A 4 THR 0.105 0.037 0.136 999.900 0.070 999.900 4.506 5.011 -0.44 999.90 0.52 0.04 A 5 VAL 0.041 0.004 0.000 999.900 0.023 999.900 3.835 3.966 0.04 999.90 0.70 0.37 A 6 VAL 0.052 0.028 0.221 999.900 0.040 999.900 3.026 3.463 -0.28 999.90 0.53 0.12 A 7 ARG 0.061 0.030 0.404 0.055 0.045 0.210 2.622 3.644 -1.19 0.56 999.90 -0.32 A 8 ASP 0.024 0.014 0.121 0.095 0.019 0.108 2.299 3.116 -0.91 -0.96 999.90 -0.94 A 9 ALA 0.038 0.002 999.900 999.900 0.020 999.900 2.186 2.042 -0.67 999.90 999.90 -0.67 A 10 VAL 0.009 0.019 0.381 999.900 0.014 999.900 1.930 2.140 -0.08 999.90 -0.20 -0.14 A 11 THR 0.013 0.002 0.201 999.900 0.008 999.900 2.024 2.214 0.07 999.90 0.66 0.37 A 12 ILE 0.005 0.002 0.001 0.153 0.003 0.074 1.941 1.936 0.10 0.75 999.90 0.43 A 13 GLY 0.002 0.054 999.900 999.900 0.028 999.900 2.336 0.000 -2.05 999.90 999.90 -2.05 A 14 LYS 0.049 0.007 0.004 0.406 0.028 0.180 2.010 2.361 -0.39 0.70 999.90 0.16 A 15 PRO 0.002 0.003 999.900 999.900 0.002 999.900 2.049 2.439 -1.85 999.90 999.90 -1.85 A 16 ALA 0.011 0.012 999.900 999.900 0.011 999.900 1.821 1.897 -3.46 999.90 999.90 -3.46 A 17 GLU 0.012 0.016 0.416 0.153 0.014 0.273 2.216 3.675 0.41 0.92 999.90 0.67 A 18 GLN 0.028 0.024 0.001 0.337 0.026 0.153 2.287 3.351 -0.41 0.92 999.90 0.26 A 19 LEU 0.020 0.042 0.001 0.002 0.031 0.001 1.727 1.628 -0.83 0.89 999.90 0.03 A 20 TYR 0.029 0.048 0.642 0.275 0.038 0.428 2.070 3.403 -0.63 -0.03 999.90 -0.33 A 21 ALA 0.024 0.124 999.900 999.900 0.072 999.900 2.926 3.118 -0.57 999.90 999.90 -0.57 A 22 VAL 0.054 0.022 0.480 999.900 0.038 999.900 3.107 2.925 -1.07 999.90 -0.52 -0.80 A 23 TRP 0.043 0.028 0.292 0.650 0.036 0.442 3.940 4.151 0.11 0.11 999.90 0.11 A 63 GLU 0.209 0.034 0.788 0.864 0.117 0.822 5.147 5.902 29.16 -0.05 999.90 14.56 A 64 ALA 0.110 0.107 999.900 999.900 0.108 999.900 4.216 4.227 -1.11 999.90 999.90 -1.11 A 65 GLU 0.101 0.050 0.070 0.177 0.075 0.122 3.473 4.455 -1.00 0.56 999.90 -0.22 A 66 LEU 0.044 0.034 0.394 0.345 0.039 0.369 2.887 2.609 -0.36 0.34 999.90 -0.01 A 67 THR 0.049 0.024 0.521 999.900 0.036 999.900 2.603 3.012 -0.58 999.90 0.38 -0.10 A 68 ALA 0.032 0.013 999.900 999.900 0.023 999.900 2.023 2.186 -0.91 999.90 999.90 -0.91 A 69 ASP 0.026 0.125 0.494 0.024 0.074 0.223 2.025 2.582 -1.32 0.21 999.90 -0.55 A 70 GLU 0.113 0.082 0.152 0.591 0.098 0.334 1.921 3.230 -1.27 0.64 999.90 -0.31 A 73 LYS 0.043 0.027 0.405 0.066 0.035 0.217 1.424 2.778 -2.96 0.99 999.90 -0.99 A 74 ARG 0.015 0.021 0.497 0.005 0.018 0.212 1.258 2.269 -1.35 0.21 999.90 -0.57 A 75 ILE 0.019 0.016 0.273 0.218 0.017 0.245 1.266 1.622 -0.17 0.46 999.90 0.15 A 76 ALA 0.044 0.018 999.900 999.900 0.031 999.900 1.736 1.734 -0.91 999.90 999.90 -0.91 A 77 TRP 0.081 0.107 0.927 0.690 0.094 0.775 2.397 3.613 -0.49 -0.47 999.90 -0.48 A 78 ARG 0.030 0.055 0.824 0.429 0.042 0.578 3.471 4.527 -1.16 0.24 999.90 -0.46 A 90 GLU 0.065 0.029 0.528 0.005 0.047 0.221 1.633 1.924 -0.91 0.35 999.90 -0.28 A 91 VAL 0.014 0.003 0.080 999.900 0.009 999.900 1.084 1.368 0.23 999.90 0.60 0.41 A 92 LEU 0.006 0.007 0.541 0.409 0.007 0.471 0.971 1.850 -0.09 0.38 999.90 0.15 A 93 PHE 0.006 0.019 0.004 0.833 0.012 0.286 1.190 1.282 -0.38 0.22 999.90 -0.08 A 