==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-NOV-08 3FCX . COMPND 2 MOLECULE: S-FORMYLGLUTATHIONE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.WU,Y.LI,G.SONG,D.ZHANG,N.SHAW,Z.J.LIU . 543 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20623.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 385 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 55 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 38 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 147 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.8 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 3 3 4 2 0 2 1 5 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 3 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 PARALLEL BRIDGES PER LADDER . 3 0 0 2 0 0 2 0 2 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 0 0 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 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 M 0 0 146 0, 0.0 2,-0.1 0, 0.0 126,-0.0 0.000 360.0 360.0 360.0 160.3 22.6 25.3 23.7 2 2 A A - 0 0 76 1,-0.1 20,-0.4 20,-0.0 2,-0.3 -0.295 360.0-165.0 -77.4 136.3 21.9 23.9 20.4 3 3 A L - 0 0 43 18,-0.1 2,-0.5 -2,-0.1 18,-0.2 -0.825 14.9-145.8-116.6 151.7 18.7 24.6 18.5 4 4 A K E -A 20 0A 129 16,-2.3 16,-2.3 -2,-0.3 2,-0.5 -0.980 21.5-136.7-114.1 120.0 16.9 23.0 15.5 5 5 A Q E +A 19 0A 98 -2,-0.5 14,-0.2 14,-0.2 3,-0.1 -0.647 23.0 178.3 -76.9 124.4 15.0 25.5 13.4 6 6 A I E - 0 0 69 12,-3.0 2,-0.3 -2,-0.5 13,-0.2 0.817 64.2 -8.1 -91.5 -41.6 11.6 24.0 12.4 7 7 A S E -A 18 0A 36 11,-1.4 11,-1.8 2,-0.0 -1,-0.3 -0.988 50.1-165.7-155.3 159.2 10.2 27.0 10.4 8 8 A S E +A 17 0A 45 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.933 13.3 169.9-151.1 127.5 10.8 30.6 9.5 9 9 A N E -A 16 0A 105 7,-2.1 7,-3.1 -2,-0.3 2,-0.2 -0.986 32.3-122.3-142.2 129.1 8.4 33.0 7.9 10 10 A K E +A 15 0A 161 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.472 35.7 170.5 -72.1 136.9 8.7 36.8 7.4 11 11 A C E > -A 14 0A 35 3,-2.7 3,-1.5 -2,-0.2 -2,-0.0 -0.930 65.6 -14.9-153.9 119.3 5.9 38.8 9.0 12 12 A F T 3 S- 0 0 112 -2,-0.3 2,-0.1 1,-0.3 3,-0.1 0.888 126.6 -54.7 48.9 45.3 5.8 42.6 9.4 13 13 A G T 3 S+ 0 0 44 1,-0.3 -1,-0.3 24,-0.1 2,-0.1 0.037 125.0 85.2 85.5 -30.2 9.5 42.9 8.6 14 14 A G E < S-A 11 0A 3 -3,-1.5 -3,-2.7 -2,-0.1 2,-0.5 -0.273 81.2-103.5 -92.3-175.1 10.6 40.5 11.3 15 15 A L E -AB 10 36A 62 21,-2.3 21,-2.6 -5,-0.2 2,-0.7 -0.957 15.8-152.4-118.5 121.0 10.9 36.7 11.3 16 