==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-OCT-06 2NQO . COMPND 2 MOLECULE: GAMMA-GLUTAMYLTRANSPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI; . AUTHOR G.BOANCA,A.SAND,T.OKADA,H.SUZUKI,H.KUMAGAI,K.FUKUYAMA,J.J.BA . 1068 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38490.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 714 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 152 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 0.9 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 . 56 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 132 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 306 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 0.8 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 7 2 5 1 1 4 3 0 6 5 1 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 10 4 4 5 3 5 3 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 2 0 0 2 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 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 29 A Y 0 0 68 0, 0.0 467,-0.1 0, 0.0 1069,-0.1 0.000 360.0 360.0 360.0 -47.7 37.5 -3.9 -34.6 2 30 A P - 0 0 104 0, 0.0 3,-0.1 0, 0.0 1068,-0.0 -0.115 360.0-125.5 -43.1 119.0 34.5 -6.3 -34.6 3 31 A P - 0 0 33 0, 0.0 526,-0.2 0, 0.0 459,-0.0 -0.193 30.9 -89.2 -64.7 159.5 33.9 -7.3 -30.9 4 32 A I E -A 528 0A 71 524,-2.6 524,-2.1 1,-0.0 2,-0.4 -0.353 52.3-151.7 -64.9 154.2 33.8 -11.0 -29.9 5 33 A K E +A 527 0A 79 522,-0.2 2,-0.3 -3,-0.1 522,-0.2 -0.990 26.8 159.5-140.1 144.6 30.3 -12.4 -30.1 6 34 A N E +A 526 0A 30 520,-1.8 520,-3.3 -2,-0.4 5,-0.1 -0.937 13.1 175.3-160.6 135.3 28.1 -15.0 -28.5 7 35 A T S S+ 0 0 78 -2,-0.3 517,-0.3 518,-0.2 -1,-0.1 0.205 77.8 49.7-126.2 12.0 24.4 -15.5 -28.3 8 36 A K S S+ 0 0 158 2,-0.2 516,-0.1 518,-0.1 -2,-0.1 0.730 121.1 2.9-113.5 -78.6 24.3 -18.9 -26.5 9 37 A V S S- 0 0 21 1,-0.3 348,-0.6 347,-0.1 2,-0.2 0.504 95.6-121.1 -96.2 -6.0 26.4 -19.4 -23.4 10 38 A G E -G 356 0B 0 346,-0.2 2,-0.3 514,-0.1 -1,-0.3 -0.591 35.8 -60.3 101.0-165.0 27.9 -16.0 -22.9 11 39 A L E -G 355 0B 3 344,-1.5 344,-2.2 -2,-0.2 2,-0.4 -0.955 25.9-170.7-131.4 147.8 31.5 -14.8 -22.7 12 40 A A E +G 354 0B 1 -2,-0.3 2,-0.4 342,-0.2 12,-0.3 -0.910 22.4 179.7-135.1 101.8 34.6 -15.5 -20.5 13 41 A L E +G 353 0B 8 340,-2.6 340,-1.9 -2,-0.4 2,-0.2 -0.910 10.2 152.9-115.2 133.3 37.4 -13.1 -21.3 14 42 A S - 0 0 2 -2,-0.4 338,-0.1 338,-0.2 500,-0.1 -0.766 55.9 -95.9-138.5-177.5 40.9 -12.8 -19.8 15 43 A S S S+ 0 0 31 -2,-0.2 337,-0.1 336,-0.1 -2,-0.0 0.393 104.2 65.1 -87.4 3.4 44.3 -11.6 -20.9 16 44 A H S > S- 0 0 21 1,-0.1 4,-2.6 32,-0.0 3,-0.3 -0.982 72.3-143.1-132.7 125.3 45.5 -15.1 -21.9 17 45 A P H > S+ 0 0 98 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.860 102.2 50.3 -46.4 -50.2 44.0 -17.3 -24.7 18 46 A L H > S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.903 113.7 45.5 -60.7 -41.9 44.4 -20.6 -22.8 19 47 A A H > S+ 0 0 0 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.889 113.8 48.3 -69.7 -40.1 42.7 -19.2 -19.7 20 48 A S H X S+ 0 0 19 -4,-2.6 4,-3.1 2,-0.2 -2,-0.2 0.932 112.0 49.6 -65.4 -45.4 39.9 -17.6 -21.7 21 49 A E H X S+ 0 0 124 -4,-2.8 4,-3.0 -5,-0.2 5,-0.2 0.917 109.2 53.1 -58.4 -44.8 39.3 -20.8 -23.7 22 50 A I H X S+ 