==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 16-MAR-12 4E77 . COMPND 2 MOLECULE: GLUTAMATE-1-SEMIALDEHYDE 2,1-AMINOMUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS; . AUTHOR J.S.BRUNZELLE,W.WAWRZAK,O.ONOPRIYENKO,W.F.ANDERSON,A.SAVCHEN . 406 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18286.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 278 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 1 0.2 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 . 20 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 1 0 0 0 0 1 1 2 2 1 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 1 3 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 . 2 1 1 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 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 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 X 0 0 114 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 120.4 31.0 -23.7 83.2 2 2 A S > - 0 0 37 1,-0.1 4,-1.9 4,-0.0 5,-0.1 -0.213 360.0-101.2 -76.1 173.4 29.5 -20.3 82.1 3 3 A K H > S+ 0 0 107 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.850 125.0 53.3 -67.9 -33.8 28.9 -19.3 78.4 4 4 A S H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.904 108.0 49.0 -64.0 -43.7 32.1 -17.1 78.7 5 5 A E H > S+ 0 0 81 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.892 112.7 48.4 -62.2 -40.3 34.2 -20.1 79.9 6 6 A N H X S+ 0 0 87 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.909 112.1 48.1 -66.9 -43.8 32.8 -22.2 76.9 7 7 A L H X S+ 0 0 45 -4,-2.4 4,-3.2 1,-0.2 -2,-0.2 0.910 111.1 51.7 -64.2 -39.3 33.5 -19.5 74.4 8 8 A Y H X S+ 0 0 37 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.907 110.5 47.3 -63.8 -43.1 37.1 -19.2 75.8 9 9 A A H X S+ 0 0 52 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.928 115.6 46.3 -61.5 -45.8 37.7 -23.0 75.5 10 10 A Q H >X S+ 0 0 131 -4,-2.4 3,-1.0 1,-0.2 4,-0.6 0.921 112.3 50.7 -58.7 -50.6 36.3 -22.9 71.9 11 11 A A H >X S+ 0 0 14 -4,-3.2 4,-2.5 1,-0.2 3,-1.0 0.841 101.1 62.8 -59.1 -38.5 38.4 -19.8 71.1 12 12 A Q H 3< S+ 0 0 95 -4,-2.1 5,-0.3 1,-0.2 -1,-0.2 0.725 96.4 59.3 -63.6 -25.1 41.7 -21.4 72.4 13 13 A Q H << S+ 0 0 166 -3,-1.0 -1,-0.2 -4,-0.7 -2,-0.2 0.789 123.3 18.9 -71.4 -30.9 41.5 -24.2 69.7 14 14 A L H << S+ 0 0 157 -3,-1.0 -2,-0.2 -4,-0.6 -1,-0.1 0.531 121.0 55.1-117.0 -17.8 41.6 -21.6 66.8 15 15 A I S >< S- 0 0 52 -4,-2.5 3,-2.6 -5,-0.1 -1,-0.2 -0.996 90.6-109.4-122.3 124.8 43.0 -18.4 68.2 16 16 A P G > S+ 0 0 121 0, 0.0 3,-0.9 0, 0.0 -3,-0.1 -0.369 106.3 0.4 -56.8 122.8 46.4 -18.3 70.1 17 17 A G G 3 S- 0 0 44 -5,-0.3 -5,-0.2 1,-0.2 -4,-0.1 0.501 116.7 -88.4 