 0 0 55 -4,-3.3 4,-1.5 1,-0.2 3,-0.4 0.934 106.1 63.1 -56.5 -42.5 19.6 -54.8 34.2 1176 186 H G H X S+ 0 0 0 -4,-2.1 4,-3.2 -5,-0.3 3,-0.2 0.865 96.5 52.1 -50.0 -48.9 17.8 -51.9 35.9 1177 187 H V H X S+ 0 0 1 -4,-1.7 4,-3.2 -3,-0.3 -1,-0.2 0.891 106.4 53.4 -61.9 -37.4 15.0 -53.9 37.4 1178 188 H Y H X S+ 0 0 87 -4,-1.3 4,-1.9 -3,-0.4 -1,-0.2 0.871 112.7 47.4 -62.4 -32.9 17.3 -56.4 39.0 1179 189 H L H X S+ 0 0 9 -4,-1.5 4,-2.5 -3,-0.2 -2,-0.2 0.951 109.6 50.7 -69.2 -52.6 18.9 -53.2 40.5 1180 190 H I H X S+ 0 0 0 -4,-3.2 4,-2.7 1,-0.2 5,-0.2 0.935 109.7 52.1 -50.8 -50.1 15.6 -51.8 41.6 1181 191 H K H X S+ 0 0 51 -4,-3.2 4,-1.9 1,-0.3 -1,-0.2 0.933 109.8 47.7 -52.8 -50.4 14.8 -55.1 43.3 1182 192 H R H <>S+ 0 0 43 -4,-1.9 5,-2.6 1,-0.2 -1,-0.3 0.859 110.6 54.8 -59.2 -34.8 18.1 -55.0 45.2 1183 193 H Y H ><5S+ 0 0 93 -4,-2.5 3,-1.8 3,-0.2 -2,-0.2 0.953 107.7 46.6 -63.2 -52.1 17.3 -51.4 46.1 1184 194 H Y H 3<5S+ 0 0 70 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.815 106.2 59.0 -62.0 -30.7 13.9 -52.2 47.6 1185 195 H E T 3<5S- 0 0 141 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.537 125.8-104.2 -74.9 -6.7 15.4 -55.1 49.5 1186 196 H G T < 5 + 0 0 45 -3,-1.8 -3,-0.2 1,-0.2 2,-0.2 0.721 56.2 171.0 93.8 23.0 17.7 -52.5 51.1 1187 197 H D < - 0 0 15 -5,-2.6 -1,-0.2 1,-0.1 -644,-0.1 -0.488 12.3-174.9 -69.3 135.3 21.0 -53.1 49.3 1188 198 H I S S+ 0 0 85 -646,-0.8 3,-0.4 -2,-0.2 -1,-0.1 0.613 73.7 66.3-103.3 -24.1 23.5 -50.3 50.2 1189 199 H E > + 0 0 26 1,-0.2 3,-3.1 -647,-0.1 4,-0.5 0.765 69.4 106.5 -72.0 -28.6 26.4 -51.2 47.9 1190 200 H L G >> S+ 0 0 4 1,-0.3 3,-1.9 2,-0.2 4,-0.6 0.622 70.1 57.3 -17.8 -58.0 24.5 -50.5 44.7 1191 201 H K G 34 S+ 0 0 91 -3,-0.4 7,-0.3 1,-0.3 3,-0.3 0.770 106.1 51.6 -57.2 -27.4 26.2 -47.2 43.7 1192 202 H T G <4 S+ 0 0 31 -3,-3.1 -1,-0.3 1,-0.2 -2,-0.2 0.520 89.9 83.4 -86.9 -7.3 29.6 -49.0 43.6 1193 203 H T T <4 S- 0 0 50 -3,-1.9 2,-0.3 -4,-0.5 -1,-0.2 0.914 108.3 -31.9 -62.2 -44.9 28.2 -51.7 41.4 1194 204 H S X - 0 0 14 -4,-0.6 4,-3.3 -3,-0.3 -1,-0.2 -0.965 57.1 -98.8-172.1 156.8 28.6 -49.8 38.1 1195 205 H D H > S+ 0 0 17 -2,-0.3 4,-2.6 1,-0.2 5,-0.1 0.864 125.4 50.3 -50.8 -37.6 28.7 -46.3 36.6 1196 206 H F H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.974 110.4 46.4 -66.0 -55.0 25.1 -47.0 35.4 1197 207 H A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.900 113.2 52.1 -54.2 -40.3 23.9 -48.1 38.9 1198 208 H K H < S+ 0 0 61 -4,-3.3 4,-0.3 -7,-0.3 -1,-0.2 0.957 109.7 48.1 -60.8 -50.0 25.6 -45.1 40.3 1199 209 H A H < S+ 0 0 18 -4,-2.6 3,-0.4 -5,-0.2 -1,-0.2 0.847 113.9 47.4 -60.2 -36.3 23.9 -42.7 37.8 1200 210 H V H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.957 119.4 35.0 -73.0 -50.4 20.5 -44.3 38.5 1201 211 H F S < S+ 0 0 19 -4,-2.4 2,-1.0 -5,-0.2 -1,-0.2 0.141 89.7 104.8 -93.8 23.2 20.5 -44.3 42.3 1202 212 H E 0 0 111 -3,-0.4 -1,-0.1 -4,-0.3 -4,-0.0 -0.794 360.0 360.0-103.8 88.0 22.5 -41.1 42.7 1203 213 H D 0 0 190 -2,-1.0 -1,-0.2 0, 0.0 -2,-0.1 0.972 360.0 360.0 58.2 360.0 19.7 -38.6 43.8