0 0 20 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.916 112.7 43.6 -57.6 -44.9 39.2 -22.7 -20.4 23 51 A G H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 3,-0.3 0.912 112.7 51.8 -67.7 -42.0 36.6 -20.4 -19.1 24 52 A Q H X S+ 0 0 31 -4,-3.1 4,-2.5 -12,-0.3 3,-0.4 0.923 106.2 54.5 -60.1 -45.1 34.6 -20.4 -22.3 25 53 A K H X S+ 0 0 114 -4,-3.0 4,-2.3 1,-0.3 -1,-0.2 0.824 103.7 56.2 -59.7 -31.3 34.6 -24.2 -22.3 26 54 A V H <>S+ 0 0 8 -4,-1.1 5,-2.7 -3,-0.3 -1,-0.3 0.880 108.6 47.3 -68.1 -36.3 33.1 -24.2 -18.9 27 55 A L H ><5S+ 0 0 2 -4,-1.5 3,-1.1 -3,-0.4 -2,-0.2 0.901 112.1 49.4 -69.3 -41.4 30.3 -22.0 -20.2 28 56 A E H 3<5S+ 0 0 125 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.862 108.9 53.9 -65.2 -36.4 29.8 -24.4 -23.2 29 57 A E T 3<5S- 0 0 130 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.450 127.7 -93.9 -79.4 -1.6 29.8 -27.4 -20.8 30 58 A G T < 5S+ 0 0 30 -3,-1.1 -3,-0.2 1,-0.3 -2,-0.1 0.389 78.1 133.6 109.5 -6.2 27.0 -25.9 -18.7 31 59 A G < - 0 0 0 -5,-2.7 -1,-0.3 -6,-0.2 2,-0.1 -0.277 50.1-120.0 -74.2 165.9 28.7 -24.1 -15.8 32 60 A N > - 0 0 13 324,-0.1 4,-2.2 90,-0.1 5,-0.2 -0.306 38.6 -82.7 -95.7-175.1 27.6 -20.5 -14.8 33 61 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.854 128.9 50.3 -56.9 -37.9 29.6 -17.3 -14.7 34 62 A I H > S+ 0 0 1 88,-0.3 4,-2.7 2,-0.2 5,-0.3 0.943 107.5 51.6 -67.8 -47.7 31.1 -18.2 -11.3 35 63 A D H > S+ 0 0 0 1,-0.2 4,-2.2 87,-0.2 -2,-0.2 0.937 114.1 45.7 -52.9 -47.9 32.2 -21.7 -12.3 36 64 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.901 110.5 53.0 -63.0 -42.3 33.9 -20.1 -15.3 37 65 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.886 110.5 47.0 -61.7 -40.4 35.5 -17.4 -13.2 38 66 A V H X S+ 0 0 0 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.896 111.4 51.5 -68.7 -39.6 37.0 -19.9 -10.7 39 67 A A H X S+ 0 0 2 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.896 112.4 46.4 -63.5 -40.2 38.3 -22.0 -13.6 40 68 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.892 105.2 61.4 -68.3 -41.0 39.9 -18.9 -15.1 41 69 A G H X S+ 0 0 0 -4,-2.3 4,-0.7 1,-0.2 12,-0.4 0.870 111.0 37.9 -54.3 -41.6 41.4 -17.8 -11.7 42 70 A F H < S+ 0 0 1 -4,-1.6 4,-0.4 2,-0.2 -1,-0.2 0.853 113.1 56.5 -81.0 -34.1 43.4 -21.0 -11.4 43 71 A A H >X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 3,-2.0 0.952 107.1 49.0 -60.6 -50.0 44.3 -21.2 -15.1 44 72 A L H 3X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.3 8,-0.3 0.779 99.9 66.3 -60.4 -27.4 45.8 -17.7 -15.1 45 73 A A H 3< S+ 0 0 7 -4,-0.7 -1,-0.3 -5,-0.3 -2,-0.2 0.642 114.0 32.8 -69.5 -11.1 47.8 -18.7 -11.9 46 74 A V H <4 S+ 0 0 0 -3,-2.0 -2,-0.2 -4,-0.4 -1,-0.1 0.805 125.9 35.1-107.6 -53.1 49.6 -21.1 -14.3 47 75 A V H < S+ 0 0 0 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.514 124.8 38.0 -85.7 -5.9 49.8 -19.5 -17.7 48 76 A H >X + 0 0 17 -4,-1.7 4,-2.3 -5,-0.3 3,-2.1 -0.376 63.6 162.6-142.6 58.1 50.2 -15.8 -16.6 49 77 A P T 34 + 0 0 10 0, 0.0 323,-0.1 0, 0.0 335,-0.1 0.614 67.8 72.3 -53.6 -18.5 52.5 -15.9 -13.5 50 78 A A T 34 S- 0 0 8 321,-0.1 322,-2.1 322,-0.1 323,-0.6 0.786 129.8 -9.8 -70.5 -26.2 53.3 -12.2 -13.8 51 79 A A T <4 S+ 0 0 4 -3,-2.1 299,-0.2 -7,-0.2 318,-0.1 0.554 115.8 84.8-137.3 -50.9 49.8 -11.4 -12.6 52 80 