==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 07-APR-03 1OYR . COMPND 2 MOLECULE: RIBONUCLEASE PH; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR L.S.HARLOW,A.KADZIOLA,K.F.JENSEN,S.LARSEN . 1452 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54905.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1079 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 324 22.3 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 . 18 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 121 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 130 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 384 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.4 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 6 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 6 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 . 18 0 0 6 15 0 12 0 6 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 6 0 0 0 0 0 0 3 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 0 123 0, 0.0 2,-0.3 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0 -75.2 12.4 54.3 85.9 2 2 A R > - 0 0 6 4,-0.7 3,-2.0 1,-0.1 4,-0.1 -0.701 360.0-118.6 -92.2 144.8 12.3 57.8 84.3 3 3 A H T 3 S+ 0 0 164 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 0.751 114.6 60.1 -57.6 -24.3 14.2 60.6 85.9 4 4 A D T 3 S- 0 0 76 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.798 115.1-121.1 -69.6 -25.9 11.1 62.7 86.7 5 5 A G < + 0 0 59 -3,-2.0 2,-0.3 1,-0.3 -2,-0.2 0.688 68.6 135.4 91.3 22.5 10.2 59.6 88.7 6 6 A R - 0 0 8 -4,-0.1 -4,-0.7 4,-0.1 -1,-0.3 -0.792 58.6-106.3-107.7 150.9 7.1 59.1 86.6 7 7 A Q > - 0 0 110 -2,-0.3 3,-2.0 1,-0.1 167,-0.2 -0.249 37.3-103.4 -66.8 157.1 5.7 55.9 85.1 8 8 A H T 3 S+ 0 0 71 1,-0.3 166,-2.7 165,-0.1 -1,-0.1 0.765 122.4 42.3 -54.6 -27.4 5.9 55.3 81.4 9 9 A D T 3 S+ 0 0 58 164,-0.2 2,-0.4 2,-0.1 -1,-0.3 -0.007 91.2 109.4-112.5 32.1 2.2 56.2 81.0 10 10 A E < - 0 0 90 -3,-2.0 2,-0.1 164,-0.2 164,-0.1 -0.880 59.5-137.3-109.8 135.4 2.1 59.2 83.3 11 11 A L - 0 0 11 -2,-0.4 -4,-0.1 1,-0.1 3,-0.1 -0.456 29.6-102.3 -83.4 162.4 1.7 62.8 82.1 12 12 A R - 0 0 8 1,-0.1 2,-0.1 -2,-0.1 -1,-0.1 -0.421 56.3 -76.5 -77.8 161.1 3.7 65.6 83.6 13 13 A P - 0 0 99 0, 0.0 20,-2.1 0, 0.0 2,-0.4 -0.390 54.4-153.1 -61.1 130.1 1.9 67.8 86.1 14 14 A I E +A 32 0A 26 18,-0.2 2,-0.3 -2,-0.1 18,-0.2 -0.893 17.5 176.5-112.7 138.7 -0.5 