==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 29-MAY-01 1J9Z . COMPND 2 MOLECULE: NADPH-CYTOCHROME P450 REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR P.A.HUBBARD,A.L.SHEN,R.PASCHKE,C.B.KASPER,J.J.KIM . 1224 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 855 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 104 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 109 8.9 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 106 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 141 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 317 25.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 36 2.9 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 0 0 0 14 2 6 2 3 2 2 1 1 4 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 1 6 0 6 1 1 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 . 7 4 2 6 1 3 2 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 . 5 2 0 3 2 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 63 A P 0 0 135 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 83.3 0.6 -24.9 32.9 2 64 A V - 0 0 142 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.525 360.0-132.2 -69.0 109.2 1.3 -28.2 34.6 3 65 A K - 0 0 64 -2,-0.6 52,-0.2 1,-0.1 51,-0.1 -0.120 14.8-117.0 -61.6 155.4 2.8 -27.5 38.1 4 66 A E - 0 0 74 50,-4.9 52,-0.3 1,-0.2 3,-0.2 -0.333 44.6 -80.7 -83.5 170.9 6.0 -29.2 39.4 5 67 A S S S- 0 0 77 1,-0.2 -1,-0.2 -2,-0.1 5,-0.1 -0.260 74.2 -52.4 -73.1 164.1 5.8 -31.4 42.5 6 68 A S > - 0 0 28 1,-0.2 4,-1.8 3,-0.1 3,-0.3 -0.045 49.1-151.3 -35.3 104.8 5.9 -30.1 46.1 7 69 A F H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.857 95.6 61.3 -55.3 -32.1 8.9 -27.8 46.1 8 70 A V H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 3,-0.4 0.981 103.3 49.8 -57.1 -51.8 9.2 -28.5 49.8 9 71 A E H > S+ 0 0 74 1,-0.3 4,-2.6 -3,-0.3 -1,-0.2 0.886 108.7 51.9 -51.8 -43.4 9.7 -32.2 49.0 10 72 A K H X S+ 0 0 44 -4,-1.8 4,-1.1 1,-0.2 -1,-0.3 0.881 108.6 51.8 -61.7 -38.0 12.4 -31.3 46.4 11 73 A M H <>S+ 0 0 0 -4,-2.3 5,-2.5 -3,-0.4 4,-0.4 0.926 110.1 49.1 -63.2 -46.3 14.1 -29.2 49.0 12 74 A K H ><5S+ 0 0 81 -4,-2.6 3,-2.0 1,-0.2 -2,-0.2 0.982 113.3 44.9 -54.2 -62.7 14.1 -32.2 51.4 13 75 A K H 3<5S+ 0 0 166 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.632 119.4 43.5 -58.4 -17.7 15.5 -34.6 48.8 14 76 A T T 3<5S- 0 0 24 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.266 109.6-118.0-115.0 12.5 18.1 -32.1 47.7 15 77 A G T < 5 + 0 0 48 -3,-2.0 2,-0.4 -4,-0.4 -3,-0.2 