==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 27-APR-13 4KFO . COMPND 2 MOLECULE: NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR X.ZHENG,P.BAUER,T.BAUMEISTER,A.J.BUCKMELTER,M.CALIGIURI, . 942 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33892.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 650 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 106 11.3 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 45 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 256 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.5 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 4 2 2 2 2 0 6 0 2 1 3 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 6 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 . 2 4 2 6 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 2 0 0 0 4 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 8 A E 0 0 208 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 136.9 33.2 -0.8 31.0 2 9 A F - 0 0 65 1,-0.1 2,-0.5 2,-0.0 3,-0.1 -0.258 360.0-163.2 -57.1 135.4 30.3 -3.3 30.8 3 10 A N > - 0 0 8 1,-0.1 3,-2.3 62,-0.0 4,-0.1 -0.943 13.5-159.5-127.9 109.7 29.9 -5.5 33.9 4 11 A I G > S+ 0 0 1 56,-0.5 3,-1.3 -2,-0.5 -1,-0.1 0.761 93.2 65.3 -58.6 -25.5 27.8 -8.7 33.6 5 12 A L G 3 S+ 0 0 0 55,-0.3 -1,-0.3 1,-0.3 3,-0.2 0.685 107.7 41.4 -70.5 -16.7 27.4 -8.8 37.4 6 13 A L G < S+ 0 0 19 -3,-2.3 -1,-0.3 1,-0.1 -2,-0.2 0.160 95.7 85.2-112.0 13.5 25.5 -5.5 37.1 7 14 A A S < S+ 0 0 2 -3,-1.3 130,-0.3 673,-0.1 2,-0.3 -0.224 74.3 80.1-113.1 43.8 23.5 -6.5 34.0 8 15 A T S S- 0 0 0 -3,-0.2 672,-0.7 128,-0.1 2,-0.2 -0.888 91.1 -81.4-136.0 166.4 20.6 -8.3 35.6 9 16 A D B >> -A 679 0A 3 -2,-0.3 3,-1.6 124,-0.2 4,-0.5 -0.552 46.6-119.6 -63.9 134.7 17.3 -7.4 37.3 10 17 A S G >4 S+ 0 0 0 668,-1.4 3,-2.0 1,-0.3 4,-0.4 0.874 109.8 58.8 -47.1 -46.6 18.1 -6.5 40.9 11 18 A Y G >4 S+ 0 0 22 1,-0.3 3,-1.7 2,-0.2 692,-0.4 0.810 92.4 68.4 -61.3 -25.9 15.9 -9.3 42.3 12 19 A K G X4 S+ 0 0 6 -3,-1.6 3,-1.1 1,-0.3 4,-0.4 0.762 84.8 71.0 -63.9 -23.5 18.0 -11.9 40.5 13 20 A V G << S+ 0 0 0 -3,-2.0 70,-0.3 -4,-0.5 3,-0.3 0.819 101.8 46.1 -56.7 -29.1 20.9 -11.1 42.8 14 21 A T G X S+ 0 0 0 -3,-1.7 3,-1.2 -4,-0.4 -1,-0.2 0.486 87.5 89.0 -95.8 -3.0 18.9 -12.8 45.5 15 22 A H G X> + 0 0 7 -3,-1.1 3,-2.3 -4,-0.3 4,-1.1 0.751 68.6 73.8 -73.6 -23.4 17.8 -15.9 43.7 16 23 A Y G 34 S+ 0 0 47 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.703 98.4 51.4 -62.6 -17.7 20.7 -18.2 44.6 17 24 A K G <4 S+ 0 0 57 -3,-1.2 -1,-0.3 1,-0.1 -2,-0.2 0.382 107.9 54.3 -93.3 0.1 19.3 -18.4 48.1 18 25 A Q T <4 S+ 0 0 0 -3,-2.3 -2,-0.2 2,-0.1 706,-0.1 