# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom A:1 DT 3.42 0.28 nan nan 3.42 0.28 3.31 0.28 3.49 0.26 A:2 DG 3.66 0.44 nan nan 3.66 0.44 3.50 0.44 3.85 0.35 A:3 DT 3.82 0.54 nan nan 3.82 0.54 3.63 0.55 4.01 0.45 A:4 DG 3.73 0.44 nan nan 3.73 0.44 3.56 0.41 3.92 0.39 A:5 DG 3.70 0.40 nan nan 3.70 0.40 3.56 0.36 3.87 0.37 A:6 DG 3.77 0.46 nan nan 3.77 0.46 3.57 0.43 4.01 0.39 A:7 DC 3.79 0.42 nan nan 3.79 0.42 3.72 0.47 3.87 0.34 A:8 DG 3.72 0.49 nan nan 3.72 0.49 3.54 0.42 3.93 0.48 A:9 DT 3.80 0.51 nan nan 3.80 0.51 3.72 0.54 3.88 0.46 A:10 DG 3.64 0.37 nan nan 3.64 0.37 3.51 0.35 3.80 0.32 A:11 DG 3.79 0.50 nan nan 3.79 0.50 3.61 0.46 4.00 0.46 A:12 DC 3.73 0.41 nan nan 3.73 0.41 3.68 0.42 3.79 0.39 A:13 DA 3.60 0.41 nan nan 3.60 0.41 3.46 0.32 3.75 0.43 A:14 DC 3.56 0.32 nan nan 3.56 0.32 3.49 0.36 3.64 0.26 A:15 DA 3.65 0.43 nan nan 3.65 0.43 3.51 0.40 3.81 0.42 A:16 DG 3.64 0.42 nan nan 3.64 0.42 3.50 0.38 3.82 0.39 A:17 DG 3.65 0.45 nan nan 3.65 0.45 3.46 0.38 3.87 0.41 A:18 DT 3.72 0.50 nan nan 3.72 0.50 3.66 0.48 3.78 0.51 A:19 DA 3.71 0.41 nan nan 3.71 0.41 3.57 0.37 3.86 0.39 A:20 DA 3.81 0.47 nan nan 3.81 0.47 3.65 0.44 3.98 0.45 A:21 DA 3.73 0.42 nan nan 3.73 0.42 3.58 0.32 3.90 0.46 A:22 DA 3.69 0.39 nan nan 3.69 0.39 3.56 0.37 3.83 0.37 A:23 DA 3.69 0.41 nan nan 3.69 0.41 3.58 0.36 3.81 0.43 A:24 DG 3.67 0.40 nan nan 3.67 0.40 3.52 0.40 3.85 0.33 A:25 DG 3.76 0.49 nan nan 3.76 0.49 3.64 0.45 3.89 0.51 A:26 DG 3.70 0.50 nan nan 3.70 0.50 3.51 0.47 3.92 0.45 A:27 DC 3.76 0.47 nan nan 3.76 0.47 3.62 0.54 3.92 0.31 A:28 DA 3.34 0.24 nan nan 3.34 0.24 3.30 0.28 3.40 0.16 B:1 DT 3.48 0.33 nan nan 3.48 0.33 3.45 0.37 3.51 0.29 B:2 DG 3.67 0.47 nan nan 3.67 0.47 3.52 0.45 3.85 0.42 B:3 DC 3.75 0.47 nan nan 3.75 0.47 3.59 0.48 3.92 0.39 B:4 DC 3.61 0.40 nan nan 3.61 0.40 3.58 0.44 3.65 0.34 B:5 DC 3.60 0.37 nan nan 3.60 0.37 3.49 0.39 3.71 0.29 B:6 DT 3.69 0.47 nan nan 3.69 0.47 3.53 0.43 3.85 0.45 B:7 DT 3.68 0.46 nan nan 3.68 0.46 3.53 0.47 3.82 0.39 B:8 DT 3.77 0.46 nan nan 3.77 0.46 3.63 0.48 3.92 0.40 B:9 DT 3.71 0.39 nan nan 3.71 0.39 3.58 0.38 3.84 0.36 B:10 DT 3.63 0.38 nan nan 3.63 0.38 3.52 0.40 3.75 0.32 B:11 DA 3.59 0.40 nan nan 3.59 0.40 3.45 0.36 3.75 0.39 B:12 DC 3.62 0.41 nan nan 3.62 0.41 3.50 0.45 3.76 0.30 B:13 DC 3.67 0.36 nan nan 3.67 0.36 3.53 0.37 3.82 0.27 B:14 DT 3.70 0.42 nan nan 3.70 0.42 3.59 0.43 3.81 0.38 B:15 DG 3.75 0.41 nan nan 3.75 0.41 3.58 