0.846 63.5 143.0 55.8 41.5 19.2 -30.9 51.1 16 78 A R < - 0 0 21 -5,-2.5 31,-0.2 -6,-0.1 -1,-0.2 -0.892 30.0-178.3-111.4 141.3 18.1 -27.3 50.7 17 79 A N + 0 0 18 29,-2.8 53,-1.3 -2,-0.4 2,-0.4 0.545 66.2 53.5-114.9 -10.5 16.6 -25.2 53.4 18 80 A I E -ab 47 70A 1 28,-1.5 30,-1.4 51,-0.2 2,-0.4 -0.986 58.5-169.9-128.3 137.6 15.9 -21.8 51.7 19 81 A I E -ab 48 71A 0 51,-1.3 53,-2.2 -2,-0.4 2,-0.5 -0.969 7.0-158.0-124.5 140.3 13.9 -21.2 48.5 20 82 A V E -ab 49 72A 0 28,-2.7 30,-1.2 -2,-0.4 2,-0.3 -0.892 7.7-159.8-124.6 103.2 13.8 -17.9 46.7 21 83 A F E -ab 50 73A 0 51,-1.7 53,-2.9 -2,-0.5 2,-0.5 -0.597 8.5-152.6 -80.3 136.4 10.8 -17.3 44.4 22 84 A Y E - b 0 74A 31 28,-1.7 2,-0.7 -2,-0.3 53,-0.2 -0.940 11.5-167.7-116.9 129.2 11.2 -14.7 41.7 23 85 A G E + b 0 75A 0 51,-2.9 53,-1.4 -2,-0.5 2,-0.3 -0.906 40.7 121.0-112.6 101.2 8.3 -12.7 40.2 24 86 A S - 0 0 10 -2,-0.7 62,-0.4 51,-0.1 -2,-0.1 -0.969 46.5-162.5-154.5 170.7 9.6 -10.9 37.1 25 87 A Q S S+ 0 0 39 -2,-0.3 -1,-0.1 60,-0.1 59,-0.0 0.649 97.4 39.6-122.4 -46.3 9.4 -10.3 33.4 26 88 A T S S- 0 0 68 364,-0.1 362,-0.1 1,-0.0 364,-0.1 0.350 113.0-111.6 -90.2 6.9 12.7 -8.7 32.3 27 89 A G S > S+ 0 0 16 360,-0.0 4,-2.4 1,-0.0 5,-0.1 0.382 84.2 118.3 84.6 -3.2 14.6 -11.0 34.7 28 90 A T H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.930 81.0 46.5 -63.3 -43.9 15.8 -8.6 37.3 29 91 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.888 110.4 55.3 -64.2 -35.7 13.9 -10.3 40.1 30 92 A E H > S+ 0 0 57 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.944 105.9 51.9 -61.1 -46.0 15.2 -13.6 38.8 31 93 A E H X S+ 0 0 38 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.932 108.3 49.6 -56.1 -50.3 18.7 -12.3 39.1 32 94 A F H X S+ 0 0 0 -4,-2.1 4,-3.3 1,-0.2 5,-0.3 0.939 109.9 52.0 -55.9 -48.1 18.3 -11.2 42.7 33 95 A A H X S+ 0 0 0 -4,-2.3 4,-3.3 1,-0.2 -1,-0.2 0.939 108.9 49.2 -51.8 -54.4 16.9 -14.6 43.6 34 96 A N H X S+ 0 0 24 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.848 114.1 47.3 -54.6 -38.2 19.8 -16.5 42.0 35 97 A R H X S+ 0 0 3 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.924 113.4 45.8 -71.3 -45.4 22.2 -14.3 43.9 36 98 A L H X S+ 0 0 0 -4,-3.3 4,-1.8 -5,-0.2 -2,-0.2 0.871 114.1 52.1 -64.8 -34.2 20.3 -14.7 47.2 37 99 A S H X S+ 0 0 16 -4,-3.3 4,-0.7 -5,-0.3 10,-0.6 0.957 112.0 42.2 -65.8 -53.0 20.2 -18.4 46.5 38 100 A K H >X S+ 0 0 90 -4,-2.6 3,-1.0 1,-0.2 4,-0.7 0.896 109.3 61.3 -62.1 -38.4 23.9 -18.8 45.9 39 101 A D H >< S+ 0 0 10 -4,-2.5 3,-1.2 1,-0.2 4,-0.4 0.920 89.7 