# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom E:21 SER 3.30 0.21 3.26 0.23 3.39 0.09 3.31 0.00 3.48 0.00 E:22 SER 3.52 0.30 3.69 0.19 3.17 0.10 3.07 0.00 3.27 0.00 E:23 SER 3.49 0.32 3.67 0.20 3.11 0.15 2.96 0.00 3.26 0.00 E:24 ASN 4.11 0.58 4.14 0.59 4.07 0.57 4.39 0.53 3.75 0.40 E:25 TYR 3.97 0.57 4.34 0.59 3.78 0.47 3.85 0.00 3.78 0.50 E:26 CYS 6.49 0.52 6.43 0.62 6.61 0.19 6.42 0.00 6.80 0.00 E:27 ASN 5.23 0.55 5.34 0.68 5.12 0.34 5.13 0.46 5.11 0.16 E:28 GLN 3.68 0.42 3.98 0.39 3.44 0.25 3.15 0.07 3.64 0.05 E:29 MET 4.51 0.91 5.17 0.64 3.85 0.62 3.18 0.00 4.08 0.56 E:30 MET 7.22 0.65 6.71 0.24 7.73 0.50 7.11 0.00 7.93 0.41 E:31 LYS 3.98 0.75 4.72 0.39 3.38 0.30 3.17 0.00 3.44 0.32 E:32 SER 3.56 0.36 3.74 0.29 3.18 0.12 3.06 0.00 3.30 0.00 E:33 ARG 3.62 0.50 3.94 0.52 3.43 0.38 3.12 0.13 3.66 0.34 E:34 ASN 3.78 0.53 4.22 0.35 3.34 0.21 3.25 0.27 3.43 0.01 E:35 LEU 4.67 0.64 5.08 0.22 4.26 0.65 nan nan 4.26 0.65 E:36 THR 6.55 0.71 6.16 0.61 7.07 0.46 6.47 0.00 7.37 0.22 E:37 LYS 3.76 0.69 4.22 0.76 3.39 0.29 2.93 0.00 3.50 0.20 E:38 ASP 3.64 0.44 3.87 0.44 3.41 0.30 3.41 0.39 3.42 0.17 E:39 ARG 3.86 0.77 4.69 0.63 3.39 0.28 3.28 0.27 3.47 0.25 E:40 CYS 4.12 0.39 4.03 0.41 4.29 0.27 4.56 0.00 4.02 0.00 E:41 LYS 4.63 0.98 5.53 0.32 3.91 0.69 3.03 0.00 4.13 0.60 E:42 PRO 3.90 0.53 4.33 0.18 3.34 0.21 nan nan 3.34 0.21 E:43 VAL 4.03 0.50 4.38 0.25 3.55 0.30 nan nan 3.55 0.30 E:44 ASN 4.49 0.51 4.66 0.39 4.31 0.55 3.91 0.40 4.71 0.35 E:45 THR 4.39 0.60 4.31 0.50 4.49 0.69 3.66 0.00 4.90 0.45 E:46 PHE 4.76 0.69 4.82 0.56 4.72 0.75 nan nan 4.72 0.75 E:47 VAL 4.26 0.52 3.99 0.44 4.62 0.37 nan nan 4.62 0.37 E:48 HIS 3.71 0.39 3.92 0.49 3.56 0.22 3.46 0.26 3.62 0.17 E:49 GLU 3.90 0.54 3.77 0.20 4.00 0.68 3.33 0.27 4.45 0.47 E:50 SER 3.86 0.41 4.00 0.41 3.60 0.23 3.83 0.00 3.37 0.00 E:51 LEU 3.67 0.54 4.06 0.49 3.28 0.17 nan nan 3.28 0.17 E:52 ALA 3.66 0.39 3.83 0.19 2.96 0.00 nan nan 2.96 0.00 E:53 ASP 4.03 0.63 4.60 0.20 3.47 0.32 3.19 0.04 3.75 0.21 E:54 VAL 5.04 0.80 5.72 0.21 4.14 0.08 nan nan 4.14 0.08 E:55 GLN 4.04 0.65 4.58 0.48 3.62 0.41 3.15 0.01 3.94 0.19 E:56 ALA 3.83 0.43 4.01 0.26 3.12 0.00 nan nan 3.12 0.00 E:57 VAL 6.50 0.79 5.98 0.43 7.19 0.61 nan nan 7.19 0.61 E:58 CYS 4.86 0.66 4.65 0.57 5.27 0.62 5.89 0.00 4.65 0.00 E:59 SER 3.56 0.40 