# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom A:51 GLY 3.10 0.16 3.10 0.16 nan nan nan nan nan nan A:52 GLY 3.12 0.06 3.12 0.06 nan nan nan nan nan nan A:58 GLY 3.08 0.12 3.08 0.12 nan nan nan nan nan nan A:81 GLY 3.03 0.04 3.03 0.04 nan nan nan nan nan nan A:85 GLY 2.97 0.06 2.97 0.06 nan nan nan nan nan nan B:51 GLY 3.13 0.16 3.13 0.16 nan nan nan nan nan nan B:52 GLY 3.12 0.08 3.12 0.08 nan nan nan nan nan nan B:58 GLY 2.95 0.09 2.95 0.09 nan nan nan nan nan nan B:81 GLY 3.00 0.05 3.00 0.05 nan nan nan nan nan nan B:85 GLY 3.05 0.05 3.05 0.05 nan nan nan nan nan nan C:1 THR 3.71 0.45 3.97 0.41 3.35 0.17 3.11 0.00 3.47 0.03 C:2 TYR 5.48 0.78 5.43 0.09 5.51 0.96 3.74 0.00 5.76 0.73 C:3 LYS 5.05 1.25 6.22 0.64 4.12 0.73 3.05 0.00 4.38 0.55 C:4 LEU 7.69 0.72 7.10 0.46 8.28 0.34 nan nan 8.28 0.34 C:5 ILE 4.64 1.08 5.66 0.40 3.62 0.28 nan nan 3.62 0.28 C:6 LEU 5.52 0.63 5.21 0.56 5.82 0.55 nan nan 5.82 0.55 C:7 ASN 4.16 0.73 4.81 0.27 3.52 0.40 3.18 0.08 3.85 0.30 C:8 GLY 4.75 0.58 4.75 0.58 nan nan nan nan nan nan C:9 LYS 3.44 0.39 3.73 0.39 3.20 0.14 2.97 0.00 3.26 0.10 C:10 THR 3.59 0.42 3.88 0.33 3.21 0.10 3.18 0.00 3.22 0.12 C:11 LEU 4.26 0.71 4.75 0.61 3.77 0.38 nan nan 3.77 0.38 C:12 LYS 3.55 0.41 3.76 0.42 3.39 0.31 2.94 0.00 3.50 0.24 C:13 GLY 3.53 0.22 3.53 0.22 nan nan nan nan nan nan C:14 GLU 3.61 0.48 3.79 0.49 3.47 0.43 3.11 0.01 3.72 0.40 C:15 THR 4.32 0.62 4.50 0.50 4.08 0.68 3.26 0.00 4.49 0.43 C:16 THR 3.86 0.54 4.19 0.43 3.42 0.33 3.11 0.00 3.57 0.30 C:17 THR 4.57 0.66 4.68 0.45 4.42 0.84 3.51 0.00 4.87 0.66 C:18 GLU 3.44 0.26 3.65 0.24 3.28 0.13 3.25 0.14 3.30 0.11 C:19 ALA 4.07 0.26 4.09 0.29 3.98 0.00 nan nan 3.98 0.00 C:20 VAL 3.68 0.40 3.95 0.27 3.32 0.20 nan nan 3.32 0.20 C:21 ASP 4.41 0.94 5.13 0.70 3.70 0.52 3.77 0.70 3.62 0.19 C:22 VAL 4.25 0.68 4.82 0.14 3.49 0.23 nan nan 3.49 0.23 C:23 PHE 3.63 0.55 4.25 0.43 3.27 0.15 nan nan 3.27 0.15 C:24 ASP 3.95 0.63 4.51 0.17 3.38 0.34 3.09 0.02 3.68 0.23 C:25 ALA 6.50 0.52 6.31 0.40 7.25 0.00 nan nan 7.25 0.00 C:26 PHE 4.33 0.99 5.61 0.25 3.61 0.24 nan nan 3.61 0.24 C:27 ASP 4.11 0.69 4.73 0.21 3.49 0.35 3.16 0.03 3.81 0.19 C:28 VAL 3.85 0.49 4.18 0.27 3.42 0.36 nan nan 3.42 0.36 C:29 PHE 6.67 0.79 6.25 0.49 6.92 0.82 nan nan 6.92 0.82 C:30 PHE 4.61 1.18 5.97 0.46 3.84 