0.662 77.9 94.7-115.5 -21.9 15.8 -19.4 46.8 19 26 A Y S < S- 0 0 7 -4,-1.1 689,-0.1 1,-0.1 3,-0.1 -0.281 92.5 -79.5 -65.8 158.8 16.2 -22.5 44.6 20 27 A P > - 0 0 10 0, 0.0 3,-0.7 0, 0.0 -1,-0.1 -0.346 55.5-100.3 -58.6 139.1 15.7 -25.9 46.2 21 28 A P T 3 S+ 0 0 69 0, 0.0 3,-0.1 0, 0.0 -4,-0.0 -0.308 107.3 29.9 -54.4 148.0 18.7 -27.1 48.2 22 29 A N T 3 S+ 0 0 112 1,-0.2 371,-2.8 370,-0.1 2,-0.6 0.786 80.2 152.6 69.4 32.2 20.8 -29.6 46.2 23 30 A T E < +B 392 0B 11 -3,-0.7 105,-0.3 369,-0.3 369,-0.3 -0.850 16.2 171.4 -95.5 120.2 19.9 -28.3 42.8 24 31 A S E + 0 0 41 367,-2.5 2,-0.4 -2,-0.6 103,-0.2 0.556 61.8 38.1-105.9 -13.4 22.7 -28.9 40.3 25 32 A K E -B 391 0B 50 366,-1.2 366,-1.7 101,-0.1 2,-0.4 -0.992 48.6-176.6-145.0 132.5 21.0 -27.9 37.1 26 33 A V E -B 390 0B 0 -2,-0.4 96,-0.8 364,-0.2 2,-0.5 -0.994 15.7-172.6-123.7 121.3 18.6 -25.1 36.0 27 34 A Y E +BC 389 121B 11 362,-2.8 361,-2.1 -2,-0.4 362,-1.6 -0.967 8.0 175.3-118.6 128.0 17.5 -25.4 32.4 28 35 A S E -BC 387 120B 0 92,-3.0 92,-2.8 -2,-0.5 2,-0.3 -0.845 10.7-158.3-133.3 164.3 15.5 -22.6 30.7 29 36 A Y E -BC 386 119B 1 357,-2.5 357,-2.4 -2,-0.3 2,-0.4 -0.971 10.8-136.1-145.7 158.5 14.2 -21.8 27.3 30 37 A F E +BC 385 118B 0 88,-2.6 87,-2.8 -2,-0.3 88,-1.0 -0.930 28.4 160.7-117.4 137.5 13.0 -18.8 25.2 31 38 A E E -BC 384 116B 6 353,-2.1 353,-2.5 -2,-0.4 2,-0.9 -0.957 46.9-119.4-143.4 163.6 9.9 -18.8 22.9 32 39 A C E -B 383 0B 1 83,-0.5 82,-2.2 -2,-0.3 351,-0.3 -0.865 53.1-131.3 -99.5 92.0 7.6 -16.3 21.3 33 40 A R - 0 0 34 349,-2.5 2,-0.1 -2,-0.9 80,-0.1 -0.063 11.1-115.6 -59.5 139.2 4.6 -17.6 23.2 34 41 A E - 0 0 134 79,-0.1 2,-0.5 78,-0.1 -1,-0.1 -0.438 27.0-149.5 -68.2 146.5 1.4 -18.4 21.3 35 42 A K 0 0 111 -2,-0.1 78,-0.0 374,-0.0 374,-0.0 -0.970 360.0 360.0-127.4 117.5 -1.5 -16.2 22.2 36 43 A K 0 0 120 -2,-0.5 372,-0.0 0, 0.0 -2,-0.0 0.190 360.0 360.0 -20.4 360.0 -5.1 -17.5 22.0 37 ! 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 38 52 A V 0 0 117 0, 0.0 307,-0.0 0, 0.0 306,-0.0 0.000 360.0 360.0 360.0 14.4 -2.0 -8.4 12.4 39 53 A K - 0 0 156 3,-0.0 0, 0.0 0, 0.0 0, 0.0 0.758 360.0-154.7 -97.5 -29.4 -1.4 -11.9 13.7 40 54 A Y + 0 0 23 1,-0.1 73,-0.1 109,-0.1 110,-0.0 0.953 23.0 170.3 48.4 64.3 2.3 -12.5 13.6 41 55 A E + 0 0 137 1,-0.1 72,-2.4 71,-0.1 2,-0.3 0.663 61.8 36.1 -80.4 -16.4 2.1 -16.3 13.3 42 56 A E E S-H 112 0C 51 70,-0.3 2,-0.4 107,-0.1 -1,-0.1 -0.994 70.9-151.7-140.9 146.0 5.8 -16.8 12.5 43 57 A T E -H 111 0C 0 68,-2.9 68,-2.5 -2,-0.3 2,-0.6 -0.900 16.2-127.9-123.6 145.6 8.9 -15.0 13.8 44 58 A V E -H 110 0C 1 101,-0.5 2,-0.8 -2,-0.4 105,-0.3 -0.807 25.3-139.6 -86.7 119.0 12.4 -14.4 12.4 45 59 A F + 0 0 0 64,-2.7 63,-3.4 -2,-0.6 2,-0.3 -0.728 45.1 141.7 -82.2 113.9 15.0 -15.5 14.9 46 60 A Y + 0 0 2 -2,-0.8 102,-0.1 95,-0.2 100,-0.1 -0.982 35.2 40.1-155.6 134.9 17.7 -12.9 14.8 47 61 A G > + 0 0 2 -2,-0.3 4,-1.4 97,-0.1 3,-0.3 0.225 68.3 106.8 121.2 -13.6 20.1 -11.1 17.2 48 62 A L H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.901 77.6 60.9 -62.2 -39.7 21.4 -13.7 19.7 49 63 A Q H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.863 101.6 54.2 -58.0 -37.9 24.8 -13.8 18.0 50 64 A Y H > S+ 0 0 14 -3,-0.3 4,-2.8 2,-0.2 5,-0.3 0.944 111.4 44.1 -58.1 -50.0 25.2 -10.0 18.8 51 65 A I H X>S+ 0 0 9 -4,-1.4 4,-2.2 2,-0.2 5,-1.2 0.915 111.3 53.2 -64.9 -42.7 24.5 -10.6 22.5 52 66 A L H X>S+ 0 0 3 -4,-2.8 5,-1.9 3,-0.2 4,-0.7 0.925 117.4 37.9 -58.4 -47.2 26.7 -13.7 22.8 53 67 A N H <5S+ 0 0 31 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.923 120.5 41.6 -71.3 -47.6 29.7 -11.8 21.3 54 68 A K H <5S+ 0 0 93 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.851 133.9 9.1 -72.6 -34.1 29.3 -8.4 22.8 55 69 A Y H <5S+ 0 0 18 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.1 0.707 125.0 41.1-121.9 -29.7 28.4 -9.4 26.3 56 70 A L T < - 0 0 32 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.925 50.0-107.0-136.2 165.5 37.3 -10.1 37.1 63 77 A K H > S+ 0 0 149 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.907 121.4 49.4 -54.7 -44.6 38.3 -9.4 40.7 64 78 A E H > S+ 0 0 128 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.901 108.5 51.3 -66.5 -42.4 37.5 -5.7 40.1 65 79 A K H > S+ 0 0 24 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.880 109.9 50.7 -63.1 -37.4 34.1 -6.4 38.6 66 80 A I H X S+ 0 0 3 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.929 112.4 46.1 -65.0 -44.3 33.2 -8.6 41.6 67 81 A Q H X S+ 0 0 86 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.895 111.3 52.8 -65.6 -41.1 34.2 -5.9 44.0 68 82 A E H X S+ 0 0 70 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.944 111.8 45.2 -57.2 -51.5 32.3 -3.2 42.0 69 83 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.911 111.6 53.0 -61.2 -41.9 29.1 -5.3 42.1 70 84 A K H X S+ 0 0 79 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.929 111.8 45.7 -57.7 -45.6 29.6 -6.0 45.8 71 85 A D H X S+ 0 0 89 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.910 115.1 46.1 -66.1 -43.6 29.9 -2.3 46.5 72 86 A V H X S+ 0 0 19 -4,-2.6 4,-2.7 1,-0.2 3,-0.4 0.937 113.2 48.1 -65.9 -47.5 26.9 -1.3 44.4 73 87 A Y H X S+ 0 0 2 -4,-2.9 4,-2.6 1,-0.2 6,-0.5 0.839 102.6 62.7 -67.8 -29.8 24.6 -4.0 45.7 74 88 A K H X>S+ 0 0 90 -4,-1.8 5,-0.8 -5,-0.3 4,-0.6 