# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom F:5 ALA 3.34 0.28 3.42 0.25 3.01 0.00 nan nan 3.01 0.00 F:6 SER 4.15 0.60 3.84 0.45 4.77 0.32 5.09 0.00 4.45 0.00 F:7 LYS 3.53 0.31 3.74 0.22 3.36 0.27 3.06 0.00 3.44 0.25 F:8 LEU 3.79 0.54 4.27 0.29 3.30 0.16 nan nan 3.30 0.16 F:9 PHE 6.36 0.57 6.17 0.43 6.47 0.61 nan nan 6.47 0.61 F:10 SER 4.21 0.71 4.55 0.61 3.51 0.24 3.28 0.00 3.75 0.00 F:11 ASN 3.46 0.40 3.70 0.38 3.22 0.24 3.00 0.05 3.45 0.12 F:12 LEU 4.66 0.74 4.22 0.47 5.10 0.70 nan nan 5.10 0.70 F:13 PHE 6.79 1.69 4.83 0.52 7.91 0.92 nan nan 7.91 0.92 F:14 GLY 3.89 0.30 3.89 0.30 nan nan nan nan nan nan F:15 ASN 3.45 0.30 3.70 0.15 3.19 0.15 3.07 0.09 3.32 0.10 F:16 LYS 3.95 0.74 4.55 0.70 3.46 0.24 3.18 0.00 3.53 0.22 F:17 GLU 4.47 1.02 5.43 0.51 3.70 0.56 3.11 0.05 4.10 0.37 F:18 MET 6.79 0.45 6.95 0.30 6.62 0.51 6.16 0.00 6.77 0.50 F:19 ARG 5.30 1.34 6.95 0.52 4.36 0.50 4.12 0.14 4.55 0.58 F:20 ILE 8.76 1.24 7.63 0.56 9.89 0.49 nan nan 9.89 0.49 F:21 LEU 9.16 1.00 9.60 1.17 8.71 0.49 nan nan 8.71 0.49 F:22 MET 10.07 0.62 9.98 0.66 10.16 0.56 10.17 0.00 10.16 0.64 F:23 VAL 9.78 0.46 9.70 0.38 9.89 0.52 nan nan 9.89 0.52 F:24 GLY 8.03 0.83 8.03 0.83 nan nan nan nan nan nan F:25 LEU 6.50 0.59 6.40 0.77 6.60 0.28 nan nan 6.60 0.28 F:26 ASP 3.88 0.57 4.33 0.45 3.43 0.23 3.33 0.29 3.53 0.04 F:27 GLY 3.63 0.28 3.63 0.28 nan nan nan nan nan nan F:28 ALA 5.31 0.55 5.08 0.32 6.26 0.00 nan nan 6.26 0.00 F:29 GLY 4.56 0.50 4.56 0.50 nan nan nan nan nan nan F:30 LYS 5.57 0.58 5.57 0.58 5.57 0.57 4.84 0.03 5.75 0.50 F:31 THR 4.09 0.50 4.51 0.07 3.53 0.11 3.54 0.00 3.52 0.14 F:32 THR 3.92 0.55 4.30 0.34 3.42 0.32 3.00 0.00 3.63 0.13 F:33 VAL 7.49 0.97 6.78 0.50 8.45 0.50 nan nan 8.45 0.50 F:34 LEU 7.46 1.11 6.59 0.58 8.33 0.77 nan nan 8.33 0.77 F:35 TYR 3.76 0.59 4.36 0.64 3.47 0.23 3.08 0.00 3.52 0.19 F:36 LYS 4.59 0.62 4.88 0.27 4.37 0.72 3.30 0.15 4.63 0.53 F:37 LEU 6.98 1.30 5.83 0.21 8.12 0.86 nan nan 8.12 0.86 F:38 LYS 3.76 0.50 4.21 0.32 3.41 0.29 2.98 0.00 3.52 0.22 F:39 LEU 5.41 1.35 4.22 0.41 6.60 0.78 nan nan 6.60 0.78 F:40 GLY 