0.64 nan nan 3.84 0.64 C:31 VAL 4.03 0.70 4.55 0.42 3.33 0.27 nan nan 3.33 0.27 C:32 TYR 4.33 0.75 4.94 0.47 4.02 0.68 3.01 0.00 4.16 0.60 C:33 ALA 6.79 0.62 6.55 0.45 7.74 0.00 nan nan 7.74 0.00 C:34 ALA 4.04 0.71 4.20 0.71 3.40 0.00 nan nan 3.40 0.00 C:35 SER 3.51 0.36 3.71 0.41 3.31 0.12 3.25 0.15 3.36 0.00 C:36 ASN 3.97 0.47 4.02 0.44 3.93 0.48 3.62 0.42 4.25 0.29 C:37 PHE 5.32 0.97 4.40 0.22 5.85 0.83 nan nan 5.85 0.83 C:38 SER 3.44 0.31 3.60 0.26 3.11 0.02 3.13 0.00 3.09 0.00 C:39 ASP 4.19 0.72 4.72 0.48 3.67 0.50 3.24 0.09 4.09 0.37 C:40 PHE 3.97 0.46 3.93 0.42 3.99 0.48 nan nan 3.99 0.48 C:41 ASP 3.69 0.52 4.01 0.46 3.38 0.35 3.07 0.13 3.68 0.20 C:42 ASP 3.94 0.56 4.40 0.26 3.48 0.38 3.14 0.12 3.82 0.22 C:43 TRP 4.40 0.83 3.84 0.36 4.62 0.86 4.11 0.00 4.68 0.89 C:44 THR 3.86 0.57 4.30 0.34 3.29 0.13 3.33 0.00 3.26 0.16 C:45 TYR 4.09 0.71 3.66 0.42 4.30 0.73 4.37 0.00 4.29 0.78 C:46 ASP 3.97 0.81 4.61 0.69 3.34 0.15 3.25 0.17 3.43 0.00 C:47 ASP 3.68 0.49 4.08 0.31 3.27 0.21 3.07 0.08 3.47 0.03 C:48 ALA 3.51 0.40 3.62 0.38 3.07 0.00 nan nan 3.07 0.00 C:49 THR 3.67 0.37 3.87 0.29 3.40 0.29 3.75 0.00 3.23 0.20 C:50 LYS 4.47 0.81 5.26 0.37 3.83 0.41 3.39 0.00 3.94 0.38 C:51 THR 4.67 0.71 5.24 0.33 3.92 0.15 3.78 0.00 3.98 0.13 C:52 PHE 5.71 0.80 5.87 0.26 5.62 0.97 nan nan 5.62 0.97 C:53 THR 4.77 0.94 5.56 0.24 3.72 0.25 3.42 0.00 3.88 0.16 C:54 VAL 7.03 0.68 6.67 0.18 7.52 0.80 nan nan 7.52 0.80 C:55 THR 4.92 1.06 5.80 0.25 3.74 0.32 3.66 0.00 3.78 0.39 C:56 GLU 4.41 0.83 4.59 0.82 4.28 0.81 3.67 0.30 4.90 0.70 D:8 GLY 3.02 0.06 3.02 0.06 nan nan nan nan nan nan D:13 GLY 1.73 2.23 1.73 2.23 nan nan nan nan nan nan E:6 GLU 3.25 0.20 3.31 0.22 3.21 0.18 3.02 0.04 3.33 0.11 E:7 VAL 3.56 0.34 3.80 0.13 3.25 0.26 nan nan 3.25 0.26 E:8 VAL 3.65 0.36 3.77 0.33 3.49 0.33 nan nan 3.49 0.33 E:9 LYS 3.62 0.53 4.15 0.30 3.19 0.16 3.05 0.00 3.23 0.16 E:10 PHE 3.54 0.50 4.00 0.56 3.29 0.17 nan nan 3.29 0.17 E:11 MET 3.67 0.52 4.14 0.30 3.20 0.12 3.38 0.00 3.14 0.06 E:12 ASP 3.88 0.64 4.40 0.52 3.37 0.11 3.26 0.03 3.47 0.00 E:13 VAL 4.18 0.68 4.69 0.36 3.51 0.32 nan nan 3.51 0.32 E:14 TYR 4.07 0.65 4.80 0.31 3.71 0.43 3.10 0.00 3.80 0.39 E:15 GLN 3.70 0.59 4.07 0.67 3.41 0.24 3.15 0.04 3.58 0.15 E:16 ARG 3.45 0.33 3.74 0.31 3.28 0.21 3.25 0.21 3.31 0.21 E:17 