94 ARG 0.044 0.030 0.424 0.071 0.037 0.227 1.536 2.038 -0.39 0.16 999.90 -0.11 A 95 PRO 0.006 0.009 999.900 999.900 0.008 999.900 1.815 2.022 0.09 999.90 999.90 0.09 A 96 ALA 0.005 0.017 999.900 999.900 0.011 999.900 2.021 2.003 -0.54 999.90 999.90 -0.54 A 97 PRO 0.005 0.015 999.900 999.900 0.010 999.900 2.463 2.495 -0.13 999.90 999.90 -0.13 A 100 ARG 0.033 0.103 0.225 0.142 0.068 0.182 2.863 4.015 -0.82 0.85 999.90 0.01 A 101 GLY 0.186 0.028 999.900 999.900 0.103 999.900 2.223 0.000 -1.54 999.90 999.90 -1.54 A 102 THR 0.009 0.003 0.000 999.900 0.006 999.900 1.694 1.622 0.38 999.90 0.65 0.52 A 103 GLU 0.011 0.007 0.135 0.002 0.009 0.066 1.455 2.040 -0.77 0.77 999.90 0.00 A 104 VAL 0.008 0.005 0.000 999.900 0.007 999.900 1.393 1.343 -0.20 999.90 0.68 0.24 A 105 VAL 0.005 0.003 0.000 999.900 0.004 999.900 1.397 1.572 -0.14 999.90 0.49 0.18 A 106 VAL 0.006 0.010 0.000 999.900 0.008 999.900 1.922 1.929 0.09 999.90 0.68 0.38 A 107 ARG 0.028 0.035 0.399 0.005 0.032 0.178 2.180 3.262 -1.13 0.72 999.90 -0.21 A 108 LEU 0.024 0.028 0.722 0.341 0.026 0.494 2.657 3.175 -0.75 0.05 999.90 -0.35 A 109 THR 0.086 0.014 0.000 999.900 0.050 999.900 3.182 3.421 -0.09 999.90 0.28 0.09 A 110 TYR 0.092 0.130 0.870 0.806 0.111 0.835 3.483 4.392 -0.48 -0.16 999.90 -0.32 A 111 ARG 0.120 0.045 0.560 0.126 0.082 0.308 3.492 5.549 -0.71 0.68 999.90 -0.01 A 112 PRO 0.012 0.035 999.900 999.900 0.023 999.900 3.890 3.974 0.01 999.90 999.90 0.01 A 116 SER 0.024 0.020 0.507 999.900 0.022 999.900 6.604 7.514 0.62 999.90 0.60 0.61 A 117 ALA 0.003 0.006 999.900 999.900 0.004 999.900 6.767 7.410 0.79 999.90 999.90 0.79 A 118 GLY 0.003 0.010 999.900 999.900 0.006 999.900 6.380 0.000 0.85 999.90 999.90 0.85 A 119 ALA 0.005 0.007 999.900 999.900 0.006 999.900 6.462 6.627 0.80 999.90 999.90 0.80 A 120 VAL 0.002 0.001 0.000 999.900 0.001 999.900 7.201 7.877 0.91 999.90 0.69 0.80 A 121 ILE 0.005 0.014 0.351 0.122 0.010 0.228 7.613 8.147 0.53 0.55 999.90 0.54 A 122 ALA 0.004 0.003 999.900 999.900 0.003 999.900 7.648 7.213 0.78 999.90 999.90 0.78 A 123 ARG 0.021 0.014 0.329 0.001 0.018 0.149 8.576 9.540 0.19 0.97 999.90 0.58 A 124 MET 0.003 0.016 0.286 0.345 0.010 0.315 9.579 10.249 0.52 0.71 999.90 0.61 A 135 ASP 0.010 0.016 0.264 0.118 0.013 0.188 3.560 4.527 0.72 0.80 999.90 0.76 A 136 ASP 0.018 0.015 0.045 0.056 0.016 0.050 3.303 4.204 0.64 0.95 999.90 0.80 A 137 LEU 0.013 0.026 0.336 0.453 0.020 0.392 2.505 2.609 0.20 0.52 999.90 0.36 A 138 MET 0.006 0.015 0.329 0.696 0.011 0.479 2.879 3.721 0.57 0.44 999.90 0.51 A 139 ARG 0.016 0.006 0.488 0.071 0.011 0.250 3.209 4.981 0.66 0.77 999.90 0.71 A 140 PHE 0.014 0.009 0.422 0.462 0.011 0.441 2.667 3.629 0.91 0.01 999.90 0.46 A 141 LYS 0.005 0.013 0.120 0.093 0.009 0.106 2.562 3.154 0.64 0.55 999.90 0.59 A 142 ARG 0.021 0.027 0.328 0.001 0.024 0.149 3.414 4.707 0.33 0.98 999.90 0.66 A 143 GLU 0.012 0.015 0.002 0.228 0.013 0.108 3.474 4.047 0.53 1.05 999.90 0.79 A 144 GLN 0.015 0.015 0.295 0.650 0.015 0.444 3.177 3.264 0.33 0.61 999.90 0.47 A 145 GLU 0.029 0.043 0.782 0.079 0.036 0.331 3.850 3.711 0.19 0.68 999.90 0.44 A 146 LEU 0.025 0.028 0.076 0.067 0.027 0.071 4.473 4.927 -0.62 0.86 999.90 0.12