3.77 0.35 3.15 0.04 3.19 0.00 3.12 0.00 E:60 GLN 4.23 0.57 4.28 0.54 4.19 0.58 3.89 0.46 4.39 0.57 E:61 LYS 3.98 0.85 4.83 0.43 3.30 0.32 2.92 0.00 3.40 0.29 E:62 ASN 3.73 0.43 3.80 0.34 3.66 0.50 3.80 0.64 3.51 0.20 E:63 VAL 4.10 0.52 4.36 0.44 3.75 0.41 nan nan 3.75 0.41 E:64 ALA 3.67 0.41 3.82 0.31 3.08 0.00 nan nan 3.08 0.00 E:65 CYS 4.92 0.75 4.50 0.55 5.75 0.10 5.85 0.00 5.66 0.00 E:66 LYS 3.46 0.31 3.60 0.40 3.35 0.15 3.10 0.00 3.41 0.10 E:67 ASN 3.53 0.38 3.53 0.33 3.54 0.43 3.70 0.51 3.37 0.24 E:68 GLY 3.40 0.31 3.40 0.31 nan nan nan nan nan nan E:69 GLN 3.75 0.55 4.20 0.45 3.39 0.30 3.13 0.11 3.56 0.27 E:70 THR 3.66 0.39 3.92 0.20 3.32 0.30 3.06 0.00 3.45 0.29 E:71 ASN 4.25 0.73 4.71 0.76 3.80 0.27 4.00 0.05 3.60 0.25 E:72 CYS 6.56 0.45 6.69 0.46 6.30 0.26 6.03 0.00 6.56 0.00 E:73 TYR 5.82 1.48 7.42 0.17 5.03 1.17 3.25 0.00 5.28 1.03 E:74 GLN 4.73 1.10 5.81 0.37 3.87 0.63 3.24 0.04 4.29 0.46 E:75 SER 5.86 0.84 5.47 0.75 6.64 0.22 6.87 0.00 6.42 0.00 E:76 TYR 3.58 0.40 3.89 0.55 3.43 0.15 3.21 0.00 3.46 0.13 E:77 SER 3.92 0.71 4.29 0.60 3.19 0.09 3.28 0.00 3.11 0.00 E:78 THR 3.71 0.45 3.93 0.42 3.43 0.32 3.15 0.00 3.58 0.31 E:79 MET 5.25 0.45 5.21 0.41 5.29 0.48 5.77 0.00 5.14 0.45 E:80 SER 4.63 0.97 5.21 0.60 3.45 0.15 3.30 0.00 3.60 0.00 E:81 ILE 6.59 0.75 6.39 0.36 6.80 0.96 nan nan 6.80 0.96 E:82 THR 5.51 1.02 6.32 0.40 4.43 0.40 3.89 0.00 4.69 0.15 E:83 ASP 4.58 0.92 5.45 0.18 3.71 0.36 3.61 0.47 3.80 0.13 E:84 CYS 6.60 0.76 6.09 0.30 7.61 0.08 7.53 0.00 7.69 0.00 E:85 ARG 4.05 0.90 5.17 0.22 3.41 0.33 3.18 0.13 3.58 0.33 E:86 GLU 4.05 0.57 4.23 0.63 3.90 0.48 3.47 0.17 4.19 0.39 E:87 THR 3.71 0.43 3.96 0.37 3.38 0.24 3.72 0.00 3.21 0.01 E:88 GLY 3.19 0.20 3.19 0.20 nan nan nan nan nan nan E:89 SER 3.47 0.27 3.60 0.22 3.20 0.04 3.16 0.00 3.24 0.00 E:90 SER 4.52 0.70 4.15 0.55 5.27 0.12 5.38 0.00 5.15 0.00 E:91 LYS 3.62 0.49 4.12 0.21 3.21 0.19 2.92 0.00 3.29 0.13 E:92 TYR 3.71 0.46 3.82 0.31 3.65 0.52 3.08 0.00 3.73 0.50 E:93 PRO 3.76 0.49 4.15 0.26 3.24 0.04 nan nan 3.24 0.04 E:94 ASN 3.89 0.66 4.48 0.33 3.30 0.26 3.04 0.01 3.56 0.08 E:95 CYS 5.44 0.63 5.07 0.40 6.20 0.16 6.03 0.00 6.36 0.00 E:96 ALA 4.57 0.74 4.90 0.40 3.28 0.00 nan nan 3.28 0.00 E:97 TYR 6.45 1.49 4.47 0.61 7.44 0.46 7.20 0.00 7.48 0.48 E:98 LYS 3.88 0.75 4.61 0.49 3.30 0.25 3.18 