75.6 4.5 45.6 -17.7 73.8 18 18 A G G < S+ 0 0 3 -3,-2.6 2,-0.3 -7,-0.4 -1,-0.2 0.451 105.3 81.6 74.8 2.5 41.8 -17.6 73.0 19 19 A V < - 0 0 24 -3,-0.9 -1,-0.1 1,-0.1 6,-0.1 -0.974 67.4-143.8-138.1 154.9 41.9 -13.8 72.2 20 20 A N S S+ 0 0 146 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.820 98.2 48.4 -82.5 -34.2 42.8 -11.5 69.3 21 21 A S S > S- 0 0 44 1,-0.1 3,-1.7 0, 0.0 4,-0.3 -0.940 80.3-144.1-110.8 111.8 44.2 -8.8 71.6 22 22 A P G > >S+ 0 0 98 0, 0.0 3,-1.1 0, 0.0 5,-0.7 0.718 99.9 57.6 -47.8 -30.9 46.7 -10.2 74.3 23 23 A V G > 5S+ 0 0 39 1,-0.2 3,-1.6 2,-0.2 5,-0.3 0.862 99.0 60.7 -67.8 -32.9 45.4 -7.7 77.0 24 24 A R G < 5S+ 0 0 146 -3,-1.7 -1,-0.2 1,-0.3 -4,-0.1 0.481 86.9 75.5 -71.7 -3.6 41.9 -9.1 76.5 25 25 A A G < 5S- 0 0 14 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.443 108.8-122.2 -83.8 -3.9 43.3 -12.6 77.6 26 26 A F T <>5 + 0 0 3 -3,-1.6 4,-4.4 6,-0.1 -2,-0.1 0.750 66.5 143.8 65.7 28.7 43.3 -11.2 81.2 27 27 A T T 4< + 0 0 101 -5,-0.7 -4,-0.1 1,-0.2 -3,-0.1 0.868 69.1 54.9 -62.9 -37.7 47.1 -11.8 81.4 28 28 A G T 4 S+ 0 0 24 -5,-0.3 -1,-0.2 349,-0.3 351,-0.1 0.835 126.4 19.2 -62.5 -38.3 47.4 -8.7 83.5 29 29 A V T 4 S- 0 0 6 348,-0.3 -2,-0.2 -3,-0.1 -1,-0.2 0.639 102.9-130.3-108.4 -19.4 44.8 -9.9 86.0 30 30 A G < + 0 0 31 -4,-4.4 -1,-0.1 1,-0.2 -2,-0.1 -0.073 59.2 75.6 86.6 168.4 44.6 -13.7 85.6 31 31 A G S S- 0 0 59 -4,-0.1 -1,-0.2 2,-0.0 -2,-0.1 -0.238 90.5 -42.9 84.9-178.3 41.5 -15.9 85.2 32 32 A I - 0 0 74 1,-0.1 -6,-0.1 -2,-0.1 -27,-0.1 -0.758 65.2-114.7 -89.7 128.8 39.2 -16.4 82.2 33 33 A P - 0 0 6 0, 0.0 2,-0.5 0, 0.0 -25,-0.2 -0.165 26.4-110.8 -63.1 157.2 38.2 -13.3 80.2 34 34 A L - 0 0 31 -10,-0.1 2,-0.4 -26,-0.0 -8,-0.1 -0.798 24.4-144.6 -87.7 125.7 34.6 -12.0 80.1 35 35 A F - 0 0 53 -2,-0.5 12,-2.1 2,-0.0 2,-0.5 -0.777 18.5-139.2 -89.6 133.6 32.9 -12.4 76.7 36 36 A I E -A 46 0A 68 -2,-0.4 10,-0.3 10,-0.3 3,-0.1 -0.848 23.2-177.4-105.3 122.0 30.5 -9.4 76.0 37 37 A E E - 0 0 120 8,-1.7 2,-0.3 -2,-0.5 9,-0.2 0.885 68.3 -26.8 -71.6 -45.7 27.1 -9.8 74.4 38 38 A R E -A 45 0A 122 7,-1.6 7,-2.7 2,-0.0 2,-0.3 -0.963 51.7-141.0-163.7 171.3 26.1 -6.1 74.2 39 39 A A E +A 44 0A 25 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.994 12.6 179.6-148.3 146.1 26.5 -2.6 75.8 40 40 A D E > -A 43 0A 71 3,-2.3 3,-2.2 -2,-0.3 27,-0.2 -0.928 58.2 -43.9-153.9 122.5 24.2 0.3 76.6 41 41 A G B 3 S-D 66 0B 18 25,-2.7 25,-3.1 -2,-0.3 348,-0.2 -0.361 126.9 -9.6 59.8-120.7 25.0 3.6 78.3 42 42 A A T 3 S+ 0 0 1 346,-0.4 12,-2.9 23,-0.2 2,-0.3 0.408 121.2 90.5 -86.9 1.9 27.3 3.1 81.3 43 43 A Y E < -AB 40 53A 83 -3,-2.2 -3,-2.3 10,-0.2 2,-0.3 -0.823 53.6-161.0-115.0 