==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE (PHOSPHOTRANSFERASE) 02-JAN-95 1IRK . COMPND 2 MOLECULE: INSULIN RECEPTOR TYROSINE KINASE DOMAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.R.HUBBARD,L.WEI,L.ELLIS,W.A.HENDRICKSON . 303 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15080.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 17 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 25.7 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+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 1 0 1 1 1 1 1 0 0 0 1 0 0 1 0 0 1 0 0 0 0 0 0 0 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 . 1 1 1 2 0 0 1 1 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 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 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 1 981 A S 0 0 132 0, 0.0 2,-0.4 0, 0.0 58,-0.0 0.000 360.0 360.0 360.0 89.7 19.8 83.0 1.6 2 982 A S - 0 0 92 1,-0.0 2,-0.6 63,-0.0 61,-0.1 -0.446 360.0-175.3 -65.4 113.9 16.1 82.0 1.5 3 983 A V - 0 0 75 -2,-0.4 2,-0.3 59,-0.2 66,-0.2 -0.961 13.6-154.3-111.2 115.7 15.8 78.5 0.0 4 984 A F - 0 0 84 -2,-0.6 3,-0.1 1,-0.1 6,-0.1 -0.663 13.9-111.5 -98.3 152.0 12.2 77.5 -0.5 5 985 A V - 0 0 15 -2,-0.3 -1,-0.1 1,-0.1 64,-0.1 -0.214 48.8 -81.5 -68.7 161.1 10.4 74.1 -0.6 6 986 A P > - 0 0 64 0, 0.0 3,-3.0 0, 0.0 4,-0.4 -0.301 46.3-101.9 -63.4 154.3 8.9 72.7 -3.8 7 987 A D G > S+ 0 0 153 1,-0.3 3,-1.7 2,-0.2 -2,-0.1 0.800 122.2 64.3 -43.3 -39.7 5.4 74.0 -4.8 8 988 A E G 3 S+ 0 0 92 1,-0.3 -1,-0.3 76,-0.0 -3,-0.0 0.733 101.6 50.7 -59.2 -26.0 4.0 70.7 -3.5 9 989 A W G < S+ 0 0 70 -3,-3.0 76,-2.4 75,-0.1 2,-0.5 0.409 85.6 101.6 -94.2 -1.0 5.2 71.6 -0.0 10 990 A E B < -a 85 0A 70 -3,-1.7 2,-0.4 -4,-0.4 76,-0.2 -0.744 57.6-157.6 -88.2 130.9 3.7 75.1 0.1 11 991 A V - 0 0 13 74,-3.0 2,-0.2 -2,-0.5 76,-0.1 -0.910 20.2-117.3-112.0 132.6 0.5 75.3 2.1 12 992 A S > - 0 0 63 -2,-0.4 3,-2.3 1,-0.1 4,-0.3 -0.512 24.5-130.9 -64.9 131.4 -2.2 78.0 1.6 13 993 A R G > S+ 0 0 80 1,-0.3 3,-2.0 -2,-0.2 -1,-0.1 0.845 104.5 64.1 -52.4 -40.0 -2.4 79.9 4.9 14 994 A E G 3 S+ 0 0 132 1,-0.3 -1,-0.3 21,-0.0 -2,-0.1 0.641 93.0 64.0 -62.6 -15.0 -6.2 79.6 4.9 15 995 A K G < S+ 0 0 55 -3,-2.3 21,-2.5 20,-0.1 2,-0.5 0.584 92.1 75.0 -86.3 -7.5 -5.8 75.8 5.2 16 996 A I E < -B 35 0A 17 -3,-2.0 2,-0.4 -4,-0.3 19,-0.2 -0.902 55.8-177.3-109.1 133.7 -4.1 76.0 8.7 17 997 A T E -B 34 0A 58 17,-2.7 17,-2.3 -2,-0.5 2,-0.4 -0.997 19.9-142.0-128.9 118.7 -6.0 76.8 11.9 18 998 A L E +B 33 0A 69 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.727 21.7 177.2 -83.6 136.1 -4.0 77.2 15.1 19 999 A L E - 0 0 94 13,-2.9 2,-0.3 1,-0.4 14,-0.2 0.831 54.7 -24.6-107.4 -47.9 -5.7 75.7 18.1 20 1000 A R E S-B 32 0A 157 12,-1.5 12,-3.1 0, 0.0 -1,-0.4 -0.963 70.6 -88.4-163.0 158.5 -3.6 75.9 21.2 21 1001 A E E -B 31 0A 120 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.597 24.6-171.7 -83.7 137.9 0.1 76.1 22.0 22 1002 A L E - 0 0 58 8,-3.3 2,-0.3 1,-0.4 9,-0.2 0.717 55.7 -87.6 -90.8 -34.1 2.0 72.8 22.4 23 1003 A