Protein Data Bank File : 1ao3a Title : COLLAGEN-BINDING 16-JUL-97 1AO3 Number of Amino Acid Residues : 187 Amino Acid Sequence : 1 2 3 4 5 6 7 8 9 10 0 CYS SER GLN PRO LEU ASP VAL ILE LEU LEU 10 LEU ASP GLY SER SER SER PHE PRO ALA SER 20 TYR PHE ASP GLU MET LYS SER PHE ALA LYS 30 ALA PHE ILE SER LYS ALA ASN ILE GLY PRO 40 ARG LEU THR GLN VAL SER VAL LEU GLN TYR 50 GLY SER ILE THR THR ILE ASP VAL PRO TRP 60 ASN VAL VAL PRO GLU LYS ALA HIS LEU LEU 70 SER LEU VAL ASP VAL MET GLN ARG GLU GLY 80 GLY PRO SER GLN ILE GLY ASP ALA LEU GLY 90 PHE ALA VAL ARG TYR LEU THR SER GLU MET 100 HIS GLY ALA ARG PRO GLY ALA SER LYS ALA 110 VAL VAL ILE LEU VAL THR ASP VAL SER VAL 120 ASP SER VAL ASP ALA ALA ALA ASP ALA ALA 130 ARG SER ASN ARG VAL THR VAL PHE PRO ILE 140 GLY ILE GLY ASP ARG TYR ASP ALA ALA GLN 150 LEU ARG ILE LEU ALA GLY PRO ALA GLY ASP 160 SER ASN VAL VAL LYS LEU GLN ARG ILE GLU 170 ASP LEU PRO THR MET VAL THR LEU GLY ASN 180 SER PHE LEU HIS LYS LEU CYS Main and Side Chain Dihedral Angles : Residue Type Phi Psi Omega Chi 1 Chi 2 Chi 3 Chi 4 1 CYS 0.0 80.7 178.3 -57.4 2 SER -137.0 -5.5 179.7 -56.5 3 GLN -97.6 153.2 179.9 37.5 -87.8 51.4 4 PRO -57.9 124.7 -178.5 26.2 -42.3 5 LEU -144.8 123.9 177.6 -164.6 -128.9 6 ASP -99.4 111.8 -179.8 -76.8 -12.5 7 VAL -116.6 134.6 174.5 -139.9 8 ILE -110.0 125.3 175.3 -74.0 -173.5 9 LEU -97.4 112.4 -178.5 -62.9 -179.8 10 LEU -104.1 98.2 -177.6 179.7 55.8 11 LEU -79.5 149.3 179.9 -41.9 -173.7 12 ASP -81.9 107.8 179.4 -172.1 -21.8 13 GLY -111.5 22.7 179.7 14 SER -78.4 165.7 -179.6 71.3 15 SER -86.8 27.3 -177.8 -61.1 16 SER -66.7 -53.0 -179.4 -65.4 17 PHE -114.4 162.3 180.0 -74.1 86.1 18 PRO -48.4 148.4 -179.1 -33.7 42.8 19 ALA -62.1 -11.3 177.8 20 SER -64.9 -28.7 179.1 52.2 21 TYR -63.2 -36.5 -179.5 -77.6 43.4 22 PHE -61.8 -35.5 -179.7 -162.4 71.7 23 ASP -66.7 -21.8 179.3 -52.8 -20.7 24 GLU -76.6 -42.3 178.9 -135.3 57.4 55.2 25 MET -57.6 -43.2 177.9 -61.5 -173.8 -175.2 26 LYS -66.8 -29.2 179.0 -68.8 165.0 47.1 154.9 27 SER -76.4 -29.6 178.3 -69.2 28 PHE -64.0 -46.1 -178.9 167.0 65.4 29 ALA -66.4 -41.5 179.5 30 LYS -63.9 -39.3 -179.1 -62.5 -169.0 -167.6 172.1 31 ALA -70.1 -39.5 178.9 32 PHE -60.1 -47.6 -179.5 -176.9 89.6 33 ILE -62.0 -50.1 179.4 -75.2 163.4 34 SER -57.8 -30.9 -178.7 -70.6 35 LYS -81.1 -30.4 -177.1 -126.6 81.8 165.6 65.3 