SER 3.84 0.33 4.00 0.27 3.53 0.20 3.73 0.00 3.33 0.00 E:18 TYR 4.07 0.59 4.75 0.25 3.73 0.38 3.17 0.00 3.81 0.34 E:19 CYS 4.95 0.68 4.74 0.75 5.38 0.01 5.39 0.00 5.37 0.00 E:20 HIS 4.14 0.76 4.92 0.57 3.62 0.27 3.75 0.35 3.55 0.19 E:21 PRO 3.91 0.46 4.18 0.44 3.56 0.12 nan nan 3.56 0.12 E:22 ILE 4.20 0.76 4.82 0.38 3.57 0.47 nan nan 3.57 0.47 E:23 GLU 3.61 0.41 3.84 0.38 3.42 0.33 3.06 0.03 3.66 0.18 E:24 THR 4.30 0.68 4.74 0.53 3.72 0.33 3.75 0.00 3.71 0.40 E:25 LEU 3.71 0.43 3.95 0.41 3.47 0.28 nan nan 3.47 0.28 E:26 VAL 4.89 0.36 5.01 0.40 4.74 0.23 nan nan 4.74 0.23 E:27 ASP 4.17 0.83 4.89 0.57 3.45 0.17 3.41 0.23 3.50 0.07 E:28 ILE 6.91 0.48 6.51 0.33 7.32 0.17 nan nan 7.32 0.17 E:29 PHE 4.10 0.65 4.56 0.47 3.84 0.59 nan nan 3.84 0.59 E:30 GLN 3.52 0.32 3.75 0.28 3.34 0.21 3.17 0.16 3.44 0.17 E:31 GLU 4.10 0.59 4.14 0.52 4.07 0.64 3.42 0.11 4.50 0.47 E:32 TYR 4.12 0.64 4.83 0.27 3.76 0.44 3.34 0.00 3.82 0.44 E:33 PRO 3.77 0.44 4.00 0.40 3.46 0.27 nan nan 3.46 0.27 E:34 ASP 3.54 0.43 3.88 0.35 3.20 0.15 3.07 0.08 3.33 0.06 E:35 GLU 4.47 0.73 5.03 0.42 4.01 0.61 3.51 0.25 4.35 0.54 E:36 ILE 3.62 0.56 4.06 0.47 3.19 0.17 nan nan 3.19 0.17 E:37 GLU 3.61 0.31 3.89 0.18 3.38 0.17 3.21 0.00 3.50 0.11 E:38 TYR 4.54 0.80 4.85 0.27 4.38 0.93 3.06 0.00 4.57 0.83 E:39 ILE 4.54 1.05 5.47 0.54 3.60 0.43 nan nan 3.60 0.43 E:40 PHE 6.08 1.03 4.86 0.59 6.78 0.35 nan nan 6.78 0.35 E:41 LYS 3.80 0.64 4.38 0.50 3.34 0.23 3.02 0.00 3.42 0.18 E:42 PRO 3.88 0.71 4.31 0.67 3.31 0.08 nan nan 3.31 0.08 E:43 SER 4.08 0.73 4.53 0.43 3.18 0.14 3.04 0.00 3.32 0.00 E:44 CYS 4.01 0.51 4.26 0.39 3.51 0.34 3.17 0.00 3.85 0.00 E:45 VAL 5.15 0.62 4.99 0.45 5.38 0.73 nan nan 5.38 0.73 E:46 PRO 3.95 0.60 4.44 0.23 3.30 0.19 nan nan 3.30 0.19 E:47 LEU 6.19 0.67 5.58 0.29 6.80 0.28 nan nan 6.80 0.28 E:48 MET 4.57 1.17 5.64 0.58 3.49 0.34 3.38 0.00 3.53 0.38 E:49 ARG 4.61 0.70 5.36 0.43 4.19 0.41 4.09 0.58 4.27 0.16 E:50 CYS 4.56 0.82 4.20 0.71 5.27 0.51 5.78 0.00 4.76 0.00 E:51 GLY 4.21 0.51 4.21 0.51 nan nan nan nan nan nan E:52 GLY 3.47 0.18 3.47 0.18 nan nan nan nan nan nan E:53 CYS 4.28 0.85 4.71 0.73 3.42 0.06 3.36 0.00 3.48 0.00 E:54 CYS 4.72 0.53 4.46 0.45 5.24 0.19 5.43 0.00 5.05 0.00 E:55 ASN 3.57 0.30 3.54 0.32 3.61 0.28 3.61 0.38 3.61 0.08 E:56 ASP 3.69 0.45 4.00 0.30 3.39 