# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom S:1 MET 3.63 0.53 3.89 0.58 3.37 0.30 3.86 0.00 3.20 0.09 S:2 THR 3.83 0.47 4.03 0.39 3.56 0.42 4.12 0.00 3.28 0.17 S:3 GLN 3.60 0.56 4.04 0.56 3.25 0.18 3.03 0.08 3.39 0.03 S:4 ALA 4.98 0.73 5.11 0.77 4.50 0.00 nan nan 4.50 0.00 S:5 GLU 5.65 1.56 7.18 0.51 4.43 0.91 3.56 0.16 5.01 0.72 S:6 ILE 5.00 0.73 5.39 0.72 4.60 0.48 nan nan 4.60 0.48 S:7 LYS 4.33 0.82 5.10 0.49 3.72 0.42 3.17 0.00 3.86 0.35 S:8 LEU 8.21 0.81 7.75 0.87 8.67 0.39 nan nan 8.67 0.39 S:9 CYS 8.17 0.27 8.08 0.28 8.35 0.09 8.43 0.00 8.26 0.00 S:10 SER 5.10 0.91 5.70 0.31 3.90 0.33 3.57 0.00 4.24 0.00 S:11 LEU 5.69 0.59 5.95 0.31 5.42 0.69 nan nan 5.42 0.69 S:12 LEU 7.61 0.70 7.35 0.37 7.86 0.84 nan nan 7.86 0.84 S:13 LEU 8.25 1.02 7.38 0.67 9.12 0.37 nan nan 9.12 0.37 S:14 GLN 4.09 0.94 4.69 1.01 3.60 0.51 3.13 0.03 3.92 0.43 S:15 GLU 3.84 0.41 3.92 0.42 3.78 0.39 3.64 0.29 3.87 0.42 S:16 HIS 3.88 0.49 3.97 0.57 3.81 0.42 3.86 0.59 3.79 0.29 S:17 PHE 4.33 0.67 3.84 0.44 4.61 0.61 nan nan 4.61 0.61 S:18 GLY 4.02 0.57 4.02 0.57 nan nan nan nan nan nan S:19 GLU 3.58 0.45 4.00 0.23 3.25 0.25 2.97 0.02 3.43 0.13 S:20 ILE 4.49 0.83 5.05 0.63 3.92 0.59 nan nan 3.92 0.59 S:21 VAL 5.73 1.11 6.20 1.04 5.11 0.85 nan nan 5.11 0.85 S:22 GLU 4.82 1.11 5.79 0.46 4.04 0.83 3.27 0.12 4.56 0.67 S:23 LYS 3.93 0.54 4.38 0.36 3.58 0.37 3.13 0.00 3.69 0.33 S:24 ILE 7.24 0.65 6.76 0.38 7.72 0.48 nan nan 7.72 0.48 S:25 GLY 7.44 0.56 7.44 0.56 nan nan nan nan nan nan S:26 VAL 4.72 0.67 5.13 0.44 4.17 0.51 nan nan 4.17 0.51 S:27 HIS 4.72 0.67 4.73 0.60 4.70 0.70 4.69 0.91 4.71 0.58 S:28 LEU 7.39 1.32 6.20 0.63 8.57 0.53 nan nan 8.57 0.53 S:29 ILE 6.21 1.32 5.23 1.00 7.18 0.76 nan nan 7.18 0.76 S:30 ARG 3.74 0.62 4.12 0.72 3.53 0.43 3.19 0.15 3.78 0.39 S:31 THR 3.89 0.53 3.83 0.44 3.97 0.62 4.76 0.00 3.57 0.32 S:32 GLY 4.12 0.61 4.12 0.61 nan nan nan nan nan nan S:33 SER 3.90 0.33 3.98 0.38 3.73 0.05 3.78 0.00 3.68 0.00 S:34 GLN 5.00 0.58 5.37 0.61 4.70 0.34 4.78 0.18 4.65 0.41 S:35 PRO 4.24 0.69 4.81 0.27 3.48 0.10 nan nan 3.48 0.10 S:36 LEU 4.49 0.58 4.81 0.61 4.17 0.32 nan nan 4.17 0.32 S:37 ARG 3.67 0.68 4.50 0.36 3.19 0.18 3.07 0.18 3.29 0.12 S:38 VAL 4.08 0.61 4.52 0.31 3.49 0.36 nan nan 3.49 0.36 S:39 ILE 7.35 0.76 6.68 0.41 8.03 0.27 nan nan 8.03 0.27 S:40 ALA 5.01 0.88 5.07 0.98 4.76 0.00 nan nan 4.76 0.00 S:41 HIS 3.49 0.41 3.78 0.51 3.30 0.13 3.24 0.13 3.33 0.11 S:42 ASP 3.53 0.36 3.65 0.32 3.40 0.36 3.10 0.09 3.71 0.25 S:43 THR 4.19 0.67 3.88 0.48 4.61 0.67 5.54 0.00 4.15 0.15 S:44 GLY 3.47 0.28 3.47 0.28 nan nan nan nan nan nan S:45 THR 4.48 0.63 3.95 0.18 5.18 0.04 5.12 0.00 5.21 0.01 S:46 SER 3.95 0.62 4.21 0.60 3.41 0.11 3.52 0.00 3.30 0.00 S:47 LEU 4.12 0.73 4.66 0.66 3.58 0.20 nan nan 3.58 0.20 S:48 ASP 3.89 0.63 4.50 0.05 3.28 0.23 3.08 0.10 3.49 0.10 S:49 GLN 4.10 0.68 4.71 0.30 3.61 0.46 3.25 0.04 3.86 0.46 S:50 VAL 6.98 0.58 6.55 0.37 7.55 0.18 nan nan 7.55 0.18 S:51 