==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-DEC-06 2OC3 . COMPND 2 MOLECULE: TYROSINE-PROTEIN PHOSPHATASE NON-RECEPTOR TYPE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.UGOCHUKWU,A.BARR,I.ALFANO,F.GORREC,C.UMEANO,P.SAVITSKY, . 279 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12303.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 15.8 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 . 5 1.8 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 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 0 0 0 0 1 1 0 0 0 1 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 2 1 0 1 0 0 0 0 2 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 0 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 6 A D 0 0 132 0, 0.0 5,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -40.0 -16.6 4.3 43.9 2 7 A S 0 0 26 240,-0.3 4,-2.4 1,-0.3 5,-0.1 0.798 360.0 360.0 -60.2 -26.2 -15.0 7.7 44.1 3 8 A A 0 0 26 2,-0.2 4,-2.2 3,-0.2 -1,-0.3 0.948 360.0 360.0 -61.1 360.0 -11.7 5.8 43.8 4 ! 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 5 10 A S > 0 0 59 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -44.6 -14.1 7.9 39.5 6 11 A F H > + 0 0 11 -4,-2.4 4,-2.1 -5,-0.2 -3,-0.2 0.920 360.0 46.6 -58.5 -43.4 -10.8 9.4 40.3 7 12 A L H 4 S+ 0 0 56 -4,-2.2 -1,-0.2 2,-0.2 -4,-0.1 0.889 107.8 55.5 -68.0 -39.7 -9.2 6.7 38.2 8 13 A E H 4 S+ 0 0 93 1,-0.2 -2,-0.2 -5,-0.2 -1,-0.2 0.926 109.9 47.5 -56.2 -44.5 -11.7 7.4 35.4 9 14 A R H < 0 0 126 -4,-2.5 -2,-0.2 0, 0.0 -1,-0.2 0.889 360.0 360.0 -61.4 -42.5 -10.6 11.1 35.5 10 15 A L < 0 0 92 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.909 360.0 360.0 -82.1 360.0 -6.9 10.0 35.5 11 ! 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 12 24 A A > 0 0 107 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -33.3 2.6 16.3 30.8 13 25 A V H > + 0 0 116 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.940 360.0 44.5 -60.6 -47.0 -0.7 16.7 32.7 14 26 A L H > S+ 0 0 31 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.853 110.2 54.8 -70.5 -33.1 1.2 15.7 35.9 15 27 A A H > S+ 0 0 29 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.942 112.4 43.7 -60.5 -49.2 4.2 18.0 35.0 16 28 A G H X S+ 0 0 32 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.892 112.3 52.7 -61.3 -41.9 1.8 20.9 34.7 17 29 A E H X S+ 0 0 41 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.910 111.0 46.1 -63.2 -45.0 -0.1 20.0 37.8 18 30 A F H X S+ 0 0 7 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.881 109.8 54.4 -65.8 -36.1 3.2 19.8 39.9 19 31 A S H X S+ 0 0 75 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.925 108.7 50.2 -63.8 -36.6 4.2 23.2 38.4 20 32 A D H X S+ 0 0 91 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.878 107.5 52.5 -67.1 -41.4 0.9 24.6 39.6 21 33 A I H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.938 111.0 47.9 -57.2 -43.4 1.5 23.2 43.1 22 34 A Q H X S+ 0 0 86 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.923 113.1 48.1 -65.9 -40.2 4.9 24.9 43.1 23 35 A A H X S+ 0 0 58 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.925 115.0 44.1 -66.7 -43.3 3.4 28.2 41.9 24 36 A C H X S+ 0 0 56 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.887 113.7 49.9 -67.9 -42.8 0.5 28.1 44.4 25 37 A S H X S+ 0 0 4 -4,-2.7 4,-2.4 -5,-0.3 -2,-0.2 0.911 111.9 48.9 -60.2 -44.7 2.8 27.1 47.3 26 38 A A H X S+ 0 0 55 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.907 110.2 51.1 -63.8 -41.7 5.2 29.9 46.4 27 39 A A H X S+ 0 0 53 -4,-2.1 4,-2.3 1,-0.2 5,-0.3 0.908 110.3 50.3 -62.8 -37.3 2.4 32.5 46.2 28 40 A W H X S+ 0 0 44 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.910 106.9 53.1 -69.6 -40.5 1.2 31.4 49.6 29 41 A K H < S+ 0 0 121 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.913 114.7 43.9 -56.2 -39.3 4.7 31.7 51.1 30 42 A A H < S+ 0 0 77 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.853 131.2 17.9 -76.5 -38.4 4.8 35.3 49.8 31 43 A D H < S+ 0 0 144 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.2 0.544 109.4 78.5-114.4 -12.2 1.3 36.4 50.7 32 44 A G S < S- 0 0 31 -4,-2.7 2,-1.3 -5,-0.3 -4,-0.0 -0.217 98.5 -75.3 -90.6-178.4 0.0 34.0 53.3 33 45 A V S S+ 0 0 114 -2,-0.1 2,-0.3 2,-0.0 25,-0.1 -0.691 80.1 137.5 -81.0 98.4 0.6 33.7 57.1 34 46 A C + 0 0 32 -2,-1.3 2,-0.3 -5,-0.2 22,-0.0 -0.951 18.0 151.5-154.6 114.7 4.1 32.1 56.7 35 47 A S - 0 0 41 -2,-0.3 22,-2.8 1,-0.0 23,-0.4 -0.970 34.0-157.8-147.0 163.7 7.3 32.8 58.6 36 48 A T > + 0 0 49 -2,-0.3 4,-0.9 20,-0.2 20,-0.1 -0.201 46.9 132.1-134.5 40.9 10.5 31.2 59.8 37 49 A V H >> S+ 0 0 103 1,-0.2 3,-0.8 2,-0.2 4,-0.5 0.932 72.2 48.1 -63.4 -49.5 11.4 33.4 62.8 38 50 A A H >4 S+ 0 0 11 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.916 109.9 50.9 -64.9 -48.3 12.2 30.6 65.3 39 51 A G H 34 S+ 0 0 0 16,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.696 