0.35 3.08 0.00 3.71 0.24 E:57 GLU 3.41 0.31 3.72 0.16 3.17 0.16 2.98 0.03 3.30 0.02 E:58 GLY 3.66 0.20 3.66 0.20 nan nan nan nan nan nan E:59 LEU 4.22 0.71 4.62 0.45 3.81 0.70 nan nan 3.81 0.70 E:60 GLU 4.13 0.78 4.84 0.53 3.56 0.38 3.18 0.10 3.81 0.27 E:61 CYS 4.39 0.63 4.09 0.45 4.98 0.51 5.49 0.00 4.47 0.00 E:62 VAL 4.63 0.80 5.16 0.54 3.92 0.48 nan nan 3.92 0.48 E:63 PRO 4.12 0.49 4.28 0.48 3.91 0.42 nan nan 3.91 0.42 E:64 THR 3.74 0.42 3.79 0.55 3.68 0.11 3.60 0.00 3.72 0.11 E:65 GLU 3.86 0.65 4.43 0.48 3.41 0.35 3.07 0.10 3.63 0.28 E:66 GLU 3.56 0.38 3.74 0.37 3.42 0.32 3.10 0.11 3.64 0.22 E:67 SER 4.03 0.52 4.27 0.47 3.55 0.12 3.66 0.00 3.43 0.00 E:68 ASN 3.52 0.33 3.65 0.36 3.39 0.24 3.26 0.25 3.53 0.12 E:69 ILE 4.27 0.69 4.49 0.41 4.05 0.82 nan nan 4.05 0.82 E:70 THR 3.72 0.44 3.95 0.40 3.41 0.28 3.01 0.00 3.60 0.00 E:71 MET 4.14 0.52 4.55 0.44 3.74 0.16 3.75 0.00 3.73 0.19 E:72 GLN 3.62 0.41 3.86 0.42 3.42 0.29 3.08 0.01 3.65 0.10 E:73 ILE 5.29 0.59 5.18 0.38 5.39 0.73 nan nan 5.39 0.73 E:74 MET 4.70 1.15 5.58 0.79 3.81 0.65 3.35 0.00 3.96 0.69 E:75 ARG 4.35 0.89 5.35 0.54 3.78 0.43 3.51 0.15 3.98 0.47 E:76 ILE 4.68 0.85 5.47 0.16 3.90 0.41 nan nan 3.90 0.41 E:77 LYS 4.05 0.56 4.64 0.12 3.57 0.19 3.43 0.00 3.60 0.20 E:78 PRO 3.65 0.32 3.83 0.26 3.40 0.22 nan nan 3.40 0.22 E:79 HIS 3.32 0.21 3.47 0.23 3.22 0.11 3.22 0.08 3.23 0.12 E:80 GLN 3.38 0.29 3.49 0.28 3.29 0.26 3.06 0.05 3.45 0.23 E:81 GLY 3.73 0.26 3.73 0.26 nan nan nan nan nan nan E:82 GLN 3.65 0.46 3.86 0.34 3.48 0.47 3.03 0.04 3.78 0.38 E:83 HIS 3.77 0.62 4.45 0.41 3.32 0.17 3.23 0.07 3.37 0.19 E:84 ILE 3.71 0.44 4.05 0.35 3.37 0.19 nan nan 3.37 0.19 E:85 GLY 4.54 0.48 4.54 0.48 nan nan nan nan nan nan E:86 GLU 3.48 0.39 3.72 0.42 3.29 0.23 3.03 0.05 3.46 0.10 E:87 MET 4.30 0.40 4.25 0.43 4.35 0.35 4.93 0.00 4.15 0.11 E:88 SER 3.94 0.43 4.24 0.32 3.56 0.19 3.42 0.17 3.71 0.01 E:89 PHE 6.18 0.68 5.29 0.12 6.68 0.13 nan nan 6.68 0.13 E:90 LEU 4.45 0.92 5.23 0.64 3.67 0.29 nan nan 3.67 0.29 E:91 GLN 5.42 1.10 6.47 0.15 4.57 0.76 3.80 0.21 5.09 0.51 E:92 HIS 5.15 1.02 5.55 0.89 4.88 1.00 4.22 0.32 5.21 1.06 E:93 ASN 3.83 0.51 4.04 0.61 3.62 0.26 3.57 0.35 3.67 0.08 E:94 LYS 4.22 0.97 5.15 0.56 3.47 0.42 3.18 0.00 3.54 0.44 E:95 CYS 5.09 0.63 4.77 0.52 5.74 0.17 5.91 0.00 5.57 0.00 