LYS 3.82 0.68 4.28 0.74 3.45 0.28 3.07 0.00 3.55 0.23 S:52 LYS 3.64 0.50 4.16 0.18 3.23 0.17 3.00 0.00 3.29 0.14 S:53 ALA 5.41 0.59 5.43 0.66 5.30 0.00 nan nan 5.30 0.00 S:54 LEU 5.65 0.77 5.29 0.58 6.01 0.76 nan nan 6.01 0.76 S:55 CYS 3.91 0.50 4.21 0.19 3.33 0.39 2.94 0.00 3.72 0.00 S:56 VAL 4.29 0.68 4.75 0.47 3.68 0.34 nan nan 3.68 0.34 S:57 LEU 7.77 0.89 6.95 0.39 8.58 0.36 nan nan 8.58 0.36 S:58 VAL 4.93 0.79 5.58 0.23 4.06 0.23 nan nan 4.06 0.23 S:59 GLN 4.45 1.05 5.53 0.55 3.59 0.24 3.46 0.24 3.68 0.20 S:60 HIS 5.43 1.49 7.02 0.39 4.37 0.90 3.87 0.37 4.62 0.98 S:61 ASN 5.66 1.02 5.19 1.08 6.12 0.67 6.56 0.58 5.68 0.43 S:62 LEU 6.57 1.02 5.62 0.49 7.53 0.17 nan nan 7.53 0.17 S:63 VAL 6.14 1.15 5.20 0.23 7.40 0.46 nan nan 7.40 0.46 S:64 SER 4.31 0.90 4.83 0.63 3.27 0.07 3.34 0.00 3.20 0.00 S:65 TYR 4.41 0.58 4.65 0.53 4.29 0.56 3.84 0.00 4.35 0.57 S:66 GLN 4.12 0.89 4.95 0.50 3.45 0.50 3.00 0.08 3.75 0.43 S:67 VAL 3.63 0.43 3.89 0.40 3.29 0.16 nan nan 3.29 0.16 S:68 HIS 4.07 0.46 4.50 0.29 3.78 0.30 3.82 0.36 3.76 0.26 S:69 LYS 3.25 0.23 3.40 0.23 3.12 0.13 2.91 0.00 3.18 0.09 S:70 ARG 3.42 0.37 3.81 0.29 3.20 0.17 3.10 0.16 3.27 0.14 S:71 GLY 3.55 0.29 3.55 0.29 nan nan nan nan nan nan S:72 VAL 4.06 0.75 4.57 0.62 3.38 0.13 nan nan 3.38 0.13 S:73 VAL 4.12 0.57 4.50 0.35 3.60 0.37 nan nan 3.60 0.37 S:74 GLU 5.22 1.35 6.52 0.28 4.18 0.90 3.33 0.09 4.76 0.73 S:75 TYR 5.85 1.48 7.26 0.34 5.14 1.32 3.12 0.00 5.43 1.16 S:76 GLU 4.86 1.26 6.06 0.50 3.90 0.77 3.13 0.05 4.41 0.56 S:77 ALA 5.96 0.70 5.65 0.38 7.18 0.00 nan nan 7.18 0.00 S:78 GLN 4.15 0.91 5.11 0.29 3.38 0.30 3.09 0.16 3.58 0.18 S:79 CYS 5.26 0.34 5.44 0.28 4.90 0.04 4.94 0.00 4.86 0.00 S:80 SER 4.04 0.69 4.47 0.39 3.18 0.02 3.16 0.00 3.20 0.00 S:81 ARG 4.91 0.96 5.20 0.79 4.74 1.01 5.48 0.84 4.18 0.73 S:82 VAL 8.54 0.94 8.12 0.94 9.09 0.58 nan nan 9.09 0.58 S:83 LEU 7.20 1.23 7.82 0.29 6.58 1.48 nan nan 6.58 1.48 S:84 ARG 5.72 1.34 7.33 0.36 4.80 0.64 4.76 0.81 4.83 0.48 S:85 MET 5.81 0.95 5.91 1.09 5.71 0.79 5.95 0.00 5.63 0.89 S:86 LEU 6.71 0.96 5.97 0.15 7.46 0.84 nan nan 7.46 0.84 S:87 ARG 7.08 0.75 7.02 0.28 7.12 0.92 6.47 0.81 7.61 0.66 S:88 TYR 5.80 0.87 5.61 0.41 5.89 1.01 6.80 0.00 5.76 1.02 S:89 PRO 3.77 0.34 3.98 0.23 3.49 0.25 nan nan 3.49 0.25 S:90 ARG 4.53 0.59 5.06 0.32 4.23 0.50 3.91 0.47 4.47 0.36 S:91 TYR 7.75 0.84 7.21 0.35 8.02 0.88 6.12 0.00 8.30 0.55 S:92 ILE 5.11 0.70 5.71 0.32 4.51 0.39 nan nan 4.51 0.39 S:93 TYR 3.90 0.83 5.00 0.34 3.35 0.24 2.98 0.00 3.40 0.22 S:94 THR 5.39 0.51 5.55 0.44 5.17 0.52 4.46 0.00 5.53 0.16 S:95 THR 7.78 0.99 7.01 0.57 8.80 0.09 8.93 0.00 8.73 0.01 S:96 LYS 4.21 0.96 4.83 0.98 3.71 0.56 3.22 0.00 3.84 0.57 S:97 THR 3.74 0.49 3.94 0.51 3.48 0.29 3.40 0.00 3.51 0.35 S:98 LEU 3.79 0.50 3.75 0.48 3.82 0.52 nan nan 3.82 0.52 S:99 TYR 4.06 0.47 3.95 0.26 4.11 0.54 3.49 0.00 4.20 0.52 S:100 SER 3.80 0.62 4.10 0.55 3.20 0.13 3.07 0.00 3.34 0.00 S:101 ASP 4.22 0.88 5.02 0.41 