0.39 3.95 0.32 B:16 DT 3.80 0.44 nan nan 3.80 0.44 3.67 0.43 3.94 0.40 B:17 DG 3.72 0.48 nan nan 3.72 0.48 3.54 0.43 3.93 0.45 B:18 DC 3.76 0.46 nan nan 3.76 0.46 3.62 0.51 3.91 0.33 B:19 DC 3.64 0.35 nan nan 3.64 0.35 3.55 0.38 3.74 0.28 B:20 DA 3.64 0.36 nan nan 3.64 0.36 3.50 0.36 3.78 0.29 B:21 DC 3.68 0.35 nan nan 3.68 0.35 3.56 0.40 3.82 0.22 B:22 DG 3.72 0.42 nan nan 3.72 0.42 3.59 0.40 3.87 0.38 B:23 DC 3.63 0.37 nan nan 3.63 0.37 3.53 0.40 3.73 0.29 B:24 DC 3.66 0.38 nan nan 3.66 0.38 3.53 0.42 3.79 0.27 B:25 DC 3.63 0.39 nan nan 3.63 0.39 3.53 0.42 3.75 0.31 B:26 DA 3.69 0.48 nan nan 3.69 0.48 3.54 0.44 3.87 0.45 B:27 DC 3.67 0.39 nan nan 3.67 0.39 3.61 0.41 3.73 0.36 B:28 DA 3.38 0.26 nan nan 3.38 0.26 3.34 0.29 3.44 0.20 C:362 PRO 3.53 0.41 3.69 0.44 3.31 0.22 nan nan 3.31 0.22 C:363 HIS 3.92 0.53 4.12 0.39 3.12 0.00 nan nan 3.12 0.00 C:364 LYS 3.71 0.37 3.83 0.30 3.20 0.00 nan nan 3.20 0.00 C:365 CYS 4.60 0.53 4.31 0.41 5.17 0.12 5.05 0.00 5.28 0.00 C:366 LYS 3.47 0.32 3.75 0.27 3.24 0.08 3.16 0.00 3.26 0.08 C:367 GLU 3.89 0.48 3.96 0.52 3.82 0.44 3.37 0.28 4.12 0.20 C:368 CYS 3.68 0.36 3.68 0.37 3.68 0.34 4.02 0.00 3.35 0.00 C:369 GLY 3.61 0.33 3.61 0.33 nan nan nan nan nan nan C:370 LYS 3.78 0.45 3.93 0.37 3.15 0.00 nan nan 3.15 0.00 C:371 ALA 3.49 0.32 3.58 0.30 3.16 0.00 nan nan 3.16 0.00 C:372 PHE 4.33 0.65 4.48 0.64 3.72 0.00 nan nan 3.72 0.00 C:373 HIS 3.47 0.31 3.70 0.30 3.32 0.21 3.38 0.23 3.29 0.19 C:374 THR 4.23 0.76 4.51 0.57 3.10 0.00 nan nan 3.10 0.00 C:375 PRO 3.60 0.43 3.94 0.21 3.14 0.06 nan nan 3.14 0.06 C:376 SER 3.61 0.41 3.87 0.21 3.09 0.06 3.03 0.00 3.15 0.00 C:377 GLN 3.73 0.37 3.87 0.26 3.14 0.00 nan nan 3.14 0.00 C:378 LEU 4.93 0.86 5.63 0.17 4.23 0.68 nan nan 4.23 0.68 C:379 SER 3.85 0.61 4.15 0.52 3.24 0.11 3.13 0.00 3.35 0.00 C:380 HIS 3.64 0.36 3.77 0.29 3.14 0.00 nan nan 3.14 0.00 C:381 HIS 4.39 0.53 4.54 0.45 4.30 0.56 4.29 0.59 4.30 0.54 C:382 GLN 3.88 0.65 4.36 0.57 3.49 0.41 3.12 0.28 3.74 0.28 C:383 LYS 3.77 0.39 3.93 0.23 3.09 0.00 nan nan 3.09 0.00 C:384 LEU 4.50 0.85 5.25 0.28 3.74 0.48 nan nan 3.74 0.48 C:385 HIS 4.74 0.61 5.30 0.25 4.38 0.49 4.15 0.08 4.49 0.56 C:386 VAL 3.95 0.58 4.33 0.40 3.44 0.33 nan nan 3.44 0.33 C:387 GLY 5.10 0.27 5.10 0.27 nan nan nan nan nan nan C:388 GLU 4.21 0.61 4.69 0.57 3.82 0.27 3.63 0.29 3.95 0.15 C:389 LYS 4.36 0.70 4.90 0.47 3.93 0.54 3.26 0.00 4.09 0.47 C:390 PRO 4.46 0.74 4.13 0.59 4.91 0.68 nan nan 