E:96 GLU 4.08 0.84 4.83 0.57 3.47 0.44 3.02 0.03 3.78 0.32 E:97 CYS 4.01 0.40 3.93 0.41 4.19 0.35 4.53 0.00 3.84 0.00 E:98 ARG 4.00 0.79 4.91 0.40 3.48 0.38 3.18 0.17 3.70 0.35 E:99 PRO 3.58 0.44 3.88 0.34 3.17 0.06 nan nan 3.17 0.06 E:100 LYS 3.49 0.34 3.49 0.38 3.49 0.30 3.05 0.00 3.60 0.24 F:6 GLU 3.28 0.23 3.31 0.26 3.25 0.20 3.01 0.05 3.40 0.06 F:7 VAL 3.57 0.32 3.79 0.17 3.27 0.20 nan nan 3.27 0.20 F:8 VAL 3.71 0.31 3.87 0.25 3.50 0.25 nan nan 3.50 0.25 F:9 LYS 3.63 0.55 4.20 0.28 3.18 0.11 3.06 0.00 3.21 0.11 F:10 PHE 3.62 0.56 4.17 0.61 3.31 0.15 nan nan 3.31 0.15 F:11 MET 3.77 0.50 4.25 0.15 3.29 0.14 3.34 0.00 3.28 0.16 F:12 ASP 3.85 0.62 4.39 0.43 3.32 0.18 3.16 0.10 3.48 0.06 F:13 VAL 3.96 0.65 4.44 0.39 3.33 0.28 nan nan 3.33 0.28 F:14 TYR 4.03 0.62 4.72 0.18 3.68 0.45 3.19 0.00 3.75 0.44 F:15 GLN 3.58 0.52 3.94 0.57 3.29 0.21 3.05 0.08 3.45 0.07 F:16 ARG 3.45 0.31 3.70 0.29 3.31 0.23 3.12 0.15 3.44 0.16 F:17 SER 3.70 0.40 3.91 0.31 3.28 0.18 3.46 0.00 3.11 0.00 F:18 TYR 4.16 0.58 4.82 0.20 3.83 0.41 3.20 0.00 3.92 0.35 F:19 CYS 4.94 0.74 4.71 0.81 5.41 0.04 5.37 0.00 5.45 0.00 F:20 HIS 4.16 0.73 4.87 0.57 3.69 0.34 3.85 0.43 3.60 0.25 F:21 PRO 3.99 0.48 4.25 0.44 3.65 0.27 nan nan 3.65 0.27 F:22 ILE 4.47 0.72 5.02 0.36 3.92 0.53 nan nan 3.92 0.53 F:23 GLU 3.68 0.44 3.93 0.40 3.49 0.35 3.11 0.05 3.74 0.21 F:24 THR 4.11 0.61 4.48 0.51 3.63 0.32 3.71 0.00 3.59 0.38 F:25 LEU 3.54 0.34 3.67 0.38 3.42 0.25 nan nan 3.42 0.25 F:26 VAL 4.90 0.33 4.77 0.31 5.07 0.28 nan nan 5.07 0.28 F:27 ASP 4.09 0.82 4.75 0.69 3.43 0.07 3.37 0.04 3.48 0.05 F:28 ILE 6.96 0.53 6.56 0.40 7.36 0.28 nan nan 7.36 0.28 F:29 PHE 3.98 0.61 4.46 0.67 3.70 0.34 nan nan 3.70 0.34 F:30 GLN 3.58 0.34 3.82 0.34 3.40 0.21 3.15 0.08 3.56 0.00 F:31 GLU 4.19 0.52 4.16 0.59 4.20 0.46 3.79 0.10 4.48 0.38 F:32 TYR 4.15 0.59 4.64 0.20 3.90 0.57 3.44 0.00 3.97 0.58 F:33 PRO 3.68 0.47 3.89 0.47 3.38 0.28 nan nan 3.38 0.28 F:34 ASP 3.48 0.37 3.75 0.30 3.20 0.17 3.06 0.12 3.35 0.07 F:35 GLU 4.16 0.52 4.09 0.36 4.21 0.61 3.68 0.45 4.56 0.41 F:36 ILE 3.57 0.46 3.84 0.43 3.30 0.29 nan nan 3.30 0.29 F:37 GLU 3.75 0.38 4.08 0.25 3.49 0.22 3.25 0.10 3.65 0.09 F:38 TYR 4.92 0.88 5.16 0.50 4.80 1.00 3.32 0.00 5.01 0.88 F:39 ILE 4.37 0.98 5.27 0.41 3.47 0.37 nan nan 3.47 0.37 F:40 PHE 5.82 0.99 