16 A Q E +AB 9 35A 13 -7,-3.1 -7,-2.1 -2,-0.5 2,-0.3 -0.837 30.6 176.9 -85.5 115.7 8.5 34.3 12.9 17 17 A K E -AB 8 34A 27 17,-3.2 17,-2.3 -2,-0.7 2,-0.4 -0.782 24.4-154.6-117.3 160.0 10.5 31.2 13.8 18 18 A V E -AB 7 33A 0 -11,-1.8 -12,-3.0 -2,-0.3 -11,-1.4 -0.994 19.0-174.3-130.1 137.4 9.8 27.9 15.6 19 19 A F E -AB 5 32A 17 13,-3.0 13,-2.2 -2,-0.4 2,-0.4 -0.897 15.8-148.1-128.4 157.7 12.6 25.9 17.2 20 20 A E E +AB 4 31A 48 -16,-2.3 -16,-2.3 -2,-0.3 2,-0.3 -0.953 23.5 167.0-120.7 145.0 13.1 22.6 18.9 21 21 A H E - B 0 30A 3 9,-2.0 9,-2.5 -2,-0.4 2,-0.8 -0.957 42.6 -97.3-147.6 167.5 15.6 21.9 21.8 22 22 A D E - B 0 29A 86 -20,-0.4 2,-0.5 -2,-0.3 7,-0.2 -0.818 41.5-146.0 -87.3 110.5 16.5 19.3 24.4 23 23 A S E >> - B 0 28A 7 5,-2.9 4,-0.9 -2,-0.8 5,-0.7 -0.679 15.1-166.5 -82.9 126.2 14.9 20.4 27.6 24 24 A V T 45S+ 0 0 66 -2,-0.5 -1,-0.2 2,-0.2 437,-0.1 0.874 92.0 46.1 -72.2 -40.5 16.8 19.7 30.8 25 25 A E T 45S+ 0 0 10 1,-0.2 -1,-0.1 3,-0.1 91,-0.1 0.874 121.3 36.1 -69.4 -36.9 13.8 20.5 33.0 26 26 A L T 45S- 0 0 0 2,-0.2 -1,-0.2 85,-0.1 -2,-0.2 0.502 96.1-133.3-101.7 -7.0 11.2 18.6 31.0 27 27 A N T <5S+ 0 0 96 -4,-0.9 2,-0.3 1,-0.2 -3,-0.2 0.820 74.4 70.8 59.6 35.8 13.4 15.6 29.9 28 28 A C E - 0 0 3 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.172 36.3 -91.6 -72.5 171.1 11.5 41.9 15.0 38 38 A P G > S+ 0 0 52 0, 0.0 3,-1.9 0, 0.0 4,-0.4 0.857 125.8 64.9 -48.5 -37.5 13.3 44.3 12.7 39 39 A K G >> S+ 0 0 70 33,-0.3 4,-2.5 1,-0.3 3,-1.5 0.838 90.4 65.0 -53.6 -36.4 15.2 45.6 15.8 40 40 A A G <4 S+ 0 0 15 -3,-1.5 -1,-0.3 1,-0.3 5,-0.1 0.625 86.2 72.2 -68.7 -13.4 16.8 42.1 16.2 41 41 A E G <4 S+ 0 0 174 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.840 119.8 11.1 -64.5 -33.5 18.7 42.6 12.9 42 42 A T T <4 S+ 0 0 130 -3,-1.5 2,-0.3 -4,-0.4 -2,-0.2 0.633 126.7 24.2-123.4 -21.1 21.0 45.1 14.5 43 43 A G S < S- 0 0 28 -4,-2.5 2,-0.3 87,-0.1 -1,-0.2 -0.906 78.9 -84.6-146.1 168.7 20.6 45.1 18.3 44 44 A K - 0 0 135 -2,-0.3 87,-0.3 87,-0.1 -3,-0.0 -0.595 45.8-153.7 -76.7 138.7 19.5 43.3 21.4 45 45 A C E -d 131 0A 0 85,-2.2 87,-2.9 -2,-0.3 90,-0.2 -0.819 19.1-107.4-113.0 150.9 15.8 43.5 22.2 46 46 A P E - 0 0 0 0, 0.0 31,-2.4 0, 0.0 2,-0.4 -0.422 43.2-126.8 -65.6 155.2 13.7 43.3 25.3 47 47 A A E -de 136 77A 1 88,-2.5 90,-2.2 85,-0.4 2,-0.5 -0.882 20.4-167.2-116.3 140.1 11.8 39.9 25.5 48 48 A L E -de 137 78A 0 29,-2.8 31,-2.3 -2,-0.4 2,-0.4 -0.992 12.5-153.2-126.0 121.2 8.1 39.2 26.0 49 49 A Y E -de 138 79A 2 88,-2.5 90,-2.6 -2,-0.5 2,-0.5 -0.817 4.5-157.7 -98.1 130.5 7.0 35.7 26.8 50 50 A W E -d 139 0A 0 29,-3.1 2,-0.5 -2,-0.4 90,-0.3 -0.940 1.1-159.2-109.0 126.7 3.5 34.4 25.9 51 51 A L E -d 140 0A 0 88,-2.4 90,-1.9 -2,-0.5 97,-0.1 -0.906 14.4-146.8-104.9 123.8 2.0 31.4 27.7 52 52 A S - 0 0 0 -2,-0.5 95,-0.1 29,-0.5 3,-0.1 -0.388 7.6-132.0 -87.1 163.7 -0.9 29.6 25.9 53 53 A G > - 0 0 0 1,-0.2 3,-1.3 90,-0.2 -1,-0.1 -0.055 51.3 -27.7 -97.2-158.3 -3.9 27.9 27.4 54 54 A L T 3 S+ 0 0 42 1,-0.2 -1,-0.2 -2,-0.1 3,-0.1 -0.137 122.3 10.1 -60.2 143.4 -5.6 24.6 26.8 55 55 A T T 3 S+ 0 0 141 1,-0.2 2,-0.3 -3,-0.1 -1,-0.2 0.523 100.2 127.7 70.5 8.7 -5.4 22.6 23.6 56 56 A C < - 0 0 10 -3,-1.3 27,-0.6 3,-0.0 -1,-0.2 -0.713 37.0-176.8-100.6 144.7 -2.7 25.0 22.3 57 57 A T - 0 0 62 -2,-0.3 4,-0.5 25,-0.1 3,-0.2 -0.318 58.9 -81.4-104.9-162.6 0.7 24.4 20.9 58 58 A E S > S+ 0 0 3 -2,-0.2 4,-1.3 1,-0.2 3,-0.2 0.741 122.0 71.9 -71.6 -27.5 2.9 27.1 20.0 59 59 A Q H > S+ 0 0 83 1,-0.2 4,-2.0 2,-0.2 5,-0.3 0.826 84.4 64.6 -59.0 -38.2 1.1 27.5 16.6 60 60 A N H > S+ 0 0 36 -3,-0.2 4,-2.2 1,-0.2 5,-0.3 0.948 106.3 39.8 -58.1 -55.8 -2.2 29.0 17.9 61 61 A F H > S+ 0 0 0 -4,-0.5 4,-1.7 1,-0.2 6,-0.4 0.913 117.0 49.2 -61.8 -45.8 -0.8 32.2 19.3 62 62 A I H < S+ 0 0 14 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.815 120.7 34.3 -69.0 -29.4 1.6 32.8 16.4 63 63 A S H < S+ 0 0 87 -4,-2.0 -1,-0.2 -3,-0.1 -2,-0.2 0.727 128.5 30.3 -96.2 -23.2 -0.9 32.3 13.6 64 64 A K H < S+ 0 0 116 -4,-2.2 191,-0.2 -5,-0.3 -3,-0.2 0.570 101.5 69.1-116.8 -13.6 -4.1 33.7 15.2 65 65 A S S < S- 0 0 0 -4,-1.7 193,-0.2 -5,-0.3 -3,-0.1 0.739 78.1-142.6 -85.4 -24.0 -3.3 36.5 17.6 66 66 A G + 0 0 48 -5,-0.3 4,-0.4 -4,-0.2 3,-0.3 0.809 53.0 139.3 63.9 32.1 -2.1 39.2 15.2 67 67 A Y > + 0 0 1 -6,-0.4 4,-2.2 1,-0.2 5,-0.2 0.656 44.0 86.7 -76.7 -17.3 0.5 40.4 17.6 68 68 A H H > S+ 0 0 13 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.837 79.3 56.5 -59.4 -43.9 3.2 40.8 15.0 69 69 A Q H > S+ 0 0 91 -3,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.951 114.1 38.4 -56.3 -52.1 2.5 44.4 13.8 70 70 A S H > S+ 0 0 3 -4,-0.4 4,-2.5 2,-0.2 5,-0.3 0.883 115.8 52.4 -69.0 -38.4 2.8 45.9 17.3 71 71 A A H X>S+ 0 0 0 -4,-2.2 5,-2.2 1,-0.2 4,-1.3 0.894 112.6 47.1 -61.3 -38.9 5.8 43.7 18.3 72 72 A S H <5S+ 0 0 22 -4,-2.9 -33,-0.3 -5,-0.2 -2,-0.2 0.933 112.4 48.2 -66.0 -48.0 7.5 44.7 15.1 73 73 A E H <5S+ 0 0 127 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.908 