3.41 0.30 3.17 0.02 3.66 0.24 S:102 THR 5.78 1.03 6.46 0.79 4.87 0.43 4.27 0.00 5.17 0.09 S:103 GLY 7.50 0.98 7.50 0.98 nan nan nan nan nan nan S:104 GLU 5.47 1.48 6.91 0.27 4.31 0.94 3.42 0.16 4.89 0.77 S:105 LEU 5.72 1.29 6.85 0.50 4.59 0.73 nan nan 4.59 0.73 S:106 ILE 9.64 0.79 9.69 0.58 9.59 0.95 nan nan 9.59 0.95 S:107 VAL 9.52 0.60 9.30 0.48 9.82 0.62 nan nan 9.82 0.62 S:108 GLU 5.15 1.34 6.38 0.68 4.16 0.82 3.48 0.40 4.61 0.72 S:109 GLU 5.41 1.11 6.26 0.32 4.73 1.03 3.87 0.54 5.30 0.87 S:110 LEU 9.11 1.00 8.33 0.49 9.90 0.71 nan nan 9.90 0.71 S:111 LEU 7.25 0.99 6.68 0.98 7.83 0.58 nan nan 7.83 0.58 S:112 LEU 3.89 0.66 4.25 0.72 3.53 0.30 nan nan 3.53 0.30 S:113 ASN 3.85 0.55 4.25 0.42 3.45 0.32 3.24 0.27 3.66 0.20 S:114 GLY 6.10 0.42 6.10 0.42 nan nan nan nan nan nan S:115 LYS 5.10 0.58 4.94 0.80 5.23 0.24 5.36 0.00 5.19 0.26 S:116 LEU 5.01 0.70 5.31 0.56 4.72 0.70 nan nan 4.72 0.70 S:117 THR 4.32 0.82 4.97 0.42 3.46 0.19 3.36 0.00 3.51 0.21 S:118 MET 4.26 0.54 4.73 0.11 3.78 0.36 3.42 0.00 3.90 0.33 S:119 SER 3.68 0.42 3.97 0.18 3.12 0.05 3.07 0.00 3.17 0.00 S:120 ALA 3.98 0.47 4.17 0.32 3.24 0.00 nan nan 3.24 0.00 S:121 VAL 7.14 0.99 6.45 0.46 8.06 0.72 nan nan 8.06 0.72 S:122 VAL 4.87 0.59 5.28 0.39 4.32 0.27 nan nan 4.32 0.27 S:123 LYS 3.77 0.60 4.39 0.22 3.27 0.25 2.97 0.00 3.35 0.22 S:124 LYS 3.87 0.58 4.41 0.27 3.44 0.37 3.05 0.00 3.53 0.35 S:125 VAL 7.09 0.70 6.53 0.33 7.84 0.14 nan nan 7.84 0.14 S:126 ALA 5.16 0.58 5.40 0.37 4.20 0.00 nan nan 4.20 0.00 S:127 ASP 3.87 0.50 4.31 0.25 3.44 0.24 3.24 0.17 3.64 0.06 S:128 ARG 4.11 0.61 4.69 0.29 3.78 0.48 3.66 0.55 3.87 0.40 S:129 LEU 4.26 0.54 4.44 0.64 4.09 0.32 nan nan 4.09 0.32 S:130 THR 3.93 0.65 4.23 0.65 3.54 0.41 3.80 0.00 3.40 0.44 S:131 GLU 3.44 0.31 3.58 0.32 3.33 0.26 3.09 0.11 3.50 0.19 S:132 THR 3.39 0.41 3.53 0.49 3.21 0.08 3.25 0.00 3.19 0.10 S:138 THR 3.40 0.33 3.56 0.34 3.18 0.16 3.13 0.00 3.21 0.19 S:139 MET 4.15 0.39 4.08 0.30 4.22 0.46 3.43 0.00 4.48 0.11 S:140 ASP 4.01 0.67 4.53 0.58 3.49 0.16 3.34 0.06 3.64 0.05 S:141 TYR 3.86 0.73 4.78 0.48 3.39 0.19 2.93 0.00 3.46 0.09 S:142 ALA 4.04 0.53 4.24 0.39 3.24 0.00 nan nan 3.24 0.00 S:143 GLU 4.11 0.71 4.79 0.28 3.57 0.42 3.24 0.04 3.79 0.40 S:144 VAL 6.84 0.34 6.66 0.26 7.08 0.26 nan nan 7.08 0.26 S:145 SER 4.57 0.81 5.09 0.38 3.53 0.25 3.28 0.00 3.79 0.00 S:146 ASN 3.75 0.57 4.28 0.27 3.21 0.13 3.09 0.04 3.34 0.02 S:147 THR 4.63 0.58 4.91 0.59 4.26 0.27 3.88 0.00 4.45 0.06 S:148 PHE 6.85 0.50 6.62 0.37 6.97 0.53 nan nan 6.97 0.53 S:149 VAL 4.44 0.93 5.20 0.30 3.43 0.33 nan nan 3.43 0.33 S:150 ARG 4.19 1.09 5.53 0.35 3.42 0.42 3.14 0.22 3.62 0.42 S:151 LEU 7.37 0.51 6.92 0.26 7.82 0.21 nan nan 7.82 0.21 S:152 ALA 4.49 0.76 4.63 0.79 3.96 0.00 nan nan 3.96 0.00 S:153 ASP 3.71 0.42 3.97 0.44 3.45 0.15 3.29 0.00 3.60 0.03 S:154 THR 4.46 0.57 4.75 0.31 4.08 0.60 4.81 0.00 3.71 0.38 S:155 HIS 4.06 0.91 5.14 0.23 3.33 0.20 3.24 0.10 3.38 0.22 S:156 PHE 6.52 