# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom C:81 SER 3.59 0.59 3.87 0.53 3.01 0.04 2.97 0.00 3.06 0.00 C:82 CYS 3.96 0.27 4.08 0.26 3.72 0.04 3.76 0.00 3.67 0.00 C:83 ALA 3.47 0.38 3.57 0.35 3.03 0.00 nan nan 3.03 0.00 C:84 THR 3.62 0.49 3.94 0.39 3.18 0.18 3.16 0.00 3.20 0.22 C:85 GLY 4.25 0.27 4.25 0.27 nan nan nan nan nan nan C:86 PRO 5.00 0.64 5.36 0.40 4.52 0.58 nan nan 4.52 0.58 C:87 ARG 4.22 1.09 5.58 0.34 3.45 0.40 3.25 0.32 3.61 0.38 C:88 ASN 6.07 1.15 7.05 0.45 5.09 0.71 4.66 0.61 5.52 0.52 C:89 CYS 8.64 0.84 8.08 0.34 9.76 0.07 9.83 0.00 9.70 0.00 C:90 LYS 4.72 1.18 5.90 0.52 3.79 0.55 3.23 0.00 3.92 0.53 C:91 ASP 4.66 0.58 5.13 0.28 4.19 0.38 3.93 0.25 4.44 0.31 C:92 LEU 6.18 0.67 6.53 0.22 5.83 0.79 nan nan 5.83 0.79 C:93 LEU 4.63 0.95 5.18 0.98 4.08 0.50 nan nan 4.08 0.50 C:94 ASP 3.69 0.41 3.91 0.46 3.47 0.16 3.36 0.16 3.59 0.05 C:95 ARG 3.57 0.34 3.76 0.46 3.47 0.17 3.35 0.17 3.55 0.11 C:96 GLY 3.65 0.36 3.65 0.36 nan nan nan nan nan nan C:97 TYR 4.03 0.63 4.53 0.52 3.78 0.52 2.98 0.00 3.90 0.45 C:98 PHE 3.43 0.31 3.74 0.26 3.26 0.15 nan nan 3.26 0.15 C:99 LEU 3.74 0.56 4.25 0.21 3.23 0.27 nan nan 3.23 0.27 C:100 SER 3.74 0.41 3.91 0.40 3.39 0.00 3.39 0.00 3.38 0.00 C:101 GLY 4.34 0.60 4.34 0.60 nan nan nan nan nan nan C:102 TRP 4.27 0.62 3.84 0.41 4.43 0.61 3.72 0.00 4.51 0.60 C:103 HIS 4.40 0.55 4.60 0.46 4.26 0.57 4.34 0.83 4.22 0.36 C:104 THR 3.74 0.50 4.10 0.32 3.25 0.21 2.96 0.00 3.40 0.00 C:105 ILE 6.87 0.95 6.01 0.30 7.73 0.50 nan nan 7.73 0.50 C:106 TYR 5.01 0.93 5.85 0.55 4.59 0.79 3.25 0.00 4.78 0.65 C:107 LEU 5.41 0.53 5.26 0.61 5.57 0.37 nan nan 5.57 0.37 C:108 PRO 3.81 0.36 3.77 0.42 3.86 0.25 nan nan 3.86 0.25 C:109 ASP 3.49 0.35 3.64 0.30 3.34 0.32 3.39 0.43 3.28 0.12 C:110 CYS 3.82 0.51 4.12 0.33 3.21 0.04 3.17 0.00 3.25 0.00 C:111 ARG 3.87 0.82 4.77 0.72 3.36 0.21 3.30 0.12 3.41 0.25 C:112 PRO 3.79 0.49 4.08 0.46 3.40 0.11 nan nan 3.40 0.11 C:113 LEU 4.70 0.65 4.72 0.48 4.68 0.78 nan nan 4.68 0.78 C:114 THR 3.99 0.51 4.33 0.35 3.53 0.27 3.15 0.00 3.73 0.02 C:115 VAL 6.97 0.73 6.49 0.45 7.62 0.51 nan nan 7.62 0.51 C:116 LEU 5.88 1.30 7.04 0.26 4.71 0.77 nan nan 4.71 0.77 C:117 CYS 6.77 1.11 6.14 0.77 8.04 0.36 8.40 0.00 7.68 0.00 C:118 ASP 5.21 0.93 5.99 0.58 4.42 0.40 4.12 0.09 4.73 0.37 C:119 MET 5.57 1.21 4.72 0.80 6.43 0.92 6.98 0.00 6.24 0.99 C:120 ASP 3.57 0.53 3.98 0.43 3.17 0.21 2.98 0.11 3.36 0.06 C:121 THR 4.19 0.51 4.42 0.51 3.89 0.32 3.48 0.00 4.09 0.18 C:122 ASP 3.83 0.40 3.74 0.27 3.93 0.48 3.88 0.68 3.98 0.00 C:123 GLY 3.31 0.15 3.31 0.15 nan nan nan nan nan nan C:124 GLY 4.88 0.39 4.88 0.39 nan nan nan nan nan nan C:125 GLY 6.57 0.37 6.57 0.37 nan nan nan nan nan nan C:126 TRP 7.75 0.87 8.58 0.55 7.42 0.74 6.76 0.00 7.49 0.75 C:127 THR 10.24 0.42 10.32 0.25 10.12 0.55 9.48 0.00 10.43 0.38 C:128 VAL 7.84 0.95 8.59 0.32 6.83 0.44 nan nan 6.83 0.44 C:129 PHE 10.86 1.65 9.00 0.59 11.92 0.99 nan nan 11.92 0.99 C:130 GLN 10.35 1.08 9.27 0.32 11.21 0.60 11.61 0.49 10.94 0.51 C:131 ARG 6.24 2.09 8.61 0.20 4.88 1.35 3.89 0.71 5.63 1.23 C:132 ARG 7.85 1.25 7.44 0.86 8.09 