==== 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 VIRUS 02-JAN-96 1VBD . COMPND 2 MOLECULE: POLIOVIRUS TYPE 1 MAHONEY; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN POLIOVIRUS 1; . AUTHOR R.A.GRANT,C.N.HIREMATH,D.J.FILMAN,R.SYED,K.ANDRIES,J.M.HOGLE . 851 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36197.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 503 59.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 208 24.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 115 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 4.6 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+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 2 3 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 13 7 0 6 5 5 1 0 1 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 1 2 0 2 1 1 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 6 0 G 0 0 118 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-126.1 6.5 50.7 85.1 2 7 0 S - 0 0 74 792,-0.2 2,-0.6 794,-0.0 794,-0.1 -0.838 360.0-140.3-108.7 106.6 6.7 48.8 88.4 3 8 0 S - 0 0 86 -2,-0.7 794,-1.3 1,-0.1 0, 0.0 -0.453 19.1-166.4 -63.0 104.0 8.9 45.8 89.0 4 9 0 S 0 0 68 -2,-0.6 793,-0.9 792,-0.3 -1,-0.1 0.875 360.0 360.0 -54.9-112.3 7.0 43.2 91.1 5 10 0 T 0 0 125 791,-0.1 794,-0.0 793,-0.1 -1,-0.0 -0.562 360.0 360.0 169.8 360.0 9.3 40.4 92.6 6 !* 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 7 20 1 A 0 0 134 0, 0.0 2,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -5.3 18.5 30.6 97.8 8 21 1 A - 0 0 52 826,-0.3 826,-3.0 1,-0.0 2,-0.1 -0.421 360.0-148.5 -68.6 99.1 17.5 29.8 101.5 9 22 1 T B > -A 833 0A 40 -2,-0.9 3,-2.2 824,-0.2 824,-0.3 -0.440 19.4-120.2 -61.2 140.9 15.4 32.7 102.8 10 23 1 S T 3 S+ 0 0 7 822,-2.9 49,-0.5 1,-0.3 52,-0.2 0.799 113.9 48.8 -48.9 -35.8 15.6 33.7 106.5 11 24 1 R T 3 S+ 0 0 91 821,-0.4 -1,-0.3 48,-0.2 2,-0.1 0.295 81.9 119.5 -93.6 11.1 11.9 33.1 106.8 12 25 1 D S < S- 0 0 77 -3,-2.2 47,-0.6 1,-0.1 48,-0.1 -0.461 74.9 -96.9 -67.7 148.3 11.8 29.7 105.2 13 26 1 A B -B 58 0B 59 45,-0.2 45,-0.2 -2,-0.1 3,-0.1 -0.341 40.5-109.6 -65.2 146.4 10.5 26.9 107.4 14 27 1 L - 0 0 20 43,-2.7 762,-0.1 1,-0.2 41,-0.1 -0.251 52.1 -66.6 -70.0 164.7 13.0 24.7 109.2 15 28 1 P - 0 0 62 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.202 52.6-114.7 -59.4 138.1 13.6 21.0 108.2 16 29 1 N - 0 0 66 39,-0.1 2,-0.5 -3,-0.1 38,-0.2 -0.388 26.8-112.9 -64.8 146.4 10.9 18.5 108.7 17 30 1 T B -C 53 0C 27 36,-1.3 36,-2.0 -2,-0.1 2,-0.3 -0.668 32.9-144.7 -81.8 129.1 11.4 15.7 111.2 18 31 