==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 12-APR-99 1CJD . COMPND 2 MOLECULE: PROTEIN (MAJOR CAPSID PROTEIN (P3)); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE PRD1; . AUTHOR S.D.BENSON,J.K.H.BAMFORD,D.H.BAMFORD,R.M.BURNETT . 1108 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40735.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 775 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 389 35.1 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 . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.7 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 . 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 . 123 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 4 0 0 0 0 0 0 0 6 0 0 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 20 12 0 9 3 3 3 0 0 5 7 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 3 3 3 0 0 0 3 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 15 A L 0 0 125 0, 0.0 4,-0.4 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 15.9 59.5 81.4 82.7 2 16 A R > + 0 0 78 1,-0.2 4,-0.9 2,-0.2 0, 0.0 0.472 360.0 67.8 -84.8 -4.4 59.6 79.5 86.0 3 17 A N H > S+ 0 0 62 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.768 82.9 67.5 -83.7 -29.4 57.4 77.2 84.0 4 18 A Q H > S+ 0 0 62 1,-0.2 4,-2.8 -3,-0.2 -1,-0.2 0.849 100.0 54.1 -58.7 -31.7 60.2 76.1 81.7 5 19 A Q H > S+ 0 0 136 -4,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.965 108.8 45.3 -63.8 -55.7 61.6 74.6 84.9 6 20 A A H X S+ 0 0 53 -4,-0.9 4,-2.7 2,-0.2 232,-0.2 0.886 117.7 44.4 -54.8 -47.0 58.5 72.5 85.6 7 21 A M H X S+ 0 0 122 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.958 111.6 51.3 -65.0 -53.1 58.2 71.4 82.0 8 22 A A H X S+ 0 0 67 -4,-2.8 4,-1.6 -5,-0.3 -2,-0.2 0.898 114.9 46.1 -49.9 -43.2 61.9 70.6 81.6 9 23 A A H X S+ 0 0 57 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.891 110.6 51.5 -66.4 -46.2 61.5 68.5 84.8 10 24 A N H X S+ 0 0 11 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.934 109.5 49.7 -59.1 -48.4 58.3 66.8 83.7 11 25 A L H X S+ 0 0 77 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.883 111.3 49.6 -60.1 -37.7 59.8 65.8 80.4 12 26 A Q H X S+ 0 0 123 -4,-1.6 4,-2.1 -5,-0.3 -1,-0.2 0.895 110.3 49.1 -67.8 -41.7 62.9 64.4 82.2 13 27 A A H X S+ 0 0 11 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.871 108.4 56.0 -64.9 -37.3 60.8 62.4 84.6 14 28 A R H X S+ 0 0 40 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.954 108.2 46.7 -59.3 -50.8 58.8 61.0 81.7 15 29 A Q H X S+ 0 0 111 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.892 111.8 50.4 -59.0 -42.9 61.9 59.7 80.0 16 30 A I H X S+ 0 0 41 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.949 