4.64 0.55 6.49 0.38 nan nan 6.49 0.38 F:41 LYS 3.76 0.59 4.31 0.41 3.32 0.23 2.99 0.00 3.40 0.18 F:42 PRO 3.73 0.65 4.08 0.67 3.26 0.03 nan nan 3.26 0.03 F:43 SER 3.98 0.68 4.39 0.43 3.15 0.07 3.08 0.00 3.22 0.00 F:44 CYS 4.15 0.66 4.57 0.33 3.32 0.18 3.14 0.00 3.50 0.00 F:45 VAL 5.17 0.63 5.26 0.53 5.07 0.73 nan nan 5.07 0.73 F:46 PRO 4.19 0.61 4.67 0.30 3.56 0.24 nan nan 3.56 0.24 F:47 LEU 6.29 0.61 5.75 0.21 6.83 0.34 nan nan 6.83 0.34 F:48 MET 4.64 1.18 5.72 0.53 3.56 0.40 3.34 0.00 3.63 0.44 F:49 ARG 4.63 0.70 5.39 0.39 4.19 0.39 4.09 0.54 4.26 0.19 F:50 CYS 4.61 0.80 4.26 0.65 5.33 0.56 5.89 0.00 4.76 0.00 F:51 GLY 4.20 0.43 4.20 0.43 nan nan nan nan nan nan F:52 GLY 3.50 0.20 3.50 0.20 nan nan nan nan nan nan F:53 CYS 4.12 0.75 4.57 0.50 3.24 0.00 3.23 0.00 3.24 0.00 F:54 CYS 4.71 0.65 4.35 0.49 5.43 0.09 5.52 0.00 5.35 0.00 F:55 ASN 3.49 0.45 3.79 0.47 3.19 0.12 3.09 0.06 3.29 0.06 F:56 ASP 3.76 0.60 4.29 0.36 3.24 0.18 3.08 0.12 3.40 0.00 F:57 GLU 3.41 0.31 3.69 0.15 3.19 0.21 2.96 0.06 3.35 0.09 F:58 GLY 3.50 0.25 3.50 0.25 nan nan nan nan nan nan F:59 LEU 4.55 0.77 5.02 0.40 4.09 0.77 nan nan 4.09 0.77 F:60 GLU 4.25 0.79 4.96 0.50 3.69 0.47 3.18 0.00 4.03 0.28 F:61 CYS 4.34 0.62 4.05 0.44 4.90 0.54 5.44 0.00 4.37 0.00 F:62 VAL 4.39 0.84 5.01 0.53 3.57 0.29 nan nan 3.57 0.29 F:63 PRO 4.10 0.63 4.22 0.67 3.94 0.54 nan nan 3.94 0.54 F:64 THR 3.91 0.42 3.84 0.49 4.01 0.27 4.36 0.00 3.83 0.11 F:65 GLU 3.92 0.77 4.63 0.58 3.34 0.27 3.05 0.03 3.54 0.15 F:66 GLU 3.81 0.58 4.00 0.54 3.66 0.57 3.24 0.24 3.93 0.56 F:67 SER 3.97 0.60 4.31 0.45 3.28 0.03 3.32 0.00 3.25 0.00 F:68 ASN 3.64 0.37 3.79 0.38 3.50 0.29 3.30 0.30 3.70 0.01 F:69 ILE 4.21 0.77 4.55 0.53 3.87 0.81 nan nan 3.87 0.81 F:70 THR 3.73 0.41 3.93 0.41 3.47 0.23 3.15 0.00 3.63 0.02 F:71 MET 4.03 0.61 4.52 0.53 3.55 0.05 3.61 0.00 3.53 0.05 F:72 GLN 3.59 0.43 3.82 0.42 3.40 0.34 3.02 0.00 3.66 0.16 F:73 ILE 5.20 0.57 5.03 0.35 5.37 0.69 nan nan 5.37 0.69 F:74 MET 4.68 1.04 5.47 0.76 3.89 0.60 3.57 0.32 3.99 0.63 F:75 ARG 4.83 1.16 5.97 0.54 4.18 0.89 3.46 0.24 4.71 0.81 F:76 ILE 4.93 1.00 5.86 0.30 4.00 0.42 nan nan 4.00 0.42 F:77 LYS 4.25 0.68 4.88 0.22 3.74 0.46 3.26 0.00 3.86 0.44 F:78 PRO 3.84 0.37 3.96 0.31 3.68 0.38 nan nan 3.68 0.38 F:79 HIS 3.29 0.24 3.47 0.20 3.18 0.18 3.12 0.15 