70.6 -51.5 -48.9 24.5 -16.5 48.8 40 102 A A H ><>S+ 0 0 0 -4,-1.8 3,-1.8 1,-0.3 5,-1.3 0.822 91.1 60.4 -36.2 -48.1 22.8 -19.0 51.1 41 103 A H H X<5S+ 0 0 115 -3,-1.0 3,-1.5 -4,-0.7 -1,-0.3 0.881 94.1 59.7 -52.8 -48.3 25.7 -21.5 50.7 42 104 A R T <<5S+ 0 0 50 -3,-1.2 134,-0.3 -4,-0.7 -1,-0.3 0.515 103.3 56.1 -62.7 -3.0 28.4 -19.2 52.2 43 105 A Y T < 5S- 0 0 22 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.1 -0.070 125.4 -93.9-120.7 34.3 26.4 -19.1 55.4 44 106 A G T < 5S+ 0 0 59 -3,-1.5 -3,-0.2 1,-0.2 2,-0.2 0.195 97.7 99.1 78.4 -17.2 26.2 -22.8 56.1 45 107 A M < - 0 0 8 -5,-1.3 2,-0.4 -6,-0.1 -2,-0.3 -0.510 63.1-138.6-100.0 168.0 22.8 -23.1 54.4 46 108 A R + 0 0 118 -2,-0.2 -29,-2.8 -3,-0.1 -28,-1.5 -0.993 26.0 173.9-129.7 125.1 21.8 -24.3 50.9 47 109 A G E -a 18 0A 13 -10,-0.6 2,-0.3 -2,-0.4 -28,-0.2 -0.634 14.8-156.7-122.6-178.8 19.2 -22.6 48.8 48 110 A M E -a 19 0A 22 -30,-1.4 -28,-2.7 -2,-0.2 2,-0.2 -0.982 16.6-126.3-155.1 152.4 17.6 -22.6 45.4 49 111 A S E -a 20 0A 26 -2,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.469 30.7-179.7 -93.1 173.4 15.6 -20.2 43.1 50 112 A A E -a 21 0A 5 -30,-1.2 -28,-1.7 -2,-0.2 3,-0.0 -0.890 33.2-120.6-175.9 142.6 12.3 -21.1 41.6 51 113 A D > - 0 0 30 -2,-0.3 3,-2.5 -30,-0.2 4,-0.5 -0.790 22.4-148.5 -88.3 115.1 9.5 -19.8 39.4 52 114 A P G > S+ 0 0 1 0, 0.0 3,-1.2 0, 0.0 5,-0.2 0.784 94.5 68.5 -56.4 -24.3 6.3 -19.7 41.5 53 115 A E G 3 S+ 0 0 73 1,-0.3 34,-0.1 3,-0.1 -30,-0.0 0.648 95.4 55.5 -70.4 -12.3 4.3 -20.4 38.3 54 116 A E G < S+ 0 0 65 -3,-2.5 -50,-4.9 -51,-0.1 -1,-0.3 0.591 111.2 48.2 -92.8 -12.2 5.9 -23.9 38.2 55 117 A Y S < S- 0 0 6 -3,-1.2 2,-0.8 -4,-0.5 -50,-0.1 -0.764 79.6-114.9-126.0 174.2 4.7 -24.7 41.7 56 118 A D > - 0 0 77 -52,-0.3 3,-2.2 -2,-0.2 -49,-0.2 -0.887 21.2-158.9-107.3 98.9 1.7 -24.6 44.1 57 119 A L G > S+ 0 0 5 -2,-0.8 3,-1.6 1,-0.3 4,-0.2 0.455 77.3 93.1 -60.8 4.7 2.7 -22.2 46.8 58 120 A A G > S+ 0 0 28 1,-0.3 3,-1.5 2,-0.1 -1,-0.3 0.851 71.6 71.6 -66.0 -28.7 0.1 -23.9 48.9 59 121 A D G X> + 0 0 37 -3,-2.2 3,-2.8 1,-0.3 4,-1.1 0.499 64.1 97.2 -66.1 -3.8 2.9 -26.1 50.2 60 122 A L G X4 S+ 0 0 0 -3,-1.6 3,-0.7 1,-0.3 -1,-0.3 0.868 78.0 62.6 -52.3 -33.3 4.3 -23.2 52.1 61 123 A S G <4 S+ 0 0 53 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.667 101.1 50.9 -66.2 -17.4 2.5 -24.8 55.0 62 124 A S G X4 S+ 0 0 24 -3,-2.8 3,-2.5 1,-0.2 -1,-0.3 0.646 85.9 87.5 -91.5 -21.4 4.7 -27.9 54.6 63 125 A L G X< S+ 0 0 0 -4,-1.1 3,-1.6 -3,-0.7 -1,-0.2 0.731 74.2 69.5 -51.3 -28.3 7.9 -25.8 54.7 64 126 A P G 3 S+ 0 0 51 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.609 79.5 78.7 -69.6 -8.3 8.1 -26.0 58.5 65 127 A E G < S+ 0 0 120 -3,-2.5 2,-0.5 2,-0.1 -2,-0.2 0.518 85.7 75.6 -74.3 -5.0 8.9 -29.7 58.1 66 128 A I S X S- 0 0 24 -3,-1.6 3,-1.3 -4,-0.1 -49,-0.0 -0.936 89.4-117.9-112.5 127.6 12.4 -28.5 57.3 67 129 A D T 3 S+ 0 0 143 -2,-0.5 3,-0.1 1,-0.3 -2,-0.1 -0.306 96.3 5.7 -62.4 143.3 14.9 -27.2 59.9 68 130 A K T 3 S+ 0 0 92 1,-0.2 -1,-0.3 -4,-0.1 2,-0.1 0.825 94.7 167.6 52.8 34.0 16.0 -23.6 59.6 69 131 A S < + 0 0 8 -3,-1.3 2,-0.3 -6,-0.1 -51,-0.2 -0.442 8.1 161.7 -79.0 154.7 13.6 -23.3 56.7 70 132 A L E -b 18 0A 0 -53,-1.3 -51,-1.3 -2,-0.1 2,-0.3 -0.847 25.7-143.6-172.9 134.5 12.7 -19.9 55.2 71 133 A V E -bc 19 106A 0 34,-2.3 36,-1.5 -2,-0.3 2,-0.4 -0.820 12.5-162.6-106.0 144.4 11.1 -18.6 52.0 72 134 A V E -bc 20 107A 0 -53,-2.2 -51,-1.7 -2,-0.3 2,-0.5 -0.993 3.5-155.4-129.8 132.9 12.2 -15.4 50.3 73 135 A F E -bc 21 108A 0 34,-2.1 36,-2.7 -2,-0.4 2,-0.9 -0.923 7.9-169.8-114.5 118.9 10.2 -13.5 47.6 74 136 A C E +bc 22 109A 0 -53,-2.9 -51,-2.9 -2,-0.5 2,-0.4 -0.822 27.6 176.4-102.8 91.9 11.8 -11.2 45.0 75 137 A M E -bc 23 110A 0 34,-1.2 36,-2.9 -2,-0.9 2,-0.3 -0.838 18.2-164.0-109.7 138.2 8.7 -9.6 43.6 76 138 A A E - c 0 111A 6 -53,-1.4 8,-0.6 -2,-0.4 2,-0.3 -0.802 16.3-130.5-112.5 154.1 8.3 -6.8 40.9 77 139 A T E +E 83 0B 29 34,-1.5 2,-0.3 -2,-0.3 5,-0.0 -0.797 26.8 167.9-108.6 147.7 5.2 -4.7 40.1 78 140 A Y E >> -E 82 0B 72 4,-2.7 4,-2.0 -2,-0.3 3,-0.7 -0.854 48.6 -3.2-143.4 177.2 3.6 -3.9 36.8 79 141 A G T 34 S- 0 0 56 -2,-0.3 2,-1.2 1,-0.2 39,-0.2 0.021 129.2 -0.0 38.4-126.8 0.4 -2.4 35.3 80 142 A E T 34 S- 0 0 107 1,-0.2 -1,-0.2 3,-0.1 -3,-0.0 -0.300 128.2 -63.3 -87.3 51.9 -2.1 -1.4 38.0 81 143 A G T <4 S+ 0 0 8 -2,-1.2 -2,-0.2 -3,-0.7 -1,-0.2 0.722 98.9 155.7 74.2 19.6 0.1 -2.5 40.9 82 144 A D E < -E 78 0B 62 -4,-2.0 -4,-2.7 1,-0.1 40,-0.2 -0.347 44.1-106.8 -79.1 159.5 -0.3 -6.0 39.3 83 145 A P E -E 77 0B 4 0, 0.0 -6,-0.1 0, 0.0 -1,-0.1 -0.321 44.1 -85.1 -80.1 166.2 2.1 -8.9 39.8 84 146 A T > - 0 0 0 -8,-0.6 3,-1.1 1,-0.1 4,-0.3 -0.337 49.7-102.5 -65.5 157.0 4.5 -10.2 37.1 85 147 A D G > S+ 0 0 85 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.915 123.7 47.2 -47.6 -54.1 2.8 -12.7 34.8 86 148 A N G 3 S+ 0 0 16 -62,-0.4 4,-0.4 1,-0.3 3,-0.4 0.704 107.0 59.4 -63.7 -20.1 4.4 -15.7 36.5 87 149 A A G <> S+ 0 0 0 -3,-1.1 4,-2.3 1,-0.2 -1,-0.3 0.421 80.6 93.2 -88.9 2.7 3.5 -14.3 39.9 88 150 A Q