1.12 7.42 0.67 6.01 1.00 nan nan 6.01 1.00 S:157 VAL 6.64 1.24 5.93 0.99 7.59 0.86 nan nan 7.59 0.86 S:158 GLN 4.27 0.78 4.98 0.56 3.70 0.35 3.35 0.08 3.94 0.26 S:159 ARG 3.61 0.37 3.94 0.37 3.43 0.21 3.31 0.20 3.51 0.18 S:160 CYS 5.10 0.87 4.55 0.43 6.20 0.30 6.50 0.00 5.91 0.00 S:161 PRO 3.66 0.47 3.96 0.38 3.27 0.26 nan nan 3.27 0.26 S:162 SER 3.41 0.31 3.50 0.34 3.22 0.03 3.25 0.00 3.19 0.00 S:228 ILE 3.25 0.30 3.31 0.32 3.03 0.00 nan nan 3.03 0.00 S:229 PRO 3.79 0.40 3.96 0.24 3.13 0.00 nan nan 3.13 0.00 S:230 ASP 4.26 0.58 4.45 0.51 3.52 0.00 nan nan 3.52 0.00 S:231 ASP 3.61 0.57 4.08 0.43 3.13 0.10 3.03 0.01 3.23 0.04 S:232 GLY 4.38 0.19 4.38 0.19 nan nan nan nan nan nan S:233 ILE 4.05 0.53 4.51 0.25 3.59 0.26 nan nan 3.59 0.26 S:234 TYR 5.11 1.38 6.66 0.49 4.33 0.95 2.96 0.00 4.53 0.86 S:235 TRP 6.28 1.71 8.37 0.45 5.44 1.25 4.94 0.00 5.50 1.31 S:236 GLN 5.96 1.69 7.65 0.41 4.61 0.96 3.75 0.16 5.19 0.83 S:237 ALA 7.35 1.12 6.98 0.92 8.86 0.00 nan nan 8.86 0.00 S:238 ASN 5.36 1.09 6.31 0.35 4.42 0.69 3.87 0.17 4.97 0.55 S:239 LEU 5.12 0.51 5.31 0.16 4.94 0.65 nan nan 4.94 0.65 S:240 ASP 3.74 0.51 4.16 0.37 3.31 0.18 3.18 0.16 3.44 0.05 S:241 ARG 4.97 0.59 5.26 0.64 4.80 0.48 4.65 0.62 4.91 0.29 S:242 PHE 8.52 1.18 7.05 0.33 9.36 0.42 nan nan 9.36 0.42 S:243 HIS 4.70 0.62 5.21 0.40 4.36 0.49 4.28 0.54 4.40 0.45 S:244 GLN 4.79 0.72 5.22 0.81 4.44 0.38 4.51 0.57 4.40 0.16 S:245 HIS 5.25 0.99 6.12 0.25 4.67 0.88 4.09 0.10 4.96 0.95 S:246 PHE 6.11 0.62 5.81 0.54 6.28 0.60 nan nan 6.28 0.60 S:247 ARG 6.02 0.61 6.62 0.35 5.67 0.43 5.64 0.60 5.70 0.22 S:248 ASP 6.44 0.59 6.21 0.55 6.67 0.53 6.93 0.48 6.41 0.45 S:249 GLN 3.85 0.56 4.30 0.49 3.48 0.26 3.23 0.13 3.65 0.17 S:250 ALA 4.41 0.28 4.47 0.28 4.16 0.00 nan nan 4.16 0.00 S:251 ILE 7.57 1.06 6.56 0.34 8.58 0.32 nan nan 8.58 0.32 S:252 VAL 5.07 0.57 5.28 0.50 4.78 0.53 nan nan 4.78 0.53 S:253 SER 3.70 0.36 3.93 0.20 3.25 0.05 3.30 0.00 3.20 0.00 S:254 ALA 4.85 0.56 4.95 0.59 4.45 0.00 nan nan 4.45 0.00 S:255 VAL 7.34 0.89 6.65 0.44 8.25 0.35 nan nan 8.25 0.35 S:256 ALA 4.17 0.74 4.36 0.72 3.42 0.00 nan nan 3.42 0.00 S:257 ASN 3.41 0.32 3.56 0.38 3.27 0.15 3.19 0.09 3.35 0.16 S:258 ARG 3.64 0.33 3.78 0.37 3.57 0.27 3.48 0.39 3.63 0.06 S:259 MET 3.96 0.38 3.82 0.38 4.10 0.33 4.59 0.00 3.94 0.20 S:260 ASP 3.78 0.42 4.07 0.35 3.48 0.25 3.41 0.34 3.56 0.05 S:261 GLN 3.65 0.58 4.16 0.48 3.24 0.19 3.01 0.04 3.40 0.04 S:262 THR 4.19 0.74 4.69 0.56 3.51 0.30 3.10 0.00 3.72 0.10 S:263 SER 6.29 1.09 6.91 0.67 5.03 0.57 4.47 0.00 5.60 0.00 S:264 SER 5.76 0.82 6.28 0.20 4.72 0.56 4.16 0.00 5.28 0.00 S:265 GLU 4.62 1.02 5.67 0.52 3.78 0.27 3.73 0.38 3.82 0.13 S:266 ILE 7.51 1.12 7.68 1.01 7.33 1.19 nan nan 7.33 1.19 S:267 VAL 9.28 0.73 8.83 0.53 9.89 0.49 nan nan 9.89 0.49 S:268 ARG 4.81 1.41 6.44 0.55 3.88 0.76 3.35 0.40 4.28 0.72 S:269 THR 6.04 0.46 6.00 0.44 6.10 0.48 6.78 0.00 5.76 0.03 S:270 MET 8.81 1.23 7.67 0.28 9.95 0.58 10.90 0.00 9.63 