70.2 84.2 15 15 A T E -A 31 0A 71 16,-1.8 16,-2.2 -2,-0.4 2,-0.5 -0.985 13.9-157.6-135.3 144.0 -1.7 73.6 85.4 16 16 A F E -A 30 0A 25 -2,-0.3 2,-0.9 14,-0.2 14,-0.2 -0.917 4.0-167.5-126.7 103.8 -3.9 76.1 83.5 17 17 A D E > -A 29 0A 81 12,-2.0 12,-2.2 -2,-0.5 3,-0.7 -0.807 19.3-150.4 -91.8 109.7 -3.6 79.7 84.6 18 18 A L E 3 +A 28 0A 62 -2,-0.9 10,-0.2 1,-0.2 8,-0.0 -0.470 69.9 12.6 -82.7 151.3 -6.5 81.5 83.0 19 19 A D T 3 S+ 0 0 98 8,-2.1 -1,-0.2 -2,-0.1 9,-0.2 0.753 73.6 158.7 57.9 30.1 -6.6 85.2 82.0 20 20 A F < + 0 0 45 7,-0.7 2,-0.5 -3,-0.7 -2,-0.1 0.861 66.8 40.1 -46.9 -48.6 -2.8 85.4 82.4 21 21 A I S S- 0 0 3 1,-0.2 -1,-0.2 3,-0.0 -2,-0.1 -0.939 77.3-147.5-113.5 118.4 -2.6 88.4 80.2 22 22 A S S S+ 0 0 87 -2,-0.5 -1,-0.2 1,-0.2 1313,-0.1 0.919 84.7 58.5 -42.5 -69.5 -5.2 91.1 80.5 23 23 A H S S+ 0 0 44 1261,-0.2 -1,-0.2 1313,-0.1 1261,-0.1 0.719 85.4 79.1 -38.6 -51.4 -5.4 92.4 76.8 24 24 A P S S- 0 0 7 0, 0.0 18,-0.2 0, 0.0 3,-0.1 -0.340 77.6-129.4 -68.2 150.4 -6.3 89.3 74.8 25 25 A E S S+ 0 0 48 16,-0.7 2,-0.4 1,-0.2 17,-0.2 0.864 102.2 27.1 -63.3 -37.0 -9.9 88.0 74.6 26 26 A G E S+ B 0 41A 0 15,-2.1 15,-3.7 113,-0.1 2,-0.4 -0.995 74.8 168.2-129.4 127.4 -8.6 84.6 75.5 27 27 A S E + B 0 40A 1 -2,-0.4 -8,-2.1 13,-0.3 -7,-0.7 -0.937 0.8 167.1-145.7 120.7 -5.4 84.1 77.5 28 28 A V E -AB 18 39A 0 11,-3.2 11,-3.4 -2,-0.4 2,-0.7 -0.994 23.7-152.8-135.1 138.1 -4.1 80.9 79.0 29 29 A L E -AB 17 38A 11 -12,-2.2 -12,-2.0 -2,-0.4 2,-0.4 -0.908 21.4-161.3-108.3 102.4 -0.7 80.1 80.5 30 30 A I E -AB 16 37A 2 7,-1.9 7,-2.4 -2,-0.7 2,-0.5 -0.720 5.8-168.3 -89.7 132.6 -0.3 76.3 80.1 31 31 A T E +AB 15 36A 18 -16,-2.2 -16,-1.8 -2,-0.4 2,-0.5 -0.971 10.0 175.5-121.6 118.1 2.4 74.6 82.2 32 32 A A E > -AB 14 35A 4 3,-3.0 3,-1.8 -2,-0.5 2,-0.7 -0.823 70.0 -57.8-123.1 90.9 3.3 71.0 81.5 33 33 A G T 3 S- 0 0 24 -20,-2.1 144,-0.0 -2,-0.5 -22,-0.0 -0.654 122.1 -19.2 74.8-117.0 6.1 70.1 83.8 34 34 A N T 3 S+ 0 0 87 -2,-0.7 2,-0.5 88,-0.2 -1,-0.3 0.413 115.8 103.5-102.4 0.4 8.8 72.6 83.0 35 35 A T E < -B 32 0A 0 -3,-1.8 -3,-3.0 87,-0.2 2,-0.4 -0.734 49.9-177.3 -85.3 125.1 7.3 73.6 79.6 36 36 A K E +BC 31 120A 52 84,-3.1 84,-1.7 -2,-0.5 83,-1.6 -0.988 4.2 177.4-128.4 125.7 5.5 76.9 79.8 37 37 A V E -BC 30 118A 0 -7,-2.4 -7,-1.9 -2,-0.4 2,-0.7 -0.984 23.6-141.5-130.7 137.9 3.6 78.5 77.0 38 38 A I E -BC 29 117A 0 79,-2.4 79,-2.3 -2,-0.4 2,-0.6 -0.879 21.5-167.6 -98.2 116.1 1.6 81.7 76.8 39 39 A C E +BC 28 116A 0 -11,-3.4 -11,-3.2 -2,-0.7 2,-0.4 -0.924 7.5 179.8-111.6 113.9 -1.5 81.1 74.6 40 40 A N E -BC 27 115A 2 75,-2.1 75,-2.5 -2,-0.6 2,-0.5 -0.931 12.8-159.3-117.3 135.0 -3.4 84.2 73.6 41 41 A A E -BC 26 114A 0 -15,-3.7 -15,-2.1 -2,-0.4 -16,-0.7 -0.951 11.5-173.7-113.9 126.4 -6.5 84.3 71.4 42 42 A S E - C 0 113A 2 71,-2.7 71,-3.6 -2,-0.5 2,-0.2 -0.981 11.2-149.5-125.5 129.5 -7.4 87.5 69.6 43 43 A V E + C 0 112A 25 -2,-0.4 69,-0.2 69,-0.2 2,-0.2 -0.581 18.6 171.2 -91.2 155.9 -10.6 88.2 67.6 44 44 A E E - C 0 111A 65 67,-0.8 67,-0.9 -2,-0.2 2,-0.9 -0.590 34.9-128.0-169.8 101.0 -10.6 90.7 64.7 45 45 A D S S+ 0 0 121 65,-0.2 2,-0.3 -2,-0.2 65,-0.2 -0.299 77.1 81.9 -54.6 95.3 -13.5 91.2 62.2 46 46 A R - 0 0 120 -2,-0.9 12,-0.2 63,-0.4 -2,-0.1 -0.897 56.8-151.4 174.3 159.4 -11.6 90.8 59.0 47 47 A V - 0 0 2 -2,-0.3 64,-0.1 1,-0.1 10,-0.1 -0.970 26.5 -98.0-146.6 160.3 -10.4 88.0 56.7 48 48 A P > - 0 0 30 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.188 60.7 -75.1 -61.7-169.7 -7.5 87.4 54.2 49 49 A P G > S+ 0 0 88 0, 0.0 3,-1.1 0, 0.0 -2,-0.0 0.940 126.0 51.0 -59.9 -49.7 -8.1 87.8 50.4 50 50 A F G 3 S+ 0 0 150 1,-0.2 0, 0.0 4,-0.0 0, 0.0 0.178 100.9 60.4 -79.5 19.9 -10.1 84.6 49.8 51 51 A L G X + 0 0 8 -3,-1.0 3,-1.9 58,-0.1 4,-0.4 0.185 65.6 147.9-127.2 14.4 -12.7 84.9 52.5 52 52 A R T < S- 0 0 152 -3,-1.1 -6,-0.0 1,-0.3 57,-0.0 -0.314 86.3 -22.2 -55.0 115.2 -14.3 88.2 51.3 53 53 A G T 3 S+ 0 0 64 -2,-0.2 -1,-0.3 1,-0.2 56,-0.0 0.649 99.1 130.4 56.3 14.7 -18.0 88.1 52.2 54 54 A G < - 0 0 42 -3,-1.9 -1,-0.2 2,-0.2 -2,-0.1 0.517 70.0-131.1 -76.2 -3.0 -17.8 84.3 52.3 55 55 A G S S+ 0 0 33 -4,-0.4 2,-0.4 1,-0.2 53,-0.4 0.630 71.9 121.9 62.5 10.0 -19.5 84.4 55.7 56 56 A K - 0 0 85 -5,-0.4 49,-0.2 53,-0.1 -1,-0.2 -0.894 53.0-146.2-108.1 135.1 -16.6 82.1 56.6 57 57 A G - 0 0 0 47,-3.2 2,-0.3 -2,-0.4 54,-0.2 -0.398 10.7-138.3 -92.7 172.4 -14.2 82.9 59.5 58 58 A W E -d 111 0A 56 52,-1.8 54,-2.5 -12,-0.2 2,-0.3 -0.858 10.0-159.9-131.3 166.2 -10.6 82.1 59.9 59 59 A I E +d 112 0A 0 -2,-0.3 2,-0.3 52,-0.2 54,-0.2 -0.912 18.9 168.4-147.2 112.2 -8.0 80.9 62.4 60 60 A T E -d 113 0A 43 52,-1.8 54,-2.3 -2,-0.3 2,-0.4 -0.883 13.4-156.7-124.3 159.3 -4.3 81.5 62.1 61 61 A A E -d 114 0A 4 -2,-0.3 2,-0.4 30,-0.2 54,-0.2 -0.993 9.7-160.8-142.5 146.6 -1.5 81.0 64.5 62 62 A E E -d 