112.4 47.5 -62.1 -46.8 63.2 58.1 83.2 17 31 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.927 115.6 44.0 -59.3 -47.3 59.9 56.4 83.8 18 32 A L H < S+ 0 0 44 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.894 117.0 47.5 -63.9 -40.4 59.7 55.2 80.2 19 33 A Q H < S+ 0 0 130 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.889 123.3 30.6 -68.6 -39.2 63.3 54.1 80.4 20 34 A Q H < S+ 0 0 107 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.731 102.4 74.5 -95.6 -30.9 63.1 52.3 83.7 21 35 A S S < S- 0 0 2 -4,-2.7 204,-0.2 -5,-0.3 205,-0.1 -0.378 74.3-127.7 -80.5 165.7 59.6 50.9 84.1 22 36 A Y E -A 224 0A 69 202,-2.2 202,-2.2 -2,-0.1 2,-0.2 -0.972 20.2-121.1-121.4 133.5 58.5 47.8 82.2 23 37 A P E -A 223 0A 55 0, 0.0 2,-0.4 0, 0.0 200,-0.2 -0.380 28.9-173.5 -72.9 137.9 55.3 47.7 80.1 24 38 A V E -A 222 0A 9 198,-3.0 198,-2.7 -2,-0.2 2,-0.4 -0.978 13.1-170.7-133.4 143.0 52.6 45.2 80.8 25 39 A I E +A 221 0A 25 1018,-1.8 1020,-0.4 -2,-0.4 2,-0.3 -0.996 24.0 164.4-132.0 121.3 49.4 44.4 79.0 26 40 A Q E -A 220 0A 71 194,-2.1 194,-3.4 -2,-0.4 2,-0.1 -0.998 41.0-104.1-149.2 145.0 47.1 42.0 80.9 27 41 A Q E +A 219 0A 86 1018,-0.4 192,-0.3 -2,-0.3 3,-0.1 -0.375 32.3 172.9 -62.5 131.0 43.5 40.8 80.9 28 42 A V E + 0 0 36 190,-3.2 2,-0.3 1,-0.4 191,-0.2 0.651 63.6 2.3-112.6 -22.4 41.4 42.4 83.6 29 43 A E E -A 218 0A 47 189,-1.4 189,-2.8 14,-0.1 -1,-0.4 -0.965 49.6-175.6-165.7 145.9 38.0 41.1 82.7 30 44 A T E +A 217 0A 64 -2,-0.3 2,-0.3 187,-0.2 187,-0.2 -0.987 15.5 166.3-138.6 147.2 36.0 38.9 80.3 31 45 A Q E -A 216 0A 53 185,-2.2 185,-2.5 -2,-0.3 2,-0.4 -0.974 21.5-155.7-163.1 146.5 32.3 38.3 80.0 32 46 A T E +A 215 0A 64 -2,-0.3 2,-0.3 183,-0.2 183,-0.3 -0.962 29.4 154.1-123.0 142.4 29.6 36.8 77.8 33 47 A F E -A 214 0A 9 181,-2.9 181,-2.4 -2,-0.4 -2,-0.0 -0.951 44.5-106.4-157.5 174.8 26.1 37.9 77.9 34 48 A D >> - 0 0 57 -2,-0.3 3,-3.3 179,-0.2 4,-1.4 -0.958 21.7-144.6-115.7 113.8 22.8 38.3 76.1 35 49 A P T 34 S+ 0 0 9 0, 0.0 -1,-0.1 0, 0.0 150,-0.1 0.661 99.3 69.9 -46.7 -23.1 21.9 42.0 75.1 36 50 A A T 34 S+ 0 0 70 175,-0.2 3,-0.1 1,-0.2 148,-0.0 0.807 108.5 34.8 -69.1 -26.9 18.3 41.0 75.8 37 51 A N T <4 S- 0 0 134 -3,-3.3 2,-0.3 1,-0.4 -1,-0.2 0.815 133.6 -15.4 -95.2 -40.8 19.2 40.8 79.5 38 52 A R < + 0 0 111 -4,-1.4 -1,-0.4 1,-0.1 3,-0.1 -0.977 41.8 174.2-162.6 154.2 21.8 43.5 80.0 39 53 A S + 0 0 18 -2,-0.3 143,-3.2 1,-0.1 2,-0.5 0.317 61.9 83.9-145.8 3.4 24.1 45.8 77.9 40 54 A V E +F 181 0B 93 141,-0.2 2,-0.3 2,-0.0 141,-0.2 -0.958 53.1 176.0-115.2 127.9 25.7 48.1 80.4 41 55 A F E -F 180 0B 19 139,-2.5 139,-3.1 -2,-0.5 2,-0.6 -0.987 23.9-150.3-134.5 144.4 28.8 47.0 82.3 42 56 A D E -F 179 0B 66 -2,-0.3 2,-0.3 137,-0.2 137,-0.2 -0.939 19.6-160.0-115.1 105.9 31.2 48.6 84.8 43 57 A V E -F 178 0B 0 135,-3.6 135,-2.9 -2,-0.6 -14,-0.1 -0.693 8.0-143.5 -89.9 140.1 34.7 47.2 84.5 44 58 A T - 0 0 78 -2,-0.3 133,-0.1 133,-0.2 3,-0.1 -0.874 15.7-148.6-109.0 104.3 37.1 47.6 87.4 45 59 A P - 0 0 5 0, 0.0 131,-0.4 0, 0.0 2,-0.3 -0.137 26.2 -99.5 -60.8 161.7 40.7 48.1 86.3 46 60 A A - 0 0 34 129,-0.1 2,-1.2 2,-0.1 123,-0.0 -0.639 27.6-130.6 -82.5 143.5 43.6 46.9 88.4 47 61 A N + 0 0 50 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.1 -0.605 58.0 135.3 -95.9 73.8 45.2 49.7 90.5 48 62 A V - 0 0 45 -2,-1.2 175,-0.2 124,-0.0 121,-0.2 -0.980 62.5 -50.7-126.3 135.6 48.8 49.0 89.4 49 63 A G S S- 0 0 3 -2,-0.4 120,-2.8 120,-0.1 2,-0.6 0.046 104.5 -18.9 42.5-144.2 51.6 51.5 88.4 50 64 A I E -BC 168 223A 0 173,-1.8 173,-2.8 118,-0.2 2,-0.5 -0.879 68.4-143.1 -98.6 120.8 50.9 54.1 85.7 51 65 A V E +BC 167 222A 0 116,-3.6 116,-2.3 -2,-0.6 171,-0.3 -0.720 21.2 177.4 -88.4 126.1 47.9 53.1 83.5 52 66 A K E - 0 0 5 169,-2.6 104,-2.5 -2,-0.5 105,-1.7 0.766 54.7 -60.1 -96.5 -33.1 48.1 54.0 79.8 53 67 A G E -DC 155 221A 0 168,-1.5 168,-2.9 102,-0.2 2,-0.4 -0.984 44.5 -94.4 169.6-176.1 44.9 52.6 78.4 54 68 A F E -DC 154 220A 0 100,-2.3 100,-3.3 -2,-0.3 2,-0.7 -0.994 16.9-149.6-133.0 132.9 42.6 49.7 77.8 55 69 A L E -DC 153 219A 9 164,-2.7 164,-2.6 -2,-0.4 2,-0.6 -0.922 19.6-159.8-102.9 118.5 42.2 47.5 74.8 56 70 A V E -DC 152 218A 1 96,-3.2 96,-1.8 -2,-0.7 2,-0.4 -0.906 4.0-163.2-106.4 116.8 38.7 46.3 74.6 57 71 A K E -DC 151 217A 32 160,-3.1 160,-2.2 -2,-0.6 2,-0.4 -0.851 9.9-174.9 -97.7 129.9 38.0 43.2 72.5 58 72 A V E +DC 150 216A 0 92,-2.8 92,-2.6 -2,-0.4 2,-0.3 -0.995 6.7 178.1-130.8 126.9 34.3 42.6 71.5 59 73 A T E +DC 149 215A 41 156,-2.3 156,-2.6 -2,-0.4 2,-0.3 -0.945 7.2 174.6-125.1 148.3 32.9 39.6 69.7 60 74 A A E -DC 148 214A 3 88,-1.5 88,-2.9 -2,-0.3 2,-0.5 -0.995 24.4-146.3-152.0 151.3 29.3 39.0 68.8 61 75 A A E -DC 147 213A 5 152,-2.1 151,-2.9 -2,-0.3 152,-1.3 -0.992 20.2-165.6-121.1 128.8 27.1 36.6 66.9 62 76 A I E -DC 146 211A 0 84,-2.7 84,-2.9 -2,-0.5 2,-0.5 -0.971 3.4-156.6-119.2 127.3 24.1 38.1 65.2 63 77 A T E -DC 145 210A 17 147,-2.9 147,-2.2 -2,-0.5 2,-1.0 -0.900 8.9-152.4-109.2 129.3 21.2 36.0 63.8 64 78 A N E + C 0 209A 0 80,-3.2 79,-2.9 -2,-0.5 145,-0.3 -0.827 17.6 177.9 -95.2 95.2 19.0 37.2 61.1 65 79 A N + 0 0 85 143,-2.2 144,-0.2 -2,-1.0 2,-0.1 0.167 34.1 131.9 -84.9 19.0 15.8 35.2 62.0 66 80 A H - 0 0 36 3,-0.2 77,-0.1 139,-0.1 139,-0.1 -0.468 62.3-130.2 -74.1 147.2 13.9 36.8 59.1 67 81 A A S S- 0 0 91 -2,-0.1 -1,-0.1 75,-0.1 138,-0.1 0.917 89.8 -17.1 -58.0 -49.6 11.9 34.6 56.8 68 82 A T S S+ 0 0 108 136,-0.1 74,-0.4 2,-0.1 2,-0.2 0.620 108.3 92.0-133.9 -30.4 13.3 