1 E - 0 0 113 -2,-0.5 32,-0.1 34,-0.2 2,-0.1 -0.748 19.9-104.2 -93.9 144.5 11.5 12.3 109.5 19 32 1 A - 0 0 70 -2,-0.3 2,-0.4 30,-0.1 32,-0.2 -0.423 42.0-172.3 -65.0 131.3 10.1 9.1 110.8 20 33 1 S - 0 0 32 30,-2.1 30,-0.4 -2,-0.1 26,-0.0 -0.993 4.7-159.0-133.1 136.7 12.9 6.8 112.1 21 34 1 G - 0 0 41 -2,-0.4 29,-0.1 1,-0.2 30,-0.0 -0.214 38.2 -52.4 -98.9-170.3 12.7 3.2 113.3 22 35 1 P - 0 0 103 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.129 53.1-153.5 -59.4 161.0 14.8 0.8 115.5 23 36 1 T + 0 0 121 2,-0.0 2,-0.1 26,-0.0 26,-0.0 -0.994 29.7 166.7-144.4 140.8 18.6 0.3 114.8 24 37 1 H + 0 0 196 -2,-0.3 2,-0.3 0, 0.0 -1,-0.0 -0.567 45.2 117.4-145.0 79.9 21.3 -2.4 115.3 25 38 1 S S S- 0 0 63 2,-0.2 -2,-0.0 -2,-0.1 0, 0.0 -0.841 74.4-103.0-143.2 175.8 24.4 -1.4 113.2 26 39 1 K S S+ 0 0 204 -2,-0.3 2,-0.5 2,-0.0 -1,-0.0 0.473 84.9 107.1 -77.7 -3.0 28.0 -0.4 113.0 27 40 1 E - 0 0 116 1,-0.1 -2,-0.2 825,-0.1 825,-0.2 -0.667 51.6-168.1 -79.8 125.9 27.1 3.3 112.4 28 41 1 I > + 0 0 49 823,-2.5 3,-1.3 -2,-0.5 824,-0.1 -0.323 24.9 154.2-116.3 61.1 27.8 5.4 115.4 29 42 1 P T 3 S+ 0 0 20 0, 0.0 -1,-0.2 0, 0.0 18,-0.1 0.848 78.1 55.7 -54.3 -39.3 26.2 9.0 115.3 30 43 1 A T 3 S+ 0 0 21 16,-0.3 692,-2.8 691,-0.1 2,-0.4 0.838 96.0 77.3 -63.8 -32.1 26.1 9.3 119.1 31 44 1 L E < +D 721 0D 46 -3,-1.3 823,-0.3 690,-0.2 2,-0.2 -0.649 61.8 135.0 -85.7 134.5 29.8 8.7 119.4 32 45 1 T E -D 720 0D 4 688,-2.9 688,-2.8 -2,-0.4 2,-0.3 -0.860 48.3-115.6-156.7-172.3 32.3 11.5 118.6 33 46 1 A > - 0 0 0 -2,-0.2 3,-1.7 686,-0.2 5,-0.4 -0.721 12.0-170.8-144.5 98.0 35.4 13.5 119.5 34 47 1 V G > S+ 0 0 7 1,-0.3 3,-1.9 -2,-0.3 447,-0.1 0.689 76.4 84.2 -63.2 -16.0 35.1 17.3 120.3 35 48 1 E G 3 S+ 0 0 0 1,-0.3 446,-2.1 445,-0.1 -1,-0.3 0.851 77.3 70.2 -51.6 -36.0 38.9 17.7 120.3 36 49 1 T G < S- 0 0 0 -3,-1.7 -1,-0.3 444,-0.2 -2,-0.2 0.713 114.2-114.6 -55.9 -24.8 38.7 18.1 116.5 37 50 1 G S < S+ 0 0 4 -3,-1.9 2,-0.2 1,-0.4 442,-0.2 0.277 77.4 119.2 100.5 -5.9 37.0 21.4 117.0 38 51 1 A - 0 0 4 -5,-0.4 2,-0.5 804,-0.2 -1,-0.4 -0.577 60.5-131.4 -95.5 154.3 33.7 20.3 115.5 39 52 1 T - 0 0 7 802,-3.1 801,-0.0 -2,-0.2 566,-0.0 -0.883 34.5-111.2-100.4 127.6 30.2 20.1 116.9 40 53 1 N - 0 0 3 -2,-0.5 2,-2.4 1,-0.1 802,-0.1 -0.444 24.2-140.8 -64.5 115.5 28.4 16.8 116.3 41 54 1 P + 0 0 41 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.136 42.3 158.6 -78.4 46.6 25.6 17.6 113.7 42 55 1 L - 0 0 1 -2,-2.4 733,-0.3 -13,-0.1 681,-0.0 -0.370 25.3-167.1 -81.2 148.9 23.0 15.3 115.3 43 56 1 V > - 0 0 26 731,-0.1 3,-2.7 -2,-0.1 