147.9 26.8 -0.7 81.2 44 44 A L E -AB 39 52A 14 8,-2.3 8,-2.4 -2,-0.3 2,-0.5 -0.882 14.8-155.1-105.4 142.0 28.5 -3.9 79.7 45 45 A F E -AB 38 51A 32 -7,-2.7 -8,-1.7 -2,-0.3 -7,-1.6 -0.980 11.0-146.0-122.4 116.3 26.4 -7.1 79.5 46 46 A D E > -A 36 0A 1 4,-2.5 3,-2.3 -2,-0.5 -10,-0.3 -0.245 33.8 -96.5 -75.8 171.1 28.4 -10.3 79.3 47 47 A V T 3 S+ 0 0 21 -12,-2.1 -11,-0.1 1,-0.3 -1,-0.1 0.597 126.8 57.0 -62.8 -15.1 27.2 -13.5 77.4 48 48 A D T 3 S- 0 0 70 -13,-0.3 -1,-0.3 2,-0.1 -12,-0.1 0.375 122.3-108.9 -95.5 2.5 25.7 -14.9 80.6 49 49 A G < + 0 0 49 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.404 67.4 149.9 84.7 3.0 23.6 -11.7 80.8 50 50 A K - 0 0 110 -5,-0.1 -4,-2.5 1,-0.1 2,-0.3 -0.476 39.5-136.5 -70.4 133.0 25.4 -10.1 83.9 51 51 A A E -B 45 0A 57 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.706 20.9-172.1 -93.0 140.5 25.5 -6.3 83.9 52 52 A Y E -B 44 0A 7 -8,-2.4 -8,-2.3 -2,-0.3 2,-0.5 -0.999 29.6-123.3-134.6 137.6 28.6 -4.3 84.8 53 53 A I E -Bc 43 373A 15 319,-2.6 321,-3.2 -2,-0.4 2,-0.4 -0.685 43.8-137.9 -74.9 120.1 29.3 -0.6 85.4 54 54 A D E + c 0 374A 4 -12,-2.9 332,-0.2 -2,-0.5 321,-0.2 -0.745 40.3 165.2 -94.1 129.2 31.9 0.0 82.7 55 55 A Y S S+ 0 0 0 319,-2.8 329,-2.4 -2,-0.4 321,-0.3 0.023 73.6 71.2-124.7 22.8 35.1 2.1 83.1 56 56 A V S >> S- 0 0 8 318,-0.2 3,-1.8 327,-0.2 4,-0.8 0.738 72.2-164.6-103.1 -36.2 36.9 0.8 80.0 57 57 A G G >4>S- 0 0 4 1,-0.3 5,-2.1 2,-0.2 3,-0.8 0.838 73.6 -61.3 51.4 38.3 34.6 2.6 77.5 58 58 A S G 345S- 0 0 52 1,-0.2 -1,-0.3 2,-0.2 195,-0.0 0.733 104.0 -51.6 57.5 31.6 36.0 0.3 74.7 59 59 A W G <45S- 0 0 40 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.715 114.3 -41.4 74.4 30.3 39.4 1.9 75.5 60 60 A G T <<5S+ 0 0 1 -4,-0.8 3,-0.2 -3,-0.8 -2,-0.2 0.090 112.0 99.7 110.6 -17.2 38.2 5.5 75.2 61 61 A P T 5 + 0 0 14 0, 0.0 2,-2.1 0, 0.0 3,-0.3 0.847 67.8 77.1 -64.3 -37.1 35.9 5.8 72.2 62 62 A X > < + 0 0 32 -5,-2.1 3,-1.2 1,-0.2 325,-0.1 -0.342 46.8 144.3 -81.6 63.9 32.6 5.7 74.3 63 63 A I T 3 S+ 0 0 0 -2,-2.1 324,-2.9 1,-0.3 -1,-0.2 0.839 78.8 44.4 -63.7 -36.3 32.6 9.2 75.6 64 64 A L T 3 S- 0 0 17 1,-0.4 -1,-0.3 -3,-0.3 322,-0.1 0.254 125.2-103.5 -91.3 7.9 28.8 9.3 75.4 65 65 A G X - 0 0 2 -3,-1.2 3,-0.6 320,-0.1 -1,-0.4 -0.227 58.6 -42.1 88.2 177.5 28.5 5.9 76.8 66 66 A H B 3 S+D 41 0B 9 -25,-3.1 -25,-2.7 1,-0.2 -23,-0.1 -0.477 120.0 5.4 -80.0 148.9 27.8 2.7 74.8 67 67 A N T 3 S- 0 0 71 -27,-0.2 -1,-0.2 1,-0.2 186,-0.1 0.828 77.7-167.5 51.9 45.4 25.2 2.6 72.0 68 68 A H <> - 0 0 45 -3,-0.6 4,-2.7 1,-0.1 3,-0.3 -0.446 22.2-130.7 -62.5 134.5 24.4 6.3 72.1 69 69 A P H > S+ 0 0 69 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.858 