0.21 S:271 LEU 7.70 0.85 7.14 0.60 8.26 0.69 nan nan 8.26 0.69 S:272 ARG 3.84 0.61 4.40 0.67 3.52 0.23 3.39 0.05 3.61 0.26 S:273 MET 3.97 0.41 3.90 0.30 4.04 0.48 4.61 0.00 3.86 0.41 S:274 SER 6.32 0.71 5.94 0.42 7.07 0.56 7.63 0.00 6.51 0.00 S:275 GLU 4.13 0.59 4.32 0.73 3.98 0.37 3.67 0.21 4.18 0.31 S:276 ILE 3.82 0.68 4.40 0.42 3.24 0.24 nan nan 3.24 0.24 S:277 THR 3.67 0.37 3.90 0.12 3.36 0.36 3.09 0.00 3.50 0.37 S:278 THR 4.36 0.81 3.77 0.43 5.13 0.50 5.72 0.00 4.84 0.34 S:279 SER 3.61 0.20 3.71 0.16 3.41 0.10 3.51 0.00 3.31 0.00 S:280 SER 3.32 0.21 3.38 0.19 3.09 0.00 nan nan 3.09 0.00 S:283 PRO 4.17 0.73 4.78 0.25 3.36 0.17 nan nan 3.36 0.17 S:284 PHE 3.86 0.53 4.38 0.43 3.57 0.30 nan nan 3.57 0.30 S:285 THR 5.82 1.29 4.80 0.60 7.19 0.37 7.64 0.00 6.96 0.23 S:286 GLN 4.16 0.73 4.75 0.61 3.69 0.40 3.43 0.34 3.87 0.34 S:287 PRO 3.81 0.56 4.24 0.32 3.22 0.11 nan nan 3.22 0.11 S:288 LEU 5.82 0.50 5.75 0.30 5.90 0.64 nan nan 5.90 0.64 S:289 SER 4.92 0.93 5.54 0.37 3.68 0.13 3.55 0.00 3.82 0.00 S:290 SER 5.21 0.67 5.64 0.19 4.35 0.38 3.96 0.00 4.73 0.00 S:291 ASN 3.78 0.60 4.32 0.34 3.24 0.17 3.09 0.09 3.40 0.02 S:292 GLU 3.81 0.39 4.11 0.23 3.57 0.32 3.36 0.25 3.70 0.28 S:293 ILE 7.07 1.03 6.13 0.33 8.01 0.51 nan nan 8.01 0.51 S:294 PHE 4.30 0.82 4.95 0.81 3.93 0.55 nan nan 3.93 0.55 S:295 ARG 3.43 0.49 3.87 0.48 3.18 0.25 2.96 0.13 3.33 0.20 S:296 SER 3.72 0.38 3.71 0.30 3.75 0.50 4.25 0.00 3.25 0.00 S:297 LEU 4.53 0.54 4.23 0.58 4.83 0.24 nan nan 4.83 0.24 S:298 PRO 3.80 0.30 3.80 0.20 3.80 0.40 nan nan 3.80 0.40 S:299 VAL 3.37 0.30 3.55 0.24 3.13 0.17 nan nan 3.13 0.17 S:300 GLY 3.55 0.14 3.55 0.14 nan nan nan nan nan nan S:301 TYR 3.31 0.27 3.57 0.27 3.18 0.17 2.86 0.00 3.23 0.12 S:302 ASN 3.82 0.24 3.70 0.19 3.94 0.23 4.08 0.20 3.80 0.14 S:303 ILE 4.08 0.85 4.75 0.68 3.42 0.32 nan nan 3.42 0.32 S:304 SER 3.97 0.56 4.37 0.06 3.18 0.09 3.09 0.00 3.27 0.00 S:305 LYS 3.60 0.49 4.11 0.18 3.19 0.18 2.97 0.00 3.25 0.16 S:306 GLN 3.94 0.63 4.55 0.20 3.45 0.39 3.08 0.10 3.70 0.31 S:307 VAL 6.54 0.31 6.44 0.33 6.68 0.22 nan nan 6.68 0.22 S:308 LEU 4.17 0.75 4.79 0.52 3.55 0.31 nan nan 3.55 0.31 S:309 ASP 3.76 0.44 4.14 0.27 3.37 0.16 3.22 0.07 3.52 0.04 S:310 GLN 4.72 0.96 5.49 0.62 4.10 0.70 3.50 0.21 4.50 0.63 S:311 TYR 7.06 0.73 6.60 0.38 7.30 0.75 7.41 0.00 7.28 0.81 S:312 LEU 3.83 0.68 4.34 0.59 3.32 0.24 nan nan 3.32 0.24 S:313 THR 3.91 0.46 4.22 0.23 3.49 0.34 3.86 0.00 3.31 0.27 S:314 LEU 7.00 0.85 6.27 0.33 7.74 0.50 nan nan 7.74 0.50 S:315 LEU 4.21 0.69 4.55 0.77 3.86 0.35 nan nan 3.86 0.35 S:316 ALA 3.47 0.37 3.60 0.29 2.93 0.00 nan nan 2.93 0.00 S:317 ASP 4.00 0.45 3.93 0.14 4.08 0.61 3.80 0.71 4.36 0.30 S:318 ASP 3.41 0.34 3.69 0.21 3.13 0.17 3.00 0.13 3.25 0.08 S:319 PRO 4.09 0.27 4.13 0.25 4.03 0.30 nan nan 4.03 0.30 S:320 LEU 4.32 0.93 5.17 0.24 3.47 0.50 nan nan 3.47 0.50 S:321 GLU 7.73 0.69 7.31 0.54 8.06 0.60 7.72 0.78 8.29 0.26 S:322 PHE 7.73 2.19 5.35 0.92 9.09 1.40 