3.21 0.19 F:80 GLN 3.53 0.39 3.71 0.38 3.39 0.33 3.03 0.01 3.62 0.19 F:81 GLY 3.84 0.28 3.84 0.28 nan nan nan nan nan nan F:82 GLN 3.58 0.44 3.76 0.37 3.45 0.44 3.12 0.17 3.67 0.42 F:83 HIS 3.83 0.59 4.42 0.46 3.44 0.22 3.28 0.07 3.52 0.23 F:84 ILE 3.65 0.42 3.98 0.34 3.33 0.13 nan nan 3.33 0.13 F:85 GLY 4.42 0.48 4.42 0.48 nan nan nan nan nan nan F:86 GLU 3.54 0.35 3.76 0.36 3.36 0.22 3.12 0.00 3.53 0.11 F:87 MET 4.86 0.42 4.84 0.52 4.87 0.29 5.31 0.00 4.72 0.15 F:88 SER 4.08 0.54 4.49 0.24 3.58 0.36 3.22 0.05 3.94 0.00 F:89 PHE 6.31 0.70 5.44 0.24 6.81 0.21 nan nan 6.81 0.21 F:90 LEU 4.48 0.96 5.33 0.56 3.63 0.28 nan nan 3.63 0.28 F:91 GLN 5.16 1.15 6.30 0.11 4.24 0.70 3.51 0.25 4.72 0.44 F:92 HIS 4.95 1.09 5.56 0.82 4.54 1.06 3.87 0.50 4.87 1.10 F:93 ASN 3.77 0.57 4.08 0.67 3.45 0.10 3.35 0.01 3.55 0.04 F:94 LYS 4.14 0.89 4.95 0.66 3.49 0.34 3.13 0.00 3.58 0.32 F:95 CYS 4.68 0.68 4.34 0.56 5.36 0.25 5.61 0.00 5.11 0.00 F:96 GLU 4.26 0.81 5.03 0.53 3.65 0.33 3.32 0.12 3.86 0.22 F:97 CYS 4.27 0.47 4.15 0.50 4.50 0.28 4.78 0.00 4.22 0.00 F:98 ARG 3.95 0.68 4.74 0.40 3.50 0.26 3.33 0.04 3.62 0.28 F:99 PRO 3.58 0.45 3.93 0.25 3.11 0.06 nan nan 3.11 0.06 F:100 LYS 3.40 0.38 3.53 0.51 3.31 0.17 3.16 0.00 3.34 0.17 G:1 THR 3.76 0.44 3.88 0.47 3.60 0.32 3.38 0.00 3.71 0.35 G:2 TYR 5.29 0.93 5.84 0.34 5.01 1.00 3.36 0.00 5.25 0.84 G:3 LYS 4.98 1.41 6.40 0.35 3.85 0.76 2.91 0.00 4.08 0.66 G:4 LEU 7.61 0.89 6.88 0.53 8.34 0.48 nan nan 8.34 0.48 G:5 ILE 5.06 1.28 6.24 0.44 3.87 0.52 nan nan 3.87 0.52 G:6 LEU 6.01 0.38 5.93 0.48 6.10 0.22 nan nan 6.10 0.22 G:7 ASN 3.94 0.66 4.46 0.53 3.43 0.20 3.23 0.05 3.62 0.01 G:8 GLY 4.20 0.55 4.20 0.55 nan nan nan nan nan nan G:9 LYS 3.47 0.43 3.74 0.50 3.26 0.19 3.04 0.00 3.32 0.17 G:10 THR 3.47 0.42 3.70 0.41 3.18 0.16 3.21 0.00 3.16 0.19 G:11 LEU 3.88 0.32 4.01 0.23 3.75 0.34 nan nan 3.75 0.34 G:12 LYS 3.39 0.37 3.66 0.35 3.18 0.21 2.88 0.00 3.25 0.16 G:13 GLY 4.00 0.30 4.00 0.30 nan nan nan nan nan nan G:14 GLU 3.63 0.42 3.91 0.37 3.40 0.31 3.08 0.16 3.62 0.13 G:15 THR 4.35 0.64 4.54 0.50 4.10 0.72 3.26 0.00 4.53 0.49 G:16 THR 3.72 0.38 3.91 0.40 3.48 0.15 3.27 0.00 3.58 0.05 G:17 THR 4.57 0.63 4.62 0.41 4.50 0.84 3.55 0.00 4.97 0.62 G:18 GLU 3.39 0.31 3.61 0.25 3.22 0.23 2.95 0.03 3.40 0.09 G:19 ALA 3.91 0.26 3.90 