4,-0.4 -0.926 41.3 -97.2-121.2 157.1 19.2 15.4 115.0 44 57 1 P G >> S+ 0 0 9 0, 0.0 4,-2.3 0, 0.0 3,-1.9 0.833 118.9 62.4 -46.3 -40.2 16.6 13.5 117.2 45 58 1 S G 34 S+ 0 0 37 1,-0.3 5,-0.1 2,-0.2 -3,-0.0 0.631 92.2 67.8 -62.5 -15.1 16.2 10.7 114.7 46 59 1 D G <4 S+ 0 0 38 -3,-2.7 -1,-0.3 1,-0.1 -16,-0.3 0.699 119.0 16.6 -74.4 -24.8 19.9 9.8 115.1 47 60 1 T T <4 S+ 0 0 38 -3,-1.9 2,-0.3 -4,-0.4 -2,-0.2 0.502 126.9 38.8-127.3 -11.6 19.5 8.6 118.7 48 61 1 V S < S- 0 0 34 -4,-2.3 2,-0.6 661,-0.1 -1,-0.2 -0.961 86.1 -96.5-134.2 159.4 15.7 8.1 119.2 49 62 1 Q - 0 0 132 -2,-0.3 2,-0.3 -3,-0.1 -28,-0.2 -0.628 50.7-166.8 -73.5 120.1 12.8 6.7 117.2 50 63 1 T - 0 0 22 -2,-0.6 -30,-2.1 -30,-0.4 2,-0.2 -0.748 16.6-138.1-109.2 156.4 11.0 9.6 115.7 51 64 1 R - 0 0 194 -2,-0.3 2,-0.7 -32,-0.2 -6,-0.1 -0.456 39.5 -89.1 -95.4 176.8 7.7 10.3 114.0 52 65 1 H + 0 0 84 -2,-0.2 2,-0.4 -34,-0.1 -34,-0.2 -0.803 46.7 178.6 -89.5 123.1 7.2 12.4 110.8 53 66 1 V B -C 17 0C 57 -36,-2.0 -36,-1.3 -2,-0.7 2,-1.0 -0.971 25.7-140.0-123.1 131.6 6.5 16.1 111.6 54 67 1 V - 0 0 77 -2,-0.4 -38,-0.1 -38,-0.2 2,-0.1 -0.786 30.1-139.0 -90.5 103.9 6.0 18.8 108.9 55 68 1 Q + 0 0 25 -2,-1.0 -39,-0.1 1,-0.1 -42,-0.1 -0.283 32.7 168.2 -69.7 132.9 7.9 21.8 110.3 56 69 1 H + 0 0 141 -41,-0.1 -1,-0.1 -43,-0.1 -40,-0.0 0.568 42.4 106.5-115.9 -16.1 6.4 25.2 110.1 57 70 1 R - 0 0 26 -44,-0.1 -43,-2.7 719,-0.1 2,-0.3 -0.271 48.6-165.6 -66.9 153.2 8.7 27.3 112.4 58 71 1 S B -B 13 0B 13 -45,-0.2 3,-0.3 721,-0.0 -45,-0.2 -0.947 31.0-129.1-139.2 161.5 11.2 29.7 110.9 59 72 1 R > + 0 0 26 -47,-0.6 3,-1.5 -49,-0.5 -48,-0.2 0.189 66.7 122.8 -96.2 25.0 14.3 31.7 111.9 60 73 1 S G > S+ 0 0 44 1,-0.3 3,-1.2 2,-0.2 6,-0.3 0.889 71.3 48.2 -52.0 -50.3 12.9 35.0 110.5 61 74 1 E G 3 S+ 0 0 58 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.594 106.9 58.0 -74.2 -7.6 13.1 37.0 113.7 62 75 1 S G < S+ 0 0 0 -3,-1.5 538,-2.6 -52,-0.2 539,-0.3 0.214 75.2 120.7-107.9 17.7 16.7 35.9 114.5 63 76 1 S B <> S-I 599 0E 1 -3,-1.2 4,-2.7 536,-0.3 536,-0.3 -0.444 80.5-108.0 -67.0 153.5 18.2 37.2 111.3 64 77 1 I H > S+ 0 0 8 534,-2.1 4,-1.8 1,-0.2 5,-0.2 0.933 121.3 48.8 -55.1 -43.4 21.0 39.8 111.8 65 78 1 E H > S+ 0 0 12 533,-0.2 4,-1.2 1,-0.2 3,-0.3 0.965 113.5 46.5 -55.9 -51.4 18.7 42.6 110.5 66 79 1 S H 4 S+ 0 0 16 -6,-0.3 3,-0.3 1,-0.2 -1,-0.2 0.862 108.3 55.0 -63.0 -36.6 15.8 41.5 112.7 67 80 1 F H < S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.874 120.5 31.4 -63.3 -39.6 18.0 41.2 115.8 68 81 1 F H < S+ 0 0 2 -4,-1.8 2,-2.7 -3,-0.3 -1,-0.2 0.439 86.1 113.4 -97.7 -1.0 19.2 44.8 115.4 69 82 1 A < + 0 0 8 -4,-1.2 2,-0.3 -3,-0.3 -1,-0.1 -0.206 57.8 90.0 -73.9 58.7 16.0 46.3 113.9 70 83 1 R S S- 0 0 82 -2,-2.7 2,-0.7 178,-0.1 503,-0.2 -0.998 80.7-110.9-152.6 141.6 15.1 48.5 116.8 71 84 1 G - 0 0 11 501,-1.5 2,-0.4 -2,-0.3 178,-0.2 -0.699 38.3-164.9 -80.2 114.7 15.9 52.1 117.8 72 85 1 A E -J 248 0F 23 176,-2.5 176,-2.8 -2,-0.7 2,-0.5 -0.813 22.7-114.3-104.3 135.2 18.2 52.0 120.9 73 86 1 C E +J 247 0F 44 -2,-0.4 174,-0.2 174,-0.2 32,-0.2 -0.483 37.3 167.5 -68.7 115.6 19.0 54.9 123.3 74 87 1 V E - 0 0 0 172,-2.9 27,-0.3 -2,-0.5 2,-0.3 0.618 59.5 -5.4-103.1 -13.9 22.7 55.8 123.0 75 88 1 T E -J 246 0F 17 171,-0.8 171,-2.5 26,-0.1 2,-0.5 -0.964 47.3-137.8-171.7 158.4 22.8 59.2 124.8 76 89 1 I E -J 245 0F 79 -2,-0.3 2,-0.4 169,-0.2 169,-0.2 -0.971 23.2-161.9-123.5 114.0 20.9 62.0 126.6 77 90 1 M E -J 244 0F 9 167,-2.9 167,-2.9 -2,-0.5 2,-0.5 -0.802 4.9-151.5 -97.0 136.7 22.1 65.5 125.8 78 91 1 T E +J 243 0F 54 -2,-0.4 2,-0.3 165,-0.2 165,-0.2 -0.917 22.2 161.3-111.5 127.5 21.2 68.5 128.1 79 92 1 V E -J 242 0F 0 163,-2.9 163,-3.0 -2,-0.5 2,-0.3 -0.891 12.0-169.2-129.7 164.9 20.8 72.1 126.9 80 93 1 D E -J 241 0F 9 11,-2.3 151,-0.4 -2,-0.3 161,-0.2 -0.902 22.9-144.1-142.8 179.9 19.1 75.2 128.3 81 94 1 N E -J 240 0F 6 159,-1.6 159,-1.5 -2,-0.3 155,-0.2 -0.775 32.0-173.6-145.9 97.4 18.0 78.7 127.6 82 95 1 P - 0 0 3 0, 0.0 154,-0.6 0, 0.0 156,-0.1 -0.226 34.3 -76.5 -85.7 178.9 18.4 81.0 130.7 83 96 1 A > - 0 0 11 154,-0.3 3,-0.6 152,-0.2 153,-0.1 -0.426 42.9-115.5 -71.2 148.4 17.4 84.6 131.5 84 97 1 S T 3 S+ 0 0 97 1,-0.2 -1,-0.1 151,-0.2 151,-0.0 0.830 112.9 55.3 -52.0 -32.9 19.6 87.4 129.9 85 98 1 T T 3 S+ 0 0 123 152,-0.0 -1,-0.2 2,-0.0 150,-0.0 0.830 75.3 108.3 -69.3 -43.7 20.6 88.4 133.4 86 99 1 T < - 0 0 60 -3,-0.6 0, 0.0 1,-0.2 0, 0.0 -0.168 66.1-137.4 -51.8 120.2 22.0 85.2 134.9 87 100 1 N S S+ 0 0 166 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.720 78.5 87.0 -48.7 -30.0 25.8 85.3 135.3 88 101 1 K S S- 0 0 148 1,-0.1 3,-0.1 3,-0.0 -2,-0.0 -0.584 86.0-101.2 -81.2 140.2 26.2 81.7 134.0 89 102 1 D - 0 0 108 -2,-0.3 2,-0.5 1,-0.1 -1,-0.1 -0.109 36.7 -98.1 -55.1 144.6 26.5 80.8 130.3 90 103 1 K - 0 0 11 1,-0.1 2,-0.6 -8,-0.1 67,-0.4 -0.501 46.4-122.0 -67.5 114.9 23.8 79.5 128.1 91 104 1 L + 0 0 78 -2,-0.5 -11,-2.3 -3,-0.1 2,-0.4 -0.524 34.8 174.5 -66.8 109.1 24.3 75.7 128.0 92 105 1 F - 0 0 38 -2,-0.6 2,-0.3 -13,-0.2 138,-0.2 -0.877 28.3-120.8-106.7 150.5 24.7 74.1 124.6 93 106 1 A E -P 229 0G 11 136,-2.4 