G E -B 30 0A 22 7,-1.9 7,-2.6 148,-0.0 -1,-0.4 -0.873 57.7 -33.5 149.3-178.0 5.2 74.5 23.7 24 1004 A Q E -B 29 0A 77 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.429 45.8-173.0 -78.4 141.3 8.5 76.2 22.8 25 1005 A G - 0 0 8 3,-2.5 147,-0.3 26,-0.2 146,-0.1 -0.525 45.5 -86.7-115.5-172.7 10.6 75.1 19.8 26 1006 A S S S+ 0 0 83 145,-1.3 146,-0.1 1,-0.2 3,-0.1 0.945 127.6 28.1 -65.3 -46.8 14.0 76.3 18.8 27 1007 A F S S- 0 0 27 1,-0.2 26,-3.5 24,-0.1 2,-0.3 0.539 130.6 -60.2 -91.3 -11.2 12.8 79.3 16.8 28 1008 A G S S- 0 0 2 24,-0.3 -3,-2.5 144,-0.1 -1,-0.2 -0.987 83.6 -8.8 160.6-164.0 9.6 80.0 18.7 29 1009 A M E -B 24 0A 26 -2,-0.3 22,-1.8 -5,-0.2 2,-0.4 -0.199 47.8-149.7 -67.6 150.8 6.2 78.6 19.8 30 1010 A V E -BC 23 50A 0 -7,-2.6 -8,-3.3 20,-0.2 -7,-1.9 -0.976 16.3-165.2-119.7 136.8 4.8 75.4 18.5 31 1011 A Y E -BC 21 49A 63 18,-3.2 18,-3.8 -2,-0.4 2,-0.4 -0.833 22.1-127.6-122.5 157.2 1.0 75.0 18.2 32 1012 A E E +BC 20 48A 37 -12,-3.1 -13,-2.9 -2,-0.3 -12,-1.5 -0.822 49.3 149.1 -94.9 143.0 -1.3 72.2 17.7 33 1013 A G E -BC 18 47A 0 14,-2.8 14,-2.3 -2,-0.4 2,-0.4 -0.843 44.7-100.5-155.1-170.0 -3.6 73.0 14.8 34 1014 A N E -BC 17 46A 37 -17,-2.3 -17,-2.7 -2,-0.3 2,-0.4 -0.953 24.2-163.4-125.0 139.5 -5.7 71.6 11.9 35 1015 A A E -BC 16 45A 0 10,-2.1 10,-2.5 -2,-0.4 3,-0.5 -0.998 15.1-139.7-126.9 126.0 -4.5 71.6 8.3 36 1016 A R E S- C 0 44A 67 -21,-2.5 8,-0.3 -2,-0.4 7,-0.1 -0.717 77.0 -7.4 -90.9 139.0 -7.1 71.1 5.6 37 1017 A D E S+ 0 0 104 6,-3.0 -1,-0.2 -2,-0.3 6,-0.1 0.817 90.7 126.0 47.5 45.6 -6.3 68.9 2.6 38 1018 A I E + 0 0 35 -3,-0.5 2,-0.4 4,-0.2 -1,-0.1 0.673 67.0 44.5-101.0 -22.2 -2.7 68.6 3.6 39 1019 A I E > S- C 0 42A 46 3,-0.5 3,-1.9 -4,-0.2 -1,-0.2 -0.985 95.7-105.4-124.1 132.0 -2.6 64.7 3.5 40 1020 A K T 3 S+ 0 0 203 -2,-0.4 3,-0.1 1,-0.2 -2,-0.0 -0.276 104.0 17.9 -57.4 137.8 -4.2 62.7 0.7 41 1021 A G T 3 S+ 0 0 93 1,-0.1 2,-0.5 2,-0.0 -1,-0.2 0.339 107.1 95.5 83.5 -4.4 -7.4 61.0 1.6 42 1022 A E E < -C 39 0A 62 -3,-1.9 -3,-0.5 1,-0.1 -4,-0.2 -0.978 56.2-161.7-122.9 122.0 -8.0 63.2 4.7 43 1023 A A E S+ 0 0 71 -2,-0.5 -6,-3.0 1,-0.2 2,-0.3 0.908 86.0 12.5 -65.3 -40.6 -10.1 66.4 4.6 44 1024 A E E -C 36 0A 95 -8,-0.3 2,-0.4 -7,-0.1 -8,-0.2 -0.992 67.5-166.7-139.7 147.3 -8.4 67.6 7.8 45 1025 A T E -C 35 0A 5 -10,-2.5 -10,-2.1 -2,-0.3 2,-0.2 -0.998 24.6-123.2-139.7 133.2 -5.4 66.6 9.7 46 1026 A R E +C 34 0A 114 -2,-0.4 52,-0.8 -12,-0.2 2,-0.3 -0.564 44.3 174.8 -71.9 135.6 -4.2 67.5 13.2 47 1027 A V E -CD 33 97A 0 -14,-2.3 -14,-2.8 -2,-0.2 2,-0.5 -0.898 36.5-120.0-141.2 167.8 -0.7 69.0 12.9 48 1028 A A E -CD 32 96A 0 48,-2.7 48,-3.2 -2,-0.3 2,-0.5 -0.920 31.2-157.9-108.7 130.0 2.0 70.6 15.0 49 1029 A V E -CD 31 95A 0 -18,-3.8 -18,-3.2 -2,-0.5 2,-0.3 -0.965 2.6-159.3-119.4 121.9 2.7 74.1 13.7 50 1030 A K E +CD 30 94A 28 44,-2.7 44,-2.0 -2,-0.5 2,-0.3 -0.751 11.9 179.0 -97.1 147.0 6.1 75.8 14.4 51 1031 A T - 0 0 15 -22,-1.8 2,-0.4 -2,-0.3 -26,-0.2 -0.897 29.1-111.9-139.1 163.9 6.6 79.6 14.2 52 1032 A V - 0 0 11 40,-0.4 -24,-0.3 -2,-0.3 40,-0.1 -0.805 42.8 -99.3 -99.6 144.0 9.6 81.9 14.8 53 1033 A N > - 0 0 64 -26,-3.5 3,-1.9 -2,-0.4 -1,-0.1 -0.284 27.6-121.5 -58.5 146.4 9.5 84.3 17.8 54 1034 A E T 3 S+ 0 0 182 1,-0.3 -1,-0.1 -3,-0.0 -26,-0.1 0.629 111.5 61.1 -68.3 -10.4 8.4 87.8 17.0 55 1035 A S T 3 S+ 0 0 108 2,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.479 80.1 117.3 -92.3 -4.8 11.7 89.1 18.4 56 1036 A A < - 0 0 15 -3,-1.9 -4,-0.0 -29,-0.1 -29,-0.0 -0.373 66.4-121.4 -66.9 142.6 13.7 87.1 15.8 57 1037 A S > - 0 0 46 1,-0.1 4,-1.7 -2,-0.1 5,-0.1 -0.161 29.8-101.8 -71.4 173.1 15.8 89.0 13.4 58 1038 A L H > S+ 0 0 130 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.913 125.2 55.4 -63.0 -43.9 15.3 88.7 9.6 59 1039 A R H > S+ 0 0 138 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.939 108.2 47.3 -54.6 -48.0 18.3 86.4 9.5 60 1040 A E H > S+ 0 0 70 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.826 110.0 53.4 -65.5 -30.9 16.7 84.1 12.1 61 1041 A R H X S+ 0 0 51 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.912 111.3 45.3 -69.8 -39.2 13.4 84.2 10.2 62 1042 A I H X S+ 0 0 35 -4,-2.5 4,-2.5 2,-0.2 -59,-0.2 0.927 112.0 51.8 -68.1 -44.8 15.2 83.1 7.0 63 1043 A E H X S+ 0 0 77 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.860 104.9 57.8 -59.9 -37.1 17.1 80.4 8.9 64 1044 A F H X S+ 0 0 5 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.945 111.6 40.4 -60.2 -47.2 13.8 79.1 10.3 65 1045 A L H X S+ 0 0 31 -4,-1.7 4,-1.5 1,-0.2 -2,-0.2 0.851 111.5 56.1 -71.3 -34.0 12.4 78.5 6.8 66 1046 A N H X S+ 0 0 34 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.858 104.5 54.1 -66.9 -33.4 15.7 77.1 5.5 67 1047 A E H X S+ 0 0 98 -4,-2.0 4,-3.1 1,-0.2 3,-0.4 0.923 104.4 53.9 -66.2 -42.8 15.7 74.5 8.2 68 1048 A A H X S+ 0 0 3 -4,-1.4 4,-1.3 1,-0.3 -1,-0.2 0.875 105.6 54.2 -58.3 -38.9 12.2 73.4 7.2 69 1049 A S H < S+ 0 0 26 -4,-1.5 4,-0.4 -66,-0.2 -1,-0.3 0.856 111.1 45.8 -62.6 -35.0 13.6 73.0 3.6 70 1050 A V H >< S+ 0 0 92 -4,-1.4 3,-2.8 -3,-0.4 -2,-0.2 0.973 110.5 51.3 -70.9 -51.5 16.3 70.7 5.1 71 1051 A M H >< S+ 0 0 55 -4,-3.1 3,-1.7 1,-0.3 11,-0.5 0.726 97.7 70.9 -57.9 -22.0 13.8 68.8 7.2 72 1052 A K T 3< S+ 0 0 56 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.811 91.3 58.7 -64.9 -29.8 11.9 68.4 4.0 73 1053 A G T < S+ 0 0 25 -3,-2.8 2,-0.9 -4,-0.4 -1,-0.3 0.361 85.1 87.4 -81.7 5.2 14.6 66.0 2.9 74 1054 A F < + 0 0 31 -3,-1.7 2,-0.7 -4,-0.1 8,-0.3 -0.831 52.3 161.1-107.0 90.8 14.1 63.7 5.8 75 1055 A T + 0 0 69 -2,-0.9 2,-0.3 6,-0.1 5,-0.1 -0.917 16.3 126.2-115.6 101.6 11.4 61.4 4.6 76 1056 A C > - 0 0 19 -2,-0.7 3,-2.1 3,-0.5 219,-0.1 -0.933 61.7-127.4-155.3 135.6 11.2 58.2 6.7 77 1057 A H T 3 S+ 0 0 71 217,-0.6 218,-0.1 -2,-0.3 4,-0.1 0.718 112.0 55.4 -52.4 -26.9 8.2 56.6 8.4 78 1058 A H T 3 S+ 0 0 1 216,-0.3 90,-2.1 89,-0.1 2,-0.4 0.115 98.9 68.5 -99.4 22.5 10.4 56.5 11.5 79 1059 A V B < S-f 168 0B 5 -3,-2.1 -3,-0.5 88,-0.3 90,-0.2 -0.996 93.6-108.2-138.1 126.4 11.2 60.2 11.6 80 1060 A V - 0 0 4 88,-2.9 2,-0.3 -2,-0.4 90,-0.1 -0.368 49.8-139.7 -53.1 