1.36 7.05 0.90 8.87 1.11 C:133 MET 4.57 0.82 5.00 0.89 4.14 0.41 3.91 0.23 4.22 0.43 C:134 ASP 3.96 0.56 4.26 0.46 3.66 0.49 3.78 0.62 3.54 0.25 C:135 GLY 4.63 0.76 4.63 0.76 nan nan nan nan nan nan C:136 SER 3.63 0.46 3.81 0.46 3.26 0.10 3.37 0.00 3.16 0.00 C:137 VAL 4.12 0.32 4.23 0.18 3.97 0.39 nan nan 3.97 0.39 C:138 ASP 3.79 0.66 4.30 0.57 3.29 0.17 3.23 0.22 3.35 0.07 C:139 PHE 7.23 1.32 5.97 0.71 7.95 1.01 nan nan 7.95 1.01 C:140 TYR 4.43 0.70 4.77 0.51 4.26 0.72 3.62 0.00 4.35 0.73 C:141 ARG 4.13 0.81 5.00 0.58 3.64 0.40 3.33 0.33 3.87 0.27 C:142 ASP 4.24 0.86 4.95 0.59 3.53 0.33 3.37 0.35 3.69 0.21 C:143 TRP 4.84 0.82 5.06 0.21 4.76 0.94 3.74 0.00 4.87 0.93 C:144 ALA 4.23 0.65 4.47 0.47 3.24 0.00 nan nan 3.24 0.00 C:145 ALA 4.94 0.65 5.16 0.51 4.02 0.00 nan nan 4.02 0.00 C:146 TYR 8.63 1.01 7.47 0.49 9.22 0.61 9.63 0.00 9.16 0.63 C:147 LYS 4.83 1.18 5.83 0.72 4.04 0.81 3.27 0.00 4.23 0.79 C:148 GLN 3.75 0.49 4.20 0.47 3.52 0.31 3.23 0.23 3.72 0.17 C:149 GLY 4.10 0.50 4.10 0.50 nan nan nan nan nan nan C:150 PHE 5.20 1.28 3.94 0.24 5.92 1.07 nan nan 5.92 1.07 C:151 GLY 3.60 0.30 3.60 0.30 nan nan nan nan nan nan C:152 SER 3.96 0.66 4.35 0.45 3.20 0.06 3.13 0.00 3.26 0.00 C:153 GLN 3.63 0.35 3.95 0.24 3.38 0.19 3.17 0.02 3.52 0.09 C:154 LEU 3.45 0.38 3.70 0.36 3.20 0.17 nan nan 3.20 0.17 C:155 GLY 4.60 0.63 4.60 0.63 nan nan nan nan nan nan C:156 GLU 5.85 0.60 5.42 0.53 6.19 0.40 6.50 0.38 5.99 0.26 C:157 PHE 6.02 0.71 6.59 0.57 5.70 0.55 nan nan 5.70 0.55 C:158 TRP 8.35 2.22 5.57 0.70 9.46 1.55 9.01 0.00 9.51 1.62 C:159 LEU 5.21 0.77 4.94 0.57 5.47 0.84 nan nan 5.47 0.84 C:160 GLY 6.50 0.53 6.50 0.53 nan nan nan nan nan nan C:161 ASN 8.51 1.36 7.30 0.58 9.73 0.66 10.19 0.27 9.26 0.62 C:162 ASP 4.28 0.72 4.88 0.50 3.69 0.30 3.64 0.42 3.74 0.02 C:163 ASN 5.59 0.94 6.30 0.59 4.89 0.65 4.40 0.32 5.37 0.51 C:164 ILE 8.90 1.01 7.96 0.35 9.84 0.36 nan nan 9.84 0.36 C:165 HIS 4.85 1.16 5.92 0.69 4.13 0.80 3.50 0.15 4.45 0.80 C:166 ALA 4.59 0.46 4.75 0.35 3.91 0.00 nan nan 3.91 0.00 C:167 LEU 7.15 0.97 6.28 0.26 8.03 0.53 nan nan 8.03 0.53 C:168 THR 6.46 0.95 5.89 0.79 7.22 0.53 6.77 0.00 7.44 0.52 C:169 ALA 3.95 0.60 4.05 0.63 3.54 0.00 nan nan 3.54 0.00 C:170 GLN 3.63 0.40 3.93 0.27 3.38 0.29 3.04 0.02 3.61 0.11 C:171 GLY 3.32 0.19 3.32 0.19 nan nan nan nan nan nan C:172 SER 3.85 0.51 4.12 0.40 3.30 0.08 3.38 0.00 3.22 0.00 C:173 SER 6.10 0.41 6.00 0.38 6.31 0.39 5.92 0.00 6.70 0.00 C:174 GLU 5.69 1.64 7.29 0.85 4.41 0.78 3.67 0.22 4.91 0.60 C:175 LEU 9.93 1.44 8.66 0.53 11.20 0.80 nan nan 11.20 0.80 C:176 ARG 7.29 2.46 9.97 0.29 5.75 1.73 4.42 0.69 6.75 1.59 C:177 THR 9.61 0.94 9.04 0.70 10.35 0.68 11.26 0.00 9.90 0.26 C:178 ASP 6.04 1.00 6.97 0.45 5.11 0.24 5.05 0.31 5.16 0.10 C:179 LEU 7.07 0.64 6.62 0.25 7.52 0.60 nan nan 7.52 0.60 C:180 VAL 5.00 1.03 5.86 0.22 3.84 0.23 nan nan 3.84 0.23 C:181 ASP 5.06 0.75 5.52 0.60 4.61 0.59 4.42 0.77 4.80 0.17 C:182 PHE 4.34 0.57 4.19 0.69 4.44 0.47 nan nan 4.44 0.47 C:183 GLU 3.46 0.39 3.73 0.41 3.24 0.20 3.05 0.01 3.37 0.16 C:184 GLY 3.61 0.26 3.61 0.26 nan nan nan nan nan nan