4.91 0.68 C:391 TYR 4.44 0.71 4.86 0.47 4.23 0.72 3.41 0.00 4.35 0.69 C:392 LYS 3.65 0.54 4.17 0.33 3.24 0.22 2.91 0.00 3.32 0.17 C:393 CYS 5.15 0.69 4.74 0.46 5.95 0.08 5.87 0.00 6.03 0.00 C:394 GLN 3.56 0.45 3.78 0.40 3.14 0.12 nan nan 3.14 0.12 C:395 GLU 3.75 0.47 3.89 0.48 3.64 0.42 3.70 0.59 3.60 0.24 C:396 CYS 3.67 0.45 3.80 0.46 3.42 0.31 3.73 0.00 3.12 0.00 C:397 GLY 3.55 0.26 3.55 0.26 nan nan nan nan nan nan C:398 LYS 4.02 0.57 4.44 0.47 3.68 0.40 3.11 0.00 3.82 0.32 C:399 ALA 4.02 0.46 4.19 0.35 3.36 0.00 nan nan 3.36 0.00 C:400 PHE 5.79 0.48 5.95 0.37 5.69 0.51 nan nan 5.69 0.51 C:401 PRO 4.06 0.56 4.41 0.43 3.58 0.31 nan nan 3.58 0.31 C:402 SER 4.45 0.85 4.97 0.52 3.40 0.09 3.49 0.00 3.32 0.00 C:403 ASN 4.00 0.62 4.60 0.10 3.41 0.22 3.20 0.12 3.61 0.04 C:404 ALA 3.70 0.35 3.86 0.19 3.09 0.00 nan nan 3.09 0.00 C:405 GLN 4.62 1.03 5.48 0.72 3.94 0.67 3.33 0.03 4.35 0.58 C:406 LEU 5.28 0.81 5.88 0.41 4.67 0.64 nan nan 4.67 0.64 C:407 SER 3.90 0.56 4.24 0.36 3.22 0.05 3.17 0.00 3.27 0.00 C:408 LEU 4.67 1.08 5.46 0.83 3.87 0.61 nan nan 3.87 0.61 C:409 HIS 6.22 1.04 7.01 0.33 5.69 1.02 5.03 0.07 6.02 1.11 C:410 HIS 4.44 0.87 5.43 0.27 3.78 0.36 3.54 0.03 3.90 0.40 C:411 ARG 4.29 0.61 4.90 0.30 3.94 0.45 3.91 0.51 3.97 0.39 C:412 VAL 4.39 0.76 4.62 0.87 4.10 0.41 nan nan 4.10 0.41 C:413 HIS 3.99 0.57 3.83 0.58 4.10 0.54 4.05 0.62 4.13 0.49 C:414 THR 3.45 0.34 3.56 0.40 3.32 0.14 3.35 0.00 3.31 0.17 C:415 ASP 3.65 0.36 3.95 0.11 3.36 0.27 3.18 0.25 3.53 0.14 C:416 GLU 3.52 0.35 3.71 0.33 3.37 0.28 3.08 0.04 3.57 0.19 C:417 LYS 3.55 0.47 3.98 0.36 3.21 0.18 2.96 0.00 3.27 0.15 C:418 CYS 4.45 0.69 4.12 0.54 5.12 0.40 4.71 0.00 5.52 0.00 C:419 PHE 4.06 0.63 4.57 0.41 3.76 0.55 nan nan 3.76 0.55 C:420 GLU 4.16 0.60 4.40 0.42 3.97 0.65 3.27 0.15 4.43 0.39 C:421 CYS 5.75 0.36 5.52 0.13 6.19 0.25 5.94 0.00 6.44 0.00 C:422 LYS 3.47 0.45 3.78 0.50 3.22 0.15 2.93 0.00 3.30 0.01 C:423 GLU 3.57 0.41 3.79 0.41 3.39 0.32 3.03 0.07 3.63 0.16 C:424 CYS 4.31 0.40 4.37 0.22 4.19 0.60 4.79 0.00 3.60 0.00 C:425 GLY 5.69 0.47 5.69 0.47 nan nan nan nan nan nan C:426 LYS 6.00 1.50 7.40 0.38 4.88 1.05 3.37 0.00 5.26 0.82 C:427 ALA 6.68 0.70 6.65 0.78 6.79 0.00 nan nan 6.79 0.00 C:428 PHE 5.07 0.94 5.93 0.41 4.57 0.80 nan nan 4.57 0.80 C:429 MET 3.91 0.56 4.26 0.53 3.55 0.31 4.09 0.00 3.37 0.03 C:430 ARG 4.00 0.82 4.92 0.47 3.47 0.40 3.20 0.38 3.67 0.28 C:431 PRO 3.78 0.48 4.19 0.11 3.24 0.05 nan nan 3.24 0.05 