3.49 0.11 3.49 0.11 nan nan nan nan nan nan F:41 GLU 3.59 0.48 3.95 0.47 3.30 0.22 3.04 0.05 3.48 0.04 F:42 VAL 4.61 0.58 4.26 0.46 5.08 0.32 nan nan 5.08 0.32 F:43 ILE 4.25 0.84 5.02 0.42 3.48 0.27 nan nan 3.48 0.27 F:44 THR 3.78 0.48 4.06 0.45 3.41 0.15 3.21 0.00 3.51 0.06 F:45 THR 4.35 0.66 4.71 0.56 3.87 0.45 3.81 0.56 3.91 0.38 F:46 ILE 3.71 0.41 3.85 0.44 3.58 0.33 nan nan 3.58 0.33 F:47 PRO 3.98 0.56 3.78 0.44 4.26 0.58 nan nan 4.26 0.58 F:48 THR 4.12 0.50 4.44 0.36 3.68 0.30 3.57 0.22 3.74 0.31 F:49 ILE 3.46 0.35 3.74 0.24 3.19 0.18 nan nan 3.19 0.18 F:50 GLY 3.42 0.23 3.42 0.23 nan nan nan nan nan nan F:51 PHE 4.89 0.69 4.96 0.72 4.86 0.68 nan nan 4.86 0.68 F:52 ASN 4.14 0.57 4.66 0.21 3.63 0.29 3.51 0.37 3.75 0.04 F:53 VAL 6.03 0.30 6.04 0.17 6.03 0.42 nan nan 6.03 0.42 F:54 GLU 5.39 1.18 6.56 0.30 4.46 0.68 4.03 0.31 4.74 0.70 F:55 THR 4.90 0.87 5.61 0.30 3.94 0.22 3.81 0.12 4.01 0.22 F:56 VAL 6.01 0.54 5.58 0.18 6.59 0.20 nan nan 6.59 0.20 F:57 GLN 3.74 0.50 4.18 0.44 3.38 0.10 3.37 0.11 3.39 0.10 F:58 TYR 4.66 0.71 4.94 0.43 4.52 0.78 3.77 0.00 4.62 0.77 F:59 LYS 3.60 0.22 3.66 0.18 3.55 0.24 3.41 0.00 3.59 0.25 F:60 ASN 4.28 0.77 4.93 0.32 3.63 0.48 3.31 0.32 3.96 0.39 F:61 ILE 7.22 1.02 6.32 0.31 8.12 0.61 nan nan 8.12 0.61 F:62 SER 5.45 1.01 6.12 0.39 4.11 0.28 3.92 0.29 4.30 0.01 F:63 PHE 8.98 2.18 6.39 0.42 10.46 1.14 nan nan 10.46 1.14 F:64 THR 5.89 1.22 6.81 0.69 4.67 0.50 3.96 0.00 5.03 0.03 F:65 VAL 7.50 0.72 7.30 0.59 7.76 0.78 nan nan 7.76 0.78 F:66 TRP 6.71 0.79 6.28 0.46 6.88 0.83 6.14 0.00 6.96 0.84 F:67 ASP 4.07 0.57 4.46 0.42 3.67 0.39 3.45 0.45 3.89 0.11 F:68 VAL 5.67 1.03 4.83 0.33 6.79 0.40 nan nan 6.79 0.40 F:69 GLY 4.43 0.33 4.43 0.33 nan nan nan nan nan nan F:70 GLY 4.20 0.06 4.20 0.06 nan nan nan nan nan nan F:71 GLN 3.38 0.36 3.70 0.31 3.13 0.13 3.01 0.04 3.21 0.10 F:72 ASP 4.03 0.45 3.92 0.21 4.15 0.57 4.05 0.79 4.24 0.11 F:73 ARG 3.53 0.41 4.01 0.23 3.26 0.18 3.08 0.08 3.40 0.10 F:74 ILE 4.29 0.61 4.20 0.46 4.38 0.72 nan nan 4.38 0.72 F:75 ARG 3.84 0.67 4.64 0.33 3.39 0.25 3.22 0.15 3.51 0.24 F:76 SER 3.59 