C:185 ASN 4.10 0.76 4.89 0.50 3.61 0.39 3.28 0.06 3.94 0.29 C:186 HIS 3.82 0.44 4.18 0.36 3.59 0.32 3.47 0.35 3.65 0.28 C:187 GLN 4.90 1.06 5.84 0.53 4.16 0.74 3.52 0.38 4.59 0.60 C:188 PHE 5.08 1.34 6.53 0.35 4.24 0.92 nan nan 4.24 0.92 C:189 ALA 7.74 0.31 7.74 0.34 7.76 0.00 nan nan 7.76 0.00 C:190 LYS 5.54 1.26 6.74 0.13 4.59 0.89 3.34 0.12 4.90 0.70 C:191 TYR 6.75 0.76 6.50 0.48 6.87 0.84 6.77 0.00 6.89 0.90 C:192 LYS 3.95 0.69 4.61 0.40 3.42 0.32 2.94 0.00 3.54 0.24 C:193 SER 4.83 0.93 5.46 0.28 3.57 0.22 3.36 0.00 3.79 0.00 C:194 PHE 8.09 1.84 5.88 0.26 9.36 0.95 nan nan 9.36 0.95 C:195 LYS 4.83 1.27 6.13 0.48 3.78 0.52 3.03 0.00 3.97 0.39 C:196 VAL 7.80 1.38 6.70 0.67 9.28 0.23 nan nan 9.28 0.23 C:197 ALA 5.61 0.56 5.76 0.52 5.01 0.00 nan nan 5.01 0.00 C:198 ASP 4.14 0.86 4.95 0.37 3.33 0.24 3.17 0.24 3.50 0.05 C:199 GLU 3.87 0.37 4.18 0.29 3.63 0.21 3.39 0.08 3.79 0.06 C:200 ALA 3.43 0.30 3.53 0.23 3.01 0.00 nan nan 3.01 0.00 C:201 GLU 4.02 0.72 4.68 0.42 3.49 0.39 3.21 0.00 3.68 0.40 C:202 LYS 4.96 1.35 6.13 0.98 4.03 0.74 3.08 0.06 4.27 0.63 C:203 TYR 7.54 1.04 8.28 0.82 7.17 0.94 5.70 0.00 7.38 0.82 C:204 LYS 5.71 1.61 7.30 0.17 4.44 1.01 2.98 0.00 4.81 0.78 C:205 LEU 7.84 1.09 6.94 0.84 8.73 0.23 nan nan 8.73 0.23 C:206 VAL 4.72 0.81 5.30 0.44 3.94 0.46 nan nan 3.94 0.46 C:207 LEU 5.28 0.99 4.57 0.72 5.99 0.68 nan nan 5.99 0.68 C:208 GLY 3.84 0.34 3.84 0.34 nan nan nan nan nan nan C:209 ALA 3.71 0.49 3.88 0.39 3.01 0.00 nan nan 3.01 0.00 C:210 PHE 4.13 0.70 3.81 0.40 4.31 0.77 nan nan 4.31 0.77 C:211 VAL 3.70 0.44 3.79 0.51 3.58 0.28 nan nan 3.58 0.28 C:212 GLY 4.07 0.46 4.07 0.46 nan nan nan nan nan nan C:213 GLY 3.65 0.22 3.65 0.22 nan nan nan nan nan nan C:214 SER 3.49 0.27 3.58 0.25 3.29 0.19 3.48 0.00 3.11 0.00 C:215 ALA 4.44 0.82 4.15 0.63 5.62 0.00 nan nan 5.62 0.00 C:216 GLY 3.99 0.55 3.99 0.55 nan nan nan nan nan nan C:217 ASN 3.86 0.49 3.77 0.33 3.95 0.60 4.09 0.77 3.81 0.26 C:218 SER 4.02 0.27 4.10 0.30 3.84 0.02 3.82 0.00 3.86 0.00 C:219 LEU 6.75 1.34 5.52 0.25 7.97 0.73 nan nan 7.97 0.73 C:220 THR 3.82 0.59 4.09 0.58 3.46 0.36 3.17 0.00 3.61 0.36 C:221 GLY 3.50 0.21 3.50 0.21 nan nan nan nan nan nan C:222 HIS 4.89 0.64 5.09 0.42 4.76 0.72 4.42 0.69 4.93 0.67 C:223 ASN 3.79 0.45 4.01 0.40 3.57 0.38 3.57 0.52 3.56 0.15 C:224 ASN 3.80 0.56 4.29 0.31 3.32 0.25 3.09 0.13 3.54 0.03 C:225 ASN 4.73 0.91 5.33 0.82 4.12 0.51 3.74 0.17 4.51 0.44 C:226 PHE 5.13 1.49 6.72 0.97 4.22 0.82 nan nan 4.22 0.82 C:227 PHE 10.34 1.47 8.80 0.52 11.22 1.05 nan nan 11.22 1.05 C:228 SER 9.21 1.08 9.82 0.52 8.01 0.87 7.13 0.00 8.88 0.00 C:229 THR 7.47 0.82 7.46 0.94 7.49 0.61 6.70 0.00 7.89 0.28 C:230 LYS 4.22 0.89 4.80 0.97 3.76 0.43 3.19 0.00 3.90 0.36 C:231 ASP 3.86 0.52 3.82 0.40 3.89 0.62 4.08 0.76 3.71 0.35 C:232 GLN 4.18 0.77 4.73 0.49 3.75 0.68 3.07 0.18 4.20 0.49 C:233 ASP 3.70 0.33 3.80 0.39 3.61 0.23 3.64 0.29 3.58 0.12 C:234 ASN 4.53 0.48 4.42 0.20 4.64 0.63 4.50 0.86 4.77 0.14 C:235 ASP 5.12 0.89 4.49 0.66 5.75 0.61 5.50 0.73 6.01 0.26 C:236 VAL 3.51 0.46 3.69 0.53 3.28 0.17 nan nan 3.28 0.17 C:237 SER 3.89 