127.7 8.6 62.9 12.4 81 1061 A R - 0 0 96 -4,-0.1 16,-2.4 88,-0.1 2,-0.4 -0.689 11.2-116.8-107.3 156.6 8.0 64.6 9.0 82 1062 A L E - E 0 96A 6 -11,-0.5 14,-0.3 -8,-0.3 3,-0.1 -0.652 26.4-176.4 -78.2 124.2 7.5 68.0 7.6 83 1063 A L E - 0 0 21 12,-2.8 2,-0.3 -2,-0.4 13,-0.2 0.770 56.8 -43.4 -94.9 -29.9 4.1 68.1 6.0 84 1064 A G E - E 0 95A 0 11,-1.8 11,-3.2 -73,-0.0 -1,-0.4 -0.987 46.6-123.3 177.4 175.7 4.2 71.6 4.5 85 1065 A V E -aE 10 94A 3 -76,-2.4 -74,-3.0 -2,-0.3 2,-0.8 -0.999 6.0-151.5-146.0 140.0 5.1 75.3 4.9 86 1066 A V E + E 0 93A 2 7,-2.7 7,-2.4 -2,-0.3 -74,-0.1 -0.961 31.6 164.1-109.3 97.2 3.3 78.6 4.7 87 1067 A S + 0 0 20 -2,-0.8 2,-0.4 5,-0.2 -1,-0.1 0.607 46.3 77.8 -92.4 -19.2 6.2 80.8 3.6 88 1068 A K S S+ 0 0 162 3,-0.1 -75,-0.1 5,-0.1 5,-0.1 -0.829 91.8 3.5 -99.9 135.4 4.5 83.9 2.3 89 1069 A G S S- 0 0 49 -2,-0.4 -3,-0.0 3,-0.1 0, 0.0 -0.234 101.5 -19.9 85.7 179.5 3.1 86.5 4.6 90 1070 A Q S S+ 0 0 134 1,-0.1 2,-0.1 -2,-0.1 -3,-0.1 -0.916 117.0 21.2-118.2 138.4 3.3 86.6 8.4 91 1071 A P S S- 0 0 55 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.687 78.0-139.9 -93.1 161.0 3.9 84.6 10.2 92 1072 A T - 0 0 7 -5,-0.1 2,-0.4 -2,-0.1 -40,-0.4 -0.595 23.0-154.1 -75.3 140.8 5.6 81.8 8.3 93 1073 A L E - E 0 86A 8 -7,-2.4 -7,-2.7 -2,-0.2 2,-0.6 -0.967 15.4-159.0-124.2 135.6 4.4 78.4 9.4 94 1074 A V E -DE 50 85A 2 -44,-2.0 -44,-2.7 -2,-0.4 2,-0.5 -0.976 18.8-152.6-112.6 114.3 6.2 75.0 9.3 95 1075 A V E -DE 49 84A 0 -11,-3.2 -12,-2.8 -2,-0.6 -11,-1.8 -0.838 17.8-179.6 -93.4 124.4 3.6 72.3 9.5 96 1076 A M E -DE 48 82A 10 -48,-3.2 -48,-2.7 -2,-0.5 -14,-0.2 -0.884 37.1 -89.5-120.8 157.6 4.7 69.0 11.0 97 1077 A E E -D 47 0A 22 -16,-2.4 2,-0.6 -2,-0.3 -50,-0.2 -0.378 41.5-131.1 -65.8 138.0 3.0 65.7 11.6 98 1078 A L - 0 0 38 -52,-0.8 2,-0.9 -65,-0.1 -52,-0.1 -0.851 11.9-139.5 -95.6 121.3 1.4 65.6 15.0 99 1079 A M > - 0 0 15 -2,-0.6 3,-2.6 1,-0.2 61,-0.2 -0.696 9.6-143.4 -85.6 109.9 2.2 62.5 17.0 100 1080 A A T 3 S+ 0 0 63 -2,-0.9 61,-0.2 1,-0.3 -1,-0.2 0.764 96.0 39.1 -40.7 -38.4 -1.0 61.5 18.8 101 1081 A H T 3 S- 0 0 59 59,-2.9 -1,-0.3 1,-0.3 60,-0.2 0.250 100.5-138.6-104.9 15.8 0.8 60.3 21.9 102 1082 A G < - 0 0 28 -3,-2.6 58,-3.3 58,-0.3 -1,-0.3 -0.158 54.8 -7.9 67.5-161.2 3.4 63.0 22.3 103 1083 A D B > -G 159 0B 38 56,-0.3 4,-2.1 1,-0.1 56,-0.3 -0.371 64.1-122.2 -72.9 154.4 7.0 62.4 23.3 104 1084 A L H > S+ 0 0 0 54,-2.4 4,-3.3 51,-1.0 5,-0.3 0.837 107.2 58.8 -64.8 -38.6 8.1 58.9 24.4 105 1085 A K H > S+ 0 0 0 50,-0.9 4,-2.3 53,-0.4 -1,-0.2 0.950 112.6 38.2 -59.6 -45.8 9.4 60.1 27.8 106 1086 A S H > S+ 0 0 35 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.859 116.3 53.3 -73.8 -36.9 6.0 61.5 28.8 107 1087 A Y H X S+ 0 0 13 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.949 110.5 46.7 -61.1 -48.2 4.2 58.6 27.2 108 1088 A L H >< S+ 0 0 0 -4,-3.3 3,-1.4 1,-0.2 4,-0.2 0.934 111.4 52.0 -60.9 -45.8 6.4 56.0 29.1 109 1089 A R H >< S+ 0 0 67 -4,-2.3 3,-1.4 -5,-0.3 -1,-0.2 0.866 103.7 57.3 -60.9 -31.3 5.8 57.9 32.4 110 1090 A S H 3< S+ 0 0 7 