0.39 3.86 0.07 3.04 0.05 2.99 0.00 3.10 0.00 F:77 LEU 3.86 0.70 4.32 0.69 3.40 0.27 nan nan 3.40 0.27 F:78 TRP 5.63 1.08 6.61 0.56 5.24 0.98 4.46 0.00 5.33 1.00 F:79 ARG 4.37 0.93 5.48 0.25 3.74 0.46 3.43 0.38 3.97 0.37 F:80 HIS 4.02 0.66 4.76 0.22 3.53 0.30 3.40 0.18 3.59 0.32 F:81 TYR 4.49 0.81 5.22 0.26 4.13 0.74 3.20 0.00 4.26 0.69 F:82 TYR 7.34 0.89 6.35 0.43 7.84 0.60 7.24 0.00 7.92 0.60 F:83 ARG 3.75 0.62 4.24 0.71 3.47 0.32 3.24 0.16 3.64 0.30 F:84 ASN 4.21 0.79 4.93 0.40 3.49 0.24 3.25 0.02 3.72 0.07 F:85 THR 6.77 0.64 6.37 0.37 7.31 0.52 6.78 0.00 7.58 0.44 F:86 GLU 7.08 0.61 7.52 0.22 6.73 0.58 6.30 0.57 7.01 0.39 F:87 GLY 9.97 0.72 9.97 0.72 nan nan nan nan nan nan F:88 VAL 11.94 0.69 12.11 0.45 11.73 0.88 nan nan 11.73 0.88 F:89 ILE 13.22 0.43 13.14 0.58 13.31 0.13 nan nan 13.31 0.13 F:90 PHE 12.27 0.79 12.85 0.37 11.94 0.78 nan nan 11.94 0.78 F:91 VAL 9.69 1.05 10.47 0.59 8.64 0.40 nan nan 8.64 0.40 F:92 ILE 10.26 1.07 9.54 0.97 10.99 0.53 nan nan 10.99 0.53 F:93 ASP 5.71 1.43 7.01 0.43 4.41 0.71 3.96 0.60 4.85 0.51 F:94 SER 7.52 0.56 7.26 0.42 8.05 0.43 8.47 0.00 7.62 0.00 F:95 ASN 4.21 0.82 4.60 0.91 3.81 0.45 3.50 0.35 4.13 0.28 F:96 ASP 4.33 0.72 4.90 0.51 3.75 0.35 3.50 0.25 4.00 0.25 F:97 ARG 3.59 0.36 3.96 0.25 3.38 0.21 3.27 0.07 3.46 0.24 F:98 SER 3.48 0.30 3.61 0.29 3.24 0.02 3.21 0.00 3.26 0.00 F:99 ARG 4.24 0.70 5.01 0.35 3.80 0.40 3.63 0.10 3.93 0.48 F:100 ILE 5.15 0.82 5.04 0.22 5.26 1.13 nan nan 5.26 1.13 F:101 GLY 3.67 0.16 3.67 0.16 nan nan nan nan nan nan F:102 GLU 4.11 0.79 4.73 0.80 3.60 0.22 3.40 0.12 3.74 0.17 F:103 ALA 7.33 0.68 7.11 0.58 8.22 0.00 nan nan 8.22 0.00 F:104 ARG 4.40 1.06 5.59 0.44 3.72 0.61 3.27 0.23 4.06 0.59 F:105 GLU 3.77 0.55 4.32 0.31 3.34 0.22 3.14 0.23 3.48 0.06 F:106 VAL 6.96 0.71 6.46 0.35 7.64 0.45 nan nan 7.64 0.45 F:107 MET 7.73 0.75 7.15 0.39 8.31 0.55 8.90 0.00 8.11 0.49 F:108 GLN 4.19 0.68 4.79 0.52 3.71 0.28 3.58 0.40 3.80 0.08 F:109 ARG 4.01 0.48 4.32 0.27 3.83 0.48 4.07 0.49 3.66 0.40 F:110 MET 7.40 1.21 6.40 0.39 8.40 0.87 9.04 0.00 8.19 0.91 F:111 LEU 4.84 0.72 4.82 0.98 4.86 