nan nan 9.09 1.40 S:323 VAL 3.86 0.59 4.25 0.47 3.34 0.24 nan nan 3.34 0.24 S:324 GLY 4.53 0.34 4.53 0.34 nan nan nan nan nan nan S:325 LYS 3.26 0.22 3.40 0.25 3.14 0.10 2.96 0.00 3.19 0.04 S:332 GLY 3.78 0.59 3.78 0.59 nan nan nan nan nan nan S:333 MET 3.62 0.50 3.97 0.43 3.27 0.26 3.59 0.00 3.16 0.22 S:334 TYR 5.55 0.93 6.26 0.38 5.14 0.90 nan nan 5.14 0.90 S:335 VAL 5.44 1.14 6.39 0.43 4.18 0.16 nan nan 4.18 0.16 S:336 ILE 8.73 1.40 7.40 0.44 10.05 0.51 nan nan 10.05 0.51 S:337 ASN 5.24 0.99 6.15 0.41 4.32 0.37 4.16 0.43 4.48 0.18 S:338 LEU 6.99 0.50 6.87 0.42 7.10 0.54 nan nan 7.10 0.54 S:339 HIS 4.17 0.72 4.99 0.25 3.63 0.30 3.54 0.27 3.68 0.31 S:340 LYS 4.13 0.85 4.86 0.77 3.55 0.25 3.19 0.00 3.64 0.20 S:341 ALA 7.61 0.77 7.34 0.61 8.68 0.00 nan nan 8.68 0.00 S:342 LEU 7.14 0.68 7.64 0.17 6.63 0.62 nan nan 6.63 0.62 S:343 ALA 5.16 0.75 5.49 0.38 3.81 0.00 nan nan 3.81 0.00 S:344 SER 4.96 0.36 5.07 0.24 4.72 0.44 5.16 0.00 4.28 0.00 S:345 LEU 4.98 0.64 5.06 0.52 4.90 0.74 nan nan 4.90 0.74 S:346 ALA 6.80 0.52 6.55 0.23 7.76 0.00 nan nan 7.76 0.00 S:347 THR 5.22 0.71 5.78 0.32 4.48 0.29 4.08 0.00 4.68 0.05 S:348 ALA 3.95 0.60 4.09 0.58 3.38 0.00 nan nan 3.38 0.00 S:349 THR 4.26 0.47 4.52 0.44 3.92 0.26 3.56 0.00 4.11 0.07 S:350 LEU 6.47 0.43 6.09 0.15 6.85 0.25 nan nan 6.85 0.25 S:351 GLU 4.52 0.77 5.21 0.25 3.96 0.57 3.36 0.13 4.36 0.36 S:352 SER 4.06 0.57 4.43 0.22 3.32 0.25 3.07 0.00 3.57 0.00 S:353 VAL 4.78 0.47 5.12 0.25 4.31 0.23 nan nan 4.31 0.23 S:354 VAL 6.67 0.26 6.50 0.19 6.90 0.15 nan nan 6.90 0.15 S:355 GLN 3.88 0.76 4.45 0.79 3.42 0.24 3.18 0.00 3.59 0.17 S:356 GLU 3.50 0.35 3.68 0.42 3.36 0.18 3.26 0.22 3.42 0.11 S:357 ARG 3.75 0.36 3.67 0.39 3.80 0.34 3.96 0.24 3.67 0.35 S:358 PHE 4.29 0.51 3.92 0.41 4.50 0.43 nan nan 4.50 0.43 S:359 GLY 4.02 0.57 4.02 0.57 nan nan nan nan nan nan S:360 SER 3.79 0.49 3.98 0.34 3.01 0.00 nan nan 3.01 0.00 S:361 ARG 3.48 0.34 3.63 0.21 2.91 0.00 nan nan 2.91 0.00 S:362 CYS 4.60 0.88 5.02 0.80 3.76 0.03 3.73 0.00 3.80 0.00 S:363 ALA 6.09 0.35 6.16 0.36 5.81 0.00 nan nan 5.81 0.00 S:364 ARG 3.54 0.59 4.15 0.58 3.19 0.17 3.09 0.19 3.27 0.09 S:365 ILE 3.88 0.51 4.32 0.22 3.44 0.28 nan nan 3.44 0.28 S:366 PHE 4.93 0.47 5.40 0.24 4.66 0.35 nan nan 4.66 0.35 S:367 ARG 3.97 0.77 4.77 0.64 3.51 0.36 3.40 0.35 3.60 0.33 S:368 LEU 3.72 0.43 4.02 0.33 3.43 0.31 nan nan 3.43 0.31 S:369 VAL 4.02 0.38 4.28 0.23 3.68 0.25 nan nan 3.68 0.25 S:370 LEU 4.30 0.50 4.27 0.67 4.32 0.22 nan nan 4.32 0.22 S:371 GLN 3.30 0.44 3.40 0.44 2.92 0.00 nan nan 2.92 0.00 S:419 ARG 3.25 0.22 3.23 0.24 3.34 0.00 nan nan 3.34 0.00 S:420 THR 3.49 0.34 3.65 0.27 3.28 0.31 3.01 0.00 3.41 0.30 S:421 PHE 4.01 0.58 4.39 0.24 3.80 0.60 nan nan 3.80 0.60 S:422 TYR 3.53 0.22 3.56 0.22 3.51 0.22 3.81 0.00 3.47 0.21 S:423 LEU 4.29 0.40 4.25 0.38 4.33 0.41 nan nan 4.33 0.41 S:424 TYR 3.79 0.52 4.37 0.21 3.51 0.37 2.99 0.00 3.58 0.33 S:425 THR 3.41 0.36 3.64 0.30 3.11 0.14 2.94 0.00 