C:432 SER 3.60 0.42 3.84 0.29 3.11 0.05 3.16 0.00 3.06 0.00 C:433 HIS 4.37 0.76 5.15 0.19 3.84 0.50 3.64 0.36 3.94 0.53 C:434 LEU 5.14 0.85 5.86 0.14 4.42 0.62 nan nan 4.42 0.62 C:435 LEU 4.06 0.72 4.74 0.18 3.39 0.33 nan nan 3.39 0.33 C:436 ARG 4.26 0.81 5.22 0.29 3.70 0.39 3.39 0.22 3.94 0.31 C:437 HIS 5.02 0.62 5.35 0.43 4.80 0.62 4.62 0.66 4.89 0.58 C:438 GLN 4.52 1.02 5.52 0.37 3.73 0.57 3.15 0.06 4.11 0.43 C:439 ARG 5.09 0.96 5.82 0.36 4.67 0.95 3.90 0.54 5.25 0.77 C:440 ILE 4.19 0.84 4.64 0.91 3.75 0.42 nan nan 3.75 0.42 C:441 HIS 4.01 0.57 3.92 0.59 4.07 0.56 3.95 0.62 4.13 0.51 C:442 THR 3.53 0.39 3.60 0.42 3.43 0.33 3.88 0.00 3.21 0.11 C:443 GLY 3.53 0.25 3.53 0.25 nan nan nan nan nan nan C:444 GLU 3.92 0.70 4.50 0.63 3.46 0.27 3.14 0.12 3.67 0.07 C:445 LYS 3.78 0.48 3.99 0.41 3.62 0.46 3.01 0.00 3.77 0.39 C:446 PRO 3.96 0.51 3.83 0.33 4.14 0.64 nan nan 4.14 0.64 C:447 HIS 4.41 0.74 5.04 0.46 3.98 0.57 3.54 0.00 4.20 0.59 C:448 LYS 3.95 0.54 4.25 0.36 3.35 0.28 nan nan 3.35 0.28 C:449 CYS 4.97 0.59 4.67 0.47 5.57 0.24 5.33 0.00 5.80 0.00 C:450 LYS 3.42 0.33 3.68 0.29 3.21 0.19 3.01 0.00 3.26 0.18 C:451 GLU 3.53 0.26 3.62 0.29 3.46 0.20 3.32 0.18 3.56 0.14 C:452 CYS 3.64 0.40 3.61 0.45 3.72 0.25 3.97 0.00 3.46 0.00 C:453 GLY 3.53 0.30 3.53 0.30 nan nan nan nan nan nan C:454 LYS 3.94 0.70 4.54 0.52 3.46 0.39 3.02 0.00 3.58 0.36 C:455 ALA 4.00 0.46 4.17 0.35 3.31 0.00 nan nan 3.31 0.00 C:456 PHE 4.84 0.83 5.50 0.47 4.47 0.76 nan nan 4.47 0.76 C:457 ARG 4.67 0.99 5.55 0.52 4.17 0.83 3.51 0.56 4.67 0.63 C:458 TYR 4.51 0.86 5.56 0.36 3.99 0.45 3.38 0.00 4.07 0.42 C:459 ASP 4.00 0.68 4.65 0.27 3.36 0.13 3.23 0.03 3.49 0.01 C:460 THR 3.94 0.64 4.47 0.13 3.23 0.23 3.28 0.00 3.20 0.28 C:461 GLN 3.83 0.54 4.33 0.26 3.43 0.33 3.36 0.44 3.47 0.23 C:462 LEU 5.31 0.71 5.83 0.11 4.79 0.68 nan nan 4.79 0.68 C:463 SER 4.53 0.71 4.99 0.28 3.62 0.34 3.28 0.00 3.95 0.00 C:464 LEU 3.93 0.57 4.22 0.65 3.63 0.25 nan nan 3.63 0.25 C:465 HIS 4.32 0.52 4.29 0.38 4.33 0.59 4.18 0.57 4.41 0.59 C:466 LEU 4.67 0.84 5.45 0.14 3.90 0.46 nan nan 3.90 0.46 C:467 LEU 4.59 0.65 4.47 0.67 4.70 0.59 nan nan 4.70 0.59 C:468 THR 3.53 0.40 3.67 0.41 3.35 0.32 3.68 0.00 3.19 0.26 C:469 HIS 4.20 0.40 4.07 0.16 4.28 0.48 4.07 0.47 4.39 0.45 C:470 ALA 3.46 0.29 3.59 0.16 2.96 0.00 nan nan 2.96 0.00 C:471 GLY 3.34 0.18 3.34 0.18 nan nan nan nan nan nan C:472 ALA 3.96 0.24 3.88 0.20 4.29 0.00 nan nan 4.29 0.00 C:473 ARG 3.70 