0.32 3.86 0.30 3.97 0.35 3.62 0.00 4.32 0.00 C:238 SER 3.34 0.27 3.47 0.23 3.07 0.03 3.04 0.00 3.10 0.00 C:239 SER 3.85 0.43 4.04 0.39 3.48 0.22 3.69 0.00 3.26 0.00 C:240 ASN 4.44 0.70 4.68 0.60 4.21 0.71 4.44 0.91 3.97 0.26 C:241 CYS 6.96 0.46 6.97 0.41 6.92 0.56 6.37 0.00 7.48 0.00 C:242 ALA 7.58 0.58 7.40 0.52 8.28 0.00 nan nan 8.28 0.00 C:243 GLU 4.19 0.87 4.77 0.85 3.73 0.56 3.15 0.10 4.12 0.39 C:244 LYS 3.76 0.47 3.96 0.41 3.59 0.45 2.99 0.00 3.74 0.37 C:245 PHE 4.53 0.56 4.63 0.10 4.47 0.69 nan nan 4.47 0.69 C:246 GLN 4.57 1.08 5.67 0.41 3.68 0.46 3.33 0.06 3.92 0.45 C:247 GLY 8.48 0.86 8.48 0.86 nan nan nan nan nan nan C:248 ALA 11.54 0.71 11.64 0.76 11.15 0.00 nan nan 11.15 0.00 C:249 TRP 9.57 1.49 11.40 0.42 8.83 1.08 7.01 0.00 9.03 0.94 C:250 TRP 10.41 1.70 8.37 1.09 11.22 1.13 11.31 0.00 11.21 1.19 C:251 TYR 8.07 1.15 6.86 0.68 8.67 0.83 8.74 0.00 8.66 0.88 C:252 ALA 5.03 0.62 5.32 0.28 3.90 0.00 nan nan 3.90 0.00 C:253 ASP 3.96 0.67 4.57 0.12 3.35 0.39 3.00 0.06 3.71 0.23 C:254 CYS 4.55 0.56 4.31 0.51 5.05 0.22 4.83 0.00 5.26 0.00 C:255 HIS 3.35 0.42 3.73 0.42 3.09 0.09 3.09 0.00 3.09 0.11 C:256 ALA 4.02 0.59 4.26 0.40 3.08 0.00 nan nan 3.08 0.00 C:257 SER 4.36 0.47 4.60 0.39 3.88 0.13 3.75 0.00 4.01 0.00 C:258 ASN 7.29 0.80 6.78 0.61 7.79 0.64 8.21 0.52 7.38 0.44 C:259 LEU 9.34 0.77 9.53 0.83 9.16 0.65 nan nan 9.16 0.65 C:260 ASN 10.34 1.61 8.97 0.99 11.72 0.65 12.18 0.13 11.26 0.64 C:261 GLY 6.58 0.79 6.58 0.79 nan nan nan nan nan nan C:262 LEU 4.18 0.71 4.84 0.19 3.53 0.33 nan nan 3.53 0.33 C:263 TYR 5.12 0.89 4.31 0.46 5.53 0.75 4.57 0.00 5.67 0.70 C:264 LEU 4.05 0.57 4.48 0.45 3.62 0.30 nan nan 3.62 0.30 C:265 MET 3.60 0.32 3.62 0.36 3.59 0.29 3.69 0.42 3.55 0.22 C:266 GLY 3.72 0.17 3.72 0.17 nan nan nan nan nan nan C:267 PRO 3.84 0.61 4.21 0.56 3.34 0.16 nan nan 3.34 0.16 C:268 HIS 3.45 0.34 3.81 0.21 3.21 0.14 3.17 0.08 3.22 0.16 C:269 GLU 3.40 0.37 3.64 0.41 3.20 0.16 3.07 0.07 3.30 0.13 C:270 SER 3.84 0.25 3.92 0.18 3.69 0.27 3.96 0.00 3.41 0.00 C:271 TYR 3.40 0.37 3.83 0.29 3.19 0.16 2.92 0.00 3.22 0.14 C:272 ALA 4.51 0.56 4.77 0.22 3.47 0.00 nan nan 3.47 0.00 C:273 ASN 4.87 0.54 5.31 0.27 4.42 0.34 4.33 0.44 4.52 0.15 C:274 GLY 5.88 0.27 5.88 0.27 nan nan nan nan nan nan C:275 ILE 6.90 1.17 5.87 0.36 7.92 0.71 nan nan 7.92 0.71 C:276 ASN 4.40 1.00 5.35 0.37 3.46 0.29 3.19 0.03 3.73 0.15 C:277 TRP 5.27 1.26 3.95 0.62 5.79 1.04 4.69 0.00 5.92 1.03 C:287 TYR 4.70 1.41 6.56 0.35 3.77 0.59 3.01 0.00 3.88 0.55 C:288 LYS 5.03 1.33 6.31 0.38 4.00 0.83 2.94 0.00 4.27 0.71 C:289 VAL 5.23 1.18 6.19 0.44 3.95 0.36 nan nan 3.95 0.36 C:290 SER 8.24 1.44 7.27 0.31 10.18 0.68 10.85 0.00 9.50 0.00 C:291 GLU 5.76 1.75 7.91 0.66 4.68 0.94 3.81 0.29 5.25 0.76 C:292 MET 11.29 1.15 10.20 0.40 12.39 0.29 12.66 0.00 12.30 0.28 C:293 LYS 9.04 2.09 10.92 0.19 7.53 1.66 5.10 0.00 8.14 1.27 C:294 VAL 9.91 0.83 9.48 0.85 10.48 0.24 nan nan 10.48 0.24 C:295 ARG 5.00 1.35 6.49 0.70 4.14 0.75 3.63 0.21 4.53 0.79 C:296 PRO 4.03 0.58 4.17 0.53 3.84 0.60 nan nan 3.84 0.60 C:297 ALA 3.62 0.52 3.76 0.56 3.32 0.23 3.10 0.00 3.55 0.00 