A G < + 0 0 2 -4,-2.3 2,-0.3 -8,-0.3 -1,-0.1 -0.328 67.6 148.2 -57.0 147.1 47.6 -14.5 -12.5 53 81 A N - 0 0 8 -12,-0.4 -8,-0.2 1,-0.1 -7,-0.1 -0.994 62.4-151.1-171.1 172.4 48.3 -16.2 -9.1 54 82 A I S S+ 0 0 2 -2,-0.3 58,-0.5 330,-0.3 -1,-0.1 0.226 100.6 65.8-132.1 -6.2 47.5 -18.2 -6.0 55 83 A G S S+ 0 0 0 329,-0.2 331,-1.4 56,-0.1 2,-0.1 0.255 103.3 43.9-102.0 10.6 50.1 -16.2 -4.0 56 84 A G S S- 0 0 0 329,-0.1 54,-2.4 53,-0.1 55,-1.8 -0.101 74.9-127.4-123.8-137.6 48.3 -12.9 -4.2 57 85 A G E +H 367 0B 0 310,-2.1 310,-2.7 53,-0.2 18,-0.3 -0.960 22.8 160.9-168.2 179.9 44.7 -11.6 -3.8 58 86 A G E -HI 366 74B 0 16,-0.8 16,-2.2 -2,-0.3 2,-0.3 -0.958 30.9 -83.8 179.0-161.8 42.0 -9.6 -5.4 59 87 A F E -HI 365 73B 0 306,-2.4 306,-1.7 -2,-0.3 2,-0.4 -0.932 18.5-158.9-134.8 156.2 38.3 -8.6 -5.6 60 88 A A E -HI 364 72B 0 12,-2.0 12,-3.6 -2,-0.3 2,-0.5 -0.982 1.8-164.5-140.1 124.8 35.2 -9.9 -7.3 61 89 A V E -HI 363 71B 0 302,-2.2 302,-2.4 -2,-0.4 2,-0.4 -0.942 20.1-168.8-107.4 126.2 32.0 -7.9 -8.1 62 90 A I E -HI 362 70B 0 8,-3.6 8,-2.4 -2,-0.5 2,-0.6 -0.956 23.1-164.0-127.4 136.7 29.1 -10.1 -8.9 63 91 A H E -HI 361 69B 8 298,-2.5 298,-2.3 -2,-0.4 6,-0.2 -0.974 26.4-147.5-112.5 118.2 25.6 -9.6 -10.3 64 92 A L > - 0 0 9 4,-3.1 3,-2.9 -2,-0.6 4,-0.1 -0.538 24.6-111.1 -89.2 154.0 23.4 -12.6 -9.6 65 93 A A T 3 S+ 0 0 58 1,-0.3 -1,-0.1 -2,-0.2 295,-0.1 0.768 117.7 60.0 -50.0 -28.9 20.6 -13.9 -11.9 66 94 A N T 3 S- 0 0 121 2,-0.1 -1,-0.3 1,-0.0 293,-0.1 0.350 123.2-101.3 -85.2 6.5 18.2 -12.9 -9.1 67 95 A G S < S+ 0 0 38 -3,-2.9 2,-0.2 1,-0.3 -2,-0.1 0.429 77.1 136.1 91.8 -1.1 19.2 -9.2 -9.3 68 96 A E - 0 0 105 -4,-0.1 -4,-3.1 -5,-0.0 2,-0.5 -0.588 41.8-150.9 -83.5 143.0 21.4 -9.2 -6.2 69 97 A N E +I 63 0B 25 -2,-0.2 2,-0.3 -6,-0.2 -6,-0.2 -0.948 22.3 172.1-117.7 113.4 24.8 -7.4 -6.4 70 98 A V E -I 62 0B 13 -8,-2.4 -8,-3.6 -2,-0.5 2,-0.4 -0.851 20.8-147.5-121.7 155.4 27.6 -8.7 -4.1 71 99 A A E -IJ 61 236B 0 165,-2.3 165,-2.9 -2,-0.3 2,-0.6 -0.969 6.7-153.2-123.4 136.5 31.3 -8.0 -3.7 72 100 A L E -IJ 60 235B 0 -12,-3.6 -12,-2.0 -2,-0.4 2,-0.8 -0.942 5.4-159.8-113.3 119.0 34.0 -10.5 -2.6 73 101 A D E +IJ 59 234B 0 161,-2.5 161,-1.8 -2,-0.6 -14,-0.2 -0.853 27.5 154.1-100.1 104.5 37.1 -9.3 -0.9 74 102 A F E +I 58 0B 0 -16,-2.2 -16,-0.8 -2,-0.8 36,-0.4 -0.182 26.7 145.8-119.6 40.2 40.0 -11.7 -1.0 75 103 A R - 0 0 1 -18,-0.3 33,-0.1 1,-0.1 -18,-0.1 -0.401 56.5 -94.5 -73.8 150.7 42.7 -9.0 -0.7 76 104 A E - 0 0 0 -2,-0.1 2,-0.3 31,-0.1 -1,-0.1 -0.283 35.9-138.0 -67.1 155.3 45.8 -10.0 1.2 77 105 A K B -L 108 0C 15 31,-0.9 31,-3.3 340,-0.2 340,-0.2 -0.876 22.1-106.7-114.5 146.0 46.1 -9.2 4.9 78 106 A A - 0 0 0 338,-2.3 337,-1.8 -2,-0.3 29,-0.1 -0.484 52.1 -97.4 -67.6 141.7 49.2 -7.8 6.7 79 107 A P > - 0 0 0 0, 0.0 3,-1.4 0, 0.0 336,-0.6 -0.074 29.1-107.9 -57.1 162.9 50.7 -10.6 8.8 80 108 A L T 3 S+ 0 0 62 1,-0.3 334,-0.2 334,-0.2 143,-0.1 0.792 122.5 47.7 -62.4 -27.0 50.0 -10.9 12.5 81 109 A K T 3 S+ 0 0 153 141,-0.3 -1,-0.3 332,-0.1 2,-0.1 0.363 85.1 122.4 -96.5 4.0 53.5 -9.7 13.2 82 110 A A < - 0 0 7 -3,-1.4 332,-0.4 331,-0.1 2,-0.3 -0.385 43.5-163.0 -68.8 143.9 53.4 -6.8 10.8 83 111 A T > - 0 0 72 330,-0.2 3,-1.7 -2,-0.1 4,-0.2 -0.928 31.1-109.3-131.0 155.5 54.1 -3.3 12.2 84 