0.52 4.24 0.48 3.40 0.20 3.25 0.20 3.50 0.11 C:474 ARG 3.82 0.37 4.09 0.40 3.73 0.31 3.61 0.27 3.82 0.30 C:475 PHE 4.36 0.60 4.70 0.48 4.16 0.58 nan nan 4.16 0.58 C:476 GLU 3.86 0.51 4.28 0.37 3.52 0.31 3.23 0.17 3.72 0.22 C:477 CYS 5.12 0.78 4.67 0.54 6.03 0.01 6.02 0.00 6.03 0.00 C:478 LYS 3.53 0.49 3.91 0.49 3.22 0.17 3.05 0.00 3.27 0.16 C:479 ASP 3.63 0.43 3.78 0.47 3.47 0.31 3.21 0.15 3.74 0.18 C:480 CYS 3.70 0.33 3.69 0.32 3.71 0.35 4.05 0.00 3.36 0.00 C:481 ASP 3.29 0.21 3.38 0.11 2.93 0.00 nan nan 2.93 0.00 C:482 LYS 4.11 0.49 4.25 0.45 3.56 0.00 nan nan 3.56 0.00 C:483 VAL 4.54 0.60 4.56 0.44 4.51 0.75 nan nan 4.51 0.75 C:484 TYR 4.97 1.11 6.13 0.43 4.39 0.87 3.33 0.00 4.54 0.83 C:485 SER 4.87 0.72 4.89 0.88 4.82 0.05 4.87 0.00 4.76 0.00 C:486 CYS 4.42 0.74 4.88 0.43 3.49 0.05 3.54 0.00 3.43 0.00 C:487 ALA 3.75 0.36 3.93 0.02 3.04 0.00 nan nan 3.04 0.00 C:488 SER 3.47 0.35 3.68 0.21 3.05 0.07 3.12 0.00 2.98 0.00 C:489 GLN 4.18 0.49 4.57 0.24 3.86 0.40 3.98 0.57 3.79 0.19 C:490 LEU 4.64 0.70 5.08 0.37 4.20 0.69 nan nan 4.20 0.69 C:491 ALA 3.74 0.39 3.92 0.17 3.02 0.00 nan nan 3.02 0.00 C:492 LEU 3.90 0.53 4.36 0.08 3.44 0.37 nan nan 3.44 0.37 C:493 HIS 4.19 0.44 4.31 0.30 4.12 0.49 3.98 0.46 4.19 0.49 C:494 GLN 4.09 0.64 4.74 0.36 3.57 0.19 3.37 0.02 3.70 0.11 C:495 MET 4.43 0.56 4.81 0.07 4.06 0.59 3.25 0.00 4.32 0.42 C:496 SER 3.63 0.44 3.86 0.36 3.18 0.11 3.29 0.00 3.07 0.00 C:497 HIS 4.08 0.56 3.99 0.52 4.15 0.57 3.92 0.44 4.26 0.59 C:498 THR 3.51 0.32 3.65 0.35 3.33 0.16 3.49 0.00 3.25 0.14 C:499 GLY 3.64 0.26 3.64 0.26 nan nan nan nan nan nan C:500 GLU 3.77 0.59 4.30 0.46 3.35 0.24 3.07 0.09 3.54 0.03 C:501 LYS 4.16 0.69 4.65 0.34 3.77 0.65 3.06 0.00 3.95 0.61 C:502 PRO 3.91 0.53 3.94 0.51 3.86 0.56 nan nan 3.86 0.56 C:503 HIS 4.05 0.67 4.62 0.56 3.67 0.43 3.67 0.50 3.68 0.39 C:504 LYS 3.63 0.40 3.98 0.35 3.35 0.13 3.23 0.00 3.39 0.13 C:505 CYS 4.95 0.70 4.55 0.50 5.73 0.15 5.58 0.00 5.89 0.00 C:506 LYS 3.39 0.35 3.51 0.29 2.92 0.00 nan nan 2.92 0.00 C:507 GLU 3.52 0.43 3.72 0.35 3.37 0.43 2.98 0.05 3.63 0.37 C:508 CYS 3.67 0.43 3.70 0.43 3.60 0.44 3.16 0.00 4.03 0.00 C:509 GLY 3.52 0.29 3.52 0.29 nan nan nan nan nan nan C:510 LYS 3.98 0.73 4.56 0.64 3.53 0.40 2.93 0.00 3.67 0.30 C:511 GLY 4.54 0.35 4.54 0.35 nan nan nan nan nan nan C:512 PHE 4.76 0.73 5.14 0.46 4.54 0.77 nan nan 4.54 0.77 C:513 ILE 3.87 0.38 4.10 0.38 3.65 0.23 nan nan 3.65 0.23 C:514 SER 4.35 0.70 4.70 0.58 