F:81 SER 3.61 0.59 3.85 0.59 3.12 0.02 3.14 0.00 3.10 0.00 F:82 CYS 3.81 0.25 3.90 0.27 3.63 0.02 3.62 0.00 3.65 0.00 F:83 ALA 3.40 0.33 3.49 0.31 3.04 0.00 nan nan 3.04 0.00 F:84 THR 3.60 0.39 3.87 0.27 3.24 0.18 3.38 0.00 3.17 0.18 F:85 GLY 4.23 0.30 4.23 0.30 nan nan nan nan nan nan F:86 PRO 5.00 0.71 5.40 0.44 4.47 0.65 nan nan 4.47 0.65 F:87 ARG 4.50 1.29 6.04 0.64 3.63 0.53 3.31 0.32 3.87 0.53 F:88 ASN 6.71 1.08 7.59 0.42 5.82 0.78 5.30 0.53 6.35 0.62 F:89 CYS 8.96 0.72 8.51 0.41 9.86 0.03 9.83 0.00 9.88 0.00 F:90 LYS 4.87 1.29 6.09 0.63 3.90 0.73 3.08 0.00 4.11 0.67 F:91 ASP 4.35 0.52 4.74 0.38 3.97 0.31 3.77 0.23 4.16 0.24 F:92 LEU 6.09 0.63 6.37 0.20 5.82 0.77 nan nan 5.82 0.77 F:93 LEU 4.51 0.89 4.96 0.96 4.06 0.51 nan nan 4.06 0.51 F:94 ASP 3.55 0.40 3.76 0.46 3.35 0.16 3.19 0.02 3.50 0.03 F:95 ARG 3.54 0.25 3.64 0.33 3.49 0.15 3.38 0.14 3.57 0.10 F:96 GLY 3.72 0.29 3.72 0.29 nan nan nan nan nan nan F:97 TYR 4.11 0.71 4.72 0.51 3.80 0.59 3.06 0.00 3.91 0.56 F:98 PHE 3.52 0.37 3.94 0.23 3.28 0.17 nan nan 3.28 0.17 F:99 LEU 3.69 0.54 4.19 0.20 3.20 0.25 nan nan 3.20 0.25 F:100 SER 3.66 0.34 3.79 0.33 3.38 0.08 3.46 0.00 3.30 0.00 F:101 GLY 4.16 0.54 4.16 0.54 nan nan nan nan nan nan F:102 TRP 4.36 0.77 3.68 0.35 4.63 0.72 4.04 0.00 4.70 0.73 F:103 HIS 4.25 0.61 4.61 0.52 4.01 0.53 4.09 0.78 3.98 0.35 F:104 THR 3.81 0.42 4.11 0.29 3.41 0.15 3.21 0.00 3.51 0.07 F:105 ILE 6.99 1.00 6.13 0.34 7.85 0.62 nan nan 7.85 0.62 F:106 TYR 4.92 1.04 5.96 0.51 4.40 0.83 3.03 0.00 4.59 0.69 F:107 LEU 5.67 0.61 5.45 0.66 5.89 0.46 nan nan 5.89 0.46 F:108 PRO 3.85 0.50 3.82 0.53 3.89 0.45 nan nan 3.89 0.45 F:109 ASP 3.52 0.36 3.62 0.25 3.42 0.41 3.51 0.54 3.33 0.17 F:110 CYS 3.80 0.47 4.07 0.33 3.25 0.10 3.15 0.00 3.36 0.00 F:111 ARG 3.97 0.74 4.74 0.71 3.53 0.23 3.45 0.02 3.60 0.28 F:112 PRO 3.69 0.53 4.01 0.49 3.28 0.21 nan nan 3.28 0.21 F:113 LEU 4.59 0.66 4.59 0.51 4.59 0.79 nan nan 4.59 0.79 F:114 THR 3.98 0.53 4.31 0.41 3.53 0.28 3.13 0.00 3.73 0.01 F:115 VAL 7.03 0.69 6.58 0.40 7.64 0.51 nan nan 7.64 0.51 F:116 LEU 5.85 1.23 6.92 0.33 4.78 0.80 nan nan 4.78 0.80 F:117 CYS 6.34 1.17 5.68 0.80 7.66 0.47 8.13 0.00 7.20 0.00 F:118 ASP 4.86 0.92 5.64 0.62 4.09 0.33 3.84 0.03 4.33 0.32 F:119 MET 5.78 1.22 4.86 0.73 6.69 0.86 7.34 0.00 6.48 0.90 F:120 ASP 3.72 0.55 4.14 0.43 3.29 0.22 3.09 0.06 3.49 0.10 F:121 THR 4.24 0.57 4.52 0.54 3.87 0.37 3.35 0.00 4.13 0.06 F:122 ASP 3.96 0.41 3.82 0.20 4.11 0.51 4.00 0.70 4.22 0.06 F:123 GLY 3.53 0.21 3.53 0.21 nan nan nan nan nan nan F:124 GLY 4.98 0.34 4.98 0.34 nan nan nan nan nan nan F:125 GLY 6.63 0.34 6.63 0.34 nan nan nan nan nan nan F:126 TRP 7.62 0.71 8.25 0.41 7.37 0.65 6.74 0.00 7.44 0.64 F:127 THR 10.18 0.48 9.91 0.39 10.54 0.32 10.19 0.00 10.72 0.24 F:128 VAL 7.62 1.01 8.42 0.28 6.56 0.55 nan nan 6.56 0.55 F:129 PHE 11.10 1.65 9.19 0.38 12.19 0.95 nan nan 12.19 0.95 F:130 GLN 10.76 1.18 9.54 0.51 11.73 0.41 11.89 0.29 11.62 0.44 F:131 ARG 6.29 2.04 8.66 0.31 4.94 1.21 4.08 0.67 5.59 1.13 F:132 ARG 7.91 1.22 7.18 0.85 8.32 1.20 7.53 1.13 8.92 0.85 F:133 MET 4.45 0.74 4.80 0.82 