0.916 114.8 33.9 -59.9 -39.0 25.5 -3.2 49.3 75 89 A E H <5S+ 0 0 66 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.887 116.5 54.4 -81.0 -40.2 24.0 0.2 48.8 76 90 A H H <5S+ 0 0 1 -4,-2.7 624,-1.9 1,-0.2 -2,-0.2 0.876 122.7 28.4 -63.7 -39.5 21.2 -0.7 46.4 77 91 A F H <5S- 0 0 15 -4,-2.6 -1,-0.2 2,-0.3 -2,-0.2 0.538 97.3-132.9 -96.6 -10.2 19.8 -3.4 48.8 78 92 A Q T <5S+ 0 0 126 -4,-0.6 2,-0.3 -5,-0.3 -3,-0.2 0.858 83.7 68.7 55.6 36.8 20.9 -1.7 52.0 79 93 A D S + 0 0 18 -70,-0.3 4,-1.7 1,-0.2 5,-0.2 -0.455 44.4 159.0 -80.5 71.6 26.7 -14.0 45.9 84 98 A E H > S+ 0 0 62 -2,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.902 71.3 55.0 -60.4 -43.7 30.4 -13.1 46.0 85 99 A K H > S+ 0 0 180 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.907 106.9 50.6 -55.6 -45.3 31.4 -16.8 46.5 86 100 A G H > S+ 0 0 10 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.892 113.6 43.6 -63.7 -41.9 29.5 -17.9 43.4 87 101 A W H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.873 110.6 55.2 -73.2 -37.4 31.1 -15.3 41.2 88 102 A N H X S+ 0 0 40 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.882 103.2 58.0 -59.0 -39.0 34.5 -15.9 42.7 89 103 A Y H X S+ 0 0 54 -4,-2.1 4,-2.9 1,-0.2 5,-0.4 0.922 106.3 47.0 -56.1 -47.7 34.2 -19.6 41.8 90 104 A I H X S+ 0 0 0 -4,-1.3 4,-1.8 1,-0.2 6,-1.7 0.905 112.6 50.9 -63.5 -40.5 33.7 -18.8 38.1 91 105 A L H X S+ 0 0 23 -4,-2.0 4,-0.7 4,-0.2 -2,-0.2 0.950 118.4 36.3 -59.0 -51.0 36.7 -16.4 38.2 92 106 A E H < S+ 0 0 150 -4,-2.9 -2,-0.2 3,-0.2 -1,-0.2 0.875 124.7 37.0 -74.0 -40.8 39.0 -19.0 39.8 93 107 A K H < S+ 0 0 126 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.849 131.6 23.7 -83.6 -36.5 37.8 -22.2 38.1 94 108 A Y H >< S- 0 0 67 -4,-1.8 3,-1.7 -5,-0.4 -2,-0.2 0.127 103.1-110.1-119.9 19.2 37.0 -20.9 34.6 95 109 A D T 3< S- 0 0 89 -4,-0.7 -4,-0.2 1,-0.3 -3,-0.2 0.887 81.8 -53.7 47.4 42.3 39.2 -17.8 34.3 96 110 A G T 3 S+ 0 0 0 -6,-1.7 -36,-2.1 1,-0.2 -35,-0.9 0.595 103.3 136.9 75.2 11.7 36.0 -15.8 34.4 97 111 A H < - 0 0 32 -3,-1.7 -1,-0.2 -7,-0.5 -38,-0.1 -0.749 60.7-108.7 -90.3 139.3 34.3 -17.6 31.5 98 112 A L - 0 0 0 -42,-0.5 2,-2.3 -40,-0.4 353,-0.6 -0.517 16.4-141.0 -74.4 119.3 30.6 -18.4 32.0 99 113 A P + 0 0 0 0, 0.0 24,-2.4 0, 0.0 25,-0.6 -0.467 61.4 122.7 -78.2 73.7 29.9 -22.1 32.5 100 114 A I E -D 122 0B 0 -2,-2.3 350,-2.0 22,-0.3 2,-0.5 -0.970 50.1-152.0-134.1 141.5 26.7 -22.0 30.4 101 115 A E E -DE 121 449B 28 20,-3.0 20,-1.8 -2,-0.3 2,-0.5 -0.989 12.8-170.7-116.7 131.3 25.6 -23.9 27.3 102 116 A I E -DE 120 448B 0 346,-2.7 345,-2.8 -2,-0.5 346,-1.6 -0.980 2.4-169.3-121.1 125.6 23.2 -22.2 24.9 103 