H <> S+ 0 0 69 -3,-1.9 4,-2.5 -4,-0.3 5,-0.3 0.897 81.8 48.7 -63.8 -45.8 -0.2 -14.3 38.9 89 151 A D H > S+ 0 0 71 -3,-0.4 4,-2.5 -4,-0.3 -1,-0.2 0.956 111.9 50.9 -58.8 -49.2 -1.1 -17.8 40.4 90 152 A F H > S+ 0 0 3 -4,-0.4 4,-2.9 2,-0.2 5,-0.2 0.940 112.8 47.5 -52.3 -50.8 0.6 -16.9 43.6 91 153 A Y H X S+ 0 0 55 -4,-2.3 4,-1.9 2,-0.2 5,-0.2 0.982 110.4 47.2 -55.9 -67.9 -1.3 -13.6 43.8 92 154 A D H X S+ 0 0 73 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.868 115.2 51.8 -42.9 -40.9 -4.8 -15.0 43.1 93 155 A W H X S+ 0 0 33 -4,-2.5 4,-3.0 -5,-0.3 3,-0.4 0.970 103.2 53.1 -61.9 -58.5 -4.0 -17.7 45.6 94 156 A L H < S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.807 112.1 50.3 -48.5 -30.3 -2.9 -15.4 48.5 95 157 A Q H < S+ 0 0 104 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.901 118.7 33.2 -76.1 -42.7 -6.2 -13.7 47.9 96 158 A E H < S+ 0 0 145 -4,-1.9 -2,-0.2 -3,-0.4 -3,-0.2 0.718 98.5 91.3 -88.8 -24.3 -8.4 -16.8 48.0 97 159 A T < - 0 0 21 -4,-3.0 -39,-0.0 -5,-0.2 0, 0.0 -0.270 43.4-174.3 -73.9 159.9 -6.6 -19.1 50.5 98 160 A D + 0 0 150 2,-0.0 -1,-0.1 -2,-0.0 -4,-0.0 0.268 38.8 147.3-130.5 -1.0 -7.3 -19.2 54.2 99 161 A V - 0 0 40 1,-0.1 2,-0.7 2,-0.1 -2,-0.0 0.188 50.4-118.9 -40.5 151.2 -4.4 -21.6 54.9 100 162 A D - 0 0 100 1,-0.1 34,-0.2 34,-0.1 -1,-0.1 -0.874 25.5-178.6-103.5 113.7 -2.4 -21.5 58.0 101 163 A L > + 0 0 0 32,-1.1 3,-2.1 -2,-0.7 35,-0.2 0.060 23.8 156.4 -96.9 24.4 1.3 -20.8 57.5 102 164 A T T 3 + 0 0 91 31,-0.3 33,-0.2 1,-0.3 3,-0.1 -0.220 67.2 26.2 -51.4 134.9 2.2 -21.1 61.2 103 165 A G T 3 S+ 0 0 34 31,-0.4 2,-0.5 1,-0.3 -1,-0.3 0.443 91.2 128.9 90.1 -0.6 5.9 -21.9 61.6 104 166 A V < - 0 0 0 -3,-2.1 32,-2.7 26,-0.1 2,-0.5 -0.799 42.9-159.6 -94.7 124.4 6.8 -20.4 58.2 105 167 A K E + d 0 136A 33 -2,-0.5 -34,-2.3 30,-0.2 2,-0.3 -0.897 21.1 169.1-104.4 126.5 9.6 -17.9 58.2 106 168 A F E -cd 71 137A 0 30,-1.9 32,-2.8 -2,-0.5 33,-0.7 -0.857 24.4-166.8-135.7 169.8 9.8 -15.4 55.3 107 169 A A E -cd 72 139A 0 -36,-1.5 -34,-2.1 -2,-0.3 2,-0.4 -0.972 14.2-154.9-151.9 146.4 11.5 -12.3 53.9 108 170 A V E -c 73 0A 0 31,-0.6 34,-2.5 -2,-0.3 2,-0.5 -0.990 11.7-174.7-135.1 133.1 10.5 -10.1 50.9 109 171 A F E -cd 74 142A 1 -36,-2.7 -34,-1.2 -2,-0.4 2,-0.3 -0.974 17.0-160.5-124.6 116.6 12.3 -7.8 48.6 110 172 A G E -cd 75 143A 0 32,-3.7 34,-2.9 -2,-0.5 2,-0.6 -0.768 10.2-145.8-102.8 144.4 10.2 -5.9 46.1 111 173 A L E +cd 76 144A 12 -36,-2.9 -34,-1.5 -2,-0.3 9,-0.2 -0.924 39.9 139.5-105.4 119.1 11.3 -4.2 42.9 112 174 A G E - 