0.00 3.33 0.27 E:99 THR 3.91 0.40 4.00 0.42 3.78 0.32 4.16 0.00 3.59 0.20 E:100 THR 4.13 0.58 4.58 0.27 3.52 0.16 3.57 0.00 3.50 0.19 E:101 GLN 3.63 0.30 3.81 0.37 3.49 0.11 3.53 0.07 3.47 0.12 E:102 ALA 4.20 0.62 4.43 0.46 3.27 0.00 nan nan 3.27 0.00 E:103 ASN 3.65 0.38 3.83 0.42 3.47 0.22 3.30 0.18 3.65 0.07 E:104 LYS 4.69 0.97 5.43 0.76 4.11 0.67 3.08 0.00 4.36 0.48 E:105 HIS 4.95 1.29 6.29 0.59 4.06 0.74 3.73 0.53 4.23 0.77 E:106 ILE 7.76 0.44 7.55 0.26 7.96 0.48 nan nan 7.96 0.48 E:107 ILE 5.46 1.06 6.48 0.24 4.44 0.31 nan nan 4.44 0.31 E:108 VAL 7.27 0.60 7.58 0.30 6.84 0.65 nan nan 6.84 0.65 E:109 ALA 5.98 0.65 6.30 0.13 4.70 0.00 nan nan 4.70 0.00 E:110 CYS 6.01 0.98 5.57 0.89 6.88 0.36 7.24 0.00 6.52 0.00 E:111 GLU 3.83 0.54 4.26 0.48 3.48 0.28 3.15 0.08 3.70 0.06 E:112 GLY 3.42 0.18 3.42 0.18 nan nan nan nan nan nan E:113 ASN 3.42 0.33 3.60 0.35 3.23 0.17 3.06 0.05 3.39 0.07 E:114 PRO 3.59 0.40 3.92 0.19 3.16 0.05 nan nan 3.16 0.05 E:115 TYR 3.68 0.35 4.04 0.34 3.50 0.17 3.20 0.00 3.54 0.13 E:116 VAL 4.51 0.74 5.12 0.08 3.68 0.26 nan nan 3.68 0.26 E:117 PRO 4.28 0.44 4.25 0.56 4.33 0.16 nan nan 4.33 0.16 E:118 VAL 3.72 0.45 3.70 0.44 3.76 0.46 nan nan 3.76 0.46 E:119 HIS 3.78 0.61 4.40 0.41 3.36 0.27 3.16 0.07 3.46 0.27 E:120 PHE 3.83 0.47 3.83 0.42 3.84 0.49 nan nan 3.84 0.49 E:121 ASP 4.20 0.47 4.13 0.41 4.26 0.51 3.89 0.44 4.64 0.22 E:122 ALA 4.09 0.58 4.30 0.46 3.26 0.00 nan nan 3.26 0.00 E:123 SER 4.16 0.42 4.01 0.44 4.45 0.05 4.41 0.00 4.50 0.00 E:124 VAL 3.71 0.50 3.91 0.54 3.51 0.36 3.84 0.00 3.40 0.35 S:1 LYS 3.26 0.19 3.26 0.23 3.25 0.15 3.09 0.00 3.29 0.14 S:2 GLU 3.66 0.18 3.60 0.20 3.71 0.15 3.59 0.07 3.79 0.13 S:3 THR 3.65 0.37 3.88 0.29 3.33 0.18 3.47 0.00 3.26 0.18 S:4 ALA 3.39 0.26 3.49 0.18 2.98 0.00 nan nan 2.98 0.00 S:5 ALA 3.52 0.29 3.64 0.18 3.05 0.00 nan nan 3.05 0.00 S:6 ALA 4.13 0.46 4.35 0.19 3.27 0.00 nan nan 3.27 0.00 S:7 LYS 3.97 0.63 4.48 0.45 3.56 0.43 3.01 0.00 3.70 0.37 S:9 GLU 3.50 0.26 3.65 0.16 3.37 0.25 3.10 0.15 3.55 0.03 S:10 ARG 3.40 0.30 3.64 0.32 3.26 0.18 3.20 0.17 3.30 0.18 S:11 GLN 3.70 0.44 3.87 0.50 3.57 0.32 3.20 0.16 3.81 0.10 S:12 HIS 3.45 0.35 3.61 0.46 3.35 0.20 3.23 0.02 3.41 0.22 S:14 ASP 3.27 0.20 3.35 0.20 3.20 0.17 3.07 0.10 3.33 0.11 S:15 SER 3.24 0.21 3.34 0.21 3.11 0.09 3.05 0.06 3.21 0.00