117 A K E +DE 119 446B 63 16,-1.6 16,-2.5 -2,-0.5 2,-0.3 -0.947 15.9 175.6-113.3 139.0 21.5 -24.1 22.0 104 118 A A E -DE 118 445B 2 341,-2.9 341,-2.7 -2,-0.4 14,-0.2 -0.979 36.5-106.7-144.9 151.6 19.6 -22.1 19.3 105 119 A V - 0 0 1 12,-2.5 339,-0.1 -2,-0.3 3,-0.1 -0.462 63.0 -84.8 -67.9 147.0 17.8 -22.4 16.1 106 120 A P > - 0 0 10 0, 0.0 3,-1.8 0, 0.0 -61,-0.2 -0.269 51.9 -99.5 -59.5 142.1 19.9 -20.9 13.2 107 121 A E T 3 S+ 0 0 6 1,-0.3 -61,-0.2 -3,-0.1 358,-0.2 -0.347 109.0 31.5 -66.6 142.6 19.6 -17.2 12.8 108 122 A G T 3 S+ 0 0 0 -63,-3.4 -1,-0.3 1,-0.4 -62,-0.1 0.116 85.7 138.6 95.4 -18.7 17.3 -16.1 10.0 109 123 A F < - 0 0 44 -3,-1.8 -64,-2.7 -64,-0.3 2,-0.6 -0.297 49.6-139.0 -62.4 142.6 15.1 -19.1 10.6 110 124 A V E +H 44 0C 22 355,-0.3 -66,-0.2 -66,-0.2 -1,-0.1 -0.929 28.8 179.0-110.2 113.1 11.4 -18.4 10.4 111 125 A I E -H 43 0C 0 -68,-2.5 -68,-2.9 -2,-0.6 4,-0.1 -0.932 28.8-113.0-124.8 133.3 9.6 -20.3 13.1 112 126 A P E > -H 42 0C 48 0, 0.0 3,-0.6 0, 0.0 -70,-0.3 -0.233 48.8 -86.7 -59.5 151.9 5.9 -20.4 14.0 113 127 A R T 3 S+ 0 0 26 -72,-2.4 -80,-0.2 1,-0.2 -79,-0.1 -0.153 108.2 39.3 -53.1 149.6 4.9 -19.0 17.4 114 128 A G T 3 S+ 0 0 10 -82,-2.2 2,-0.3 1,-0.3 -1,-0.2 0.701 86.4 119.2 85.7 18.9 5.0 -21.2 20.4 115 129 A N S < S- 0 0 14 -3,-0.6 -83,-0.5 -83,-0.2 -1,-0.3 -0.888 71.7-100.6-116.0 150.0 8.3 -23.1 19.6 116 130 A V E +C 31 0B 0 -2,-0.3 -85,-0.2 301,-0.2 3,-0.1 -0.479 36.9 175.1 -66.0 131.9 11.5 -23.2 21.5 117 131 A L E - 0 0 2 -87,-2.8 -12,-2.5 1,-0.4 2,-0.3 0.720 66.2 -2.5-109.6 -36.9 14.0 -20.8 19.9 118 132 A F E -CD 30 104B 0 -88,-1.0 -88,-2.6 -14,-0.2 -1,-0.4 -0.990 58.9-151.7-150.8 157.6 16.9 -21.2 22.3 119 133 A T E -CD 29 103B 1 -16,-2.5 -16,-1.6 -2,-0.3 2,-0.4 -0.920 7.4-160.7-124.7 155.5 17.7 -23.1 25.6 120 134 A V E +CD 28 102B 0 -92,-2.8 -92,-3.0 -2,-0.3 2,-0.3 -0.999 16.8 160.0-138.4 131.9 20.1 -22.1 28.4 121 135 A E E -CD 27 101B 26 -20,-1.8 -20,-3.0 -2,-0.4 2,-0.2 -0.992 38.0-109.0-149.6 155.8 21.7 -24.4 31.0 122 136 A N E - D 0 100B 3 -96,-0.8 -22,-0.3 -2,-0.3 6,-0.1 -0.563 15.1-157.8 -81.9 149.2 24.6 -24.4 33.4 123 137 A T S S+ 0 0 48 -24,-2.4 -23,-0.2 -2,-0.2 -1,-0.1 0.433 79.3 56.4-107.4 -2.9 27.5 -26.8 32.7 124 138 A D S > S- 0 0 11 -25,-0.6 3,-2.2 1,-0.1 -1,-0.1 -0.999 78.6-136.7-129.9 128.1 28.8 -26.8 36.3 125 139 A P G > S+ 0 0 78 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.787 103.9 62.4 -55.5 -30.1 26.6 -27.8 39.2 126 140 A E G 3 S+ 0 0 116 1,-0.3 3,-0.4 2,-0.1 -37,-0.1 0.722 99.7 57.1 -65.1 -20.7 27.9 -25.0 41.3 127 141 A C G X> + 0 0 0 -3,-2.2 3,-1.9 1,-0.2 4,-0.6 0.013 61.0 124.1-107.2 30.0 26.5 -22.5 