3.66 0.26 3.92 0.00 3.40 0.00 C:515 ASP 3.78 0.54 4.26 0.31 3.31 0.20 3.17 0.20 3.44 0.01 C:516 SER 3.72 0.38 3.98 0.14 3.21 0.04 3.16 0.00 3.25 0.00 C:517 HIS 4.32 0.82 5.16 0.45 3.76 0.46 3.60 0.24 3.84 0.51 C:518 LEU 5.11 1.02 5.98 0.31 4.25 0.69 nan nan 4.25 0.69 C:519 LEU 3.92 0.64 4.46 0.37 3.38 0.33 nan nan 3.38 0.33 C:520 ARG 3.74 0.39 4.17 0.25 3.49 0.19 3.32 0.11 3.61 0.13 C:521 HIS 4.62 0.56 4.81 0.22 4.50 0.67 4.38 0.84 4.56 0.56 C:522 GLN 4.35 0.57 4.74 0.31 4.04 0.54 4.12 0.83 3.99 0.13 C:523 SER 4.36 0.33 4.55 0.23 3.99 0.14 3.85 0.00 4.14 0.00 C:524 VAL 3.68 0.56 3.88 0.59 3.43 0.38 nan nan 3.43 0.38 C:525 HIS 4.03 0.54 3.64 0.48 4.29 0.40 4.51 0.37 4.18 0.37 C:526 THR 3.54 0.32 3.71 0.27 3.31 0.21 3.02 0.00 3.46 0.07 C:527 GLY 3.58 0.28 3.58 0.28 nan nan nan nan nan nan C:528 GLU 3.85 0.47 4.04 0.30 3.09 0.00 nan nan 3.09 0.00 C:529 THR 3.92 0.48 4.26 0.25 3.47 0.29 3.74 0.00 3.33 0.27 C:530 PRO 3.86 0.36 4.03 0.28 3.64 0.33 nan nan 3.64 0.33 C:531 TYR 5.33 1.00 6.19 0.45 4.90 0.92 3.62 0.00 5.08 0.83 C:532 LYS 4.59 1.15 5.81 0.34 3.62 0.37 3.17 0.00 3.73 0.33 C:533 CYS 5.78 0.83 5.45 0.85 6.42 0.15 6.27 0.00 6.57 0.00 C:534 LYS 3.88 0.57 4.10 0.72 3.71 0.33 3.35 0.00 3.80 0.30 C:535 GLU 3.60 0.43 3.81 0.50 3.44 0.25 3.21 0.12 3.59 0.20 C:536 CYS 3.71 0.42 3.66 0.36 3.79 0.50 4.29 0.00 3.30 0.00 C:537 GLY 3.58 0.32 3.58 0.32 nan nan nan nan nan nan C:538 LYS 4.02 0.68 4.23 0.59 3.18 0.00 nan nan 3.18 0.00 C:539 GLY 3.99 0.36 3.99 0.36 nan nan nan nan nan nan C:540 PHE 4.57 0.68 4.98 0.46 4.34 0.68 nan nan 4.34 0.68 C:541 ARG 3.74 0.43 4.09 0.30 3.53 0.35 3.26 0.17 3.74 0.31 C:542 ARG 3.79 0.72 4.65 0.41 3.30 0.26 3.09 0.19 3.47 0.17 C:543 GLY 3.74 0.09 3.74 0.09 nan nan nan nan nan nan C:544 SER 3.67 0.41 3.88 0.35 3.25 0.07 3.33 0.00 3.18 0.00 C:545 GLU 4.48 1.07 5.58 0.51 3.60 0.36 3.35 0.00 3.77 0.38 C:546 LEU 6.33 0.38 6.30 0.25 6.37 0.47 nan nan 6.37 0.47 C:547 ALA 4.42 0.62 4.70 0.28 3.28 0.00 nan nan 3.28 0.00 C:548 ARG 4.84 1.05 5.89 0.33 4.24 0.82 3.57 0.34 4.75 0.71 C:549 HIS 4.84 0.88 5.63 0.40 4.32 0.70 3.89 0.34 4.53 0.74 C:550 GLN 4.43 0.65 4.88 0.63 4.07 0.38 3.95 0.47 4.15 0.27 C:551 ARG 4.44 0.68 5.12 0.30 4.06 0.51 3.75 0.29 4.28 0.52 C:552 ALA 3.84 0.64 3.99 0.63 3.24 0.00 nan nan 3.24 0.00 C:553 HIS 3.81 0.39 3.77 0.42 3.84 0.37 3.61 0.19 3.95 0.38 C:554 SER 3.48 0.34 3.61 0.32 3.23 0.18 3.05 0.00 3.40 0.00 C:555 GLY 3.51 0.26 3.51 0.26 nan nan nan nan