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.708 97.5 64.2 -70.8 -19.0 2.1 57.9 31.8 111 1091 A L T << S+ 0 0 1 -3,-1.4 -1,-0.3 -4,-0.7 -2,-0.2 0.450 74.0 120.3 -83.0 -5.0 2.2 54.1 31.6 112 1092 A R S X S- 0 0 82 -3,-1.4 3,-1.9 -4,-0.2 6,-0.1 -0.336 78.3-112.5 -60.8 147.3 3.3 53.8 35.2 113 1093 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.785 115.4 32.0 -48.6 -39.4 0.9 51.8 37.5 114 1094 A E T 3 S+ 0 0 98 3,-0.0 2,-0.1 0, 0.0 -2,-0.1 0.165 84.1 137.2-109.1 17.6 -0.1 54.8 39.5 115 1095 A A X - 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0 0 5 -3,-0.8 15,-0.1 -4,-0.6 10,-0.0 -0.593 68.6-120.1 -88.9 137.7 25.9 61.2 26.8 197 1177 A A >> - 0 0 0 -2,-0.3 4,-2.1 13,-0.2 3,-0.7 -0.306 32.9-108.7 -65.7 154.1 28.6 58.7 25.9 198 1178 A P H 3> S+ 0 0 3 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.842 119.0 52.0 -55.1 -34.3 31.9 58.8 28.0 199 1179 A E H 3> S+ 0 0 35 2,-0.2 4,-3.0 69,-0.2 6,-0.7 0.849 106.9 51.9 -73.6 -30.4 33.8 60.3 25.1 200 1180 A S H <> S+ 0 0 2 -3,-0.7 4,-2.5 4,-0.2 -1,-0.2 0.933 112.7 46.3 -68.8 -41.7 31.3 63.1 24.6 201 1181 A L H < S+ 0 0 2 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.909 119.1 40.8 -64.6 -44.0 31.5 64.0 28.3 202 1182 A K H < S+ 0 0 135 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.897 136.4 12.7 -74.5 -41.8 35.3 63.8 28.3 203 1183 A D H < S- 0 0 96 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.413 91.2-122.6-118.8 0.4 36.0 65.5 24.9 204 1184 A G < + 0 0 49 -4,-2.5 2,-0.3 -5,-0.3 -4,-0.2 0.532 65.1 137.4 71.4 3.7 32.8 67.2 23.9 205 1185 A V - 0 0 81 -6,-0.7 2,-0.4 5,-0.0 -1,-0.2 -0.627 36.2-162.2 -86.1 143.3 32.7 65.3 20.6 206 1186 A F + 0 0 44 -2,-0.3 2,-0.2 -3,-0.1 -57,-0.1 -0.990 17.4 158.8-127.3 133.5 29.5 63.7 19.3 207 1187 A T >> - 0 0 48 -2,-0.4 4,-1.8 1,-0.0 3,-0.6 -0.794 59.4 -90.8-139.7 178.9 29.3 61.0 16.6 208 1188 A T H 3> S+ 0 0 39 1,-0.3 4,-1.9 -2,-0.2 5,-0.1 0.856 127.8 60.2 -64.7 -27.6 26.8 58.3 15.5 209 1189 A S H 3> S+ 0 0 32 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.804 104.3 46.0 -67.5 -34.4 28.6 56.1 18.0 210 1190 A S H <> S+ 0 0 2 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.774 109.0 56.9 -77.7 -28.5 27.7 58.5 20.8 211 1191 A D H X S+ 0 0 1 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.894 103.0 54.6 -64.7 -38.7 24.2 58.5 19.4 212 1192 A M H X S+ 0 0 1 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.896 104.6 53.7 -61.4 -40.3 24.3 54.7 19.8 213 1193 A W H X S+ 0 0 3 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.937 110.1 46.6 -56.6 -49.9 25.2 55.1 23.5 214 1194 A S H X S+ 0 0 8 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.876 107.1 58.1 -61.0 -39.7 22.1 57.3 23.9 215 1195 A F H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.889 103.9 52.6 -58.7 -39.8 20.0 54.8 22.0 216 1196 A G H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.943 108.5 50.4 -61.4 -42.0 21.1 52.3 24.7 217 1197 A V H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.873 107.3 53.8 -63.6 -36.4 19.8 54.8 27.3 