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0 0 2 -5,-1.0 2,-0.4 -33,-0.2 -1,-0.4 -0.142 55.1-121.4 -51.7 143.9 4.1 -17.0 58.7 136 198 A Q E -d 105 0A 91 -32,-2.7 -30,-1.9 -35,-0.2 2,-0.5 -0.769 19.2-122.0 -94.7 133.3 6.6 -15.0 60.8 137 199 A R E -d 106 0A 77 -2,-0.4 -30,-0.2 -32,-0.2 3,-0.1 -0.584 23.6-175.3 -76.6 120.8 8.7 -12.2 59.2 138 200 A I E S+ 0 0 17 -32,-2.8 2,-0.3 -2,-0.5 -31,-0.2 0.566 71.4 12.1 -91.4 -11.0 12.4 -12.9 59.6 139 201 A F E S-d 107 0A 25 -33,-0.7 -31,-0.6 25,-0.1 -1,-0.3 -0.914 88.7 -86.8-167.9 140.0 13.4 -9.6 58.0 140 202 A E E - 0 0 115 -2,-0.3 -32,-0.2 1,-0.1 -2,-0.0 0.048 52.2 -91.4 -47.1 148.8 11.9 -6.3 56.9 141 203 A L E - 0 0 38 -34,-0.1 2,-0.6 1,-0.1 -32,-0.2 -0.301 38.2-132.7 -61.8 141.9 10.4 -5.7 53.5 142 204 A G E -d 109 0A 3 -34,-2.5 -32,-3.7 -3,-0.1 2,-0.9 -0.891 14.7-164.2-104.7 121.5 12.8 -4.4 50.9 143 205 A L E -d 110 0A 80 -2,-0.6 2,-0.4 -34,-0.2 -32,-0.2 -0.760 10.9-169.0-104.4 87.4 11.6 -1.5 48.8 144 206 A G E -d 111 0A 0 -34,-2.9 -32,-2.6 -2,-0.9 2,-0.7 -0.604 7.5-152.9 -79.9 130.6 13.9 -1.3 45.7 145 207 A D E >> -d 112 0A 18 -2,-0.4 4,-0.7 4,-0.2 3,-0.6 -0.891 14.0-175.5-109.2 110.9 13.6 1.9 43.6 146 208 A D T 34 S+ 0 0 90 -34,-1.2 -33,-0.2 -2,-0.7 4,-0.2 0.797 84.9 64.0 -71.3 -29.7 14.5 1.5 40.0 147 209 A D T 34 S+ 0 0 48 2,-0.1 -1,-0.2 3,-0.1 -34,-0.1 0.758 119.9 25.7 -65.5 -23.8 14.0 5.2 39.3 148 210 A G T <4 S- 0 0 47 -3,-0.6 2,-0.2 0, 0.0 -2,-0.2 0.657 136.9 -52.7 -99.6 -97.6 16.9 5.7 41.8 149 211 A N X - 0 0 44 -4,-0.7 4,-2.4 1,-0.1 -3,-0.2 -0.615 46.5-178.2-153.8 90.4 19.1 2.6 41.8 150 212 A L H > S+ 0 0 8 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.901 84.2 60.4 -50.0 -50.1 17.5 -0.7 42.4 151 213 A E H > S+ 0 0 4 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.935 109.6 40.5 -45.7 -60.3 20.9 -2.5 42.3 152 214 A E H > S+ 0 0 10 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.900 112.0 56.6 -58.6 -42.1 22.3 -0.6 45.2 153 215 A D H X S+ 0 0 60 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.928 109.8 47.1 -54.5 -43.7 18.9 -0.8 47.0 154 216 A F H X S+ 0 0 0 -4,-3.2 4,-3.4 2,-0.2 5,-0.2 0.941 111.7 50.3 -62.6 -48.9 19.3 -4.6 46.7 155 217 A I H X S+ 0 0 11 -4,-2.6 4,-2.8 -5,-0.2 5,-0.3 0.979 109.8 48.4 -51.6 -65.2 22.9 -4.5 47.9 156 218 A T H X S+ 0 0 55 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.829 117.6 43.6 -43.7 -43.0 22.2 -2.5 51.0 157 219 A W H >X S+ 0 0 13 -4,-1.8 4,-2.5 -5,-0.3 3,-0.9 0.952 111.2 51.1 -70.7 -53.7 19.3 -4.8 51.8 158 220 