36 ALA -64.8 147.4 179.0 37 ASN -90.0 82.1 -176.4 -163.3 13.8 38 ILE -85.6 129.8 -179.7 -58.6 179.5 39 GLY -172.6 163.4 -179.7 40 PRO -61.8 -29.9 178.8 -27.5 44.1 41 ARG -116.1 19.4 -178.9 -63.4 -137.1 -93.0 -119.2 42 LEU -124.6 -125.9 -179.6 -106.6 16.7 43 THR -94.8 133.0 179.7 -60.4 44 GLN -120.7 127.1 178.3 -110.3 -148.6 139.8 45 VAL -125.0 133.7 179.2 19.6 46 SER -113.7 147.5 179.3 -169.4 47 VAL -126.5 118.1 178.4 -175.1 48 LEU -117.5 170.7 176.9 -77.9 52.0 49 GLN -148.5 146.8 -179.4 67.5 164.8 117.0 50 TYR -117.9 157.6 179.7 66.1 -88.5 51 GLY -179.1 -125.4 178.1 52 SER -60.1 -32.2 177.7 -61.6 53 ILE -146.7 160.3 178.9 59.6 161.8 54 THR -97.1 127.2 178.7 -63.5 55 THR -118.0 152.4 -179.6 69.5 56 ILE -100.2 111.4 -178.5 -51.2 -168.7 57 ASP -95.4 -28.0 175.5 -58.3 -57.7 58 VAL -132.6 104.3 -179.9 -173.7 59 PRO -86.6 173.1 176.9 39.1 -41.2 60 TRP -73.9 168.6 179.0 -53.8 121.9 61 ASN 67.9 54.7 176.6 -64.9 -26.1 62 VAL -123.5 153.5 179.5 168.2 63 VAL -66.3 133.7 -179.5 168.6 64 PRO -69.1 51.3 178.3 -18.0 38.0 65 GLU -106.4 113.4 179.9 -122.6 61.5 88.4 66 LYS -56.5 -41.7 179.0 -75.7 -177.3 179.8 172.5 67 ALA -54.6 -39.1 -179.2 68 HIS -72.6 -43.3 178.6 172.2 59.5 69 LEU -64.3 -31.5 179.4 -70.0 162.1 70 LEU -73.4 -26.9 178.2 -57.2 -178.5 71 SER -73.4 -36.9 179.1 -54.4 72 LEU -65.4 -46.6 178.6 -103.2 16.9 73 VAL -64.5 -46.3 -179.4 174.7 74 ASP -49.9 -36.1 -178.4 -168.2 77.2 75 VAL -82.9 -9.5 179.6 95.0 76 MET -60.3 148.3 179.4 -73.1 174.7 70.3 77 GLN -139.6 141.4 178.9 -57.6 160.7 73.7 78 ARG -54.0 126.7 179.5 -155.7 -172.9 68.4 166.9 79 GLU -66.5 -49.6 -179.3 149.8 62.1 34.8 80 GLY 91.3 162.8 179.7 81 GLY 113.4 -178.9 -179.8 82 PRO -74.2 160.2 178.7 32.4 -44.1 83 SER -80.9 86.0 178.1 -70.6 84 GLN -99.2 74.7 -178.5 -59.1 175.0 122.5 85 ILE -65.3 -41.3 -179.7 -59.8 173.1 86 GLY -56.0 -50.8 -179.9 87 ASP -62.8 -37.6 -178.2 -156.9 75.6 88 ALA -70.2 -38.3 179.7 89 LEU -70.4 -40.4 178.4 177.3 55.4 90 GLY -58.8 -43.3 179.0 91 PHE -64.7 -43.8 -179.2 178.0 -80.1 92 ALA -61.7 -37.9 -179.0 93 VAL -67.6 -38.6 178.6 170.3 94 ARG -70.9 -45.3 -179.4 -63.6 -179.8 -58.9 -116.0 95 TYR -60.2 -31.6 -178.3 -171.9 62.3 96 LEU -79.2 -25.5 -179.1 -162.0 42.7 97 THR -111.1 12.3 -178.5 58.9 98 SER -83.9 134.8 178.8 -170.5 99 GLU -70.3 -51.8 -178.0 38.0 -161.5 2.8 100 MET -68.8 -7.2 -177.2 43.8 -95.7 -83.2 101 HIS -104.4 -12.7 178.2 -65.3 -85.3 102 GLY 127.3 -15.0 179.9 103 ALA -62.5 129.6 -179.3 104 ARG -79.4 132.6 179.2 -57.6 121.1 98.1 -156.9 105 PRO -78.0 136.8 -179.4 -25.0 42.9 106 GLY 94.0 -10.8 177.6 107 ALA -84.6 151.7 177.3 108 SER -67.7 152.1 -177.9 -66.7 109 LYS -119.6 136.1 178.8 -51.6 -60.6 -167.4 -173.3 110 ALA -154.5 140.7 175.7 111 VAL -124.1 127.5 177.3 40.3 112 VAL -101.3 112.9 -177.9 -178.9 113 ILE -111.7 127.4 -179.8 177.5 179.1 114 LEU -94.2 129.4 -178.8 -50.6 -171.3 115 VAL -128.3 125.4 180.0 -179.4 116 THR -115.1 -15.7 -178.4 67.9 117 ASP -137.0 178.3 178.3 -155.5 15.4 118 VAL -87.5 137.4 -179.5 -3.0 119 SER -59.5 135.5 179.7 -168.1 120 VAL -77.0 -19.4 178.6 80.4 121 ASP -121.3 163.3 179.3 58.4 1.1 122 SER -66.5 141.6 -179.1 167.2 123 VAL -106.7 -0.1 -177.9 -67.6 124 ASP -59.7 -48.9 -179.6 -66.4 83.1 125 ALA -58.7 -53.6 178.9 126 ALA -58.3 -37.9 180.0 127 ALA -64.4 -39.5 178.4 128 ASP -64.3 -48.4 -179.8 -79.5 -24.8 129 ALA -58.0 -30.2 179.7 130 ALA -71.4 -45.8 -178.4 131 ARG -70.0 -43.4 179.2 70.1 145.9 56.3 66.3 132 SER -62.9 -20.8 178.9 66.6 133 ASN -99.7 8.6 179.3 -74.1 -90.0 134 ARG 59.6 37.2 177.6 175.5 49.0 -166.5 86.2 135 VAL -100.6 121.7 177.1 172.1 136 THR -85.3 127.1 179.0 -54.4 137 VAL -115.3 137.1 179.6 -0.1 138 PHE -116.9 100.6 179.7 -68.6 -87.5 139 PRO -83.9 138.5 178.4 -12.1 33.3 140 ILE -124.9 107.8 179.1 -56.4 179.7 141 GLY -88.1 137.2 -179.5 142 ILE -125.8 128.5 179.3 -67.7 149.0 143 GLY 90.3 -148.2 -177.8 144 ASP -136.0 16.7 -178.2 45.6 63.8 145 ARG -102.8 -7.8 179.7 -46.9 -171.4 51.7 -123.7 146 TYR -78.6 159.0 178.4 60.7 74.3 147 ASP -92.3 113.2 -179.1 179.7 -11.1 148 ALA -57.2 -34.8 178.7 149 ALA -66.0 -31.9 178.9 150 GLN -69.4 -41.8 178.5 -87.7 178.5 175.2 151 LEU -61.0 -41.3 -178.7 -69.4 -157.7 152 ARG -63.9 -40.3 -179.5 -166.2 -173.4 68.0 -121.3 153 ILE -73.2 -34.2 177.7 97.7 109.9 154 LEU -62.1 -32.5 179.4 -69.4 177.6 155 ALA -74.3 -2.8 178.1 156 GLY 60.1 -137.6 -179.6 157 PRO -52.4 -39.0 -178.9 -25.9 41.5 158 ALA -64.9 -30.5 -178.5 159 GLY 59.8 -136.1 -178.1 160 ASP -67.3 -9.4 177.6 -62.2 -87.7 161 SER -65.8 -24.8 -179.6 -67.4 162 ASN -106.1 -0.9 -178.3 -78.5 1.9 163 VAL -91.6 137.4 178.0 175.4 164 VAL -121.5 124.8 178.9 173.3 165 LYS -111.0 118.5 -179.3 -76.9 156.9 176.4 171.9 166 LEU -111.2 137.1 -179.4 -112.4 29.3 167 GLN -85.4 -30.6 179.5 44.6 -71.5 -76.3 168 ARG -131.1 146.0 179.3 -65.9 -165.1 -55.8 146.8 169 ILE -60.8 -33.6 -179.3 -170.5 65.2 170 GLU -66.6 -14.5 179.0 -56.0 89.8 -14.2 171 ASP -82.7 -13.8 -177.5 -64.8 -38.9 172 LEU -62.7 -60.4 179.8 -174.9 59.6 173 PRO -64.8 -32.0 -179.7 25.8 -39.2 174 THR -62.9 -15.2 179.3 -154.0 175 MET -74.8 -19.5 179.2 -176.7 -178.6 78.9 176 VAL -111.9 -18.8 179.8 -50.7 177 THR -87.6 -35.9 -179.0 57.8 178 LEU -86.2 43.7 179.3 -134.5 43.1 179 GLY 125.1 152.3 179.6 180 ASN -92.8 41.9 -179.3 -56.6 69.9 181 SER -74.7 -49.6 179.9 -48.9 182 PHE -62.7 -51.6 -179.6 -168.6 58.6 183 LEU -57.4 -24.6 178.0 -57.2 96.7 184 HIS -63.9 -48.3 -179.1 -103.5 145.4 185 LYS -63.1 -21.0 179.8 -163.9 157.3 56.1 -178.2 186 LEU -79.5 -43.3 -179.4 -94.2 174.4 187 CYS -146.1 -88.8 0.0 19.7 Alpha Carbon Cartesian Coordinates : Residue Type X Y Z 1 CYS -21.796 -9.912 6.482 2 SER -25.344 -10.740 5.363 3 GLN -26.386 -7.091 5.094 4 PRO -26.029 -4.878 1.957 5 LEU -22.519 -3.461 1.707 6 ASP -20.802 -1.442 -1.070 7 VAL -16.996 -1.766 -0.674 8 ILE -14.358 -0.067 -2.737 9 LEU -10.890 -1.614 -2.549 10 LEU -8.661 1.324 -3.473 11 LEU -5.255 -0.051 -4.437 12 ASP -2.065 1.936 -4.467 13 GLY -1.064 2.115 -8.098 14 SER 1.507 4.855 -7.645 15 SER 5.169 4.438 -8.699 16 SER 6.366 4.563 -5.083 17 PHE 7.619 1.002 -4.661 18 PRO 8.690 -1.591 -7.247 19 ALA 5.785 -2.914 -9.333 20 SER 6.241 -6.302 -7.694 21 TYR 4.310 -4.673 -4.855 22 PHE 1.249 -4.182 -7.030 23 ASP 0.985 -7.921 -7.587 24 GLU 0.642 -8.401 -3.855 25 MET -2.153 -5.886 -3.876 26 LYS -3.895 -7.839 -6.663 27 SER -3.528 -11.018 -4.636 28 PHE -5.016 -9.095 -1.769 29 ALA -8.021 -8.169 -3.922 30 LYS -8.584 -11.662 -5.297 31 ALA -8.630 -13.158 -1.797 32 PHE -10.980 -10.525 -0.408 33 ILE -13.313 -11.220 -3.303 34 SER -13.139 -14.983 -3.006 35 LYS -13.943 -14.501 0.681 36 ALA -16.804 -12.008 0.209 37 ASN -20.540 -12.855 0.386 38 ILE -21.294 -11.382 -3.036 39 GLY -24.831 -10.756 -4.254 40 PRO -27.202 -8.029 -5.523 41 ARG -28.658 -7.642 -2.019 42 LEU -25.465 -8.678 -0.177 43 THR -21.845 -7.515 -0.674 44 GLN -20.797 -5.549 -3.792 45 VAL -17.138 -4.750 -4.488 46 SER -15.515 -2.271 -6.827 47 VAL -11.719 -2.081 -7.312 48 LEU -10.022 1.231 -8.148 49 GLN -6.322 2.191 -8.088 50 TYR -4.624 5.546 -7.715 51 GLY -1.584 7.285 -9.142 52 SER -1.527 10.134 -11.647 53 ILE -5.313 9.530 -11.898 54 THR -7.702 7.149 -10.174 55 THR -9.073 4.500 -12.534 56 ILE -11.934 2.070 -12.044 57 ASP -10.825 -1.438 -12.952 58 VAL -13.834 -3.275 -11.487 59 PRO -16.986 -1.057 -11.533 60 TRP -20.343 -1.622 -9.844 61 ASN -22.838 -3.484 -12.101 62 VAL -20.811 -6.545 -12.991 63 VAL -22.397 -10.033 -12.858 64 PRO -21.919 -11.440 -9.293 65 GLU -19.787 -14.269 -10.630 66 LYS -16.643 -14.521 -8.531 67 ALA -14.882 -16.280 -11.384 68 HIS -15.639 -13.182 -13.451 69 LEU -14.572 -10.632 -10.819 70 LEU -11.233 -12.544 -10.415 71 SER -10.538 -12.280 -14.159 72 LEU -11.017 -8.492 -14.038 73 VAL -8.581 -8.086 -11.149 74 ASP -6.153 -10.506 -12.794 75 VAL -5.914 -8.239 -15.782 76 MET -5.164 -5.055 -13.754 77 GLN -1.780 -3.390 -14.312 78 ARG -0.185 -0.625 -12.308 79 GLU -1.172 2.880 -13.509 80 GLY 1.953 4.587 -12.207 81 GLY 2.419 8.154 -11.068 82 PRO 2.456 9.963 -7.676 83 SER 0.574 9.211 -4.454 84 GLN -2.309 11.668 -4.699 85 ILE -4.269 10.102 -1.839 86 GLY -6.447 13.117 -1.147 87 ASP -7.699 13.121 -4.706 88 ALA -8.181 9.345 -4.862 89 LEU -10.257 9.183 -1.694 90 GLY -12.330 12.089 -2.953 91 PHE -12.976 10.180 -6.167 92 ALA -13.785 7.002 -4.223 93 VAL -16.337 8.739 -1.968 94 ARG -18.256 10.126 -4.923 95 TYR -18.205 6.833 -6.883 96 LEU -19.490 5.147 -3.748 97 THR -22.344 7.602 -3.216 98 SER -23.240 8.112 -6.878 99 GLU -26.742 7.437 -8.125 100 MET -25.748 7.034 -11.765 101 HIS -22.937 4.481 -11.347 102 GLY -24.402 1.477 -9.643 103 ALA -23.923 2.196 -5.956 104 ARG -26.979 0.988 -4.019 105 PRO -28.837 3.559 -1.933 106 GLY -29.268 2.307 1.609 107 ALA -26.275 -0.054 1.546 108 SER -23.474 0.524 4.109 109 LYS -20.448 2.250 2.555 110 ALA -16.745 1.476 3.014 111 VAL -13.425 2.081 1.279 112 VAL -10.324 -0.007 2.055 113 ILE -7.307 2.115 1.033 114 LEU -3.777 0.787 0.710 115 VAL -1.122 3.387 1.435 116 THR 2.629 2.892 0.869 117 ASP 3.873 6.504 0.797 118 VAL 3.026 9.947 2.149 119 SER 0.364 11.786 0.155 120 VAL 1.630 14.377 -2.283 121 ASP -1.622 16.336 -1.681 122 SER -3.581 17.297 1.462 123 VAL -5.946 14.563 2.588 124 ASP -8.182 16.636 4.857 125 ALA -10.984 17.524 2.447 126 ALA -11.471 13.955 1.237 127 ALA -11.367 12.708 4.838 128 ASP -14.131 15.194 5.616 129 ALA -16.090 14.133 2.549 130 ALA -15.894 10.551 3.719 131 ARG -17.394 11.227 7.139 132 SER -20.166 13.641 