218 1198 A V H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.917 107.4 50.3 -63.6 -43.3 16.5 55.1 25.4 219 1199 A L H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 3,-0.3 0.935 110.1 51.3 -58.5 -45.1 16.1 51.3 25.5 220 1200 A W H X S+ 0 0 21 -4,-2.4 4,-2.5 1,-0.3 -1,-0.2 0.865 105.8 54.9 -60.2 -35.7 16.8 51.6 29.2 221 1201 A E H X>S+ 0 0 0 -4,-2.0 5,-3.5 2,-0.2 4,-0.6 0.838 105.1 53.1 -68.7 -32.7 14.1 54.3 29.5 222 1202 A I H ><5S+ 0 0 4 -4,-1.8 3,-1.0 -3,-0.3 -2,-0.2 0.961 111.5 46.4 -66.1 -41.4 11.6 51.9 27.9 223 1203 A T H 3<5S+ 0 0 46 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.887 119.5 39.3 -68.8 -35.6 12.5 49.3 30.5 224 1204 A S H 3<5S- 0 0 22 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.385 111.3-114.4 -95.8 7.7 12.3 51.7 33.4 225 1205 A L T <<5S- 0 0 19 -3,-1.0 -3,-0.2 -4,-0.6 -4,-0.1 0.946 77.4 -54.8 55.6 42.9 9.3 53.7 32.1 226 1206 A A S - 0 0 38 1,-0.1 3,-1.5 -2,-0.1 -1,-0.1 -0.648 51.2-109.3 -78.9 127.5 16.1 59.4 35.3 229 1209 A P T 3 S+ 0 0 0 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.370 102.0 5.2 -58.6 139.1 19.2 57.6 34.3 230 1210 A Y T > S+ 0 0 20 1,-0.1 3,-3.4 2,-0.1 8,-0.1 0.833 81.9 175.6 54.6 40.2 21.5 57.1 37.3 231 1211 A Q T < S+ 0 0 125 -3,-1.5 -1,-0.1 1,-0.3 -3,-0.0 0.684 71.9 59.3 -49.2 -25.3 18.8 58.6 39.5 232 1212 A G T 3 S+ 0 0 70 -4,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.566 98.5 72.8 -83.3 -5.4 20.8 57.9 42.6 233 1213 A L S < S- 0 0 54 -3,-3.4 2,-0.1 -4,-0.1 0, 0.0 -0.809 77.3-127.4-112.8 149.2 23.7 60.0 41.3 234 1214 A S > - 0 0 57 -2,-0.3 4,-2.6 1,-0.1 3,-0.2 -0.401 39.9 -97.2 -81.0 171.1 24.0 63.8 41.1 235 1215 A N H > S+ 0 0 42 1,-0.3 4,-2.0 2,-0.2 -1,-0.1 0.873 126.9 49.4 -57.0 -43.9 25.1 65.3 37.8 236 1216 A E H > S+ 0 0 104 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.868 110.8 51.1 -63.7 -39.9 28.7 65.6 38.9 237 1217 A Q H > S+ 0 0 106 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.897 105.7 55.0 -65.6 -39.4 28.6 62.0 40.0 238 1218 A V H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.4 0.956 105.0 54.8 -58.2 -45.1 27.2 60.9 36.6 239 1219 A L H X S+ 0 0 11 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.895 113.9 39.0 -54.6 -49.2 30.1 62.6 34.9 240 1220 A K H X S+ 0 0 143 -4,-1.6 4,-2.0 2,-0.2 6,-0.2 0.935 116.4 51.3 -67.6 -47.0 32.7 60.6 37.0 241 1221 A F H <>S+ 0 0 82 -4,-3.0 5,-2.8 1,-0.2 4,-0.2 0.943 115.7 40.3 -55.9 -54.4 30.8 57.4 36.9 242 1222 A V H ><5S+ 0 0 1 -4,-3.2 3,-1.6 1,-0.2 -1,-0.2 0.912 114.4 51.1 -66.3 -42.2 30.3 57.4 33.1 243 1223 A M H 3<5S+ 0 0 56 -4,-2.1 -1,-0.2 -5,-0.4 -2,-0.2 0.814 106.5 57.1 -66.3 -25.9 33.8 58.6 32.3 244 1224 A D T 3<5S- 0 0 112 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.492 131.6 -92.8 -79.8 -6.1 35.2 55.9 34.5 245 1225 A G T < 5S+ 0 0 31 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.2 0.478 76.4 147.5 108.2 2.8 33.4 53.3 32.4 246 1226 A G < + 0 0 14 -5,-2.8 2,-0.3 -6,-0.2 -1,-0.2 -0.238 19.5 177.5 -67.9 158.8 30.2 53.0 34.4 247 1227 A Y - 0 0 99 3,-0.0 3,-0.1 0, 