nan nan C:556 ASP 3.97 0.79 4.60 0.61 3.34 0.31 3.07 0.06 3.60 0.21 C:557 LYS 3.84 0.53 4.10 0.40 3.64 0.53 2.94 0.00 3.82 0.45 C:558 PRO 3.84 0.50 3.81 0.45 3.87 0.56 nan nan 3.87 0.56 C:559 TYR 4.33 0.78 4.93 0.45 4.03 0.73 3.12 0.00 4.16 0.69 C:560 LYS 3.64 0.46 4.02 0.35 3.33 0.26 2.95 0.00 3.43 0.19 C:561 CYS 4.93 0.62 4.61 0.45 5.58 0.35 5.23 0.00 5.93 0.00 C:562 LYS 3.43 0.33 3.53 0.30 3.06 0.00 nan nan 3.06 0.00 C:563 GLU 3.56 0.28 3.61 0.29 3.33 0.00 nan nan 3.33 0.00 C:564 CYS 3.74 0.41 3.80 0.43 3.63 0.35 3.98 0.00 3.29 0.00 C:565 GLY 3.69 0.21 3.69 0.21 nan nan nan nan nan nan C:566 LYS 4.01 0.82 4.25 0.75 3.07 0.00 nan nan 3.07 0.00 C:567 SER 4.11 0.47 4.33 0.38 3.65 0.21 3.44 0.00 3.86 0.00 C:568 PHE 4.97 0.93 5.82 0.49 4.48 0.75 nan nan 4.48 0.75 C:569 THR 5.00 0.75 5.57 0.35 4.24 0.35 4.06 0.00 4.32 0.39 C:570 CYS 5.25 0.64 5.58 0.40 4.61 0.53 4.07 0.00 5.14 0.00 C:571 THR 3.76 0.52 4.16 0.20 3.23 0.27 2.98 0.00 3.35 0.25 C:572 THR 3.72 0.51 4.13 0.23 3.19 0.18 2.94 0.00 3.31 0.06 C:573 GLU 4.11 0.61 4.72 0.23 3.61 0.27 3.36 0.12 3.78 0.20 C:574 LEU 5.28 0.78 5.86 0.17 4.69 0.71 nan nan 4.69 0.71 C:575 PHE 3.81 0.73 4.74 0.17 3.28 0.21 nan nan 3.28 0.21 C:576 ARG 3.89 0.53 4.50 0.14 3.55 0.30 3.33 0.35 3.71 0.08 C:577 HIS 4.11 0.53 4.34 0.30 3.96 0.60 3.74 0.53 4.07 0.59 C:578 GLN 4.07 0.65 4.66 0.45 3.61 0.34 3.27 0.03 3.83 0.27 C:579 LYS 4.78 0.94 5.52 0.33 4.19 0.85 3.20 0.00 4.44 0.77 C:580 VAL 3.87 0.72 4.30 0.68 3.29 0.10 nan nan 3.29 0.10 C:581 HIS 3.71 0.43 3.69 0.47 3.72 0.40 3.68 0.34 3.74 0.42 C:582 THR 3.80 0.51 3.97 0.42 3.12 0.00 nan nan 3.12 0.00 C:583 GLY 3.34 0.27 3.34 0.27 nan nan nan nan nan nan C:584 ASP 3.94 0.50 4.12 0.37 3.19 0.00 nan nan 3.19 0.00 C:585 ARG 3.81 0.47 3.88 0.40 3.77 0.50 3.32 0.29 4.11 0.35 C:586 PRO 3.85 0.66 4.28 0.57 3.27 0.12 nan nan 3.27 0.12 C:587 HIS 3.87 0.51 4.00 0.55 3.78 0.45 3.94 0.66 3.70 0.27 C:588 LYS 3.66 0.39 3.78 0.35 3.19 0.00 nan nan 3.19 0.00 C:589 CYS 4.31 0.41 4.22 0.37 4.50 0.42 4.07 0.00 4.92 0.00 C:590 LYS 3.39 0.27 3.49 0.22 3.02 0.00 nan nan 3.02 0.00 C:591 GLU 3.54 0.35 3.64 0.32 3.14 0.00 nan nan 3.14 0.00 C:592 CYS 3.67 0.36 3.71 0.43 3.58 0.08 3.66 0.00 3.50 0.00 C:593 GLY 3.45 0.24 3.45 0.24 nan nan nan nan nan nan C:594 LYS 4.00 0.65 4.16 0.63 3.37 0.00 nan nan 3.37 0.00 C:595 ALA 3.80 0.40 3.90 0.38 3.39 0.00 nan nan 3.39 0.00 C:596 PHE 4.77 0.93 5.69 0.46 4.24 0.70 nan nan 4.24 0.70 C:597 ILE 4.44 0.58 