A R H 3X S+ 0 0 54 -4,-3.4 4,-1.8 1,-0.3 -2,-0.2 0.908 106.4 57.5 -50.0 -47.7 21.1 -8.1 51.1 159 221 A E H 3< S+ 0 0 106 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.802 113.0 37.7 -55.9 -36.2 24.0 -7.0 53.3 160 222 A Q H S+ 0 0 67 0, 0.0 4,-2.9 0, 0.0 -1,-0.2 0.956 109.8 49.9 -60.8 -49.0 23.2 -11.4 59.4 164 226 A A H X S+ 0 0 30 -4,-1.7 4,-3.0 2,-0.2 5,-0.3 0.967 114.3 46.2 -51.6 -53.8 19.6 -11.2 60.6 165 227 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.4 0.979 112.1 49.7 -50.1 -66.5 19.1 -14.7 59.1 166 228 A C H X>S+ 0 0 16 -4,-3.6 5,-2.1 1,-0.2 4,-0.8 0.790 115.1 46.2 -41.7 -38.4 22.4 -16.0 60.6 167 229 A E H <5S+ 0 0 169 -4,-2.9 3,-0.3 3,-0.2 -1,-0.2 0.947 108.8 50.1 -75.1 -51.2 21.4 -14.6 64.0 168 230 A F H <5S+ 0 0 103 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.862 125.3 31.6 -56.1 -35.4 17.8 -15.8 64.2 169 231 A F H <5S- 0 0 28 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.523 107.0-123.7-100.3 -8.9 19.0 -19.3 63.2 170 232 A G T <5 + 0 0 56 -4,-0.8 2,-0.3 -5,-0.4 -3,-0.2 0.998 55.6 146.5 61.9 71.1 22.4 -19.2 64.8 171 233 A V < - 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0 0 16 -2,-0.6 4,-2.5 -46,-0.2 5,-0.3 -0.315 37.2 -83.5 -88.4 179.0 29.2 -2.0 29.1 365 427 A I H > S+ 0 0 2 -48,-0.5 4,-2.5 1,-0.2 5,-0.2 0.919 127.7 47.3 -46.6 -59.2 31.3 -5.2 29.3 366 428 A L H > S+ 0 0 5 -51,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.901 111.3 53.5 -53.4 -42.8 33.6 -4.5 26.3 367 429 A A H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.962 109.7 46.3 -56.9 -52.5 34.2 -1.0 27.7 368 430 A I H X S+ 0 0 0 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.854 110.3 55.1 -58.7 -34.5 35.2 -2.3 31.1 369 431 A L H < S+ 0 0 0 -4,-2.5 6,-0.3 -5,-0.3 -1,-0.2 0.915 111.3 44.0 -65.1 -40.2 37.4 -4.9 29.3 370 432 A Q H < S+ 0 0 24 -4,-2.4 781,-0.2 -5,-0.2 -2,-0.2 0.848 115.5 47.5 -74.1 -32.2 39.2 -2.1 27.5 371 433 A D H < S+ 0 0 35 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.644 118.8 39.4 -85.2 -13.6 39.5 0.1 30.6 372 434 A Y S >< S+ 0 0 16 -4,-1.5 3,-3.5 -5,-0.2 -1,-0.3 -0.501 71.0 171.5-130.4 62.3 40.8 -2.7 32.8 373 435 A P T 3 S+ 0 0 70 0, 0.0 -41,-0.1 0, 0.0 -1,-0.1 0.664 72.9 67.6 -47.1 -23.4 43.1 -4.5 30.4 374 436 A S T 3 S+ 0 0 16 1,-0.1 -42,-1.9 -43,-0.1 2,-1.1 0.681 82.4 91.3 -74.2 -11.8 44.5 -6.6 33.1 375 437 A L B < +P 331 0G 0 -3,-3.5 -44,-0.3 -44,-0.3 -3,-0.1 -0.706 45.3 152.2 -86.1 98.8 41.0 -8.2 33.2 376 438 A R - 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