6.102 133 ASN -21.285 10.966 3.634 134 ARG -21.188 8.188 6.216 135 VAL -18.469 6.318 4.359 136 THR -16.273 4.192 6.629 137 VAL -12.620 4.063 5.498 138 PHE -10.120 1.463 6.582 139 PRO -6.584 2.675 5.818 140 ILE -3.902 0.009 5.616 141 GLY -0.366 1.422 5.786 142 ILE 2.320 -0.871 4.437 143 GLY 6.025 -0.490 5.122 144 ASP 7.588 2.560 6.723 145 ARG 7.349 5.443 4.278 146 TYR 3.736 6.510 4.902 147 ASP 2.801 9.336 7.260 148 ALA 1.061 7.671 10.224 149 ALA -0.750 10.920 11.002 150 GLN -2.210 10.873 7.446 151 LEU -3.525 7.356 7.905 152 ARG -5.136 8.405 11.174 153 ILE -6.983 11.377 9.685 154 LEU -8.234 9.353 6.689 155 ALA -9.912 6.947 9.168 156 GLY -11.957 9.878 10.409 157 PRO -13.771 9.596 13.794 158 ALA -12.449 6.072 14.364 159 GLY -8.829 7.164 14.146 160 ASP -6.433 4.301 14.744 161 SER -9.257 1.904 15.575 162 ASN -9.705 1.492 11.804 163 VAL -6.046 1.671 10.836 164 VAL -4.029 -1.428 9.991 165 LYS -0.247 -1.211 9.890 166 LEU 1.548 -3.907 7.952 167 GLN 5.354 -4.206 7.946 168 ARG 5.799 -6.155 4.695 169 ILE 3.785 -6.147 1.480 170 GLU 3.759 -9.961 1.598 171 ASP 1.725 -9.762 4.830 172 LEU -1.154 -8.077 2.938 173 PRO -2.975 -10.930 1.224 174 THR -2.269 -13.180 4.232 175 MET -4.411 -10.747 6.223 176 VAL -7.555 -11.965 4.458 177 THR -6.473 -15.560 3.801 178 LEU -5.325 -16.360 7.342 179 GLY -8.773 -15.763 8.825 180 ASN -11.967 -13.771 8.372 181 SER -10.746 -11.196 10.889 182 PHE -10.603 -8.111 8.618 183 LEU -13.919 -8.894 6.901 184 HIS -15.347 -9.173 10.428 185 LYS -14.492 -5.536 11.022 186 LEU -16.284 -4.700 7.776 187 CYS -19.779 -6.124 8.443 Richards-Kundrot Secondary Structure Assignment : 1 2 3 4 5 6 7 8 9 10 0 C C S S S S S S S S 10 S S C C C C C H H H 20 H 3 3 3/H H H H H H H 30 H H H H H H C C T T 40 T T/S S S S S S S S S/T 50 T T T/S S S S S S/S S S 60 S C C C H H H H H H 70 H H H H H H/S S S S/S S 80 S S C H H H H H H H 90 H H H H H H H H/T T T 100 T/S S S S C S S S S S 110 S S S S S S S C C S 120 S S S/H H H H H H H H 130 H H H H/S S S S S S S 140 S S S C C C H H H H 150 H H H H H H C T T T 160 T S S S S S S S C C 170 H H H H H 3 3 C C H 180 H H H H H H H Kabsch-Sander Secondary Structure Assignment : 1 2 3 4 5 6 7 8 9 10 0 S e E E E E E E 10 E E e S S S S t h H 20 H H H H H H H H H H 30 H H H H H h B t T 40 T e E E E E E E E E 50 S S S E E E E S 60 S S h H H H H H 70 H H H