4.78 0.60 4.11 0.30 nan nan 4.11 0.30 C:598 ARG 3.93 0.66 4.66 0.47 3.52 0.28 3.33 0.31 3.65 0.16 C:599 ARG 3.59 0.30 3.73 0.10 3.01 0.00 nan nan 3.01 0.00 C:600 SER 3.58 0.38 3.84 0.12 3.06 0.09 2.97 0.00 3.15 0.00 C:601 GLU 4.11 0.51 4.50 0.23 3.80 0.45 3.37 0.29 4.08 0.28 C:602 LEU 4.30 0.59 4.48 0.52 3.57 0.00 nan nan 3.57 0.00 C:603 THR 3.70 0.43 4.00 0.21 3.30 0.32 3.01 0.00 3.45 0.30 C:604 HIS 3.93 0.26 4.04 0.16 3.50 0.00 nan nan 3.50 0.00 C:605 HIS 4.09 0.56 4.51 0.51 3.82 0.38 3.69 0.25 3.88 0.42 C:606 GLU 4.00 0.60 4.19 0.52 3.22 0.00 nan nan 3.22 0.00 C:607 ARG 4.22 0.22 4.29 0.19 3.94 0.00 nan nan 3.94 0.00 C:608 SER 3.68 0.45 3.80 0.42 3.18 0.00 nan nan 3.18 0.00 C:609 HIS 3.85 0.39 3.84 0.45 3.85 0.34 3.91 0.48 3.83 0.23 C:610 SER 3.44 0.26 3.50 0.25 3.16 0.00 nan nan 3.16 0.00 C:611 GLY 3.40 0.30 3.40 0.30 nan nan nan nan nan nan C:612 GLU 3.82 0.36 3.98 0.17 3.17 0.00 nan nan 3.17 0.00 C:613 LYS 3.75 0.27 3.78 0.30 3.63 0.00 nan nan 3.63 0.00 C:614 PRO 3.58 0.35 3.66 0.33 3.48 0.36 nan nan 3.48 0.36 C:615 TYR 4.22 0.66 4.42 0.59 3.40 0.00 nan nan 3.40 0.00 C:616 GLU 3.76 0.38 3.82 0.40 3.51 0.00 nan nan 3.51 0.00 C:617 CYS 4.21 0.43 4.12 0.41 4.40 0.40 4.00 0.00 4.80 0.00 C:618 LYS 3.43 0.26 3.55 0.12 2.96 0.00 nan nan 2.96 0.00 C:619 GLU 3.38 0.22 3.44 0.22 3.17 0.00 nan nan 3.17 0.00 C:620 CYS 3.68 0.32 3.67 0.39 3.72 0.07 3.65 0.00 3.79 0.00 C:621 GLY 3.65 0.40 3.65 0.40 nan nan nan nan nan nan C:622 LYS 4.00 0.66 4.20 0.59 3.19 0.00 nan nan 3.19 0.00 C:623 THR 3.72 0.51 3.92 0.53 3.45 0.32 3.30 0.00 3.53 0.37 C:624 PHE 4.18 0.63 4.42 0.42 4.05 0.69 nan nan 4.05 0.69 C:625 GLY 3.67 0.24 3.67 0.24 nan nan nan nan nan nan C:626 ARG 3.74 0.50 4.23 0.40 3.46 0.30 3.27 0.31 3.60 0.21 C:627 GLY 3.51 0.11 3.51 0.11 nan nan nan nan nan nan C:628 SER 3.61 0.34 3.79 0.27 3.26 0.12 3.38 0.00 3.13 0.00 C:629 GLU 4.59 0.80 5.40 0.17 3.95 0.43 3.78 0.52 4.06 0.30 C:630 LEU 4.46 0.69 4.58 0.73 4.00 0.00 nan nan 4.00 0.00 C:631 SER 3.57 0.35 3.70 0.25 3.03 0.00 nan nan 3.03 0.00 C:632 ARG 3.44 0.34 3.75 0.29 3.27 0.24 3.16 0.20 3.36 0.23 C:633 HIS 4.28 0.44 4.67 0.32 4.01 0.28 4.03 0.29 4.00 0.27 C:634 GLN 4.03 0.59 4.22 0.49 3.25 0.00 nan nan 3.25 0.00 C:635 LYS 3.87 0.48 4.03 0.40 3.24 0.00 nan nan 3.24 0.00 C:636 ILE 3.62 0.46 3.83 0.43 3.42 0.39 nan nan 3.42 0.39 C:637 HIS 3.53 0.35 3.63 0.47 3.47 0.23 3.64 0.29 3.39 0.12 C:638 THR 3.37 0.32 3.47 0.39 3.24 0.03 3.29 0.00 3.22 0.01