119.9 37.2 -63.0 -42.4 6.8 48.5 15.6 74 74 A H H <5S- 0 0 50 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.646 109.6-122.9 -84.8 -17.2 8.0 48.5 19.2 75 75 A G T <5 + 0 0 2 -4,-1.3 2,-0.4 -5,-0.3 -3,-0.2 0.954 50.3 159.1 75.2 52.3 10.8 46.0 18.6 76 76 A L < - 0 0 0 -5,-2.2 2,-0.5 -31,-0.1 -1,-0.2 -0.909 39.3-136.3-106.3 132.9 10.0 43.2 21.1 77 77 A V E - e 0 47A 0 -31,-2.4 -29,-2.8 -2,-0.4 2,-0.5 -0.766 26.6-155.7 -77.7 129.1 11.3 39.6 20.8 78 78 A V E -Ce 35 48A 1 -43,-1.3 -43,-2.5 -2,-0.5 2,-0.5 -0.959 8.9-166.4-117.4 124.1 8.3 37.4 21.5 79 79 A I E -Ce 34 49A 0 -31,-2.3 -29,-3.1 -2,-0.5 -45,-0.2 -0.936 6.3-178.4-113.0 125.9 8.7 33.9 22.8 80 80 A A E -C 33 0A 1 -47,-2.3 -47,-2.6 -2,-0.5 -29,-0.1 -0.874 10.6-165.8-126.8 96.5 5.8 31.4 22.8 81 81 A P E -C 32 0A 0 0, 0.0 -29,-0.5 0, 0.0 -49,-0.2 -0.353 31.7 -94.9 -74.4 160.8 6.7 28.0 24.3 82 82 A D - 0 0 32 -51,-2.1 -25,-0.1 1,-0.1 -24,-0.0 -0.295 35.2-121.1 -61.2 161.4 4.5 24.9 23.9 83 83 A T S S+ 0 0 14 -27,-0.6 16,-0.3 1,-0.2 14,-0.2 0.712 82.4 6.9 -83.9 -22.5 2.2 24.3 26.9 84 84 A S - 0 0 28 1,-0.1 -1,-0.2 12,-0.1 27,-0.1 -0.988 62.7-119.2-157.0 157.2 3.4 20.9 28.0 85 85 A P S S+ 0 0 24 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.826 99.7 32.7 -67.5 -31.6 6.1 18.2 27.4 86 86 A R S S- 0 0 108 1,-0.1 3,-0.1 -3,-0.1 -58,-0.0 -0.808 91.3 -92.4-126.3 162.9 3.4 15.7 26.4 87 87 A G - 0 0 68 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 -0.140 57.7 -78.0 -65.7 168.4 0.0 15.5 24.7 88 88 A C - 0 0 89 1,-0.1 -1,-0.1 -4,-0.1 7,-0.1 -0.473 23.9-149.6 -76.7 137.1 -3.3 15.8 26.6 89 89 A N 0 0 129 6,-0.3 -1,-0.1 -2,-0.2 6,-0.1 0.570 360.0 360.0 -78.2 -11.5 -4.6 12.7 28.4 90 90 A I 0 0 140 4,-0.3 5,-0.1 0, 0.0 -1,-0.1 0.825 360.0 360.0 -98.9 360.0 -8.2 14.0 27.8 91 ! 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 92 99 A F 0 0 238 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 34.1 -14.3 16.3 33.5 93 100 A G - 0 0 21 1,-0.1 83,-0.1 2,-0.0 84,-0.1 -0.099 360.0-103.3 91.6 168.0 -11.2 18.4 33.9 94 101 A T - 0 0 17 82,-0.3 -4,-0.3 2,-0.2 -1,-0.1 0.724 34.9-139.9 -95.4 -29.3 -8.7 19.9 31.6 95 102 A G + 0 0 27 1,-0.3 -6,-0.3 81,-0.1 2,-0.2 0.391 62.2 125.8 79.1 -1.5 -5.9 17.3 32.0 96 103 A A - 0 0 19 -8,-0.1 -1,-0.3 1,-0.1 -2,-0.2 -0.482 63.3-134.6 -92.3 161.0 -3.4 20.2 32.0 97 104 A G > - 0 0 1 -14,-0.2 3,-1.4 -2,-0.2 -1,-0.1 0.365 29.1-130.0-102.2 1.7 -0.8 21.1 34.6 98 105 A F T 3 - 0 0 0 