H h t 80 S h H H H H H H 90 H H H H H H H h T T 100 T T t t T T t E E E 110 E E E E E S S 120 S h H H H H H H H 130 H H h e E E E E E E 140 E E e S S h H H H 150 H H H H h G G G G G 160 G G g E E E S t T h 170 H H H H H H H h h 180 H H H H H H h Buried Surface Area Percentages : Residue Type Buried Area % Buried % Polar Cover 1 CYS 75.9 76.5 68.4 2 SER 16.9 20.3 82.2 3 GLN 54.6 36.7 71.7 4 PRO 68.8 55.2 69.4 5 LEU 143.7 97.2 44.9 6 ASP 110.5 100.0 47.1 7 VAL 118.8 100.0 30.2 8 ILE 143.5 100.0 33.2 9 LEU 147.5 99.8 27.2 10 LEU 147.8 100.0 34.5 11 LEU 147.5 99.8 29.0 12 ASP 108.3 98.0 54.4 13 GLY 34.8 100.0 63.1 14 SER 83.3 99.7 69.8 15 SER 45.0 53.8 77.6 16 SER 69.3 82.9 75.6 17 PHE 131.7 79.0 53.8 18 PRO 36.9 29.7 74.3 19 ALA 28.7 39.5 76.2 20 SER 22.6 27.0 70.5 21 TYR 118.4 65.4 50.8 22 PHE 162.8 97.6 42.5 23 ASP 32.2 29.2 74.2 24 GLU 96.3 69.5 53.8 25 MET 155.3 97.4 33.4 26 LYS 142.6 82.2 56.5 27 SER 38.4 45.9 68.6 28 PHE 166.5 99.8 26.3 29 ALA 72.6 100.0 34.5 30 LYS 107.8 62.2 60.8 31 ALA 57.2 78.8 57.1 32 PHE 164.4 98.5 21.5 33 ILE 143.4 100.0 28.0 34 SER 41.6 49.8 60.6 35 LYS 115.7 66.7 72.2 36 ALA 68.4 94.2 44.8 37 ASN 56.2 46.5 67.9 38 ILE 136.9 95.4 38.1 39 GLY 29.8 85.7 45.0 40 PRO 31.4 25.2 65.9 41 ARG 0.3 0.2 88.9 42 LEU 92.5 62.6 74.9 43 THR 101.8 95.2 45.0 44 GLN 119.5 80.4 59.6 45 VAL 118.7 99.9 31.1 46 SER 83.6 100.0 35.4 47 VAL 118.8 100.0 30.7 48 LEU 147.8 100.0 35.5 49 GLN 145.9 98.2 51.1 50 TYR 179.8 99.3 48.6 51 GLY 34.8 100.0 62.1 52 SER 41.3 49.5 66.6 53 ILE 42.0 29.3 78.5 54 THR 102.7 96.1 42.1 55 THR 69.0 64.6 63.5 56 ILE 112.9 78.7 47.4 57 ASP 79.3 71.8 61.9 58 VAL 118.7 99.9 37.9 59 PRO 70.9 57.0 66.5 60 TRP 202.2 98.6 51.3 61 ASN 30.0 24.8 81.8 62 VAL 100.5 84.6 56.2 63 VAL 28.2 23.7 69.1 64 PRO 80.3 64.5 54.5 65 GLU 42.9 31.0 69.8 66 LYS 101.5 58.5 67.4 67 ALA 6.2 8.5 71.9 68 HIS 75.2 50.1 59.8 69 LEU 140.5 95.1 38.7 70 LEU 100.2 67.8 59.6 71 SER 23.9 28.6 77.7 72 LEU 103.6 70.1 54.4 73 VAL 118.8 100.0 33.0 74 ASP 42.4 38.4 75.3 75 VAL 16.0 13.5 85.3 76 MET 153.8 96.5 43.0 77 GLN 11.0 7.4 87.2 78 ARG 156.3 74.8 61.2 79 GLU 93.7 67.6 69.6 80 GLY 24.8 71.3 76.7 81 GLY 21.6 62.0 61.5 82 PRO 58.3 46.9 64.2 83 SER 81.6 97.7 55.6 84 GLN 101.6 68.4 62.5 85 ILE 142.6 99.4 39.8 86 GLY 33.0 94.7 57.8 87 ASP 25.9 23.5 83.2 88 ALA 72.2 99.5 50.7 89 