0.0 16,-0.0 -0.946 37.0 -68.9-154.2 166.9 26.9 52.2 32.6 248 1228 A L - 0 0 7 -2,-0.3 2,-0.2 1,-0.1 18,-0.1 -0.244 57.4 -95.0 -64.6 149.8 23.3 51.7 33.6 249 1229 A D - 0 0 138 1,-0.1 -1,-0.1 -29,-0.0 3,-0.1 -0.452 44.0-100.6 -69.0 135.9 22.2 48.5 35.4 250 1230 A Q - 0 0 112 -2,-0.2 -1,-0.1 1,-0.1 9,-0.0 -0.293 46.7-112.1 -53.3 125.5 21.0 45.7 33.4 251 1231 A P - 0 0 18 0, 0.0 3,-0.4 0, 0.0 2,-0.1 -0.307 30.1-111.3 -63.6 151.8 17.1 45.8 33.6 252 1232 A D S S+ 0 0 141 1,-0.2 -3,-0.0 -3,-0.1 0, 0.0 -0.481 93.2 14.6 -80.5 155.9 15.3 43.0 35.5 253 1233 A N S S+ 0 0 177 1,-0.2 -1,-0.2 -2,-0.1 0, 0.0 0.913 94.3 128.2 44.8 53.6 13.1 40.4 33.7 254 1234 A C - 0 0 22 -3,-0.4 -1,-0.2 -128,-0.0 5,-0.1 -0.993 64.9-101.6-138.8 129.2 14.5 41.3 30.3 255 1235 A P >> - 0 0 52 0, 0.0 4,-2.6 0, 0.0 3,-0.7 -0.079 24.1-120.0 -52.6 148.8 15.9 38.7 27.9 256 1236 A E H 3> S+ 0 0 152 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.862 114.3 59.8 -57.5 -37.3 19.7 38.2 27.6 257 1237 A R H 3> S+ 0 0 75 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.883 110.7 40.8 -59.7 -39.9 19.4 39.2 23.9 258 1238 A V H <> S+ 0 0 10 -3,-0.7 4,-2.4 2,-0.2 3,-0.5 0.954 116.1 46.4 -74.1 -54.1 18.0 42.6 24.9 259 1239 A T H X S+ 0 0 4 -4,-2.6 4,-2.8 1,-0.3 -2,-0.2 0.853 112.1 53.2 -58.8 -35.5 20.2 43.4 27.8 260 1240 A D H X S+ 0 0 53 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.3 0.817 106.7 52.3 -66.2 -36.2 23.2 42.3 25.7 261 1241 A L H X S+ 0 0 8 -4,-0.9 4,-1.8 -3,-0.5 -2,-0.2 0.926 110.6 47.8 -66.3 -43.0 22.2 44.7 23.0 262 1242 A M H X S+ 0 0 1 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.942 110.3 52.3 -62.1 -45.7 22.0 47.4 25.7 263 1243 A R H < S+ 0 0 73 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.890 106.2 53.8 -58.4 -40.1 25.5 46.4 26.9 264 1244 A M H >< S+ 0 0 67 -4,-2.2 3,-1.5 1,-0.2 -1,-0.2 0.886 106.2 52.8 -61.2 -41.7 26.9 46.6 23.4 265 1245 A C H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.845 108.1 52.5 -61.1 -35.0 25.6 50.2 23.1 266 1246 A W T 3< S+ 0 0 9 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.115 75.6 138.4 -91.0 20.2 27.4 51.0 26.3 267 1247 A Q < - 0 0 82 -3,-1.5 6,-0.1 1,-0.1 -3,-0.1 -0.474 56.1-133.5 -64.1 137.1 30.7 49.7 25.2 268 1248 A F S S+ 0 0 112 -2,-0.2 -69,-0.2 -23,-0.1 -1,-0.1 0.889 92.6 66.0 -61.1 -45.0 33.4 52.1 26.4 269 1249 A N S > S- 0 0 68 1,-0.2 3,-1.8 -71,-0.1 4,-0.3 -0.724 79.1-146.5 -80.8 119.7 35.2 52.2 23.1 270 1250 A P G > S+ 0 0 34 0, 0.0 3,-1.5 0, 0.0 -1,-0.2 0.831 97.8 64.5 -55.6 -33.0 32.9 53.9 20.6 271 1251 A K G 3 S+ 0 0 180 1,-0.3 -3,-0.1 -3,-0.0 -2,-0.0 0.776 96.6 57.0 -62.6 -25.4 34.4 51.6 17.9 272 1252 A M G < S+ 0 0 121 -3,-1.8 -1,-0.3 -5,-0.1 -4,-0.1 0.507 87.5 100.7 -84.4 -3.7 32.9 48.6 19.7 273 1253 A R S < S- 0 0 13 -3,-1.5 -8,-0.2 -4,-0.3 -9,-0.1 -0.520 78.0-108.1 -84.5 150.2 29.4 49.8 19.6 274 1254 A P - 0 0 12 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.147 28.2-121.5 -65.5 169.0 26.8 48.6 17.1 275 1255 A T > - 0 0 67 1,-0.1 4,-1.8 -63,-0.0 5,-0.1 -0.689 29.7-108.4-100.9 