0.28 nan nan 4.86 0.28 F:112 ASN 3.61 0.51 3.95 0.51 3.27 0.18 3.11 0.12 3.43 0.02 F:113 GLU 4.57 0.49 4.51 0.04 4.61 0.65 4.01 0.37 5.01 0.46 F:114 ASP 4.05 0.66 4.58 0.40 3.52 0.37 3.19 0.14 3.84 0.20 F:115 GLU 4.70 0.86 5.44 0.17 4.10 0.71 3.42 0.21 4.56 0.54 F:116 LEU 7.26 1.16 6.19 0.28 8.33 0.57 nan nan 8.33 0.57 F:117 ARG 3.93 0.61 4.61 0.33 3.54 0.32 3.39 0.35 3.65 0.24 F:118 ASN 4.23 0.73 4.93 0.20 3.53 0.22 3.34 0.10 3.72 0.11 F:119 ALA 7.20 0.65 7.03 0.63 7.84 0.00 nan nan 7.84 0.00 F:120 VAL 7.90 1.24 8.60 1.01 6.97 0.84 nan nan 6.97 0.84 F:121 TRP 9.03 0.49 8.59 0.56 9.20 0.33 9.51 0.00 9.17 0.33 F:122 LEU 10.00 0.92 10.45 0.84 9.56 0.75 nan nan 9.56 0.75 F:123 VAL 9.34 0.48 9.25 0.55 9.45 0.32 nan nan 9.45 0.32 F:124 PHE 10.72 0.47 10.35 0.28 10.94 0.42 nan nan 10.94 0.42 F:125 ALA 8.11 1.09 8.38 1.05 7.04 0.00 nan nan 7.04 0.00 F:126 ASN 7.00 0.99 7.67 0.75 6.34 0.72 5.89 0.62 6.78 0.50 F:127 LYS 4.64 1.05 5.72 0.29 3.78 0.48 3.20 0.00 3.92 0.44 F:128 GLN 4.16 0.66 4.11 0.75 4.20 0.57 4.28 0.80 4.14 0.34 F:129 ASP 3.63 0.37 3.65 0.34 3.61 0.40 3.71 0.49 3.52 0.25 F:130 LEU 4.26 0.54 4.57 0.15 3.95 0.62 nan nan 3.95 0.62 F:131 PRO 3.48 0.35 3.66 0.34 3.24 0.19 nan nan 3.24 0.19 F:132 GLU 3.52 0.30 3.74 0.23 3.34 0.22 3.27 0.27 3.39 0.15 F:133 ALA 4.75 0.58 4.58 0.52 5.45 0.00 nan nan 5.45 0.00 F:134 MET 5.30 0.68 4.75 0.34 5.85 0.46 5.50 0.00 5.96 0.47 F:135 SER 4.09 0.80 4.48 0.71 3.32 0.14 3.46 0.00 3.17 0.00 F:136 ALA 4.11 0.36 4.26 0.22 3.51 0.00 nan nan 3.51 0.00 F:137 ALA 3.51 0.31 3.65 0.16 2.97 0.00 nan nan 2.97 0.00 F:138 GLU 3.95 0.59 4.48 0.34 3.54 0.36 3.29 0.11 3.70 0.37 F:139 ILE 7.53 0.93 6.69 0.40 8.38 0.37 nan nan 8.38 0.37 F:140 THR 4.88 0.77 5.53 0.18 4.01 0.08 3.93 0.00 4.06 0.08 F:141 GLU 3.80 0.64 4.44 0.34 3.29 0.24 3.07 0.10 3.43 0.20 F:142 LYS 3.99 0.40 4.22 0.29 3.80 0.37 3.22 0.22 3.95 0.24 F:143 LEU 7.02 1.37 5.77 0.27 8.26 0.73 nan nan 8.26 0.73 F:144 GLY 4.55 0.29 4.55 0.29 nan nan nan nan nan nan F:145 LEU 6.38 0.83 5.68 0.32 7.09 0.54 nan nan 7.09 0.54 F:146 HIS 3.64 0.58 4.17 0.53 3.29 0.25 3.09 