1,-0.3 -45,-0.0 15,-0.0 -2,-0.0 0.771 60.1 -69.8 60.0 32.4 -1.3 24.8 35.1 99 106 A Y T 3 S+ 0 0 1 -16,-0.3 -1,-0.3 1,-0.2 2,-0.2 0.781 95.6 139.2 58.4 30.5 2.4 25.8 34.7 100 107 A V < - 0 0 0 -3,-1.4 13,-1.1 13,-0.1 2,-0.8 -0.508 64.7-112.9 -92.2 165.9 3.4 24.2 38.0 101 108 A D B -I 112 0B 9 11,-0.2 11,-0.2 12,-0.2 7,-0.1 -0.940 48.3-128.1 -91.5 108.5 6.4 22.2 38.9 102 109 A A - 0 0 0 9,-2.8 83,-0.2 -2,-0.8 82,-0.1 -0.267 28.8-174.5 -65.1 144.2 4.6 18.9 39.6 103 110 A T + 0 0 23 81,-2.7 2,-0.4 2,-0.1 82,-0.2 0.400 61.6 79.6-116.6 -4.6 5.2 17.1 42.9 104 111 A E S > S- 0 0 70 80,-1.6 4,-2.7 82,-0.1 3,-0.4 -0.891 84.4 -86.2-109.1 137.0 3.1 13.9 42.1 105 112 A D T 4 S+ 0 0 117 -2,-0.4 -2,-0.1 1,-0.3 0, 0.0 -0.513 105.9 21.4 -71.1 147.1 4.3 10.9 40.1 106 113 A P T >> S+ 0 0 80 0, 0.0 3,-0.9 0, 0.0 4,-0.5 -0.996 129.6 47.5 -87.0 -3.2 4.2 10.4 37.2 107 114 A W H >> S+ 0 0 51 -3,-0.4 4,-2.9 1,-0.2 3,-0.8 0.834 99.7 75.3 -61.9 -35.8 3.9 14.1 36.4 108 115 A K H 3< S+ 0 0 40 -4,-2.7 -1,-0.2 1,-0.2 -3,-0.2 0.816 91.0 52.1 -34.0 -53.0 6.8 14.7 38.9 109 116 A T H <4 S+ 0 0 76 -3,-0.9 -1,-0.2 1,-0.1 -2,-0.2 0.809 129.0 8.8 -69.7 -32.1 9.5 13.4 36.5 110 117 A N H << S+ 0 0 34 -3,-0.8 2,-1.8 -4,-0.5 -2,-0.2 0.693 100.4 87.7-124.5 -32.1 8.7 15.6 33.5 111 118 A Y < + 0 0 5 -4,-2.9 -9,-2.8 -5,-0.2 3,-0.2 -0.568 42.7 136.9 -82.5 84.1 6.1 18.3 34.2 112 119 A R B > +I 101 0B 10 -2,-1.8 4,-2.0 -11,-0.2 -11,-0.2 -0.416 14.1 143.6-121.3 50.2 8.4 21.0 35.4 113 120 A M H > + 0 0 0 -13,-1.1 4,-2.7 2,-0.2 -12,-0.2 0.790 65.7 57.2 -68.5 -31.5 6.8 23.9 33.5 114 121 A Y H > S+ 0 0 29 -14,-0.6 4,-2.3 2,-0.2 5,-0.3 0.960 112.8 40.6 -63.2 -50.3 7.3 26.5 36.2 115 122 A S H >>S+ 0 0 6 2,-0.2 4,-2.1 1,-0.2 5,-1.9 0.847 114.8 54.3 -66.1 -34.7 11.1 26.0 36.2 116 123 A Y H <>S+ 0 0 0 -4,-2.0 5,-3.2 3,-0.2 -2,-0.2 0.955 113.8 39.6 -61.6 -53.9 11.1 25.7 32.4 117 124 A V H <5S+ 0 0 1 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.881 125.0 35.9 -62.9 -41.9 9.3 29.0 31.9 118 125 A T H <5S+ 0 0 1 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.742 135.2 8.5 -88.6 -26.2 11.1 31.0 34.6 119 126 A E T X5S+ 0 0 30 -4,-2.1 4,-1.6 -5,-0.3 -3,-0.2 0.749 124.5 40.6-121.8 -60.6 14.7 29.5 34.5 120 127 A E H > S+ 0 0 8 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.891 110.5 52.9 -59.9 -36.7 15.1 32.4 29.4 123 130 A Q H X S+ 0 0 83 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.919 112.0 45.9 -59.2 -43.7 18.6 31.0 29.7 124 