35.9 53.6 69 83 A E - 0 0 88 135,-0.2 -3,-0.2 72,-0.1 74,-0.2 -0.557 52.0-152.8 -84.2 140.9 15.0 39.4 53.9 70 84 A A - 0 0 39 -2,-0.2 135,-1.9 71,-0.1 2,-0.3 -0.368 5.4-142.3 -97.1 177.4 18.7 40.0 54.5 71 85 A V E -O 140 0C 5 69,-1.5 69,-2.4 133,-0.2 2,-0.3 -0.959 10.0-150.8-137.5 155.6 20.5 43.0 56.2 72 86 A A E -OP 139 202C 38 130,-2.9 130,-2.6 -2,-0.3 67,-0.2 -0.959 31.7 -86.5-130.0 149.6 23.8 44.6 55.3 73 87 A L E - P 0 201C 13 65,-2.1 128,-0.3 -2,-0.3 2,-0.1 -0.134 39.2-131.9 -50.9 142.3 26.5 46.5 57.3 74 88 A T - 0 0 7 126,-2.0 424,-0.2 125,-0.1 -1,-0.1 -0.315 39.3 -89.8 -82.3 178.8 25.9 50.2 57.9 75 89 A D S S+ 0 0 33 1,-0.2 423,-2.9 422,-0.1 122,-0.1 0.844 130.9 38.5 -61.7 -33.8 28.9 52.6 57.2 76 90 A F S > S+ 0 0 7 120,-0.3 3,-2.4 123,-0.3 -1,-0.2 0.729 86.1 160.2 -88.8 -28.2 30.0 52.2 60.8 77 91 A G G > + 0 0 0 1,-0.3 3,-2.1 122,-0.3 -1,-0.2 -0.097 69.0 8.9 48.7-124.4 29.2 48.5 61.1 78 92 A P G > S+ 0 0 0 0, 0.0 3,-1.9 0, 0.0 4,-0.3 0.632 114.5 79.3 -63.9 -14.1 31.1 46.7 64.0 79 93 A A G < S+ 0 0 0 -3,-2.4 3,-0.4 1,-0.3 25,-0.2 0.681 88.6 59.5 -66.9 -15.0 32.3 50.1 65.3 80 94 A N G < S+ 0 0 0 -3,-2.1 -1,-0.3 1,-0.2 120,-0.1 0.197 72.3 97.8 -96.4 15.4 28.8 50.3 66.8 81 95 A L S < S+ 0 0 0 -3,-1.9 102,-2.4 1,-0.2 2,-0.6 0.804 88.9 46.8 -70.8 -29.0 29.2 47.1 68.9 82 96 A V E S-G 182 0B 1 -3,-0.4 18,-0.4 -4,-0.3 100,-0.3 -0.970 71.9-171.7-111.8 120.5 30.0 49.5 71.8 83 97 A Q E - 0 0 23 98,-2.6 17,-1.6 -2,-0.6 2,-0.3 0.908 66.7 -5.0 -77.4 -42.8 27.5 52.4 71.9 84 98 A R E -GH 181 99B 104 97,-1.7 97,-2.6 15,-0.3 2,-0.3 -0.992 54.3-157.7-151.9 158.6 29.4 54.4 74.6 85 99 A V E +GH 180 98B 2 13,-2.5 13,-1.4 -2,-0.3 2,-0.4 -0.983 8.8 179.8-136.2 144.2 32.4 54.5 76.9 86 100 A I E -GH 179 97B 22 93,-2.0 93,-3.2 -2,-0.3 2,-0.4 -0.978 7.9-163.3-145.1 134.4 33.1 56.5 80.1 87 101 A Y E -G 178 0B 0 9,-2.0 8,-2.6 -2,-0.4 2,-0.4 -0.974 3.0-170.1-122.0 134.9 36.2 56.3 82.3 88 102 A Y E -GH 177 94B 37 89,-2.5 89,-2.2 -2,-0.4 6,-0.2 -0.982 17.1-141.7-118.9 130.5 36.6 57.6 85.9 89 103 A D > - 0 0 1 4,-2.6 3,-2.2 -2,-0.4 80,-0.1 -0.270 38.6 -87.7 -84.0 174.7 40.0 57.7 87.5 90 104 A P T 3 S+ 0 0 7 0, 0.0 -1,-0.1 0, 0.0 79,-0.0 0.707 129.2 56.2 -56.5 -19.7 40.7 56.9 91.2 91 105 A D T 3 S- 0 0 103 2,-0.1 3,-0.1 80,-0.0 83,-0.1 0.165 119.3-110.4 -94.9 14.8 40.0 60.5 92.1 92 106 A N S < S+ 0 0 97 -3,-2.2 2,-0.5 1,-0.2 84,-0.0 0.751 72.4 141.9 63.1 23.3 36.5 60.3 90.5 93 107 A Q - 0 0 75 -4,-0.0 -4,-2.6 1,-0.0 -1,-0.2 -0.842 48.9-130.3 -95.0 130.0 37.6 62.6 87.7 94 108 A R E +H 88 0B 112 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.524 28.0 175.7 -77.9 146.4 36.1 61.6 84.3 95 109 A H E + 0 0 3 -8,-2.6 150,-0.2 1,-0.5 -1,-0.1 0.312 61.5 17.6-112.6-109.4 