0.16 3.40 0.22 F:147 SER 3.69 0.47 3.94 0.36 3.18 0.17 3.01 0.00 3.35 0.00 F:148 ILE 4.42 0.51 4.07 0.29 4.77 0.44 nan nan 4.77 0.44 F:149 ARG 3.50 0.30 3.75 0.26 3.36 0.23 3.35 0.34 3.37 0.07 F:150 ASN 3.45 0.33 3.70 0.13 3.19 0.27 2.94 0.10 3.45 0.03 F:151 ARG 4.63 0.63 4.14 0.22 4.90 0.62 4.66 0.74 5.09 0.43 F:152 PRO 4.30 0.79 4.67 0.82 3.79 0.32 nan nan 3.79 0.32 F:153 TRP 4.27 0.69 4.57 0.60 4.15 0.69 3.37 0.00 4.24 0.67 F:154 PHE 4.52 0.99 5.44 0.67 3.99 0.73 nan nan 3.99 0.73 F:155 ILE 4.73 0.81 4.44 0.52 5.02 0.94 nan nan 5.02 0.94 F:156 GLN 4.75 0.87 5.32 0.50 4.30 0.83 3.50 0.16 4.83 0.65 F:157 SER 3.84 0.44 4.14 0.17 3.25 0.00 3.25 0.00 3.25 0.00 F:158 THR 5.79 1.09 4.93 0.07 6.94 0.69 7.90 0.00 6.46 0.17 F:159 CYS 4.99 0.74 5.45 0.42 4.08 0.23 3.85 0.00 4.31 0.00 F:160 ALA 5.65 0.36 5.65 0.40 5.67 0.00 nan nan 5.67 0.00 F:161 THR 3.65 0.56 3.98 0.51 3.22 0.19 3.18 0.00 3.24 0.24 F:162 SER 3.71 0.33 3.78 0.32 3.57 0.29 3.87 0.00 3.28 0.00 F:163 GLY 4.53 0.28 4.53 0.28 nan nan nan nan nan nan F:164 GLU 3.65 0.51 4.16 0.31 3.25 0.16 3.09 0.14 3.35 0.06 F:165 GLY 4.71 0.86 4.71 0.86 nan nan nan nan nan nan F:166 LEU 7.01 0.80 6.72 0.68 7.30 0.80 nan nan 7.30 0.80 F:167 TYR 4.44 1.07 5.87 0.19 3.72 0.39 3.09 0.00 3.81 0.33 F:168 GLU 3.98 0.64 4.55 0.48 3.52 0.28 3.51 0.39 3.53 0.17 F:169 GLY 6.13 0.44 6.13 0.44 nan nan nan nan nan nan F:170 LEU 8.93 1.45 7.62 0.42 10.23 0.77 nan nan 10.23 0.77 F:171 GLU 4.44 0.98 5.31 0.59 3.75 0.60 3.14 0.07 4.15 0.44 F:172 TRP 4.78 0.97 4.62 0.52 4.84 1.10 3.45 0.00 5.00 1.05 F:173 LEU 8.26 1.69 6.74 0.59 9.77 0.86 nan nan 9.77 0.86 F:174 SER 4.73 0.95 4.84 1.10 4.53 0.51 4.02 0.00 5.03 0.00 F:175 ASN 3.63 0.48 3.89 0.52 3.37 0.23 3.17 0.10 3.58 0.09 F:176 ASN 3.99 0.49 4.22 0.25 3.77 0.57 3.33 0.32 4.21 0.41 F:177 LEU 5.41 1.14 4.48 0.66 6.35 0.64 nan nan 6.35 0.64 F:178 LYS 3.82 0.56 4.37 0.34 3.39 0.18 3.09 0.00 3.46 0.12 F:179 ASN 3.86 0.48 3.83 0.38 3.88 0.56 4.02 0.73 3.75 0.24 F:180 GLN 3.87 0.58 4.38 0.10 3.47 0.48 3.05 0.00 3.75 0.43 F:181 SER 3.35 0.29 3.52 0.28 3.13 0.06 3.10 0.06 3.18 0.00