104.4 53.0 -59.2 -39.3 21.1 6.9 70.0 70 70 A A H > S+ 0 0 27 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.883 114.4 42.4 -63.1 -39.5 22.6 9.8 67.9 71 71 A I H > S+ 0 0 20 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.941 115.1 49.4 -70.6 -48.2 25.6 7.7 66.9 72 72 A R H X S+ 0 0 101 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.911 112.6 48.8 -57.5 -43.5 23.5 4.5 66.3 73 73 A Q H X S+ 0 0 119 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.892 109.8 50.9 -63.8 -44.9 21.0 6.6 64.1 74 74 A A H X S+ 0 0 25 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.867 113.6 44.9 -61.9 -38.8 23.8 8.2 62.0 75 75 A V H X S+ 0 0 25 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.903 110.9 51.5 -75.3 -41.9 25.4 4.8 61.3 76 76 A I H X S+ 0 0 99 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.938 114.3 46.0 -59.9 -41.8 22.1 3.0 60.4 77 77 A E H < S+ 0 0 106 -4,-2.3 3,-0.4 1,-0.2 4,-0.3 0.883 114.5 46.7 -65.8 -41.9 21.3 5.9 58.0 78 78 A A H >< S+ 0 0 8 -4,-1.8 3,-1.4 1,-0.2 -1,-0.2 0.833 103.0 63.0 -69.9 -35.5 24.9 5.8 56.5 79 79 A V H >< S+ 0 0 65 -4,-2.4 3,-1.5 1,-0.3 -1,-0.2 0.806 92.2 65.7 -60.8 -30.8 24.9 2.0 56.1 80 80 A E T 3< S+ 0 0 163 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.722 99.3 53.1 -63.0 -24.8 21.9 2.3 53.6 81 81 A R T < S- 0 0 169 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.444 127.5 -84.3 -91.1 -2.7 24.3 4.1 51.2 82 82 A G < - 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0 0 11 -2,-0.7 -319,-0.1 -10,-0.2 8,-0.1 -0.623 48.6 -77.5-100.2 163.1 37.7 -1.9 85.2 376 394 A A - 0 0 7 -321,-0.3 2,-1.4 -2,-0.2 5,-0.1 -0.407 45.7-128.6 -61.1 132.8 40.6 -2.0 82.8 377 395 A P S S+ 0 0 2 0, 0.0 -348,-0.3 0, 0.0 -349,-0.3 -0.233 80.5 72.0 -84.8 51.4 42.1 -5.4 83.4 378 396 A S S > S- 0 0 15 -2,-1.4 3,-0.9 3,-0.2 -2,-0.1 -0.966 71.7-138.0-157.2 147.9 45.6 -4.1 83.8 379 397 A A T 3 S+ 0 0 16 -2,-0.3 -1,-0.0 1,-0.2 -23,-0.0 0.613 107.8 56.7 -74.9 -14.7 47.6 -2.0 86.4 380 398 A F T 3 S+ 0 0 68 -186,-0.1 -186,-1.4 -188,-0.1 2,-0.4 0.023 91.3 87.8-110.1 26.3 49.1 -0.1 83.4 381 399 A E S < S- 0 0 42 -3,-0.9 -186,-0.3 -188,-0.3 -189,-0.2 -0.966 70.7-125.5-129.0 143.1 45.8 1.1 81.9 382 400 A A - 0 0 0 -191,-1.1 2,-0.3 -2,-0.4 -44,-0.2 -0.339 23.3-120.0 -79.9 162.0 43.8 4.3 82.6 383 401 A G E -O 337 0G 8 -46,-3.6 -46,-2.4 -8,-0.1 2,-0.4 -0.752 22.3-143.6-100.8 153.3 40.1 4.3 83.5 384 402 A F E -O 336 0G 3 -329,-2.4 2,-0.3 -2,-0.3 -48,-0.2 -0.974 4.1-154.0-127.7 132.3 37.5 6.1 81.4 385 403 A X - 0 0 0 -50,-2.4 2,-0.3 -2,-0.4 -320,-0.1 -0.781 14.3-155.1 -96.8 144.2 34.3 8.0 82.5 386 404 A S > - 0 0 6 -2,-0.3 3,-1.2 -332,-0.2 -322,-0.2 -0.838 26.5-123.3-118.8 159.2 31.3 8.3 80.2 387 405 A L T 3 S+ 0 0 39 -324,-2.9 -323,-0.2 -2,-0.3 -345,-0.1 0.609 110.2 65.0 -72.6 -9.8 28.6 10.9 80.0 388 406 A A T 3 S+ 0 0 39 -325,-0.2 -346,-0.4 -347,-0.1 -1,-0.2 0.649 76.4 105.4 -88.0 -12.4 26.0 8.1 80.4 389 407 A H < - 0 0 7 -3,-1.2 2,-0.2 -348,-0.2 -80,-0.1 -0.452 62.4-149.2 -67.3 130.7 27.3 7.3 84.0 390 408 A S > - 0 0 48 -2,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.603 27.4-108.3 -95.1 164.4 24.8 8.6 86.6 391 409 A N H > S+ 0 0 120 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.884 124.7 55.2 -56.4 -37.4 25.5 9.9 90.2 392 410 A E H > S+ 0 0 138 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.889 105.7 50.9 -62.5 -41.3 23.9 6.6 91.3 393 411 A D H > S+ 0 0 5 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.914 112.2 47.4 -61.9 -43.5 26.4 4.6 89.2 394 412 A I H X S+ 0 0 6 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.931 112.8 46.7 -64.7 -48.1 29.3 6.5 90.7 395 413 A Q H X S+ 0 0 105 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.912 112.6 51.5 -65.2 -36.9 28.0 6.0 94.3 396 414 A K H X S+ 0 0 113 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.882 111.6 47.7 -61.2 -41.8 27.4 2.3 93.6 397 415 A T H X S+ 0 0 3 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.909 112.1 48.3 -64.7 -46.9 31.0 2.0 92.3 398 416 A V H X S+ 0 0 12 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.905 113.2 48.6 -61.9 -40.6 32.4 3.9 95.4 399 417 A N H X S+ 0 0 70 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.885 112.7 47.8 -66.8 -40.9 30.4 1.6 97.7 400 418 A A H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.917 111.2 50.6 -64.2 -44.4 31.6 -1.5 95.8 401 419 A A H X S+ 0 0 0 -4,-2.9 4,-3.1 1,-0.2 -2,-0.2 0.893 108.1 53.3 -62.2 -39.4 35.3 -0.3 96.0 402 420 A R H X S+ 0 0 98 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.909 110.1 47.1 -60.7 -44.2 34.9 0.3 99.8 403 421 A R H < S+ 0 0 117 -4,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.871 114.8 47.3 -64.1 -37.2 33.7 -3.3 100.2 404 422 A C H >< S+ 0 0 1 -4,-2.2 3,-1.1 1,-0.2 4,-0.4 0.895 109.3 52.6 -70.6 -42.8 36.6 -4.5 98.0 405 423 A F H >< S+ 0 0 2 -4,-3.1 3,-1.1 1,-0.2 -2,-0.2 0.854 103.5 58.8 -59.5 -36.2 39.2 -2.3 99.9 406 424 A A T 3< S+ 0 0 58 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.714 106.8 49.0 -64.8 -20.7 37.9 -3.9 103.2 407 425 A K T < 0 0 104 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.418 360.0 360.0 -99.4 -2.5 38.9 -7.4 101.7 408 426 A L < 0 0 61 -3,-1.1 -2,-0.1 -4,-0.4 -1,-0.1 0.764 360.0 360.0 -83.4 360.0 42.5 -6.5 100.6