167.0 25.7 50.8 14.2 276 1256 A F H > S+ 0 0 2 -2,-0.3 4,-2.1 1,-0.2 -135,-0.2 0.814 120.8 54.9 -67.2 -34.4 21.9 51.6 13.9 277 1257 A L H > S+ 0 0 53 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.907 107.2 50.8 -64.3 -40.8 21.6 49.3 10.9 278 1258 A E H > S+ 0 0 99 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.882 106.6 55.4 -63.5 -37.2 23.1 46.4 12.9 279 1259 A I H X S+ 0 0 0 -4,-1.8 4,-0.9 2,-0.2 -1,-0.2 0.955 110.6 44.3 -60.9 -47.6 20.6 47.1 15.7 280 1260 A V H >X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 3,-1.1 0.924 110.0 54.8 -63.0 -43.3 17.8 46.7 13.2 281 1261 A N H 3< S+ 0 0 75 -4,-2.8 4,-0.4 1,-0.3 3,-0.2 0.934 106.5 54.7 -53.7 -41.8 19.4 43.6 11.7 282 1262 A L H 3< S+ 0 0 86 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.721 119.5 29.6 -65.1 -24.4 19.4 42.2 15.2 283 1263 A L H X< S+ 0 0 12 -3,-1.1 3,-1.9 -4,-0.9 -1,-0.2 0.545 89.7 99.1-114.7 -7.6 15.7 42.7 15.8 284 1264 A K G >< S+ 0 0 61 -4,-2.3 3,-0.9 1,-0.3 -2,-0.1 0.739 72.5 66.6 -51.6 -34.0 14.3 42.4 12.3 285 1265 A D G 3 S+ 0 0 130 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.644 105.7 40.6 -68.3 -14.7 13.2 38.8 12.7 286 1266 A D G < S+ 0 0 91 -3,-1.9 -1,-0.2 -156,-0.1 2,-0.2 -0.222 88.5 113.3-131.2 50.8 10.5 39.6 15.3 287 1267 A L S < S- 0 0 28 -3,-0.9 -159,-0.1 1,-0.1 -156,-0.0 -0.712 75.0 -72.7-117.4 168.6 8.8 42.8 14.2 288 1268 A H > - 0 0 105 -2,-0.2 3,-2.2 1,-0.1 -1,-0.1 -0.252 49.3-114.8 -55.9 139.2 5.3 43.8 13.1 289 1269 A P T 3 S+ 0 0 104 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.735 113.3 62.0 -51.1 -27.7 4.7 42.6 9.5 290 1270 A S T >> S+ 0 0 36 1,-0.2 3,-1.6 2,-0.1 4,-1.1 0.724 79.2 90.5 -71.4 -20.8 4.5 46.2 8.2 291 1271 A F H X> S+ 0 0 2 -3,-2.2 4,-2.5 1,-0.3 3,-1.1 0.858 84.7 48.3 -45.4 -51.8 8.1 46.9 9.2 292 1272 A P H 34 S+ 0 0 69 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.783 107.9 59.0 -61.5 -26.3 9.7 45.8 5.9 293 1273 A E H <4 S+ 0 0 157 -3,-1.6 -2,-0.2 -4,-0.3 -3,-0.1 0.744 121.9 20.2 -72.6 -25.2 7.1 48.0 4.1 294 1274 A V H << S+ 0 0 43 -4,-1.1 -217,-0.6 -3,-1.1 -216,-0.3 0.572 93.2 109.6-123.6 -8.5 8.2 51.2 5.9 295 1275 A S < - 0 0 4 -4,-2.5 4,-0.1 -5,-0.2 -160,-0.1 -0.354 60.0-141.8 -77.1 150.2 11.7 50.8 7.3 296 1276 A F S > S+ 0 0 9 1,-0.2 3,-1.5 2,-0.2 6,-0.4 0.847 103.7 65.2 -67.6 -38.7 14.8 52.5 6.0 297 1277 A F T 3 S+ 0 0 35 1,-0.3 -1,-0.2 4,-0.1 5,-0.1 0.912 107.8 35.8 -49.1 -51.3 16.5 49.1 6.7 298 1278 A H T 3 S+ 0 0 78 -7,-0.2 -1,-0.3 3,-0.0 -2,-0.2 0.290 101.9 109.7 -89.4 11.8 14.5 47.2 4.1 299 1279 A S S X S- 0 0 35 -3,-1.5 3,-1.3 1,-0.1 -3,-0.1 -0.477 80.3-121.9 -90.5 162.2 14.5 50.1 1.7 300 1280 A E T 3 S+ 0 0 172 1,-0.3 -1,-0.1 -2,-0.2 -4,-0.1 0.720 112.5 67.9 -69.0 -16.1 16.2 50.6 -1.6 301 1281 A E T 3 S+ 0 0 104 1,-0.1 2,-1.7 -5,-0.1 -1,-0.3 0.689 73.3 91.5 -76.5 -20.2 17.6 53.7 0.1 302 1282 A N < 0 0 45 -3,-1.3 -1,-0.1 -6,-0.4 -160,-0.0 -0.608 360.0 360.0 -77.3 88.1 19.7 51.6 2.5 303 1283 A K 0 0 229 -2,-1.7 -1,-0.2 -158,-0.0 -2,-0.1 0.474 360.0 360.0-112.0 360.0 22.8 51.5 0.3