109.6 51.6 -61.8 -19.1 14.4 28.6 63.0 40 52 A S H << S+ 0 0 64 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.391 78.4 120.6 -97.8 -3.5 16.5 31.7 62.1 41 53 A R S XX S- 0 0 35 -3,-1.3 3,-1.9 -4,-0.5 4,-1.3 -0.394 75.2-119.0 -58.0 139.4 17.2 32.7 65.8 42 54 A P T 34 S+ 0 0 117 0, 0.0 4,-0.5 0, 0.0 3,-0.4 0.862 113.5 53.2 -50.5 -39.7 21.0 32.7 66.4 43 55 A E T 34 S+ 0 0 128 1,-0.2 -2,-0.1 2,-0.1 -4,-0.0 0.627 114.3 42.4 -73.0 -16.1 20.7 30.0 69.1 44 56 A N T X4 S+ 0 0 6 -3,-1.9 3,-1.8 -6,-0.2 -1,-0.2 0.556 85.5 88.9-105.5 -12.2 18.7 27.7 66.7 45 57 A V G >< S+ 0 0 79 -4,-1.3 3,-1.6 -3,-0.4 -2,-0.1 0.892 87.2 54.2 -58.3 -39.1 20.6 28.0 63.4 46 58 A R G 3 S+ 0 0 66 -4,-0.5 -1,-0.3 1,-0.3 52,-0.1 0.568 97.2 67.6 -68.7 -16.1 23.0 25.2 64.2 47 59 A K G < S+ 0 0 36 -3,-1.8 2,-0.5 -8,-0.1 29,-0.4 0.410 83.6 88.1 -85.9 0.2 20.0 22.9 64.9 48 60 A N < - 0 0 19 -3,-1.6 3,-0.1 -4,-0.2 6,-0.1 -0.896 63.7-155.6-101.6 129.0 19.0 22.9 61.2 49 61 A R S S+ 0 0 40 -2,-0.5 2,-0.4 1,-0.2 -1,-0.1 0.843 85.0 32.5 -66.3 -38.4 20.6 20.3 58.9 50 62 A Y S > S- 0 0 53 3,-0.4 3,-1.5 169,-0.1 -1,-0.2 -0.985 71.6-141.1-125.4 134.6 20.1 22.5 55.7 51 63 A K T 3 S+ 0 0 151 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.756 103.5 51.6 -65.3 -25.8 20.2 26.4 55.6 52 64 A D T 3 S+ 0 0 140 1,-0.1 2,-0.5 -4,-0.0 -1,-0.3 0.296 96.1 76.2 -97.2 9.0 17.3 26.5 53.2 53 65 A V < + 0 0 10 -3,-1.5 -3,-0.4 -14,-0.1 -1,-0.1 -0.906 55.3 157.4-123.5 100.3 14.9 24.3 55.2 54 66 A L - 0 0 31 -2,-0.5 2,-0.1 -6,-0.1 22,-0.1 -0.978 43.3-111.9-119.6 140.1 13.4 26.0 58.2 55 67 A P - 0 0 0 0, 0.0 -16,-0.4 0, 0.0 2,-0.2 -0.378 34.9-110.9 -71.3 142.4 10.1 25.0 59.8 56 68 A Y >> - 0 0 15 202,-0.3 3,-1.1 1,-0.2 4,-0.6 -0.508 19.8-135.7 -70.3 135.1 7.2 27.4 59.4 57 69 A D G >4 S+ 0 0 34 -22,-2.8 3,-0.6 1,-0.2 -1,-0.2 0.810 97.4 68.6 -56.5 -33.7 6.4 29.0 62.7 58 70 A Q G 34 S+ 0 0 81 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.722 118.1 16.8 -63.4 -26.5 2.7 28.5 62.2 59 71 A T G <4 S+ 0 0 23 -3,-1.1 20,-2.6 199,-0.1 -1,-0.2 0.161 91.3 140.1-130.6 10.3 2.8 24.7 62.6 60 72 A R E << -A 78 0A 39 -4,-0.6 2,-0.5 -3,-0.6 18,-0.3 -0.248 58.9-108.8 -66.2 151.7 6.2 24.1 64.2 61 73 A V E - 0 0 0 16,-2.0 2,-0.7 14,-0.3 14,-0.5 -0.669 30.6-155.5 -77.4 121.3 6.7 21.5 67.0 62 74 A I E -A 74 0A 78 -2,-0.5 2,-0.3 12,-0.1 12,-0.2 -0.889 9.1-148.6-102.1 113.7 7.2 23.4 70.3 63 75 A L + 0 0 5 10,-2.6 43,-0.1 -2,-0.7 39,-0.0 -0.651 28.7 163.6 -82.8 140.4 9.1 21.2 72.8 64 76 A S > + 0 0 62 -2,-0.3 3,-2.3 41,-0.1 4,-0.3 0.448 38.1 116.0-126.0 -14.9 8.3 21.5 76.5 65 77 A L T 3 S+ 0 0 33 1,-0.3 40,-0.1 2,-0.1 44,-0.0 -0.388 92.1 5.6 -65.2 130.6 9.9 18.3 77.8 66 78 A L T > >S+ 0 0 14 -2,-0.1 5,-1.7 4,-0.1 3,-1.0 0.658 86.0 135.8 70.4 18.1 12.8 19.2 80.1 67 79 A Q G X 5 + 0 0 74 -3,-2.3 3,-2.1 1,-0.2 -2,-0.1 0.901 68.9 58.5 -60.1 -40.0 12.0 22.9 79.8 68 80 A E G 3 5S+ 0 0 118 -4,-0.3 -1,-0.2 1,-0.3 -3,-0.1 0.693 102.8 53.6 -61.1 -22.3 12.5 23.2 83.6 69 81 A E G < 5S- 0 0 83 -3,-1.0 -1,-0.3 2,-0.1 -2,-0.2 0.292 128.6 -98.6 -96.8 8.5 16.0 21.9 83.1 70 82 A G T < 5 + 0 0 66 -3,-2.1 2,-0.2 1,-0.3 -3,-0.2 0.548 68.5 152.4 92.6 10.6 16.7 24.6 80.6 71 83 A H < - 0 0 61 -5,-1.7 -1,-0.3 -7,-0.1 -2,-0.1 -0.557 45.4-111.5 -77.0 141.5 16.2 22.8 77.2 72 84 A S - 0 0 42 -2,-0.2 -1,-0.1 1,-0.1 -5,-0.0 -0.172 10.8-130.8 -64.9 153.3 15.1 24.9 74.3 73 85 A D S S+ 0 0 63 -11,-0.1 -10,-2.6 -9,-0.1 2,-0.4 0.516 72.3 110.9 -79.7 -1.7 11.7 24.6 72.6 74 86 A Y E +A 62 0A 0 -12,-0.2 2,-0.3 -36,-0.1 -12,-0.1 -0.585 28.4 148.7 -95.7 130.6 13.2 24.3 69.2 75 87 A I E - 0 0 9 -14,-0.5 2,-1.7 -2,-0.4 -14,-0.3 -0.979 52.0-112.5-142.8 146.4 13.3 21.4 66.7 76 88 A N E S+ 0 0 1 -29,-0.4 17,-1.7 -2,-0.3 2,-0.3 -0.625 80.3 102.3 -76.1 88.6 13.3 21.5 63.0 77 89 A G E - B 0 92A 0 -2,-1.7 -16,-2.0 15,-0.2 2,-0.3 -0.967 50.5-154.6-167.5 154.7 9.9 19.9 62.6 78 90 A N E -AB 60 91A 0 13,-2.5 13,-2.8 -2,-0.3 2,-0.3 -0.988 21.2-118.6-136.6 145.3 6.2 20.7 61.8 79 91 A F E - B 0 90A 26 -20,-2.6 2,-0.4 -2,-0.3 11,-0.2 -0.626 24.2-158.7 -75.9 146.2 2.9 19.1 62.6 80 92 A I E - B 0 89A 1 9,-2.5 9,-2.1 -2,-0.3 8,-0.8 -0.990 18.1-123.4-126.6 129.9 0.7 18.0 59.7 81 93 A R E - B 0 87A 120 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.483 25.5-146.6 -72.1 143.2 -3.1 17.5 60.1 82 94 A G > - 0 0 5 4,-2.6 3,-2.1 -2,-0.2 -1,-0.1 -0.247 39.1 -74.5-100.0-169.0 -4.7 14.2 59.3 83 95 A V T 3 S+ 0 0 54 1,-0.3 -2,-0.1 2,-0.1 149,-0.0 0.745 131.0 48.9 -65.7 -23.1 -8.0 13.1 57.8 84 96 A D T 3 S- 0 0 121 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.356 118.0-108.4 -96.3 7.0 -9.9 13.9 61.1 85 97 A G S < S+ 0 0 47 -3,-2.1 -2,-0.1 1,-0.3 2,-0.1 0.376 81.4 125.5 82.0 -3.2 -8.2 17.4 61.4 86 98 A S S S- 0 0 39 1,-0.1 -4,-2.6 -5,-0.1 2,-1.5 -0.292 81.3 -88.6 -78.8 167.1 -6.1 16.2 64.4 87 99 A L E +B 81 0A 88 -6,-0.2 -6,-0.2 1,-0.2 -1,-0.1 -0.648 61.1 