131 A L H X S+ 0 0 12 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.914 113.3 48.3 -66.4 -45.1 18.3 29.4 26.3 125 132 A I H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 3,-0.5 0.929 111.4 50.2 -60.5 -46.5 16.8 32.5 24.7 126 133 A N H < S+ 0 0 52 -4,-2.7 5,-0.3 1,-0.2 -1,-0.2 0.826 112.1 47.8 -63.8 -33.0 19.5 34.7 26.1 127 134 A A H < S+ 0 0 74 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.735 122.5 32.3 -77.2 -23.8 22.3 32.4 24.9 128 135 A N H < S+ 0 0 62 -4,-1.3 -2,-0.2 -3,-0.5 -3,-0.2 0.606 112.8 47.5-113.2 -19.0 20.8 32.0 21.3 129 136 A F S < S- 0 0 23 -4,-2.3 2,-2.1 -5,-0.2 -85,-0.0 -0.839 87.4 -96.1-129.8 161.3 19.1 35.2 20.3 130 137 A P S S+ 0 0 39 0, 0.0 -85,-2.2 0, 0.0 2,-0.4 -0.520 72.7 139.2 -76.7 79.4 19.7 39.0 20.3 131 138 A V E -d 45 0A 1 -2,-2.1 -87,-0.1 -87,-0.3 -2,-0.1 -0.963 57.8-124.5-127.3 139.4 17.8 39.6 23.6 132 139 A D E > - 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0 0 1 -21,-2.0 3,-1.2 -5,-0.1 16,-0.2 0.678 47.3-147.9 -69.7 -20.2 18.7 24.2 54.1 372 105 B F T 3 - 0 0 0 -22,-0.2 -1,-0.1 1,-0.2 3,-0.1 0.561 46.7 -91.2 59.2 13.4 20.7 26.8 52.1 373 106 B Y T 3 S+ 0 0 0 -23,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.855 91.4 125.3 52.7 40.1 17.6 29.0 51.9 374 107 B V < - 0 0 1 -3,-1.2 14,-1.0 14,-0.1 13,-0.9 -0.795 68.0-120.6-114.0 162.4 16.5 27.5 48.6 375 108 B D B -S 386 0E 19 -2,-0.3 11,-0.2 11,-0.2 7,-0.1 -0.939 40.8-133.5 -98.3 105.8 13.2 25.9 47.6 376 109 B A - 0 0 4 9,-3.1 83,-0.2 -2,-0.7 82,-0.1 -0.316 23.7-172.5 -63.5 142.4 14.4 22.5 46.6 377 110 B T + 0 0 19 81,-2.3 2,-0.3 2,-0.1 82,-0.2 0.527 59.4 81.7-109.0 -14.6 13.2 21.1 43.2 378 111 B E S >> S- 0 0 64 80,-2.1 3,-1.7 79,-0.1 4,-0.7 -0.749 83.1 -80.5-102.3 140.5 14.5 17.6 43.5 379 112 B D T 34 S+ 0 0 89 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.0 -0.494 108.9 23.9 -64.3 144.0 13.2 14.5 45.3 380 113 B P T 34 S+ 0 0 57 0, 0.0 -1,-0.3 0, 0.0 4,-0.3 -0.922 126.1 51.0 -92.5 18.7 13.3 13.7 48.2 381 114 B W T <> S+ 0 0 19 -3,-1.7 4,-2.3 76,-0.2 -5,-0.3 0.598 82.1 91.3 -92.9 -13.8 13.8 17.4 49.2 382 115 B K T < S+ 0 0 20 -4,-0.7 -1,-0.2 1,-0.2 -3,-0.1 0.797 88.3 43.0 -52.4 -41.8 10.8 19.0 47.3 383 116 B T T 4 S+ 0 0 64 -3,-0.3 -1,-0.2 1,-0.1 -2,-0.1 0.855 128.1 19.8 -82.7 -37.1 8.2 18.8 50.0 384 117 B N T 4 S+ 0 0 19 -4,-0.3 2,-1.7 -3,-0.2 -2,-0.2 0.719 104.2 78.3-106.9 -28.1 10.1 19.9 53.2 385 118 B Y < + 0 0 2 -4,-2.3 -9,-3.1 1,-0.2 -1,-0.1 -0.500 53.3 