112 A K T 3 S+ 0 0 104 -2,-0.3 328,-0.4 1,-0.3 3,-0.2 0.830 118.5 29.9 -47.1 -45.7 53.5 0.3 11.2 85 113 A N T > S+ 0 0 83 1,-0.2 3,-0.9 326,-0.1 -1,-0.3 -0.294 78.8 126.9-113.6 47.0 57.2 1.0 10.5 86 114 A M T < S+ 0 0 28 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.1 0.648 75.9 48.3 -76.9 -15.0 58.3 -2.4 9.5 87 115 A F T 3 S+ 0 0 1 -3,-0.2 8,-2.8 307,-0.2 2,-0.3 0.142 95.8 89.1-111.0 18.1 59.9 -1.1 6.3 88 116 A L B < S-M 94 0D 24 -3,-0.9 6,-0.2 6,-0.3 -3,-0.0 -0.885 71.5-124.0-117.2 148.2 61.8 1.8 7.8 89 117 A D > - 0 0 67 4,-3.2 3,-1.6 -2,-0.3 2,-1.1 -0.028 49.8 -76.0 -75.2-173.9 65.4 1.8 9.2 90 118 A K T 3 S+ 0 0 212 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 -0.083 131.4 52.7 -78.5 39.6 66.4 3.0 12.7 91 119 A Q T 3 S- 0 0 155 -2,-1.1 -1,-0.3 2,-0.2 3,-0.1 0.125 119.5 -99.5-156.9 18.4 65.9 6.6 11.5 92 120 A G S < S+ 0 0 35 -3,-1.6 2,-0.4 1,-0.2 -2,-0.1 0.580 80.9 135.4 68.7 9.6 62.4 6.6 10.0 93 121 A N - 0 0 72 1,-0.1 -4,-3.2 302,-0.0 -1,-0.2 -0.754 64.6-101.1 -96.5 138.2 63.8 6.3 6.5 94 122 A V B -M 88 0D 45 -2,-0.4 -6,-0.3 -6,-0.2 -1,-0.1 -0.307 31.2-131.1 -56.8 123.7 62.4 3.9 3.9 95 123 A V > - 0 0 46 -8,-2.8 3,-2.2 -2,-0.1 4,-0.4 -0.709 37.0-105.2 -81.3 108.7 64.6 0.7 3.6 96 124 A P T 3 S- 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.023 89.5 -13.5 -38.3 124.4 65.2 0.3 -0.2 97 125 A K T >> S+ 0 0 114 1,-0.1 4,-2.2 2,-0.1 3,-0.6 0.547 94.3 122.4 56.6 12.6 63.1 -2.5 -1.8 98 126 A L T <4 S+ 0 0 53 -3,-2.2 -1,-0.1 1,-0.2 -10,-0.1 0.787 83.4 38.7 -72.5 -23.5 62.2 -4.0 1.5 99 127 A S T 34 S+ 0 0 5 -4,-0.4 291,-0.5 -12,-0.1 -1,-0.2 0.304 122.3 44.3-105.3 6.7 58.5 -3.6 0.5 100 128 A E T <4 S+ 0 0 54 -3,-0.6 2,-0.4 1,-0.3 -2,-0.2 0.755 112.2 33.6-115.8 -46.8 59.1 -4.5 -3.1 101 129 A D S < S+ 0 0 12 -4,-2.2 -1,-0.3 274,-0.1 3,-0.2 -0.919 95.5 26.7-118.1 142.3 61.3 -7.6 -3.3 102 130 A G S > S- 0 0 6 272,-1.9 3,-0.6 -2,-0.4 274,-0.2 -0.338 92.7 -59.9 106.6 173.8 61.5 -10.6 -1.0 103 131 A Y G > S+ 0 0 7 116,-0.3 3,-1.0 1,-0.2 119,-0.4 0.736 122.5 59.7 -69.2 -28.4 59.5 -12.5 1.5 104 132 A L G 3 S+ 0 0 33 1,-0.2 -1,-0.2 115,-0.2 -2,-0.1 0.710 92.9 67.2 -76.0 -19.1 58.7 -9.6 3.9 105 133 A A G < S+ 0 0 0 -3,-0.6 284,-1.7 -8,-0.1 285,-0.4 0.424 85.7 101.4 -80.3 3.8 57.0 -7.7 1.2 106 134 A A < - 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0 0 22 -4,-2.4 3,-0.1 -5,-0.5 -4,-0.1 -0.204 45.3-165.4 -79.7 175.4 29.0 -22.0 -8.2 124 152 A T + 0 0 98 -92,-0.1 2,-0.2 2,-0.0 -1,-0.1 0.495 67.0 68.7-132.8 -22.9 27.4 -25.2 -9.5 125 153 A K S S- 0 0 52 -93,-0.1 2,-0.3 1,-0.0 -2,-0.1 -0.609 87.7 -99.0 -99.6 162.7 30.4 -27.4 -10.5 126 154 A K >> - 0 0 154 -2,-0.2 3,-1.9 1,-0.1 4,-1.7 -0.640 21.2-129.3 -85.7 136.2 33.0 -29.0 -8.2 127 155 A L H 3> S+ 0 0 19 -2,-0.3 4,-1.9 1,-0.3 5,-0.3 0.886 106.5 65.9 -44.5 -49.4 36.3 -27.3 -7.7 128 156 A S H 34 S+ 0 0 34 1,-0.2 4,-0.4 68,-0.2 -1,-0.3 0.809 108.6 39.2 -45.7 -36.3 38.1 -30.6 -8.5 129 157 A Q H <4 S+ 0 0 102 -3,-1.9 3,-0.4 2,-0.2 -1,-0.2 0.852 112.8 52.8 -85.3 -37.2 36.8 -30.3 -12.1 130 158 A L H < S+ 0 0 5 -4,-1.7 4,-0.3 1,-0.2 -2,-0.2 0.655 112.2 48.0 -72.8 -14.9 37.2 -26.5 -12.6 131 159 A I S X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.596 86.9 86.2-101.1 -13.7 40.8 -26.8 -11.5 132 