38.4 61.3 81.3 96 110 A T E + 0 0 1 59,-0.3 -9,-2.0 148,-0.3 -1,-0.5 -0.353 56.2 168.0 -67.0 138.1 36.9 60.1 78.1 97 111 A E E +Hi 86 247B 33 149,-2.6 151,-0.9 -11,-0.2 2,-0.3 -0.749 33.8 115.9-147.2 93.7 33.1 60.1 77.7 98 112 A T E -H 85 0B 0 -13,-1.4 -13,-2.5 -2,-0.2 2,-0.1 -0.877 62.7 -75.4-150.7-179.3 32.2 59.4 74.0 99 113 A S E > -H 84 0B 5 -2,-0.3 4,-2.4 -15,-0.2 -15,-0.3 -0.433 39.1-118.2 -80.7 156.8 30.5 57.1 71.5 100 114 A G H > S+ 0 0 0 -17,-1.6 4,-2.6 -18,-0.4 -17,-0.2 0.901 115.4 51.5 -63.3 -38.2 32.1 53.9 70.3 101 115 A W H > S+ 0 0 6 -18,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.914 109.9 48.7 -66.9 -39.0 32.2 55.1 66.7 102 116 A H H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.947 111.4 49.2 -65.1 -46.1 34.0 58.3 67.8 103 117 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.940 112.1 50.1 -55.7 -45.8 36.5 56.4 69.8 104 118 A H H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 11,-0.3 0.932 108.3 51.2 -59.7 -46.9 37.1 54.1 66.9 105 119 A F H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.869 111.0 49.1 -60.6 -35.4 37.6 57.1 64.4 106 120 A V H X S+ 0 0 1 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.897 106.9 55.3 -69.9 -38.0 40.2 58.6 66.8 107 121 A N H X S+ 0 0 7 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.932 111.6 45.5 -57.2 -44.8 42.0 55.2 67.1 108 122 A T H X>S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-1.2 0.952 111.1 51.3 -62.5 -50.5 42.2 55.3 63.3 109 123 A A H <5S+ 0 0 10 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.902 112.7 46.8 -55.5 -42.7 43.4 58.9 63.2 110 124 A K H <5S+ 0 0 63 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.833 112.3 48.3 -72.2 -32.7 46.1 58.1 65.7 111 125 A Q H <5S- 0 0 47 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.826 105.0-129.3 -74.2 -29.8 47.3 55.0 63.9 112 126 A G T <5S+ 0 0 28 -4,-2.4 -3,-0.2 1,-0.2 -4,-0.1 0.631 83.8 51.2 88.5 14.7 47.4 56.9 60.6 113 127 A A S S- 0 0 1 0, 0.0 3,-2.0 0, 0.0 -9,-0.1 -0.168 80.3 -93.0 -43.1 122.4 42.0 52.3 59.5 115 129 A F T 3 S- 0 0 9 1,-0.3 -7,-0.1 -11,-0.3 36,-0.1 -0.164 97.4 -13.1 -49.1 125.2 42.6 50.9 63.1 116 130 A L T 3 S+ 0 0 4 1,-0.2 18,-0.3 -3,-0.2 -1,-0.3 0.726 98.5 153.2 51.9 30.2 44.0 47.4 63.2 117 131 A S < - 0 0 5 -3,-2.0 2,-0.6 16,-0.1 -1,-0.2 -0.347 47.5-123.4 -83.0 164.2 43.3 46.9 59.5 118 132 A S - 0 0 2 -2,-0.1 376,-1.8 943,-0.1 943,-0.3 -0.960 26.5-138.6-112.0 114.3 45.2 44.6 57.1 119 133 A M B -R 493 0D 20 941,-3.1 2,-0.4 -2,-0.6 374,-0.2 -0.460 16.5-124.4 -71.4 140.2 46.5 46.5 54.2 120 134 A V + 0 0 60 372,-2.6 742,-2.6 742,-0.2 372,-0.3 -0.751 38.9 164.5 -90.4 131.9 46.2 44.8 50.8 121 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