121.6 -90.2 71.2 13.2 21.8 52.0 386 119 B R B > +S 375 0E 40 -2,-1.7 4,-2.2 -11,-0.2 -11,-0.2 -0.358 18.1 143.3-124.0 48.7 11.5 25.1 51.1 387 120 B M H > + 0 0 1 -13,-0.9 4,-2.5 -16,-0.2 -12,-0.2 0.772 69.0 60.5 -63.3 -27.5 13.5 27.4 53.4 388 121 B Y H > S+ 0 0 19 -14,-1.0 4,-2.2 2,-0.2 5,-0.3 0.972 110.5 38.6 -63.0 -54.1 13.4 30.2 50.8 389 122 B S H >>S+ 0 0 9 2,-0.2 4,-2.2 1,-0.2 5,-1.9 0.827 115.1 56.4 -65.1 -32.2 9.6 30.4 50.8 390 123 B Y H <>S+ 0 0 0 -4,-2.2 5,-3.2 3,-0.2 -2,-0.2 0.966 113.1 38.7 -61.1 -53.0 9.6 29.8 54.6 391 124 B V H <5S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.832 126.7 34.6 -68.6 -35.0 11.8 32.8 55.3 392 125 B T H <5S+ 0 0 1 -4,-2.2 -1,-0.2 -5,-0.2 -3,-0.2 0.733 134.4 11.7 -95.2 -25.8 10.3 35.2 52.6 393 126 B E T X5S+ 0 0 36 -4,-2.2 4,-1.8 -5,-0.3 -3,-0.2 0.758 125.0 37.1-117.4 -66.3 6.6 34.2 52.7 394 127 B E H > S+ 0 0 5 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.885 112.7 51.8 -60.9 -35.3 6.8 37.0 57.8 397 130 B Q H X S+ 0 0 75 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.913 112.4 45.7 -61.2 -44.5 3.1 36.3 57.4 398 131 B L H X S+ 0 0 35 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.897 114.3 47.8 -65.5 -43.1 3.1 34.4 60.7 399 132 B I H >X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 3,-0.6 0.944 111.6 49.6 -63.5 -49.8 5.0 37.2 62.4 400 133 B N H 3< S+ 0 0 56 -4,-2.7 5,-0.3 1,-0.2 -1,-0.2 0.865 112.9 47.9 -56.7 -38.7 2.8 40.0 61.1 401 134 B A H 3< S+ 0 0 82 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.723 123.7 29.5 -76.4 -22.7 -0.3 38.1 62.2 402 135 B N H << S+ 0 0 83 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.592 113.7 52.6-115.4 -16.9 0.9 37.4 65.7 403 136 B F S < S- 0 0 22 -4,-2.5 2,-2.7 -5,-0.2 -1,-0.1 -0.873 87.2-100.8-129.7 155.5 3.3 40.1 66.8 404 137 B P S S+ 0 0 71 0, 0.0 2,-0.4 0, 0.0 -4,-0.1 -0.385 71.1 143.5 -74.0 66.9 3.3 44.0 66.9 405 138 B V - 0 0 15 -2,-2.7 -2,-0.1 -5,-0.3 5,-0.1 -0.884 56.7-124.8-114.2 136.8 5.3 44.2 63.7 406 139 B D > - 0 0 46 -94,-2.8 3,-1.5 -2,-0.4 -92,-0.4 -0.729 18.8-156.3 -75.6 111.0 5.1 46.8 61.0 407 140 B P T 3 S+ 0 0 67 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.705 90.9 56.3 -65.0 -17.6 4.5 44.7 57.9 408 141 B Q T 3 S+ 0 0 125 1,-0.2 2,-0.5 -3,-0.0 -2,-0.0 0.515 100.5 61.2 -90.5 -8.8 5.9 47.5 55.7 409 142 B R < + 0 0 79 -3,-1.5 -95,-2.4 -97,-0.2 2,-0.3 -0.875 65.7 139.5-127.8 99.8 9.3 47.8 57.5 410 143 B M E -n 314 0C 13 -2,-0.5 24,-2.6 22,-0.3 