38.8 128 142 A Y T <4 S+ 0 0 48 -3,-1.1 3,-0.4 1,-0.3 4,-0.4 0.786 75.5 56.9 -55.7 -29.0 22.9 -23.6 38.9 129 143 A W T 3> S+ 0 0 11 -3,-0.4 4,-1.0 1,-0.2 -1,-0.3 0.603 92.1 71.4 -79.6 -13.2 22.0 -19.9 39.7 130 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51.4 48.1 33.2 24.6 21.1 924 465 B G T 3 S+ 0 0 3 -353,-0.7 -393,-2.5 -351,-0.3 2,-0.4 0.395 117.8 103.8 90.8 -2.1 33.7 21.0 22.4 925 466 B K E < -Y 922 0I 145 -3,-1.5 -3,-2.4 -395,-0.2 2,-0.6 -0.911 69.4-129.4-119.8 140.2 33.2 21.8 26.1 926 467 B V E -Y 921 0I 41 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.775 28.4-179.0 -80.9 122.9 30.3 21.3 28.5 927 468 B T + 0 0 70 -7,-2.0 2,-0.3 -2,-0.6 -6,-0.2 0.563 61.7 21.6-106.3 -13.8 29.8 24.7 30.0 928 469 B K + 0 0 74 -8,-1.0 -1,-0.3 -10,-0.1 2,-0.3 -0.961 65.8 167.4-156.5 140.4 26.9 24.0 32.5 929 470 B S - 0 0 71 -2,-0.3 2,-0.4 -3,-0.1 -239,-0.1 -0.929 20.6-136.1-151.6 169.1 25.6 20.9 34.1 930 471 B Y - 0 0 27 -2,-0.3 2,-0.1 -351,-0.0 -349,-0.0 -0.980 17.4-125.2-135.3 139.9 23.3 19.7 36.9 931 472 B S > - 0 0 39 -2,-0.4 4,-2.0 1,-0.1 -240,-0.2 -0.400 31.3-113.5 -75.2 163.8 23.5 17.0 39.6 932 473 B F H > S+ 0 0 0 -241,-2.4 4,-2.3 1,-0.2 -240,-0.2 0.814 118.1 59.1 -67.2 -29.9 20.9 14.3 39.8 933 474 B D H > S+ 0 0 46 -242,-0.8 4,-1.8 2,-0.2 -1,-0.2 0.905 106.8 45.8 -64.6 -40.8 19.8 15.8 43.1 934 475 B E H > S+ 0 0 89 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.887 110.6 53.4 -70.3 -37.5 19.1 19.2 41.5 935 476 B I H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.928 108.3 50.2 -60.5 -46.7 17.2 17.5 38.6 936 477 B R H < S+ 0 0 38 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.906 110.4 50.1 -57.3 -42.8 15.0 15.7 41.1 937 478 B K H >< S+ 0 0 126 -4,-1.8 3,-1.2 1,-0.2 -2,-0.2 0.926 110.1 50.0 -63.7 -43.4 14.3 18.9 42.9 938 479 B N H 3< S+ 0 0 53 -4,-2.5 -355,-0.3 1,-0.2 -1,-0.2 0.828 110.8 51.1 -63.2 -30.0 13.4 20.7 39.7 939 480 B A T 3< S+ 0 0 1 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.399 81.0 130.5 -93.3 4.4 11.0 17.8 38.7 940 481 B Q < - 0 0 70 -3,-1.2 2,-0.2 -4,-0.4 -357,-0.1 -0.109 61.5-108.6 -57.3 152.1 9.1 17.7 42.0 941 482 B L > - 0 0 4 1,-0.1 4,-2.0 -313,-0.0 3,-0.4 -0.511 22.0-120.2 -76.7 152.2 5.3 17.7 42.0 942 483 B N T 4 S+ 0 0 130 1,-0.2 -1,-0.1 2,-0.2 -2,-0.1 0.916 116.4 55.3 -54.5 -44.6 3.4 20.8 43.1 943 484 B I T 4 S+ 0 0 92 1,-0.2 -1,-0.2 -3,-0.0 -3,-0.0 0.815 107.8 49.2 -61.6 -31.2 1.8 18.7 45.8 944 485 B E T 4 0 0 59 -3,-0.4 -1,-0.2 -302,-0.0 -2,-0.2 0.862 360.0 360.0 -72.2 -38.0 5.2 17.7 47.0 945 486 B L < 0 0 129 -4,-2.0 0, 0.0 -3,-0.0 0, 0.0 -0.402 360.0 360.0 -67.7 360.0 6.3 21.3 47.0