0.28 3.94 0.00 nan nan 3.94 0.00 G:20 VAL 3.50 0.43 3.75 0.39 3.17 0.17 nan nan 3.17 0.17 G:21 ASP 4.25 0.79 4.82 0.65 3.68 0.44 3.74 0.54 3.61 0.28 G:22 VAL 4.03 0.54 4.62 0.23 3.64 0.26 nan nan 3.64 0.26 G:23 PHE 3.66 0.50 4.24 0.34 3.33 0.14 nan nan 3.33 0.14 G:24 ASP 3.77 0.51 4.19 0.27 3.36 0.34 3.06 0.01 3.67 0.22 G:25 ALA 6.32 0.52 6.13 0.40 7.07 0.00 nan nan 7.07 0.00 G:26 PHE 4.35 1.00 5.63 0.25 3.62 0.30 nan nan 3.62 0.30 G:27 ASP 3.88 0.62 4.43 0.31 3.33 0.29 3.08 0.13 3.59 0.14 G:28 VAL 3.85 0.41 4.11 0.24 3.50 0.34 nan nan 3.50 0.34 G:29 PHE 6.68 0.79 6.22 0.45 6.95 0.82 nan nan 6.95 0.82 G:30 PHE 4.46 1.16 5.80 0.50 3.70 0.60 nan nan 3.70 0.60 G:31 VAL 3.76 0.60 4.17 0.42 3.21 0.27 nan nan 3.21 0.27 G:32 TYR 4.06 0.68 4.60 0.43 3.80 0.62 3.15 0.00 3.89 0.61 G:33 ALA 6.40 0.59 6.17 0.43 7.29 0.00 nan nan 7.29 0.00 G:34 ALA 3.84 0.62 3.99 0.61 3.23 0.00 nan nan 3.23 0.00 G:35 SER 3.45 0.35 3.54 0.39 3.27 0.13 3.40 0.00 3.14 0.00 G:36 ASN 3.98 0.45 4.00 0.39 3.96 0.50 3.60 0.30 4.32 0.40 G:37 PHE 5.49 1.16 4.24 0.24 6.20 0.83 nan nan 6.20 0.83 G:38 SER 3.31 0.30 3.46 0.26 3.00 0.01 3.01 0.00 2.99 0.00 G:39 ASP 3.92 0.67 4.55 0.25 3.28 0.17 3.12 0.09 3.44 0.05 G:40 PHE 4.22 0.48 4.05 0.51 4.32 0.43 nan nan 4.32 0.43 G:41 ASP 3.68 0.57 4.01 0.54 3.34 0.38 3.00 0.02 3.68 0.23 G:42 ASP 3.90 0.59 4.36 0.40 3.43 0.31 3.13 0.08 3.72 0.12 G:43 TRP 4.50 0.88 3.94 0.44 4.72 0.92 3.96 0.00 4.81 0.93 G:44 THR 3.99 0.56 4.41 0.38 3.44 0.11 3.37 0.00 3.47 0.12 G:45 TYR 4.21 0.59 3.82 0.43 4.40 0.57 4.33 0.00 4.41 0.61 G:46 ASP 3.94 0.71 4.53 0.52 3.35 0.23 3.13 0.09 3.57 0.09 G:47 ASP 3.47 0.34 3.73 0.27 3.20 0.14 3.08 0.10 3.32 0.02 G:48 ALA 3.37 0.36 3.49 0.31 2.91 0.00 nan nan 2.91 0.00 G:49 THR 3.50 0.30 3.61 0.29 3.35 0.25 3.64 0.00 3.21 0.19 G:50 LYS 4.15 0.87 4.99 0.43 3.48 0.44 3.04 0.00 3.59 0.43 G:51 THR 4.47 0.73 5.08 0.25 3.66 0.17 3.42 0.00 3.78 0.00 G:52 PHE 5.80 0.75 6.01 0.17 5.69 0.91 nan nan 5.69 0.91 G:53 THR 4.72 0.93 5.50 0.22 3.68 0.24 3.36 0.00 3.84 0.09 G:54 VAL 7.06 0.69 6.64 0.16 7.62 0.71 nan nan 7.62 0.71 G:55 THR 4.70 1.04 5.57 0.28 3.55 0.31 3.49 0.00 3.59 0.37 G:56 GLU 4.36 0.75 4.73 0.74 4.11 0.64 3.71 0.37 4.50 0.62 H:8 GLY 3.00 0.04 3.00 0.04 nan nan nan nan nan nan H:13 GLY 1.71 2.22 1.71 2.22 nan nan nan nan nan nan