25,-0.3 -0.992 21.1-178.8-142.3 139.0 11.5 44.7 57.4 411 144 B S E -n 315 0C 0 -97,-2.1 -95,-2.7 -2,-0.3 2,-0.3 -0.887 11.5-147.6-133.6 169.7 15.2 44.0 57.0 412 145 B I E +no 316 436C 0 23,-1.7 25,-1.2 -2,-0.3 2,-0.3 -0.995 19.8 156.8-144.6 142.8 17.4 40.9 56.9 413 146 B F E +no 317 437C 0 -97,-2.7 -95,-2.7 -2,-0.3 2,-0.3 -0.938 8.9 156.8-152.7 173.1 20.9 39.8 57.8 414 147 B G E -no 318 438C 0 23,-0.6 25,-2.6 -2,-0.3 2,-0.4 -0.990 34.0 -91.4 177.4-178.5 22.8 36.6 58.6 415 148 B H E > S- o 0 439C 11 -97,-1.9 3,-2.7 -2,-0.3 25,-0.2 -0.967 72.7 -45.3-126.4 127.0 26.0 34.6 58.9 416 149 B S T >> S+ 0 0 2 23,-2.6 4,-2.8 -2,-0.4 26,-1.2 -0.308 139.4 14.4 61.0-120.9 27.7 32.3 56.3 417 150 B M H 3> S+ 0 0 0 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.870 137.1 49.6 -48.5 -35.6 24.9 30.1 54.8 418 151 B G H <> S+ 0 0 0 -3,-2.7 4,-2.4 2,-0.2 -2,-0.3 0.702 105.5 55.0 -76.1 -22.8 22.6 32.7 56.4 419 152 B G H <> S+ 0 0 0 -3,-1.1 4,-2.5 20,-0.2 -2,-0.2 0.905 109.8 46.7 -71.6 -47.0 24.7 35.6 54.9 420 153 B H H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.955 113.3 51.0 -49.4 -53.5 24.0 33.9 51.5 421 154 B G H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.912 110.3 47.0 -55.9 -48.5 20.4 33.6 52.6 422 155 B A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.932 113.8 48.0 -61.1 -46.8 20.0 37.3 53.6 423 156 B L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.916 114.8 43.7 -60.9 -47.5 21.7 38.5 50.4 424 157 B I H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.863 110.8 55.4 -70.9 -33.2 19.6 36.4 48.0 425 158 B C H < S+ 0 0 0 -4,-2.3 4,-0.5 -5,-0.3 -1,-0.2 0.909 113.8 41.2 -63.9 -41.5 16.3 37.1 49.9 426 159 B A H >< S+ 0 0 3 -4,-2.0 3,-0.8 -5,-0.2 6,-0.3 0.930 117.1 47.4 -68.8 -46.2 16.9 40.9 49.5 427 160 B L H 3< S+ 0 0 6 -4,-2.5 -2,-0.2 1,-0.3 53,-0.2 0.781 112.1 48.6 -72.3 -28.2 18.1 40.6 45.9 428 161 B K T 3< S+ 0 0 25 -4,-2.3 -1,-0.3 1,-0.2 -270,-0.2 0.563 114.6 48.5 -83.7 -10.9 15.3 38.3 44.7 429 162 B N S X> S- 0 0 3 -3,-0.8 3,-2.3 -4,-0.5 4,-0.6 -0.540 76.9-165.0-131.4 67.4 12.7 40.6 46.3 430 163 B P T 34 S+ 0 0 21 0, 0.0 -3,-0.1 0, 0.0 -273,-0.0 -0.300 79.8 17.5 -55.6 129.4 13.4 44.2 45.3 431 164 B G T 34 S+ 0 0 55 2,-0.3 -5,-0.1 50,-0.2 -274,-0.0 0.210 100.5 96.1 94.2 -13.9 11.4 46.5 47.6 432 165 B K T <4 S+ 0 0 24 -3,-2.3 2,-0.4 -6,-0.3 -22,-0.3 0.883 82.2 43.8 -76.2 -40.2 10.7 43.9 50.3 433 166 B Y < - 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