160 A D H > S+ 0 0 56 -4,-0.4 4,-2.6 -3,-0.4 5,-0.2 0.880 85.0 55.4 -54.9 -44.2 41.8 -29.8 -13.7 133 161 A P H > S+ 0 0 44 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.928 109.9 45.7 -56.6 -46.6 42.7 -27.6 -16.8 134 162 A A H > S+ 0 0 1 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.903 111.5 53.0 -63.0 -41.6 45.1 -25.5 -14.8 135 163 A I H X S+ 0 0 13 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.913 108.8 49.6 -59.6 -43.0 46.6 -28.6 -13.3 136 164 A K H X S+ 0 0 140 -4,-2.6 4,-3.4 1,-0.2 5,-0.4 0.913 110.7 49.9 -62.2 -43.4 47.1 -30.1 -16.7 137 165 A L H X S+ 0 0 27 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.833 113.3 46.4 -64.5 -33.7 48.8 -26.8 -17.9 138 166 A A H < S+ 0 0 0 -4,-2.1 47,-2.3 2,-0.2 -2,-0.2 0.874 118.5 41.9 -75.8 -37.9 51.1 -26.9 -14.9 139 167 A E H < S+ 0 0 70 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.933 128.5 26.6 -74.7 -49.7 51.9 -30.6 -15.4 140 168 A N H < S- 0 0 93 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.2 0.572 105.2-140.0 -92.8 -12.0 52.3 -30.7 -19.1 141 169 A G < - 0 0 14 -4,-1.0 2,-0.3 -5,-0.4 43,-0.2 0.086 7.1-118.8 77.9 169.9 53.3 -27.1 -19.6 142 170 A Y E -N 183 0E 9 41,-1.2 41,-2.6 -4,-0.1 2,-0.3 -0.945 34.6 -80.2-145.4 163.5 52.5 -24.4 -22.2 143 171 A A E -N 182 0E 65 -2,-0.3 2,-0.5 39,-0.2 39,-0.2 -0.498 40.5-123.8 -72.5 129.1 54.4 -22.3 -24.7 144 172 A I - 0 0 3 37,-2.5 36,-3.6 34,-0.3 37,-0.2 -0.609 36.5-135.6 -70.8 120.8 56.2 -19.2 -23.3 145 173 A S > - 0 0 47 -2,-0.5 4,-2.1 34,-0.2 5,-0.2 -0.206 18.3-103.4 -77.1 171.3 54.7 -16.3 -25.4 146 174 A Q H > S+ 0 0 101 1,-0.2 4,-1.2 2,-0.2 3,-0.1 0.943 122.4 45.8 -57.3 -52.6 56.5 -13.4 -27.0 147 175 A R H > S+ 0 0 100 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.834 110.8 54.3 -62.6 -33.9 55.4 -11.0 -24.3 148 176 A Q H > S+ 0 0 9 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.877 100.9 56.6 -69.3 -39.7 56.3 -13.4 -21.5 149 177 A A H X S+ 0 0 15 -4,-2.1 4,-1.1 2,-0.2 -1,-0.2 0.875 113.0 46.0 -58.2 -35.2 59.8 -13.9 -22.7 150 178 A E H >X S+ 0 0 82 -4,-1.2 4,-2.6 2,-0.2 3,-0.7 0.992 114.2 42.0 -69.3 -66.6 60.1 -10.1 -22.3 151 179 A T H 3X S+ 0 0 11 -4,-2.5 4,-0.8 1,-0.3 -2,-0.2 0.867 115.2 53.0 -50.7 -41.4 58.4 -9.6 -18.9 152 180 A L H 3< S+ 0 0 8 -4,-2.9 3,-0.4 1,-0.2 4,-0.3 0.874 110.5 48.0 -62.8 -36.8 60.3 -12.6 -17.6 153 181 A K H X< S+ 0 0 139 -4,-1.1 3,-1.0 -3,-0.7 4,-0.4 0.884 107.8 54.0 -71.1 -39.0 63.5 -11.1 -18.8 154 182 A E H 3< S+ 0 0 137 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.622 113.1 44.9 -70.5 -11.9 62.7 -7.7 -17.3 155 183 A A T >X S+ 0 0 5 -4,-0.8 4,-2.4 -3,-0.4 3,-0.6 0.392 82.6 100.8-109.8 -1.4 62.3 -9.5 -14.0 156 184 A R H <> S+ 0 0 76 -3,-1.0 4,-2.4 -4,-0.3 -2,-0.1 0.905 78.0 56.3 -48.4 -50.9 65.4 -11.7 -14.2 157 185 A E H 3> S+ 0 0 156 -4,-0.4 4,-0.5 1,-0.2 -1,-0.2 0.871 110.7 45.0 -51.4 -41.9 67.3 -9.4 -11.9 158 186 A R H X4 S+ 0 0 41 -3,-0.6 3,-1.3 2,-0.2 4,-0.3 0.934 109.7 52.7 -71.3 -47.2 64.7 -9.9 -9.2 159 187 A F H >< S+ 0 0 1 -4,-2.4 3,-2.5 1,-0.3 7,-0.4 0.909 99.9 64.6 -54.0 -46.0 64.3 -13.6 -9.6 160 188 A L H 3< S+ 0 0 57 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.752 89.8 66.6 -50.3 -30.1 68.1 -14.1 -9.2 161 189 A K T << S+ 0 0 107 -3,-1.3 