4.10 0.41 4.02 0.03 4.13 0.47 F:134 ASP 3.96 0.52 4.22 0.51 3.70 0.40 3.75 0.54 3.65 0.14 F:135 GLY 4.49 0.74 4.49 0.74 nan nan nan nan nan nan F:136 SER 3.65 0.38 3.77 0.41 3.39 0.07 3.46 0.00 3.33 0.00 F:137 VAL 4.44 0.33 4.49 0.15 4.36 0.46 nan nan 4.36 0.46 F:138 ASP 3.94 0.75 4.51 0.67 3.37 0.14 3.31 0.16 3.43 0.08 F:139 PHE 7.38 1.23 6.13 0.63 8.09 0.86 nan nan 8.09 0.86 F:140 TYR 4.39 0.70 4.85 0.42 4.17 0.71 3.57 0.00 4.25 0.71 F:141 ARG 4.40 0.88 5.32 0.56 3.88 0.52 3.50 0.50 4.15 0.32 F:142 ASP 4.34 0.89 5.14 0.48 3.54 0.30 3.33 0.27 3.76 0.14 F:143 TRP 5.03 0.85 5.05 0.25 5.03 0.99 3.94 0.00 5.15 0.97 F:144 ALA 4.14 0.61 4.38 0.40 3.17 0.00 nan nan 3.17 0.00 F:145 ALA 4.54 0.73 4.76 0.64 3.66 0.00 nan nan 3.66 0.00 F:146 TYR 8.60 1.10 7.34 0.64 9.23 0.65 9.50 0.00 9.19 0.69 F:147 LYS 4.84 1.18 5.87 0.70 4.02 0.78 3.35 0.00 4.18 0.79 F:148 GLN 3.66 0.47 4.04 0.52 3.47 0.29 3.25 0.25 3.61 0.21 F:149 GLY 4.16 0.51 4.16 0.51 nan nan nan nan nan nan F:150 PHE 5.21 1.26 4.04 0.32 5.89 1.10 nan nan 5.89 1.10 F:151 GLY 3.60 0.40 3.60 0.40 nan nan nan nan nan nan F:152 SER 3.92 0.68 4.30 0.51 3.15 0.05 3.10 0.00 3.20 0.00 F:153 GLN 3.76 0.44 4.13 0.29 3.47 0.29 3.16 0.06 3.68 0.18 F:154 LEU 3.44 0.40 3.68 0.40 3.20 0.20 nan nan 3.20 0.20 F:155 GLY 4.82 0.70 4.82 0.70 nan nan nan nan nan nan F:156 GLU 6.11 0.51 5.78 0.55 6.38 0.26 6.53 0.30 6.27 0.17 F:157 PHE 6.52 0.74 7.11 0.61 6.19 0.57 nan nan 6.19 0.57 F:158 TRP 8.78 2.27 5.89 0.76 9.94 1.51 9.52 0.00 9.98 1.59 F:159 LEU 5.33 0.80 5.11 0.53 5.56 0.94 nan nan 5.56 0.94 F:160 GLY 6.83 0.57 6.83 0.57 nan nan nan nan nan nan F:161 ASN 8.60 1.34 7.41 0.62 9.79 0.60 10.18 0.37 9.40 0.53 F:162 ASP 4.27 0.76 4.92 0.52 3.62 0.17 3.56 0.22 3.68 0.05 F:163 ASN 5.63 1.00 6.38 0.60 4.88 0.72 4.36 0.43 5.40 0.56 F:164 ILE 9.19 1.17 8.08 0.40 10.31 0.34 nan nan 10.31 0.34 F:165 HIS 5.00 1.14 6.07 0.66 4.28 0.77 3.69 0.10 4.58 0.79 F:166 ALA 4.91 0.48 5.10 0.33 4.15 0.00 nan nan 4.15 0.00 F:167 LEU 7.96 1.08 6.95 0.29 8.98 0.41 nan nan 8.98 0.41 F:168 THR 6.71 0.96 6.16 0.77 7.44 0.66 6.98 0.00 7.67 0.70 F:169 ALA 3.97 0.65 4.09 0.67 3.47 0.00 nan nan 3.47 0.00 F:170 GLN 3.64 0.37 3.98 0.19 3.37 0.23 3.22 0.14 3.46 0.22 F:171 GLY 3.47 0.16 3.47 0.16 nan nan nan nan nan nan F:172 SER 3.79 0.40 4.01 0.31 3.34 0.01 3.36 0.00 3.33 0.00 F:173 SER 5.96 0.47 5.78 0.45 6.34 0.23 6.11 0.00 6.57 0.00 F:174 GLU 5.62 1.75 7.35 0.86 4.24 0.81 3.65 0.56 4.64 0.71 F:175 LEU 10.08 1.70 8.58 0.66 11.58 0.92 nan nan 11.58 0.92 F:176 ARG 7.48 2.32 9.99 0.16 6.05 1.66 4.75 0.66 7.01 1.53 F:177 THR 9.81 1.07 9.08 0.67 10.80 0.62 11.63 0.00 10.38 0.22 F:178 ASP 5.95 0.94 6.83 0.47 5.08 0.13 5.06 0.16 5.10 0.07 F:179 LEU 7.33 0.83 6.68 0.30 7.98 0.66 nan nan 7.98 0.66 F:180 VAL 5.15 1.07 6.05 0.21 3.95 0.29 nan nan 3.95 0.29 F:181 ASP 4.58 0.78 5.19 0.46 3.97 0.51 4.01 0.72 3.93 0.02 F:182 PHE 4.04 0.57 3.86 0.61 4.14 0.52 nan nan 4.14 0.52 F:183 GLU 3.39 0.34 3.65 0.29 3.18 0.21 3.02 0.04 3.29 0.21 F:184 GLY 3.65 0.26 3.65 0.26 nan nan nan nan nan nan F:185 ASN 4.18 0.76 4.85 0.55 3.76 0.54 3.33 0.17 4.19 