3.20 0.09 S:426 VAL 3.81 0.45 4.10 0.40 3.43 0.11 nan nan 3.43 0.11 S:427 ASN 4.36 0.73 4.92 0.53 3.81 0.42 3.45 0.04 4.17 0.29 S:428 ILE 4.58 0.99 5.42 0.52 3.73 0.51 nan nan 3.73 0.51 S:429 LEU 4.36 0.78 4.99 0.55 3.73 0.36 nan nan 3.73 0.36 S:430 SER 3.97 0.41 4.23 0.17 3.46 0.18 3.63 0.00 3.28 0.00 S:431 ALA 5.37 0.25 5.36 0.27 5.43 0.00 nan nan 5.43 0.00 S:432 ALA 7.27 0.44 7.09 0.28 7.99 0.00 nan nan 7.99 0.00 S:433 ARG 4.20 0.96 5.23 0.69 3.61 0.47 3.23 0.13 3.89 0.44 S:434 MET 4.10 0.86 4.91 0.33 3.29 0.22 3.10 0.00 3.35 0.22 S:435 LEU 5.73 0.46 5.79 0.24 5.67 0.59 nan nan 5.67 0.59 S:436 LEU 5.78 0.98 6.59 0.22 4.98 0.76 nan nan 4.98 0.76 S:437 HIS 4.34 0.96 5.45 0.17 3.60 0.39 3.39 0.13 3.70 0.43 S:438 ARG 3.88 0.53 4.43 0.40 3.57 0.27 3.42 0.24 3.68 0.23 S:439 CYS 5.37 0.46 5.49 0.42 5.13 0.44 4.69 0.00 5.58 0.00 S:440 TYR 6.12 1.03 6.76 0.43 5.80 1.10 4.05 0.00 6.05 0.94 S:441 LYS 4.08 0.77 4.80 0.42 3.50 0.42 2.90 0.00 3.65 0.32 S:442 SER 4.03 0.55 4.38 0.28 3.34 0.13 3.47 0.00 3.20 0.00 S:443 ILE 7.34 0.90 6.74 0.70 7.94 0.64 nan nan 7.94 0.64 S:444 ALA 5.90 0.54 6.12 0.36 5.04 0.00 nan nan 5.04 0.00 S:445 ASN 4.04 0.71 4.68 0.36 3.40 0.20 3.20 0.04 3.59 0.00 S:446 LEU 5.35 0.92 6.02 0.64 4.67 0.60 nan nan 4.67 0.60 S:447 ILE 6.99 0.73 6.59 0.60 7.40 0.60 nan nan 7.40 0.60 S:448 GLU 3.74 0.62 4.22 0.65 3.35 0.14 3.20 0.12 3.44 0.03 S:449 ARG 3.98 0.79 4.86 0.46 3.48 0.39 3.19 0.23 3.70 0.34 S:450 ARG 4.77 0.72 5.38 0.59 4.43 0.54 4.60 0.46 4.29 0.56 S:451 GLN 3.82 0.33 4.06 0.37 3.63 0.09 3.55 0.05 3.68 0.06 S:452 PHE 3.73 0.60 4.46 0.28 3.31 0.20 nan nan 3.31 0.20 S:453 GLU 4.53 0.66 5.09 0.25 4.08 0.53 3.66 0.16 4.36 0.51 S:454 THR 4.06 0.69 4.50 0.59 3.47 0.21 3.18 0.00 3.62 0.02 S:455 LYS 3.69 0.44 4.08 0.26 3.37 0.26 3.08 0.00 3.44 0.24 S:456 GLU 3.61 0.49 3.91 0.54 3.37 0.26 3.06 0.01 3.58 0.03 S:457 ASN 4.29 0.42 4.52 0.26 4.06 0.43 3.70 0.02 4.43 0.32 S:458 LYS 3.86 0.64 4.54 0.16 3.32 0.25 3.02 0.00 3.40 0.22 S:459 ARG 3.41 0.41 3.89 0.24 3.14 0.13 3.03 0.12 3.21 0.09 S:460 LEU 4.43 0.65 4.76 0.73 4.11 0.31 nan nan 4.11 0.31 S:461 LEU 4.49 0.71 5.07 0.42 3.92 0.42 nan nan 3.92 0.42 S:462 GLU 4.11 0.70 4.75 0.34 3.59 0.45 3.19 0.03 3.86 0.39 S:463 LYS 4.02 0.57 4.56 0.34 3.59 0.28 3.36 0.00 3.64 0.28 S:464 SER 4.69 0.73 5.13 0.36 3.80 0.42 3.38 0.00 4.22 0.00 S:465 GLN 3.62 0.51 3.99 0.55 3.33 0.17 3.17 0.11 3.44 0.11 S:466 ARG 3.59 0.37 4.02 0.15 3.34 0.16 3.26 0.14 3.39 0.14 S:467 VAL 4.97 0.37 5.22 0.30 4.64 0.13 nan nan 4.64 0.13 S:468 GLU 3.69 0.55 4.17 0.44 3.30 0.21 3.06 0.04 3.47 0.08 S:469 ALA 3.63 0.31 3.76 0.19 3.11 0.00 nan nan 3.11 0.00 S:470 ILE 4.03 0.66 4.57 0.39 3.48 0.35 nan nan 3.48 0.35 S:471 ILE 4.24 0.70 4.59 0.72 3.90 0.48 nan nan 3.90 0.48 S:472 ALA 3.56 0.37 3.67 0.34 3.12 0.00 nan nan 3.12 0.00 S:473 SER 3.58 0.30 3.70 0.30 3.34 0.04 3.38 0.00 3.30 0.00 S:474 MET 3.57 0.47 3.53 0.50 3.61 0.43 3.45 0.00 3.66 0.48 S:483 GLN 3.44 0.36 3.70 