136,-2.4 -2,-0.4 2,-0.5 -0.690 19.7-168.9-100.5 141.4 25.6 70.4 124.4 94 107 1 V E +P 228 0G 75 -2,-0.3 2,-0.5 134,-0.2 134,-0.2 -0.966 10.8 179.9-124.8 116.5 28.6 68.6 122.8 95 108 1 W E -P 227 0G 17 132,-3.0 132,-3.0 -2,-0.5 2,-0.6 -0.959 24.8-138.8-118.8 127.6 28.4 64.8 122.4 96 109 1 K E -P 226 0G 99 -2,-0.5 130,-0.3 130,-0.3 2,-0.2 -0.691 38.3-113.1 -76.6 117.1 31.2 62.6 120.9 97 110 1 I + 0 0 29 128,-2.0 127,-0.3 -2,-0.6 2,-0.3 -0.307 58.9 130.7 -65.6 126.1 29.3 60.0 118.7 98 111 1 T - 0 0 39 -2,-0.2 3,-0.3 -24,-0.1 -2,-0.0 -0.990 58.7-135.0-163.5 153.0 29.5 56.5 120.0 99 112 1 Y S S+ 0 0 38 -2,-0.3 7,-0.4 1,-0.2 3,-0.4 0.421 94.0 77.7 -89.3 1.7 27.5 53.3 120.8 100 113 1 K + 0 0 61 1,-0.2 -1,-0.2 5,-0.1 168,-0.1 0.498 64.5 79.3 -93.5 -7.0 29.4 52.9 124.1 101 114 1 D S S+ 0 0 86 -3,-0.3 2,-0.3 -27,-0.3 -1,-0.2 0.704 101.0 43.4 -72.5 -21.0 28.0 55.4 126.6 102 115 1 T S S- 0 0 25 -3,-0.4 4,-0.3 -28,-0.1 -28,-0.1 -0.808 78.4-139.3-115.9 167.5 25.1 53.1 127.2 103 116 1 V S > S+ 0 0 14 -2,-0.3 4,-2.5 3,-0.1 5,-0.2 0.866 80.0 65.4 -99.2 -36.3 25.2 49.3 127.6 104 117 1 Q H > S+ 0 0 87 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.936 107.6 36.0 -61.5 -55.3 22.3 47.5 125.8 105 118 1 L H > S+ 0 0 6 -32,-0.2 4,-2.8 2,-0.2 5,-0.3 0.916 114.9 60.3 -62.9 -39.5 23.0 48.1 122.1 106 119 1 R H > S+ 0 0 8 -7,-0.4 4,-2.2 -4,-0.3 -2,-0.2 0.944 104.6 47.2 -52.6 -50.3 26.8 47.9 122.9 107 120 1 R H < S+ 0 0 0 -4,-2.5 -1,-0.2 2,-0.2 4,-0.2 0.903 111.6 51.0 -62.3 -39.7 26.4 44.3 124.2 108 121 1 K H >< S+ 0 0 22 -4,-1.7 3,-1.6 1,-0.2 -2,-0.2 0.963 112.8 45.0 -62.0 -48.4 24.3 43.3 121.1 109 122 1 L H >< S+ 0 0 1 -4,-2.8 3,-1.4 1,-0.3 -1,-0.2 0.843 104.2 66.2 -63.1 -31.3 26.9 44.7 118.7 110 123 1 E T 3< S+ 0 0 16 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.453 73.7 83.9 -77.5 3.0 29.6 43.1 120.6 111 124 1 F T < S+ 0 0 0 -3,-1.6 148,-3.0 -4,-0.2 2,-0.4 0.560 97.8 53.0 -68.2 -11.7 28.5 39.5 119.8 112 125 1 F E < S-K 258 0F 0 -3,-1.4 145,-0.2 146,-0.3 3,-0.1 -0.975 72.3-146.5-128.4 145.6 30.6 40.3 116.7 113 126 1 T E S+ 0 0 0 144,-2.2 81,-2.5 143,-1.0 82,-0.7 0.930 86.9 22.2 -73.5 -46.6 34.1 41.5 116.0 114 127 1 Y E -KL 256 193F 0 142,-2.0 142,-2.7 79,-0.2 2,-0.3 -0.905 66.7-179.4-125.1 149.3 33.4 43.6 112.9 115 128 1 S E -KL 255 192F 0 77,-2.2 77,-3.3 -2,-0.3 2,-0.4 -0.993 14.1-162.1-144.2 161.1 30.2 45.2 111.4 116 129 1 R E +K 254 0F 28 138,-2.8 138,-2.7 -2,-0.3 2,-0.3 -0.994 30.2 139.5-141.9 125.2 29.0 47.2 108.5 117 130 1 F E - 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