0.41 F:186 HIS 3.82 0.44 4.13 0.41 3.61 0.33 3.48 0.35 3.67 0.30 F:187 GLN 4.93 0.99 5.72 0.41 4.30 0.86 3.49 0.23 4.84 0.68 F:188 PHE 5.07 1.33 6.51 0.36 4.25 0.92 nan nan 4.25 0.92 F:189 ALA 7.64 0.28 7.62 0.31 7.76 0.00 nan nan 7.76 0.00 F:190 LYS 5.29 1.28 6.57 0.10 4.27 0.78 3.26 0.10 4.53 0.66 F:191 TYR 6.86 0.89 6.17 0.52 7.21 0.83 7.01 0.00 7.24 0.88 F:192 LYS 3.81 0.62 4.37 0.41 3.35 0.30 2.97 0.00 3.44 0.26 F:193 SER 4.69 0.89 5.28 0.37 3.50 0.13 3.37 0.00 3.63 0.00 F:194 PHE 7.91 1.92 5.62 0.27 9.22 1.02 nan nan 9.22 1.02 F:195 LYS 4.81 1.22 6.05 0.50 3.82 0.54 3.04 0.00 4.02 0.42 F:196 VAL 7.63 1.42 6.49 0.63 9.15 0.36 nan nan 9.15 0.36 F:197 ALA 5.30 0.60 5.47 0.55 4.63 0.00 nan nan 4.63 0.00 F:198 ASP 4.14 0.79 4.86 0.39 3.43 0.25 3.26 0.26 3.59 0.02 F:199 GLU 3.77 0.39 4.13 0.23 3.48 0.20 3.26 0.01 3.62 0.11 F:200 ALA 3.41 0.27 3.51 0.22 3.03 0.00 nan nan 3.03 0.00 F:201 GLU 3.98 0.67 4.59 0.34 3.48 0.41 3.13 0.00 3.72 0.38 F:202 LYS 5.00 1.43 6.31 0.93 3.95 0.73 3.14 0.00 4.15 0.68 F:203 TYR 7.44 1.14 8.20 0.77 7.05 1.10 5.45 0.00 7.28 0.98 F:204 LYS 5.68 1.44 7.07 0.25 4.57 0.95 3.22 0.00 4.90 0.75 F:205 LEU 8.08 0.99 7.20 0.62 8.96 0.11 nan nan 8.96 0.11 F:206 VAL 4.71 0.89 5.38 0.44 3.82 0.43 nan nan 3.82 0.43 F:207 LEU 5.52 1.11 4.67 0.73 6.37 0.69 nan nan 6.37 0.69 F:208 GLY 3.96 0.29 3.96 0.29 nan nan nan nan nan nan F:209 ALA 3.84 0.61 4.03 0.54 3.10 0.00 nan nan 3.10 0.00 F:210 PHE 4.03 0.68 3.79 0.46 4.16 0.74 nan nan 4.16 0.74 F:211 VAL 3.73 0.50 3.85 0.54 3.57 0.39 nan nan 3.57 0.39 F:212 GLY 4.12 0.48 4.12 0.48 nan nan nan nan nan nan F:213 GLY 3.71 0.22 3.71 0.22 nan nan nan nan nan nan F:214 SER 3.56 0.29 3.67 0.27 3.34 0.18 3.52 0.00 3.16 0.00 F:215 ALA 4.68 0.85 4.35 0.60 5.98 0.00 nan nan 5.98 0.00 F:216 GLY 4.03 0.60 4.03 0.60 nan nan nan nan nan nan F:217 ASN 4.02 0.56 3.88 0.37 4.15 0.68 4.25 0.92 4.05 0.25 F:218 SER 4.26 0.38 4.20 0.31 4.38 0.47 4.84 0.00 3.91 0.00 F:219 LEU 7.04 1.39 5.75 0.38 8.32 0.67 nan nan 8.32 0.67 F:220 THR 3.85 0.67 4.13 0.69 3.48 0.43 3.14 0.00 3.65 0.43 F:221 GLY 3.72 0.22 3.72 0.22 nan nan nan nan nan nan F:222 HIS 4.88 0.98 4.76 0.50 4.94 1.12 4.77 1.30 5.02 1.01 F:223 ASN 3.99 0.53 4.14 0.45 3.85 0.57 3.91 0.79 3.79 0.11 F:224 ASN 3.83 0.55 4.41 0.40 3.47 0.24 3.30 0.22 3.65 0.08 F:225 ASN 4.77 1.01 5.47 0.84 4.07 0.58 3.63 0.12 4.50 0.53 F:226 PHE 5.01 1.47 6.66 0.81 4.07 0.77 nan nan 4.07 0.77 F:227 PHE 10.42 1.82 8.33 0.56 11.62 1.04 nan nan 11.62 1.04 F:228 SER 8.75 0.89 9.25 0.67 8.13 0.73 8.03 1.01 8.24 0.10 F:229 THR 7.44 0.82 7.26 0.88 7.67 0.65 6.86 0.00 8.08 0.38 F:230 LYS 4.06 0.83 4.59 0.95 3.63 0.34 3.12 0.00 3.76 0.24 F:231 ASP 3.72 0.51 3.67 0.37 3.78 0.61 4.00 0.74 3.56 0.34 F:232 GLN 4.15 0.71 4.59 0.50 3.80 0.66 3.12 0.04 4.26 0.45 F:233 ASP 3.64 0.32 3.72 0.41 3.57 0.17 3.57 0.24 3.57 0.07 F:234 ASN 4.24 0.50 4.30 0.28 4.19 0.64 4.05 0.87 4.32 0.15 F:235 ASP 4.99 0.90 4.34 0.67 5.64 0.58 5.42 0.71 5.87 0.25 F:236 VAL 3.63 0.46 3.84 0.52 3.36 0.07 nan nan 3.36 0.07 F:237 SER 4.02 0.36 3.94 0.31 4.20 0.40 3.80 0.00 4.59 0.00 F:238 SER 