2,-0.4 -4,-0.5 -1,-0.3 0.649 100.8 55.4 -69.0 -15.5 67.9 -12.8 -5.6 162 190 A Y <> - 0 0 41 -3,-2.5 4,-2.3 -4,-0.3 5,-0.2 -0.972 66.0-153.2-128.9 126.0 65.9 -15.8 -4.5 163 191 A S H > S+ 0 0 73 -2,-0.4 4,-2.0 1,-0.2 5,-0.2 0.903 96.4 58.0 -56.3 -47.5 66.8 -19.5 -4.9 164 192 A S H > S+ 0 0 0 1,-0.2 4,-1.3 213,-0.2 3,-0.4 0.942 112.5 39.4 -49.9 -54.9 63.1 -20.6 -4.9 165 193 A S H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.859 109.5 60.8 -65.4 -36.6 62.3 -18.4 -7.9 166 194 A K H < S+ 0 0 58 -4,-2.3 4,-0.4 -7,-0.4 -1,-0.2 0.858 107.3 47.5 -58.8 -33.9 65.6 -19.2 -9.6 167 195 A K H < S+ 0 0 110 -4,-2.0 -1,-0.2 -3,-0.4 -2,-0.2 0.824 119.5 36.2 -76.9 -33.7 64.5 -22.9 -9.6 168 196 A Y H < S+ 0 0 24 -4,-1.3 -2,-0.2 -5,-0.2 -3,-0.2 0.788 121.3 39.8 -92.0 -31.0 61.0 -22.3 -11.0 169 197 A F S < S+ 0 0 6 -4,-3.1 8,-0.4 -5,-0.1 2,-0.3 0.176 107.4 63.0-108.9 19.6 61.5 -19.5 -13.5 170 198 A F S S- 0 0 9 -4,-0.4 6,-0.2 -5,-0.2 4,-0.1 -0.974 73.3-125.4-139.6 151.8 64.8 -20.4 -15.1 171 199 A K B >> -O 175 0F 70 4,-3.2 4,-1.5 -2,-0.3 3,-0.8 -0.353 66.4 -46.0 -85.8 175.0 66.0 -23.3 -17.2 172 200 A K T 34 S+ 0 0 197 1,-0.3 3,-0.4 2,-0.2 -1,-0.2 -0.066 135.1 23.9 -42.2 137.1 69.1 -25.3 -16.2 173 201 A G T 34 S- 0 0 57 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.765 130.3 -76.7 74.1 24.8 71.9 -22.9 -15.1 174 202 A H T <4 S+ 0 0 81 -3,-0.8 2,-0.4 1,-0.2 -1,-0.2 0.884 81.5 164.9 51.7 44.9 69.4 -20.1 -14.3 175 203 A L B < -O 171 0F 104 -4,-1.5 -4,-3.2 -3,-0.4 -1,-0.2 -0.757 40.2-108.0 -94.1 137.7 68.9 -19.4 -18.0 176 204 A D - 0 0 29 -2,-0.4 2,-0.2 -6,-0.2 -6,-0.1 -0.220 33.6-110.1 -60.9 151.5 66.0 -17.2 -19.1 177 205 A Y - 0 0 32 -8,-0.4 2,-0.2 -29,-0.1 -1,-0.1 -0.599 35.0-144.2 -81.1 144.9 63.1 -18.9 -20.8 178 206 A Q > - 0 0 100 -2,-0.2 3,-2.2 1,-0.1 -34,-0.3 -0.687 31.6 -76.4-109.0 164.3 62.7 -17.9 -24.5 179 207 A E T 3 S+ 0 0 112 1,-0.3 -34,-0.2 -2,-0.2 -1,-0.1 -0.342 121.1 20.1 -56.7 132.9 59.7 -17.4 -26.7 180 208 A G T 3 S+ 0 0 52 -36,-3.6 -1,-0.3 1,-0.3 -35,-0.1 0.164 88.8 137.3 93.2 -20.3 58.3 -20.8 -27.6 181 209 A D < - 0 0 39 -3,-2.2 -37,-2.5 -37,-0.2 2,-0.7 -0.249 60.5-115.3 -60.0 149.1 60.0 -22.7 -24.7 182 210 A L E -N 143 0E 106 -39,-0.2 2,-0.7 -3,-0.1 -39,-0.2 -0.805 29.4-156.5 -90.6 115.2 57.8 -25.2 -23.0 183 211 A F E -N 142 0E 4 -41,-2.6 -41,-1.2 -2,-0.7 2,-0.4 -0.832 12.7-177.1 -99.1 111.5 57.3 -24.1 -19.4 184 212 A V - 0 0 50 -2,-0.7 2,-0.4 -43,-0.2 -45,-0.2 -0.892 11.2-168.3-110.1 137.8 56.4 -26.9 -16.9 185 213 A Q > + 0 0 11 -47,-2.3 4,-1.6 -2,-0.4 -44,-0.1 -0.754 13.1 168.4-128.7 83.7 55.7 -26.3 -13.3 186 214 A K H > S+ 0 0 97 -2,-0.4 4,-1.9 2,-0.2 -1,-0.1 0.918 77.7 48.2 -61.7 -51.4 55.6 -29.5 -11.3 187 215 A D H > S+ 0 0 30 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.892 109.6 53.7 -60.3 -38.9 55.6 -28.2 -7.8 188 216 A L H > S+ 0 0 3 194,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.905 106.0 55.2 -61.5 -37.9 52.8 -25.8 -8.7 189 217 A A H X S+ 0 0 0 -4,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.924 105.2 51.6 -59.5 -45.6 50.9 -28.8 -9.9 190 218 A K H X S+ 0 0 129 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.945 111.0 47.6 -56.9 -48.9 51.3 -30.5 -6.5 191 219 A T H X S+ 0 0 2 -4,-2.2 4,-1.7 190,-0.3 -1,-0.2 0.920 112.3 49.3 -58.6 -45.6 50.0 -27.5 -4.8 192 220 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.905 108.9 52.7 -61.9 -40.4 47.0 -27.3 -7.2 193 221 A N H X S+ 0 0 53 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.843 105.2 56.1 -63.7 -32.0 46.4 -31.0 -6.7 194 222 A Q H X S+ 0 0 58 -4,-1.9 4,-3.2 2,-0.2 5,-0.3 0.906 111.1 42.9 -64.0 -42.5 46.3 -30.3 -2.9 195 223 A I H X S+ 0 0 1 -4,-1.7 4,-1.9 7,-0.2 -2,-0.2 0.884 111.2 55.4 -70.3 -39.6 43.6 -27.7 -3.5 196 224 A K H < S+ 0 0 61 -4,-2.8 -68,-0.2 -5,-0.2 -2,-0.2 0.882 120.5 31.5 -59.4 -38.9 41.8 -30.0 -5.9 197 225 A T H < S+ 0 0 105 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.934 135.3 22.4 -84.5 -55.8 41.7 -32.7 -3.2 198 226 A L H >< S- 0 0 102 -4,-3.2 3,-0.8 1,-0.3 -3,-0.2 0.407 96.0-140.1 -96.8 0.4 41.4 -30.8 0.1 199 227 A G T >< - 0 0 12 -4,-1.9 3,-2.1 -5,-0.3 -1,-0.3 -0.385 67.8 -17.2 74.0-154.9 40.0 -27.6 -1.2 200 228 A A T >> S+ 0 0 8 1,-0.3 3,-2.6 2,-0.2 4,-2.0 0.846 133.5 66.3 -53.4 -36.4 41.2 -24.3 0.3 201 229 A K H <> S+ 0 0 130 -3,-0.8 4,-1.6 1,-0.3 -1,-0.3 0.772 86.1 71.0 -57.8 -25.3 42.6 -26.2 3.2 202 230 A G H <4 S+ 0 0 1 -3,-2.1 6,-0.4 -8,-0.2 -1,-0.3 0.647 110.8 31.3 -66.3 -12.4 45.1 -27.7 0.8 203 231 A F H <4 S+ 0 0 0 -3,-2.6 -2,-0.2 -4,-0.2 -1,-0.2 0.783 124.2 40.2-108.7 -49.4 46.7 -24.3 0.7 204 232 A Y H < S+ 0 0 15 -4,-2.0 2,-0.2 24,-0.1 -3,-0.2 0.433 122.9 30.0 -84.1 -1.5 46.2 -22.7 4.1 205 233 A Q S X S+ 0 0 90 -4,-1.6 4,-1.5 -5,-0.3 3,-0.4 -0.778 97.6 26.7-141.9-175.2 46.9 -26.0 6.0 206 234 A G H > S- 0 0 52 -2,-0.2 4,-2.2 1,-0.2 3,-0.4 -0.023 116.1 -17.0 54.9-156.5 48.8 -29.2 5.8 207 235 A Q H > S+ 0 0 111 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.868 136.5 53.6 -47.6 -50.0 52.1 -29.5 3.8 208 236 A V H > S+ 0 0 3 -3,-0.4 4,-2.4 -6,-0.4 -1,-0.2 0.913 110.1 47.5 -56.4 -43.7 51.6 -26.4 1.8 209 237 A A H X S+ 0 0 2 -4,-1.5 4,-2.4 -3,-0.4 -1,-0.2 0.886 112.5 51.7 -63.9 -36.8 51.1 -24.3 4.9 210 238 A E H X S+ 0 0 56 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.958 109.1 48.4 -63.1 -52.2 54.2 -26.0 6.3 211 239 A L H X S+ 0 0 37 -4,-3.3 4,-2.2 1,-0.2 5,-0.3 0.913 112.4 49.9 -55.0 -45.5 56.3 -25.2 3.2 212 240 A I H X S+ 0 0 3 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.950 113.7 43.2 -59.6 -52.6 55.1 -21.5 3.4 213 241 A E H X S+ 0 0 40 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.936 116.5 45.9 -61.1 -50.2 55.9 -21.0 7.1 214 242 A K H X S+ 0 0 94 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.868 115.3 46.0 -63.2 -38.3 59.3 -22.8 7.0 215 243 A D H X S+ 0 0 11 -4,-2.2 4,-0.9 -5,-0.3 -1,-0.2 0.868 113.9 50.6 -73.1 -34.2 60.4 -21.0 3.9 216 244 A M H ><>S+ 0 0 0 -4,-2.2 5,-3.0 -5,-0.3 3,-0.9 0.956 112.1 45.2 -64.8 -52.4 59.2 -17.7 5.3 217 245 A K H ><5S+ 0 0 174 -4,-3.0 3,-1.1 1,-0.3 -2,-0.2 0.925 111.9 54.0 -56.3 -46.6 61.0 -18.2 8.6 218 246 A K H 3<5S+ 0 0 144 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.695 114.8 40.5 -62.3 -21.7 64.1 -19.3 6.7 219 247 A N T <<5S- 0 0 63 -3,-0.9 -116,-0.3 -4,-0.9 -1,-0.2 0.248 119.0 -94.3-116.7 14.7 64.0 -16.1 4.6 220 248 A G T < 5S+ 0 0 53 -3,-1.1 -3,-0.2 -4,-0.5 2,-0.1 0.659 80.7 134.7 84.8 13.9 63.1 -13.3 6.9 221 249 A G < - 0 0 10 -5,-3.0 -1,-0.3 -6,-0.2 -117,-0.2 -0.456 47.3-150.4 -89.4 169.4 59.4 -13.4 6.2 222 250 A I + 0 0 39 -119,-0.4 2,-0.3 -116,-0.2 -141,-0.3 0.392 53.4 118.1-122.9 2.0 56.8 -13.2 8.9 223 251 A I + 0 0 2 -120,-0.2 2,-0.2 -11,-0.1 -6,-0.2 -0.557 41.7 178.2 -74.0 131.3 53.9 -15.2 7.5 224 252 A T >> - 0 0 46 -2,-0.3 4,-2.1 -8,-0.1 3,-0.6 -0.777 47.9 -95.9-128.8 172.1 53.1 -18.3 9.6 225 253 A K H 3> S+ 0 0 81 1,-0.3 4,-2.7 -2,-0.2 5,-0.2 0.809 124.4 60.9 -56.5 -29.6 50.6 -21.2 9.8 226 254 A E H 3> S+ 0 0 131 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.914 104.8 47.2 -63.7 -43.6 48.7 -19.0 12.2 227 255 A D H <> S+ 0 0 1 -3,-0.6 4,-0.7 2,-0.2 3,-0.2 0.951 113.9 46.6 -62.1 -51.8 48.3 -16.3 9.5 228 256 A L H >< S+ 0 0 2 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.907 111.6 49.9 -58.5 -47.2 47.2 -18.9 6.9 229 257 A A H 3< S+ 0 0 68 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.810 114.6 47.1 -63.3 -28.7 44.7 -20.6 9.1 230 258 A S H 3< S+ 0 0 49 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.478 80.9 118.9 -93.4 -3.4 43.3 -17.2 10.0 231 259 A Y << + 0 0 20 -3,-1.0 2,-0.4 -4,-0.7 -155,-0.1 -0.442 41.3 179.9 -65.1 135.5 43.0 -15.8 6.5 232 260 A N - 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0 0 22 -4,-2.5 -90,-0.1 -5,-0.6 3,-0.0 -0.165 50.2-158.2 -82.7-178.2 54.9 -17.4 -61.8 657 152 C T + 0 0 96 -92,-0.1 2,-0.2 2,-0.0 -1,-0.1 0.425 67.3 69.7-136.0 -12.5 56.4 -20.9 -61.2 658 153 C K S S- 0 0 55 -6,-0.1 2,-0.3 -93,-0.1 -2,-0.1 -0.606 85.2 -96.3-108.2 169.7 53.3 -23.1 -60.7 659 154 C K >> - 0 0 143 -2,-0.2 4,-2.0 1,-0.1 3,-1.1 -0.675 19.8-135.3 -87.6 136.3 50.6 -24.3 -63.0 660 155 C L H 3> S+ 0 0 21 -2,-0.3 4,-1.8 1,-0.3 5,-0.2 0.881 104.5 68.3 -54.0 -37.4 47.3 -22.5 -63.1 661 156 C S H 34 S+ 0 0 41 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.864 108.1 34.1 -50.6 -42.7 45.7 -25.9 -63.0 662 157 C Q H X4 S+ 0 0 92 -3,-1.1 3,-0.5 2,-0.2 -1,-0.2 0.834 113.3 57.2 -84.4 -35.7 46.8 -26.4 -59.4 663 158 C L H 3< S+ 0 0 6 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.724 108.2 49.5 -68.4 -20.6 46.6 -22.8 -58.1 664 159 C I T 3X S+ 0 0 0 -4,-1.8 4,-2.1 -5,-0.2 3,-0.3 0.626 87.7 84.5 -93.6 -14.1 42.9 -22.7 -59.0 665 160 C D H <> S+ 0 0 63 -3,-0.5 4,-2.9 -4,-0.4 5,-0.2 0.882 84.5 56.7 -56.0 -43.9 41.9 -26.0 -57.3 666 161 C P H > S+ 0 0 35 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.920 109.6 46.7 -55.4 -42.8 41.4 -24.4 -53.9 667 162 C A H > S+ 0 0 0 -3,-0.3 4,-2.2 -4,-0.3 -2,-0.2 0.909 111.2 51.2 -64.1 -44.5 38.9 -22.0 -55.4 668 163 C I H X S+ 0 0 6 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.923 107.6 53.5 -59.6 -43.9 37.1 -24.8 -57.2 669 164 C K H X S+ 0 0 133 -4,-2.9 4,-3.1 1,-0.2 5,-0.4 0.876 109.6 48.4 -57.8 -40.3 36.9 -26.8 -54.0 670 165 C L H X S+ 0 0 24 -4,-1.7 4,-1.3 -5,-0.2 -1,-0.2 0.855 112.6 47.3 -69.7 -36.9 35.3 -23.8 -52.3 671 166 C A H < S+ 0 0 0 -4,-2.2 47,-2.5 2,-0.2 -2,-0.2 0.900 120.7 38.3 -71.1 -40.0 32.8 -23.3 -55.1 672 167 C E H < S+ 0 0 90 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.913 127.7 31.3 -77.1 -46.4 31.9 -27.0 -55.2 673 168 C N H < S- 0 0 98 -4,-3.1 -3,-0.2 -5,-0.3 -2,-0.2 0.692 106.4-137.1 -86.3 -22.0 32.0 -27.8 -51.5 674 169 C G < - 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