162.0 -80.0 89.0 -2.3 16.5 64.5 88 100 A A E + 0 0 15 -2,-1.5 125,-2.3 -8,-0.8 2,-0.4 0.671 52.4 35.0 -91.9 -22.4 -1.7 13.2 62.8 89 101 A Y E -Bc 80 213A 2 -9,-2.1 -9,-2.5 123,-0.3 2,-0.5 -0.984 53.6-155.6-132.8 148.3 2.0 13.5 61.7 90 102 A I E -Bc 79 214A 0 123,-2.8 125,-3.1 -2,-0.4 2,-0.6 -0.993 18.4-163.5-115.8 117.0 5.1 15.1 62.9 91 103 A A E +Bc 78 215A 0 -13,-2.8 -13,-2.5 -2,-0.5 2,-0.3 -0.914 24.6 157.1-100.4 118.4 7.4 15.8 59.8 92 104 A T E -Bc 77 216A 1 123,-2.2 125,-0.8 -2,-0.6 -15,-0.2 -0.846 39.0 -97.5-139.2 170.7 10.9 16.4 61.0 93 105 A Q - 0 0 4 -17,-1.7 126,-0.2 -2,-0.3 125,-0.2 -0.448 48.5 -88.2 -84.4 167.3 14.6 16.3 59.7 94 106 A G - 0 0 0 124,-2.3 -1,-0.1 34,-0.3 -45,-0.1 -0.601 60.8-106.8 -70.6 125.4 17.1 13.5 60.3 95 107 A P - 0 0 2 0, 0.0 35,-2.6 0, 0.0 -1,-0.1 -0.168 26.6-137.3 -62.8 151.0 18.7 14.4 63.6 96 108 A L >> - 0 0 21 33,-0.2 3,-1.9 -49,-0.1 4,-1.0 -0.527 35.6 -95.7 -92.8 168.7 22.2 15.8 63.9 97 109 A P G >4 S+ 0 0 79 0, 0.0 3,-0.7 0, 0.0 4,-0.3 0.924 128.6 43.3 -53.1 -41.0 24.7 14.7 66.5 98 110 A H G 34 S+ 0 0 111 1,-0.2 4,-0.1 -52,-0.1 -51,-0.0 0.380 113.8 50.6 -88.2 2.9 23.7 17.7 68.7 99 111 A T G <> S+ 0 0 6 -3,-1.9 4,-2.4 2,-0.1 -1,-0.2 0.339 77.9 98.3-116.2 8.0 19.9 17.3 68.0 100 112 A L H S+ 0 0 37 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.913 109.7 50.8 -62.0 -42.5 18.4 14.5 72.4 102 114 A D H > S+ 0 0 14 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.892 105.8 55.7 -63.8 -39.1 15.8 16.8 70.9 103 115 A F H X S+ 0 0 2 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.942 110.3 45.1 -56.5 -46.3 14.6 14.1 68.5 104 116 A W H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.885 108.6 56.1 -70.5 -33.5 13.9 11.8 71.5 105 117 A R H X S+ 0 0 1 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.922 109.6 48.1 -58.1 -41.1 12.3 14.7 73.5 106 118 A L H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 6,-0.3 0.968 113.0 46.1 -61.1 -53.7 9.9 15.0 70.5 107 119 A V H <>S+ 0 0 3 -4,-2.4 5,-1.8 1,-0.2 4,-0.4 0.919 119.3 41.4 -59.1 -44.2 9.2 11.3 70.3 108 120 A W H ><5S+ 0 0 20 -4,-3.0 3,-1.3 3,-0.2 -1,-0.2 0.953 112.1 52.1 -69.5 -49.9 8.6 11.0 74.1 109 121 A E H 3<5S+ 0 0 54 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.895 115.5 40.3 -57.9 -41.8 6.6 14.2 74.6 110 122 A F T 3<5S- 0 0 49 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.393 109.3-118.8 -93.5 6.2 4.1 13.5 72.0 111 123 A G T < 5 - 0 0 21 -3,-1.3 -3,-0.2 -4,-0.4 100,-0.1 0.784 40.9-171.4 66.8 26.7 3.8 9.7 72.8 112 124 A V < + 0 0 4 -5,-1.8 -1,-0.2 -6,-0.3 101,-0.1 -0.273 18.1 179.1 -54.5 133.0 5.0 8.6 69.4 113 125 A K + 0 0 47 99,-0.4 63,-2.6 1,-0.3 2,-0.4 0.637 67.6 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48.4 253 265 A L H X S+ 0 0 22 -4,-2.7 4,-0.8 -5,-0.2 -1,-0.2 0.929 109.9 49.7 -59.1 -44.8 -0.9 21.8 48.3 254 266 A K H >< S+ 0 0 84 -4,-2.2 3,-0.7 -5,-0.2 -1,-0.2 0.900 109.3 51.8 -59.7 -39.6 -2.3 21.6 51.9 255 267 A M H >X S+ 0 0 5 -4,-2.0 4,-2.3 1,-0.2 3,-2.0 0.892 103.6 58.8 -60.0 -44.3 0.7 19.6 53.0 256 268 A R H 3< S+ 0 0 18 -4,-2.5 5,-0.3 1,-0.3 -1,-0.2 0.707 99.8 57.3 -60.1 -23.4 3.1 22.3 51.6 257 269 A K T << S+ 0 0 79 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.409 113.9 39.8 -85.9 -1.1 1.4 24.9 53.8 258 270 A Q T <4 S+ 0 0 8 -3,-2.0 -202,-0.3 1,-0.4 -2,-0.2 0.683 125.0 24.3-117.7 -35.5 2.4 22.9 56.9 259 271 A R S >< S- 0 0 1 -4,-2.3 3,-1.6 -204,-0.1 -1,-0.4 -0.999 92.6-105.3-132.0 127.2 5.9 21.5 56.2 260 272 A P T 3 S- 0 0 13 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.261 97.5 -2.3 -53.0 135.3 8.2 23.3 53.7 261 273 A A T 3 S- 0 0 26 -5,-0.3 2,-0.3 1,-0.2 -36,-0.2 0.663 78.0-179.0 58.2 26.1 8.6 21.5 50.4 262 274 A A S < S+ 0 0 0 -3,-1.6 -40,-0.2 -7,-0.2 -1,-0.2 -0.425 78.0 15.1 -58.6 119.5 6.4 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X S+ 0 0 31 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.924 110.2 50.0 -54.8 -44.7 0.2 9.4 41.7 274 286 A H H X S+ 0 0 100 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.911 112.0 48.6 -60.2 -44.3 1.3 5.9 40.9 275 287 A T H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.916 112.7 46.3 -64.0 -46.1 1.0 4.8 44.5 276 288 A V H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.918 111.0 52.2 -67.0 -42.9 -2.5 6.3 44.9 277 289 A A H X S+ 0 0 34 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.912 110.5 49.7 -57.0 -43.1 -3.7 4.7 41.6 278 290 A Q H >< S+ 0 0 64 -4,-2.2 3,-0.8 1,-0.2 -2,-0.2 0.910 110.2 49.1 -64.8 -42.9 -2.4 1.3 42.8 279 291 A M H 3< S+ 0 0 25 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.875 111.0 50.0 -61.4 -37.1 -4.3 1.7 46.1 280 292 A F H 3< 0 0 17 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.590 360.0 360.0 -78.9 -9.7 -7.4 2.6 44.2 281 293 A C << 0 0 138 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.1 -0.409 360.0 360.0 68.6 360.0 -6.8 -0.5 42.1