3.37 0.31 3.52 0.27 3.05 0.01 3.07 0.00 3.04 0.00 F:239 SER 4.03 0.34 4.18 0.31 3.73 0.18 3.55 0.00 3.91 0.00 F:240 ASN 4.55 0.74 4.85 0.66 4.26 0.71 4.47 0.93 4.05 0.25 F:241 CYS 6.93 0.47 6.93 0.43 6.93 0.54 6.39 0.00 7.47 0.00 F:242 ALA 7.85 0.57 7.75 0.60 8.26 0.00 nan nan 8.26 0.00 F:243 GLU 4.36 0.99 5.03 0.95 3.82 0.61 3.26 0.22 4.19 0.50 F:244 LYS 3.65 0.54 4.01 0.54 3.37 0.35 3.04 0.00 3.45 0.35 F:245 PHE 4.27 0.57 4.55 0.15 4.10 0.65 nan nan 4.10 0.65 F:246 GLN 4.54 0.99 5.55 0.37 3.73 0.42 3.40 0.11 3.95 0.41 F:247 GLY 8.46 1.07 8.46 1.07 nan nan nan nan nan nan F:248 ALA 11.18 0.56 11.24 0.61 10.92 0.00 nan nan 10.92 0.00 F:249 TRP 9.94 1.26 11.30 0.41 9.40 1.05 7.64 0.00 9.59 0.92 F:250 TRP 10.61 1.55 8.86 1.02 11.30 1.11 11.08 0.00 11.33 1.17 F:251 TYR 8.29 1.01 7.30 0.82 8.79 0.67 8.41 0.00 8.85 0.69 F:252 ALA 5.21 0.63 5.49 0.35 4.12 0.00 nan nan 4.12 0.00 F:253 ASP 4.08 0.61 4.55 0.45 3.61 0.33 3.50 0.44 3.72 0.06 F:254 CYS 4.38 0.59 4.42 0.68 4.30 0.34 4.64 0.00 3.96 0.00 F:255 HIS 3.47 0.43 3.82 0.47 3.25 0.16 3.17 0.05 3.28 0.18 F:256 ALA 3.99 0.59 4.22 0.41 3.06 0.00 nan nan 3.06 0.00 F:257 SER 4.15 0.48 4.42 0.35 3.62 0.14 3.47 0.00 3.76 0.00 F:258 ASN 7.05 0.73 6.55 0.59 7.55 0.47 7.84 0.41 7.27 0.35 F:259 LEU 9.37 0.76 9.41 0.84 9.33 0.67 nan nan 9.33 0.67 F:260 ASN 10.32 1.60 8.93 0.95 11.71 0.59 12.11 0.02 11.31 0.62 F:261 GLY 6.34 0.62 6.34 0.62 nan nan nan nan nan nan F:262 LEU 4.15 0.68 4.77 0.09 3.54 0.39 nan nan 3.54 0.39 F:263 TYR 5.27 0.81 4.62 0.49 5.59 0.74 4.58 0.00 5.74 0.68 F:264 LEU 4.01 0.66 4.56 0.37 3.46 0.37 nan nan 3.46 0.37 F:265 MET 3.58 0.27 3.70 0.26 3.51 0.26 3.45 0.34 3.53 0.22 F:266 GLY 3.75 0.22 3.75 0.22 nan nan nan nan nan nan F:267 PRO 3.73 0.56 4.08 0.49 3.27 0.16 nan nan 3.27 0.16 F:268 HIS 3.45 0.37 3.78 0.32 3.22 0.18 3.14 0.16 3.27 0.18 F:269 GLU 3.39 0.36 3.63 0.38 3.20 0.20 3.13 0.20 3.24 0.19 F:270 SER 3.83 0.29 3.95 0.25 3.59 0.23 3.82 0.00 3.37 0.00 F:271 TYR 3.46 0.38 3.87 0.31 3.26 0.21 2.95 0.00 3.30 0.18 F:272 ALA 4.42 0.51 4.65 0.22 3.47 0.00 nan nan 3.47 0.00 F:273 ASN 4.99 0.72 5.63 0.18 4.36 0.45 4.20 0.55 4.52 0.21 F:274 GLY 6.35 0.36 6.35 0.36 nan nan nan nan nan nan F:275 ILE 7.50 1.23 6.56 0.39 8.44 1.06 nan nan 8.44 1.06 F:276 ASN 4.34 0.93 5.21 0.41 3.48 0.26 3.25 0.05 3.71 0.14 F:277 TRP 5.52 1.35 3.95 0.61 6.15 1.00 5.02 0.00 6.27 0.98 F:286 SER 3.86 0.39 3.83 0.43 3.90 0.29 4.19 0.00 3.61 0.00 F:287 TYR 5.32 1.17 6.42 0.78 4.77 0.91 3.46 0.00 4.95 0.81 F:288 LYS 4.88 1.32 6.17 0.30 3.85 0.81 2.92 0.00 4.08 0.74 F:289 VAL 5.40 1.25 6.40 0.52 4.06 0.40 nan nan 4.06 0.40 F:290 SER 8.11 1.12 7.34 0.28 9.66 0.13 9.79 0.00 9.53 0.00 F:291 GLU 5.64 1.74 7.78 0.46 4.57 1.00 3.68 0.27 5.17 0.85 F:292 MET 11.29 1.53 9.80 0.39 12.78 0.33 13.17 0.00 12.65 0.28 F:293 LYS 8.68 2.20 10.74 0.46 7.03 1.55 4.79 0.00 7.59 1.20 F:294 VAL 10.31 0.82 9.98 0.70 10.59 0.80 nan nan 10.59 0.80 F:295 ARG 4.99 1.45 6.64 0.72 4.04 0.76 3.53 0.10 4.43 0.80 F:296 PRO 4.30 0.62 4.38 0.56 4.19 0.68 nan nan 4.19 0.68 F:297 ALA 3.64 0.52 3.77 0.54 3.36 0.32 3.04 0.00 3.68 0.00