LEU 147.8 100.0 32.6 90 GLY 23.4 67.3 62.5 91 PHE 110.5 66.2 60.8 92 ALA 72.6 100.0 35.6 93 VAL 115.2 97.0 42.3 94 ARG 56.0 26.8 80.1 95 TYR 169.2 93.5 40.1 96 LEU 147.8 100.0 38.2 97 THR 74.5 69.7 59.8 98 SER 63.6 76.1 58.0 99 GLU 12.7 9.1 78.3 100 MET 35.6 22.4 84.0 101 HIS 63.7 42.4 70.3 102 GLY 25.2 72.3 70.9 103 ALA 71.1 97.9 70.4 104 ARG 170.4 81.6 61.4 105 PRO 16.8 13.5 83.1 106 GLY 0.0 0.0 86.2 107 ALA 72.2 99.4 62.1 108 SER 34.6 41.4 71.2 109 LYS 152.0 87.6 56.6 110 ALA 69.2 95.3 37.6 111 VAL 118.8 100.0 30.1 112 VAL 118.7 99.9 29.1 113 ILE 143.5 100.0 32.0 114 LEU 147.6 99.8 29.6 115 VAL 118.4 99.7 44.2 116 THR 103.5 96.8 39.2 117 ASP 85.8 77.6 68.5 118 VAL 52.1 43.8 80.1 119 SER 83.6 100.0 60.4 120 VAL 43.9 37.0 72.0 121 ASP 68.3 61.8 69.4 122 SER 15.5 18.6 82.8 123 VAL 113.8 95.8 47.1 124 ASP 27.7 25.0 75.4 125 ALA 0.0 0.0 84.6 126 ALA 67.2 92.6 50.3 127 ALA 70.5 97.2 56.9 128 ASP 32.0 28.9 78.0 129 ALA 37.9 52.2 68.9 130 ALA 70.6 97.2 47.4 131 ARG 113.2 54.2 67.6 132 SER 18.0 21.5 81.3 133 ASN 66.5 55.0 66.1 134 ARG 57.4 27.5 87.5 135 VAL 118.8 100.0 38.3 136 THR 66.8 62.5 66.7 137 VAL 115.6 97.3 38.6 138 PHE 159.2 95.4 37.9 139 PRO 124.5 100.0 38.9 140 ILE 143.5 100.0 30.9 141 GLY 34.8 100.0 45.7 142 ILE 140.7 98.0 34.7 143 GLY 20.8 59.7 67.7 144 ASP 3.0 2.7 77.8 145 ARG 97.9 46.9 78.5 146 TYR 161.8 89.4 50.4 147 ASP 53.7 48.6 63.5 148 ALA 31.7 43.6 70.3 149 ALA 33.5 46.1 81.2 150 GLN 121.4 81.7 52.3 151 LEU 147.3 99.6 33.4 152 ARG 95.7 45.8 70.5 153 ILE 94.5 65.9 65.3 154 LEU 147.3 99.6 29.8 155 ALA 72.6 100.0 56.1 156 GLY 29.8 85.6 70.8 157 PRO 42.7 34.3 79.8 158 ALA 44.0 60.6 75.6 159 GLY 20.9 60.2 70.0 160 ASP 52.9 47.9 64.2 161 SER 11.2 13.4 84.5 162 ASN 102.7 85.0 47.3 163 VAL 116.9 98.4 49.3 164 VAL 93.7 78.9 51.3 165 LYS 95.7 55.2 66.9 166 LEU 131.1 88.7 47.2 167 GLN 33.9 22.8 76.1 168 ARG 69.6 33.3 81.3 169 ILE 136.4 95.0 36.1 170 GLU 63.7 46.0 71.3 171 ASP 83.3 75.4 62.9 172 LEU 147.8 100.0 23.9 173 PRO 105.6 84.8 55.3 174 THR 58.6 54.8 66.3 175 MET 129.1 81.0 40.2 176 VAL 118.8 100.0 41.0 177 THR 53.0 49.5 61.8 178 LEU 23.6 16.0 89.9 179 GLY 10.8 31.1 85.8 180 ASN 53.9 44.6 68.2 181 SER 13.9 16.6 83.6 182 PHE 159.9 95.9 29.2 183 LEU 133.0 90.0 42.6 184 HIS 24.7 16.4 82.9 185 LYS 97.6 56.3 65.7 186 LEU 145.4 98.4 28.7 187 CYS 86.1 86.8 55.7