0.34 3.23 0.21 3.04 0.07 3.36 0.17 S:484 LEU 4.00 0.63 4.55 0.32 3.45 0.31 nan nan 3.45 0.31 S:485 GLN 3.73 0.64 4.33 0.40 3.25 0.30 2.92 0.08 3.48 0.14 S:486 GLU 3.62 0.53 4.10 0.44 3.24 0.17 3.03 0.02 3.38 0.03 S:487 ILE 4.62 0.63 5.00 0.46 4.25 0.55 nan nan 4.25 0.55 S:488 GLU 4.22 0.89 5.06 0.43 3.54 0.50 3.06 0.03 3.87 0.39 S:489 GLU 3.67 0.47 4.07 0.40 3.35 0.19 3.20 0.13 3.45 0.16 S:490 MET 4.02 0.56 4.33 0.23 3.72 0.63 3.18 0.00 3.90 0.64 S:491 ILE 5.07 0.38 5.21 0.45 4.93 0.22 nan nan 4.93 0.22 S:492 THR 4.13 0.73 4.69 0.42 3.39 0.20 3.44 0.00 3.37 0.23 S:493 ALA 3.54 0.36 3.71 0.13 2.85 0.00 nan nan 2.85 0.00 S:494 PRO 3.62 0.33 3.88 0.13 3.28 0.16 nan nan 3.28 0.16 S:495 GLU 4.30 0.72 4.83 0.52 3.87 0.54 3.72 0.64 3.97 0.44 S:496 ARG 3.95 0.62 4.61 0.49 3.58 0.29 3.49 0.35 3.64 0.20 S:497 GLN 3.79 0.61 4.39 0.34 3.30 0.24 3.14 0.19 3.41 0.21 S:498 GLN 4.37 1.01 5.41 0.50 3.54 0.26 3.28 0.18 3.72 0.14 S:499 LEU 4.26 0.60 4.56 0.72 3.96 0.17 nan nan 3.96 0.17 S:500 GLU 4.10 0.79 4.89 0.30 3.47 0.40 3.07 0.03 3.73 0.30 S:501 THR 4.54 0.81 5.19 0.28 3.68 0.35 3.63 0.00 3.70 0.43 S:502 LEU 5.20 0.60 5.50 0.32 4.90 0.66 nan nan 4.90 0.66 S:503 LYS 3.78 0.64 4.44 0.24 3.25 0.27 2.88 0.00 3.34 0.22 S:504 ARG 3.71 0.52 4.28 0.28 3.38 0.28 3.25 0.18 3.48 0.30 S:505 ASN 4.60 0.95 5.40 0.24 3.79 0.68 3.25 0.06 4.33 0.57 S:506 VAL 4.85 0.88 5.55 0.26 3.91 0.41 nan nan 3.91 0.41 S:507 ASN 3.63 0.51 3.98 0.51 3.29 0.18 3.13 0.12 3.45 0.06 S:508 LYS 3.53 0.36 3.89 0.14 3.24 0.18 3.07 0.00 3.28 0.17 S:509 LEU 5.47 0.56 5.53 0.59 5.40 0.52 nan nan 5.40 0.52 S:510 ASP 4.17 0.77 4.86 0.42 3.48 0.25 3.34 0.29 3.62 0.07 S:511 ALA 3.80 0.41 3.99 0.18 3.04 0.00 nan nan 3.04 0.00 S:512 SER 4.50 0.81 4.99 0.45 3.52 0.34 3.18 0.00 3.86 0.00 S:513 GLU 6.04 1.09 6.99 0.44 5.29 0.83 4.63 0.71 5.72 0.58 S:514 ILE 4.66 0.96 5.57 0.29 3.75 0.33 nan nan 3.75 0.33 S:515 GLN 3.96 0.60 4.56 0.28 3.47 0.24 3.23 0.10 3.64 0.16 S:516 VAL 4.98 0.71 5.49 0.39 4.29 0.39 nan nan 4.29 0.39 S:517 ASP 7.93 0.71 7.28 0.32 8.59 0.21 8.54 0.25 8.64 0.14 S:518 GLU 4.17 0.80 4.85 0.60 3.62 0.44 3.17 0.13 3.93 0.28 S:519 THR 4.99 0.90 5.48 0.80 4.33 0.55 3.57 0.00 4.71 0.15 S:520 ILE 7.54 0.55 7.22 0.39 7.87 0.49 nan nan 7.87 0.49 S:521 PHE 6.07 0.57 6.58 0.38 5.78 0.44 nan nan 5.78 0.44 S:522 LEU 5.61 1.48 6.96 0.51 4.25 0.66 nan nan 4.25 0.66 S:523 LEU 7.26 0.70 6.85 0.75 7.68 0.27 nan nan 7.68 0.27 S:524 GLU 4.42 0.44 4.67 0.52 4.21 0.20 4.40 0.09 4.09 0.16 S:525 SER 4.99 0.22 5.05 0.21 4.89 0.19 4.70 0.00 5.08 0.00 S:526 TYR 6.41 0.98 6.65 0.21 6.29 1.18 4.44 0.00 6.56 1.01 S:527 ILE 4.85 0.67 5.08 0.55 4.62 0.71 nan nan 4.62 0.71 S:528 GLU 3.57 0.46 3.97 0.29 3.24 0.28 2.99 0.00 3.41 0.25 S:529 CYS 4.44 0.26 4.32 0.24 4.68 0.01 4.69 0.00 4.67 0.00 S:530 THR 4.16 0.66 4.10 0.63 4.24 0.70 5.01 0.00 3.85 0.54 S:531 MET 3.58 0.39 3.74 0.42 3.41 0.25 3.53 0.00 3.37 0.28 S:532 LYS 3.33 0.29 3.40 0.28 3.04 0.00 nan nan 3.04 0.00