115 0A 21 52,-2.5 54,-2.7 -2,-0.4 2,-0.4 -0.959 12.8-165.9-123.0 140.4 2.0 82.3 65.2 63 63 A Y E +d 116 0A 2 -2,-0.4 2,-0.3 52,-0.2 54,-0.2 -0.990 10.4 170.0-130.9 135.3 4.5 80.5 67.4 64 64 A S E -d 117 0A 17 52,-1.8 54,-2.4 -2,-0.4 2,-0.5 -0.947 23.4-144.9-139.3 161.2 7.8 81.7 68.8 65 65 A M E -d 118 0A 49 -2,-0.3 12,-0.2 52,-0.2 54,-0.1 -0.973 29.4-120.8-129.6 114.6 10.3 80.5 71.3 66 66 A L > - 0 0 5 52,-1.8 3,-2.5 -2,-0.5 4,-0.5 -0.265 31.7-110.2 -55.0 138.2 12.0 83.2 73.4 67 67 A P G > S+ 0 0 2 0, 0.0 7,-2.2 0, 0.0 3,-0.5 0.808 115.7 33.1 -38.1 -49.7 15.8 83.1 72.9 68 68 A R G 3 S+ 0 0 9 5,-0.2 5,-0.1 1,-0.2 -2,-0.1 -0.121 85.6 102.1-105.4 38.8 16.7 81.7 76.4 69 69 A A G < S+ 0 0 1 -3,-2.5 52,-2.4 3,-0.1 1169,-0.2 0.754 79.6 67.3 -82.6 -26.3 13.5 79.7 76.8 70 70 A T S < S- 0 0 26 -3,-0.5 52,-0.1 -4,-0.5 4,-0.0 -0.506 101.3-106.2 -93.0 158.7 15.9 76.8 75.9 71 71 A N S S+ 0 0 101 50,-0.2 2,-0.4 -2,-0.2 -1,-0.1 0.803 113.9 41.1 -52.8 -32.5 18.8 75.3 77.9 72 72 A Q S S- 0 0 113 -5,-0.1 2,-0.6 1167,-0.0 -2,-0.3 -0.962 102.3-106.5-119.4 136.9 21.1 77.1 75.4 73 73 A R - 0 0 25 -2,-0.4 2,-0.3 -5,-0.1 -5,-0.2 -0.501 37.3-155.9 -67.6 111.6 20.4 80.6 74.1 74 74 A T - 0 0 61 -7,-2.2 3,-0.1 -2,-0.6 -5,-0.1 -0.661 29.2 -92.9 -89.0 142.8 19.2 80.2 70.5 75 75 A I - 0 0 122 -2,-0.3 -1,-0.1 1,-0.1 5,-0.1 -0.276 48.1-101.5 -55.4 131.4 19.5 83.1 68.1 76 76 A R >> - 0 0 20 1,-0.1 4,-1.1 2,-0.1 3,-0.6 -0.295 24.7-132.0 -56.9 133.6 16.5 85.4 68.0 77 77 A E T 34 S+ 0 0 44 1,-0.2 5,-0.4 -12,-0.2 -1,-0.1 0.804 107.0 57.3 -58.6 -32.5 14.4 84.5 64.8 78 78 A S T 34 S+ 0 0 21 1,-0.2 -1,-0.2 3,-0.1 1220,-0.1 0.854 97.0 62.7 -66.6 -37.4 14.2 88.3 64.0 79 79 A S T <4 S+ 0 0 48 -3,-0.6 2,-0.2 2,-0.1 -1,-0.2 0.904 97.7 65.8 -53.5 -45.7 18.0 88.5 64.0 80 80 A K S < S- 0 0 118 -4,-1.1 4,-0.0 2,-0.2 0, 0.0 -0.583 96.7-123.7 -76.1 140.9 17.9 86.0 61.1 81 81 A G S S+ 0 0 63 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.402 90.8 47.2 -68.6 9.1 16.3 87.6 58.0 82 82 A K S S- 0 0 141 -5,-0.4 2,-0.4 243,-0.0 -2,-0.2 -0.974 85.0-107.7-149.3 160.4 13.9 84.6 58.0 83 83 A I - 0 0 44 -2,-0.3 -2,-0.0 1210,-0.1 -5,-0.0 -0.736 48.4-112.3 -87.3 133.2 11.6 82.5 60.2 84 84 A S > - 0 0 45 -2,-0.4 4,-1.8 1,-0.1 -1,-0.1 -0.033 21.2-109.8 -62.9 168.9 13.0 79.0 60.8 85 85 A G H > S+ 0 0 15 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.948 114.6 53.4 -65.2 -51.1 11.6 75.8 59.5 86 86 A R H > S+ 0 0 88 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.949 108.9 48.7 -49.2 -58.1 10.3 74.5 62.8 87 87 A T H > S+ 0 0 5 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.923 115.2 46.8 -48.8 -47.0 8.4 77.7 63.6 88 88 A M H X S+ 0 0 41 -4,-1.8 4,-1.7 1,-0.2 5,-0.3 0.978 113.5 46.2 -57.9 -59.8 7.0 77.4 60.1 89 89 A E H X S+ 0 0 19 -4,-3.5 4,-1.2 1,-0.2 -1,-0.2 0.840 118.2 44.8 -51.0 -40.0 6.1 73.7 60.4 90 90 A I H X S+ 0 0 0 -4,-3.4 4,-2.3 -5,-0.3 -1,-0.2 0.884 105.5 56.6 -76.5 -44.4 4.6 74.3 63.8 91 91 A Q H X S+ 0 0 15 -4,-3.1 4,-1.8 -5,-0.3 -30,-0.2 0.909 110.3 46.5 -54.9 -44.0 2.6 77.5 63.2 92 92 A R H X S+ 0 0 67 -4,-1.7 4,-3.0 -5,-0.2 5,-0.3 0.913 109.2 55.4 -66.0 -42.5 0.7 75.7 60.4 93 93 A L H X S+ 0 0 4 -4,-1.2 4,-2.5 -5,-0.3 -2,-0.2 0.913 107.6 48.5 -56.5 -47.4 0.1 72.7 62.6 94 94 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.926 115.5 43.5 -62.0 -44.6 -1.5 74.7 65.4 95 95 A G H X S+ 0 0 2 -4,-1.8 4,-2.4 -5,-0.2 -2,-0.2 0.937 113.1 50.5 -66.1 -47.3 -3.8 76.5 63.0 96 96 A R H X S+ 0 0 47 -4,-3.0 4,-1.2 1,-0.2 -2,-0.2 0.930 112.9 49.2 -55.2 -46.7 -4.7 73.4 61.0 97 97 A A H >< S+ 0 0 0 -4,-2.5 3,-0.8 -5,-0.3 4,-0.3 0.945 109.9 47.2 -59.8 -55.9 -5.5 71.7 64.3 98 98 A L H >< S+ 0 0 0 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.897 107.8 57.4 -56.6 -42.9 -7.8 74.3 65.8 99 99 A R H >< S+ 0 0 72 -4,-2.4 3,-1.7 1,-0.3 -1,-0.2 0.821 91.6 71.5 -58.3 -31.7 -9.7 74.7 62.6 100 100 A A T << S+ 0 0 39 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.598 104.9 39.0 -62.7 -10.2 -10.6 71.0 62.7 101 101 A V T < S+ 0 0 1 -3,-1.8 55,-2.3 -4,-0.3 56,-0.5 0.082 101.4 82.3-127.9 25.0 -13.0 71.6 65.6 102 102 A V B < S-E 155 0B 9 -3,-1.7 2,-1.6 53,-0.2 53,-0.2 -0.990 72.8-131.8-135.9 127.0 -14.6 75.0 64.7 103 103 A D > - 0 0 56 51,-2.2 4,-1.7 -2,-0.4 3,-0.2 -0.593 22.5-165.5 -75.0 89.9 -17.5 75.6 62.4 104 104 A L H > S+ 0 0 28 -2,-1.6 -47,-3.2 1,-0.2 4,-0.8 0.737 85.6 55.0 -52.0 -22.8 -15.8 78.5 60.5 105 105 A E H >4 S+ 0 0 137 -49,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.958 106.6 46.8 -76.6 -51.8 -19.2 79.4 59.1 106 106 A K H 34 S+ 0 0 105 1,-0.2 46,-0.3 -3,-0.2 -2,-0.2 0.731 104.9 64.9 -61.4 -22.7 -21.0 79.8 62.5 107 107 A L H 3< S- 0 0 0 -4,-1.7 -1,-0.2 1,-0.2 2,-0.2 0.863 104.0-134.1 -69.5 -35.9 -18.0 81.8 63.7 108 108 A G << - 0 0 19 -3,-0.9 -1,-0.2 -4,-0.8 42,-0.0 -0.654 38.4 -53.8 110.7-172.5 -18.7 84.6 61.2 109 109 A E S S+ 0 0 71 -2,-0.2 -63,-0.4 -52,-0.1 -1,-0.1 0.048 101.7 111.5 -93.8 26.2 -16.5 86.4 58.8 110 110 A R - 0 0 36 -65,-0.2 -52,-1.8 -3,-0.1 2,-0.4 -0.350 62.7-128.1 -89.7 174.3 -14.2 87.4 61.7 111 111 A T E -Cd 44 58A 5 -67,-0.9 -67,-0.8 -54,-0.2 2,-0.6 -0.990 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77.1 1400 185 F E S S+ 0 0 43 -19,-2.8 22,-0.9 1,-0.3 21,-0.7 0.821 89.1 38.4 -86.6 -34.0 3.2 116.8 75.3 1401 186 F V E -EF13811420M 3 -20,-1.0 -20,-1.2 19,-0.2 -1,-0.3 -0.923 69.4-171.2-126.7 106.3 6.7 116.0 76.6 1402 187 F D E + F 01419M 40 17,-1.9 17,-1.9 -2,-0.5 -22,-0.2 -0.527 13.9 176.0 -84.3 153.6 7.8 112.3 76.8 1403 188 F M E - F 01418M 2 -24,-0.5 -24,-1.2 15,-0.2 2,-0.4 -0.576 20.4-159.3-171.0 110.5 11.1 111.7 78.6 1404 189 F N E -CF13781417M 11 13,-2.1 13,-2.4 -26,-0.2 2,-0.4 -0.701 14.0-169.4 -90.2 136.1 13.1 108.6 79.7 1405 190 F V E -CF13771416M 0 -28,-2.0 -28,-1.9 -2,-0.4 2,-0.5 -0.988 6.7-172.6-130.8 129.9 15.7 109.0 82.4 1406 191 F I E +CF13761415M 2 9,-2.2 8,-3.0 -2,-0.4 9,-1.6 -0.972 17.7 161.5-124.1 119.3 18.3 106.4 83.4 1407 192 F M E -CF13751413M 0 -32,-1.7 -32,-1.6 -2,-0.5 6,-0.2 -0.734 29.8-117.4-129.9 177.9 20.5 106.9 86.5 1408 193 F T E > -C 1374 0M 2 4,-1.9 3,-1.4 -2,-0.2 -34,-0.2 -0.576 35.9-102.8-110.0 173.8 22.8 105.2 89.0 1409 194 F G T 3 S+ 0 0 21 -36,-1.1 -35,-0.1 1,-0.3 -1,-0.1 0.886 120.7 64.1 -63.0 -36.4 22.6 104.6 92.7 1410 195 F S T 3 S- 0 0 71 -37,-0.2 -1,-0.3 1,-0.1 -38,-0.0 0.214 120.0-110.7 -72.5 16.1 25.2 107.4 93.1 1411 196 F G S < S+ 0 0 20 -3,-1.4 -227,-0.3 1,-0.2 2,-0.3 0.766 74.2 131.8 60.9 29.4 22.6 109.8 91.6 1412 197 F R - 0 0 97 -229,-0.1 -4,-1.9 -228,-0.1 2,-0.3 -0.746 57.7-107.7-110.3 160.7 24.4 110.3 88.3 1413 198 F F E +BF11821407M 0 -231,-5.8 -231,-2.3 -2,-0.3 -6,-0.2 -0.690 29.4 173.5 -90.7 138.7 23.0 110.2 84.8 1414 199 F V E S- 0 0 0 -8,-3.0 -237,-2.9 1,-0.4 2,-0.3 0.709 76.3 -3.9-106.1 -38.8 23.8 107.4 82.3 1415 200 F E E -AF11761406M 10 -9,-1.6 -9,-2.2 -239,-0.2 -1,-0.4 -0.968 55.8-164.9-159.2 144.0 21.4 108.5 79.7 1416 201 F L E +AF11751405M 3 -241,-3.9 -241,-3.5 -2,-0.3 2,-0.5 -0.989 10.2 174.9-133.4 121.8 18.8 111.2 79.1 1417 202 F Q E +AF11741404M 32 -13,-2.4 -13,-2.1 -2,-0.4 2,-0.4 -0.918 8.8 165.7-133.3 106.4 16.3 111.1 76.3 1418 203 F G E +AF11731403M 2 -245,-2.8 -245,-2.2 -2,-0.5 2,-0.4 -0.976 7.0 178.2-126.0 135.2 13.7 113.8 76.2 1419 204 F T E -AF11721402M 24 -17,-1.9 -17,-1.9 -2,-0.4 2,-1.0 -0.979 20.7-154.5-140.0 127.8 11.3 114.7 73.3 1420 205 F G E + F 01401M 2 -249,-1.2 -19,-0.2 -2,-0.4 -20,-0.1 -0.806 21.9 169.8 -99.0 95.3 8.6 117.2 73.0 1421 206 F E S S+ 0 0 129 -2,-1.0 -1,-0.2 -21,-0.7 -20,-0.1 0.978 77.4 26.2 -69.3 -59.3 6.3 115.8 70.3 1422 207 F E S S- 0 0 118 -22,-0.9 -2,-0.1 -23,-0.3 -22,-0.1 0.986 136.6 -9.6 -64.8 -79.0 3.3 118.2 70.6 1423 208 F A S S- 0 0 36 -23,-0.1 2,-0.3 1,-0.1 -351,-0.0 0.222 78.8-100.6 -97.2-144.7 5.0 121.3 72.0 1424 209 F T - 0 0 31 -5,-0.1 2,-0.2 -23,-0.1 -253,-0.2 -0.956 25.3-129.2-144.4 158.3 8.5 122.1 73.4 1425 210 F F B -Z 1170 0M 0 -255,-0.8 -255,-1.7 -2,-0.3 2,-0.2 -0.717 12.9-136.0-112.8 165.2 9.9 122.4 76.9 1426 211 F S > - 0 0 18 -2,-0.2 4,-2.9 -257,-0.2 5,-0.2 -0.618 35.7 -98.2-111.4 171.9 12.0 125.0 78.7 1427 212 F R H > S+ 0 0 75 1,-0.2 4,-2.1 -2,-0.2 5,-0.1 0.837 127.5 52.3 -56.6 -31.0 15.0 124.9 81.0 1428 213 F E H > S+ 0 0 164 2,-0.2 4,-1.3 1,-0.1 -1,-0.2 0.948 108.6 46.4 -71.3 -49.9 12.5 125.2 83.7 1429 214 F D H >> S+ 0 0 54 2,-0.2 4,-2.2 1,-0.2 3,-1.4 0.975 112.4 53.1 -53.7 -56.2 10.3 122.4 82.6 1430 215 F L H 3X S+ 0 0 1 -4,-2.9 4,-3.0 1,-0.3 5,-0.3 0.904 106.3 49.8 -45.0 -57.9 13.4 120.2 82.1 1431 216 F N H 3X S+ 0 0 51 -4,-2.1 4,-1.3 1,-0.2 -1,-0.3 0.768 110.2 55.1 -58.0 -22.9 14.7 120.8 85.6 1432 217 F G H X S+ 0 0 84 -4,-1.4 4,-1.9 2,-0.2 3,-1.0 0.994 108.1 44.8 -67.2 -60.5 15.8 100.9 97.1 1447 232 F K H 3X S+ 0 0 73 -4,-1.5 4,-1.7 1,-0.3 5,-0.2 0.831 112.8 56.3 -48.4 -34.2 13.3 98.2 96.2 1448 233 F Q H 3X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.3 0.880 104.9 50.9 -66.8 -40.7 16.1 97.0 94.0 1449 234 F K H < S+ 0 0 7 -4,-2.1 3,-1.5 -5,-0.2 2,-0.4 0.929 85.6 138.5 -53.0 -45.2 18.7 91.7 95.3 1453 238 F G T 3< S+ 0 0 38 -4,-2.5 -1,-0.2 -5,-0.3 3,-0.2 -0.137 75.6 0.6 43.1 -94.1 19.8 91.4 98.9 1454 239 F D T 3 S+ 0 0 148 -2,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.761 105.0 90.8 -94.5 -33.5 22.3 88.5 99.1 1455 240 F S S < S+ 0 0 49 -3,-1.5 -1,-0.1 -4,-0.3 -2,-0.1 0.680 101.1 32.2 -38.1 -24.0 22.5 87.3 95.5 1456 241 F L 0 0 19 -4,-0.3 -1,-0.1 -3,-0.2 -99,-0.1 -0.993 360.0 360.0-143.2 132.3 25.3 89.8 95.1 1457 242 F P 0 0 112 0, 0.0 -89,-0.1 0, 0.0 -3,-0.1 -0.341 360.0 360.0 -65.7 360.0 28.0 91.0 97.7